A0A077ZJX1_TRITR Loading...

AMOP and VWD domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZJX1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 322 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	36.1	Very low	37.6	Very low	241 Å²	241	158.9 Å²	158.9	100%	1.187	75%	0.752	S	S	*	*				0	93.9	0	-155.7	-174.1	-61.3	0	0	106	G3	M1-G3 PolarHBondContact O-N 3.22Å; M1-G3 VanDerWaalsContact O-N 3.16Å
2	W	35.9	Very low	38.7	Very low	259 Å²	259	147.3 Å²	147.3	98%	0.981	70%	0.7	S	S	*	*			trans	-74.1	106.8	-175.3	-65.8	89.6	0	0	0	108.1	K4	W2-K4 PolarHBondContact O-N 3.09Å
3	G	40.2	Very low	39.7	Very low	56 Å²	56	141.8 Å²	141.8	58%	0.577	68%	0.684	S	S	*	*			trans	-61.6	120.4	174.9	0	0	0	0	0	108.7	M1 Y5	M1-G3 PolarHBondContact O-N 3.22Å; M1-G3 VanDerWaalsContact O-N 3.16Å; G3-Y5 WeakPolarHBondContact O-CD2 3.49Å; G3-Y5 PolarHBondContact O-N 3.17Å
4	K	35.5	Very low	40.8	Very low	161 Å²	161	137.8 Å²	137.8	70%	0.7	67%	0.668	S	S	*	*			trans	-70.2	112.2	170.5	-68.5	-173.3	178	-174.4	0	107.3	W2 Y6	W2-K4 PolarHBondContact O-N 3.09Å; K4-Y6 HydrophobicContact CB-CE2 3.87Å
5	Y	32.5	Very low	41.6	Very low	217 Å²	217	133.9 Å²	133.9	85%	0.851	64%	0.643	S	S	*	*			trans	-70.4	138.5	167.1	-61.4	-90.1	0	0	0	108	G3	G3-Y5 WeakPolarHBondContact O-CD2 3.49Å; G3-Y5 PolarHBondContact O-N 3.17Å
6	Y	37	Very low	42.9	Very low	156 Å²	156	128 Å²	128	61%	0.612	62%	0.624	S	S	*	*			trans	-126.1	125.2	165.3	-70.1	-82.3	0	0	0	107.1	K4	K4-Y6 HydrophobicContact CB-CE2 3.87Å
7	D	30.3	Very low	44.7	Very low	148 Å²	148	130.4 Å²	130.4	79%	0.791	64%	0.638	S	S	*	*			trans	-75.9	123.7	171.3	-71.4	-34.6	0	0	0	108.5	E9	D7-E9 PolarHBondContact O-N 3.34Å
8	L	37.1	Very low	46.9	Very low	125 Å²	125	125.5 Å²	125.5	65%	0.654	62%	0.618	S	S	*	*			trans	-84.5	95.9	166.1	-178.3	74	0	0	0	106.8	I10 L307	L8-I10 HydrophobicContact CD2-CG1 4.38Å; L8-I10 HydrophobicContact CG-CG1 4.42Å; L8-I10 PolarHBondContact O-N 3.17Å; L8-L307 HydrophobicContact CD2-CD1 4.5Å
9	E	37.6	Very low	49.2	Very low	146 Å²	146	120.1 Å²	120.1	68%	0.682	60%	0.597	S	S	*	*			trans	-77.9	104.9	170.8	-69.9	-177.4	179.4	0	0	108.9	D7 L11	D7-E9 PolarHBondContact O-N 3.34Å; E9-L11 VanDerWaalsContact C-N 3.29Å; E9-L11 HydrophobicContact CB-CG 4.49Å; E9-L11 PolarHBondContact O-N 2.68Å
10	I	46.3	Very low	51.6	Low	150 Å²	150	114.1 Å²	114.1	77%	0.769	57%	0.567	S	S	*	*			trans	-76.6	91.1	165.2	-57.6	175.4	0	0	0	105.9	L8	L8-I10 HydrophobicContact CD2-CG1 4.38Å; L8-I10 HydrophobicContact CG-CG1 4.42Å; L8-I10 PolarHBondContact O-N 3.17Å
11	L	45.6	Very low	53.6	Low	89 Å²	89	113 Å²	113	47%	0.466	56%	0.562	S	S	.	*			trans	-69.8	138.5	175.4	-69.8	170.3	0	0	0	109.8	E9	E9-L11 VanDerWaalsContact C-N 3.29Å; E9-L11 HydrophobicContact CB-CG 4.49Å; E9-L11 PolarHBondContact O-N 2.68Å
12	P	50.8	Low	56.4	Low	20 Å²	20	102.7 Å²	102.7	13%	0.13	51%	0.512	C	S	.	.			trans	-51.6	142.5	164.5	-26.4	35.6	0	0	0	111.2	D14 R15 A16 F265	P12-D14 WeakPolarHBondContact CB-OD1 3.34Å; P12-D14 PolarHBondContact O-N 3.4Å; P12-D14 VanDerWaalsContact O-N 3.09Å; P12-R15 PolarHBondContact O-N 3.22Å; P12-A16 PolarHBondContact O-N 2.9Å; P12-F265 WeakPolarHBondContact CG-O 3.4Å
13	P	51.5	Low	59.1	Low	76 Å²	76	96.3 Å²	96.3	49%	0.494	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-26.5	-177.6	-26.1	34	0	0	0	114.8	R15	P13-R15 VanDerWaalsContact C-N 3.29Å
14	D	54.2	Low	61.4	Low	85 Å²	85	101.2 Å²	101.2	46%	0.455	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-21.1	175.6	55.6	-65	0	0	0	113.5	P12	P12-D14 WeakPolarHBondContact CB-OD1 3.34Å; P12-D14 PolarHBondContact O-N 3.4Å; P12-D14 VanDerWaalsContact O-N 3.09Å
15	R	53.9	Low	63.7	Low	79 Å²	79	96.2 Å²	96.2	30%	0.298	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-21.1	178.8	-64.3	-169.3	-179.5	-126.8	6.8	114.6	P12 P13 I17 L197 T264 F265	P12-R15 PolarHBondContact O-N 3.22Å; P13-R15 VanDerWaalsContact C-N 3.29Å; R15-I17 PolarHBondContact O-N 3.16Å; R15-L197 VanDerWaalsContact NH2-CD1 3.35Å; R15-T264 PolarHBondContact NE-O 3.4Å; R15-F265 VanDerWaalsContact NH1-CD1 3.32Å; R15-F265 VanDerWaalsContact NH2-CE2 3.29Å
16	A	62.5	Low	65.8	Low	40 Å²	40	91.3 Å²	91.3	33%	0.331	47%	0.467	S	S	.	.	S	Bend	trans	-59.5	132.5	167.2	0	0	0	0	0	108.3	P12 P18	P12-A16 PolarHBondContact O-N 2.9Å; A16-P18 WeakPolarHBondContact O-CD 3.47Å
17	I	73.1	Confident	67.8	Low	169 Å²	169	91.7 Å²	91.7	87%	0.867	48%	0.478	S	S	*	.			trans	-56.4	114	173.6	-62	173.3	0	0	0	106.7	R15 G19	R15-I17 PolarHBondContact O-N 3.16Å; I17-G19 PolarHBondContact O-N 3.22Å
18	P	84.9	Confident	70.2	Confident	42 Å²	42	86.6 Å²	86.6	27%	0.273	46%	0.455	S	S	.	.			trans	-69.8	128.7	-172.6	28.6	-34.9	0	0	0	108.5	A16 V20 T134	A16-P18 WeakPolarHBondContact O-CD 3.47Å; P18-V20 PolarHBondContact O-N 3.23Å; P18-T134 HydrophobicContact CB-CG2 3.97Å; P18-T134 HydrophobicContact CG-CG2 4.06Å
19	G	90.5	Very high	72	Confident	22 Å²	22	88.8 Å²	88.8	23%	0.227	46%	0.455	C	S	.	.	S	Bend	trans	-65.4	-25.9	174.3	0	0	0	0	0	112.1	I17 W46 Y132	I17-G19 PolarHBondContact O-N 3.22Å; G19-W46 WeakPolarHBondContact O-CB 3.24Å; G19-Y132 PolarHBondContact N-O 3.3Å
20	V	95.7	Very high	74.2	Confident	0 Å²	0	86 Å²	86	0%	0	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	116.4	174.8	-177.2	0	0	0	0	109.2	P18 L22 I44 T45 W46 V118 V120 L131 Y132 S133	P18-V20 PolarHBondContact O-N 3.23Å; V20-L22 HydrophobicContact CG1-CD2 4.42Å; V20-I44 HydrophobicContact CG1-CG2 3.28Å; V20-T45 CarbonylContact C-O 3.59Å; V20-T45 WeakPolarHBondContact CA-O 3.25Å; V20-W46 HydrophobicContact CG2-CB 4.47Å; V20-V118 HydrophobicContact CG1-CG1 4.28Å; V20-V120 HydrophobicContact CB-CG2 4.43Å; V20-V120 HydrophobicContact CG1-CG2 3.96Å; V20-V120 HydrophobicContact CG2-CB 3.85Å; V20-V120 HydrophobicContact CG2-CG2 3.53Å; V20-L131 HydrophobicContact CG2-CB 3.58Å; V20-L131 WeakPolarHBondContact CG2-O 3.45Å; V20-Y132 PolarHBondContact N-O 3.35Å; V20-S133 WeakPolarHBondContact O-CA 3.23Å; V20-S133 WeakPolarHBondContact O-CB 3.28Å
21	I	95.1	Very high	76.3	Confident	91 Å²	91	80.8 Å²	80.8	47%	0.467	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	118.9	178.3	-57.7	172.3	0	0	0	108.4	R23 T45	I21-R23 PolarHBondContact O-N 3.41Å; I21-T45 PolarHBondContact N-O 2.9Å; I21-T45 PolarHBondContact O-N 2.8Å
22	L	94.5	Very high	78.6	Confident	25 Å²	25	76.7 Å²	76.7	13%	0.131	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	108.4	165.2	-52.3	-175.4	0	0	0	106.3	V20 K24 F34 I44 V118 T136	V20-L22 HydrophobicContact CG1-CD2 4.42Å; L22-K24 PolarHBondContact O-N 3.09Å; L22-F34 HydrophobicContact CB-CD1 4.3Å; L22-F34 HydrophobicContact CB-CD2 3.78Å; L22-F34 HydrophobicContact CB-CE1 4.24Å; L22-F34 HydrophobicContact CB-CE2 3.7Å; L22-F34 HydrophobicContact CB-CG 4.08Å; L22-F34 HydrophobicContact CB-CZ 3.93Å; L22-F34 HydrophobicContact CD1-CD1 4.01Å; L22-F34 HydrophobicContact CD1-CE1 4.34Å; L22-F34 HydrophobicContact CD1-CG 4.22Å; L22-F34 HydrophobicContact CD2-CD1 4.28Å; L22-F34 HydrophobicContact CD2-CE1 3.76Å; L22-F34 HydrophobicContact CD2-CZ 3.92Å; L22-F34 HydrophobicContact CG-CD1 4.41Å; L22-F34 HydrophobicContact CG-CE1 4.31Å; L22-F34 HydrophobicContact CG-CZ 4.41Å; L22-I44 HydrophobicContact CD2-CG1 4.15Å; L22-I44 HydrophobicContact CD2-CG2 4.44Å; L22-V118 HydrophobicContact CD1-CG2 4.43Å; L22-V118 HydrophobicContact CD2-CB 4.05Å; L22-V118 HydrophobicContact CD2-CG2 3.7Å; L22-T136 HydrophobicContact CD1-CG2 3.98Å
23	R	92.7	Very high	80.5	Confident	126 Å²	126	76.1 Å²	76.1	48%	0.475	39%	0.393	S	S	.	.			trans	-57.1	143.7	179.7	-170.9	171.5	177.8	-169.9	-1	108.2	I21 N32 F34 T43	I21-R23 PolarHBondContact O-N 3.41Å; R23-N32 HydrophobicContact CB-CB 4.17Å; R23-N32 WeakPolarHBondContact CD-ND2 3.16Å; R23-N32 HydrophobicContact CG-CB 4.29Å; R23-N32 VanDerWaalsContact O-CB 3.3Å; R23-N32 WeakPolarHBondContact O-CB 3.15Å; R23-N32 VanDerWaalsContact O-O 3.09Å; R23-F34 WeakPolarHBondContact O-CD2 3.49Å; R23-F34 VanDerWaalsContact O-CE2 3.3Å; R23-F34 WeakPolarHBondContact O-CE2 3.17Å; R23-T43 WeakPolarHBondContact CB-O 3.29Å; R23-T43 PolarHBondContact N-O 2.49Å; R23-T43 VanDerWaalsContact N-O 3.07Å
24	K	87.4	Confident	82.4	Confident	158 Å²	158	73.2 Å²	73.2	69%	0.687	37%	0.373	S	S	*	.			trans	-125.8	125.7	173.3	-171.8	174.1	-177.6	177.9	0	108.1	L22	L22-K24 PolarHBondContact O-N 3.09Å
25	D	84.8	Confident	84	Confident	57 Å²	57	74.7 Å²	74.7	31%	0.305	38%	0.381	S	S	.	.			trans	-106.5	105	172.6	-161.2	-39.6	0	0	0	108.5	L27 S28 V31 N32	D25-L27 PolarHBondContact O-N 2.65Å; D25-L27 PolarHBondContact OD1-N 2.83Å; D25-S28 PolarHBondContact O-N 2.69Å; D25-S28 PolarHBondContact OD1-N 2.7Å; D25-V31 VanDerWaalsContact CB-O 3.31Å; D25-V31 WeakPolarHBondContact CB-O 2.98Å; D25-N32 HydrophobicContact CB-CB 4.38Å
26	V	76.4	Confident	85.7	Confident	114 Å²	114	72.1 Å²	72.1	69%	0.691	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-23	-173.9	-174.9	0	0	0	0	111.6
27	L	78.8	Confident	87.1	Confident	163 Å²	163	72.6 Å²	72.6	85%	0.853	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-13.6	-176.8	-60.5	177.7	0	0	0	112.8	D25	D25-L27 PolarHBondContact O-N 2.65Å; D25-L27 PolarHBondContact OD1-N 2.83Å
28	S	81.4	Confident	88	Confident	42 Å²	42	65.9 Å²	65.9	29%	0.294	34%	0.344	S	S	.	.			trans	-127.3	99.2	-176	-168.6	0	0	0	0	112.4	D25 Q30 V31	D25-S28 PolarHBondContact O-N 2.69Å; D25-S28 PolarHBondContact OD1-N 2.7Å; S28-Q30 PolarHBondContact O-N 3.36Å; S28-V31 PolarHBondContact O-N 3.4Å; S28-V31 VanDerWaalsContact O-N 3.16Å; S28-V31 VanDerWaalsContact O-O 3.09Å
29	Y	74.4	Confident	88.5	Confident	170 Å²	170	63.9 Å²	63.9	67%	0.667	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-13.1	179.7	-70.8	-82.4	0	0	0	115.3	A33	Y29-A33 WeakPolarHBondContact O-CB 3.32Å
30	Q	83.6	Confident	88.6	Confident	88 Å²	88	66.8 Å²	66.8	41%	0.411	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-14.4	179.2	-62.2	-59.2	-28.1	0	0	113.1	S28 D40	S28-Q30 PolarHBondContact O-N 3.36Å; Q30-D40 HydrophobicContact CB-CB 4.4Å; Q30-D40 PolarHBondContact O-N 3.49Å
31	V	91	Very high	88.6	Confident	40 Å²	40	69.2 Å²	69.2	24%	0.242	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-117.3	124.2	-173.6	-179.6	0	0	0	0	109.2	D25 S28 A33 L41	D25-V31 VanDerWaalsContact CB-O 3.31Å; D25-V31 WeakPolarHBondContact CB-O 2.98Å; S28-V31 PolarHBondContact O-N 3.4Å; S28-V31 VanDerWaalsContact O-N 3.16Å; S28-V31 VanDerWaalsContact O-O 3.09Å; V31-A33 PolarHBondContact O-N 3.38Å; V31-L41 HydrophobicContact CG1-CD2 4.44Å
32	N	92.6	Very high	88.7	Confident	3 Å²	3	64.9 Å²	64.9	2%	0.016	33%	0.332	C	S	.	.	S	Bend	trans	58	29.8	-177	-52.3	-50.2	0	0	0	113.6	R23 D25 F34 L41 T43	R23-N32 HydrophobicContact CB-CB 4.17Å; R23-N32 WeakPolarHBondContact CD-ND2 3.16Å; R23-N32 HydrophobicContact CG-CB 4.29Å; R23-N32 VanDerWaalsContact O-CB 3.3Å; R23-N32 WeakPolarHBondContact O-CB 3.15Å; R23-N32 VanDerWaalsContact O-O 3.09Å; D25-N32 HydrophobicContact CB-CB 4.38Å; N32-F34 PolarHBondContact O-N 3.18Å; N32-L41 PolarHBondContact N-O 2.87Å; N32-T43 WeakPolarHBondContact OD1-CB 3.36Å; N32-T43 PolarHBondContact OD1-N 3.16Å; N32-T43 PolarHBondContact OD1-OG1 2.96Å
33	A	91.1	Very high	88.8	Confident	9 Å²	9	63.8 Å²	63.8	7%	0.074	33%	0.327	C	S	.	.			trans	-91.6	80.8	174.6	0	0	0	0	0	110.2	Y29 V31 D35 S36 P39	Y29-A33 WeakPolarHBondContact O-CB 3.32Å; V31-A33 PolarHBondContact O-N 3.38Å; A33-D35 PolarHBondContact O-N 3.36Å; A33-S36 WeakPolarHBondContact O-CB 3.29Å; A33-S36 PolarHBondContact O-N 3.41Å; A33-S36 VanDerWaalsContact O-N 3.1Å; A33-P39 HydrophobicContact CB-CB 4.36Å; A33-P39 WeakPolarHBondContact O-CG 3.28Å
34	F	92.3	Very high	89	Confident	15 Å²	15	57.8 Å²	57.8	7%	0.066	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-12.8	-179.2	-77.9	-92.6	0	0	0	114.1	L22 R23 N32 L42 I44 T136 W140	L22-F34 HydrophobicContact CB-CD1 4.3Å; L22-F34 HydrophobicContact CB-CD2 3.78Å; L22-F34 HydrophobicContact CB-CE1 4.24Å; L22-F34 HydrophobicContact CB-CE2 3.7Å; L22-F34 HydrophobicContact CB-CG 4.08Å; L22-F34 HydrophobicContact CB-CZ 3.93Å; L22-F34 HydrophobicContact CD1-CD1 4.01Å; L22-F34 HydrophobicContact CD1-CE1 4.34Å; L22-F34 HydrophobicContact CD1-CG 4.22Å; L22-F34 HydrophobicContact CD2-CD1 4.28Å; L22-F34 HydrophobicContact CD2-CE1 3.76Å; L22-F34 HydrophobicContact CD2-CZ 3.92Å; L22-F34 HydrophobicContact CG-CD1 4.41Å; L22-F34 HydrophobicContact CG-CE1 4.31Å; L22-F34 HydrophobicContact CG-CZ 4.41Å; R23-F34 WeakPolarHBondContact O-CD2 3.49Å; R23-F34 VanDerWaalsContact O-CE2 3.3Å; R23-F34 WeakPolarHBondContact O-CE2 3.17Å; N32-F34 PolarHBondContact O-N 3.18Å; F34-L42 HydrophobicContact CD1-CD1 3.93Å; F34-L42 HydrophobicContact CD1-CD2 4.09Å; F34-L42 HydrophobicContact CD1-CG 4.46Å; F34-L42 HydrophobicContact CD2-CD2 3.82Å; F34-L42 HydrophobicContact CE1-CB 4Å; F34-L42 HydrophobicContact CE1-CD1 3.88Å; F34-L42 HydrophobicContact CE1-CD2 4.19Å; F34-L42 HydrophobicContact CE1-CG 4.25Å; F34-L42 HydrophobicContact CE2-CB 4.26Å; F34-L42 HydrophobicContact CE2-CD2 3.93Å; F34-L42 HydrophobicContact CG-CD2 3.91Å; F34-L42 HydrophobicContact CZ-CB 3.77Å; F34-L42 HydrophobicContact CZ-CD1 4.46Å; F34-L42 HydrophobicContact CZ-CD2 4.12Å; F34-L42 HydrophobicContact CZ-CG 4.34Å; F34-I44 HydrophobicContact CE1-CG1 4.05Å; F34-I44 HydrophobicContact CZ-CG1 3.81Å; F34-T136 PolarHBondContact O-OG1 3.04Å; F34-W140 VanDerWaalsContact O-CD1 3.25Å
35	D	87.5	Confident	89.5	Confident	116 Å²	116	52.1 Å²	52.1	62%	0.62	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-20.5	172.3	55.4	-24.5	0	0	0	112.7	A33	A33-D35 PolarHBondContact O-N 3.36Å
36	S	90.3	Very high	90.1	Very high	25 Å²	25	50 Å²	50	18%	0.175	27%	0.27	C	S	.	.	S	Bend	trans	-74.7	140.8	175	-179.8	0	0	0	0	111.2	A33 A38 P39 S139	A33-S36 WeakPolarHBondContact O-CB 3.29Å; A33-S36 PolarHBondContact O-N 3.41Å; A33-S36 VanDerWaalsContact O-N 3.1Å; S36-A38 VanDerWaalsContact C-N 3.32Å; S36-A38 PolarHBondContact OG-N 3.22Å; S36-P39 WeakPolarHBondContact O-CD 3.4Å; S36-S139 PolarHBondContact O-OG 3.08Å
37	P	91.8	Very high	90.9	Very high	49 Å²	49	47.6 Å²	47.6	32%	0.318	26%	0.258	S	S	.	.	S	Bend	trans	-71.5	-23.3	173.6	27.4	-34.1	0	0	0	113.9	W140 L143 W154	P37-W140 VanDerWaalsContact O-CA 3.28Å; P37-W140 WeakPolarHBondContact O-CA 3.44Å; P37-L143 HydrophobicContact CB-CD1 3.98Å; P37-L143 WeakPolarHBondContact O-CD2 3.4Å; P37-W154 HydrophobicContact CB-CH2 4.24Å; P37-W154 HydrophobicContact CB-CZ2 3.69Å; P37-W154 HydrophobicContact CG-CZ2 4.25Å
38	A	91.8	Very high	91.7	Very high	29 Å²	29	41.4 Å²	41.4	24%	0.24	23%	0.228	C	C	.	.	S	Bend	trans	-136.3	52.7	-174.2	0	0	0	0	0	113.5	S36 L143	S36-A38 VanDerWaalsContact C-N 3.32Å; S36-A38 PolarHBondContact OG-N 3.22Å; A38-L143 HydrophobicContact CB-CD2 4Å
39	P	93.9	Very high	92.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.248	C	C	.	.			trans	-69.3	146.3	179.3	29.7	-30.6	0	0	0	110.5	A33 S36 L42 P95 W140	A33-P39 HydrophobicContact CB-CB 4.36Å; A33-P39 WeakPolarHBondContact O-CG 3.28Å; S36-P39 WeakPolarHBondContact O-CD 3.4Å; P39-L42 HydrophobicContact CB-CD2 3.88Å; P39-L42 HydrophobicContact CB-CG 4.33Å; P39-L42 HydrophobicContact CG-CD1 3.97Å; P39-L42 HydrophobicContact CG-CD2 3.66Å; P39-L42 HydrophobicContact CG-CG 3.82Å; P39-P95 HydrophobicContact CG-CG 4.04Å; P39-P95 WeakPolarHBondContact O-CD 3.15Å; P39-W140 HydrophobicContact CG-CB 3.95Å
40	D	93.8	Very high	93.1	Very high	83 Å²	83	45.4 Å²	45.4	44%	0.444	25%	0.245	S	C	.	.	S	Bend	trans	-72.6	-38	-178.9	-74.6	-26.6	0	0	0	111.8	Q30 K94	Q30-D40 HydrophobicContact CB-CB 4.4Å; Q30-D40 PolarHBondContact O-N 3.49Å; D40-K94 WeakPolarHBondContact O-CG 3.49Å
41	L	95.4	Very high	93.5	Very high	51 Å²	51	42 Å²	42	27%	0.267	23%	0.229	S	C	.	.	B	Isolated β-bridge	trans	-147	132.8	-177.7	-176.1	74.6	0	0	0	110.3	V31 N32 K92 K94	V31-L41 HydrophobicContact CG1-CD2 4.44Å; N32-L41 PolarHBondContact N-O 2.87Å; L41-K92 HydrophobicContact CD1-CB 4.37Å; L41-K94 HydrophobicContact CD1-CG 4.01Å
42	L	96.7	Very high	93.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	137.1	170.5	-63	177.9	0	0	0	110.2	F34 P39 K92 L93 P95 W140	F34-L42 HydrophobicContact CD1-CD1 3.93Å; F34-L42 HydrophobicContact CD1-CD2 4.09Å; F34-L42 HydrophobicContact CD1-CG 4.46Å; F34-L42 HydrophobicContact CD2-CD2 3.82Å; F34-L42 HydrophobicContact CE1-CB 4Å; F34-L42 HydrophobicContact CE1-CD1 3.88Å; F34-L42 HydrophobicContact CE1-CD2 4.19Å; F34-L42 HydrophobicContact CE1-CG 4.25Å; F34-L42 HydrophobicContact CE2-CB 4.26Å; F34-L42 HydrophobicContact CE2-CD2 3.93Å; F34-L42 HydrophobicContact CG-CD2 3.91Å; F34-L42 HydrophobicContact CZ-CB 3.77Å; F34-L42 HydrophobicContact CZ-CD1 4.46Å; F34-L42 HydrophobicContact CZ-CD2 4.12Å; F34-L42 HydrophobicContact CZ-CG 4.34Å; P39-L42 HydrophobicContact CB-CD2 3.88Å; P39-L42 HydrophobicContact CB-CG 4.33Å; P39-L42 HydrophobicContact CG-CD1 3.97Å; P39-L42 HydrophobicContact CG-CD2 3.66Å; P39-L42 HydrophobicContact CG-CG 3.82Å; L42-K92 WeakPolarHBondContact O-CA 3.44Å; L42-L93 HydrophobicContact CB-CD1 4.14Å; L42-L93 HydrophobicContact CB-CD2 4.2Å; L42-L93 HydrophobicContact CB-CG 3.92Å; L42-L93 HydrophobicContact CD1-CD1 4.22Å; L42-L93 PolarHBondContact N-O 2.93Å; L42-L93 PolarHBondContact O-N 2.95Å; L42-P95 HydrophobicContact CD1-CG 3.75Å; L42-P95 HydrophobicContact CG-CG 4.08Å; L42-W140 HydrophobicContact CD1-CB 4.34Å; L42-W140 HydrophobicContact CD1-CD2 3.65Å; L42-W140 HydrophobicContact CD1-CE3 3.9Å; L42-W140 HydrophobicContact CD1-CG 3.83Å; L42-W140 HydrophobicContact CD1-CZ3 4.49Å
43	T	97	Very high	93.5	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.012	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	120.3	177.1	-49.7	0	0	0	0	109.6	R23 N32 T45 I90 L91 K92	R23-T43 WeakPolarHBondContact CB-O 3.29Å; R23-T43 PolarHBondContact N-O 2.49Å; R23-T43 VanDerWaalsContact N-O 3.07Å; N32-T43 WeakPolarHBondContact OD1-CB 3.36Å; N32-T43 PolarHBondContact OD1-N 3.16Å; N32-T43 PolarHBondContact OD1-OG1 2.96Å; T43-T45 HydrophobicContact CG2-CG2 4.13Å; T43-I90 HydrophobicContact CG2-CD1 3.8Å; T43-I90 HydrophobicContact CG2-CG1 3.93Å; T43-L91 WeakPolarHBondContact CA-O 3.35Å; T43-K92 HydrophobicContact CG2-CG 4.06Å
44	I	97.4	Very high	93.6	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	129.2	175.8	-59.6	165.2	0	0	0	107.1	V20 L22 F34 W46 V61 I90 L91 L93 V118	V20-I44 HydrophobicContact CG1-CG2 3.28Å; L22-I44 HydrophobicContact CD2-CG1 4.15Å; L22-I44 HydrophobicContact CD2-CG2 4.44Å; F34-I44 HydrophobicContact CE1-CG1 4.05Å; F34-I44 HydrophobicContact CZ-CG1 3.81Å; I44-W46 HydrophobicContact CG2-CE3 4.27Å; I44-W46 HydrophobicContact CG2-CZ3 4.41Å; I44-V61 HydrophobicContact CD1-CG1 4.11Å; I44-I90 CarbonylContact O-C 3.48Å; I44-I90 WeakPolarHBondContact O-CA 3.4Å; I44-L91 HydrophobicContact CB-CB 4.41Å; I44-L91 HydrophobicContact CD1-CD2 4.37Å; I44-L91 PolarHBondContact N-O 2.76Å; I44-L91 PolarHBondContact O-N 3.09Å; I44-L93 HydrophobicContact CD1-CD2 3.4Å; I44-L93 VanDerWaalsContact CD1-CD2 3.4Å; I44-L93 HydrophobicContact CG1-CD2 3.99Å; I44-V118 HydrophobicContact CD1-CG1 3.95Å; I44-V118 HydrophobicContact CG2-CG1 4.23Å
45	T	97.6	Very high	93.5	Very high	39 Å²	39	54.6 Å²	54.6	24%	0.239	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	150.3	177.1	56.3	0	0	0	0	111.7	V20 I21 T43 G89 I90	V20-T45 CarbonylContact C-O 3.59Å; V20-T45 WeakPolarHBondContact CA-O 3.25Å; I21-T45 PolarHBondContact N-O 2.9Å; I21-T45 PolarHBondContact O-N 2.8Å; T43-T45 HydrophobicContact CG2-CG2 4.13Å; T45-G89 CarbonylContact C-O 3.56Å; T45-G89 VanDerWaalsContact CA-O 3.25Å; T45-G89 WeakPolarHBondContact CA-O 3.32Å; T45-I90 HydrophobicContact CG2-CB 4.18Å; T45-I90 HydrophobicContact CG2-CD1 4Å; T45-I90 HydrophobicContact CG2-CG1 3.87Å
46	W	96.3	Very high	93.8	Very high	13 Å²	13	56.3 Å²	56.3	5%	0.049	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	163.8	175.4	64.7	95.4	0	0	0	109.2	G19 V20 I44 P48 V59 N87 G89 L91 V120 L131	G19-W46 WeakPolarHBondContact O-CB 3.24Å; V20-W46 HydrophobicContact CG2-CB 4.47Å; I44-W46 HydrophobicContact CG2-CE3 4.27Å; I44-W46 HydrophobicContact CG2-CZ3 4.41Å; W46-P48 VanDerWaalsContact O-CD 3.3Å; W46-P48 WeakPolarHBondContact O-CD 2.99Å; W46-V59 HydrophobicContact CH2-CG2 4.29Å; W46-V59 HydrophobicContact CZ2-CG2 3.74Å; W46-N87 PolarHBondContact NE1-OD1 2.78Å; W46-G89 VanDerWaalsContact CE2-CA 3.47Å; W46-G89 PolarHBondContact N-O 3.37Å; W46-G89 CarbonylContact O-C 3.51Å; W46-G89 WeakPolarHBondContact O-CA 3.5Å; W46-G89 VanDerWaalsContact O-O 3.11Å; W46-L91 HydrophobicContact CH2-CB 4.1Å; W46-L91 HydrophobicContact CZ3-CB 3.85Å; W46-V120 HydrophobicContact CD2-CB 4.42Å; W46-V120 HydrophobicContact CD2-CG1 3.83Å; W46-V120 HydrophobicContact CD2-CG2 4.07Å; W46-V120 HydrophobicContact CE3-CG1 4.32Å; W46-V120 HydrophobicContact CE3-CG2 3.85Å; W46-V120 HydrophobicContact CG-CG1 4.11Å; W46-V120 HydrophobicContact CG-CG2 4.46Å; W46-V120 HydrophobicContact CZ2-CG1 4.2Å; W46-V120 HydrophobicContact CZ3-CG2 4.33Å; W46-L131 HydrophobicContact CB-CD1 3.96Å; W46-L131 HydrophobicContact CG-CD1 4.41Å
47	S	95.2	Very high	94	Very high	62 Å²	62	55.5 Å²	55.5	43%	0.434	31%	0.308	S	S	.	.			trans	-85	113	174.4	-66.5	0	0	0	0	110	Y49 N50	S47-Y49 VanDerWaalsContact C-N 3.26Å; S47-Y49 PolarHBondContact O-N 3.18Å; S47-N50 WeakPolarHBondContact O-CB 3.27Å; S47-N50 PolarHBondContact O-N 3Å; S47-N50 VanDerWaalsContact O-N 3.07Å
48	P	95.2	Very high	94.3	Very high	33 Å²	33	58.2 Å²	58.2	21%	0.214	31%	0.314	C	S	.	.	H	α-helix	trans	-56.4	-40.3	-177.8	-28.2	37.6	0	0	0	113.2	W46 N50 L51 T52 N87	W46-P48 VanDerWaalsContact O-CD 3.3Å; W46-P48 WeakPolarHBondContact O-CD 2.99Å; P48-N50 PolarHBondContact O-N 3.33Å; P48-L51 WeakPolarHBondContact O-CB 3.17Å; P48-L51 PolarHBondContact O-N 3.2Å; P48-T52 PolarHBondContact O-N 2.71Å; P48-N87 PolarHBondContact O-ND2 3.32Å
49	Y	93.9	Very high	94.5	Very high	185 Å²	185	56.8 Å²	56.8	73%	0.725	30%	0.303	S	S	*	.	H	α-helix	trans	-69.4	-16.8	-178.4	-62.6	-69.1	0	0	0	114.1	S47 L51 T52	S47-Y49 VanDerWaalsContact C-N 3.26Å; S47-Y49 PolarHBondContact O-N 3.18Å; Y49-L51 VanDerWaalsContact C-N 3.27Å; Y49-T52 WeakPolarHBondContact CA-O 3.28Å
50	N	90.6	Very high	94.6	Very high	111 Å²	111	57.3 Å²	57.3	59%	0.594	31%	0.306	S	S	*	.	H	α-helix	trans	-75.9	-20.2	172.3	-71.1	7.7	0	0	0	111.8	S47 P48 L131	S47-N50 WeakPolarHBondContact O-CB 3.27Å; S47-N50 PolarHBondContact O-N 3Å; S47-N50 VanDerWaalsContact O-N 3.07Å; P48-N50 PolarHBondContact O-N 3.33Å; N50-L131 HydrophobicContact CB-CD1 4.19Å; N50-L131 HydrophobicContact CB-CD2 4.19Å
51	L	91.2	Very high	94.8	Very high	16 Å²	16	53.4 Å²	53.4	8%	0.084	29%	0.285	C	S	.	.	H	α-helix	trans	-89.1	-48.5	174.2	-67.5	168.3	0	0	0	111.3	P48 Y49 V59 V120 L122 G129 L131	P48-L51 WeakPolarHBondContact O-CB 3.17Å; P48-L51 PolarHBondContact O-N 3.2Å; Y49-L51 VanDerWaalsContact C-N 3.27Å; L51-V59 HydrophobicContact CD1-CG1 3.75Å; L51-V120 HydrophobicContact CD1-CG1 3.85Å; L51-L122 HydrophobicContact CB-CD2 4.1Å; L51-L122 HydrophobicContact CB-CG 4.31Å; L51-G129 WeakPolarHBondContact CD2-O 3.43Å; L51-L131 HydrophobicContact CD1-CD1 4.24Å; L51-L131 HydrophobicContact CD2-CB 4.47Å; L51-L131 HydrophobicContact CD2-CD1 3.88Å; L51-L131 HydrophobicContact CD2-CG 3.67Å; L51-L131 HydrophobicContact CG-CD1 3.71Å; L51-L131 HydrophobicContact CG-CG 4.09Å
52	T	92	Very high	94.8	Very high	35 Å²	35	51 Å²	51	22%	0.215	27%	0.272	C	S	.	.			trans	-166.3	154.8	-175.8	-175.7	0	0	0	0	111.5	P48 Y49 D54 A57 L122	P48-T52 PolarHBondContact O-N 2.71Å; Y49-T52 WeakPolarHBondContact CA-O 3.28Å; T52-D54 VanDerWaalsContact C-N 3.32Å; T52-D54 HydrophobicContact CG2-CB 4.19Å; T52-D54 WeakPolarHBondContact OG1-CB 3.48Å; T52-D54 PolarHBondContact OG1-N 2.86Å; T52-D54 VanDerWaalsContact OG1-N 3.09Å; T52-A57 HydrophobicContact CG2-CB 3.44Å; T52-A57 VanDerWaalsContact CG2-CB 3.44Å; T52-L122 HydrophobicContact CG2-CD1 4.47Å; T52-L122 HydrophobicContact CG2-CD2 3.71Å
53	S	92.1	Very high	94.8	Very high	105 Å²	105	51 Å²	51	73%	0.734	27%	0.272	S	S	*	.	S	Bend	trans	-82.4	-9.6	168.2	55	0	0	0	0	113.3	T55	S53-T55 PolarHBondContact O-N 2.69Å
54	D	92.7	Very high	94.7	Very high	82 Å²	82	51.2 Å²	51.2	44%	0.439	27%	0.273	S	S	.	.			trans	-72.5	117.4	178.2	-179.4	8.7	0	0	0	111.5	T52 Q56 A57	T52-D54 VanDerWaalsContact C-N 3.32Å; T52-D54 HydrophobicContact CG2-CB 4.19Å; T52-D54 WeakPolarHBondContact OG1-CB 3.48Å; T52-D54 PolarHBondContact OG1-N 2.86Å; T52-D54 VanDerWaalsContact OG1-N 3.09Å; D54-Q56 VanDerWaalsContact C-N 3.3Å; D54-Q56 PolarHBondContact O-N 3.34Å; D54-Q56 PolarHBondContact OD1-N 3.19Å; D54-A57 HydrophobicContact CB-CB 4.18Å; D54-A57 WeakPolarHBondContact O-CB 3.42Å; D54-A57 PolarHBondContact O-N 3.42Å
55	T	91.4	Very high	94.5	Very high	110 Å²	110	51.2 Å²	51.2	68%	0.675	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-16.5	-179.2	60.8	0	0	0	0	113.6	S53	S53-T55 PolarHBondContact O-N 2.69Å
56	Q	93.9	Very high	94.1	Very high	152 Å²	152	53.3 Å²	53.3	71%	0.71	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-1.2	176.7	-60.3	-55.8	-58.7	0	0	112.8	D54	D54-Q56 VanDerWaalsContact C-N 3.3Å; D54-Q56 PolarHBondContact O-N 3.34Å; D54-Q56 PolarHBondContact OD1-N 3.19Å
57	A	94.6	Very high	93.6	Very high	8 Å²	8	55.5 Å²	55.5	7%	0.066	29%	0.286	C	S	.	.			trans	-60.8	142.2	-178.2	0	0	0	0	0	112.1	T52 D54 N87 L122	T52-A57 HydrophobicContact CG2-CB 3.44Å; T52-A57 VanDerWaalsContact CG2-CB 3.44Å; D54-A57 HydrophobicContact CB-CB 4.18Å; D54-A57 WeakPolarHBondContact O-CB 3.42Å; D54-A57 PolarHBondContact O-N 3.42Å; A57-N87 HydrophobicContact CB-CB 4.42Å; A57-N87 VanDerWaalsContact O-CB 3.23Å; A57-N87 WeakPolarHBondContact O-CB 3.41Å; A57-N87 PolarHBondContact O-N 2.69Å; A57-L122 HydrophobicContact CB-CD2 4.02Å
58	K	97.1	Very high	92.9	Very high	106 Å²	106	56.7 Å²	56.7	46%	0.461	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	147	173.3	-65.3	-179.1	-178.8	-180	0	110.2	N84 V85 T123	K58-N84 HydrophobicContact CD-CB 4.36Å; K58-V85 CarbonylContact C-O 3.51Å; K58-V85 VanDerWaalsContact CA-O 3.31Å; K58-V85 WeakPolarHBondContact CA-O 3.42Å; K58-T123 PolarHBondContact O-N 2.88Å; K58-T123 PolarHBondContact O-OG1 3.46Å
59	V	97.2	Very high	92	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	155.5	177.3	-60.3	0	0	0	0	111.2	W46 L51 N84 V85 N87 V120 A121 L122	W46-V59 HydrophobicContact CH2-CG2 4.29Å; W46-V59 HydrophobicContact CZ2-CG2 3.74Å; L51-V59 HydrophobicContact CD1-CG1 3.75Å; V59-N84 PolarHBondContact O-N 3.38Å; V59-V85 HydrophobicContact CG2-CG2 3.64Å; V59-V85 PolarHBondContact N-O 2.85Å; V59-V85 PolarHBondContact O-N 2.82Å; V59-N87 HydrophobicContact CG1-CB 3.92Å; V59-V120 HydrophobicContact CB-CG1 4.02Å; V59-V120 HydrophobicContact CG1-CG1 4.21Å; V59-V120 HydrophobicContact CG2-CG1 4.18Å; V59-A121 CarbonylContact C-O 3.39Å; V59-A121 WeakPolarHBondContact CA-O 3.25Å; V59-A121 WeakPolarHBondContact CB-O 3.44Å; V59-L122 HydrophobicContact CG1-CD2 4.27Å
60	T	96.3	Very high	90.8	Very high	11 Å²	11	54.1 Å²	54.1	7%	0.067	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130.1	167.4	-62.9	0	0	0	0	107.7	D62 Q83 A121 T123	T60-D62 HydrophobicContact CG2-CB 4.44Å; T60-Q83 HydrophobicContact CG2-CB 4.46Å; T60-Q83 HydrophobicContact CG2-CG 4.13Å; T60-A121 PolarHBondContact N-O 2.61Å; T60-A121 PolarHBondContact O-N 3.23Å; T60-T123 PolarHBondContact OG1-OG1 3.31Å; T60-T123 VanDerWaalsContact OG1-OG1 3.09Å
61	V	96.8	Very high	89.9	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	112.7	174.6	-172.2	0	0	0	0	107.6	I44 V81 A82 L91 V118 R119 V120	I44-V61 HydrophobicContact CD1-CG1 4.11Å; V61-V81 HydrophobicContact CB-CB 4.5Å; V61-V81 HydrophobicContact CG1-CB 4.29Å; V61-V81 WeakPolarHBondContact O-CB 3.16Å; V61-V81 PolarHBondContact O-N 3.02Å; V61-A82 HydrophobicContact CB-CB 4.35Å; V61-A82 PolarHBondContact N-O 2.9Å; V61-A82 PolarHBondContact O-N 3.41Å; V61-A82 VanDerWaalsContact O-O 3.12Å; V61-L91 HydrophobicContact CB-CD2 3.84Å; V61-L91 HydrophobicContact CG1-CD2 3.95Å; V61-L91 HydrophobicContact CG2-CD2 3.75Å; V61-V118 HydrophobicContact CG1-CG1 3.71Å; V61-R119 WeakPolarHBondContact CA-O 3.35Å; V61-V120 HydrophobicContact CG1-CG2 4.26Å; V61-V120 HydrophobicContact CG2-CG1 4.46Å; V61-V120 HydrophobicContact CG2-CG2 4.08Å
62	D	95.5	Very high	89.2	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	170.8	-176.6	62.5	20.9	0	0	0	111.6	T60 R77 G79 I80 R119	T60-D62 HydrophobicContact CG2-CB 4.44Å; D62-R77 HydrophobicContact CB-CG 4.44Å; D62-R77 IonicContact OD2-CZ 2.83Å; D62-R77 IonicContact OD2-NE 2.69Å; D62-R77 PolarHBondContact OD2-NE 3.49Å; D62-R77 IonicContact OD2-NH2 3.05Å; D62-R77 PolarHBondContact OD2-NH2 2.96Å; D62-G79 WeakPolarHBondContact CA-O 3.34Å; D62-G79 VanDerWaalsContact CB-O 3.25Å; D62-G79 WeakPolarHBondContact CB-O 3.48Å; D62-I80 HydrophobicContact CB-CG1 4.4Å; D62-R119 PolarHBondContact N-O 2.99Å; D62-R119 PolarHBondContact O-N 3.24Å; D62-R119 VanDerWaalsContact OD1-CB 3.32Å; D62-R119 WeakPolarHBondContact OD1-CB 3.31Å; D62-R119 IonicContact OD1-CZ 3.29Å; D62-R119 IonicContact OD1-NE 3.48Å; D62-R119 PolarHBondContact OD1-NE 3.2Å; D62-R119 IonicContact OD1-NH2 3.23Å; D62-R119 PolarHBondContact OD1-NH2 2.71Å; D62-R119 IonicContact OD2-CZ 2.7Å; D62-R119 IonicContact OD2-NE 3.52Å; D62-R119 IonicContact OD2-NH2 2.61Å; D62-R119 PolarHBondContact OD2-NH2 3.31Å
63	L	96.1	Very high	88.6	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	130.2	-177.9	-57	-179.9	0	0	0	108.7	R77 V78 G79 V81 V118 F138 W140 Y141	L63-R77 CarbonylContact O-C 3.38Å; L63-R77 WeakPolarHBondContact O-CA 3.26Å; L63-V78 HydrophobicContact CB-CG2 3.65Å; L63-V78 PolarHBondContact O-N 2.8Å; L63-G79 PolarHBondContact N-O 2.84Å; L63-G79 PolarHBondContact O-N 2.81Å; L63-V81 HydrophobicContact CD1-CG2 4.23Å; L63-V81 HydrophobicContact CD2-CG2 3.88Å; L63-V81 HydrophobicContact CG-CG2 3.86Å; L63-V118 HydrophobicContact CD2-CB 4.41Å; L63-V118 HydrophobicContact CD2-CG2 3.8Å; L63-F138 HydrophobicContact CB-CE1 3.87Å; L63-F138 HydrophobicContact CB-CZ 3.98Å; L63-F138 HydrophobicContact CD1-CD1 3.97Å; L63-F138 HydrophobicContact CD1-CE1 4.02Å; L63-F138 HydrophobicContact CD2-CE1 4.01Å; L63-F138 HydrophobicContact CG-CE1 4.18Å; L63-W140 HydrophobicContact CD1-CH2 3.8Å; L63-W140 HydrophobicContact CD1-CZ2 4.33Å; L63-W140 HydrophobicContact CD1-CZ3 4.44Å; L63-W140 HydrophobicContact CD2-CH2 3.84Å; L63-W140 HydrophobicContact CD2-CZ2 4.13Å; L63-W140 HydrophobicContact CG-CH2 4.4Å; L63-Y141 HydrophobicContact CD1-CD1 3.36Å; L63-Y141 HydrophobicContact CD1-CD2 3.94Å; L63-Y141 HydrophobicContact CD1-CE1 3.8Å; L63-Y141 HydrophobicContact CD1-CE2 4.31Å; L63-Y141 HydrophobicContact CD1-CG 3.45Å; L63-Y141 VanDerWaalsContact CD1-CG 3.45Å
64	L	94.8	Very high	88.3	Confident	7 Å²	7	65.7 Å²	65.7	4%	0.037	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	119.9	170.6	-61.3	-172	0	0	0	109.4	F75 E76 R77 G116 V117 R119 Y132 F138	L64-F75 HydrophobicContact CB-CD2 4.35Å; L64-F75 HydrophobicContact CB-CE1 4.35Å; L64-F75 HydrophobicContact CB-CE2 3.71Å; L64-F75 HydrophobicContact CB-CZ 3.73Å; L64-F75 HydrophobicContact CD1-CD1 4.23Å; L64-F75 HydrophobicContact CD1-CE1 3.44Å; L64-F75 VanDerWaalsContact CD1-CE1 3.44Å; L64-F75 HydrophobicContact CD1-CE2 4.28Å; L64-F75 HydrophobicContact CD1-CZ 3.48Å; L64-F75 VanDerWaalsContact CD1-CZ 3.48Å; L64-F75 HydrophobicContact CG-CZ 4.29Å; L64-E76 CarbonylContact C-O 3.57Å; L64-E76 VanDerWaalsContact CA-O 3.23Å; L64-E76 WeakPolarHBondContact CA-O 3.33Å; L64-R77 VanDerWaalsContact CD2-CA 3.49Å; L64-R77 HydrophobicContact CD2-CB 3.87Å; L64-R77 HydrophobicContact CD2-CG 4.49Å; L64-G116 CarbonylContact O-C 3.58Å; L64-G116 VanDerWaalsContact O-CA 3.25Å; L64-G116 WeakPolarHBondContact O-CA 3.39Å; L64-V117 HydrophobicContact CB-CG2 3.96Å; L64-V117 PolarHBondContact N-O 3.5Å; L64-V117 PolarHBondContact O-N 2.78Å; L64-R119 HydrophobicContact CD1-CB 4.37Å; L64-R119 HydrophobicContact CG-CB 4.27Å; L64-Y132 HydrophobicContact CD1-CD1 4.38Å; L64-Y132 HydrophobicContact CD1-CE1 3.63Å; L64-F138 WeakPolarHBondContact O-CZ 3.28Å
65	G	94.6	Very high	88.1	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	140.4	177.1	0	0	0	0	0	111.5	F75 E76 F113	G65-F75 WeakPolarHBondContact O-CA 3.4Å; G65-E76 PolarHBondContact N-O 3.03Å; G65-E76 PolarHBondContact O-N 3.19Å; G65-F113 VanDerWaalsContact C-CE1 3.41Å; G65-F113 VanDerWaalsContact CA-CD1 3.41Å; G65-F113 VanDerWaalsContact O-CE1 3.29Å; G65-F113 WeakPolarHBondContact O-CE1 3.48Å
66	Y	89.3	Confident	88.2	Confident	83 Å²	83	64.6 Å²	64.6	33%	0.325	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	133.7	169.1	-175.8	-101.8	0	0	0	109.2	E68 R74 F75 F115	Y66-E68 HydrophobicContact CE1-CB 4.18Å; Y66-E68 HydrophobicContact CE1-CG 3.87Å; Y66-E68 VanDerWaalsContact OH-CD 3.29Å; Y66-E68 PolarHBondContact OH-OE2 3.02Å; Y66-R74 WeakPolarHBondContact CA-O 3.23Å; Y66-F75 HydrophobicContact CD2-CD2 4.27Å; Y66-F115 HydrophobicContact CD1-CE2 4.17Å; Y66-F115 PolarHBondContact N-O 2.95Å
67	W	85.8	Confident	88.1	Confident	59 Å²	59	62.1 Å²	62.1	22%	0.223	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	138.1	173	-179.9	86.7	0	0	0	109.6	D69 V72 R73 R74 F113	W67-D69 HydrophobicContact CH2-CB 3.82Å; W67-D69 WeakPolarHBondContact CH2-OD2 3.23Å; W67-D69 HydrophobicContact CZ2-CB 4.12Å; W67-D69 HydrophobicContact CZ3-CB 4.37Å; W67-V72 HydrophobicContact CZ3-CB 4.3Å; W67-V72 HydrophobicContact CZ3-CG1 4.42Å; W67-R73 CarbonylContact O-C 3.57Å; W67-R74 HydrophobicContact CB-CB 4.5Å; W67-R74 HydrophobicContact CE3-CB 4.46Å; W67-R74 HydrophobicContact CE3-CG 4.05Å; W67-R74 PolarHBondContact N-O 3.2Å; W67-R74 PolarHBondContact O-N 3.15Å; W67-F113 HydrophobicContact CB-CD1 3.79Å; W67-F113 HydrophobicContact CB-CE1 3.48Å; W67-F113 VanDerWaalsContact CB-CE1 3.48Å; W67-F113 HydrophobicContact CB-CZ 4.18Å
68	E	80	Confident	88.2	Confident	87 Å²	87	61.8 Å²	61.8	41%	0.407	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	145.9	177.1	65.8	-178.9	176.4	0	0	111.8	Y66 V72 R73	Y66-E68 HydrophobicContact CE1-CB 4.18Å; Y66-E68 HydrophobicContact CE1-CG 3.87Å; Y66-E68 VanDerWaalsContact OH-CD 3.29Å; Y66-E68 PolarHBondContact OH-OE2 3.02Å; E68-V72 WeakPolarHBondContact CA-O 3.21Å; E68-R73 HydrophobicContact CB-CG 4.09Å
69	D	76	Confident	88	Confident	57 Å²	57	56.7 Å²	56.7	31%	0.305	27%	0.267	S	S	.	.			trans	-126.4	-167.1	161.4	70.6	18.9	0	0	0	110.1	W67 E71 V72	W67-D69 HydrophobicContact CH2-CB 3.82Å; W67-D69 WeakPolarHBondContact CH2-OD2 3.23Å; W67-D69 HydrophobicContact CZ2-CB 4.12Å; W67-D69 HydrophobicContact CZ3-CB 4.37Å; D69-E71 PolarHBondContact O-N 2.87Å; D69-E71 WeakPolarHBondContact OD1-CA 3.29Å; D69-E71 PolarHBondContact OD1-N 3.06Å; D69-V72 PolarHBondContact N-O 3.09Å; D69-V72 PolarHBondContact OD1-N 3.24Å
70	A	67.9	Low	87.9	Confident	107 Å²	107	58.2 Å²	58.2	88%	0.884	28%	0.275	S	S	*	.	S	Bend	trans	-64.3	-21	-179.9	0	0	0	0	0	113.9
71	E	71.8	Confident	87.8	Confident	178 Å²	178	58.5 Å²	58.5	83%	0.832	28%	0.276	S	S	*	.	S	Bend	trans	-117.1	-35.7	-170.1	-63	-174.8	177.2	0	0	113	D69	D69-E71 PolarHBondContact O-N 2.87Å; D69-E71 WeakPolarHBondContact OD1-CA 3.29Å; D69-E71 PolarHBondContact OD1-N 3.06Å
72	V	76.3	Confident	87.7	Confident	58 Å²	58	59.2 Å²	59.2	35%	0.352	28%	0.283	S	S	.	.			trans	-130.1	135.9	-165.6	-176	0	0	0	0	110.2	W67 E68 D69 R74	W67-V72 HydrophobicContact CZ3-CB 4.3Å; W67-V72 HydrophobicContact CZ3-CG1 4.42Å; E68-V72 WeakPolarHBondContact CA-O 3.21Å; D69-V72 PolarHBondContact N-O 3.09Å; D69-V72 PolarHBondContact OD1-N 3.24Å; V72-R74 HydrophobicContact CG1-CG 4.01Å
73	R	80.2	Confident	87.6	Confident	179 Å²	179	64.7 Å²	64.7	68%	0.675	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.2	133.2	172.4	-60.8	163.7	-163.6	162.3	5.2	108.1	W67 E68	W67-R73 CarbonylContact O-C 3.57Å; E68-R73 HydrophobicContact CB-CG 4.09Å
74	R	86.6	Confident	87.6	Confident	96 Å²	96	68.4 Å²	68.4	36%	0.362	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	128	-179.1	-61.5	-175.7	-177.4	169.8	3.7	109.3	Y66 W67 V72 D112 F113	Y66-R74 WeakPolarHBondContact CA-O 3.23Å; W67-R74 HydrophobicContact CB-CB 4.5Å; W67-R74 HydrophobicContact CE3-CB 4.46Å; W67-R74 HydrophobicContact CE3-CG 4.05Å; W67-R74 PolarHBondContact N-O 3.2Å; W67-R74 PolarHBondContact O-N 3.15Å; V72-R74 HydrophobicContact CG1-CG 4.01Å; R74-D112 IonicContact NH1-OD2 3.77Å; R74-F113 HydrophobicContact CB-CE1 4.25Å; R74-F113 HydrophobicContact CB-CZ 4.01Å
75	F	89	Confident	87.6	Confident	108 Å²	108	69.8 Å²	69.8	47%	0.474	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	98.2	168.8	-172.3	-118.5	0	0	0	108.1	L64 G65 Y66 V117 Y132	L64-F75 HydrophobicContact CB-CD2 4.35Å; L64-F75 HydrophobicContact CB-CE1 4.35Å; L64-F75 HydrophobicContact CB-CE2 3.71Å; L64-F75 HydrophobicContact CB-CZ 3.73Å; L64-F75 HydrophobicContact CD1-CD1 4.23Å; L64-F75 HydrophobicContact CD1-CE1 3.44Å; L64-F75 VanDerWaalsContact CD1-CE1 3.44Å; L64-F75 HydrophobicContact CD1-CE2 4.28Å; L64-F75 HydrophobicContact CD1-CZ 3.48Å; L64-F75 VanDerWaalsContact CD1-CZ 3.48Å; L64-F75 HydrophobicContact CG-CZ 4.29Å; G65-F75 WeakPolarHBondContact O-CA 3.4Å; Y66-F75 HydrophobicContact CD2-CD2 4.27Å; F75-V117 HydrophobicContact CE2-CG2 3.9Å; F75-V117 HydrophobicContact CZ-CG2 3.67Å; F75-Y132 HydrophobicContact CE1-CE1 4.37Å; F75-Y132 HydrophobicContact CZ-CE1 4.38Å
76	E	91.7	Very high	87.8	Confident	60 Å²	60	73.9 Å²	73.9	28%	0.28	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	162.8	-167	60.3	174.6	176.1	0	0	112.4	L64 G65 V78 K109 F113	L64-E76 CarbonylContact C-O 3.57Å; L64-E76 VanDerWaalsContact CA-O 3.23Å; L64-E76 WeakPolarHBondContact CA-O 3.33Å; G65-E76 PolarHBondContact N-O 3.03Å; G65-E76 PolarHBondContact O-N 3.19Å; E76-V78 PolarHBondContact O-N 2.97Å; E76-K109 IonicContact OE1-NZ 3.22Å; E76-K109 PolarHBondContact OE1-NZ 2.85Å; E76-K109 IonicContact OE2-NZ 2.65Å; E76-K109 PolarHBondContact OE2-NZ 3.02Å; E76-F113 HydrophobicContact CG-CE1 4.34Å; E76-F113 HydrophobicContact CG-CE2 4.08Å; E76-F113 HydrophobicContact CG-CZ 3.56Å; E76-F113 WeakPolarHBondContact OE1-CE2 3.38Å; E76-F113 WeakPolarHBondContact OE1-CZ 3.32Å
77	R	93.3	Very high	88.1	Confident	100 Å²	100	70.9 Å²	70.9	38%	0.377	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	126.8	179.7	-173.5	-176.1	-79.5	161.7	-6	110.3	D62 L63 L64 L106	D62-R77 HydrophobicContact CB-CG 4.44Å; D62-R77 IonicContact OD2-CZ 2.83Å; D62-R77 IonicContact OD2-NE 2.69Å; D62-R77 PolarHBondContact OD2-NE 3.49Å; D62-R77 IonicContact OD2-NH2 3.05Å; D62-R77 PolarHBondContact OD2-NH2 2.96Å; L63-R77 CarbonylContact O-C 3.38Å; L63-R77 WeakPolarHBondContact O-CA 3.26Å; L64-R77 VanDerWaalsContact CD2-CA 3.49Å; L64-R77 HydrophobicContact CD2-CB 3.87Å; L64-R77 HydrophobicContact CD2-CG 4.49Å; R77-L106 HydrophobicContact CG-CD2 4.23Å; R77-L106 VanDerWaalsContact O-CD2 3.24Å; R77-L106 WeakPolarHBondContact O-CD2 3.45Å
78	V	95	Very high	88.6	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.006	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	-16.1	-179.5	-59.5	0	0	0	0	113.7	L63 E76 K109 F113 F138 F142	L63-V78 HydrophobicContact CB-CG2 3.65Å; L63-V78 PolarHBondContact O-N 2.8Å; E76-V78 PolarHBondContact O-N 2.97Å; V78-K109 HydrophobicContact CB-CB 3.83Å; V78-K109 HydrophobicContact CB-CG 4.27Å; V78-K109 HydrophobicContact CG1-CB 4.01Å; V78-K109 HydrophobicContact CG1-CD 4.34Å; V78-K109 HydrophobicContact CG1-CG 4.3Å; V78-F113 HydrophobicContact CG1-CB 4Å; V78-F113 HydrophobicContact CG1-CD1 4.1Å; V78-F113 HydrophobicContact CG1-CD2 3.46Å; V78-F113 VanDerWaalsContact CG1-CD2 3.46Å; V78-F113 HydrophobicContact CG1-CE1 4.45Å; V78-F113 HydrophobicContact CG1-CE2 3.9Å; V78-F113 HydrophobicContact CG1-CG 3.57Å; V78-F113 HydrophobicContact CG1-CZ 4.37Å; V78-F138 HydrophobicContact CG2-CD2 4.07Å; V78-F138 HydrophobicContact CG2-CE2 3.5Å; V78-F138 HydrophobicContact CG2-CZ 3.84Å; V78-F142 HydrophobicContact CB-CZ 4.13Å; V78-F142 HydrophobicContact CG2-CZ 4.22Å
79	G	94.6	Very high	89.4	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	158.9	-176.9	0	0	0	0	0	112.2	D62 L63 Y141	D62-G79 WeakPolarHBondContact CA-O 3.34Å; D62-G79 VanDerWaalsContact CB-O 3.25Å; D62-G79 WeakPolarHBondContact CB-O 3.48Å; L63-G79 PolarHBondContact N-O 2.84Å; L63-G79 PolarHBondContact O-N 2.81Å; G79-Y141 VanDerWaalsContact CA-OH 3.28Å; G79-Y141 WeakPolarHBondContact CA-OH 3.45Å
80	I	94.4	Very high	90.4	Very high	31 Å²	31	69.5 Å²	69.5	16%	0.159	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	127.8	170.8	-57.5	171.5	0	0	0	106.6	D62 Q83 P101 L106 Y141	D62-I80 HydrophobicContact CB-CG1 4.4Å; I80-Q83 HydrophobicContact CG2-CB 4.26Å; I80-P101 HydrophobicContact CB-CG 4.01Å; I80-P101 HydrophobicContact CG1-CG 4.36Å; I80-L106 HydrophobicContact CD1-CD1 4.15Å; I80-L106 HydrophobicContact CG1-CD1 4.07Å; I80-Y141 PolarHBondContact N-OH 2.75Å; I80-Y141 PolarHBondContact O-OH 3.41Å
81	V	94.7	Very high	91.8	Very high	17 Å²	17	65.6 Å²	65.6	10%	0.103	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-46	179.2	-178.6	0	0	0	0	110	V61 L63 L91 L93 L98 W140	V61-V81 HydrophobicContact CB-CB 4.5Å; V61-V81 HydrophobicContact CG1-CB 4.29Å; V61-V81 WeakPolarHBondContact O-CB 3.16Å; V61-V81 PolarHBondContact O-N 3.02Å; L63-V81 HydrophobicContact CD1-CG2 4.23Å; L63-V81 HydrophobicContact CD2-CG2 3.88Å; L63-V81 HydrophobicContact CG-CG2 3.86Å; V81-L91 HydrophobicContact CG1-CD2 4.12Å; V81-L93 HydrophobicContact CG1-CB 4.49Å; V81-L93 HydrophobicContact CG1-CD1 4Å; V81-L93 HydrophobicContact CG1-CD2 3.96Å; V81-L93 HydrophobicContact CG1-CG 4.36Å; V81-L98 HydrophobicContact CG1-CD1 4.43Å; V81-L98 HydrophobicContact CG1-CD2 4.06Å; V81-W140 HydrophobicContact CG2-CH2 4.2Å
82	A	94.7	Very high	93	Very high	16 Å²	16	63.6 Å²	63.6	13%	0.132	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	144.3	176.6	0	0	0	0	0	110.1	V61 V85 L91	V61-A82 HydrophobicContact CB-CB 4.35Å; V61-A82 PolarHBondContact N-O 2.9Å; V61-A82 PolarHBondContact O-N 3.41Å; V61-A82 VanDerWaalsContact O-O 3.12Å; A82-V85 HydrophobicContact CB-CG1 3.88Å; A82-V85 HydrophobicContact CB-CG2 4.38Å; A82-L91 HydrophobicContact CB-CD1 4.16Å; A82-L91 HydrophobicContact CB-CD2 3.75Å
83	Q	93.7	Very high	93.9	Very high	114 Å²	114	61.4 Å²	61.4	53%	0.533	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	145.2	179.3	-164	179	6.2	0	0	109.8	T60 I80 V85	T60-Q83 HydrophobicContact CG2-CB 4.46Å; T60-Q83 HydrophobicContact CG2-CG 4.13Å; I80-Q83 HydrophobicContact CG2-CB 4.26Å; Q83-V85 PolarHBondContact O-N 3.46Å
84	N	95	Very high	94.5	Very high	79 Å²	79	57.6 Å²	57.6	42%	0.422	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	57.9	31.2	176.4	-63.1	-45.1	0	0	0	114.2	K58 V59 T123	K58-N84 HydrophobicContact CD-CB 4.36Å; V59-N84 PolarHBondContact O-N 3.38Å; N84-T123 WeakPolarHBondContact OD1-CG2 3.33Å
85	V	95.9	Very high	94.9	Very high	35 Å²	35	53.8 Å²	53.8	21%	0.212	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	146.2	178.3	-62.4	0	0	0	0	110.6	K58 V59 A82 Q83	K58-V85 CarbonylContact C-O 3.51Å; K58-V85 VanDerWaalsContact CA-O 3.31Å; K58-V85 WeakPolarHBondContact CA-O 3.42Å; V59-V85 HydrophobicContact CG2-CG2 3.64Å; V59-V85 PolarHBondContact N-O 2.85Å; V59-V85 PolarHBondContact O-N 2.82Å; A82-V85 HydrophobicContact CB-CG1 3.88Å; A82-V85 HydrophobicContact CB-CG2 4.38Å; Q83-V85 PolarHBondContact O-N 3.46Å
86	P	97.1	Very high	94.9	Very high	86 Å²	86	57.8 Å²	57.8	56%	0.558	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.2	141.3	176.3	-23.2	33.9	0	0	0	112	T88	P86-T88 HydrophobicContact CB-CG2 4.19Å; P86-T88 PolarHBondContact O-N 3.21Å
87	N	96.4	Very high	94.8	Very high	21 Å²	21	60.6 Å²	60.6	11%	0.112	30%	0.297	C	S	.	.			trans	-73.8	70.9	178.7	-173.5	22.4	0	0	0	112.4	W46 P48 A57 V59	W46-N87 PolarHBondContact NE1-OD1 2.78Å; P48-N87 PolarHBondContact O-ND2 3.32Å; A57-N87 HydrophobicContact CB-CB 4.42Å; A57-N87 VanDerWaalsContact O-CB 3.23Å; A57-N87 WeakPolarHBondContact O-CB 3.41Å; A57-N87 PolarHBondContact O-N 2.69Å; V59-N87 HydrophobicContact CG1-CB 3.92Å
88	T	96.4	Very high	94.7	Very high	91 Å²	91	58 Å²	58	56%	0.558	29%	0.29	S	S	*	.			trans	-88.5	-12.6	-179.6	56.4	0	0	0	0	113.8	P86 I90	P86-T88 HydrophobicContact CB-CG2 4.19Å; P86-T88 PolarHBondContact O-N 3.21Å; T88-I90 VanDerWaalsContact C-N 3.35Å; T88-I90 PolarHBondContact OG1-O 2.96Å
89	G	96.8	Very high	94.2	Very high	8 Å²	8	66.2 Å²	66.2	8%	0.082	33%	0.328	C	S	.	.	S	Bend	trans	87.2	2.9	-176.8	0	0	0	0	0	114.4	T45 W46	T45-G89 CarbonylContact C-O 3.56Å; T45-G89 VanDerWaalsContact CA-O 3.25Å; T45-G89 WeakPolarHBondContact CA-O 3.32Å; W46-G89 VanDerWaalsContact CE2-CA 3.47Å; W46-G89 PolarHBondContact N-O 3.37Å; W46-G89 CarbonylContact O-C 3.51Å; W46-G89 WeakPolarHBondContact O-CA 3.5Å; W46-G89 VanDerWaalsContact O-O 3.11Å
90	I	97.8	Very high	93.6	Very high	75 Å²	75	70.6 Å²	70.6	39%	0.385	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	135.4	-179.7	-174.6	163.3	0	0	0	111.3	T43 I44 T45 T88	T43-I90 HydrophobicContact CG2-CD1 3.8Å; T43-I90 HydrophobicContact CG2-CG1 3.93Å; I44-I90 CarbonylContact O-C 3.48Å; I44-I90 WeakPolarHBondContact O-CA 3.4Å; T45-I90 HydrophobicContact CG2-CB 4.18Å; T45-I90 HydrophobicContact CG2-CD1 4Å; T45-I90 HydrophobicContact CG2-CG1 3.87Å; T88-I90 VanDerWaalsContact C-N 3.35Å; T88-I90 PolarHBondContact OG1-O 2.96Å
91	L	97.5	Very high	92.8	Very high	25 Å²	25	70.9 Å²	70.9	13%	0.131	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	123.6	169.7	179.7	66.9	0	0	0	108.9	T43 I44 W46 V61 V81 A82 L93	T43-L91 WeakPolarHBondContact CA-O 3.35Å; I44-L91 HydrophobicContact CB-CB 4.41Å; I44-L91 HydrophobicContact CD1-CD2 4.37Å; I44-L91 PolarHBondContact N-O 2.76Å; I44-L91 PolarHBondContact O-N 3.09Å; W46-L91 HydrophobicContact CH2-CB 4.1Å; W46-L91 HydrophobicContact CZ3-CB 3.85Å; V61-L91 HydrophobicContact CB-CD2 3.84Å; V61-L91 HydrophobicContact CG1-CD2 3.95Å; V61-L91 HydrophobicContact CG2-CD2 3.75Å; V81-L91 HydrophobicContact CG1-CD2 4.12Å; A82-L91 HydrophobicContact CB-CD1 4.16Å; A82-L91 HydrophobicContact CB-CD2 3.75Å; L91-L93 HydrophobicContact CD2-CD2 4.24Å; L91-L93 HydrophobicContact CG-CD2 4.3Å
92	K	96.6	Very high	92.1	Very high	135 Å²	135	82 Å²	82	59%	0.587	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.8	169.4	-68.4	-178.5	-178.6	-180	0	108.2	L41 L42 T43	L41-K92 HydrophobicContact CD1-CB 4.37Å; L42-K92 WeakPolarHBondContact O-CA 3.44Å; T43-K92 HydrophobicContact CG2-CG 4.06Å
93	L	94	Very high	91.7	Very high	12 Å²	12	84.6 Å²	84.6	6%	0.063	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	148.6	179.9	62.6	126.5	0	0	0	110.7	L42 I44 V81 L91 P95 L98 W140	L42-L93 HydrophobicContact CB-CD1 4.14Å; L42-L93 HydrophobicContact CB-CD2 4.2Å; L42-L93 HydrophobicContact CB-CG 3.92Å; L42-L93 HydrophobicContact CD1-CD1 4.22Å; L42-L93 PolarHBondContact N-O 2.93Å; L42-L93 PolarHBondContact O-N 2.95Å; I44-L93 HydrophobicContact CD1-CD2 3.4Å; I44-L93 VanDerWaalsContact CD1-CD2 3.4Å; I44-L93 HydrophobicContact CG1-CD2 3.99Å; V81-L93 HydrophobicContact CG1-CB 4.49Å; V81-L93 HydrophobicContact CG1-CD1 4Å; V81-L93 HydrophobicContact CG1-CD2 3.96Å; V81-L93 HydrophobicContact CG1-CG 4.36Å; L91-L93 HydrophobicContact CD2-CD2 4.24Å; L91-L93 HydrophobicContact CG-CD2 4.3Å; L93-P95 HydrophobicContact CD1-CG 4.32Å; L93-L98 HydrophobicContact CB-CD2 4.47Å; L93-L98 HydrophobicContact CD1-CD1 3.8Å; L93-L98 HydrophobicContact CD1-CD2 4.46Å; L93-L98 HydrophobicContact CD1-CG 4.41Å; L93-W140 HydrophobicContact CD1-CZ3 4.2Å
94	K	94.6	Very high	91.4	Very high	99 Å²	99	84.8 Å²	84.8	43%	0.43	41%	0.41	S	S	.	.			trans	-109.3	112.1	168.9	-66.3	175.8	173.7	-178.3	0	107.5	D40 L41 R96 E97	D40-K94 WeakPolarHBondContact O-CG 3.49Å; L41-K94 HydrophobicContact CD1-CG 4.01Å; K94-R96 PolarHBondContact O-N 2.69Å; K94-R96 VanDerWaalsContact O-N 3.13Å; K94-E97 HydrophobicContact CB-CB 4.28Å; K94-E97 HydrophobicContact CB-CG 4.09Å; K94-E97 HydrophobicContact CD-CG 4.3Å; K94-E97 WeakPolarHBondContact CD-OE1 3.42Å; K94-E97 IonicContact NZ-OE1 3.95Å; K94-E97 PolarHBondContact NZ-OE1 3.36Å; K94-E97 PolarHBondContact O-N 2.78Å
95	P	93.1	Very high	91.1	Very high	16 Å²	16	85.4 Å²	85.4	10%	0.104	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-54.1	-36.3	-174	-31.1	37.5	0	0	0	114.5	P39 L42 L93 E97 L98 W140	P39-P95 HydrophobicContact CG-CG 4.04Å; P39-P95 WeakPolarHBondContact O-CD 3.15Å; L42-P95 HydrophobicContact CD1-CG 3.75Å; L42-P95 HydrophobicContact CG-CG 4.08Å; L93-P95 HydrophobicContact CD1-CG 4.32Å; P95-E97 PolarHBondContact O-N 3.25Å; P95-L98 WeakPolarHBondContact O-CB 3.49Å; P95-L98 PolarHBondContact O-N 3.46Å; P95-L98 VanDerWaalsContact O-N 3.1Å; P95-W140 HydrophobicContact CB-CB 4.46Å; P95-W140 HydrophobicContact CB-CE3 4.42Å; P95-W140 HydrophobicContact CG-CB 4.34Å; P95-W140 HydrophobicContact CG-CE3 4.31Å
96	R	89.6	Confident	90.9	Very high	192 Å²	192	84.4 Å²	84.4	73%	0.725	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-64.1	-20.6	177.4	-61.7	-174.6	-174.9	168.2	8	114.3	K94	K94-R96 PolarHBondContact O-N 2.69Å; K94-R96 VanDerWaalsContact O-N 3.13Å
97	E	90.9	Very high	90.4	Very high	119 Å²	119	83.9 Å²	83.9	56%	0.556	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-97.9	-2.3	179.2	-60.2	177.7	-166.8	0	0	112	K94 P95 H99	K94-E97 HydrophobicContact CB-CB 4.28Å; K94-E97 HydrophobicContact CB-CG 4.09Å; K94-E97 HydrophobicContact CD-CG 4.3Å; K94-E97 WeakPolarHBondContact CD-OE1 3.42Å; K94-E97 IonicContact NZ-OE1 3.95Å; K94-E97 PolarHBondContact NZ-OE1 3.36Å; K94-E97 PolarHBondContact O-N 2.78Å; P95-E97 PolarHBondContact O-N 3.25Å; E97-H99 PolarHBondContact O-N 2.65Å; E97-H99 PolarHBondContact O-ND1 2.76Å
98	L	90.3	Very high	90.2	Very high	46 Å²	46	87 Å²	87	24%	0.241	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-73.2	124.7	178.3	-68.9	176.6	0	0	0	110.9	V81 L93 P95 W140 Y141	V81-L98 HydrophobicContact CG1-CD1 4.43Å; V81-L98 HydrophobicContact CG1-CD2 4.06Å; L93-L98 HydrophobicContact CB-CD2 4.47Å; L93-L98 HydrophobicContact CD1-CD1 3.8Å; L93-L98 HydrophobicContact CD1-CD2 4.46Å; L93-L98 HydrophobicContact CD1-CG 4.41Å; P95-L98 WeakPolarHBondContact O-CB 3.49Å; P95-L98 PolarHBondContact O-N 3.46Å; P95-L98 VanDerWaalsContact O-N 3.1Å; L98-W140 HydrophobicContact CD1-CZ3 4.06Å; L98-Y141 HydrophobicContact CD1-CD2 4.01Å; L98-Y141 HydrophobicContact CD1-CE2 4.28Å
99	H	84.4	Confident	90.1	Very high	173 Å²	173	84.4 Å²	84.4	80%	0.801	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-85.9	130.3	174.2	-64.7	77.1	0	0	0	109.7	E97	E97-H99 PolarHBondContact O-N 2.65Å; E97-H99 PolarHBondContact O-ND1 2.76Å
100	R	81.9	Confident	89.9	Confident	93 Å²	93	85 Å²	85	35%	0.351	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-61.8	133.7	172.4	-66.3	-58.1	-136.9	166	16.3	109.9	Y141 F142 D145	R100-Y141 VanDerWaalsContact CZ-O 3.29Å; R100-Y141 PolarHBondContact NH1-O 3.36Å; R100-F142 VanDerWaalsContact NH1-CD1 3.3Å; R100-D145 IonicContact CZ-OD2 3.07Å; R100-D145 VanDerWaalsContact CZ-OD2 3.29Å; R100-D145 IonicContact NE-OD2 3.61Å; R100-D145 PolarHBondContact NE-OD2 3.17Å; R100-D145 IonicContact NH2-OD2 2.68Å; R100-D145 PolarHBondContact NH2-OD2 3.18Å
101	P	77	Confident	89.6	Confident	36 Å²	36	87.8 Å²	87.8	23%	0.234	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-57.1	145.3	175.1	-24.5	34.1	0	0	0	111.8	I80 D103 L106 Y141	I80-P101 HydrophobicContact CB-CG 4.01Å; I80-P101 HydrophobicContact CG1-CG 4.36Å; P101-D103 HydrophobicContact CB-CB 4.37Å; P101-D103 PolarHBondContact O-N 3.21Å; P101-L106 HydrophobicContact CB-CD1 4.06Å; P101-L106 HydrophobicContact CG-CD1 4.01Å; P101-Y141 WeakPolarHBondContact CD-OH 3.26Å
102	R	79.7	Confident	89.2	Confident	250 Å²	250	89.9 Å²	89.9	94%	0.943	42%	0.42	S	S	*	.	S	Bend	trans	-74.4	-6.6	172.4	-64.2	-176.4	-176.6	176.4	1.2	113.4	T104	R102-T104 PolarHBondContact O-N 2.9Å
103	D	86.6	Confident	89.1	Confident	71 Å²	71	83.5 Å²	83.5	38%	0.38	39%	0.392	S	S	.	.			trans	-66	113.8	178.9	-173.3	-16.5	0	0	0	110.2	P101 T105 L106	P101-D103 HydrophobicContact CB-CB 4.37Å; P101-D103 PolarHBondContact O-N 3.21Å; D103-T105 PolarHBondContact O-N 2.91Å; D103-T105 VanDerWaalsContact O-N 3.17Å; D103-T105 WeakPolarHBondContact OD1-CB 2.96Å; D103-T105 WeakPolarHBondContact OD1-CG2 3.2Å; D103-T105 PolarHBondContact OD1-N 2.82Å; D103-T105 PolarHBondContact OD1-OG1 3.46Å; D103-T105 PolarHBondContact OD2-OG1 3.36Å; D103-L106 HydrophobicContact CB-CD1 4.24Å; D103-L106 HydrophobicContact CB-CG 4.28Å; D103-L106 PolarHBondContact O-N 3.13Å; D103-L106 VanDerWaalsContact O-N 3.09Å
104	T	87.7	Confident	88.9	Confident	119 Å²	119	85.4 Å²	85.4	73%	0.73	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-21.2	-178.7	51.6	0	0	0	0	112.9	R102 L106 T107	R102-T104 PolarHBondContact O-N 2.9Å; T104-L106 PolarHBondContact O-N 2.88Å; T104-T107 WeakPolarHBondContact CA-OG1 3.44Å
105	T	89.2	Confident	88.9	Confident	91 Å²	91	84.4 Å²	84.4	56%	0.558	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-19.6	177.6	68.9	0	0	0	0	112.6	D103 K109	D103-T105 PolarHBondContact O-N 2.91Å; D103-T105 VanDerWaalsContact O-N 3.17Å; D103-T105 WeakPolarHBondContact OD1-CB 2.96Å; D103-T105 WeakPolarHBondContact OD1-CG2 3.2Å; D103-T105 PolarHBondContact OD1-N 2.82Å; D103-T105 PolarHBondContact OD1-OG1 3.46Å; D103-T105 PolarHBondContact OD2-OG1 3.36Å; T105-K109 VanDerWaalsContact O-CE 3.32Å; T105-K109 WeakPolarHBondContact O-CE 3.37Å
106	L	91.8	Very high	88.9	Confident	14 Å²	14	83.7 Å²	83.7	7%	0.073	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-14.4	-178.1	-57.7	-178.7	0	0	0	113.5	R77 I80 P101 D103 T104 N108 K109	R77-L106 HydrophobicContact CG-CD2 4.23Å; R77-L106 VanDerWaalsContact O-CD2 3.24Å; R77-L106 WeakPolarHBondContact O-CD2 3.45Å; I80-L106 HydrophobicContact CD1-CD1 4.15Å; I80-L106 HydrophobicContact CG1-CD1 4.07Å; P101-L106 HydrophobicContact CB-CD1 4.06Å; P101-L106 HydrophobicContact CG-CD1 4.01Å; D103-L106 HydrophobicContact CB-CD1 4.24Å; D103-L106 HydrophobicContact CB-CG 4.28Å; D103-L106 PolarHBondContact O-N 3.13Å; D103-L106 VanDerWaalsContact O-N 3.09Å; T104-L106 PolarHBondContact O-N 2.88Å; L106-N108 VanDerWaalsContact C-N 3.34Å; L106-N108 PolarHBondContact O-N 2.98Å; L106-K109 PolarHBondContact O-N 2.82Å
107	T	87.1	Confident	89.2	Confident	76 Å²	76	75.1 Å²	75.1	47%	0.466	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-35.3	-168.6	-50.3	0	0	0	0	114.5	T104 W110	T104-T107 WeakPolarHBondContact CA-OG1 3.44Å; T107-W110 PolarHBondContact O-NE1 2.96Å; T107-W110 VanDerWaalsContact O-NE1 3.16Å
108	N	91.1	Very high	89.4	Confident	87 Å²	87	69.5 Å²	69.5	47%	0.465	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	6.8	-174.6	-73.4	-45.9	0	0	0	114.2	L106 W110 R111	L106-N108 VanDerWaalsContact C-N 3.34Å; L106-N108 PolarHBondContact O-N 2.98Å; N108-W110 PolarHBondContact O-N 3.3Å; N108-R111 WeakPolarHBondContact O-CB 3.37Å; N108-R111 WeakPolarHBondContact O-CG 3.39Å; N108-R111 PolarHBondContact O-N 3.09Å; N108-R111 VanDerWaalsContact O-N 3.15Å
109	K	93.9	Very high	89.6	Confident	36 Å²	36	68.9 Å²	68.9	16%	0.157	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-63.7	-25.3	-175.3	-64.4	-67.8	-165.3	-169.1	0	113.1	E76 V78 T105 L106 R111 D112 F113 F142	E76-K109 IonicContact OE1-NZ 3.22Å; E76-K109 PolarHBondContact OE1-NZ 2.85Å; E76-K109 IonicContact OE2-NZ 2.65Å; E76-K109 PolarHBondContact OE2-NZ 3.02Å; V78-K109 HydrophobicContact CB-CB 3.83Å; V78-K109 HydrophobicContact CB-CG 4.27Å; V78-K109 HydrophobicContact CG1-CB 4.01Å; V78-K109 HydrophobicContact CG1-CD 4.34Å; V78-K109 HydrophobicContact CG1-CG 4.3Å; T105-K109 VanDerWaalsContact O-CE 3.32Å; T105-K109 WeakPolarHBondContact O-CE 3.37Å; L106-K109 PolarHBondContact O-N 2.82Å; K109-R111 PolarHBondContact O-N 3.25Å; K109-R111 VanDerWaalsContact O-N 3.09Å; K109-D112 PolarHBondContact O-N 2.91Å; K109-F113 HydrophobicContact CB-CD2 4.19Å; K109-F113 HydrophobicContact CD-CD2 4.14Å; K109-F113 HydrophobicContact CD-CE2 3.88Å; K109-F113 WeakPolarHBondContact O-CD2 3.36Å; K109-F113 PolarHBondContact O-N 3.16Å; K109-F142 HydrophobicContact CB-CZ 4.3Å
110	W	92.8	Very high	90.2	Very high	19 Å²	19	60.7 Å²	60.7	7%	0.072	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-60.8	-17.2	175.6	63.6	-100.2	0	0	0	114.9	T107 N108 F142 D145 W146 K149 Y150 R158	T107-W110 PolarHBondContact O-NE1 2.96Å; T107-W110 VanDerWaalsContact O-NE1 3.16Å; N108-W110 PolarHBondContact O-N 3.3Å; W110-F142 HydrophobicContact CB-CB 4.1Å; W110-F142 HydrophobicContact CB-CD1 3.86Å; W110-F142 HydrophobicContact CB-CD2 3.82Å; W110-F142 HydrophobicContact CB-CE1 4.04Å; W110-F142 HydrophobicContact CB-CE2 4.1Å; W110-F142 HydrophobicContact CB-CG 3.67Å; W110-F142 HydrophobicContact CB-CZ 4.17Å; W110-D145 HydrophobicContact CB-CB 4.14Å; W110-D145 HydrophobicContact CD2-CB 3.72Å; W110-D145 HydrophobicContact CE3-CB 4.26Å; W110-D145 HydrophobicContact CG-CB 3.65Å; W110-D145 PolarHBondContact NE1-OD1 3.01Å; W110-W146 AromaticContact CE3-CD1 3.81Å; W110-W146 PolarHBondContact O-NE1 3.42Å; W110-K149 HydrophobicContact CH2-CB 3.79Å; W110-K149 HydrophobicContact CH2-CD 4.21Å; W110-K149 HydrophobicContact CH2-CG 3.79Å; W110-K149 HydrophobicContact CZ3-CB 3.83Å; W110-K149 HydrophobicContact CZ3-CG 3.84Å; W110-Y150 HydrophobicContact CZ3-CE2 4.45Å; W110-R158 PolarHBondContact O-NH1 2.97Å
111	R	92.2	Very high	90.9	Very high	135 Å²	135	56.3 Å²	56.3	51%	0.509	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-72.3	-45.9	177.6	-65.6	-177.1	178.6	-149.8	2.2	111.3	N108 K109	N108-R111 WeakPolarHBondContact O-CB 3.37Å; N108-R111 WeakPolarHBondContact O-CG 3.39Å; N108-R111 PolarHBondContact O-N 3.09Å; N108-R111 VanDerWaalsContact O-N 3.15Å; K109-R111 PolarHBondContact O-N 3.25Å; K109-R111 VanDerWaalsContact O-N 3.09Å
112	D	89	Confident	91.8	Very high	69 Å²	69	55.6 Å²	55.6	37%	0.369	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-30.5	-169.5	-57.3	-21.1	0	0	0	112.1	R74 K109	R74-D112 IonicContact NH1-OD2 3.77Å; K109-D112 PolarHBondContact O-N 2.91Å
113	F	93.5	Very high	92.5	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.234	C	C	.	.			trans	-106.8	126.2	-173.1	-63.1	-82.3	0	0	0	112.7	G65 W67 R74 E76 V78 K109 F138 F142	G65-F113 VanDerWaalsContact C-CE1 3.41Å; G65-F113 VanDerWaalsContact CA-CD1 3.41Å; G65-F113 VanDerWaalsContact O-CE1 3.29Å; G65-F113 WeakPolarHBondContact O-CE1 3.48Å; W67-F113 HydrophobicContact CB-CD1 3.79Å; W67-F113 HydrophobicContact CB-CE1 3.48Å; W67-F113 VanDerWaalsContact CB-CE1 3.48Å; W67-F113 HydrophobicContact CB-CZ 4.18Å; R74-F113 HydrophobicContact CB-CE1 4.25Å; R74-F113 HydrophobicContact CB-CZ 4.01Å; E76-F113 HydrophobicContact CG-CE1 4.34Å; E76-F113 HydrophobicContact CG-CE2 4.08Å; E76-F113 HydrophobicContact CG-CZ 3.56Å; E76-F113 WeakPolarHBondContact OE1-CE2 3.38Å; E76-F113 WeakPolarHBondContact OE1-CZ 3.32Å; V78-F113 HydrophobicContact CG1-CB 4Å; V78-F113 HydrophobicContact CG1-CD1 4.1Å; V78-F113 HydrophobicContact CG1-CD2 3.46Å; V78-F113 VanDerWaalsContact CG1-CD2 3.46Å; V78-F113 HydrophobicContact CG1-CE1 4.45Å; V78-F113 HydrophobicContact CG1-CE2 3.9Å; V78-F113 HydrophobicContact CG1-CG 3.57Å; V78-F113 HydrophobicContact CG1-CZ 4.37Å; K109-F113 HydrophobicContact CB-CD2 4.19Å; K109-F113 HydrophobicContact CD-CD2 4.14Å; K109-F113 HydrophobicContact CD-CE2 3.88Å; K109-F113 WeakPolarHBondContact O-CD2 3.36Å; K109-F113 PolarHBondContact O-N 3.16Å; F113-F138 HydrophobicContact CB-CD2 4.45Å; F113-F142 HydrophobicContact CB-CE2 4.36Å; F113-F142 WeakPolarHBondContact O-CD2 3.42Å; F113-F142 WeakPolarHBondContact O-CE2 3.48Å
114	E	91.6	Very high	92.7	Very high	52 Å²	52	48.7 Å²	48.7	24%	0.243	25%	0.252	C	S	.	.	S	Bend	trans	-107	-34.3	-177.7	-71.6	160	167.2	0	0	112.4	F138 R158	E114-F138 PolarHBondContact O-N 3.1Å; E114-R158 VanDerWaalsContact CD-NH2 3.34Å; E114-R158 IonicContact OE1-CZ 2.69Å; E114-R158 IonicContact OE1-NE 2.9Å; E114-R158 IonicContact OE1-NH2 3.32Å; E114-R158 PolarHBondContact OE1-NH2 3.31Å
115	F	93.5	Very high	92.8	Very high	78 Å²	78	49.3 Å²	49.3	34%	0.342	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	171	-177.6	61.6	-94.9	0	0	0	109.5	Y66 I135 T136 F138	Y66-F115 HydrophobicContact CD1-CE2 4.17Å; Y66-F115 PolarHBondContact N-O 2.95Å; F115-I135 HydrophobicContact CB-CG2 4.16Å; F115-I135 HydrophobicContact CD2-CG2 3.59Å; F115-I135 HydrophobicContact CE2-CG2 4.39Å; F115-I135 HydrophobicContact CG-CG2 4.2Å; F115-T136 VanDerWaalsContact CA-O 3.24Å; F115-T136 WeakPolarHBondContact CA-O 3.09Å; F115-T136 VanDerWaalsContact CB-O 3.27Å; F115-T136 WeakPolarHBondContact CB-O 3.39Å; F115-F138 VanDerWaalsContact O-CE2 3.29Å; F115-F138 WeakPolarHBondContact O-CE2 3.39Å
116	G	94	Very high	92.6	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.3	-145.1	176.8	0	0	0	0	0	109.5	L64 I135 T136 F138	L64-G116 CarbonylContact O-C 3.58Å; L64-G116 VanDerWaalsContact O-CA 3.25Å; L64-G116 WeakPolarHBondContact O-CA 3.39Å; G116-I135 CarbonylContact O-C 3.52Å; G116-I135 VanDerWaalsContact O-CA 3.26Å; G116-I135 WeakPolarHBondContact O-CA 3.5Å; G116-T136 PolarHBondContact N-O 2.6Å; G116-T136 PolarHBondContact O-N 3.2Å; G116-F138 VanDerWaalsContact CA-CZ 3.5Å
117	V	94.4	Very high	92	Very high	13 Å²	13	53.8 Å²	53.8	8%	0.079	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	152	-177.5	-59.2	0	0	0	0	111.1	L64 F75 Y132 S133 I135	L64-V117 HydrophobicContact CB-CG2 3.96Å; L64-V117 PolarHBondContact N-O 3.5Å; L64-V117 PolarHBondContact O-N 2.78Å; F75-V117 HydrophobicContact CE2-CG2 3.9Å; F75-V117 HydrophobicContact CZ-CG2 3.67Å; V117-Y132 HydrophobicContact CG2-CD1 3.83Å; V117-S133 WeakPolarHBondContact CG1-O 3.47Å; V117-I135 HydrophobicContact CG1-CG1 4.42Å
118	V	96.3	Very high	91.6	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	126.2	163	-178.9	0	0	0	0	107.6	V20 L22 I44 V61 L63 Y132 S133 T136	V20-V118 HydrophobicContact CG1-CG1 4.28Å; L22-V118 HydrophobicContact CD1-CG2 4.43Å; L22-V118 HydrophobicContact CD2-CB 4.05Å; L22-V118 HydrophobicContact CD2-CG2 3.7Å; I44-V118 HydrophobicContact CD1-CG1 3.95Å; I44-V118 HydrophobicContact CG2-CG1 4.23Å; V61-V118 HydrophobicContact CG1-CG1 3.71Å; L63-V118 HydrophobicContact CD2-CB 4.41Å; L63-V118 HydrophobicContact CD2-CG2 3.8Å; V118-Y132 CarbonylContact O-C 3.47Å; V118-S133 PolarHBondContact N-OG 2.94Å; V118-S133 PolarHBondContact O-N 3.3Å; V118-S133 PolarHBondContact O-OG 3.3Å; V118-T136 HydrophobicContact CG2-CG2 4.08Å
119	R	95	Very high	91.1	Very high	34 Å²	34	52.9 Å²	52.9	13%	0.128	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	133.7	173.4	172.5	-178.3	65.2	176.3	5	109.7	V61 D62 L64 A121 V130 L131 Y132	V61-R119 WeakPolarHBondContact CA-O 3.35Å; D62-R119 PolarHBondContact N-O 2.99Å; D62-R119 PolarHBondContact O-N 3.24Å; D62-R119 VanDerWaalsContact OD1-CB 3.32Å; D62-R119 WeakPolarHBondContact OD1-CB 3.31Å; D62-R119 IonicContact OD1-CZ 3.29Å; D62-R119 IonicContact OD1-NE 3.48Å; D62-R119 PolarHBondContact OD1-NE 3.2Å; D62-R119 IonicContact OD1-NH2 3.23Å; D62-R119 PolarHBondContact OD1-NH2 2.71Å; D62-R119 IonicContact OD2-CZ 2.7Å; D62-R119 IonicContact OD2-NE 3.52Å; D62-R119 IonicContact OD2-NH2 2.61Å; D62-R119 PolarHBondContact OD2-NH2 3.31Å; L64-R119 HydrophobicContact CD1-CB 4.37Å; L64-R119 HydrophobicContact CG-CB 4.27Å; R119-A121 HydrophobicContact CG-CB 4.29Å; R119-V130 HydrophobicContact CG-CG2 3.51Å; R119-L131 WeakPolarHBondContact CA-O 3.38Å; R119-Y132 HydrophobicContact CB-CD1 3.93Å; R119-Y132 HydrophobicContact CB-CE1 3.99Å; R119-Y132 HydrophobicContact CG-CD1 4.12Å; R119-Y132 HydrophobicContact CG-CE1 3.85Å
120	V	96.8	Very high	90.9	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	117.2	167.5	-178.7	0	0	0	0	107.2	V20 W46 L51 V59 V61 L131	V20-V120 HydrophobicContact CB-CG2 4.43Å; V20-V120 HydrophobicContact CG1-CG2 3.96Å; V20-V120 HydrophobicContact CG2-CB 3.85Å; V20-V120 HydrophobicContact CG2-CG2 3.53Å; W46-V120 HydrophobicContact CD2-CB 4.42Å; W46-V120 HydrophobicContact CD2-CG1 3.83Å; W46-V120 HydrophobicContact CD2-CG2 4.07Å; W46-V120 HydrophobicContact CE3-CG1 4.32Å; W46-V120 HydrophobicContact CE3-CG2 3.85Å; W46-V120 HydrophobicContact CG-CG1 4.11Å; W46-V120 HydrophobicContact CG-CG2 4.46Å; W46-V120 HydrophobicContact CZ2-CG1 4.2Å; W46-V120 HydrophobicContact CZ3-CG2 4.33Å; L51-V120 HydrophobicContact CD1-CG1 3.85Å; V59-V120 HydrophobicContact CB-CG1 4.02Å; V59-V120 HydrophobicContact CG1-CG1 4.21Å; V59-V120 HydrophobicContact CG2-CG1 4.18Å; V61-V120 HydrophobicContact CG1-CG2 4.26Å; V61-V120 HydrophobicContact CG2-CG1 4.46Å; V61-V120 HydrophobicContact CG2-CG2 4.08Å; V120-L131 PolarHBondContact N-O 3.29Å; V120-L131 PolarHBondContact O-N 2.84Å
121	A	95.9	Very high	90.9	Very high	2 Å²	2	53.1 Å²	53.1	2%	0.017	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	149.9	-178.5	0	0	0	0	0	111.4	V59 T60 R119 T123 P126 G129 V130	V59-A121 CarbonylContact C-O 3.39Å; V59-A121 WeakPolarHBondContact CA-O 3.25Å; V59-A121 WeakPolarHBondContact CB-O 3.44Å; T60-A121 PolarHBondContact N-O 2.61Å; T60-A121 PolarHBondContact O-N 3.23Å; R119-A121 HydrophobicContact CG-CB 4.29Å; A121-T123 PolarHBondContact O-N 2.91Å; A121-P126 HydrophobicContact CB-CB 4.28Å; A121-G129 CarbonylContact C-O 3.6Å; A121-G129 VanDerWaalsContact CA-O 3.26Å; A121-G129 WeakPolarHBondContact CA-O 3.29Å; A121-V130 HydrophobicContact CB-CG2 4.3Å
122	L	96.1	Very high	90.9	Very high	20 Å²	20	51.1 Å²	51.1	11%	0.105	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	130.1	168.9	-66.9	176.3	0	0	0	109.6	L51 T52 A57 V59 D124 K125 P126 G129	L51-L122 HydrophobicContact CB-CD2 4.1Å; L51-L122 HydrophobicContact CB-CG 4.31Å; T52-L122 HydrophobicContact CG2-CD1 4.47Å; T52-L122 HydrophobicContact CG2-CD2 3.71Å; A57-L122 HydrophobicContact CB-CD2 4.02Å; V59-L122 HydrophobicContact CG1-CD2 4.27Å; L122-D124 VanDerWaalsContact C-N 3.3Å; L122-D124 PolarHBondContact O-N 3.35Å; L122-K125 HydrophobicContact CB-CB 4.48Å; L122-K125 CarbonylContact O-C 3.42Å; L122-K125 PolarHBondContact O-N 2.94Å; L122-P126 WeakPolarHBondContact O-CA 3.25Å; L122-G129 PolarHBondContact N-O 2.85Å
123	T	94.7	Very high	91.1	Very high	36 Å²	36	48.1 Å²	48.1	22%	0.221	24%	0.243	C	C	.	.	S	Bend	trans	-59.5	-43.3	-179.4	-59.8	0	0	0	0	111.4	K58 T60 N84 A121	K58-T123 PolarHBondContact O-N 2.88Å; K58-T123 PolarHBondContact O-OG1 3.46Å; T60-T123 PolarHBondContact OG1-OG1 3.31Å; T60-T123 VanDerWaalsContact OG1-OG1 3.09Å; N84-T123 WeakPolarHBondContact OD1-CG2 3.33Å; A121-T123 PolarHBondContact O-N 2.91Å
124	D	91.4	Very high	90.8	Very high	141 Å²	141	50.2 Å²	50.2	75%	0.754	26%	0.255	S	S	*	.	S	Bend	trans	-81.8	-24.4	-174.4	-55.9	-34.3	0	0	0	112.9	L122	L122-D124 VanDerWaalsContact C-N 3.3Å; L122-D124 PolarHBondContact O-N 3.35Å
125	K	88.4	Confident	90.7	Very high	132 Å²	132	51.8 Å²	51.8	57%	0.574	27%	0.265	S	S	*	.			trans	-139.1	67.1	-175.4	-65.9	-174.8	-179.5	179.2	0	111.6	L122 D127 I128 G129	L122-K125 HydrophobicContact CB-CB 4.48Å; L122-K125 CarbonylContact O-C 3.42Å; L122-K125 PolarHBondContact O-N 2.94Å; K125-D127 PolarHBondContact O-N 2.83Å; K125-I128 HydrophobicContact CD-CD1 4.39Å; K125-I128 PolarHBondContact O-N 2.88Å; K125-G129 PolarHBondContact O-N 2.86Å
126	P	84.6	Confident	90.7	Very high	48 Å²	48	48.5 Å²	48.5	31%	0.312	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-20.2	-172.9	26.9	-35.6	0	0	0	114	A121 L122	A121-P126 HydrophobicContact CB-CB 4.28Å; L122-P126 WeakPolarHBondContact O-CA 3.25Å
127	D	79	Confident	90.7	Very high	150 Å²	150	50.4 Å²	50.4	80%	0.802	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-16.4	-176.4	-56.5	-39.2	0	0	0	114	K125	K125-D127 PolarHBondContact O-N 2.83Å
128	I	78.9	Confident	90.7	Very high	141 Å²	141	49.8 Å²	49.8	72%	0.723	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	-49.7	-174	-59.7	173.9	0	0	0	110.9	K125	K125-I128 HydrophobicContact CD-CD1 4.39Å; K125-I128 PolarHBondContact O-N 2.88Å
129	G	82.3	Confident	90.5	Very high	3 Å²	3	50 Å²	50	3%	0.031	26%	0.262	C	S	.	.	S	Bend	trans	-100.3	88.7	179	0	0	0	0	0	109.5	L51 A121 L122 K125	L51-G129 WeakPolarHBondContact CD2-O 3.43Å; A121-G129 CarbonylContact C-O 3.6Å; A121-G129 VanDerWaalsContact CA-O 3.26Å; A121-G129 WeakPolarHBondContact CA-O 3.29Å; L122-G129 PolarHBondContact N-O 2.85Å; K125-G129 PolarHBondContact O-N 2.86Å
130	V	89.6	Confident	90.5	Very high	41 Å²	41	48.8 Å²	48.8	25%	0.248	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	133.7	-179.4	66.8	0	0	0	0	111.5	R119 A121 Y132	R119-V130 HydrophobicContact CG-CG2 3.51Å; A121-V130 HydrophobicContact CB-CG2 4.3Å; V130-Y132 HydrophobicContact CG1-CE2 3.98Å; V130-Y132 HydrophobicContact CG2-CD2 4.46Å; V130-Y132 HydrophobicContact CG2-CE1 4.02Å; V130-Y132 HydrophobicContact CG2-CE2 3.75Å; V130-Y132 VanDerWaalsContact CG2-CZ 3.5Å; V130-Y132 WeakPolarHBondContact CG2-OH 3.45Å
131	L	91.8	Very high	90.4	Very high	20 Å²	20	49.6 Å²	49.6	11%	0.105	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	144.5	174.2	-60.8	173.3	0	0	0	108.9	V20 W46 N50 L51 R119 V120	V20-L131 HydrophobicContact CG2-CB 3.58Å; V20-L131 WeakPolarHBondContact CG2-O 3.45Å; W46-L131 HydrophobicContact CB-CD1 3.96Å; W46-L131 HydrophobicContact CG-CD1 4.41Å; N50-L131 HydrophobicContact CB-CD1 4.19Å; N50-L131 HydrophobicContact CB-CD2 4.19Å; L51-L131 HydrophobicContact CD1-CD1 4.24Å; L51-L131 HydrophobicContact CD2-CB 4.47Å; L51-L131 HydrophobicContact CD2-CD1 3.88Å; L51-L131 HydrophobicContact CD2-CG 3.67Å; L51-L131 HydrophobicContact CG-CD1 3.71Å; L51-L131 HydrophobicContact CG-CG 4.09Å; R119-L131 WeakPolarHBondContact CA-O 3.38Å; V120-L131 PolarHBondContact N-O 3.29Å; V120-L131 PolarHBondContact O-N 2.84Å
132	Y	91.7	Very high	90.3	Very high	93 Å²	93	49.6 Å²	49.6	37%	0.365	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	149.1	179.3	-59.5	-80.1	0	0	0	110.7	G19 V20 L64 F75 V117 V118 R119 V130	G19-Y132 PolarHBondContact N-O 3.3Å; V20-Y132 PolarHBondContact N-O 3.35Å; L64-Y132 HydrophobicContact CD1-CD1 4.38Å; L64-Y132 HydrophobicContact CD1-CE1 3.63Å; F75-Y132 HydrophobicContact CE1-CE1 4.37Å; F75-Y132 HydrophobicContact CZ-CE1 4.38Å; V117-Y132 HydrophobicContact CG2-CD1 3.83Å; V118-Y132 CarbonylContact O-C 3.47Å; R119-Y132 HydrophobicContact CB-CD1 3.93Å; R119-Y132 HydrophobicContact CB-CE1 3.99Å; R119-Y132 HydrophobicContact CG-CD1 4.12Å; R119-Y132 HydrophobicContact CG-CE1 3.85Å; V130-Y132 HydrophobicContact CG1-CE2 3.98Å; V130-Y132 HydrophobicContact CG2-CD2 4.46Å; V130-Y132 HydrophobicContact CG2-CE1 4.02Å; V130-Y132 HydrophobicContact CG2-CE2 3.75Å; V130-Y132 VanDerWaalsContact CG2-CZ 3.5Å; V130-Y132 WeakPolarHBondContact CG2-OH 3.45Å
133	S	93.4	Very high	90.2	Very high	6 Å²	6	50 Å²	50	4%	0.042	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	173.5	167.9	71.1	0	0	0	0	111.9	V20 V117 V118	V20-S133 WeakPolarHBondContact O-CA 3.23Å; V20-S133 WeakPolarHBondContact O-CB 3.28Å; V117-S133 WeakPolarHBondContact CG1-O 3.47Å; V118-S133 PolarHBondContact N-OG 2.94Å; V118-S133 PolarHBondContact O-N 3.3Å; V118-S133 PolarHBondContact O-OG 3.3Å
134	T	88.5	Confident	90.1	Very high	43 Å²	43	52.6 Å²	52.6	26%	0.264	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	169.4	156.9	56.6	0	0	0	0	110.7	P18 T136	P18-T134 HydrophobicContact CB-CG2 3.97Å; P18-T134 HydrophobicContact CG-CG2 4.06Å; T134-T136 PolarHBondContact O-N 3.05Å
135	I	89.4	Confident	90.1	Very high	86 Å²	86	47.5 Å²	47.5	44%	0.441	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	137.2	176.3	-63.2	172.7	0	0	0	109.9	F115 G116 V117	F115-I135 HydrophobicContact CB-CG2 4.16Å; F115-I135 HydrophobicContact CD2-CG2 3.59Å; F115-I135 HydrophobicContact CE2-CG2 4.39Å; F115-I135 HydrophobicContact CG-CG2 4.2Å; G116-I135 CarbonylContact O-C 3.52Å; G116-I135 VanDerWaalsContact O-CA 3.26Å; G116-I135 WeakPolarHBondContact O-CA 3.5Å; V117-I135 HydrophobicContact CG1-CG1 4.42Å
136	T	92.4	Very high	90.4	Very high	9 Å²	9	41.4 Å²	41.4	6%	0.055	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	148.4	175.3	-173.6	0	0	0	0	110.5	L22 F34 F115 G116 V118 T134 F138	L22-T136 HydrophobicContact CD1-CG2 3.98Å; F34-T136 PolarHBondContact O-OG1 3.04Å; F115-T136 VanDerWaalsContact CA-O 3.24Å; F115-T136 WeakPolarHBondContact CA-O 3.09Å; F115-T136 VanDerWaalsContact CB-O 3.27Å; F115-T136 WeakPolarHBondContact CB-O 3.39Å; G116-T136 PolarHBondContact N-O 2.6Å; G116-T136 PolarHBondContact O-N 3.2Å; V118-T136 HydrophobicContact CG2-CG2 4.08Å; T134-T136 PolarHBondContact O-N 3.05Å; T136-F138 HydrophobicContact CG2-CE1 4.26Å
137	S	93.2	Very high	90.9	Very high	40 Å²	40	43.5 Å²	43.5	28%	0.28	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	147	169.5	-173	0	0	0	0	109.9	S139 W140	S137-S139 VanDerWaalsContact C-N 3.31Å; S137-S139 WeakPolarHBondContact OG-CB 3.48Å; S137-S139 PolarHBondContact OG-N 3.34Å; S137-S139 VanDerWaalsContact OG-N 3.14Å; S137-S139 PolarHBondContact OG-OG 3.23Å; S137-W140 PolarHBondContact O-NE1 3.06Å
138	F	94.7	Very high	91.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.234	C	C	.	.	S	Bend	trans	-94.2	14.3	168	-61.9	-35.6	0	0	0	113	L63 L64 V78 F113 E114 F115 G116 T136 W140 Y141 F142	L63-F138 HydrophobicContact CB-CE1 3.87Å; L63-F138 HydrophobicContact CB-CZ 3.98Å; L63-F138 HydrophobicContact CD1-CD1 3.97Å; L63-F138 HydrophobicContact CD1-CE1 4.02Å; L63-F138 HydrophobicContact CD2-CE1 4.01Å; L63-F138 HydrophobicContact CG-CE1 4.18Å; L64-F138 WeakPolarHBondContact O-CZ 3.28Å; V78-F138 HydrophobicContact CG2-CD2 4.07Å; V78-F138 HydrophobicContact CG2-CE2 3.5Å; V78-F138 HydrophobicContact CG2-CZ 3.84Å; F113-F138 HydrophobicContact CB-CD2 4.45Å; E114-F138 PolarHBondContact O-N 3.1Å; F115-F138 VanDerWaalsContact O-CE2 3.29Å; F115-F138 WeakPolarHBondContact O-CE2 3.39Å; G116-F138 VanDerWaalsContact CA-CZ 3.5Å; T136-F138 HydrophobicContact CG2-CE1 4.26Å; F138-W140 VanDerWaalsContact C-N 3.29Å; F138-W140 PolarHBondContact O-N 3.39Å; F138-Y141 CarbonylContact O-C 3.48Å; F138-Y141 PolarHBondContact O-N 2.74Å; F138-F142 HydrophobicContact CB-CD2 3.56Å; F138-F142 HydrophobicContact CB-CE2 3.88Å; F138-F142 HydrophobicContact CB-CG 4.15Å; F138-F142 HydrophobicContact CD2-CD2 4.36Å; F138-F142 AromaticContact CD2-CE2 3.85Å; F138-F142 HydrophobicContact CD2-CE2 3.85Å; F138-F142 HydrophobicContact CG-CD2 4.4Å; F138-F142 HydrophobicContact CG-CE2 4.23Å; F138-F142 WeakPolarHBondContact O-CB 3.37Å; F138-F142 PolarHBondContact O-N 2.9Å
139	S	93.6	Very high	92.4	Very high	5 Å²	5	42.9 Å²	42.9	4%	0.035	23%	0.225	C	C	.	.	H	α-helix	trans	-51.7	-46.5	177.1	60.2	0	0	0	0	112.6	S36 S137 Y141 F142 L143 W146	S36-S139 PolarHBondContact O-OG 3.08Å; S137-S139 VanDerWaalsContact C-N 3.31Å; S137-S139 WeakPolarHBondContact OG-CB 3.48Å; S137-S139 PolarHBondContact OG-N 3.34Å; S137-S139 VanDerWaalsContact OG-N 3.14Å; S137-S139 PolarHBondContact OG-OG 3.23Å; S139-Y141 VanDerWaalsContact C-N 3.26Å; S139-Y141 PolarHBondContact O-N 2.83Å; S139-F142 PolarHBondContact O-N 2.79Å; S139-L143 WeakPolarHBondContact O-CA 2.99Å; S139-L143 VanDerWaalsContact O-CB 3.26Å; S139-L143 WeakPolarHBondContact O-CB 3.4Å; S139-L143 PolarHBondContact O-N 2.8Å; S139-W146 VanDerWaalsContact CA-CZ3 3.41Å
140	W	94	Very high	93	Very high	9 Å²	9	46.2 Å²	46.2	3%	0.034	24%	0.237	C	C	.	.	H	α-helix	trans	-66.4	-22.7	176.5	57.5	-95.5	0	0	0	114.6	F34 P37 P39 L42 L63 V81 L93 P95 L98 S137 F138	F34-W140 VanDerWaalsContact O-CD1 3.25Å; P37-W140 VanDerWaalsContact O-CA 3.28Å; P37-W140 WeakPolarHBondContact O-CA 3.44Å; P39-W140 HydrophobicContact CG-CB 3.95Å; L42-W140 HydrophobicContact CD1-CB 4.34Å; L42-W140 HydrophobicContact CD1-CD2 3.65Å; L42-W140 HydrophobicContact CD1-CE3 3.9Å; L42-W140 HydrophobicContact CD1-CG 3.83Å; L42-W140 HydrophobicContact CD1-CZ3 4.49Å; L63-W140 HydrophobicContact CD1-CH2 3.8Å; L63-W140 HydrophobicContact CD1-CZ2 4.33Å; L63-W140 HydrophobicContact CD1-CZ3 4.44Å; L63-W140 HydrophobicContact CD2-CH2 3.84Å; L63-W140 HydrophobicContact CD2-CZ2 4.13Å; L63-W140 HydrophobicContact CG-CH2 4.4Å; V81-W140 HydrophobicContact CG2-CH2 4.2Å; L93-W140 HydrophobicContact CD1-CZ3 4.2Å; P95-W140 HydrophobicContact CB-CB 4.46Å; P95-W140 HydrophobicContact CB-CE3 4.42Å; P95-W140 HydrophobicContact CG-CB 4.34Å; P95-W140 HydrophobicContact CG-CE3 4.31Å; L98-W140 HydrophobicContact CD1-CZ3 4.06Å; S137-W140 PolarHBondContact O-NE1 3.06Å; F138-W140 VanDerWaalsContact C-N 3.29Å; F138-W140 PolarHBondContact O-N 3.39Å
141	Y	94.9	Very high	93.3	Very high	17 Å²	17	45.6 Å²	45.6	7%	0.067	24%	0.239	C	C	.	.	H	α-helix	trans	-94.3	-33.4	179.4	-170.2	-117.5	0	0	0	112.7	L63 G79 I80 L98 R100 P101 F138 S139	L63-Y141 HydrophobicContact CD1-CD1 3.36Å; L63-Y141 HydrophobicContact CD1-CD2 3.94Å; L63-Y141 HydrophobicContact CD1-CE1 3.8Å; L63-Y141 HydrophobicContact CD1-CE2 4.31Å; L63-Y141 HydrophobicContact CD1-CG 3.45Å; L63-Y141 VanDerWaalsContact CD1-CG 3.45Å; G79-Y141 VanDerWaalsContact CA-OH 3.28Å; G79-Y141 WeakPolarHBondContact CA-OH 3.45Å; I80-Y141 PolarHBondContact N-OH 2.75Å; I80-Y141 PolarHBondContact O-OH 3.41Å; L98-Y141 HydrophobicContact CD1-CD2 4.01Å; L98-Y141 HydrophobicContact CD1-CE2 4.28Å; R100-Y141 VanDerWaalsContact CZ-O 3.29Å; R100-Y141 PolarHBondContact NH1-O 3.36Å; P101-Y141 WeakPolarHBondContact CD-OH 3.26Å; F138-Y141 CarbonylContact O-C 3.48Å; F138-Y141 PolarHBondContact O-N 2.74Å; S139-Y141 VanDerWaalsContact C-N 3.26Å; S139-Y141 PolarHBondContact O-N 2.83Å
142	F	94.2	Very high	93.4	Very high	1 Å²	1	49.3 Å²	49.3	0%	0.004	27%	0.273	C	S	.	.	H	α-helix	trans	-105	2.5	-173.8	-68.3	-19.8	0	0	0	113.8	V78 R100 K109 W110 F113 F138 S139 S144 D145 W146	V78-F142 HydrophobicContact CB-CZ 4.13Å; V78-F142 HydrophobicContact CG2-CZ 4.22Å; R100-F142 VanDerWaalsContact NH1-CD1 3.3Å; K109-F142 HydrophobicContact CB-CZ 4.3Å; W110-F142 HydrophobicContact CB-CB 4.1Å; W110-F142 HydrophobicContact CB-CD1 3.86Å; W110-F142 HydrophobicContact CB-CD2 3.82Å; W110-F142 HydrophobicContact CB-CE1 4.04Å; W110-F142 HydrophobicContact CB-CE2 4.1Å; W110-F142 HydrophobicContact CB-CG 3.67Å; W110-F142 HydrophobicContact CB-CZ 4.17Å; F113-F142 HydrophobicContact CB-CE2 4.36Å; F113-F142 WeakPolarHBondContact O-CD2 3.42Å; F113-F142 WeakPolarHBondContact O-CE2 3.48Å; F138-F142 HydrophobicContact CB-CD2 3.56Å; F138-F142 HydrophobicContact CB-CE2 3.88Å; F138-F142 HydrophobicContact CB-CG 4.15Å; F138-F142 HydrophobicContact CD2-CD2 4.36Å; F138-F142 AromaticContact CD2-CE2 3.85Å; F138-F142 HydrophobicContact CD2-CE2 3.85Å; F138-F142 HydrophobicContact CG-CD2 4.4Å; F138-F142 HydrophobicContact CG-CE2 4.23Å; F138-F142 WeakPolarHBondContact O-CB 3.37Å; F138-F142 PolarHBondContact O-N 2.9Å; S139-F142 PolarHBondContact O-N 2.79Å; F142-S144 VanDerWaalsContact C-N 3.35Å; F142-S144 PolarHBondContact O-N 2.89Å; F142-D145 PolarHBondContact O-N 2.71Å; F142-D145 VanDerWaalsContact O-N 3.09Å; F142-W146 HydrophobicContact CB-CD2 3.99Å; F142-W146 HydrophobicContact CB-CE3 4.48Å; F142-W146 HydrophobicContact CB-CG 4.44Å; F142-W146 HydrophobicContact CB-CH2 4.4Å; F142-W146 HydrophobicContact CB-CZ2 3.85Å; F142-W146 AromaticContact CD2-CZ2 3.87Å; F142-W146 HydrophobicContact CD2-CZ2 3.87Å; F142-W146 HydrophobicContact CG-CZ2 4.36Å; F142-W146 PolarHBondContact O-N 3.28Å
143	L	93.6	Very high	93.5	Very high	28 Å²	28	48.2 Å²	48.2	15%	0.147	27%	0.274	C	S	.	.	H	α-helix	trans	-47.4	-53.6	-177.1	-177.1	60.1	0	0	0	112.7	P37 A38 S139 D145 W146 E147 W154	P37-L143 HydrophobicContact CB-CD1 3.98Å; P37-L143 WeakPolarHBondContact O-CD2 3.4Å; A38-L143 HydrophobicContact CB-CD2 4Å; S139-L143 WeakPolarHBondContact O-CA 2.99Å; S139-L143 VanDerWaalsContact O-CB 3.26Å; S139-L143 WeakPolarHBondContact O-CB 3.4Å; S139-L143 PolarHBondContact O-N 2.8Å; L143-D145 VanDerWaalsContact C-N 3.31Å; L143-D145 PolarHBondContact O-N 2.72Å; L143-W146 PolarHBondContact O-N 3.16Å; L143-W146 VanDerWaalsContact O-N 3.16Å; L143-E147 HydrophobicContact CD1-CG 3.85Å; L143-E147 HydrophobicContact CG-CG 4.22Å; L143-E147 WeakPolarHBondContact O-CB 3.26Å; L143-E147 WeakPolarHBondContact O-CG 3.36Å; L143-E147 PolarHBondContact O-N 2.83Å; L143-W154 HydrophobicContact CD1-CZ2 3.94Å
144	S	92.6	Very high	93.6	Very high	91 Å²	91	49.4 Å²	49.4	64%	0.636	28%	0.277	S	S	*	.	H	α-helix	trans	-61.2	-37.3	-176.1	-55.8	0	0	0	0	113.1	F142 L148	F142-S144 VanDerWaalsContact C-N 3.35Å; F142-S144 PolarHBondContact O-N 2.89Å; S144-L148 WeakPolarHBondContact O-CB 3.5Å; S144-L148 PolarHBondContact O-N 2.88Å
145	D	92.6	Very high	93.8	Very high	34 Å²	34	49.8 Å²	49.8	18%	0.182	28%	0.284	C	S	.	.	H	α-helix	trans	-72.6	-37.1	178.3	-65	-98	0	0	0	111.6	R100 W110 F142 L143 K149	R100-D145 IonicContact CZ-OD2 3.07Å; R100-D145 VanDerWaalsContact CZ-OD2 3.29Å; R100-D145 IonicContact NE-OD2 3.61Å; R100-D145 PolarHBondContact NE-OD2 3.17Å; R100-D145 IonicContact NH2-OD2 2.68Å; R100-D145 PolarHBondContact NH2-OD2 3.18Å; W110-D145 HydrophobicContact CB-CB 4.14Å; W110-D145 HydrophobicContact CD2-CB 3.72Å; W110-D145 HydrophobicContact CE3-CB 4.26Å; W110-D145 HydrophobicContact CG-CB 3.65Å; W110-D145 PolarHBondContact NE1-OD1 3.01Å; F142-D145 PolarHBondContact O-N 2.71Å; F142-D145 VanDerWaalsContact O-N 3.09Å; L143-D145 VanDerWaalsContact C-N 3.31Å; L143-D145 PolarHBondContact O-N 2.72Å; D145-K149 VanDerWaalsContact O-CB 3.27Å; D145-K149 WeakPolarHBondContact O-CB 3.42Å; D145-K149 PolarHBondContact O-N 3.41Å
146	W	94.5	Very high	94	Very high	5 Å²	5	50.7 Å²	50.7	2%	0.019	29%	0.29	C	S	.	.	H	α-helix	trans	-71	-42.5	177.5	-67.2	-8.4	0	0	0	112	W110 S139 F142 L143 K149 Y150 W154 R158	W110-W146 AromaticContact CE3-CD1 3.81Å; W110-W146 PolarHBondContact O-NE1 3.42Å; S139-W146 VanDerWaalsContact CA-CZ3 3.41Å; F142-W146 HydrophobicContact CB-CD2 3.99Å; F142-W146 HydrophobicContact CB-CE3 4.48Å; F142-W146 HydrophobicContact CB-CG 4.44Å; F142-W146 HydrophobicContact CB-CH2 4.4Å; F142-W146 HydrophobicContact CB-CZ2 3.85Å; F142-W146 AromaticContact CD2-CZ2 3.87Å; F142-W146 HydrophobicContact CD2-CZ2 3.87Å; F142-W146 HydrophobicContact CG-CZ2 4.36Å; F142-W146 PolarHBondContact O-N 3.28Å; L143-W146 PolarHBondContact O-N 3.16Å; L143-W146 VanDerWaalsContact O-N 3.16Å; W146-K149 PolarHBondContact O-N 3.4Å; W146-Y150 HydrophobicContact CB-CD2 4.37Å; W146-Y150 WeakPolarHBondContact O-CB 3.33Å; W146-Y150 PolarHBondContact O-N 3.32Å; W146-W154 HydrophobicContact CB-CB 4.15Å; W146-W154 HydrophobicContact CB-CD2 4.05Å; W146-W154 HydrophobicContact CB-CE3 4.18Å; W146-W154 HydrophobicContact CB-CG 4.04Å; W146-W154 HydrophobicContact CD2-CE3 4.11Å; W146-W154 HydrophobicContact CD2-CZ3 4.29Å; W146-W154 HydrophobicContact CE3-CD2 4.09Å; W146-W154 AromaticContact CE3-CE3 3.39Å; W146-W154 HydrophobicContact CE3-CE3 3.39Å; W146-W154 AromaticContact CE3-CH2 3.74Å; W146-W154 HydrophobicContact CE3-CH2 3.74Å; W146-W154 HydrophobicContact CE3-CZ2 4.36Å; W146-W154 AromaticContact CE3-CZ3 3.2Å; W146-W154 HydrophobicContact CE3-CZ3 3.2Å; W146-W154 HydrophobicContact CG-CE3 4.47Å; W146-W154 HydrophobicContact CZ3-CE3 4.03Å; W146-W154 AromaticContact CZ3-CH2 3.82Å; W146-W154 HydrophobicContact CZ3-CH2 3.82Å; W146-W154 AromaticContact CZ3-CZ3 3.37Å; W146-W154 HydrophobicContact CZ3-CZ3 3.37Å; W146-R158 VanDerWaalsContact CE2-NH1 3.3Å
147	E	94.8	Very high	94.1	Very high	91 Å²	91	54.5 Å²	54.5	43%	0.425	31%	0.306	S	S	.	.	H	α-helix	trans	-62.6	-42.7	172.9	-74.6	-178.8	159.8	0	0	111.3	L143 K149 G151	L143-E147 HydrophobicContact CD1-CG 3.85Å; L143-E147 HydrophobicContact CG-CG 4.22Å; L143-E147 WeakPolarHBondContact O-CB 3.26Å; L143-E147 WeakPolarHBondContact O-CG 3.36Å; L143-E147 PolarHBondContact O-N 2.83Å; E147-K149 PolarHBondContact O-N 2.89Å; E147-G151 WeakPolarHBondContact O-CA 3.28Å; E147-G151 PolarHBondContact O-N 3.42Å
148	L	94.2	Very high	94.1	Very high	154 Å²	154	53.9 Å²	53.9	81%	0.806	30%	0.297	S	S	*	.	H	α-helix	trans	-63.3	-40.9	177	-177.8	66.7	0	0	0	112.1	S144	S144-L148 WeakPolarHBondContact O-CB 3.5Å; S144-L148 PolarHBondContact O-N 2.88Å
149	K	94.9	Very high	93.9	Very high	125 Å²	125	57.2 Å²	57.2	54%	0.543	32%	0.32	S	S	.	.	H	α-helix	trans	-81.4	-42.3	-175.8	179.6	58.9	-179.4	172.4	0	113.3	W110 D145 W146 E147	W110-K149 HydrophobicContact CH2-CB 3.79Å; W110-K149 HydrophobicContact CH2-CD 4.21Å; W110-K149 HydrophobicContact CH2-CG 3.79Å; W110-K149 HydrophobicContact CZ3-CB 3.83Å; W110-K149 HydrophobicContact CZ3-CG 3.84Å; D145-K149 VanDerWaalsContact O-CB 3.27Å; D145-K149 WeakPolarHBondContact O-CB 3.42Å; D145-K149 PolarHBondContact O-N 3.41Å; W146-K149 PolarHBondContact O-N 3.4Å; E147-K149 PolarHBondContact O-N 2.89Å
150	Y	94.7	Very high	94	Very high	72 Å²	72	60.9 Å²	60.9	28%	0.282	34%	0.338	S	S	.	.	H	α-helix	trans	-112.3	-16.8	-168.3	-58	-65.1	0	0	0	113.2	W110 W146 W154 K157 R158	W110-Y150 HydrophobicContact CZ3-CE2 4.45Å; W146-Y150 HydrophobicContact CB-CD2 4.37Å; W146-Y150 WeakPolarHBondContact O-CB 3.33Å; W146-Y150 PolarHBondContact O-N 3.32Å; Y150-W154 HydrophobicContact CD2-CB 4.26Å; Y150-W154 HydrophobicContact CG-CB 4.39Å; Y150-K157 WeakPolarHBondContact O-CD 3.49Å; Y150-K157 PolarHBondContact O-NZ 2.87Å; Y150-R158 HydrophobicContact CD2-CG 4.49Å; Y150-R158 HydrophobicContact CE2-CG 4.33Å
151	G	95.4	Very high	93.9	Very high	28 Å²	28	65.8 Å²	65.8	29%	0.289	36%	0.362	S	S	.	.			trans	90.3	-170.6	-175	0	0	0	0	0	113.1	E147 D153 W154	E147-G151 WeakPolarHBondContact O-CA 3.28Å; E147-G151 PolarHBondContact O-N 3.42Å; G151-D153 PolarHBondContact O-N 3.26Å; G151-W154 WeakPolarHBondContact O-CB 3.48Å; G151-W154 PolarHBondContact O-N 2.82Å; G151-W154 VanDerWaalsContact O-N 3.16Å
152	A	94.5	Very high	93.6	Very high	99 Å²	99	71.7 Å²	71.7	82%	0.818	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-25.9	-178.2	0	0	0	0	0	113.4	W154	A152-W154 VanDerWaalsContact C-N 3.27Å; A152-W154 PolarHBondContact O-N 3.08Å
153	D	94.4	Very high	93.4	Very high	70 Å²	70	79.4 Å²	79.4	37%	0.374	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	22.2	177	66	-33.1	0	0	0	112.8	G151 A155 L156 K157	G151-D153 PolarHBondContact O-N 3.26Å; D153-A155 PolarHBondContact O-N 3.14Å; D153-L156 PolarHBondContact O-N 2.82Å; D153-K157 PolarHBondContact O-N 2.84Å; D153-K157 IonicContact OD1-NZ 2.78Å; D153-K157 PolarHBondContact OD1-NZ 2.91Å; D153-K157 WeakPolarHBondContact OD2-CE 3.27Å; D153-K157 IonicContact OD2-NZ 3.52Å; D153-K157 PolarHBondContact OD2-NZ 2.99Å
154	W	94.6	Very high	93.2	Very high	30 Å²	30	84.6 Å²	84.6	11%	0.114	44%	0.435	C	S	.	.	H	α-helix	trans	-52.5	-40.1	-179.4	66.6	-95.2	0	0	0	112.4	P37 L143 W146 Y150 G151 A152 K157 R158	P37-W154 HydrophobicContact CB-CH2 4.24Å; P37-W154 HydrophobicContact CB-CZ2 3.69Å; P37-W154 HydrophobicContact CG-CZ2 4.25Å; L143-W154 HydrophobicContact CD1-CZ2 3.94Å; W146-W154 HydrophobicContact CB-CB 4.15Å; W146-W154 HydrophobicContact CB-CD2 4.05Å; W146-W154 HydrophobicContact CB-CE3 4.18Å; W146-W154 HydrophobicContact CB-CG 4.04Å; W146-W154 HydrophobicContact CD2-CE3 4.11Å; W146-W154 HydrophobicContact CD2-CZ3 4.29Å; W146-W154 HydrophobicContact CE3-CD2 4.09Å; W146-W154 AromaticContact CE3-CE3 3.39Å; W146-W154 HydrophobicContact CE3-CE3 3.39Å; W146-W154 AromaticContact CE3-CH2 3.74Å; W146-W154 HydrophobicContact CE3-CH2 3.74Å; W146-W154 HydrophobicContact CE3-CZ2 4.36Å; W146-W154 AromaticContact CE3-CZ3 3.2Å; W146-W154 HydrophobicContact CE3-CZ3 3.2Å; W146-W154 HydrophobicContact CG-CE3 4.47Å; W146-W154 HydrophobicContact CZ3-CE3 4.03Å; W146-W154 AromaticContact CZ3-CH2 3.82Å; W146-W154 HydrophobicContact CZ3-CH2 3.82Å; W146-W154 AromaticContact CZ3-CZ3 3.37Å; W146-W154 HydrophobicContact CZ3-CZ3 3.37Å; Y150-W154 HydrophobicContact CD2-CB 4.26Å; Y150-W154 HydrophobicContact CG-CB 4.39Å; G151-W154 WeakPolarHBondContact O-CB 3.48Å; G151-W154 PolarHBondContact O-N 2.82Å; G151-W154 VanDerWaalsContact O-N 3.16Å; A152-W154 VanDerWaalsContact C-N 3.27Å; A152-W154 PolarHBondContact O-N 3.08Å; W154-K157 PolarHBondContact O-N 3.44Å; W154-R158 WeakPolarHBondContact O-CB 3.38Å; W154-R158 WeakPolarHBondContact O-CG 3.24Å; W154-R158 PolarHBondContact O-N 3.46Å
155	A	93.1	Very high	92.9	Very high	51 Å²	51	83.3 Å²	83.3	42%	0.421	42%	0.419	S	S	.	.	H	α-helix	trans	-63.9	-45.8	-177.5	0	0	0	0	0	111.2	D153 R158 C159	D153-A155 PolarHBondContact O-N 3.14Å; A155-R158 PolarHBondContact O-N 2.9Å; A155-C159 VanDerWaalsContact O-CB 3.32Å; A155-C159 WeakPolarHBondContact O-CB 3.46Å; A155-C159 PolarHBondContact O-N 3.12Å
156	L	94.2	Very high	92.5	Very high	105 Å²	105	83.2 Å²	83.2	55%	0.55	42%	0.419	S	S	.	.	H	α-helix	trans	-63.6	-45.2	175.9	178.7	61	0	0	0	111.1	D153 R158 C159 L160	D153-L156 PolarHBondContact O-N 2.82Å; L156-R158 VanDerWaalsContact C-N 3.34Å; L156-R158 PolarHBondContact O-N 2.92Å; L156-C159 WeakPolarHBondContact O-CB 3.25Å; L156-C159 PolarHBondContact O-N 3.01Å; L156-L160 HydrophobicContact CD1-CD1 4.27Å; L156-L160 HydrophobicContact CD1-CG 4.2Å; L156-L160 HydrophobicContact CG-CD1 4.15Å; L156-L160 HydrophobicContact CG-CG 4.48Å; L156-L160 WeakPolarHBondContact O-CB 3.47Å; L156-L160 VanDerWaalsContact O-CG 3.32Å; L156-L160 WeakPolarHBondContact O-CG 3.41Å; L156-L160 PolarHBondContact O-N 3.4Å
157	K	94.6	Very high	92.1	Very high	90 Å²	90	85.7 Å²	85.7	39%	0.391	45%	0.445	S	S	.	.	H	α-helix	trans	-60.2	-41.9	178	-78	170.1	168.9	146.1	0	112.5	Y150 D153 W154 H161	Y150-K157 WeakPolarHBondContact O-CD 3.49Å; Y150-K157 PolarHBondContact O-NZ 2.87Å; D153-K157 PolarHBondContact O-N 2.84Å; D153-K157 IonicContact OD1-NZ 2.78Å; D153-K157 PolarHBondContact OD1-NZ 2.91Å; D153-K157 WeakPolarHBondContact OD2-CE 3.27Å; D153-K157 IonicContact OD2-NZ 3.52Å; D153-K157 PolarHBondContact OD2-NZ 2.99Å; W154-K157 PolarHBondContact O-N 3.44Å; K157-H161 WeakPolarHBondContact O-CB 3.43Å; K157-H161 PolarHBondContact O-N 2.79Å
158	R	92.1	Very high	91.6	Very high	27 Å²	27	91.3 Å²	91.3	10%	0.102	46%	0.463	C	S	.	.	H	α-helix	trans	-68.2	-42.7	175.4	-69.7	-165	77.8	104.3	15.3	111.8	W110 E114 W146 Y150 W154 A155 L156 L160 H161 W162	W110-R158 PolarHBondContact O-NH1 2.97Å; E114-R158 VanDerWaalsContact CD-NH2 3.34Å; E114-R158 IonicContact OE1-CZ 2.69Å; E114-R158 IonicContact OE1-NE 2.9Å; E114-R158 IonicContact OE1-NH2 3.32Å; E114-R158 PolarHBondContact OE1-NH2 3.31Å; W146-R158 VanDerWaalsContact CE2-NH1 3.3Å; Y150-R158 HydrophobicContact CD2-CG 4.49Å; Y150-R158 HydrophobicContact CE2-CG 4.33Å; W154-R158 WeakPolarHBondContact O-CB 3.38Å; W154-R158 WeakPolarHBondContact O-CG 3.24Å; W154-R158 PolarHBondContact O-N 3.46Å; A155-R158 PolarHBondContact O-N 2.9Å; L156-R158 VanDerWaalsContact C-N 3.34Å; L156-R158 PolarHBondContact O-N 2.92Å; R158-L160 VanDerWaalsContact C-N 3.34Å; R158-L160 PolarHBondContact O-N 3.47Å; R158-H161 WeakPolarHBondContact O-CB 3.49Å; R158-H161 PolarHBondContact O-N 2.86Å; R158-H161 VanDerWaalsContact O-N 3.12Å; R158-W162 PolarHBondContact O-N 3.03Å
159	C	91.7	Very high	91	Very high	70 Å²	70	89.2 Å²	89.2	47%	0.473	44%	0.444	S	S	.	.	H	α-helix	trans	-56.9	-47.3	174.5	-179.5	0	0	0	0	111.5	A155 L156 H161 W162 Y163	A155-C159 VanDerWaalsContact O-CB 3.32Å; A155-C159 WeakPolarHBondContact O-CB 3.46Å; A155-C159 PolarHBondContact O-N 3.12Å; L156-C159 WeakPolarHBondContact O-CB 3.25Å; L156-C159 PolarHBondContact O-N 3.01Å; C159-H161 VanDerWaalsContact C-N 3.31Å; C159-H161 PolarHBondContact O-N 2.74Å; C159-W162 PolarHBondContact O-N 3.28Å; C159-Y163 WeakPolarHBondContact O-CB 3.25Å; C159-Y163 PolarHBondContact O-N 2.79Å
160	L	94.5	Very high	90.4	Very high	81 Å²	81	90.3 Å²	90.3	42%	0.424	45%	0.445	S	S	.	.	H	α-helix	trans	-64.8	-34	176.2	-68.9	174.2	0	0	0	112.8	L156 R158 K164	L156-L160 HydrophobicContact CD1-CD1 4.27Å; L156-L160 HydrophobicContact CD1-CG 4.2Å; L156-L160 HydrophobicContact CG-CD1 4.15Å; L156-L160 HydrophobicContact CG-CG 4.48Å; L156-L160 WeakPolarHBondContact O-CB 3.47Å; L156-L160 VanDerWaalsContact O-CG 3.32Å; L156-L160 WeakPolarHBondContact O-CG 3.41Å; L156-L160 PolarHBondContact O-N 3.4Å; R158-L160 VanDerWaalsContact C-N 3.34Å; R158-L160 PolarHBondContact O-N 3.47Å; L160-K164 WeakPolarHBondContact O-CB 3.4Å; L160-K164 VanDerWaalsContact O-CG 3.25Å; L160-K164 WeakPolarHBondContact O-CG 3.19Å; L160-K164 PolarHBondContact O-N 3.49Å; L160-K164 VanDerWaalsContact O-N 3.08Å
161	H	91.7	Very high	89.9	Confident	113 Å²	113	90.8 Å²	90.8	52%	0.523	45%	0.453	S	S	.	.	H	α-helix	trans	-65.8	-48.2	174	179.7	-90.8	0	0	0	111.2	K157 R158 C159 K164 Q165	K157-H161 WeakPolarHBondContact O-CB 3.43Å; K157-H161 PolarHBondContact O-N 2.79Å; R158-H161 WeakPolarHBondContact O-CB 3.49Å; R158-H161 PolarHBondContact O-N 2.86Å; R158-H161 VanDerWaalsContact O-N 3.12Å; C159-H161 VanDerWaalsContact C-N 3.31Å; C159-H161 PolarHBondContact O-N 2.74Å; H161-K164 PolarHBondContact O-N 3.07Å; H161-Q165 WeakPolarHBondContact O-CB 3.33Å; H161-Q165 PolarHBondContact O-N 3.14Å
162	W	88.6	Confident	89.5	Confident	141 Å²	141	90.8 Å²	90.8	53%	0.534	44%	0.444	S	S	.	.	H	α-helix	trans	-57.8	-48.7	175	174.7	80.3	0	0	0	111.3	R158 C159 K164 Q165 D166	R158-W162 PolarHBondContact O-N 3.03Å; C159-W162 PolarHBondContact O-N 3.28Å; W162-K164 VanDerWaalsContact C-N 3.32Å; W162-K164 PolarHBondContact O-N 3.24Å; W162-Q165 PolarHBondContact O-N 3.1Å; W162-D166 WeakPolarHBondContact O-CB 3.34Å; W162-D166 PolarHBondContact O-N 3.33Å
163	Y	89.4	Confident	88.9	Confident	163 Å²	163	93.3 Å²	93.3	64%	0.639	43%	0.433	S	S	*	.	H	α-helix	trans	-55.2	-45.1	176.5	175.3	-100.5	0	0	0	112.6	C159 Q165 G167	C159-Y163 WeakPolarHBondContact O-CB 3.25Å; C159-Y163 PolarHBondContact O-N 2.79Å; Y163-Q165 VanDerWaalsContact C-N 3.33Å; Y163-Q165 PolarHBondContact O-N 3.47Å; Y163-G167 PolarHBondContact O-N 2.97Å
164	K	91	Very high	88.4	Confident	137 Å²	137	96.1 Å²	96.1	60%	0.596	45%	0.446	S	S	*	.	H	α-helix	trans	-66.7	-33.6	177	-73.9	171.6	-177	177.4	0	112.9	L160 H161 W162 R168	L160-K164 WeakPolarHBondContact O-CB 3.4Å; L160-K164 VanDerWaalsContact O-CG 3.25Å; L160-K164 WeakPolarHBondContact O-CG 3.19Å; L160-K164 PolarHBondContact O-N 3.49Å; L160-K164 VanDerWaalsContact O-N 3.08Å; H161-K164 PolarHBondContact O-N 3.07Å; W162-K164 VanDerWaalsContact C-N 3.32Å; W162-K164 PolarHBondContact O-N 3.24Å; K164-R168 WeakPolarHBondContact O-CG 3.26Å
165	Q	86.5	Confident	88.1	Confident	64 Å²	64	96.3 Å²	96.3	30%	0.299	45%	0.449	S	S	.	.	H	α-helix	trans	-74.2	-44.5	177.7	-174.9	170.1	10	0	0	110.9	H161 W162 Y163 G167 R168	H161-Q165 WeakPolarHBondContact O-CB 3.33Å; H161-Q165 PolarHBondContact O-N 3.14Å; W162-Q165 PolarHBondContact O-N 3.1Å; Y163-Q165 VanDerWaalsContact C-N 3.33Å; Y163-Q165 PolarHBondContact O-N 3.47Å; Q165-G167 VanDerWaalsContact C-N 3.34Å; Q165-G167 PolarHBondContact O-N 3.03Å; Q165-R168 WeakPolarHBondContact O-CB 3.48Å; Q165-R168 PolarHBondContact O-N 3.43Å; Q165-R168 VanDerWaalsContact O-N 3.1Å
166	D	84	Confident	87.9	Confident	32 Å²	32	95.5 Å²	95.5	17%	0.171	44%	0.437	C	S	.	.	H	α-helix	trans	-61.7	-40.8	177.1	-167.8	74	0	0	0	111.7	W162 R168 W169 R261	W162-D166 WeakPolarHBondContact O-CB 3.34Å; W162-D166 PolarHBondContact O-N 3.33Å; D166-R168 PolarHBondContact O-N 2.8Å; D166-R168 VanDerWaalsContact O-N 3.14Å; D166-W169 WeakPolarHBondContact O-CB 3.21Å; D166-W169 PolarHBondContact O-N 3.28Å; D166-R261 PolarHBondContact O-NH2 2.88Å; D166-R261 IonicContact OD1-CZ 3.68Å; D166-R261 VanDerWaalsContact OD1-CZ 3.22Å; D166-R261 IonicContact OD1-NE 3.43Å; D166-R261 PolarHBondContact OD1-NE 3.05Å; D166-R261 IonicContact OD1-NH2 3.16Å; D166-R261 PolarHBondContact OD1-NH2 2.83Å; D166-R261 VanDerWaalsContact OD1-NH2 3.07Å; D166-R261 IonicContact OD2-CZ 3.49Å; D166-R261 IonicContact OD2-NE 2.76Å; D166-R261 IonicContact OD2-NH2 3.26Å; D166-R261 PolarHBondContact OD2-NH2 3.23Å
167	G	84.4	Confident	87.6	Confident	56 Å²	56	94.5 Å²	94.5	58%	0.577	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-12.2	175.1	0	0	0	0	0	115.1	Y163 Q165	Y163-G167 PolarHBondContact O-N 2.97Å; Q165-G167 VanDerWaalsContact C-N 3.34Å; Q165-G167 PolarHBondContact O-N 3.03Å
168	R	85.4	Confident	87.4	Confident	210 Å²	210	95 Å²	95	79%	0.792	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-15.6	171.3	-65.5	171.4	-174.8	-179	0.7	112.5	K164 Q165 D166	K164-R168 WeakPolarHBondContact O-CG 3.26Å; Q165-R168 WeakPolarHBondContact O-CB 3.48Å; Q165-R168 PolarHBondContact O-N 3.43Å; Q165-R168 VanDerWaalsContact O-N 3.1Å; D166-R168 PolarHBondContact O-N 2.8Å; D166-R168 VanDerWaalsContact O-N 3.14Å
169	W	82.1	Confident	87.3	Confident	109 Å²	109	95.5 Å²	95.5	41%	0.413	45%	0.449	S	S	.	.	S	Bend	trans	-81.3	165.5	179.5	-66.5	4.3	0	0	0	110.4	D166 N171	D166-W169 WeakPolarHBondContact O-CB 3.21Å; D166-W169 PolarHBondContact O-N 3.28Å; W169-N171 PolarHBondContact O-N 2.82Å
170	R	82	Confident	87.5	Confident	148 Å²	148	92.9 Å²	92.9	56%	0.558	43%	0.431	S	S	*	.			trans	-56.9	132.6	174.5	178.5	176.7	171.2	143.5	1.6	109.4	F172 D175 W224 R261	R170-F172 PolarHBondContact O-N 3.09Å; R170-F172 VanDerWaalsContact O-N 3.11Å; R170-D175 IonicContact CZ-OD1 2.71Å; R170-D175 IonicContact NE-OD2 3.55Å; R170-D175 IonicContact NH2-OD1 2.89Å; R170-D175 PolarHBondContact NH2-OD1 3.39Å; R170-D175 IonicContact NH2-OD2 2.77Å; R170-W224 VanDerWaalsContact NH2-CZ2 3.29Å; R170-R261 PolarHBondContact O-NH1 2.83Å
171	N	84.6	Confident	87.4	Confident	83 Å²	83	92.9 Å²	92.9	44%	0.444	44%	0.437	S	S	.	.			trans	-60.2	108.7	169.7	-80.6	-12.9	0	0	0	110	W169 W173	W169-N171 PolarHBondContact O-N 2.82Å; N171-W173 VanDerWaalsContact CG-NE1 3.32Å; N171-W173 PolarHBondContact ND2-NE1 2.74Å
172	F	86.2	Confident	87.5	Confident	27 Å²	27	89 Å²	89	12%	0.118	42%	0.421	C	S	.	.	S	Bend	trans	-80.3	-22.4	-179.1	68.4	-88.8	0	0	0	112.7	R170 M174 D175 L176 A227 P259 R261	R170-F172 PolarHBondContact O-N 3.09Å; R170-F172 VanDerWaalsContact O-N 3.11Å; F172-M174 PolarHBondContact O-N 2.88Å; F172-D175 WeakPolarHBondContact O-CB 3.47Å; F172-D175 PolarHBondContact O-N 3.26Å; F172-L176 HydrophobicContact CD2-CD1 4.32Å; F172-L176 HydrophobicContact CD2-CD2 4.41Å; F172-L176 HydrophobicContact CE2-CD1 4.33Å; F172-A227 HydrophobicContact CB-CB 3.92Å; F172-A227 HydrophobicContact CD2-CB 3.41Å; F172-A227 VanDerWaalsContact CD2-CB 3.41Å; F172-A227 HydrophobicContact CE2-CB 4.23Å; F172-A227 HydrophobicContact CG-CB 3.99Å; F172-P259 HydrophobicContact CE2-CB 3.95Å; F172-P259 HydrophobicContact CE2-CG 4.44Å; F172-R261 HydrophobicContact CD1-CB 3.86Å; F172-R261 HydrophobicContact CD1-CG 4.02Å; F172-R261 HydrophobicContact CE1-CB 3.74Å; F172-R261 HydrophobicContact CE1-CG 4.38Å; F172-R261 HydrophobicContact CE2-CB 4.45Å; F172-R261 HydrophobicContact CG-CB 4.29Å; F172-R261 HydrophobicContact CG-CG 4.39Å; F172-R261 HydrophobicContact CZ-CB 4.05Å
173	W	82.1	Confident	87.8	Confident	152 Å²	152	83.1 Å²	83.1	58%	0.576	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-61.1	-27.8	-178.2	65.4	-78.9	0	0	0	113.7	N171 D175 L176	N171-W173 VanDerWaalsContact CG-NE1 3.32Å; N171-W173 PolarHBondContact ND2-NE1 2.74Å; W173-D175 PolarHBondContact O-N 2.88Å; W173-L176 HydrophobicContact CB-CD1 4.17Å; W173-L176 PolarHBondContact O-N 3.1Å
174	M	84.5	Confident	88.1	Confident	130 Å²	130	80.7 Å²	80.7	64%	0.64	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-67.6	-20.2	174.6	-64.1	-63.3	-63.6	0	0	113.5	F172	F172-M174 PolarHBondContact O-N 2.88Å
175	D	87.9	Confident	88.3	Confident	33 Å²	33	78.9 Å²	78.9	18%	0.176	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-96.3	-1.8	-178.1	-55.4	-52.6	0	0	0	112.1	R170 F172 W173 T223 W224 T225	R170-D175 IonicContact CZ-OD1 2.71Å; R170-D175 IonicContact NE-OD2 3.55Å; R170-D175 IonicContact NH2-OD1 2.89Å; R170-D175 PolarHBondContact NH2-OD1 3.39Å; R170-D175 IonicContact NH2-OD2 2.77Å; F172-D175 WeakPolarHBondContact O-CB 3.47Å; F172-D175 PolarHBondContact O-N 3.26Å; W173-D175 PolarHBondContact O-N 2.88Å; D175-T223 HydrophobicContact CB-CG2 4.39Å; D175-T223 WeakPolarHBondContact O-CG2 3.33Å; D175-W224 PolarHBondContact OD1-NE1 3.34Å; D175-T225 WeakPolarHBondContact OD2-CG2 3.34Å; D175-T225 PolarHBondContact OD2-OG1 3.4Å
176	L	88.6	Confident	88.7	Confident	34 Å²	34	75.9 Å²	75.9	18%	0.178	38%	0.379	C	S	.	.	S	Bend	trans	-81.3	148.8	-174.1	-63.7	174.4	0	0	0	112.6	F172 W173 T223 A227 Q228 P259	F172-L176 HydrophobicContact CD2-CD1 4.32Å; F172-L176 HydrophobicContact CD2-CD2 4.41Å; F172-L176 HydrophobicContact CE2-CD1 4.33Å; W173-L176 HydrophobicContact CB-CD1 4.17Å; W173-L176 PolarHBondContact O-N 3.1Å; L176-T223 HydrophobicContact CD2-CG2 3.84Å; L176-A227 HydrophobicContact CD2-CB 3.81Å; L176-Q228 WeakPolarHBondContact CD2-O 3.44Å; L176-P259 HydrophobicContact CD1-CB 3.21Å; L176-P259 HydrophobicContact CD1-CG 4.13Å
177	E	87.5	Confident	89.1	Confident	85 Å²	85	78 Å²	78	40%	0.397	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-75.7	140.9	169	-63.2	-167	175.9	0	0	111.4	R192	E177-R192 IonicContact OE2-CZ 2.71Å; E177-R192 IonicContact OE2-NE 2.8Å; E177-R192 PolarHBondContact OE2-NE 3.11Å; E177-R192 IonicContact OE2-NH2 3.33Å; E177-R192 PolarHBondContact OE2-NH2 2.91Å
178	P	89.7	Confident	89.5	Confident	101 Å²	101	83.8 Å²	83.8	66%	0.656	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-71.5	144.1	178.9	29.5	-34.6	0	0	0	111.7	R192	P178-R192 PolarHBondContact O-NH2 3.27Å; P178-R192 VanDerWaalsContact O-NH2 3.13Å
179	C	91.5	Very high	89.9	Confident	37 Å²	37	76 Å²	76	25%	0.25	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-66.3	138.6	174.6	-68	0	0	0	0	111.8	C231 L239	C179-C231 WeakPolarHBondContact CA-SG 3.46Å; C179-C231 HydrophobicContact CB-CB 3.67Å; C179-C231 WeakPolarHBondContact CB-SG 3.25Å; C179-C231 WeakPolarHBondContact SG-CB 3.46Å; C179-C231 CovalentContact SG-SG 2.02Å; C179-C231 PolarHBondContact SG-SG 3.39Å; C179-L239 HydrophobicContact CB-CD1 3.69Å; C179-L239 HydrophobicContact CB-CD2 3.59Å; C179-L239 HydrophobicContact CB-CG 4.31Å
180	P	94.2	Very high	90.2	Very high	14 Å²	14	77.4 Å²	77.4	9%	0.091	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-60.6	144.4	166.2	-21.7	33.5	0	0	0	110.7	T182 Q185 A186 F193 Y233	P180-T182 VanDerWaalsContact C-N 3.32Å; P180-T182 PolarHBondContact O-N 3.36Å; P180-Q185 HydrophobicContact CB-CB 3.72Å; P180-A186 HydrophobicContact CB-CB 4.14Å; P180-A186 HydrophobicContact CG-CB 3.98Å; P180-F193 HydrophobicContact CG-CD2 3.89Å; P180-F193 HydrophobicContact CG-CE2 3.54Å; P180-F193 HydrophobicContact CG-CZ 4.1Å; P180-Y233 WeakPolarHBondContact CD-OH 3.21Å; P180-Y233 WeakPolarHBondContact O-CE1 3.49Å; P180-Y233 PolarHBondContact O-OH 2.66Å
181	C	92.7	Very high	90.6	Very high	82 Å²	82	72.8 Å²	72.8	55%	0.554	39%	0.386	S	S	*	.	S	Bend	trans	-70.3	-29.8	-173.2	-60.7	0	0	0	0	112.7	Q185 L239	C181-Q185 VanDerWaalsContact N-OE1 3.08Å; C181-L239 WeakPolarHBondContact O-CB 3.39Å; C181-L239 PolarHBondContact O-N 2.79Å
182	T	95.4	Very high	90.8	Very high	31 Å²	31	72.8 Å²	72.8	19%	0.19	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-126.5	154	179.3	69.8	0	0	0	0	111.8	P180 D184 Q185 A186 G237 W238	P180-T182 VanDerWaalsContact C-N 3.32Å; P180-T182 PolarHBondContact O-N 3.36Å; T182-D184 VanDerWaalsContact C-N 3.27Å; T182-D184 PolarHBondContact O-N 3.28Å; T182-Q185 WeakPolarHBondContact O-CB 3.34Å; T182-Q185 PolarHBondContact O-N 2.9Å; T182-Q185 VanDerWaalsContact O-N 3.13Å; T182-Q185 WeakPolarHBondContact OG1-CG 3.47Å; T182-Q185 PolarHBondContact OG1-N 3.28Å; T182-A186 PolarHBondContact O-N 2.79Å; T182-A186 VanDerWaalsContact O-N 3.13Å; T182-G237 CarbonylContact C-O 3.54Å; T182-G237 VanDerWaalsContact CA-O 3.31Å; T182-G237 WeakPolarHBondContact CA-O 3.3Å; T182-W238 HydrophobicContact CG2-CE3 4.07Å; T182-W238 HydrophobicContact CG2-CZ3 3.87Å
183	L	93.8	Very high	91.2	Very high	18 Å²	18	71.7 Å²	71.7	9%	0.094	38%	0.375	C	S	.	.	H	α-helix	trans	-57.6	-41.2	177	176.3	55.3	0	0	0	111.7	Q185 A186 I187 M201 H215 Y233 G237	L183-Q185 VanDerWaalsContact C-N 3.31Å; L183-Q185 PolarHBondContact O-N 3.43Å; L183-A186 WeakPolarHBondContact O-CB 3.48Å; L183-A186 PolarHBondContact O-N 3.45Å; L183-A186 VanDerWaalsContact O-N 3.12Å; L183-I187 HydrophobicContact CD1-CD1 3.77Å; L183-I187 HydrophobicContact CD1-CG1 4.01Å; L183-I187 HydrophobicContact CG-CD1 3.83Å; L183-I187 HydrophobicContact CG-CG1 4.48Å; L183-I187 WeakPolarHBondContact O-CG1 3.4Å; L183-I187 PolarHBondContact O-N 3.07Å; L183-M201 HydrophobicContact CD1-CE 3.76Å; L183-M201 HydrophobicContact CD2-CE 3.44Å; L183-M201 VanDerWaalsContact CD2-CE 3.44Å; L183-M201 HydrophobicContact CG-CE 3.93Å; L183-H215 HydrophobicContact CD1-CB 3.91Å; L183-H215 VanDerWaalsContact CD1-CD2 3.47Å; L183-H215 WeakPolarHBondContact CD1-CD2 3.2Å; L183-H215 HydrophobicContact CD2-CB 4.34Å; L183-Y233 HydrophobicContact CB-CD1 3.9Å; L183-Y233 HydrophobicContact CB-CD2 4.23Å; L183-Y233 HydrophobicContact CB-CG 3.72Å; L183-Y233 HydrophobicContact CD1-CD2 3.7Å; L183-Y233 HydrophobicContact CD1-CE2 4.33Å; L183-Y233 HydrophobicContact CD1-CG 4.01Å; L183-Y233 HydrophobicContact CG-CG 4.38Å; L183-Y233 VanDerWaalsContact N-CD1 3.31Å; L183-G237 PolarHBondContact N-O 3.07Å
184	D	95.7	Very high	91.6	Very high	111 Å²	111	66.9 Å²	66.9	59%	0.594	36%	0.359	S	S	*	.	H	α-helix	trans	-57.6	-44.4	176.2	-72.1	-23	0	0	0	111.7	T182 A186 I187 F188	T182-D184 VanDerWaalsContact C-N 3.27Å; T182-D184 PolarHBondContact O-N 3.28Å; D184-A186 VanDerWaalsContact C-N 3.32Å; D184-A186 PolarHBondContact O-N 2.95Å; D184-I187 PolarHBondContact O-N 2.68Å; D184-F188 WeakPolarHBondContact O-CD2 3.46Å; D184-F188 PolarHBondContact O-N 2.85Å
185	Q	95.8	Very high	91.9	Very high	99 Å²	99	63.4 Å²	63.4	46%	0.463	35%	0.346	S	S	.	.	H	α-helix	trans	-62.8	-41.7	177.2	-69.7	172.8	-10.9	0	0	111.3	P180 C181 T182 L183 F188 D189	P180-Q185 HydrophobicContact CB-CB 3.72Å; C181-Q185 VanDerWaalsContact N-OE1 3.08Å; T182-Q185 WeakPolarHBondContact O-CB 3.34Å; T182-Q185 PolarHBondContact O-N 2.9Å; T182-Q185 VanDerWaalsContact O-N 3.13Å; T182-Q185 WeakPolarHBondContact OG1-CG 3.47Å; T182-Q185 PolarHBondContact OG1-N 3.28Å; L183-Q185 VanDerWaalsContact C-N 3.31Å; L183-Q185 PolarHBondContact O-N 3.43Å; Q185-F188 PolarHBondContact O-N 3.32Å; Q185-D189 WeakPolarHBondContact O-CB 3.32Å; Q185-D189 PolarHBondContact O-N 2.96Å
186	A	94.1	Very high	92.1	Very high	2 Å²	2	62.6 Å²	62.6	2%	0.017	34%	0.341	C	S	.	.	H	α-helix	trans	-63.8	-41.4	178.4	0	0	0	0	0	113.1	P180 T182 L183 D184 F188 D189 V217 Y233	P180-A186 HydrophobicContact CB-CB 4.14Å; P180-A186 HydrophobicContact CG-CB 3.98Å; T182-A186 PolarHBondContact O-N 2.79Å; T182-A186 VanDerWaalsContact O-N 3.13Å; L183-A186 WeakPolarHBondContact O-CB 3.48Å; L183-A186 PolarHBondContact O-N 3.45Å; L183-A186 VanDerWaalsContact O-N 3.12Å; D184-A186 VanDerWaalsContact C-N 3.32Å; D184-A186 PolarHBondContact O-N 2.95Å; A186-F188 VanDerWaalsContact C-N 3.35Å; A186-D189 PolarHBondContact O-N 2.75Å; A186-V217 HydrophobicContact CB-CG1 4.02Å; A186-V217 HydrophobicContact CB-CG2 3.97Å; A186-Y233 HydrophobicContact CB-CE2 3.73Å; A186-Y233 WeakPolarHBondContact CB-OH 3.39Å
187	I	92	Very high	91.8	Very high	76 Å²	76	66 Å²	66	39%	0.39	36%	0.359	S	S	.	.	H	α-helix	trans	-68.4	-35.7	177.8	-66.8	168.7	0	0	0	111.2	L183 D184 I190 M201	L183-I187 HydrophobicContact CD1-CD1 3.77Å; L183-I187 HydrophobicContact CD1-CG1 4.01Å; L183-I187 HydrophobicContact CG-CD1 3.83Å; L183-I187 HydrophobicContact CG-CG1 4.48Å; L183-I187 WeakPolarHBondContact O-CG1 3.4Å; L183-I187 PolarHBondContact O-N 3.07Å; D184-I187 PolarHBondContact O-N 2.68Å; I187-I190 WeakPolarHBondContact O-CG2 3.5Å; I187-M201 HydrophobicContact CD1-CE 3.74Å
188	F	94.2	Very high	91.4	Very high	177 Å²	177	67 Å²	67	78%	0.776	36%	0.363	S	S	*	.	H	α-helix	trans	-74.2	-24.2	175.3	-79.6	-63.6	0	0	0	113.5	D184 Q185 A186 I190	D184-F188 WeakPolarHBondContact O-CD2 3.46Å; D184-F188 PolarHBondContact O-N 2.85Å; Q185-F188 PolarHBondContact O-N 3.32Å; A186-F188 VanDerWaalsContact C-N 3.35Å; F188-I190 VanDerWaalsContact C-N 3.27Å; F188-I190 PolarHBondContact O-N 3.27Å; F188-I190 VanDerWaalsContact O-N 3.14Å
189	D	93.9	Very high	91.3	Very high	46 Å²	46	62.1 Å²	62.1	25%	0.246	33%	0.332	C	S	.	.			trans	-88.4	52.4	-179.7	-164.7	-0.1	0	0	0	112.8	Q185 A186 G191 R192 F193	Q185-D189 WeakPolarHBondContact O-CB 3.32Å; Q185-D189 PolarHBondContact O-N 2.96Å; A186-D189 PolarHBondContact O-N 2.75Å; D189-G191 PolarHBondContact O-N 3.09Å; D189-R192 PolarHBondContact O-N 2.94Å; D189-R192 VanDerWaalsContact O-N 3.15Å; D189-R192 WeakPolarHBondContact OD1-CB 3.32Å; D189-R192 VanDerWaalsContact OD2-CD 3.29Å; D189-R192 WeakPolarHBondContact OD2-CD 3.37Å; D189-R192 IonicContact OD2-CZ 3.57Å; D189-R192 IonicContact OD2-NE 3.09Å; D189-R192 IonicContact OD2-NH1 3.63Å; D189-R192 PolarHBondContact OD2-NH1 3.37Å; D189-F193 HydrophobicContact CB-CD2 4.09Å; D189-F193 PolarHBondContact O-N 3.17Å
190	I	87.7	Confident	91.2	Very high	139 Å²	139	62.2 Å²	62.2	71%	0.713	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-13.5	-177.4	63.1	172.3	0	0	0	114.6	I187 F188 F193	I187-I190 WeakPolarHBondContact O-CG2 3.5Å; F188-I190 VanDerWaalsContact C-N 3.27Å; F188-I190 PolarHBondContact O-N 3.27Å; F188-I190 VanDerWaalsContact O-N 3.14Å; I190-F193 CarbonylContact C-O 3.59Å; I190-F193 WeakPolarHBondContact CA-O 3.3Å
191	G	89.3	Confident	90.9	Very high	52 Å²	52	65.2 Å²	65.2	54%	0.536	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-39.3	176.8	0	0	0	0	0	111.6	D189 T220	D189-G191 PolarHBondContact O-N 3.09Å; G191-T220 PolarHBondContact O-OG1 2.97Å
192	R	90.1	Very high	90.6	Very high	82 Å²	82	68 Å²	68	31%	0.309	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-30.4	-178.4	-67.3	172.4	54.5	-138.2	-1.4	112.5	E177 P178 D189 S219 T220	E177-R192 IonicContact OE2-CZ 2.71Å; E177-R192 IonicContact OE2-NE 2.8Å; E177-R192 PolarHBondContact OE2-NE 3.11Å; E177-R192 IonicContact OE2-NH2 3.33Å; E177-R192 PolarHBondContact OE2-NH2 2.91Å; P178-R192 PolarHBondContact O-NH2 3.27Å; P178-R192 VanDerWaalsContact O-NH2 3.13Å; D189-R192 PolarHBondContact O-N 2.94Å; D189-R192 VanDerWaalsContact O-N 3.15Å; D189-R192 WeakPolarHBondContact OD1-CB 3.32Å; D189-R192 VanDerWaalsContact OD2-CD 3.29Å; D189-R192 WeakPolarHBondContact OD2-CD 3.37Å; D189-R192 IonicContact OD2-CZ 3.57Å; D189-R192 IonicContact OD2-NE 3.09Å; D189-R192 IonicContact OD2-NH1 3.63Å; D189-R192 PolarHBondContact OD2-NH1 3.37Å; R192-S219 CarbonylContact O-C 3.54Å; R192-S219 VanDerWaalsContact O-CA 3.26Å; R192-S219 WeakPolarHBondContact O-CA 3.41Å; R192-T220 PolarHBondContact O-N 3.35Å; R192-T220 PolarHBondContact O-OG1 3.33Å
193	F	93.4	Very high	89.7	Confident	5 Å²	5	69.2 Å²	69.2	2%	0.022	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	149.6	-173.8	-63.1	-79.3	0	0	0	113.2	P180 D189 I190 V217 M218 T220 T229	P180-F193 HydrophobicContact CG-CD2 3.89Å; P180-F193 HydrophobicContact CG-CE2 3.54Å; P180-F193 HydrophobicContact CG-CZ 4.1Å; D189-F193 HydrophobicContact CB-CD2 4.09Å; D189-F193 PolarHBondContact O-N 3.17Å; I190-F193 CarbonylContact C-O 3.59Å; I190-F193 WeakPolarHBondContact CA-O 3.3Å; F193-V217 HydrophobicContact CB-CB 4.06Å; F193-V217 HydrophobicContact CB-CG2 3.95Å; F193-V217 HydrophobicContact CD1-CB 4.38Å; F193-V217 HydrophobicContact CD1-CG2 3.6Å; F193-V217 HydrophobicContact CE1-CG2 4.4Å; F193-V217 HydrophobicContact CG-CG2 3.94Å; F193-M218 CarbonylContact C-O 3.56Å; F193-M218 VanDerWaalsContact CA-O 3.3Å; F193-M218 WeakPolarHBondContact CA-O 3.39Å; F193-T220 VanDerWaalsContact C-CG2 3.49Å; F193-T229 HydrophobicContact CE1-CG2 3.81Å
194	M	91.1	Very high	88.5	Confident	50 Å²	50	74.8 Å²	74.8	25%	0.246	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	158.1	171.6	58.9	169.9	-73.8	0	0	110	Y196 V217 M218 T220 F265	M194-Y196 PolarHBondContact O-N 3.37Å; M194-V217 CarbonylContact O-C 3.48Å; M194-V217 VanDerWaalsContact O-CA 3.24Å; M194-V217 WeakPolarHBondContact O-CA 3.12Å; M194-V217 WeakPolarHBondContact O-CB 3.37Å; M194-M218 HydrophobicContact CE-CE 3.36Å; M194-M218 HydrophobicContact CG-CE 4.04Å; M194-M218 HydrophobicContact CG-CG 3.88Å; M194-M218 PolarHBondContact N-O 3.17Å; M194-M218 PolarHBondContact O-N 2.72Å; M194-M218 HydrophobicContact SD-CE 3.8Å; M194-T220 HydrophobicContact CB-CG2 3.98Å; M194-T220 HydrophobicContact CG-CG2 4.07Å; M194-F265 HydrophobicContact CE-CE2 3.71Å; M194-F265 HydrophobicContact CE-CZ 3.45Å; M194-F265 VanDerWaalsContact CE-CZ 3.45Å; M194-F265 HydrophobicContact SD-CD2 4.49Å; M194-F265 HydrophobicContact SD-CE2 3.39Å; M194-F265 WeakPolarHBondContact SD-CE2 3.38Å; M194-F265 HydrophobicContact SD-CZ 3.57Å; M194-F265 VanDerWaalsContact SD-CZ 3.57Å
195	P	91.4	Very high	86.9	Confident	57 Å²	57	71.8 Å²	71.8	37%	0.37	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.7	134.3	175.9	-29.1	37.1	0	0	0	112.3	M218	P195-M218 WeakPolarHBondContact O-CE 3.16Å
196	Y	91	Very high	85.8	Confident	16 Å²	16	69.7 Å²	69.7	6%	0.063	40%	0.401	C	S	.	.			trans	-72.8	131.6	172.1	-175.7	-117.2	0	0	0	109.4	M194 E198 C199 H210 C216 M218 V230	M194-Y196 PolarHBondContact O-N 3.37Å; Y196-E198 HydrophobicContact CD1-CB 4.22Å; Y196-E198 HydrophobicContact CE1-CB 3.77Å; Y196-E198 HydrophobicContact CE1-CG 4.2Å; Y196-E198 PolarHBondContact O-N 2.88Å; Y196-E198 PolarHBondContact OH-OE2 3.42Å; Y196-C199 HydrophobicContact CD1-CB 4.16Å; Y196-C199 CarbonylContact O-C 3.58Å; Y196-C199 PolarHBondContact O-N 2.79Å; Y196-H210 AromaticContact CE1-CD2 3.82Å; Y196-H210 AromaticContact CE1-NE2 3.64Å; Y196-C216 WeakPolarHBondContact CB-O 3.44Å; Y196-C216 HydrophobicContact CD1-CB 4.27Å; Y196-C216 HydrophobicContact CG-CB 4.33Å; Y196-C216 PolarHBondContact N-O 3.2Å; Y196-M218 HydrophobicContact CD2-CB 4.1Å; Y196-M218 HydrophobicContact CD2-CG 4.25Å; Y196-M218 HydrophobicContact CD2-SD 3.82Å; Y196-M218 HydrophobicContact CE2-SD 4.4Å; Y196-V230 HydrophobicContact CD1-CG1 4.39Å; Y196-V230 HydrophobicContact CD2-CG1 4.1Å; Y196-V230 HydrophobicContact CD2-CG2 4.08Å; Y196-V230 HydrophobicContact CE2-CG1 4.48Å; Y196-V230 HydrophobicContact CE2-CG2 4.09Å; Y196-V230 HydrophobicContact CG-CG1 4.06Å
197	L	83.4	Confident	85.3	Confident	107 Å²	107	69.8 Å²	69.8	56%	0.56	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-22	-166.2	-65.6	178.5	0	0	0	114.8	R15 M218 T264	R15-L197 VanDerWaalsContact NH2-CD1 3.35Å; L197-M218 HydrophobicContact CG-CE 3.94Å; L197-T264 HydrophobicContact CD1-CG2 4.23Å
198	E	79.1	Confident	84.7	Confident	104 Å²	104	72.6 Å²	72.6	49%	0.486	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	0.1	-174.7	-52.9	-179	148.4	0	0	113.4	Y196	Y196-E198 HydrophobicContact CD1-CB 4.22Å; Y196-E198 HydrophobicContact CE1-CB 3.77Å; Y196-E198 HydrophobicContact CE1-CG 4.2Å; Y196-E198 PolarHBondContact O-N 2.88Å; Y196-E198 PolarHBondContact OH-OE2 3.42Å
199	C	88.3	Confident	83.9	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	40%	0.397	C	S	.	.			trans	-150.1	74.1	-179.6	-179.6	0	0	0	0	110	Y196 C207 C216	Y196-C199 HydrophobicContact CD1-CB 4.16Å; Y196-C199 CarbonylContact O-C 3.58Å; Y196-C199 PolarHBondContact O-N 2.79Å; C199-C207 VanDerWaalsContact CA-SG 3.51Å; C199-C207 HydrophobicContact CB-CB 3.8Å; C199-C207 WeakPolarHBondContact CB-SG 3.18Å; C199-C207 WeakPolarHBondContact SG-CB 3.35Å; C199-C207 CovalentContact SG-SG 2.02Å; C199-C207 PolarHBondContact SG-SG 2.96Å; C199-C216 HydrophobicContact CB-CB 4.07Å; C199-C216 PolarHBondContact O-N 2.84Å; C199-C216 PolarHBondContact SG-SG 3.1Å
200	D	89.5	Confident	83.4	Confident	39 Å²	39	68.6 Å²	68.6	21%	0.209	39%	0.386	C	S	.	.			trans	-114.1	127.4	178.6	-176.9	5.7	0	0	0	110.4	N202 G203 D204 G205 H215	D200-N202 PolarHBondContact O-N 3.07Å; D200-N202 PolarHBondContact OD1-N 3.13Å; D200-G203 PolarHBondContact O-N 3.09Å; D200-D204 CarbonylContact O-C 3.58Å; D200-G205 PolarHBondContact O-N 3.25Å; D200-H215 WeakPolarHBondContact CA-ND1 3.37Å; D200-H215 IonicContact OD1-CE1 3.62Å; D200-H215 PolarHBondContact OD1-CE1 2.89Å; D200-H215 IonicContact OD1-ND1 2.75Å; D200-H215 PolarHBondContact OD1-ND1 3.25Å
201	M	87.6	Confident	83.2	Confident	77 Å²	77	67.4 Å²	67.4	38%	0.379	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-26.8	179.2	66.5	172.5	80.6	0	0	111.9	L183 I187 H215	L183-M201 HydrophobicContact CD1-CE 3.76Å; L183-M201 HydrophobicContact CD2-CE 3.44Å; L183-M201 VanDerWaalsContact CD2-CE 3.44Å; L183-M201 HydrophobicContact CG-CE 3.93Å; I187-M201 HydrophobicContact CD1-CE 3.74Å; M201-H215 HydrophobicContact CB-CB 4.2Å; M201-H215 HydrophobicContact CE-CB 3.46Å; M201-H215 VanDerWaalsContact CE-CB 3.46Å; M201-H215 VanDerWaalsContact CE-CG 3.47Å; M201-H215 HydrophobicContact CG-CB 4.46Å; M201-H215 PolarHBondContact N-ND1 3.03Å; M201-H215 VanDerWaalsContact N-ND1 3.11Å
202	N	85.5	Confident	82.9	Confident	141 Å²	141	66.5 Å²	66.5	75%	0.754	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-7.4	-178.8	-61.7	-50.1	0	0	0	112.7	D200	D200-N202 PolarHBondContact O-N 3.07Å; D200-N202 PolarHBondContact OD1-N 3.13Å
203	G	77.6	Confident	82.9	Confident	56 Å²	56	63.1 Å²	63.1	58%	0.577	35%	0.353	S	S	*	.	S	Bend	trans	-115.4	-121.3	-177	0	0	0	0	0	111.7	D200	D200-G203 PolarHBondContact O-N 3.09Å
204	D	66.9	Low	82.7	Confident	135 Å²	135	64.2 Å²	64.2	72%	0.722	36%	0.361	S	S	*	.			trans	-92	96.2	171.1	-170	2	0	0	0	109.1	D200 G206	D200-D204 CarbonylContact O-C 3.58Å; D204-G206 PolarHBondContact O-N 3.36Å; D204-G206 VanDerWaalsContact O-N 3.08Å
205	G	63.1	Low	82.8	Confident	48 Å²	48	62 Å²	62	50%	0.495	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	16	-177.2	0	0	0	0	0	114.8	D200 C207	D200-G205 PolarHBondContact O-N 3.25Å; G205-C207 VanDerWaalsContact C-N 3.28Å; G205-C207 PolarHBondContact O-N 2.96Å
206	G	73.1	Confident	82.9	Confident	54 Å²	54	59.3 Å²	59.3	56%	0.557	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-21.7	-177.2	0	0	0	0	0	114.6	D204 Y208	D204-G206 PolarHBondContact O-N 3.36Å; D204-G206 VanDerWaalsContact O-N 3.08Å; G206-Y208 PolarHBondContact O-N 3.22Å
207	C	83.3	Confident	83.1	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.034	33%	0.331	C	S	.	.			trans	39.9	49.5	174.7	-62.1	0	0	0	0	113.4	C199 G205 Y209 H210 R211	C199-C207 VanDerWaalsContact CA-SG 3.51Å; C199-C207 HydrophobicContact CB-CB 3.8Å; C199-C207 WeakPolarHBondContact CB-SG 3.18Å; C199-C207 WeakPolarHBondContact SG-CB 3.35Å; C199-C207 CovalentContact SG-SG 2.02Å; C199-C207 PolarHBondContact SG-SG 2.96Å; G205-C207 VanDerWaalsContact C-N 3.28Å; G205-C207 PolarHBondContact O-N 2.96Å; C207-Y209 VanDerWaalsContact C-N 3.27Å; C207-Y209 PolarHBondContact O-N 3.25Å; C207-Y209 VanDerWaalsContact O-N 3.12Å; C207-H210 HydrophobicContact CB-CB 4.44Å; C207-H210 CarbonylContact O-C 3.44Å; C207-H210 WeakPolarHBondContact O-CA 3.19Å; C207-H210 PolarHBondContact O-N 3.16Å; C207-R211 PolarHBondContact O-N 3.16Å
208	Y	78.2	Confident	83.5	Confident	134 Å²	134	53.6 Å²	53.6	53%	0.525	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-38.6	-164.5	-179.8	-96	0	0	0	114.1	G206	G206-Y208 PolarHBondContact O-N 3.22Å
209	Y	77.7	Confident	84.1	Confident	136 Å²	136	48.9 Å²	48.9	53%	0.533	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-9.6	177.2	-61.2	-65.9	0	0	0	114	C207 S255	C207-Y209 VanDerWaalsContact C-N 3.27Å; C207-Y209 PolarHBondContact O-N 3.25Å; C207-Y209 VanDerWaalsContact O-N 3.12Å; Y209-S255 WeakPolarHBondContact O-CB 2.96Å; Y209-S255 PolarHBondContact O-OG 2.86Å
210	H	85.1	Confident	84.1	Confident	3 Å²	3	50.9 Å²	50.9	1%	0.014	29%	0.294	C	S	.	.	S	Bend	trans	-123.5	49.5	-179.1	-61.3	-62.2	0	0	0	110.5	Y196 C207 G212 A213 S255 P256	Y196-H210 AromaticContact CE1-CD2 3.82Å; Y196-H210 AromaticContact CE1-NE2 3.64Å; C207-H210 HydrophobicContact CB-CB 4.44Å; C207-H210 CarbonylContact O-C 3.44Å; C207-H210 WeakPolarHBondContact O-CA 3.19Å; C207-H210 PolarHBondContact O-N 3.16Å; H210-G212 PolarHBondContact O-N 3.44Å; H210-A213 HydrophobicContact CB-CB 4.17Å; H210-A213 WeakPolarHBondContact O-CB 3.19Å; H210-A213 PolarHBondContact O-N 3.06Å; H210-S255 CarbonylContact C-O 3.56Å; H210-S255 WeakPolarHBondContact CA-O 2.94Å; H210-P256 PolarHBondContact ND1-O 2.91Å
211	R	82.2	Confident	83.9	Confident	114 Å²	114	54.7 Å²	54.7	43%	0.43	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	139.7	-178.3	-76.4	-177.7	-169.9	-166	3.6	110.4	C207 A213 Y253 Y254 S255	C207-R211 PolarHBondContact O-N 3.16Å; R211-A213 VanDerWaalsContact C-N 3.27Å; R211-Y253 WeakPolarHBondContact CB-O 3.22Å; R211-Y253 VanDerWaalsContact NH1-CD1 3.32Å; R211-Y254 WeakPolarHBondContact O-CA 3.5Å; R211-S255 PolarHBondContact O-N 2.81Å
212	G	83.6	Confident	83.8	Confident	33 Å²	33	51.7 Å²	51.7	34%	0.34	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	-19.2	-172.1	0	0	0	0	0	113.8	H210	H210-G212 PolarHBondContact O-N 3.44Å
213	A	89.5	Confident	83.9	Confident	11 Å²	11	45.9 Å²	45.9	9%	0.091	27%	0.268	C	S	.	.			trans	-79.2	142.8	173.7	0	0	0	0	0	111.5	H210 R211 C232 Y233 M240	H210-A213 HydrophobicContact CB-CB 4.17Å; H210-A213 WeakPolarHBondContact O-CB 3.19Å; H210-A213 PolarHBondContact O-N 3.06Å; R211-A213 VanDerWaalsContact C-N 3.27Å; A213-C232 HydrophobicContact CB-CB 3.87Å; A213-Y233 CarbonylContact C-O 3.56Å; A213-Y233 WeakPolarHBondContact CA-O 3.43Å; A213-Y233 WeakPolarHBondContact CB-O 3.38Å; A213-M240 HydrophobicContact CB-SD 3.75Å
214	S	90.3	Very high	83.9	Confident	28 Å²	28	50.4 Å²	50.4	20%	0.196	27%	0.268	C	S	.	.	S	Bend	trans	-88.2	-30.8	166	66.5	0	0	0	0	111.9	Y233 D234	S214-Y233 PolarHBondContact N-O 3.36Å; S214-Y233 PolarHBondContact OG-O 3.01Å; S214-D234 WeakPolarHBondContact CB-O 3.46Å; S214-D234 PolarHBondContact OG-O 2.88Å
215	H	93.4	Very high	84.5	Confident	5 Å²	5	45.8 Å²	45.8	2%	0.023	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	145.3	-178.3	-170.7	64.3	0	0	0	110.9	L183 D200 M201 Y233	L183-H215 HydrophobicContact CD1-CB 3.91Å; L183-H215 VanDerWaalsContact CD1-CD2 3.47Å; L183-H215 WeakPolarHBondContact CD1-CD2 3.2Å; L183-H215 HydrophobicContact CD2-CB 4.34Å; D200-H215 WeakPolarHBondContact CA-ND1 3.37Å; D200-H215 IonicContact OD1-CE1 3.62Å; D200-H215 PolarHBondContact OD1-CE1 2.89Å; D200-H215 IonicContact OD1-ND1 2.75Å; D200-H215 PolarHBondContact OD1-ND1 3.25Å; M201-H215 HydrophobicContact CB-CB 4.2Å; M201-H215 HydrophobicContact CE-CB 3.46Å; M201-H215 VanDerWaalsContact CE-CB 3.46Å; M201-H215 VanDerWaalsContact CE-CG 3.47Å; M201-H215 HydrophobicContact CG-CB 4.46Å; M201-H215 PolarHBondContact N-ND1 3.03Å; M201-H215 VanDerWaalsContact N-ND1 3.11Å; H215-Y233 PolarHBondContact O-N 2.8Å
216	C	93.4	Very high	85.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	147.4	167.1	-53.9	0	0	0	0	110.7	Y196 C199 V230 C231 C232	Y196-C216 WeakPolarHBondContact CB-O 3.44Å; Y196-C216 HydrophobicContact CD1-CB 4.27Å; Y196-C216 HydrophobicContact CG-CB 4.33Å; Y196-C216 PolarHBondContact N-O 3.2Å; C199-C216 HydrophobicContact CB-CB 4.07Å; C199-C216 PolarHBondContact O-N 2.84Å; C199-C216 PolarHBondContact SG-SG 3.1Å; C216-V230 HydrophobicContact CB-CG1 4.21Å; C216-C231 CarbonylContact C-O 3.58Å; C216-C231 WeakPolarHBondContact CA-O 3.46Å; C216-C231 WeakPolarHBondContact CB-O 3.44Å; C216-C232 HydrophobicContact CB-CB 4.08Å; C216-C232 WeakPolarHBondContact CB-SG 3.5Å; C216-C232 VanDerWaalsContact SG-CA 3.57Å; C216-C232 WeakPolarHBondContact SG-CB 3.22Å; C216-C232 CovalentContact SG-SG 2.03Å; C216-C232 PolarHBondContact SG-SG 3.46Å
217	V	93.9	Very high	86.2	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.018	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	155.9	167	-55.7	0	0	0	0	109.8	A186 F193 M194 V230 C231 Y233	A186-V217 HydrophobicContact CB-CG1 4.02Å; A186-V217 HydrophobicContact CB-CG2 3.97Å; F193-V217 HydrophobicContact CB-CB 4.06Å; F193-V217 HydrophobicContact CB-CG2 3.95Å; F193-V217 HydrophobicContact CD1-CB 4.38Å; F193-V217 HydrophobicContact CD1-CG2 3.6Å; F193-V217 HydrophobicContact CE1-CG2 4.4Å; F193-V217 HydrophobicContact CG-CG2 3.94Å; M194-V217 CarbonylContact O-C 3.48Å; M194-V217 VanDerWaalsContact O-CA 3.24Å; M194-V217 WeakPolarHBondContact O-CA 3.12Å; M194-V217 WeakPolarHBondContact O-CB 3.37Å; V217-V230 CarbonylContact O-C 3.56Å; V217-V230 WeakPolarHBondContact O-CA 3.42Å; V217-C231 HydrophobicContact CG2-CB 3.86Å; V217-C231 PolarHBondContact N-O 2.96Å; V217-C231 PolarHBondContact O-N 3.35Å; V217-Y233 HydrophobicContact CG2-CE2 4.09Å
218	M	91.9	Very high	86.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	157.4	169.3	62.8	178.1	164	0	0	110.6	F193 M194 P195 Y196 L197 T220 T229 V230 F265	F193-M218 CarbonylContact C-O 3.56Å; F193-M218 VanDerWaalsContact CA-O 3.3Å; F193-M218 WeakPolarHBondContact CA-O 3.39Å; M194-M218 HydrophobicContact CE-CE 3.36Å; M194-M218 HydrophobicContact CG-CE 4.04Å; M194-M218 HydrophobicContact CG-CG 3.88Å; M194-M218 PolarHBondContact N-O 3.17Å; M194-M218 PolarHBondContact O-N 2.72Å; M194-M218 HydrophobicContact SD-CE 3.8Å; P195-M218 WeakPolarHBondContact O-CE 3.16Å; Y196-M218 HydrophobicContact CD2-CB 4.1Å; Y196-M218 HydrophobicContact CD2-CG 4.25Å; Y196-M218 HydrophobicContact CD2-SD 3.82Å; Y196-M218 HydrophobicContact CE2-SD 4.4Å; L197-M218 HydrophobicContact CG-CE 3.94Å; M218-T220 PolarHBondContact O-N 3.22Å; M218-T229 CarbonylContact C-O 3.53Å; M218-T229 WeakPolarHBondContact CA-O 3.41Å; M218-V230 HydrophobicContact CB-CG2 3.93Å; M218-F265 HydrophobicContact CE-CD2 4.42Å; M218-F265 HydrophobicContact CE-CE2 3.46Å; M218-F265 VanDerWaalsContact CE-CE2 3.46Å; M218-F265 HydrophobicContact CE-CZ 4.12Å; M218-F265 HydrophobicContact SD-CE2 4.3Å
219	S	92.2	Very high	87.1	Confident	5 Å²	5	35.3 Å²	35.3	4%	0.035	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54	139.2	170.7	49.4	0	0	0	0	110.8	R192 Q221 Q228 T229 H263	R192-S219 CarbonylContact O-C 3.54Å; R192-S219 VanDerWaalsContact O-CA 3.26Å; R192-S219 WeakPolarHBondContact O-CA 3.41Å; S219-Q221 VanDerWaalsContact C-N 3.31Å; S219-Q221 WeakPolarHBondContact CB-O 3.3Å; S219-Q221 PolarHBondContact OG-O 2.89Å; S219-Q228 WeakPolarHBondContact OG-CA 3.37Å; S219-Q228 WeakPolarHBondContact OG-CB 3.46Å; S219-T229 PolarHBondContact N-O 3.07Å; S219-T229 PolarHBondContact OG-N 2.7Å; S219-H263 PolarHBondContact O-NE2 2.02Å
220	T	89	Confident	87.8	Confident	41 Å²	41	29 Å²	29	25%	0.252	15%	0.151	S	C	.	.	S	Bend	trans	-70.3	-31.5	175.4	52.9	0	0	0	0	112	G191 R192 F193 M194 M218	G191-T220 PolarHBondContact O-OG1 2.97Å; R192-T220 PolarHBondContact O-N 3.35Å; R192-T220 PolarHBondContact O-OG1 3.33Å; F193-T220 VanDerWaalsContact C-CG2 3.49Å; M194-T220 HydrophobicContact CB-CG2 3.98Å; M194-T220 HydrophobicContact CG-CG2 4.07Å; M218-T220 PolarHBondContact O-N 3.22Å
221	Q	85	Confident	88.2	Confident	120 Å²	120	28.9 Å²	28.9	56%	0.561	15%	0.15	S	C	*	.	S	Bend	trans	-121	144.5	-177.3	-61.3	-177.2	31.6	0	0	110.9	S219 H263	S219-Q221 VanDerWaalsContact C-N 3.31Å; S219-Q221 WeakPolarHBondContact CB-O 3.3Å; S219-Q221 PolarHBondContact OG-O 2.89Å; Q221-H263 VanDerWaalsContact C-CD2 3.47Å; Q221-H263 VanDerWaalsContact C-NE2 3.27Å
222	A	85.8	Confident	88.7	Confident	13 Å²	13	23.4 Å²	23.4	11%	0.107	13%	0.13	C	C	.	.			trans	-68.2	144.9	170	0	0	0	0	0	110.5	A227 H263 G266	A222-A227 CarbonylContact C-O 3.43Å; A222-A227 WeakPolarHBondContact CA-O 3.49Å; A222-H263 VanDerWaalsContact CA-CD2 3.46Å; A222-H263 WeakPolarHBondContact CA-CD2 3.31Å; A222-H263 HydrophobicContact CB-CB 3.43Å; A222-H263 VanDerWaalsContact CB-CB 3.43Å; A222-H263 PolarHBondContact N-CD2 2.98Å; A222-H263 VanDerWaalsContact N-CD2 3.34Å; A222-H263 PolarHBondContact N-NE2 3.37Å; A222-G266 WeakPolarHBondContact CB-O 2.87Å
223	T	86.1	Confident	89.1	Confident	19 Å²	19	21.9 Å²	21.9	12%	0.117	11%	0.114	C	C	.	.			trans	-61.4	167.6	166.5	69.5	0	0	0	0	110.3	D175 L176 T225 G226 A227	D175-T223 HydrophobicContact CB-CG2 4.39Å; D175-T223 WeakPolarHBondContact O-CG2 3.33Å; L176-T223 HydrophobicContact CD2-CG2 3.84Å; T223-T225 PolarHBondContact O-N 3.05Å; T223-T225 VanDerWaalsContact O-N 3.13Å; T223-T225 PolarHBondContact OG1-N 3.44Å; T223-T225 PolarHBondContact OG1-OG1 3.44Å; T223-G226 WeakPolarHBondContact O-CA 3.47Å; T223-G226 PolarHBondContact O-N 3.2Å; T223-G226 PolarHBondContact OG1-N 3.33Å; T223-A227 HydrophobicContact CG2-CB 4.35Å; T223-A227 PolarHBondContact N-O 2.97Å; T223-A227 WeakPolarHBondContact OG1-CB 3.28Å; T223-A227 PolarHBondContact OG1-N 3.17Å
224	W	78.1	Confident	89	Confident	151 Å²	151	23.2 Å²	23.2	57%	0.572	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-20.9	175.8	73.3	-85.5	0	0	0	113.1	R170 D175 G226	R170-W224 VanDerWaalsContact NH2-CZ2 3.29Å; D175-W224 PolarHBondContact OD1-NE1 3.34Å; W224-G226 VanDerWaalsContact C-N 3.32Å
225	T	79.5	Confident	88.9	Confident	38 Å²	38	29.2 Å²	29.2	23%	0.233	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-7.8	169.9	42	0	0	0	0	113.7	D175 T223	D175-T225 WeakPolarHBondContact OD2-CG2 3.34Å; D175-T225 PolarHBondContact OD2-OG1 3.4Å; T223-T225 PolarHBondContact O-N 3.05Å; T223-T225 VanDerWaalsContact O-N 3.13Å; T223-T225 PolarHBondContact OG1-N 3.44Å; T223-T225 PolarHBondContact OG1-OG1 3.44Å
226	G	83.9	Confident	88.9	Confident	8 Å²	8	35.6 Å²	35.6	8%	0.082	18%	0.183	C	C	.	.	S	Bend	trans	91.7	8.3	-178.9	0	0	0	0	0	114.1	T223 W224 R261 A262 H263	T223-G226 WeakPolarHBondContact O-CA 3.47Å; T223-G226 PolarHBondContact O-N 3.2Å; T223-G226 PolarHBondContact OG1-N 3.33Å; W224-G226 VanDerWaalsContact C-N 3.32Å; G226-R261 CarbonylContact C-O 3.6Å; G226-A262 CarbonylContact O-C 3.51Å; G226-A262 VanDerWaalsContact O-CA 3.28Å; G226-A262 WeakPolarHBondContact O-CA 3.29Å; G226-H263 WeakPolarHBondContact O-CB 3.49Å; G226-H263 PolarHBondContact O-N 3.48Å
227	A	88.7	Confident	88.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.189	C	C	.	.			trans	-85.8	164.2	-175.8	0	0	0	0	0	113.4	F172 L176 A222 T223 Y260 R261	F172-A227 HydrophobicContact CB-CB 3.92Å; F172-A227 HydrophobicContact CD2-CB 3.41Å; F172-A227 VanDerWaalsContact CD2-CB 3.41Å; F172-A227 HydrophobicContact CE2-CB 4.23Å; F172-A227 HydrophobicContact CG-CB 3.99Å; L176-A227 HydrophobicContact CD2-CB 3.81Å; A222-A227 CarbonylContact C-O 3.43Å; A222-A227 WeakPolarHBondContact CA-O 3.49Å; T223-A227 HydrophobicContact CG2-CB 4.35Å; T223-A227 PolarHBondContact N-O 2.97Å; T223-A227 WeakPolarHBondContact OG1-CB 3.28Å; T223-A227 PolarHBondContact OG1-N 3.17Å; A227-Y260 WeakPolarHBondContact CA-O 3.26Å; A227-Y260 WeakPolarHBondContact CB-O 3.3Å; A227-R261 WeakPolarHBondContact CA-O 3.37Å; A227-R261 PolarHBondContact N-O 2.93Å
228	Q	89.6	Confident	88.8	Confident	3 Å²	3	43.5 Å²	43.5	1%	0.014	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-129.7	151.1	173.3	66.2	178.5	26.6	0	0	111.6	L176 S219 V230 Y260 H263 T264	L176-Q228 WeakPolarHBondContact CD2-O 3.44Å; S219-Q228 WeakPolarHBondContact OG-CA 3.37Å; S219-Q228 WeakPolarHBondContact OG-CB 3.46Å; Q228-V230 HydrophobicContact CG-CG2 4.42Å; Q228-Y260 HydrophobicContact CG-CD2 4.1Å; Q228-Y260 HydrophobicContact CG-CG 4.33Å; Q228-Y260 PolarHBondContact N-O 3.14Å; Q228-Y260 VanDerWaalsContact NE2-CD2 3.28Å; Q228-Y260 PolarHBondContact O-N 3.03Å; Q228-H263 HydrophobicContact CB-CB 3.96Å; Q228-H263 WeakPolarHBondContact CB-CD2 3.15Å; Q228-T264 VanDerWaalsContact CD-OG1 3.3Å; Q228-T264 PolarHBondContact NE2-OG1 3.33Å; Q228-T264 PolarHBondContact OE1-OG1 2.99Å
229	T	90.9	Very high	88.8	Confident	11 Å²	11	45.2 Å²	45.2	7%	0.067	23%	0.225	C	C	.	.			trans	-98.6	140.9	165.4	-174.8	0	0	0	0	109	F193 M218 S219	F193-T229 HydrophobicContact CE1-CG2 3.81Å; M218-T229 CarbonylContact C-O 3.53Å; M218-T229 WeakPolarHBondContact CA-O 3.41Å; S219-T229 PolarHBondContact N-O 3.07Å; S219-T229 PolarHBondContact OG-N 2.7Å
230	V	92.4	Very high	88.6	Confident	3 Å²	3	45.6 Å²	45.6	2%	0.018	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	124.5	170.9	-180	0	0	0	0	107	Y196 C216 V217 M218 Q228 G257 Y260	Y196-V230 HydrophobicContact CD1-CG1 4.39Å; Y196-V230 HydrophobicContact CD2-CG1 4.1Å; Y196-V230 HydrophobicContact CD2-CG2 4.08Å; Y196-V230 HydrophobicContact CE2-CG1 4.48Å; Y196-V230 HydrophobicContact CE2-CG2 4.09Å; Y196-V230 HydrophobicContact CG-CG1 4.06Å; C216-V230 HydrophobicContact CB-CG1 4.21Å; V217-V230 CarbonylContact O-C 3.56Å; V217-V230 WeakPolarHBondContact O-CA 3.42Å; M218-V230 HydrophobicContact CB-CG2 3.93Å; Q228-V230 HydrophobicContact CG-CG2 4.42Å; V230-G257 CarbonylContact O-C 3.14Å; V230-G257 VanDerWaalsContact O-C 3.23Å; V230-G257 WeakPolarHBondContact O-CA 3.01Å; V230-Y260 HydrophobicContact CB-CD2 4.47Å; V230-Y260 HydrophobicContact CB-CE2 4.18Å; V230-Y260 HydrophobicContact CG2-CD2 3.67Å; V230-Y260 HydrophobicContact CG2-CE2 3.61Å
231	C	92.5	Very high	88.2	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	123.1	-175.7	-50.7	0	0	0	0	108	C179 C216 V217 Y233 L239	C179-C231 WeakPolarHBondContact CA-SG 3.46Å; C179-C231 HydrophobicContact CB-CB 3.67Å; C179-C231 WeakPolarHBondContact CB-SG 3.25Å; C179-C231 WeakPolarHBondContact SG-CB 3.46Å; C179-C231 CovalentContact SG-SG 2.02Å; C179-C231 PolarHBondContact SG-SG 3.39Å; C216-C231 CarbonylContact C-O 3.58Å; C216-C231 WeakPolarHBondContact CA-O 3.46Å; C216-C231 WeakPolarHBondContact CB-O 3.44Å; V217-C231 HydrophobicContact CG2-CB 3.86Å; V217-C231 PolarHBondContact N-O 2.96Å; V217-C231 PolarHBondContact O-N 3.35Å; C231-Y233 HydrophobicContact CB-CE2 4.08Å; C231-L239 HydrophobicContact CB-CD1 4Å
232	C	92.6	Very high	87.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	143.7	-179	-66.4	0	0	0	0	110.5	A213 C216 M240 G257	A213-C232 HydrophobicContact CB-CB 3.87Å; C216-C232 HydrophobicContact CB-CB 4.08Å; C216-C232 WeakPolarHBondContact CB-SG 3.5Å; C216-C232 VanDerWaalsContact SG-CA 3.57Å; C216-C232 WeakPolarHBondContact SG-CB 3.22Å; C216-C232 CovalentContact SG-SG 2.03Å; C216-C232 PolarHBondContact SG-SG 3.46Å; C232-M240 HydrophobicContact CB-SD 4.32Å; C232-M240 WeakPolarHBondContact O-CB 3.41Å; C232-M240 PolarHBondContact O-N 3.37Å; C232-G257 WeakPolarHBondContact SG-CA 3.37Å
233	Y	92.2	Very high	86.8	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	137.9	-174.7	-59.3	-87.1	0	0	0	110	P180 L183 A186 A213 S214 H215 V217 C231 W238 L239	P180-Y233 WeakPolarHBondContact CD-OH 3.21Å; P180-Y233 WeakPolarHBondContact O-CE1 3.49Å; P180-Y233 PolarHBondContact O-OH 2.66Å; L183-Y233 HydrophobicContact CB-CD1 3.9Å; L183-Y233 HydrophobicContact CB-CD2 4.23Å; L183-Y233 HydrophobicContact CB-CG 3.72Å; L183-Y233 HydrophobicContact CD1-CD2 3.7Å; L183-Y233 HydrophobicContact CD1-CE2 4.33Å; L183-Y233 HydrophobicContact CD1-CG 4.01Å; L183-Y233 HydrophobicContact CG-CG 4.38Å; L183-Y233 VanDerWaalsContact N-CD1 3.31Å; A186-Y233 HydrophobicContact CB-CE2 3.73Å; A186-Y233 WeakPolarHBondContact CB-OH 3.39Å; A213-Y233 CarbonylContact C-O 3.56Å; A213-Y233 WeakPolarHBondContact CA-O 3.43Å; A213-Y233 WeakPolarHBondContact CB-O 3.38Å; S214-Y233 PolarHBondContact N-O 3.36Å; S214-Y233 PolarHBondContact OG-O 3.01Å; H215-Y233 PolarHBondContact O-N 2.8Å; V217-Y233 HydrophobicContact CG2-CE2 4.09Å; C231-Y233 HydrophobicContact CB-CE2 4.08Å; Y233-W238 CarbonylContact C-O 3.49Å; Y233-W238 WeakPolarHBondContact CA-O 3.5Å; Y233-L239 HydrophobicContact CD1-CB 4.26Å; Y233-L239 HydrophobicContact CE1-CB 3.93Å; Y233-L239 HydrophobicContact CE1-CD1 4.06Å
234	D	88.7	Confident	85.5	Confident	40 Å²	40	55 Å²	55	21%	0.214	28%	0.278	C	S	.	.			trans	-70.3	-173	177.7	67.5	15.4	0	0	0	112.5	S214 D236 G237 W238 M240	S214-D234 WeakPolarHBondContact CB-O 3.46Å; S214-D234 PolarHBondContact OG-O 2.88Å; D234-D236 PolarHBondContact O-N 3.12Å; D234-D236 WeakPolarHBondContact OD1-CA 3.47Å; D234-D236 PolarHBondContact OD1-N 3.22Å; D234-G237 PolarHBondContact O-N 2.89Å; D234-G237 PolarHBondContact OD1-N 3.06Å; D234-W238 PolarHBondContact N-O 2.81Å; D234-W238 PolarHBondContact OD1-N 2.02Å; D234-M240 HydrophobicContact CB-CG 4.24Å
235	L	88.3	Confident	84.6	Confident	154 Å²	154	54.8 Å²	54.8	81%	0.806	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-23	177.9	-70.2	169.7	0	0	0	113.7
236	D	91.9	Very high	83.4	Confident	138 Å²	138	57.8 Å²	57.8	74%	0.738	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-5.9	178.5	-68.1	-51.5	0	0	0	112.1	D234	D234-D236 PolarHBondContact O-N 3.12Å; D234-D236 WeakPolarHBondContact OD1-CA 3.47Å; D234-D236 PolarHBondContact OD1-N 3.22Å
237	G	92.3	Very high	82	Confident	13 Å²	13	64.3 Å²	64.3	13%	0.134	32%	0.322	C	S	.	.	S	Bend	trans	86.2	16.6	178.3	0	0	0	0	0	114.2	T182 L183 D234	T182-G237 CarbonylContact C-O 3.54Å; T182-G237 VanDerWaalsContact CA-O 3.31Å; T182-G237 WeakPolarHBondContact CA-O 3.3Å; L183-G237 PolarHBondContact N-O 3.07Å; D234-G237 PolarHBondContact O-N 2.89Å; D234-G237 PolarHBondContact OD1-N 3.06Å
238	W	93.2	Very high	80.4	Confident	157 Å²	157	68.9 Å²	68.9	60%	0.595	35%	0.346	S	S	*	.	B	Isolated β-bridge	trans	-88.3	144.1	175.2	-63.6	105	0	0	0	111.7	T182 Y233 D234 M240	T182-W238 HydrophobicContact CG2-CE3 4.07Å; T182-W238 HydrophobicContact CG2-CZ3 3.87Å; Y233-W238 CarbonylContact C-O 3.49Å; Y233-W238 WeakPolarHBondContact CA-O 3.5Å; D234-W238 PolarHBondContact N-O 2.81Å; D234-W238 PolarHBondContact OD1-N 2.02Å; W238-M240 PolarHBondContact O-N 2.85Å
239	L	91.4	Very high	79	Confident	36 Å²	36	75 Å²	75	19%	0.188	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-61.9	122.8	174.6	177.9	66.3	0	0	0	110.3	C179 C181 C231 Y233	C179-L239 HydrophobicContact CB-CD1 3.69Å; C179-L239 HydrophobicContact CB-CD2 3.59Å; C179-L239 HydrophobicContact CB-CG 4.31Å; C181-L239 WeakPolarHBondContact O-CB 3.39Å; C181-L239 PolarHBondContact O-N 2.79Å; C231-L239 HydrophobicContact CB-CD1 4Å; Y233-L239 HydrophobicContact CD1-CB 4.26Å; Y233-L239 HydrophobicContact CE1-CB 3.93Å; Y233-L239 HydrophobicContact CE1-CD1 4.06Å
240	M	88.2	Confident	77.4	Confident	12 Å²	12	78.2 Å²	78.2	6%	0.059	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-75.6	130.4	168.5	-59.2	175.3	61	0	0	109.2	A213 C232 D234 W238 Y254 P256	A213-M240 HydrophobicContact CB-SD 3.75Å; C232-M240 HydrophobicContact CB-SD 4.32Å; C232-M240 WeakPolarHBondContact O-CB 3.41Å; C232-M240 PolarHBondContact O-N 3.37Å; D234-M240 HydrophobicContact CB-CG 4.24Å; W238-M240 PolarHBondContact O-N 2.85Å; M240-Y254 HydrophobicContact CE-CD1 3.76Å; M240-Y254 HydrophobicContact CE-CG 4.45Å; M240-P256 HydrophobicContact CB-CB 3.89Å
241	H	81.6	Confident	75.6	Confident	121 Å²	121	80.7 Å²	80.7	56%	0.56	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-87.4	132.5	-173.5	-72.8	-59.9	0	0	0	111	D243 D244 P256	H241-D243 PolarHBondContact O-N 3.13Å; H241-D244 HydrophobicContact CB-CB 4.14Å; H241-D244 PolarHBondContact N-OD2 3.26Å; H241-D244 PolarHBondContact O-N 2.87Å; H241-P256 VanDerWaalsContact O-CB 3.31Å; H241-P256 WeakPolarHBondContact O-CB 3.4Å; H241-P256 VanDerWaalsContact O-CG 3.29Å; H241-P256 WeakPolarHBondContact O-CG 3.33Å
242	S	71.7	Confident	73.8	Confident	66 Å²	66	82.7 Å²	82.7	46%	0.462	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-23	177.5	57.3	0	0	0	0	115
243	D	69.1	Low	72.2	Confident	150 Å²	150	88.8 Å²	88.8	80%	0.802	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-5.6	-178	-59.7	-13.1	0	0	0	113.3	H241 Y245	H241-D243 PolarHBondContact O-N 3.13Å; D243-Y245 PolarHBondContact O-N 2.76Å; D243-Y245 VanDerWaalsContact O-N 3.14Å
244	D	59.8	Low	71.1	Confident	55 Å²	55	93.9 Å²	93.9	29%	0.294	48%	0.477	S	S	.	.			trans	-78.9	16.1	179.8	68.5	16.6	0	0	0	114.1	H241 E246	H241-D244 HydrophobicContact CB-CB 4.14Å; H241-D244 PolarHBondContact N-OD2 3.26Å; H241-D244 PolarHBondContact O-N 2.87Å; D244-E246 VanDerWaalsContact C-N 3.27Å; D244-E246 PolarHBondContact O-N 3.28Å
245	Y	57.7	Low	70.4	Confident	146 Å²	146	94 Å²	94	57%	0.573	48%	0.482	S	S	*	.			trans	-64.3	89.1	165.4	-174.9	-97.9	0	0	0	109.8	D243	D243-Y245 PolarHBondContact O-N 2.76Å; D243-Y245 VanDerWaalsContact O-N 3.14Å
246	E	54	Low	69.9	Low	101 Å²	101	87 Å²	87	47%	0.472	45%	0.445	S	S	.	.			trans	-85.4	127.6	170	-67.9	-160.3	175.2	0	0	109.9	D244 L248 L251	D244-E246 VanDerWaalsContact C-N 3.27Å; D244-E246 PolarHBondContact O-N 3.28Å; E246-L248 HydrophobicContact CB-CG 4.36Å; E246-L248 PolarHBondContact O-N 2.82Å; E246-L248 VanDerWaalsContact OE2-CD1 3.22Å; E246-L248 WeakPolarHBondContact OE2-CD1 3.29Å; E246-L251 HydrophobicContact CB-CB 3.99Å; E246-L251 HydrophobicContact CB-CD1 3.75Å; E246-L251 HydrophobicContact CG-CD1 4.01Å; E246-L251 VanDerWaalsContact OE2-CD1 3.23Å; E246-L251 WeakPolarHBondContact OE2-CD1 3.19Å
247	D	56.3	Low	69.4	Low	144 Å²	144	80.8 Å²	80.8	77%	0.77	41%	0.414	S	S	*	.			trans	-71.7	51.3	169.1	-167.1	19.9	0	0	0	110.6
248	L	55.2	Low	68.9	Low	96 Å²	96	82.8 Å²	82.8	50%	0.503	42%	0.423	S	S	.	.	S	Bend	trans	-109.8	132.2	166.8	-66.1	-178.9	0	0	0	106.7	E246 A250 L251 S252	E246-L248 HydrophobicContact CB-CG 4.36Å; E246-L248 PolarHBondContact O-N 2.82Å; E246-L248 VanDerWaalsContact OE2-CD1 3.22Å; E246-L248 WeakPolarHBondContact OE2-CD1 3.29Å; L248-A250 PolarHBondContact O-N 2.89Å; L248-L251 HydrophobicContact CB-CB 4.33Å; L248-L251 HydrophobicContact CD1-CD1 4.23Å; L248-L251 CarbonylContact O-C 3.58Å; L248-L251 PolarHBondContact O-N 3.15Å; L248-S252 PolarHBondContact O-N 2.77Å; L248-S252 PolarHBondContact O-OG 2.84Å
249	D	58.3	Low	68.7	Low	133 Å²	133	77.7 Å²	77.7	71%	0.711	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-28.5	-177.6	-162	28.6	0	0	0	112.6	Y253	D249-Y253 WeakPolarHBondContact O-CD2 3.09Å; D249-Y253 WeakPolarHBondContact O-CE2 3.49Å
250	A	58.2	Low	68.5	Low	78 Å²	78	79.5 Å²	79.5	65%	0.645	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-31.5	175.2	0	0	0	0	0	114.5	L248	L248-A250 PolarHBondContact O-N 2.89Å
251	L	54.3	Low	68.3	Low	55 Å²	55	81.8 Å²	81.8	29%	0.288	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-10.1	-179.3	-65	179.1	0	0	0	113.5	E246 L248 Y253 Y254	E246-L251 HydrophobicContact CB-CB 3.99Å; E246-L251 HydrophobicContact CB-CD1 3.75Å; E246-L251 HydrophobicContact CG-CD1 4.01Å; E246-L251 VanDerWaalsContact OE2-CD1 3.23Å; E246-L251 WeakPolarHBondContact OE2-CD1 3.19Å; L248-L251 HydrophobicContact CB-CB 4.33Å; L248-L251 HydrophobicContact CD1-CD1 4.23Å; L248-L251 CarbonylContact O-C 3.58Å; L248-L251 PolarHBondContact O-N 3.15Å; L251-Y253 PolarHBondContact O-N 2.78Å; L251-Y254 HydrophobicContact CD2-CD2 3.57Å; L251-Y254 HydrophobicContact CD2-CE2 3.72Å; L251-Y254 HydrophobicContact CD2-CG 4.5Å; L251-Y254 PolarHBondContact O-N 2.85Å
252	S	55.6	Low	68.5	Low	42 Å²	42	79.3 Å²	79.3	29%	0.294	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-15.6	170.6	-64.8	0	0	0	0	113	L248	L248-S252 PolarHBondContact O-N 2.77Å; L248-S252 PolarHBondContact O-OG 2.84Å
253	Y	57.3	Low	69.3	Low	127 Å²	127	76.8 Å²	76.8	50%	0.498	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-12.6	176.3	-58.9	-70.4	0	0	0	114.2	R211 D249 L251 S255	R211-Y253 WeakPolarHBondContact CB-O 3.22Å; R211-Y253 VanDerWaalsContact NH1-CD1 3.32Å; D249-Y253 WeakPolarHBondContact O-CD2 3.09Å; D249-Y253 WeakPolarHBondContact O-CE2 3.49Å; L251-Y253 PolarHBondContact O-N 2.78Å; Y253-S255 PolarHBondContact O-N 2.97Å
254	Y	69.3	Low	69.8	Low	107 Å²	107	71.4 Å²	71.4	42%	0.42	38%	0.377	S	S	.	.			trans	-79.9	120.8	172.8	-75.7	-95.2	0	0	0	108.4	R211 M240 L251	R211-Y254 WeakPolarHBondContact O-CA 3.5Å; M240-Y254 HydrophobicContact CE-CD1 3.76Å; M240-Y254 HydrophobicContact CE-CG 4.45Å; L251-Y254 HydrophobicContact CD2-CD2 3.57Å; L251-Y254 HydrophobicContact CD2-CE2 3.72Å; L251-Y254 HydrophobicContact CD2-CG 4.5Å; L251-Y254 PolarHBondContact O-N 2.85Å
255	S	74.4	Confident	70.6	Confident	43 Å²	43	72.4 Å²	72.4	30%	0.301	38%	0.379	S	S	.	.			trans	-121.2	100.8	179	-177.4	0	0	0	0	108.3	Y209 H210 R211 Y253	Y209-S255 WeakPolarHBondContact O-CB 2.96Å; Y209-S255 PolarHBondContact O-OG 2.86Å; H210-S255 CarbonylContact C-O 3.56Å; H210-S255 WeakPolarHBondContact CA-O 2.94Å; R211-S255 PolarHBondContact O-N 2.81Å; Y253-S255 PolarHBondContact O-N 2.97Å
256	P	79.2	Confident	71.3	Confident	7 Å²	7	66.7 Å²	66.7	5%	0.045	37%	0.365	C	S	.	.			trans	-66.9	175.1	-177	28.8	-37.1	0	0	0	112	H210 M240 H241 V258	H210-P256 PolarHBondContact ND1-O 2.91Å; M240-P256 HydrophobicContact CB-CB 3.89Å; H241-P256 VanDerWaalsContact O-CB 3.31Å; H241-P256 WeakPolarHBondContact O-CB 3.4Å; H241-P256 VanDerWaalsContact O-CG 3.29Å; H241-P256 WeakPolarHBondContact O-CG 3.33Å; P256-V258 PolarHBondContact O-N 3.47Å
257	G	79.5	Confident	71.9	Confident	7 Å²	7	65.4 Å²	65.4	7%	0.072	37%	0.367	C	S	.	.			trans	-65.1	125.9	169.1	0	0	0	0	0	109.8	V230 C232	V230-G257 CarbonylContact O-C 3.14Å; V230-G257 VanDerWaalsContact O-C 3.23Å; V230-G257 WeakPolarHBondContact O-CA 3.01Å; C232-G257 WeakPolarHBondContact SG-CA 3.37Å
258	V	83.3	Confident	72.2	Confident	55 Å²	55	63 Å²	63	33%	0.333	35%	0.348	S	S	.	.			trans	-111.2	141.2	178	-65.9	0	0	0	0	110.6	P256 Y260	P256-V258 PolarHBondContact O-N 3.47Å; V258-Y260 HydrophobicContact CG2-CE1 4.42Å; V258-Y260 HydrophobicContact CG2-CE2 4Å; V258-Y260 VanDerWaalsContact O-CD2 3.22Å; V258-Y260 WeakPolarHBondContact O-CD2 3.43Å; V258-Y260 VanDerWaalsContact O-CE2 3.25Å; V258-Y260 WeakPolarHBondContact O-CE2 3.24Å
259	P	87.4	Confident	72.1	Confident	50 Å²	50	64.4 Å²	64.4	33%	0.325	36%	0.363	S	S	.	.			trans	-73.1	142.8	175.2	32.6	-36.6	0	0	0	111	F172 L176	F172-P259 HydrophobicContact CE2-CB 3.95Å; F172-P259 HydrophobicContact CE2-CG 4.44Å; L176-P259 HydrophobicContact CD1-CB 3.21Å; L176-P259 HydrophobicContact CD1-CG 4.13Å
260	Y	87.5	Confident	71.7	Confident	75 Å²	75	63.9 Å²	63.9	29%	0.294	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-113.7	137.5	177.8	-61.2	-97.7	0	0	0	111	A227 Q228 V230 V258 A262	A227-Y260 WeakPolarHBondContact CA-O 3.26Å; A227-Y260 WeakPolarHBondContact CB-O 3.3Å; Q228-Y260 HydrophobicContact CG-CD2 4.1Å; Q228-Y260 HydrophobicContact CG-CG 4.33Å; Q228-Y260 PolarHBondContact N-O 3.14Å; Q228-Y260 VanDerWaalsContact NE2-CD2 3.28Å; Q228-Y260 PolarHBondContact O-N 3.03Å; V230-Y260 HydrophobicContact CB-CD2 4.47Å; V230-Y260 HydrophobicContact CB-CE2 4.18Å; V230-Y260 HydrophobicContact CG2-CD2 3.67Å; V230-Y260 HydrophobicContact CG2-CE2 3.61Å; V258-Y260 HydrophobicContact CG2-CE1 4.42Å; V258-Y260 HydrophobicContact CG2-CE2 4Å; V258-Y260 VanDerWaalsContact O-CD2 3.22Å; V258-Y260 WeakPolarHBondContact O-CD2 3.43Å; V258-Y260 VanDerWaalsContact O-CE2 3.25Å; V258-Y260 WeakPolarHBondContact O-CE2 3.24Å; Y260-A262 PolarHBondContact O-N 3.03Å
261	R	85.5	Confident	71.1	Confident	59 Å²	59	69.7 Å²	69.7	22%	0.223	36%	0.359	C	S	.	.	S	Bend	trans	-61.4	-29.1	178.5	-178.4	178.1	-66.2	-78.1	3.3	112.9	D166 R170 F172 G226 A227	D166-R261 PolarHBondContact O-NH2 2.88Å; D166-R261 IonicContact OD1-CZ 3.68Å; D166-R261 VanDerWaalsContact OD1-CZ 3.22Å; D166-R261 IonicContact OD1-NE 3.43Å; D166-R261 PolarHBondContact OD1-NE 3.05Å; D166-R261 IonicContact OD1-NH2 3.16Å; D166-R261 PolarHBondContact OD1-NH2 2.83Å; D166-R261 VanDerWaalsContact OD1-NH2 3.07Å; D166-R261 IonicContact OD2-CZ 3.49Å; D166-R261 IonicContact OD2-NE 2.76Å; D166-R261 IonicContact OD2-NH2 3.26Å; D166-R261 PolarHBondContact OD2-NH2 3.23Å; R170-R261 PolarHBondContact O-NH1 2.83Å; F172-R261 HydrophobicContact CD1-CB 3.86Å; F172-R261 HydrophobicContact CD1-CG 4.02Å; F172-R261 HydrophobicContact CE1-CB 3.74Å; F172-R261 HydrophobicContact CE1-CG 4.38Å; F172-R261 HydrophobicContact CE2-CB 4.45Å; F172-R261 HydrophobicContact CG-CB 4.29Å; F172-R261 HydrophobicContact CG-CG 4.39Å; F172-R261 HydrophobicContact CZ-CB 4.05Å; G226-R261 CarbonylContact C-O 3.6Å; A227-R261 WeakPolarHBondContact CA-O 3.37Å; A227-R261 PolarHBondContact N-O 2.93Å
262	A	85.5	Confident	70.9	Confident	70 Å²	70	72.3 Å²	72.3	58%	0.579	37%	0.373	S	S	*	.	S	Bend	trans	-116.6	133.5	177.7	0	0	0	0	0	109.7	G226 Y260	G226-A262 CarbonylContact O-C 3.51Å; G226-A262 VanDerWaalsContact O-CA 3.28Å; G226-A262 WeakPolarHBondContact O-CA 3.29Å; Y260-A262 PolarHBondContact O-N 3.03Å
263	H	87.2	Confident	70.8	Confident	12 Å²	12	73.8 Å²	73.8	6%	0.056	39%	0.388	C	S	.	.			trans	-77.6	140.8	175.1	-174.5	-86.7	0	0	0	110.2	S219 Q221 A222 G226 Q228 F265 G266	S219-H263 PolarHBondContact O-NE2 2.02Å; Q221-H263 VanDerWaalsContact C-CD2 3.47Å; Q221-H263 VanDerWaalsContact C-NE2 3.27Å; A222-H263 VanDerWaalsContact CA-CD2 3.46Å; A222-H263 WeakPolarHBondContact CA-CD2 3.31Å; A222-H263 HydrophobicContact CB-CB 3.43Å; A222-H263 VanDerWaalsContact CB-CB 3.43Å; A222-H263 PolarHBondContact N-CD2 2.98Å; A222-H263 VanDerWaalsContact N-CD2 3.34Å; A222-H263 PolarHBondContact N-NE2 3.37Å; G226-H263 WeakPolarHBondContact O-CB 3.49Å; G226-H263 PolarHBondContact O-N 3.48Å; Q228-H263 HydrophobicContact CB-CB 3.96Å; Q228-H263 WeakPolarHBondContact CB-CD2 3.15Å; H263-F265 AromaticContact CE1-CD2 3.41Å; H263-F265 VanDerWaalsContact CE1-CD2 3.41Å; H263-F265 WeakPolarHBondContact CE1-CD2 3.43Å; H263-F265 AromaticContact ND1-CD2 3.86Å; H263-F265 PolarHBondContact ND1-N 3.08Å; H263-F265 VanDerWaalsContact ND1-N 3.17Å; H263-F265 PolarHBondContact O-N 3.17Å; H263-F265 VanDerWaalsContact O-N 3.1Å; H263-G266 WeakPolarHBondContact CB-O 3.11Å; H263-G266 WeakPolarHBondContact O-CA 3.13Å; H263-G266 PolarHBondContact O-N 3.01Å
264	T	80.9	Confident	70.6	Confident	37 Å²	37	76.5 Å²	76.5	23%	0.227	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-20.5	-173	-48.8	0	0	0	0	112.3	R15 L197 Q228	R15-T264 PolarHBondContact NE-O 3.4Å; L197-T264 HydrophobicContact CD1-CG2 4.23Å; Q228-T264 VanDerWaalsContact CD-OG1 3.3Å; Q228-T264 PolarHBondContact NE2-OG1 3.33Å; Q228-T264 PolarHBondContact OE1-OG1 2.99Å
265	F	75.1	Confident	70.1	Confident	76 Å²	76	75 Å²	75	33%	0.333	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	12.6	174.4	-60.9	-97	0	0	0	113.6	P12 R15 M194 M218 H263	P12-F265 WeakPolarHBondContact CG-O 3.4Å; R15-F265 VanDerWaalsContact NH1-CD1 3.32Å; R15-F265 VanDerWaalsContact NH2-CE2 3.29Å; M194-F265 HydrophobicContact CE-CE2 3.71Å; M194-F265 HydrophobicContact CE-CZ 3.45Å; M194-F265 VanDerWaalsContact CE-CZ 3.45Å; M194-F265 HydrophobicContact SD-CD2 4.49Å; M194-F265 HydrophobicContact SD-CE2 3.39Å; M194-F265 WeakPolarHBondContact SD-CE2 3.38Å; M194-F265 HydrophobicContact SD-CZ 3.57Å; M194-F265 VanDerWaalsContact SD-CZ 3.57Å; M218-F265 HydrophobicContact CE-CD2 4.42Å; M218-F265 HydrophobicContact CE-CE2 3.46Å; M218-F265 VanDerWaalsContact CE-CE2 3.46Å; M218-F265 HydrophobicContact CE-CZ 4.12Å; M218-F265 HydrophobicContact SD-CE2 4.3Å; H263-F265 AromaticContact CE1-CD2 3.41Å; H263-F265 VanDerWaalsContact CE1-CD2 3.41Å; H263-F265 WeakPolarHBondContact CE1-CD2 3.43Å; H263-F265 AromaticContact ND1-CD2 3.86Å; H263-F265 PolarHBondContact ND1-N 3.08Å; H263-F265 VanDerWaalsContact ND1-N 3.17Å; H263-F265 PolarHBondContact O-N 3.17Å; H263-F265 VanDerWaalsContact O-N 3.1Å
266	G	72.4	Confident	69.3	Low	26 Å²	26	77 Å²	77	27%	0.268	43%	0.429	S	S	.	.			trans	83.7	-172.5	-176.5	0	0	0	0	0	113.3	A222 H263	A222-G266 WeakPolarHBondContact CB-O 2.87Å; H263-G266 WeakPolarHBondContact CB-O 3.11Å; H263-G266 WeakPolarHBondContact O-CA 3.13Å; H263-G266 PolarHBondContact O-N 3.01Å
267	S	68	Low	68.5	Low	75 Å²	75	79 Å²	79	52%	0.524	44%	0.441	S	S	.	.	S	Bend	trans	-85.6	164.7	-178.1	66.8	0	0	0	0	112.4
268	Y	62.4	Low	67.7	Low	93 Å²	93	83 Å²	83	37%	0.365	46%	0.458	S	S	.	.			trans	-46.7	130.2	172.7	-150	-120.4	0	0	0	112.4	F270	Y268-F270 AromaticContact CD1-CD1 3.82Å; Y268-F270 HydrophobicContact CD1-CD1 3.82Å; Y268-F270 HydrophobicContact CD1-CD2 4.04Å; Y268-F270 AromaticContact CD1-CE1 3.79Å; Y268-F270 HydrophobicContact CD1-CE1 3.79Å; Y268-F270 HydrophobicContact CD1-CE2 4.03Å; Y268-F270 AromaticContact CD1-CG 3.99Å; Y268-F270 HydrophobicContact CD1-CG 3.99Å; Y268-F270 AromaticContact CD1-CZ 3.94Å; Y268-F270 HydrophobicContact CD1-CZ 3.94Å; Y268-F270 WeakPolarHBondContact CD1-O 3.5Å; Y268-F270 AromaticContact CE1-CD1 3.61Å; Y268-F270 HydrophobicContact CE1-CD1 3.61Å; Y268-F270 AromaticContact CE1-CD2 3.77Å; Y268-F270 HydrophobicContact CE1-CD2 3.77Å; Y268-F270 AromaticContact CE1-CE1 3.08Å; Y268-F270 HydrophobicContact CE1-CE1 3.08Å; Y268-F270 AromaticContact CE1-CE2 3.29Å; Y268-F270 HydrophobicContact CE1-CE2 3.29Å; Y268-F270 AromaticContact CE1-CG 3.96Å; Y268-F270 HydrophobicContact CE1-CG 3.96Å; Y268-F270 AromaticContact CE1-CZ 2.95Å; Y268-F270 HydrophobicContact CE1-CZ 2.95Å; Y268-F270 HydrophobicContact CE2-CE1 4.42Å; Y268-F270 AromaticContact CZ-CE1 3.4Å; Y268-F270 VanDerWaalsContact CZ-CE1 3.4Å; Y268-F270 AromaticContact CZ-CZ 3.4Å; Y268-F270 VanDerWaalsContact CZ-CZ 3.4Å; Y268-F270 PolarHBondContact O-N 3.49Å; Y268-F270 VanDerWaalsContact O-N 3.09Å; Y268-F270 WeakPolarHBondContact OH-CE1 3.11Å; Y268-F270 WeakPolarHBondContact OH-CZ 3.02Å
269	P	53.4	Low	66.8	Low	126 Å²	126	83.2 Å²	83.2	82%	0.818	45%	0.454	S	S	*	.	S	Bend	trans	-68.1	-13.1	-169.9	23.5	-32.1	0	0	0	114
270	F	48.9	Very low	65.8	Low	122 Å²	122	86.3 Å²	86.3	54%	0.535	47%	0.467	S	S	.	.			trans	-124.7	121.8	175.1	58.4	-85.9	0	0	0	111.4	Y268	Y268-F270 AromaticContact CD1-CD1 3.82Å; Y268-F270 HydrophobicContact CD1-CD1 3.82Å; Y268-F270 HydrophobicContact CD1-CD2 4.04Å; Y268-F270 AromaticContact CD1-CE1 3.79Å; Y268-F270 HydrophobicContact CD1-CE1 3.79Å; Y268-F270 HydrophobicContact CD1-CE2 4.03Å; Y268-F270 AromaticContact CD1-CG 3.99Å; Y268-F270 HydrophobicContact CD1-CG 3.99Å; Y268-F270 AromaticContact CD1-CZ 3.94Å; Y268-F270 HydrophobicContact CD1-CZ 3.94Å; Y268-F270 WeakPolarHBondContact CD1-O 3.5Å; Y268-F270 AromaticContact CE1-CD1 3.61Å; Y268-F270 HydrophobicContact CE1-CD1 3.61Å; Y268-F270 AromaticContact CE1-CD2 3.77Å; Y268-F270 HydrophobicContact CE1-CD2 3.77Å; Y268-F270 AromaticContact CE1-CE1 3.08Å; Y268-F270 HydrophobicContact CE1-CE1 3.08Å; Y268-F270 AromaticContact CE1-CE2 3.29Å; Y268-F270 HydrophobicContact CE1-CE2 3.29Å; Y268-F270 AromaticContact CE1-CG 3.96Å; Y268-F270 HydrophobicContact CE1-CG 3.96Å; Y268-F270 AromaticContact CE1-CZ 2.95Å; Y268-F270 HydrophobicContact CE1-CZ 2.95Å; Y268-F270 HydrophobicContact CE2-CE1 4.42Å; Y268-F270 AromaticContact CZ-CE1 3.4Å; Y268-F270 VanDerWaalsContact CZ-CE1 3.4Å; Y268-F270 AromaticContact CZ-CZ 3.4Å; Y268-F270 VanDerWaalsContact CZ-CZ 3.4Å; Y268-F270 PolarHBondContact O-N 3.49Å; Y268-F270 VanDerWaalsContact O-N 3.09Å; Y268-F270 WeakPolarHBondContact OH-CE1 3.11Å; Y268-F270 WeakPolarHBondContact OH-CZ 3.02Å
271	R	46	Very low	64.6	Low	199 Å²	199	84.4 Å²	84.4	75%	0.751	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-94.2	140.6	164.6	-82.1	-161.5	-177	-115.8	3.7	110.3
272	I	51	Low	62.9	Low	111 Å²	111	91.6 Å²	91.6	57%	0.569	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-87.2	116.4	167.6	-58.7	172.6	0	0	0	107.3	Y274	I272-Y274 HydrophobicContact CB-CE2 4.35Å; I272-Y274 HydrophobicContact CG2-CD2 4.29Å; I272-Y274 HydrophobicContact CG2-CE1 4.2Å; I272-Y274 HydrophobicContact CG2-CE2 3.77Å
273	A	53.3	Low	62	Low	73 Å²	73	94.5 Å²	94.5	60%	0.603	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-94	122.2	172.2	0	0	0	0	0	109.5	F279	A273-F279 HydrophobicContact CB-CE1 4.17Å
274	Y	52.7	Low	61	Low	184 Å²	184	96 Å²	96	72%	0.722	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-94	122.2	173.3	-64.5	-86	0	0	0	109.3	I272	I272-Y274 HydrophobicContact CB-CE2 4.35Å; I272-Y274 HydrophobicContact CG2-CD2 4.29Å; I272-Y274 HydrophobicContact CG2-CE1 4.2Å; I272-Y274 HydrophobicContact CG2-CE2 3.77Å
275	G	58.7	Low	60.4	Low	74 Å²	74	95.8 Å²	95.8	76%	0.763	52%	0.523	S	S	*	.	S	Bend	trans	175.7	-178.9	-180	0	0	0	0	0	113.7
276	S	57.5	Low	60.2	Low	87 Å²	87	100.4 Å²	100.4	61%	0.608	54%	0.543	S	S	*	.	S	Bend	trans	-61.2	159.8	166.6	58.9	0	0	0	0	110.2	H278	S276-H278 PolarHBondContact O-N 2.86Å
277	T	61.7	Low	60	Low	47 Å²	47	102.9 Å²	102.9	29%	0.288	55%	0.545	S	S	.	.	S	Bend	trans	-70.8	37.9	-174.3	59.4	0	0	0	0	114.6	R288 F289 L313	T277-R288 CarbonylContact O-C 3.57Å; T277-R288 VanDerWaalsContact O-CA 3.32Å; T277-R288 WeakPolarHBondContact O-CA 3.47Å; T277-F289 WeakPolarHBondContact CB-O 3.45Å; T277-F289 PolarHBondContact O-N 2.87Å; T277-F289 PolarHBondContact OG1-O 3.29Å; T277-L313 HydrophobicContact CG2-CD1 4.45Å
278	H	64.3	Low	60.1	Low	93 Å²	93	108.7 Å²	108.7	43%	0.431	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.8	126.9	-176.8	-56.4	-19.8	0	0	0	110.1	S276 Y287 R288	S276-H278 PolarHBondContact O-N 2.86Å; H278-Y287 CarbonylContact C-O 3.55Å; H278-Y287 VanDerWaalsContact CA-O 3.25Å; H278-Y287 WeakPolarHBondContact CA-O 3.43Å; H278-R288 WeakPolarHBondContact CE1-CD 3.01Å; H278-R288 VanDerWaalsContact CE1-CG 3.4Å; H278-R288 WeakPolarHBondContact CE1-CG 3.5Å; H278-R288 PolarHBondContact CE1-NE 2.03Å; H278-R288 WeakPolarHBondContact ND1-CG 3.31Å
279	F	64.4	Low	60.4	Low	58 Å²	58	105 Å²	105	25%	0.254	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	145	179.2	-70.7	-99.2	0	0	0	110	A273 K286 Y287 F289 V311 L313	A273-F279 HydrophobicContact CB-CE1 4.17Å; F279-K286 CarbonylContact O-C 3.59Å; F279-K286 WeakPolarHBondContact O-CA 3.1Å; F279-Y287 PolarHBondContact N-O 3.29Å; F279-Y287 PolarHBondContact O-N 2.91Å; F279-F289 HydrophobicContact CB-CE2 4.32Å; F279-F289 AromaticContact CD2-CD2 3.62Å; F279-F289 HydrophobicContact CD2-CD2 3.62Å; F279-F289 AromaticContact CD2-CE2 3.46Å; F279-F289 HydrophobicContact CD2-CE2 3.46Å; F279-F289 VanDerWaalsContact CD2-CE2 3.46Å; F279-F289 AromaticContact CE2-CD2 3.97Å; F279-F289 HydrophobicContact CE2-CD2 3.97Å; F279-F289 HydrophobicContact CE2-CE2 4.07Å; F279-F289 HydrophobicContact CG-CE2 4.14Å; F279-V311 HydrophobicContact CZ-CG1 4.43Å; F279-L313 HydrophobicContact CE2-CD2 3.88Å; F279-L313 HydrophobicContact CZ-CD2 4.04Å
280	I	65.2	Low	61.1	Low	115 Å²	115	104.7 Å²	104.7	59%	0.59	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.5	124.4	171.6	-49.5	-175	0	0	0	107.6	A285 K286	I280-A285 VanDerWaalsContact CA-O 3.29Å; I280-A285 WeakPolarHBondContact CA-O 3.47Å; I280-K286 HydrophobicContact CD1-CG 4.34Å; I280-K286 HydrophobicContact CG1-CG 4.15Å
281	T	61.9	Low	62.1	Low	36 Å²	36	100.2 Å²	100.2	22%	0.221	53%	0.53	C	S	.	.			trans	-78.4	167.9	176.4	45.2	0	0	0	0	111.7	D283 G284 A285 Y287 L297	T281-D283 WeakPolarHBondContact CB-OD1 3.45Å; T281-D283 PolarHBondContact O-N 3.18Å; T281-D283 VanDerWaalsContact O-N 3.16Å; T281-D283 PolarHBondContact OG1-OD1 3.27Å; T281-G284 WeakPolarHBondContact O-CA 3.44Å; T281-G284 PolarHBondContact O-N 2.81Å; T281-A285 PolarHBondContact N-O 3.43Å; T281-A285 VanDerWaalsContact OG1-CB 3.28Å; T281-A285 WeakPolarHBondContact OG1-CB 3.16Å; T281-A285 PolarHBondContact OG1-N 2.82Å; T281-A285 PolarHBondContact OG1-O 3.42Å; T281-Y287 HydrophobicContact CG2-CD2 4.09Å; T281-Y287 HydrophobicContact CG2-CE2 3.57Å; T281-L297 HydrophobicContact CG2-CD2 4.21Å; T281-L297 HydrophobicContact CG2-CG 4.41Å
282	F	51.5	Low	63.2	Low	210 Å²	210	97.1 Å²	97.1	92%	0.921	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-23.6	-178.5	-71.5	-69.5	0	0	0	114.2	G284	F282-G284 VanDerWaalsContact C-N 3.32Å
283	D	65.8	Low	64.2	Low	131 Å²	131	93.1 Å²	93.1	70%	0.701	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	4.7	173.6	66.1	-23.2	0	0	0	113.4	T281 A285	T281-D283 WeakPolarHBondContact CB-OD1 3.45Å; T281-D283 PolarHBondContact O-N 3.18Å; T281-D283 VanDerWaalsContact O-N 3.16Å; T281-D283 PolarHBondContact OG1-OD1 3.27Å; D283-A285 PolarHBondContact OD1-N 3.16Å
284	G	65.3	Low	65.2	Low	43 Å²	43	96.4 Å²	96.4	44%	0.443	51%	0.506	S	S	.	.			trans	85.5	4.1	176.7	0	0	0	0	0	115.3	T281 F282	T281-G284 WeakPolarHBondContact O-CA 3.44Å; T281-G284 PolarHBondContact O-N 2.81Å; F282-G284 VanDerWaalsContact C-N 3.32Å
285	A	68.7	Low	66.1	Low	33 Å²	33	90.3 Å²	90.3	27%	0.273	48%	0.482	S	S	.	.			trans	-69.8	133	178.4	0	0	0	0	0	111.4	I280 T281 D283 Y287	I280-A285 VanDerWaalsContact CA-O 3.29Å; I280-A285 WeakPolarHBondContact CA-O 3.47Å; T281-A285 PolarHBondContact N-O 3.43Å; T281-A285 VanDerWaalsContact OG1-CB 3.28Å; T281-A285 WeakPolarHBondContact OG1-CB 3.16Å; T281-A285 PolarHBondContact OG1-N 2.82Å; T281-A285 PolarHBondContact OG1-O 3.42Å; D283-A285 PolarHBondContact OD1-N 3.16Å; A285-Y287 HydrophobicContact CB-CE2 3.94Å
286	K	72.3	Confident	66.8	Low	173 Å²	173	90.2 Å²	90.2	75%	0.752	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102	123.7	-174.6	-60.1	-174.3	179.4	176.4	0	110.9	F279 I280	F279-K286 CarbonylContact O-C 3.59Å; F279-K286 WeakPolarHBondContact O-CA 3.1Å; I280-K286 HydrophobicContact CD1-CG 4.34Å; I280-K286 HydrophobicContact CG1-CG 4.15Å
287	Y	68.1	Low	67.2	Low	78 Å²	78	87.6 Å²	87.6	31%	0.306	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	138.1	176.9	-64.4	-92.6	0	0	0	110.4	H278 F279 T281 A285 F289 L297	H278-Y287 CarbonylContact C-O 3.55Å; H278-Y287 VanDerWaalsContact CA-O 3.25Å; H278-Y287 WeakPolarHBondContact CA-O 3.43Å; F279-Y287 PolarHBondContact N-O 3.29Å; F279-Y287 PolarHBondContact O-N 2.91Å; T281-Y287 HydrophobicContact CG2-CD2 4.09Å; T281-Y287 HydrophobicContact CG2-CE2 3.57Å; A285-Y287 HydrophobicContact CB-CE2 3.94Å; Y287-F289 HydrophobicContact CD1-CZ 4.38Å; Y287-F289 HydrophobicContact CG-CZ 4.29Å; Y287-L297 HydrophobicContact CD1-CD1 4.37Å; Y287-L297 HydrophobicContact CD2-CD1 3.9Å; Y287-L297 HydrophobicContact CE2-CD1 4.2Å; Y287-L297 HydrophobicContact CG-CD1 3.99Å; Y287-L297 PolarHBondContact OH-O 3.32Å
288	R	69.7	Low	67.5	Low	196 Å²	196	88.3 Å²	88.3	74%	0.74	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.7	125.3	171.5	175.1	166.6	-170.5	172.9	10.8	109.1	T277 H278	T277-R288 CarbonylContact O-C 3.57Å; T277-R288 VanDerWaalsContact O-CA 3.32Å; T277-R288 WeakPolarHBondContact O-CA 3.47Å; H278-R288 WeakPolarHBondContact CE1-CD 3.01Å; H278-R288 VanDerWaalsContact CE1-CG 3.4Å; H278-R288 WeakPolarHBondContact CE1-CG 3.5Å; H278-R288 PolarHBondContact CE1-NE 2.03Å; H278-R288 WeakPolarHBondContact ND1-CG 3.31Å
289	F	68.4	Low	67.6	Low	16 Å²	16	89 Å²	89	7%	0.07	45%	0.454	C	S	.	.			trans	-109.6	149.1	-178.9	-57.4	-75.2	0	0	0	111.2	T277 F279 Y287 G291 Y295 L297 L313	T277-F289 WeakPolarHBondContact CB-O 3.45Å; T277-F289 PolarHBondContact O-N 2.87Å; T277-F289 PolarHBondContact OG1-O 3.29Å; F279-F289 HydrophobicContact CB-CE2 4.32Å; F279-F289 AromaticContact CD2-CD2 3.62Å; F279-F289 HydrophobicContact CD2-CD2 3.62Å; F279-F289 AromaticContact CD2-CE2 3.46Å; F279-F289 HydrophobicContact CD2-CE2 3.46Å; F279-F289 VanDerWaalsContact CD2-CE2 3.46Å; F279-F289 AromaticContact CE2-CD2 3.97Å; F279-F289 HydrophobicContact CE2-CD2 3.97Å; F279-F289 HydrophobicContact CE2-CE2 4.07Å; F279-F289 HydrophobicContact CG-CE2 4.14Å; Y287-F289 HydrophobicContact CD1-CZ 4.38Å; Y287-F289 HydrophobicContact CG-CZ 4.29Å; F289-G291 VanDerWaalsContact C-N 3.35Å; F289-G291 PolarHBondContact O-N 2.77Å; F289-Y295 HydrophobicContact CB-CD2 4.27Å; F289-Y295 HydrophobicContact CB-CE1 4.34Å; F289-Y295 HydrophobicContact CB-CE2 4.09Å; F289-Y295 HydrophobicContact CB-CG 4.48Å; F289-Y295 AromaticContact CD1-CD1 3.48Å; F289-Y295 HydrophobicContact CD1-CD1 3.48Å; F289-Y295 VanDerWaalsContact CD1-CD1 3.48Å; F289-Y295 AromaticContact CD1-CD2 3.89Å; F289-Y295 HydrophobicContact CD1-CD2 3.89Å; F289-Y295 HydrophobicContact CD1-CE1 4.08Å; F289-Y295 HydrophobicContact CD1-CE2 4.44Å; F289-Y295 AromaticContact CD1-CG 3.36Å; F289-Y295 HydrophobicContact CD1-CG 3.36Å; F289-Y295 VanDerWaalsContact CE1-CB 3.46Å; F289-Y295 HydrophobicContact CE1-CD1 4.13Å; F289-Y295 AromaticContact CE1-CG 3.82Å; F289-Y295 HydrophobicContact CE1-CG 3.82Å; F289-Y295 HydrophobicContact CG-CD1 4.4Å; F289-Y295 HydrophobicContact CG-CD2 4.22Å; F289-Y295 HydrophobicContact CG-CG 4.14Å; F289-L297 HydrophobicContact CE2-CD1 4.39Å; F289-L297 HydrophobicContact CZ-CD1 3.9Å; F289-L313 HydrophobicContact CB-CD1 3.25Å; F289-L313 HydrophobicContact CD2-CD1 3.95Å; F289-L313 HydrophobicContact CG-CD1 3.73Å
290	S	68.3	Low	67.8	Low	120 Å²	120	88.3 Å²	88.3	84%	0.839	46%	0.457	S	S	*	.			trans	-92.3	25.9	-169.9	-58.3	0	0	0	0	114.9
291	G	68.5	Low	68.3	Low	27 Å²	27	87 Å²	87	28%	0.278	46%	0.455	S	S	.	.	S	Bend	trans	118	-143.4	177.4	0	0	0	0	0	113.2	F289 Y295 L313	F289-G291 VanDerWaalsContact C-N 3.35Å; F289-G291 PolarHBondContact O-N 2.77Å; G291-Y295 WeakPolarHBondContact O-CE2 3.23Å; G291-Y295 PolarHBondContact O-OH 3.05Å; G291-L313 VanDerWaalsContact O-CB 3.26Å; G291-L313 WeakPolarHBondContact O-CB 3.38Å; G291-L313 WeakPolarHBondContact O-CD1 3.39Å
292	K	70.1	Confident	68.6	Low	135 Å²	135	89.3 Å²	89.3	59%	0.587	46%	0.463	S	S	*	.	S	Bend	trans	-71.1	140.8	-175.6	-59.2	-179.5	-174.9	-179.6	0	111.2	L313 Q315	K292-L313 CarbonylContact C-O 3.4Å; K292-L313 VanDerWaalsContact CA-O 3.28Å; K292-L313 WeakPolarHBondContact CA-O 3.38Å; K292-Q315 HydrophobicContact CG-CG 4.37Å
293	G	71.6	Confident	69.6	Low	27 Å²	27	85 Å²	85	28%	0.278	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	147.8	-173.2	174.2	0	0	0	0	0	113.6	R312 L313	G293-R312 WeakPolarHBondContact O-CA 3.16Å; G293-L313 PolarHBondContact N-O 3.12Å; G293-L313 PolarHBondContact O-N 3.45Å
294	Y	75.4	Confident	69.7	Low	141 Å²	141	86.1 Å²	86.1	55%	0.553	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	132.9	173.1	-63.5	-83.8	0	0	0	109.5	V311 R312	Y294-V311 CarbonylContact C-O 3.58Å; Y294-V311 WeakPolarHBondContact CA-O 3.12Å; Y294-R312 HydrophobicContact CD1-CB 3.75Å; Y294-R312 HydrophobicContact CD1-CG 3.86Å; Y294-R312 HydrophobicContact CE1-CB 3.77Å; Y294-R312 VanDerWaalsContact CE1-CD 3.48Å; Y294-R312 HydrophobicContact CE1-CG 3.58Å; Y294-R312 PolarHBondContact OH-NH1 2.92Å
295	Y	70.8	Confident	69.5	Low	56 Å²	56	90.1 Å²	90.1	22%	0.22	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	139	-178.1	-60	-85.1	0	0	0	109.8	F289 G291 Q310 V311 L313	F289-Y295 HydrophobicContact CB-CD2 4.27Å; F289-Y295 HydrophobicContact CB-CE1 4.34Å; F289-Y295 HydrophobicContact CB-CE2 4.09Å; F289-Y295 HydrophobicContact CB-CG 4.48Å; F289-Y295 AromaticContact CD1-CD1 3.48Å; F289-Y295 HydrophobicContact CD1-CD1 3.48Å; F289-Y295 VanDerWaalsContact CD1-CD1 3.48Å; F289-Y295 AromaticContact CD1-CD2 3.89Å; F289-Y295 HydrophobicContact CD1-CD2 3.89Å; F289-Y295 HydrophobicContact CD1-CE1 4.08Å; F289-Y295 HydrophobicContact CD1-CE2 4.44Å; F289-Y295 AromaticContact CD1-CG 3.36Å; F289-Y295 HydrophobicContact CD1-CG 3.36Å; F289-Y295 VanDerWaalsContact CE1-CB 3.46Å; F289-Y295 HydrophobicContact CE1-CD1 4.13Å; F289-Y295 AromaticContact CE1-CG 3.82Å; F289-Y295 HydrophobicContact CE1-CG 3.82Å; F289-Y295 HydrophobicContact CG-CD1 4.4Å; F289-Y295 HydrophobicContact CG-CD2 4.22Å; F289-Y295 HydrophobicContact CG-CG 4.14Å; G291-Y295 WeakPolarHBondContact O-CE2 3.23Å; G291-Y295 PolarHBondContact O-OH 3.05Å; Y295-Q310 CarbonylContact O-C 3.59Å; Y295-Q310 WeakPolarHBondContact O-CA 3.43Å; Y295-Q310 WeakPolarHBondContact O-CG 3.22Å; Y295-V311 PolarHBondContact N-O 3.39Å; Y295-V311 PolarHBondContact O-N 3.37Å; Y295-L313 HydrophobicContact CD2-CB 4.43Å; Y295-L313 HydrophobicContact CD2-CD1 3.76Å; Y295-L313 HydrophobicContact CD2-CG 3.9Å; Y295-L313 HydrophobicContact CE2-CB 4.13Å; Y295-L313 HydrophobicContact CE2-CD1 3.58Å; Y295-L313 HydrophobicContact CE2-CG 3.95Å
296	V	72.9	Confident	68.9	Low	73 Å²	73	95.7 Å²	95.7	44%	0.442	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	118.2	172.6	-179.2	0	0	0	0	108.2	M299 M308	V296-M299 HydrophobicContact CG1-CB 3.86Å; V296-M308 HydrophobicContact CG1-CG 3.89Å; V296-M308 HydrophobicContact CG2-CG 4.46Å; V296-M308 HydrophobicContact CG2-SD 4.25Å
297	L	67.2	Low	68.6	Low	31 Å²	31	90.6 Å²	90.6	16%	0.162	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	-47.3	-179.2	-172.7	76.6	0	0	0	111.3	T281 Y287 F289 V309 V311	T281-L297 HydrophobicContact CG2-CD2 4.21Å; T281-L297 HydrophobicContact CG2-CG 4.41Å; Y287-L297 HydrophobicContact CD1-CD1 4.37Å; Y287-L297 HydrophobicContact CD2-CD1 3.9Å; Y287-L297 HydrophobicContact CE2-CD1 4.2Å; Y287-L297 HydrophobicContact CG-CD1 3.99Å; Y287-L297 PolarHBondContact OH-O 3.32Å; F289-L297 HydrophobicContact CE2-CD1 4.39Å; F289-L297 HydrophobicContact CZ-CD1 3.9Å; L297-V309 HydrophobicContact CB-CB 4.35Å; L297-V309 HydrophobicContact CB-CG1 4.18Å; L297-V309 WeakPolarHBondContact CB-O 3.17Å; L297-V309 HydrophobicContact CD2-CG1 4.01Å; L297-V309 PolarHBondContact N-O 3.14Å; L297-V311 HydrophobicContact CB-CG2 4.03Å; L297-V311 HydrophobicContact CD1-CG2 4.39Å; L297-V311 HydrophobicContact CD2-CG2 4.44Å
298	T	67.2	Low	68.5	Low	63 Å²	63	92.1 Å²	92.1	39%	0.387	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	144	171.6	-174.3	0	0	0	0	109.7	L307 M308 V309	T298-L307 HydrophobicContact CG2-CD2 4.14Å; T298-M308 CarbonylContact O-C 3.54Å; T298-M308 WeakPolarHBondContact O-CA 3.35Å; T298-V309 HydrophobicContact CG2-CB 3.73Å; T298-V309 HydrophobicContact CG2-CG2 3.53Å; T298-V309 PolarHBondContact N-O 3Å; T298-V309 PolarHBondContact O-N 3.13Å
299	M	67	Low	68.4	Low	106 Å²	106	85.2 Å²	85.2	52%	0.522	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	119	174.2	-175.7	-171.2	63.1	0	0	109.4	V296 T301 L307 M308	V296-M299 HydrophobicContact CG1-CB 3.86Å; M299-T301 HydrophobicContact CE-CG2 3.68Å; M299-T301 HydrophobicContact CG-CG2 4.38Å; M299-T301 HydrophobicContact SD-CG2 4.17Å; M299-L307 CarbonylContact C-O 3.57Å; M299-L307 WeakPolarHBondContact CA-O 3.19Å; M299-M308 HydrophobicContact CG-CB 4.48Å; M299-M308 HydrophobicContact CG-CE 4.11Å; M299-M308 HydrophobicContact SD-CE 3.74Å
300	S	67.2	Low	68.4	Low	44 Å²	44	89.6 Å²	89.6	31%	0.308	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	130.3	165	176.5	0	0	0	0	109.4	H302 H305 R306 L307	S300-H302 PolarHBondContact OG-N 2.71Å; S300-H305 VanDerWaalsContact CB-O 3.28Å; S300-H305 WeakPolarHBondContact CB-O 3.48Å; S300-H305 PolarHBondContact OG-O 3.27Å; S300-R306 VanDerWaalsContact O-CA 3.23Å; S300-R306 WeakPolarHBondContact O-CA 3.31Å; S300-L307 PolarHBondContact N-O 3.13Å; S300-L307 PolarHBondContact O-N 2.85Å
301	T	76.3	Confident	68.3	Low	89 Å²	89	85.1 Å²	85.1	55%	0.546	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	5.1	174.8	55.2	0	0	0	0	112.9	M299 R306	M299-T301 HydrophobicContact CE-CG2 3.68Å; M299-T301 HydrophobicContact CG-CG2 4.38Å; M299-T301 HydrophobicContact SD-CG2 4.17Å; T301-R306 PolarHBondContact O-NE 3.19Å
302	H	68	Low	68.3	Low	84 Å²	84	90.9 Å²	90.9	39%	0.389	45%	0.45	S	S	.	.			trans	-51.4	133.8	-176.5	-172.2	-94.1	0	0	0	111.2	S300 Q304 H305 R306	S300-H302 PolarHBondContact OG-N 2.71Å; H302-Q304 PolarHBondContact ND1-N 3.31Å; H302-Q304 PolarHBondContact O-N 3.39Å; H302-H305 HydrophobicContact CB-CB 4.14Å; H302-H305 WeakPolarHBondContact CB-O 3.36Å; H302-H305 AromaticContact CE1-CD2 3.89Å; H302-H305 AromaticContact ND1-CD2 3.56Å; H302-H305 AromaticContact ND1-CG 4Å; H302-H305 PolarHBondContact ND1-N 3.11Å; H302-H305 CarbonylContact O-C 3.23Å; H302-H305 PolarHBondContact O-N 2.78Å; H302-H305 VanDerWaalsContact O-N 3.08Å; H302-R306 WeakPolarHBondContact O-CG 3.46Å; H302-R306 PolarHBondContact O-N 3Å
303	P	73.2	Confident	68.2	Low	118 Å²	118	85.7 Å²	85.7	77%	0.766	43%	0.429	S	S	*	.	S	Bend	trans	-55.3	-32.5	-173.9	-25.7	33.2	0	0	0	114.3
304	Q	68.5	Low	67.9	Low	155 Å²	155	90.1 Å²	90.1	72%	0.724	44%	0.443	S	S	*	.	S	Bend	trans	-100.8	-17.7	179.7	-63.4	174.4	-32.5	0	0	113.8	H302	H302-Q304 PolarHBondContact ND1-N 3.31Å; H302-Q304 PolarHBondContact O-N 3.39Å
305	H	59.8	Low	67.5	Low	128 Å²	128	89.7 Å²	89.7	59%	0.593	45%	0.446	S	S	*	.			trans	-137.7	67.4	-171.3	-58.3	-57.3	0	0	0	109.9	S300 H302	S300-H305 VanDerWaalsContact CB-O 3.28Å; S300-H305 WeakPolarHBondContact CB-O 3.48Å; S300-H305 PolarHBondContact OG-O 3.27Å; H302-H305 HydrophobicContact CB-CB 4.14Å; H302-H305 WeakPolarHBondContact CB-O 3.36Å; H302-H305 AromaticContact CE1-CD2 3.89Å; H302-H305 AromaticContact ND1-CD2 3.56Å; H302-H305 AromaticContact ND1-CG 4Å; H302-H305 PolarHBondContact ND1-N 3.11Å; H302-H305 CarbonylContact O-C 3.23Å; H302-H305 PolarHBondContact O-N 2.78Å; H302-H305 VanDerWaalsContact O-N 3.08Å
306	R	57	Low	66.9	Low	150 Å²	150	91.6 Å²	91.6	57%	0.566	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	127.1	174.7	-65.7	-169.4	161.4	179.1	-5.1	109.8	S300 T301 H302	S300-R306 VanDerWaalsContact O-CA 3.23Å; S300-R306 WeakPolarHBondContact O-CA 3.31Å; T301-R306 PolarHBondContact O-NE 3.19Å; H302-R306 WeakPolarHBondContact O-CG 3.46Å; H302-R306 PolarHBondContact O-N 3Å
307	L	65.2	Low	66.4	Low	66 Å²	66	94.6 Å²	94.6	35%	0.346	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	140.6	179.2	176.9	65.5	0	0	0	107.6	L8 T298 M299 S300 V309	L8-L307 HydrophobicContact CD2-CD1 4.5Å; T298-L307 HydrophobicContact CG2-CD2 4.14Å; M299-L307 CarbonylContact C-O 3.57Å; M299-L307 WeakPolarHBondContact CA-O 3.19Å; S300-L307 PolarHBondContact N-O 3.13Å; S300-L307 PolarHBondContact O-N 2.85Å; L307-V309 HydrophobicContact CD1-CG2 4.21Å; L307-V309 HydrophobicContact CD2-CG2 4.43Å; L307-V309 HydrophobicContact CG-CG2 4.27Å
308	M	66.6	Low	65.4	Low	109 Å²	109	102.4 Å²	102.4	54%	0.537	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	119.3	165.2	-175.4	-176.5	-69.7	0	0	108.2	V296 T298 M299	V296-M308 HydrophobicContact CG1-CG 3.89Å; V296-M308 HydrophobicContact CG2-CG 4.46Å; V296-M308 HydrophobicContact CG2-SD 4.25Å; T298-M308 CarbonylContact O-C 3.54Å; T298-M308 WeakPolarHBondContact O-CA 3.35Å; M299-M308 HydrophobicContact CG-CB 4.48Å; M299-M308 HydrophobicContact CG-CE 4.11Å; M299-M308 HydrophobicContact SD-CE 3.74Å
309	V	67.4	Low	64.6	Low	52 Å²	52	105.1 Å²	105.1	32%	0.315	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	117.4	171.5	-178.9	0	0	0	0	107	L297 T298 L307	L297-V309 HydrophobicContact CB-CB 4.35Å; L297-V309 HydrophobicContact CB-CG1 4.18Å; L297-V309 WeakPolarHBondContact CB-O 3.17Å; L297-V309 HydrophobicContact CD2-CG1 4.01Å; L297-V309 PolarHBondContact N-O 3.14Å; T298-V309 HydrophobicContact CG2-CB 3.73Å; T298-V309 HydrophobicContact CG2-CG2 3.53Å; T298-V309 PolarHBondContact N-O 3Å; T298-V309 PolarHBondContact O-N 3.13Å; L307-V309 HydrophobicContact CD1-CG2 4.21Å; L307-V309 HydrophobicContact CD2-CG2 4.43Å; L307-V309 HydrophobicContact CG-CG2 4.27Å
310	Q	67.5	Low	63.2	Low	107 Å²	107	108 Å²	108	50%	0.5	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	145	178.9	-170.8	174.4	-63.6	0	0	110.4	Y295	Y295-Q310 CarbonylContact O-C 3.59Å; Y295-Q310 WeakPolarHBondContact O-CA 3.43Å; Y295-Q310 WeakPolarHBondContact O-CG 3.22Å
311	V	68	Low	61.5	Low	26 Å²	26	112 Å²	112	16%	0.158	57%	0.57	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-118	132.6	173.4	176.9	0	0	0	0	108.1	F279 Y294 Y295 L297 L313	F279-V311 HydrophobicContact CZ-CG1 4.43Å; Y294-V311 CarbonylContact C-O 3.58Å; Y294-V311 WeakPolarHBondContact CA-O 3.12Å; Y295-V311 PolarHBondContact N-O 3.39Å; Y295-V311 PolarHBondContact O-N 3.37Å; L297-V311 HydrophobicContact CB-CG2 4.03Å; L297-V311 HydrophobicContact CD1-CG2 4.39Å; L297-V311 HydrophobicContact CD2-CG2 4.44Å; V311-L313 HydrophobicContact CG1-CD2 3.61Å; V311-L313 HydrophobicContact CG1-CG 4.1Å
312	R	66.9	Low	59.5	Low	148 Å²	148	116.4 Å²	116.4	56%	0.558	60%	0.597	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.2	125.8	167.9	-179.7	-177.7	166.8	161.5	-14.6	108.3	G293 Y294 E314	G293-R312 WeakPolarHBondContact O-CA 3.16Å; Y294-R312 HydrophobicContact CD1-CB 3.75Å; Y294-R312 HydrophobicContact CD1-CG 3.86Å; Y294-R312 HydrophobicContact CE1-CB 3.77Å; Y294-R312 VanDerWaalsContact CE1-CD 3.48Å; Y294-R312 HydrophobicContact CE1-CG 3.58Å; Y294-R312 PolarHBondContact OH-NH1 2.92Å; R312-E314 IonicContact CZ-OE2 3.03Å; R312-E314 IonicContact NE-OE2 3.46Å; R312-E314 PolarHBondContact NE-OE2 3.36Å; R312-E314 VanDerWaalsContact NE-OE2 3.09Å; R312-E314 IonicContact NH2-OE2 3.81Å; R312-E314 PolarHBondContact NH2-OE2 3.43Å
313	L	67.9	Low	59.1	Low	26 Å²	26	118 Å²	118	14%	0.136	61%	0.608	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.3	127	173.9	-59.5	-175.2	0	0	0	109.6	T277 F279 F289 G291 K292 G293 Y295 V311	T277-L313 HydrophobicContact CG2-CD1 4.45Å; F279-L313 HydrophobicContact CE2-CD2 3.88Å; F279-L313 HydrophobicContact CZ-CD2 4.04Å; F289-L313 HydrophobicContact CB-CD1 3.25Å; F289-L313 HydrophobicContact CD2-CD1 3.95Å; F289-L313 HydrophobicContact CG-CD1 3.73Å; G291-L313 VanDerWaalsContact O-CB 3.26Å; G291-L313 WeakPolarHBondContact O-CB 3.38Å; G291-L313 WeakPolarHBondContact O-CD1 3.39Å; K292-L313 CarbonylContact C-O 3.4Å; K292-L313 VanDerWaalsContact CA-O 3.28Å; K292-L313 WeakPolarHBondContact CA-O 3.38Å; G293-L313 PolarHBondContact N-O 3.12Å; G293-L313 PolarHBondContact O-N 3.45Å; Y295-L313 HydrophobicContact CD2-CB 4.43Å; Y295-L313 HydrophobicContact CD2-CD1 3.76Å; Y295-L313 HydrophobicContact CD2-CG 3.9Å; Y295-L313 HydrophobicContact CE2-CB 4.13Å; Y295-L313 HydrophobicContact CE2-CD1 3.58Å; Y295-L313 HydrophobicContact CE2-CG 3.95Å; V311-L313 HydrophobicContact CG1-CD2 3.61Å; V311-L313 HydrophobicContact CG1-CG 4.1Å
314	E	66.4	Low	58.4	Low	121 Å²	121	118 Å²	118	57%	0.565	60%	0.6	S	S	*	*			trans	-136	154.2	173.6	58.9	-171.4	-159.4	0	0	109.9	R312	R312-E314 IonicContact CZ-OE2 3.03Å; R312-E314 IonicContact NE-OE2 3.46Å; R312-E314 PolarHBondContact NE-OE2 3.36Å; R312-E314 VanDerWaalsContact NE-OE2 3.09Å; R312-E314 IonicContact NH2-OE2 3.81Å; R312-E314 PolarHBondContact NH2-OE2 3.43Å
315	Q	66.1	Low	57.8	Low	132 Å²	132	115.9 Å²	115.9	62%	0.617	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-85.2	136.9	166.8	-72.8	173.7	-25.7	0	0	106.9	K292 V317	K292-Q315 HydrophobicContact CG-CG 4.37Å; Q315-V317 PolarHBondContact O-N 3.03Å
316	P	59.8	Low	57.7	Low	96 Å²	96	115.2 Å²	115.2	62%	0.623	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-54.1	142.8	165.6	22.9	-29.8	0	0	0	108.4	K318	P316-K318 PolarHBondContact O-N 3.01Å
317	V	60.4	Low	57.7	Low	135 Å²	135	113.1 Å²	113.1	82%	0.818	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-51.2	131.3	173.3	-167.7	0	0	0	0	106.7	Q315 T319	Q315-V317 PolarHBondContact O-N 3.03Å; V317-T319 VanDerWaalsContact C-N 3.33Å; V317-T319 PolarHBondContact O-N 3.37Å
318	K	46.7	Very low	57.3	Low	196 Å²	196	116.2 Å²	116.2	85%	0.852	61%	0.611	S	S	*	*			trans	-56.4	107.2	167.8	-81.1	-175.3	176.5	-177.7	0	105.4	P316 Q320	P316-K318 PolarHBondContact O-N 3.01Å; K318-Q320 PolarHBondContact O-N 2.89Å
319	T	50.1	Low	56.6	Low	119 Å²	119	116.7 Å²	116.7	73%	0.73	62%	0.616	S	S	*	*			trans	-54.8	118.9	161.1	35.7	0	0	0	0	104.7	V317 C321	V317-T319 VanDerWaalsContact C-N 3.33Å; V317-T319 PolarHBondContact O-N 3.37Å; T319-C321 VanDerWaalsContact C-N 3.26Å; T319-C321 PolarHBondContact O-N 2.85Å
320	Q	38.2	Very low	55.8	Low	168 Å²	168	121.7 Å²	121.7	79%	0.785	64%	0.639	S	S	*	*			trans	-59.7	104.6	164.4	-73.3	-178	-11.4	0	0	104.6	K318 T322	K318-Q320 PolarHBondContact O-N 2.89Å; Q320-T322 PolarHBondContact O-N 2.91Å
321	C	32	Very low	54.8	Low	126 Å²	126	122.9 Å²	122.9	85%	0.851	65%	0.651	S	S	*	*			trans	-68.8	85.5	156.6	-66.1	0	0	0	0	105.6	T319	T319-C321 VanDerWaalsContact C-N 3.26Å; T319-C321 PolarHBondContact O-N 2.85Å
322	T	34.9	Very low	53.6	Low	182 Å²	182	131.7 Å²	131.7	100%	1.117	70%	0.696	S	S	*	*			trans	-136.1	0	163.6	42.9	0	0	0	0	107.3	Q320	Q320-T322 PolarHBondContact O-N 2.91Å

Retrieved 322 of 322 residues in 612.5 ms (Link to these results)

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