A0A3B3VII7_9TELE Loading...

Chromosome 14 open reading frame 28

AlphaFold DB , UniProt , Accession A0A3B3VII7, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 339 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	29.5	Very low	32.5	Very low	238 Å²	238	125.9 Å²	125.9	100%	1.172	65%	0.651	S	S	*	*				0	60.2	0	-170.2	-176.5	-94.2	0	0	107.7
2	E	25.2	Very low	33.8	Very low	181 Å²	181	121.6 Å²	121.6	85%	0.846	63%	0.629	S	S	*	*			trans	-127.5	3.1	-166.6	-76.4	176.3	146.9	0	0	113.3
3	S	25.2	Very low	34.7	Very low	113 Å²	113	119.4 Å²	119.4	79%	0.79	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	7.2	-172	65.7	0	0	0	0	115.8
4	R	30.3	Very low	35.9	Very low	229 Å²	229	117.7 Å²	117.7	86%	0.864	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	-6.5	179.9	-74.7	-170.8	179	-175.1	0.2	115
5	F	30.2	Very low	36.8	Very low	169 Å²	169	112.4 Å²	112.4	74%	0.741	58%	0.575	S	S	*	*	S	Bend	trans	-96.2	-16.5	-177.4	-77.8	-79.6	0	0	0	114.3	G7	F5-G7 VanDerWaalsContact C-N 3.31Å; F5-G7 PolarHBondContact O-N 2.82Å
6	S	28.2	Very low	37.4	Very low	80 Å²	80	107.8 Å²	107.8	56%	0.559	56%	0.556	S	S	*	*	H	α-helix	trans	-80	-10.5	178	109.5	0	0	0	0	113.7	N10	S6-N10 PolarHBondContact O-ND2 3.19Å
7	G	30.7	Very low	37.8	Very low	30 Å²	30	110.8 Å²	110.8	31%	0.309	56%	0.559	S	S	.	*	H	α-helix	trans	-76.2	-38	176.7	0	0	0	0	0	112.8	F5 L9 N10 D11	F5-G7 VanDerWaalsContact C-N 3.31Å; F5-G7 PolarHBondContact O-N 2.82Å; G7-L9 PolarHBondContact O-N 3.25Å; G7-N10 WeakPolarHBondContact O-CB 3.29Å; G7-N10 PolarHBondContact O-N 3.24Å; G7-N10 VanDerWaalsContact O-N 3.12Å; G7-D11 VanDerWaalsContact O-CG 3.25Å; G7-D11 PolarHBondContact O-N 2.84Å
8	V	38.4	Very low	38.2	Very low	69 Å²	69	110 Å²	110	42%	0.418	56%	0.556	S	S	.	*	H	α-helix	trans	-69.1	-35.7	-172.7	-177.5	0	0	0	0	112.7	I12	V8-I12 WeakPolarHBondContact O-CG1 3.42Å; V8-I12 PolarHBondContact O-N 3.26Å
9	L	35.9	Very low	38.5	Very low	110 Å²	110	105.7 Å²	105.7	58%	0.576	54%	0.537	S	S	*	.	H	α-helix	trans	-69.4	-36	172.8	-90.9	152.1	0	0	0	111.9	G7 E13	G7-L9 PolarHBondContact O-N 3.25Å; L9-E13 PolarHBondContact O-N 2.82Å
10	N	36.5	Very low	38.6	Very low	92 Å²	92	106.7 Å²	106.7	49%	0.492	54%	0.544	S	S	.	.	H	α-helix	trans	-68.9	-33.8	176.4	-76.7	-13.6	0	0	0	112.1	S6 G7 E13 E14	S6-N10 PolarHBondContact O-ND2 3.19Å; G7-N10 WeakPolarHBondContact O-CB 3.29Å; G7-N10 PolarHBondContact O-N 3.24Å; G7-N10 VanDerWaalsContact O-N 3.12Å; N10-E13 CarbonylContact O-C 3.59Å; N10-E13 PolarHBondContact O-N 3.26Å; N10-E14 WeakPolarHBondContact O-CB 3.45Å; N10-E14 PolarHBondContact O-N 3.03Å
11	D	47.2	Very low	38.7	Very low	74 Å²	74	107.1 Å²	107.1	40%	0.396	55%	0.552	S	S	.	*	H	α-helix	trans	-72.4	-33.4	178.9	-64	-22.2	0	0	0	112.1	G7 E14 L15	G7-D11 VanDerWaalsContact O-CG 3.25Å; G7-D11 PolarHBondContact O-N 2.84Å; D11-E14 PolarHBondContact O-N 2.85Å; D11-L15 PolarHBondContact O-N 3.4Å
12	I	48.3	Very low	39.3	Very low	74 Å²	74	104.4 Å²	104.4	38%	0.379	54%	0.536	S	S	.	.	H	α-helix	trans	-71.3	-38.6	171.6	-64.8	171.3	0	0	0	110.7	V8 E14 L15 S16	V8-I12 WeakPolarHBondContact O-CG1 3.42Å; V8-I12 PolarHBondContact O-N 3.26Å; I12-E14 VanDerWaalsContact C-N 3.3Å; I12-L15 PolarHBondContact O-N 2.88Å; I12-S16 PolarHBondContact O-N 2.96Å; I12-S16 VanDerWaalsContact O-N 3.08Å; I12-S16 PolarHBondContact O-OG 3.38Å
13	E	46.2	Very low	40	Very low	93 Å²	93	99.7 Å²	99.7	44%	0.435	52%	0.517	S	S	.	.	H	α-helix	trans	-62.9	-34.6	168.4	-89	-164.4	-164.4	0	0	112.3	L9 N10 S16 R17	L9-E13 PolarHBondContact O-N 2.82Å; N10-E13 CarbonylContact O-C 3.59Å; N10-E13 PolarHBondContact O-N 3.26Å; E13-S16 WeakPolarHBondContact CA-OG 3.44Å; E13-S16 PolarHBondContact O-OG 3.46Å; E13-R17 WeakPolarHBondContact O-CB 3.42Å; E13-R17 WeakPolarHBondContact O-CG 3.39Å; E13-R17 PolarHBondContact O-N 3.46Å; E13-R17 IonicContact OE2-CZ 3Å; E13-R17 IonicContact OE2-NH2 3.91Å; E13-R17 PolarHBondContact OE2-NH2 2.79Å
14	E	50.8	Low	40.4	Very low	96 Å²	96	101.9 Å²	101.9	45%	0.449	52%	0.52	S	S	.	.	H	α-helix	trans	-71.4	-39.3	177.6	-124.4	-175.8	174	0	0	111.7	N10 D11 I12 R17 L18	N10-E14 WeakPolarHBondContact O-CB 3.45Å; N10-E14 PolarHBondContact O-N 3.03Å; D11-E14 PolarHBondContact O-N 2.85Å; I12-E14 VanDerWaalsContact C-N 3.3Å; E14-R17 CarbonylContact O-C 3.47Å; E14-R17 PolarHBondContact O-N 2.96Å; E14-R17 VanDerWaalsContact O-N 3.16Å; E14-L18 WeakPolarHBondContact O-CG 3.42Å; E14-L18 PolarHBondContact O-N 3.19Å
15	L	49.6	Very low	40.8	Very low	38 Å²	38	100.2 Å²	100.2	20%	0.199	52%	0.519	C	S	.	.	H	α-helix	trans	-61.4	-42.5	172.2	-83.1	160.6	0	0	0	112.1	D11 I12 R17 L18 S19	D11-L15 PolarHBondContact O-N 3.4Å; I12-L15 PolarHBondContact O-N 2.88Å; L15-R17 VanDerWaalsContact C-N 3.3Å; L15-R17 PolarHBondContact O-N 3.28Å; L15-L18 PolarHBondContact O-N 3.37Å; L15-S19 PolarHBondContact O-N 2.87Å
16	S	46.8	Very low	41.4	Very low	39 Å²	39	98.5 Å²	98.5	27%	0.273	51%	0.513	S	S	.	.	H	α-helix	trans	-71.5	-21.9	174.7	46.3	0	0	0	0	113.4	I12 E13 S19 N20	I12-S16 PolarHBondContact O-N 2.96Å; I12-S16 VanDerWaalsContact O-N 3.08Å; I12-S16 PolarHBondContact O-OG 3.38Å; E13-S16 WeakPolarHBondContact CA-OG 3.44Å; E13-S16 PolarHBondContact O-OG 3.46Å; S16-S19 PolarHBondContact O-OG 2.83Å; S16-N20 VanDerWaalsContact O-CG 3.27Å; S16-N20 PolarHBondContact O-ND2 2.77Å
17	R	43.5	Very low	42.1	Very low	158 Å²	158	100.6 Å²	100.6	60%	0.596	52%	0.522	S	S	*	.	H	α-helix	trans	-80	-34.4	169.7	-73.7	171.7	-164	-156.8	9.6	112.7	E13 E14 L15 N20 T21	E13-R17 WeakPolarHBondContact O-CB 3.42Å; E13-R17 WeakPolarHBondContact O-CG 3.39Å; E13-R17 PolarHBondContact O-N 3.46Å; E13-R17 IonicContact OE2-CZ 3Å; E13-R17 IonicContact OE2-NH2 3.91Å; E13-R17 PolarHBondContact OE2-NH2 2.79Å; E14-R17 CarbonylContact O-C 3.47Å; E14-R17 PolarHBondContact O-N 2.96Å; E14-R17 VanDerWaalsContact O-N 3.16Å; L15-R17 VanDerWaalsContact C-N 3.3Å; L15-R17 PolarHBondContact O-N 3.28Å; R17-N20 PolarHBondContact O-N 3.09Å; R17-T21 PolarHBondContact O-OG1 2.98Å
18	L	44.4	Very low	42.8	Very low	97 Å²	97	108.1 Å²	108.1	51%	0.508	55%	0.55	S	S	.	.	H	α-helix	trans	-65.5	-40.4	176.6	-76.1	165	0	0	0	111.4	E14 L15 N20 T21	E14-L18 WeakPolarHBondContact O-CG 3.42Å; E14-L18 PolarHBondContact O-N 3.19Å; L15-L18 PolarHBondContact O-N 3.37Å; L18-N20 VanDerWaalsContact C-N 3.32Å; L18-N20 PolarHBondContact O-N 2.95Å; L18-T21 PolarHBondContact O-N 2.74Å; L18-T21 PolarHBondContact O-OG1 3.38Å
19	S	45	Very low	43.7	Very low	29 Å²	29	110.8 Å²	110.8	20%	0.203	55%	0.552	C	S	.	*	H	α-helix	trans	-66.2	-30.7	174.9	63.6	0	0	0	0	113.5	L15 S16 T21	L15-S19 PolarHBondContact O-N 2.87Å; S16-S19 PolarHBondContact O-OG 2.83Å; S19-T21 VanDerWaalsContact C-N 3.26Å; S19-T21 PolarHBondContact O-N 3.18Å
20	N	40.2	Very low	45.1	Very low	125 Å²	125	110.9 Å²	110.9	67%	0.668	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-14.7	178.5	-78.4	-23.6	0	0	0	114.1	S16 R17 L18	S16-N20 VanDerWaalsContact O-CG 3.27Å; S16-N20 PolarHBondContact O-ND2 2.77Å; R17-N20 PolarHBondContact O-N 3.09Å; L18-N20 VanDerWaalsContact C-N 3.32Å; L18-N20 PolarHBondContact O-N 2.95Å
21	T	40	Very low	47.4	Very low	116 Å²	116	112.2 Å²	112.2	71%	0.712	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-5.2	-177	-0.3	0	0	0	0	114.7	R17 L18 S19	R17-T21 PolarHBondContact O-OG1 2.98Å; L18-T21 PolarHBondContact O-N 2.74Å; L18-T21 PolarHBondContact O-OG1 3.38Å; S19-T21 VanDerWaalsContact C-N 3.26Å; S19-T21 PolarHBondContact O-N 3.18Å
22	Q	42.3	Very low	49.6	Very low	181 Å²	181	109.9 Å²	109.9	85%	0.846	55%	0.552	S	S	*	*	S	Bend	trans	-118.7	-5.1	-179.8	-81.3	-172.5	-13.6	0	0	116
23	N	39.6	Very low	51.8	Low	82 Å²	82	106.3 Å²	106.3	44%	0.439	53%	0.534	S	S	.	.			trans	-113.3	80.1	-175	-76.5	-16.8	0	0	0	113.5
24	N	34.9	Very low	54	Low	159 Å²	159	102.2 Å²	102.2	85%	0.85	51%	0.514	S	S	*	.			trans	-102.4	19.8	161.2	-99.7	-9.3	0	0	0	113
25	F	38.6	Very low	56.1	Low	193 Å²	193	101.8 Å²	101.8	85%	0.846	51%	0.512	S	S	*	.			trans	-129	66.3	170.7	-77.9	-80.4	0	0	0	110.3	T27	F25-T27 PolarHBondContact O-N 2.88Å
26	H	43.1	Very low	58.1	Low	133 Å²	133	101.6 Å²	101.6	62%	0.616	51%	0.511	S	S	*	.			trans	-84.1	88.9	166.2	-85	-65.2	0	0	0	109.5
27	T	42.2	Very low	60.2	Low	124 Å²	124	99.8 Å²	99.8	76%	0.761	50%	0.498	S	S	*	.			trans	-74.1	130.5	154.9	-32.4	0	0	0	0	107.4	F25 R29	F25-T27 PolarHBondContact O-N 2.88Å; T27-R29 PolarHBondContact O-N 3.44Å
28	E	46.1	Very low	62.5	Low	189 Å²	189	95.5 Å²	95.5	88%	0.883	48%	0.482	S	S	*	.			trans	-49.9	102.1	179.6	-69.2	172	136.8	0	0	112.3	S30	E28-S30 PolarHBondContact O-N 2.68Å
29	R	56.3	Low	64.6	Low	124 Å²	124	92.2 Å²	92.2	47%	0.468	47%	0.469	S	S	.	.			trans	-83.6	101.7	167.2	-143	-171	-167.6	153.2	23.5	107.6	T27 E36 D126 C128	T27-R29 PolarHBondContact O-N 3.44Å; R29-E36 IonicContact CZ-OE1 3.19Å; R29-E36 IonicContact NE-OE1 3.18Å; R29-E36 PolarHBondContact NE-OE1 2.74Å; R29-E36 IonicContact NH2-OE1 3.66Å; R29-E36 IonicContact NH2-OE2 3.37Å; R29-D126 PolarHBondContact NH1-O 3.32Å; R29-C128 PolarHBondContact NH1-SG 2.83Å
30	S	64.9	Low	66.6	Low	113 Å²	113	92.1 Å²	92.1	79%	0.79	47%	0.468	S	S	*	.			trans	-81.6	-14.2	-178.6	57.1	0	0	0	0	113.9	E28	E28-S30 PolarHBondContact O-N 2.68Å
31	K	85.1	Confident	68.8	Low	119 Å²	119	87 Å²	87	52%	0.517	44%	0.441	S	S	.	.	S	Bend	trans	-116	141.5	-179.7	-64.2	-176.1	-179.2	-178.5	0	111.6	E35 E36	K31-E35 WeakPolarHBondContact CA-OE2 3.33Å; K31-E35 HydrophobicContact CB-CB 4.39Å; K31-E36 HydrophobicContact CB-CG 4.18Å
32	T	93.2	Very high	70.5	Confident	25 Å²	25	86.7 Å²	86.7	15%	0.153	43%	0.434	C	S	.	.			trans	-75.7	157.7	174.1	64.8	0	0	0	0	110.8	F34 E35 E36 D126	T32-F34 PolarHBondContact O-N 3.43Å; T32-E35 PolarHBondContact N-OE2 3.1Å; T32-E35 PolarHBondContact O-N 3.22Å; T32-E35 VanDerWaalsContact O-N 3.14Å; T32-E35 VanDerWaalsContact OG1-CD 3.32Å; T32-E35 VanDerWaalsContact OG1-CG 3.24Å; T32-E35 WeakPolarHBondContact OG1-CG 3.39Å; T32-E35 PolarHBondContact OG1-N 2.91Å; T32-E35 PolarHBondContact OG1-OE2 3.42Å; T32-E36 WeakPolarHBondContact O-CG 3.43Å; T32-E36 PolarHBondContact O-N 2.87Å; T32-D126 WeakPolarHBondContact CB-OD2 3.37Å; T32-D126 VanDerWaalsContact CG2-OD2 3.28Å; T32-D126 WeakPolarHBondContact CG2-OD2 3.25Å
33	L	94.1	Very high	71.9	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	43%	0.427	C	S	.	.	H	α-helix	trans	-55.6	-38.8	174.6	158.4	70.4	0	0	0	111.1	E36 I37 F51 V55 Y96 M125 Y130	L33-E36 PolarHBondContact O-N 2.81Å; L33-I37 HydrophobicContact CD1-CD1 3.68Å; L33-I37 HydrophobicContact CD1-CG1 3.97Å; L33-I37 HydrophobicContact CG-CD1 3.91Å; L33-I37 WeakPolarHBondContact O-CG1 3.27Å; L33-I37 PolarHBondContact O-N 2.93Å; L33-F51 HydrophobicContact CD1-CE1 3.9Å; L33-F51 HydrophobicContact CD1-CZ 4.19Å; L33-V55 HydrophobicContact CD1-CG2 3.9Å; L33-V55 HydrophobicContact CD2-CG1 3.99Å; L33-Y96 HydrophobicContact CB-CE1 4.35Å; L33-Y96 WeakPolarHBondContact CB-OH 3.38Å; L33-Y96 HydrophobicContact CD2-CE1 3.91Å; L33-Y96 HydrophobicContact CG-CE1 3.96Å; L33-Y96 PolarHBondContact N-OH 3.33Å; L33-M125 HydrophobicContact CD2-CE 4.18Å; L33-M125 WeakPolarHBondContact CD2-O 3.36Å; L33-Y130 HydrophobicContact CD2-CE1 4.3Å
34	F	94.2	Very high	73.1	Confident	6 Å²	6	83.8 Å²	83.8	3%	0.026	43%	0.425	C	S	.	.	H	α-helix	trans	-62.3	-44.3	177.1	-175.4	-103.3	0	0	0	112.8	T32 E36 I37 R38 Y96 V97 R100 D101 I301	T32-F34 PolarHBondContact O-N 3.43Å; F34-E36 VanDerWaalsContact C-N 3.29Å; F34-E36 PolarHBondContact O-N 2.94Å; F34-I37 PolarHBondContact O-N 2.77Å; F34-R38 VanDerWaalsContact CE1-CZ 3.43Å; F34-R38 VanDerWaalsContact O-CB 3.28Å; F34-R38 WeakPolarHBondContact O-CB 3.4Å; F34-R38 PolarHBondContact O-N 2.93Å; F34-Y96 HydrophobicContact CB-CE1 3.82Å; F34-Y96 WeakPolarHBondContact CB-OH 3.47Å; F34-Y96 HydrophobicContact CD2-CE1 4.48Å; F34-Y96 PolarHBondContact N-OH 2.92Å; F34-V97 HydrophobicContact CE2-CG1 4.22Å; F34-V97 HydrophobicContact CE2-CG2 4.46Å; F34-R100 HydrophobicContact CB-CB 3.81Å; F34-R100 HydrophobicContact CB-CG 3.76Å; F34-R100 HydrophobicContact CD1-CB 3.77Å; F34-R100 HydrophobicContact CD2-CB 3.61Å; F34-R100 HydrophobicContact CD2-CG 4.32Å; F34-R100 HydrophobicContact CE1-CB 4.16Å; F34-R100 HydrophobicContact CE2-CB 4.06Å; F34-R100 HydrophobicContact CG-CB 3.45Å; F34-R100 VanDerWaalsContact CG-CB 3.45Å; F34-R100 HydrophobicContact CG-CG 4Å; F34-R100 HydrophobicContact CZ-CB 4.32Å; F34-D101 HydrophobicContact CE2-CB 4.4Å; F34-D101 HydrophobicContact CZ-CB 3.79Å; F34-I301 HydrophobicContact CD2-CD1 4.27Å; F34-I301 HydrophobicContact CE2-CD1 3.92Å; F34-I301 HydrophobicContact CE2-CG1 3.98Å; F34-I301 HydrophobicContact CE2-CG2 4.2Å; F34-I301 HydrophobicContact CZ-CG2 4.1Å
35	E	93.3	Very high	74	Confident	87 Å²	87	84 Å²	84	41%	0.407	43%	0.426	S	S	.	.	H	α-helix	trans	-66.1	-33.8	175.9	-72.8	164	151.8	0	0	112.1	K31 T32 A39	K31-E35 WeakPolarHBondContact CA-OE2 3.33Å; K31-E35 HydrophobicContact CB-CB 4.39Å; T32-E35 PolarHBondContact N-OE2 3.1Å; T32-E35 PolarHBondContact O-N 3.22Å; T32-E35 VanDerWaalsContact O-N 3.14Å; T32-E35 VanDerWaalsContact OG1-CD 3.32Å; T32-E35 VanDerWaalsContact OG1-CG 3.24Å; T32-E35 WeakPolarHBondContact OG1-CG 3.39Å; T32-E35 PolarHBondContact OG1-N 2.91Å; T32-E35 PolarHBondContact OG1-OE2 3.42Å; E35-A39 WeakPolarHBondContact O-CB 3.27Å; E35-A39 PolarHBondContact O-N 2.74Å
36	E	92.3	Very high	74.7	Confident	35 Å²	35	83.3 Å²	83.3	16%	0.164	43%	0.425	C	S	.	.	H	α-helix	trans	-67.3	-43.4	174.3	-67.2	177.7	-166.2	0	0	111.7	R29 K31 T32 L33 F34 A39 S40 F51 R53	R29-E36 IonicContact CZ-OE1 3.19Å; R29-E36 IonicContact NE-OE1 3.18Å; R29-E36 PolarHBondContact NE-OE1 2.74Å; R29-E36 IonicContact NH2-OE1 3.66Å; R29-E36 IonicContact NH2-OE2 3.37Å; K31-E36 HydrophobicContact CB-CG 4.18Å; T32-E36 WeakPolarHBondContact O-CG 3.43Å; T32-E36 PolarHBondContact O-N 2.87Å; L33-E36 PolarHBondContact O-N 2.81Å; F34-E36 VanDerWaalsContact C-N 3.29Å; F34-E36 PolarHBondContact O-N 2.94Å; E36-A39 PolarHBondContact O-N 3.48Å; E36-S40 PolarHBondContact O-N 2.88Å; E36-F51 HydrophobicContact CB-CE2 4.35Å; E36-F51 HydrophobicContact CB-CZ 4.16Å; E36-R53 IonicContact OE2-CZ 3.17Å; E36-R53 IonicContact OE2-NH1 3.62Å; E36-R53 PolarHBondContact OE2-NH1 2.81Å; E36-R53 IonicContact OE2-NH2 3.42Å; E36-R53 PolarHBondContact OE2-NH2 3.21Å
37	I	91.7	Very high	75.1	Confident	0 Å²	0	85.4 Å²	85.4	0%	0	44%	0.435	C	S	.	.	H	α-helix	trans	-64.2	-46.7	174.1	-64.5	163.2	0	0	0	110.5	L33 F34 A39 S40 I41 F51 M93 I301 M306 L316	L33-I37 HydrophobicContact CD1-CD1 3.68Å; L33-I37 HydrophobicContact CD1-CG1 3.97Å; L33-I37 HydrophobicContact CG-CD1 3.91Å; L33-I37 WeakPolarHBondContact O-CG1 3.27Å; L33-I37 PolarHBondContact O-N 2.93Å; F34-I37 PolarHBondContact O-N 2.77Å; I37-A39 VanDerWaalsContact C-N 3.28Å; I37-A39 PolarHBondContact O-N 2.8Å; I37-S40 PolarHBondContact O-N 2.8Å; I37-S40 VanDerWaalsContact O-N 3.14Å; I37-S40 PolarHBondContact O-OG 2.87Å; I37-I41 WeakPolarHBondContact O-CG1 3.23Å; I37-I41 PolarHBondContact O-N 3.17Å; I37-F51 HydrophobicContact CB-CE2 4.42Å; I37-F51 HydrophobicContact CG1-CD1 4.13Å; I37-F51 HydrophobicContact CG1-CD2 4.19Å; I37-F51 HydrophobicContact CG1-CE1 3.8Å; I37-F51 HydrophobicContact CG1-CE2 3.91Å; I37-F51 HydrophobicContact CG1-CG 4.3Å; I37-F51 HydrophobicContact CG1-CZ 3.7Å; I37-M93 HydrophobicContact CD1-CE 4.11Å; I37-I301 HydrophobicContact CB-CD1 4.41Å; I37-I301 HydrophobicContact CG2-CD1 3.59Å; I37-M306 HydrophobicContact CG2-CE 4.14Å; I37-L316 HydrophobicContact CD1-CD2 3.73Å; I37-L316 HydrophobicContact CG1-CD2 3.87Å; I37-L316 HydrophobicContact CG2-CD2 4.12Å
38	R	91.3	Very high	75.6	Confident	68 Å²	68	85.1 Å²	85.1	26%	0.257	43%	0.429	S	S	.	.	H	α-helix	trans	-58.3	-41.8	176.4	176.9	179	-88.8	158	0.7	111.4	F34 S40 I41 N42 D101 I301 D302	F34-R38 VanDerWaalsContact CE1-CZ 3.43Å; F34-R38 VanDerWaalsContact O-CB 3.28Å; F34-R38 WeakPolarHBondContact O-CB 3.4Å; F34-R38 PolarHBondContact O-N 2.93Å; R38-S40 VanDerWaalsContact C-N 3.34Å; R38-S40 PolarHBondContact O-N 3.32Å; R38-I41 WeakPolarHBondContact O-CB 3.07Å; R38-I41 PolarHBondContact O-N 3.41Å; R38-N42 PolarHBondContact O-N 3.13Å; R38-N42 PolarHBondContact O-ND2 3.3Å; R38-D101 IonicContact CZ-OD1 2.83Å; R38-D101 IonicContact NH2-OD1 3.7Å; R38-D101 PolarHBondContact NH2-OD1 2.97Å; R38-I301 HydrophobicContact CB-CG2 4.21Å; R38-I301 HydrophobicContact CG-CG2 4.49Å; R38-D302 VanDerWaalsContact CD-OD2 3.23Å; R38-D302 WeakPolarHBondContact CD-OD2 3.29Å; R38-D302 WeakPolarHBondContact CG-OD2 3.11Å; R38-D302 IonicContact CZ-OD1 3.55Å; R38-D302 IonicContact CZ-OD2 2.6Å; R38-D302 VanDerWaalsContact NE-CG 3.27Å; R38-D302 IonicContact NE-OD1 3.67Å; R38-D302 PolarHBondContact NE-OD1 3.4Å; R38-D302 IonicContact NE-OD2 3.86Å; R38-D302 PolarHBondContact NE-OD2 3.04Å; R38-D302 IonicContact NH2-OD1 3.73Å; R38-D302 PolarHBondContact NH2-OD1 3.49Å; R38-D302 IonicContact NH2-OD2 4Å
39	A	89.1	Confident	76.9	Confident	29 Å²	29	84 Å²	84	24%	0.24	42%	0.417	C	S	.	.	H	α-helix	trans	-65.9	-34.7	177.3	0	0	0	0	0	112.7	E35 E36 I37 I41 N42 N43	E35-A39 WeakPolarHBondContact O-CB 3.27Å; E35-A39 PolarHBondContact O-N 2.74Å; E36-A39 PolarHBondContact O-N 3.48Å; I37-A39 VanDerWaalsContact C-N 3.28Å; I37-A39 PolarHBondContact O-N 2.8Å; A39-I41 VanDerWaalsContact C-N 3.28Å; A39-I41 PolarHBondContact O-N 2.81Å; A39-N42 PolarHBondContact O-N 3.06Å; A39-N43 PolarHBondContact O-N 3.3Å; A39-N43 PolarHBondContact O-ND2 3.21Å
40	S	86.3	Confident	78	Confident	26 Å²	26	79.5 Å²	79.5	18%	0.182	40%	0.404	C	S	.	.	H	α-helix	trans	-67.2	-30	175	63.5	0	0	0	0	112.6	E36 I37 R38 N44 F51	E36-S40 PolarHBondContact O-N 2.88Å; I37-S40 PolarHBondContact O-N 2.8Å; I37-S40 VanDerWaalsContact O-N 3.14Å; I37-S40 PolarHBondContact O-OG 2.87Å; R38-S40 VanDerWaalsContact C-N 3.34Å; R38-S40 PolarHBondContact O-N 3.32Å; S40-N44 PolarHBondContact O-ND2 3.21Å; S40-N44 VanDerWaalsContact O-ND2 3.08Å; S40-N44 PolarHBondContact O-OD1 2.79Å; S40-F51 WeakPolarHBondContact OG-CD2 3.22Å
41	I	85.5	Confident	79	Confident	19 Å²	19	74.2 Å²	74.2	10%	0.097	37%	0.367	C	S	.	.	H	α-helix	trans	-66	-42.4	174.9	-61.9	168.5	0	0	0	110.6	I37 R38 A39 I301 C304 M306 L318	I37-I41 WeakPolarHBondContact O-CG1 3.23Å; I37-I41 PolarHBondContact O-N 3.17Å; R38-I41 WeakPolarHBondContact O-CB 3.07Å; R38-I41 PolarHBondContact O-N 3.41Å; A39-I41 VanDerWaalsContact C-N 3.28Å; A39-I41 PolarHBondContact O-N 2.81Å; I41-I301 HydrophobicContact CD1-CB 3.76Å; I41-I301 HydrophobicContact CD1-CG2 3.8Å; I41-C304 HydrophobicContact CG2-CB 3.97Å; I41-M306 HydrophobicContact CD1-CG 4.29Å; I41-M306 HydrophobicContact CD1-SD 3.85Å; I41-M306 HydrophobicContact CG1-SD 3.95Å; I41-L318 HydrophobicContact CG1-CD1 4.45Å; I41-L318 HydrophobicContact CG2-CD1 4.43Å
42	N	77.4	Confident	78.9	Confident	109 Å²	109	77.4 Å²	77.4	58%	0.583	38%	0.376	S	S	*	.	H	α-helix	trans	-80.5	-23.3	-172.4	-70.5	-38.1	0	0	0	115.2	R38 A39	R38-N42 PolarHBondContact O-N 3.13Å; R38-N42 PolarHBondContact O-ND2 3.3Å; A39-N42 PolarHBondContact O-N 3.06Å
43	N	70.8	Confident	78.5	Confident	129 Å²	129	77.1 Å²	77.1	69%	0.69	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	11.8	-173.2	-71.7	-26.8	0	0	0	114.2	A39 D45	A39-N43 PolarHBondContact O-N 3.3Å; A39-N43 PolarHBondContact O-ND2 3.21Å; N43-D45 PolarHBondContact O-N 2.88Å
44	N	63.9	Low	78.2	Confident	72 Å²	72	80 Å²	80	39%	0.385	39%	0.391	S	S	.	.			trans	-99	89.3	-166.5	-89	-6.2	0	0	0	113.5	S40 D48	S40-N44 PolarHBondContact O-ND2 3.21Å; S40-N44 VanDerWaalsContact O-ND2 3.08Å; S40-N44 PolarHBondContact O-OD1 2.79Å; N44-D48 PolarHBondContact ND2-O 3.4Å
45	D	54.9	Low	78.1	Confident	164 Å²	164	79.8 Å²	79.8	88%	0.877	39%	0.39	S	S	*	.	S	Bend	trans	-95	47.6	171.9	-79	-29.8	0	0	0	112.8	N43	N43-D45 PolarHBondContact O-N 2.88Å
46	E	52.9	Low	78	Confident	178 Å²	178	75.6 Å²	75.6	83%	0.832	37%	0.37	S	S	*	.	S	Bend	trans	104.2	128.3	177.8	-53.6	-160.3	161.2	0	0	117.1
47	E	50.7	Low	77.9	Confident	178 Å²	178	76.6 Å²	76.6	83%	0.832	38%	0.38	S	S	*	.	S	Bend	trans	90.1	-13.8	159.8	-67.6	-167.7	159.2	0	0	124.4
48	D	53.1	Low	77.8	Confident	117 Å²	117	82 Å²	82	63%	0.626	40%	0.4	S	S	*	.			trans	-105.8	90.7	167.9	-90.5	-25.4	0	0	0	112.3	N44 S50	N44-D48 PolarHBondContact ND2-O 3.4Å; D48-S50 VanDerWaalsContact C-N 3.25Å; D48-S50 PolarHBondContact O-N 2.88Å
49	R	73.3	Confident	77.8	Confident	166 Å²	166	79.3 Å²	79.3	63%	0.626	39%	0.393	S	S	*	.			trans	-74.9	-11.1	-179.7	-64	-176.9	-179.2	-176.5	1.4	113.4	I317 L318 H320	R49-I317 HydrophobicContact CB-CG2 4.43Å; R49-I317 CarbonylContact O-C 3.5Å; R49-I317 WeakPolarHBondContact O-CA 3.45Å; R49-I317 WeakPolarHBondContact O-CG2 3.41Å; R49-L318 PolarHBondContact O-N 2.78Å; R49-H320 PolarHBondContact NE-NE2 3.48Å
50	S	79.5	Confident	77.9	Confident	30 Å²	30	78.8 Å²	78.8	21%	0.21	39%	0.391	C	S	.	.	B	Isolated β-bridge	trans	-109.5	147.2	-179.3	52.1	0	0	0	0	111.5	D48 W52 L316	D48-S50 VanDerWaalsContact C-N 3.25Å; D48-S50 PolarHBondContact O-N 2.88Å; S50-W52 PolarHBondContact O-N 3.31Å; S50-L316 CarbonylContact C-O 3.52Å; S50-L316 WeakPolarHBondContact CA-O 3.4Å
51	F	86.9	Confident	78.2	Confident	2 Å²	2	81.1 Å²	81.1	1%	0.009	40%	0.404	C	S	.	.			trans	-66.7	127.5	165.4	-175.2	-122.6	0	0	0	108.4	L33 E36 I37 S40 R53 V55 L316	L33-F51 HydrophobicContact CD1-CE1 3.9Å; L33-F51 HydrophobicContact CD1-CZ 4.19Å; E36-F51 HydrophobicContact CB-CE2 4.35Å; E36-F51 HydrophobicContact CB-CZ 4.16Å; I37-F51 HydrophobicContact CB-CE2 4.42Å; I37-F51 HydrophobicContact CG1-CD1 4.13Å; I37-F51 HydrophobicContact CG1-CD2 4.19Å; I37-F51 HydrophobicContact CG1-CE1 3.8Å; I37-F51 HydrophobicContact CG1-CE2 3.91Å; I37-F51 HydrophobicContact CG1-CG 4.3Å; I37-F51 HydrophobicContact CG1-CZ 3.7Å; S40-F51 WeakPolarHBondContact OG-CD2 3.22Å; F51-R53 HydrophobicContact CD1-CG 3.7Å; F51-R53 VanDerWaalsContact CD1-O 3.28Å; F51-R53 WeakPolarHBondContact CD1-O 3.47Å; F51-R53 HydrophobicContact CE1-CG 3.18Å; F51-R53 HydrophobicContact CZ-CG 3.84Å; F51-R53 PolarHBondContact O-N 2.79Å; F51-V55 HydrophobicContact CD1-CG2 3.76Å; F51-V55 HydrophobicContact CE1-CG2 3.75Å; F51-L316 HydrophobicContact CB-CB 4.01Å; F51-L316 HydrophobicContact CB-CD2 3.94Å; F51-L316 HydrophobicContact CB-CG 4.01Å; F51-L316 HydrophobicContact CD1-CD2 3.94Å; F51-L316 HydrophobicContact CG-CD2 4.12Å; F51-L316 PolarHBondContact N-O 3.42Å
52	W	82.2	Confident	78.3	Confident	185 Å²	185	81.4 Å²	81.4	70%	0.701	40%	0.404	S	S	*	.	S	Bend	trans	-60.8	-12.6	-168.1	65.5	-89	0	0	0	115.7	S50	S50-W52 PolarHBondContact O-N 3.31Å
53	R	86.2	Confident	78.7	Confident	20 Å²	20	79.4 Å²	79.4	8%	0.075	40%	0.396	C	S	.	.	S	Bend	trans	-125.1	148.6	177.5	68.3	165.1	-175.5	-132	1.6	112.4	E36 F51	E36-R53 IonicContact OE2-CZ 3.17Å; E36-R53 IonicContact OE2-NH1 3.62Å; E36-R53 PolarHBondContact OE2-NH1 2.81Å; E36-R53 IonicContact OE2-NH2 3.42Å; E36-R53 PolarHBondContact OE2-NH2 3.21Å; F51-R53 HydrophobicContact CD1-CG 3.7Å; F51-R53 VanDerWaalsContact CD1-O 3.28Å; F51-R53 WeakPolarHBondContact CD1-O 3.47Å; F51-R53 HydrophobicContact CE1-CG 3.18Å; F51-R53 HydrophobicContact CZ-CG 3.84Å; F51-R53 PolarHBondContact O-N 2.79Å
54	P	87.4	Confident	79.1	Confident	61 Å²	61	76.1 Å²	76.1	40%	0.396	38%	0.378	S	S	.	.			trans	-62.3	137.9	168.2	-16.6	26.9	0	0	0	112	P57 S313 N315	P54-P57 HydrophobicContact CB-CB 4.44Å; P54-S313 WeakPolarHBondContact CG-O 3.16Å; P54-N315 WeakPolarHBondContact CA-OD1 3.4Å
55	V	91.1	Very high	79.8	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	38%	0.384	C	S	.	.	S	Bend	trans	-117	133	171.7	-177.5	0	0	0	0	108.7	L33 F51 M93 Y130 Y308 N315 L316	L33-V55 HydrophobicContact CD1-CG2 3.9Å; L33-V55 HydrophobicContact CD2-CG1 3.99Å; F51-V55 HydrophobicContact CD1-CG2 3.76Å; F51-V55 HydrophobicContact CE1-CG2 3.75Å; V55-M93 HydrophobicContact CG1-SD 3.61Å; V55-Y130 HydrophobicContact CG1-CE1 4Å; V55-Y308 WeakPolarHBondContact O-CE2 3.33Å; V55-N315 PolarHBondContact N-ND2 2.88Å; V55-N315 PolarHBondContact N-OD1 3.48Å; V55-N315 PolarHBondContact O-ND2 2.83Å; V55-L316 HydrophobicContact CG2-CD2 4.1Å
56	L	91.9	Very high	80.5	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	36%	0.356	C	S	.	.	S	Bend	trans	49.4	44.7	179.8	-71.1	166.1	0	0	0	115	D89 L92 M93 M125 Y130 V133 Y308	L56-D89 HydrophobicContact CB-CB 4.27Å; L56-D89 WeakPolarHBondContact CD1-O 3.48Å; L56-L92 HydrophobicContact CD1-CB 3.92Å; L56-L92 HydrophobicContact CD2-CB 4.48Å; L56-L92 HydrophobicContact CD2-CD1 4.28Å; L56-M93 HydrophobicContact CD1-CB 3.92Å; L56-M93 HydrophobicContact CD1-SD 4.27Å; L56-M125 HydrophobicContact CD1-CE 3.72Å; L56-M125 HydrophobicContact CD1-SD 4.15Å; L56-M125 HydrophobicContact CD2-SD 3.93Å; L56-M125 HydrophobicContact CG-CE 4.07Å; L56-M125 HydrophobicContact CG-SD 4.12Å; L56-Y130 HydrophobicContact CB-CD1 4.48Å; L56-Y130 HydrophobicContact CD2-CD1 3.78Å; L56-Y130 HydrophobicContact CD2-CG 4.24Å; L56-Y130 HydrophobicContact CG-CD1 3.87Å; L56-Y130 HydrophobicContact CG-CE1 4.37Å; L56-Y130 HydrophobicContact CG-CG 4.46Å; L56-V133 HydrophobicContact CD2-CG1 4.38Å; L56-Y308 HydrophobicContact CB-CE2 4.43Å; L56-Y308 PolarHBondContact O-OH 3.19Å
57	P	90.5	Very high	80.9	Confident	55 Å²	55	67 Å²	67	36%	0.357	35%	0.35	S	S	.	.			trans	-54.5	146	-171.7	27.6	-36.7	0	0	0	112.7	P54 G59 Y130 K134	P54-P57 HydrophobicContact CB-CB 4.44Å; P57-G59 PolarHBondContact O-N 3.07Å; P57-Y130 HydrophobicContact CG-CD2 4.3Å; P57-K134 PolarHBondContact O-NZ 3.46Å
58	W	89.5	Confident	81.1	Confident	115 Å²	115	70.7 Å²	70.7	44%	0.436	36%	0.357	S	S	.	.	S	Bend	trans	-55.2	133	-176.6	-178.5	17.8	0	0	0	112.9	N84 G310 L311	W58-N84 WeakPolarHBondContact CZ2-OD1 3.38Å; W58-G310 WeakPolarHBondContact CB-O 3.32Å; W58-G310 PolarHBondContact N-O 3.04Å; W58-L311 HydrophobicContact CD2-CD2 4.08Å; W58-L311 HydrophobicContact CE3-CD2 3.27Å; W58-L311 HydrophobicContact CE3-CG 4.45Å; W58-L311 HydrophobicContact CH2-CD2 3.49Å; W58-L311 VanDerWaalsContact CH2-CD2 3.49Å; W58-L311 HydrophobicContact CZ2-CD2 4.27Å; W58-L311 HydrophobicContact CZ3-CD2 2.97Å; W58-L311 HydrophobicContact CZ3-CG 4.34Å
59	G	90.6	Very high	81.2	Confident	10 Å²	10	74.6 Å²	74.6	10%	0.103	37%	0.368	C	S	.	.			trans	91.1	-152.7	175.4	0	0	0	0	0	111.9	P57 L82 T85 K134	P57-G59 PolarHBondContact O-N 3.07Å; G59-L82 WeakPolarHBondContact CA-O 3.17Å; G59-T85 PolarHBondContact N-OG1 3.38Å; G59-K134 PolarHBondContact O-NZ 3.14Å
60	G	91.3	Very high	80.1	Confident	18 Å²	18	70.1 Å²	70.1	19%	0.186	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.7	154.9	179.2	0	0	0	0	0	110.6	Q81 L82	G60-Q81 WeakPolarHBondContact O-CA 3.42Å; G60-L82 PolarHBondContact O-N 2.96Å
61	V	91.6	Very high	78.8	Confident	75 Å²	75	77.5 Å²	77.5	46%	0.455	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	126.4	176.8	-176.4	0	0	0	0	107.9	E79 Q81 T131	V61-E79 HydrophobicContact CG1-CB 3.98Å; V61-E79 HydrophobicContact CG1-CG 4.23Å; V61-Q81 HydrophobicContact CG2-CG 4.35Å; V61-T131 WeakPolarHBondContact O-CG2 3.27Å
62	F	88	Confident	77.2	Confident	25 Å²	25	80.9 Å²	80.9	11%	0.11	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	149.6	174	71.5	-81.3	0	0	0	110.3	I64 V80 L82 T131 M135 W139 I158	F62-I64 HydrophobicContact CD2-CG2 3.75Å; F62-I64 HydrophobicContact CE2-CG2 3.38Å; F62-V80 HydrophobicContact CD1-CB 4.06Å; F62-V80 HydrophobicContact CD1-CG1 4.37Å; F62-V80 WeakPolarHBondContact CD1-O 3.24Å; F62-V80 HydrophobicContact CD2-CB 4.47Å; F62-V80 HydrophobicContact CE1-CB 3.5Å; F62-V80 HydrophobicContact CE1-CG1 3.42Å; F62-V80 VanDerWaalsContact CE1-CG1 3.42Å; F62-V80 HydrophobicContact CE2-CB 3.96Å; F62-V80 HydrophobicContact CE2-CG1 4.38Å; F62-V80 HydrophobicContact CE2-CG2 4.29Å; F62-V80 HydrophobicContact CZ-CB 3.46Å; F62-V80 VanDerWaalsContact CZ-CB 3.46Å; F62-V80 HydrophobicContact CZ-CG1 3.43Å; F62-V80 VanDerWaalsContact CZ-CG1 3.43Å; F62-V80 HydrophobicContact CZ-CG2 4.1Å; F62-V80 PolarHBondContact N-O 3.47Å; F62-V80 PolarHBondContact O-N 3.15Å; F62-L82 HydrophobicContact CD1-CD2 4.16Å; F62-L82 HydrophobicContact CD1-CG 4.21Å; F62-L82 HydrophobicContact CE1-CD2 3.7Å; F62-L82 HydrophobicContact CE1-CG 4.25Å; F62-T131 HydrophobicContact CB-CG2 4.23Å; F62-M135 HydrophobicContact CB-CG 4.16Å; F62-M135 HydrophobicContact CD1-CE 3.91Å; F62-M135 HydrophobicContact CD1-CG 4.12Å; F62-M135 HydrophobicContact CD1-SD 3.49Å; F62-M135 WeakPolarHBondContact CD1-SD 3.45Å; F62-M135 HydrophobicContact CD2-CE 4.12Å; F62-M135 HydrophobicContact CD2-CG 4.48Å; F62-M135 HydrophobicContact CD2-SD 4.45Å; F62-M135 HydrophobicContact CE1-CE 3.5Å; F62-M135 VanDerWaalsContact CE1-CE 3.5Å; F62-M135 HydrophobicContact CE1-SD 3.58Å; F62-M135 VanDerWaalsContact CE1-SD 3.58Å; F62-M135 HydrophobicContact CE2-CE 3.72Å; F62-M135 HydrophobicContact CG-CE 4.2Å; F62-M135 HydrophobicContact CG-CG 4.01Å; F62-M135 HydrophobicContact CG-SD 3.95Å; F62-M135 HydrophobicContact CZ-CE 3.38Å; F62-M135 HydrophobicContact CZ-SD 4.11Å; F62-W139 HydrophobicContact CD2-CH2 4.03Å; F62-W139 HydrophobicContact CD2-CZ3 4.14Å; F62-W139 AromaticContact CE2-CH2 3.56Å; F62-W139 HydrophobicContact CE2-CH2 3.56Å; F62-W139 AromaticContact CE2-CZ3 3.9Å; F62-W139 HydrophobicContact CE2-CZ3 3.9Å; F62-W139 HydrophobicContact CZ-CH2 4.4Å; F62-I158 HydrophobicContact CE1-CD1 4.09Å; F62-I158 HydrophobicContact CZ-CD1 3.87Å
63	T	85.5	Confident	76	Confident	67 Å²	67	78.8 Å²	78.8	41%	0.411	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	124.8	-176.8	-48.5	0	0	0	0	109.9	Y77 V78	T63-Y77 HydrophobicContact CG2-CD1 3.91Å; T63-Y77 HydrophobicContact CG2-CG 4.19Å; T63-V78 CarbonylContact C-O 3.57Å; T63-V78 WeakPolarHBondContact CA-O 3.48Å
64	I	80.3	Confident	74.7	Confident	60 Å²	60	83.9 Å²	83.9	31%	0.308	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	144.7	171.1	60.1	173.3	0	0	0	110.6	F62 A66 Y77 V78 V80 W139	F62-I64 HydrophobicContact CD2-CG2 3.75Å; F62-I64 HydrophobicContact CE2-CG2 3.38Å; I64-A66 PolarHBondContact O-N 2.98Å; I64-Y77 CarbonylContact O-C 3.54Å; I64-Y77 WeakPolarHBondContact O-CA 3.4Å; I64-V78 HydrophobicContact CG1-CB 4.29Å; I64-V78 WeakPolarHBondContact CG1-O 3.5Å; I64-V78 PolarHBondContact N-O 2.85Å; I64-V78 PolarHBondContact O-N 3.49Å; I64-V80 HydrophobicContact CD1-CG2 3.86Å; I64-V80 HydrophobicContact CG1-CG2 3.99Å; I64-W139 HydrophobicContact CG2-CH2 4.28Å
65	K	78.3	Confident	73.5	Confident	118 Å²	118	84 Å²	84	51%	0.513	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	118	168.3	-170	176.6	-177.5	177	0	108.4	G67 Y77	K65-G67 PolarHBondContact O-N 3.38Å; K65-Y77 HydrophobicContact CB-CD1 4.34Å; K65-Y77 HydrophobicContact CB-CE1 4.15Å; K65-Y77 HydrophobicContact CG-CE1 4.28Å
66	A	69.4	Low	72.6	Confident	35 Å²	35	89.6 Å²	89.6	29%	0.289	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-60.6	129.3	175	0	0	0	0	0	109.4	I64 L76 V78	I64-A66 PolarHBondContact O-N 2.98Å; A66-L76 HydrophobicContact CB-CB 3.83Å; A66-L76 VanDerWaalsContact CB-O 3.29Å; A66-L76 WeakPolarHBondContact CB-O 3.31Å; A66-L76 PolarHBondContact N-O 3.16Å; A66-V78 HydrophobicContact CB-CG2 3.78Å
67	G	61.9	Low	72	Confident	69 Å²	69	95.9 Å²	95.9	71%	0.711	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-56.2	144.4	175.1	0	0	0	0	0	110.8	K65 K69	K65-G67 PolarHBondContact O-N 3.38Å; G67-K69 VanDerWaalsContact C-N 3.27Å; G67-K69 PolarHBondContact O-N 3.44Å
68	R	54.7	Low	71.6	Confident	257 Å²	257	95.4 Å²	95.4	97%	0.97	52%	0.516	S	S	*	.			trans	-63.4	85.2	177.7	-74.4	-178.6	176.4	175.5	-0.7	110.6
69	K	54.5	Low	71.6	Confident	198 Å²	198	95.9 Å²	95.9	86%	0.861	52%	0.523	S	S	*	.			trans	-109.8	109.9	147.7	-83.8	-172.7	175.9	179.1	0	107.4	G67	G67-K69 VanDerWaalsContact C-N 3.27Å; G67-K69 PolarHBondContact O-N 3.44Å
70	A	50.5	Low	71.4	Confident	72 Å²	72	96 Å²	96	60%	0.595	52%	0.521	S	S	*	.	S	Bend	trans	96.6	121	158.1	0	0	0	0	0	118.9	S72	A70-S72 PolarHBondContact O-N 2.8Å
71	I	52.4	Low	71.5	Confident	186 Å²	186	99.1 Å²	99.1	95%	0.954	53%	0.531	S	S	*	.	S	Bend		66.1	-11.9	124.1	-54.9	167.6	0	0	0	118.2
72	S	53.9	Low	71.5	Confident	73 Å²	73	95.8 Å²	95.8	51%	0.51	51%	0.511	S	S	.	.			trans	-122.5	133.1	178.6	170.3	0	0	0	0	111.6	A70 I74	A70-S72 PolarHBondContact O-N 2.8Å; S72-I74 PolarHBondContact O-N 3.31Å; S72-I74 PolarHBondContact OG-N 3.14Å
73	C	56.3	Low	71.6	Confident	140 Å²	140	98.3 Å²	98.3	95%	0.946	52%	0.522	S	S	*	.	S	Bend	trans	-76.4	2.2	179	-62.7	0	0	0	0	113.9
74	I	59.7	Low	71.8	Confident	128 Å²	128	97.2 Å²	97.2	66%	0.656	51%	0.514	S	S	*	.	S	Bend	trans	-101.4	125.2	-179.6	-56.2	173.8	0	0	0	108.8	S72 L76	S72-I74 PolarHBondContact O-N 3.31Å; S72-I74 PolarHBondContact OG-N 3.14Å; I74-L76 PolarHBondContact O-N 3.11Å; I74-L76 VanDerWaalsContact O-N 3.16Å
75	P	60.9	Low	72.3	Confident	64 Å²	64	94.4 Å²	94.4	42%	0.416	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-62.2	118.4	173	24.7	-30.8	0	0	0	109.6	Y77	P75-Y77 HydrophobicContact CB-CE2 3.92Å; P75-Y77 HydrophobicContact CG-CE2 3.88Å; P75-Y77 WeakPolarHBondContact O-CD2 3.07Å
76	L	72.8	Confident	72.9	Confident	116 Å²	116	88.9 Å²	88.9	61%	0.607	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-76.2	127	170.6	-79.6	153.2	0	0	0	108.2	A66 I74	A66-L76 HydrophobicContact CB-CB 3.83Å; A66-L76 VanDerWaalsContact CB-O 3.29Å; A66-L76 WeakPolarHBondContact CB-O 3.31Å; A66-L76 PolarHBondContact N-O 3.16Å; I74-L76 PolarHBondContact O-N 3.11Å; I74-L76 VanDerWaalsContact O-N 3.16Å
77	Y	79.1	Confident	73.8	Confident	132 Å²	132	87.3 Å²	87.3	52%	0.518	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	144.3	172.1	-71.2	-86.5	0	0	0	108.5	T63 I64 K65 P75	T63-Y77 HydrophobicContact CG2-CD1 3.91Å; T63-Y77 HydrophobicContact CG2-CG 4.19Å; I64-Y77 CarbonylContact O-C 3.54Å; I64-Y77 WeakPolarHBondContact O-CA 3.4Å; K65-Y77 HydrophobicContact CB-CD1 4.34Å; K65-Y77 HydrophobicContact CB-CE1 4.15Å; K65-Y77 HydrophobicContact CG-CE1 4.28Å; P75-Y77 HydrophobicContact CB-CE2 3.92Å; P75-Y77 HydrophobicContact CG-CE2 3.88Å; P75-Y77 WeakPolarHBondContact O-CD2 3.07Å
78	V	82	Confident	75.2	Confident	45 Å²	45	84 Å²	84	27%	0.273	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	132.6	-179.9	-135.1	0	0	0	0	110.4	T63 I64 A66 M156	T63-V78 CarbonylContact C-O 3.57Å; T63-V78 WeakPolarHBondContact CA-O 3.48Å; I64-V78 HydrophobicContact CG1-CB 4.29Å; I64-V78 WeakPolarHBondContact CG1-O 3.5Å; I64-V78 PolarHBondContact N-O 2.85Å; I64-V78 PolarHBondContact O-N 3.49Å; A66-V78 HydrophobicContact CB-CG2 3.78Å; V78-M156 HydrophobicContact CB-CE 3.43Å; V78-M156 VanDerWaalsContact CB-CE 3.43Å; V78-M156 HydrophobicContact CB-SD 4.19Å; V78-M156 HydrophobicContact CG1-CE 3.09Å; V78-M156 HydrophobicContact CG1-SD 3.16Å; V78-M156 WeakPolarHBondContact CG1-SD 3.48Å; V78-M156 HydrophobicContact CG2-CE 4.33Å
79	E	89.2	Confident	77.1	Confident	125 Å²	125	71.8 Å²	71.8	58%	0.584	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	132.7	177.1	-67.5	-177.3	174.3	0	0	109.6	V61 M156	V61-E79 HydrophobicContact CG1-CB 3.98Å; V61-E79 HydrophobicContact CG1-CG 4.23Å; E79-M156 WeakPolarHBondContact O-CB 3.39Å; E79-M156 WeakPolarHBondContact O-CE 3.46Å
80	V	87.6	Confident	78.9	Confident	13 Å²	13	62.4 Å²	62.4	8%	0.079	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.1	174.9	-178.8	0	0	0	0	107.7	F62 I64 M156 I158	F62-V80 HydrophobicContact CD1-CB 4.06Å; F62-V80 HydrophobicContact CD1-CG1 4.37Å; F62-V80 WeakPolarHBondContact CD1-O 3.24Å; F62-V80 HydrophobicContact CD2-CB 4.47Å; F62-V80 HydrophobicContact CE1-CB 3.5Å; F62-V80 HydrophobicContact CE1-CG1 3.42Å; F62-V80 VanDerWaalsContact CE1-CG1 3.42Å; F62-V80 HydrophobicContact CE2-CB 3.96Å; F62-V80 HydrophobicContact CE2-CG1 4.38Å; F62-V80 HydrophobicContact CE2-CG2 4.29Å; F62-V80 HydrophobicContact CZ-CB 3.46Å; F62-V80 VanDerWaalsContact CZ-CB 3.46Å; F62-V80 HydrophobicContact CZ-CG1 3.43Å; F62-V80 VanDerWaalsContact CZ-CG1 3.43Å; F62-V80 HydrophobicContact CZ-CG2 4.1Å; F62-V80 PolarHBondContact N-O 3.47Å; F62-V80 PolarHBondContact O-N 3.15Å; I64-V80 HydrophobicContact CD1-CG2 3.86Å; I64-V80 HydrophobicContact CG1-CG2 3.99Å; V80-M156 CarbonylContact C-O 3.58Å; V80-M156 VanDerWaalsContact CA-O 3.31Å; V80-M156 WeakPolarHBondContact CA-O 2.98Å; V80-M156 HydrophobicContact CG2-CE 3.99Å; V80-I158 HydrophobicContact CG1-CD1 3.94Å; V80-I158 HydrophobicContact CG1-CG1 3.79Å
81	Q	92.6	Very high	80.9	Confident	84 Å²	84	59.2 Å²	59.2	39%	0.393	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	137.2	-179.9	-57.1	-174.8	-2.9	0	0	110.5	G60 V61 M156 E157 I158	G60-Q81 WeakPolarHBondContact O-CA 3.42Å; V61-Q81 HydrophobicContact CG2-CG 4.35Å; Q81-M156 PolarHBondContact N-O 3.07Å; Q81-E157 HydrophobicContact CB-CG 4.23Å; Q81-E157 WeakPolarHBondContact O-CA 3.28Å; Q81-I158 PolarHBondContact O-N 3.37Å
82	L	92.1	Very high	82.9	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.026	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	128	168	-57.5	179.7	0	0	0	108.8	G59 G60 F62 T85 K134 M135 I138 I158	G59-L82 WeakPolarHBondContact CA-O 3.17Å; G60-L82 PolarHBondContact O-N 2.96Å; F62-L82 HydrophobicContact CD1-CD2 4.16Å; F62-L82 HydrophobicContact CD1-CG 4.21Å; F62-L82 HydrophobicContact CE1-CD2 3.7Å; F62-L82 HydrophobicContact CE1-CG 4.25Å; L82-T85 HydrophobicContact CB-CG2 3.68Å; L82-K134 HydrophobicContact CD1-CB 3.99Å; L82-K134 HydrophobicContact CD1-CD 4.09Å; L82-M135 HydrophobicContact CD1-SD 3.7Å; L82-M135 HydrophobicContact CD2-SD 3.8Å; L82-M135 HydrophobicContact CG-SD 4.16Å; L82-I138 HydrophobicContact CD1-CD1 4.27Å; L82-I138 HydrophobicContact CD2-CD1 4.03Å; L82-I158 HydrophobicContact CD2-CB 4.19Å; L82-I158 HydrophobicContact CD2-CD1 4.36Å
83	K	90.6	Very high	84.9	Confident	77 Å²	77	46.9 Å²	46.9	34%	0.335	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	157.5	174.6	-73.5	-169.1	175.7	171	0	111.1	T85 E157 I158 L160	K83-T85 PolarHBondContact O-N 3.3Å; K83-T85 VanDerWaalsContact O-N 3.14Å; K83-E157 HydrophobicContact CD-CG 4.47Å; K83-E157 WeakPolarHBondContact CD-OE2 3.35Å; K83-E157 VanDerWaalsContact CE-OE1 3.27Å; K83-E157 WeakPolarHBondContact CE-OE1 3.47Å; K83-E157 VanDerWaalsContact CE-OE2 3.3Å; K83-E157 WeakPolarHBondContact CE-OE2 3.41Å; K83-E157 IonicContact NZ-OE1 3.17Å; K83-E157 PolarHBondContact NZ-OE1 2.84Å; K83-E157 IonicContact NZ-OE2 3.87Å; K83-E157 PolarHBondContact NZ-OE2 3.27Å; K83-I158 PolarHBondContact N-O 3.33Å; K83-L160 PolarHBondContact O-N 3.12Å
84	N	88.8	Confident	86.8	Confident	45 Å²	45	40.4 Å²	40.4	24%	0.241	20%	0.201	C	C	.	.			trans	51.2	38.1	176.4	-56.5	-32.4	0	0	0	114.4	W58 C86 D159 F161	W58-N84 WeakPolarHBondContact CZ2-OD1 3.38Å; N84-C86 PolarHBondContact O-N 3.12Å; N84-D159 VanDerWaalsContact CB-OD1 3.28Å; N84-D159 WeakPolarHBondContact CB-OD1 3.18Å; N84-D159 PolarHBondContact ND2-OD1 2.9Å; N84-D159 PolarHBondContact ND2-OD2 3.17Å; N84-F161 HydrophobicContact CB-CB 3.71Å; N84-F161 HydrophobicContact CB-CD2 4.24Å; N84-F161 HydrophobicContact CB-CG 4.45Å
85	T	92	Very high	88.5	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-1.7	-176.2	65.3	0	0	0	0	114.4	G59 L82 K83 T87 I88 D89 L160	G59-T85 PolarHBondContact N-OG1 3.38Å; L82-T85 HydrophobicContact CB-CG2 3.68Å; K83-T85 PolarHBondContact O-N 3.3Å; K83-T85 VanDerWaalsContact O-N 3.14Å; T85-T87 PolarHBondContact O-N 2.94Å; T85-I88 WeakPolarHBondContact O-CG2 3.43Å; T85-I88 PolarHBondContact O-N 3.21Å; T85-I88 VanDerWaalsContact O-N 3.08Å; T85-D89 WeakPolarHBondContact CB-OD2 3.39Å; T85-D89 WeakPolarHBondContact O-CB 3.32Å; T85-D89 PolarHBondContact O-N 2.82Å; T85-D89 VanDerWaalsContact O-OD2 3.12Å; T85-D89 PolarHBondContact OG1-OD2 3.49Å; T85-L160 HydrophobicContact CG2-CD1 3.88Å
86	C	90.1	Very high	90.1	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.02	15%	0.15	C	C	.	.	H	α-helix	trans	-47.9	-39	-178.5	61.7	0	0	0	0	114.8	N84 G90 H294 Y295	N84-C86 PolarHBondContact O-N 3.12Å; C86-G90 PolarHBondContact O-N 2.95Å; C86-G90 VanDerWaalsContact O-N 3.14Å; C86-H294 WeakPolarHBondContact CB-CE1 3.33Å; C86-H294 VanDerWaalsContact CB-ND1 3.32Å; C86-H294 WeakPolarHBondContact CB-ND1 3.33Å; C86-Y295 WeakPolarHBondContact CB-O 3.39Å
87	T	88.8	Confident	91.2	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.006	12%	0.123	C	C	.	.	H	α-helix	trans	-63.9	-52.4	177.7	55.5	0	0	0	0	112.1	T85 F91 L160 E164 Y295	T85-T87 PolarHBondContact O-N 2.94Å; T87-F91 PolarHBondContact O-N 3.39Å; T87-L160 PolarHBondContact OG1-O 3.48Å; T87-E164 HydrophobicContact CG2-CB 3.89Å; T87-Y295 HydrophobicContact CG2-CD2 3.46Å; T87-Y295 VanDerWaalsContact CG2-CD2 3.46Å; T87-Y295 HydrophobicContact CG2-CE2 3.85Å; T87-Y295 HydrophobicContact CG2-CG 3.92Å
88	I	91.8	Very high	91.9	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-70.5	-34.2	-179.7	-171.2	-179.2	0	0	0	111.1	T85 F91 L92 K134 W137 I138 L160	T85-I88 WeakPolarHBondContact O-CG2 3.43Å; T85-I88 PolarHBondContact O-N 3.21Å; T85-I88 VanDerWaalsContact O-N 3.08Å; I88-F91 WeakPolarHBondContact O-CB 3.12Å; I88-F91 PolarHBondContact O-N 2.97Å; I88-L92 HydrophobicContact CD1-CD1 4.11Å; I88-L92 HydrophobicContact CG1-CD1 3.69Å; I88-L92 HydrophobicContact CG1-CG 4.01Å; I88-L92 WeakPolarHBondContact O-CB 3.42Å; I88-L92 WeakPolarHBondContact O-CG 3.46Å; I88-L92 PolarHBondContact O-N 3.45Å; I88-K134 HydrophobicContact CD1-CB 4.38Å; I88-W137 HydrophobicContact CD1-CB 4.04Å; I88-W137 VanDerWaalsContact CD1-CD1 3.44Å; I88-W137 HydrophobicContact CD1-CG 4.03Å; I88-W137 HydrophobicContact CG1-CG 4.41Å; I88-I138 HydrophobicContact CD1-CD1 4.26Å; I88-I138 HydrophobicContact CD1-CG1 3.84Å; I88-L160 HydrophobicContact CG2-CD1 3.84Å
89	D	93.8	Very high	92.5	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-66.3	-47.5	-178.7	-63.5	-20.9	0	0	0	111.6	L56 T85 F91 L92 M93 K134 Y308	L56-D89 HydrophobicContact CB-CB 4.27Å; L56-D89 WeakPolarHBondContact CD1-O 3.48Å; T85-D89 WeakPolarHBondContact CB-OD2 3.39Å; T85-D89 WeakPolarHBondContact O-CB 3.32Å; T85-D89 PolarHBondContact O-N 2.82Å; T85-D89 VanDerWaalsContact O-OD2 3.12Å; T85-D89 PolarHBondContact OG1-OD2 3.49Å; D89-F91 VanDerWaalsContact C-N 3.31Å; D89-F91 PolarHBondContact O-N 3Å; D89-L92 PolarHBondContact O-N 3.29Å; D89-M93 WeakPolarHBondContact O-CB 3.38Å; D89-M93 PolarHBondContact O-N 3.48Å; D89-K134 WeakPolarHBondContact OD1-CE 3.44Å; D89-K134 IonicContact OD1-NZ 3.4Å; D89-K134 IonicContact OD2-NZ 3.93Å; D89-Y308 HydrophobicContact CB-CE1 3.6Å; D89-Y308 VanDerWaalsContact CB-OH 3.32Å; D89-Y308 WeakPolarHBondContact CB-OH 3.44Å
90	G	92.4	Very high	92.7	Very high	2 Å²	2	14 Å²	14	2%	0.021	7%	0.067	C	C	.	.	H	α-helix	trans	-58.8	-43.6	175.1	0	0	0	0	0	112.1	C86 M93 I94	C86-G90 PolarHBondContact O-N 2.95Å; C86-G90 VanDerWaalsContact O-N 3.14Å; G90-M93 PolarHBondContact O-N 3.44Å; G90-I94 WeakPolarHBondContact O-CG1 3.29Å; G90-I94 PolarHBondContact O-N 2.78Å; G90-I94 VanDerWaalsContact O-N 3.1Å
91	F	92.6	Very high	92.8	Very high	4 Å²	4	16 Å²	16	2%	0.018	8%	0.077	C	C	.	.	H	α-helix	trans	-58.3	-53.2	174.3	174	-99.5	0	0	0	112.9	T87 I88 D89 M93 I94 L95 W137 N167 F168 L172	T87-F91 PolarHBondContact O-N 3.39Å; I88-F91 WeakPolarHBondContact O-CB 3.12Å; I88-F91 PolarHBondContact O-N 2.97Å; D89-F91 VanDerWaalsContact C-N 3.31Å; D89-F91 PolarHBondContact O-N 3Å; F91-M93 VanDerWaalsContact C-N 3.28Å; F91-M93 PolarHBondContact O-N 3Å; F91-I94 PolarHBondContact O-N 3.38Å; F91-L95 HydrophobicContact CE1-CB 4.39Å; F91-L95 HydrophobicContact CE1-CD2 3.82Å; F91-L95 HydrophobicContact CZ-CB 4.3Å; F91-L95 HydrophobicContact CZ-CD2 3.88Å; F91-L95 WeakPolarHBondContact O-CB 3.14Å; F91-L95 PolarHBondContact O-N 2.95Å; F91-W137 HydrophobicContact CD1-CD2 4.43Å; F91-W137 HydrophobicContact CD1-CH2 4.14Å; F91-W137 AromaticContact CD1-CZ2 3.87Å; F91-W137 HydrophobicContact CD1-CZ2 3.87Å; F91-W137 AromaticContact CE1-CD2 3.98Å; F91-W137 HydrophobicContact CE1-CD2 3.98Å; F91-W137 AromaticContact CE1-CE2 3.67Å; F91-W137 AromaticContact CE1-CE3 3.89Å; F91-W137 HydrophobicContact CE1-CE3 3.89Å; F91-W137 AromaticContact CE1-CH2 3.08Å; F91-W137 HydrophobicContact CE1-CH2 3.08Å; F91-W137 AromaticContact CE1-CZ2 3.24Å; F91-W137 HydrophobicContact CE1-CZ2 3.24Å; F91-W137 AromaticContact CE1-CZ3 3.45Å; F91-W137 HydrophobicContact CE1-CZ3 3.45Å; F91-W137 VanDerWaalsContact CE1-CZ3 3.45Å; F91-W137 HydrophobicContact CE2-CH2 4.26Å; F91-W137 HydrophobicContact CE2-CZ2 4.43Å; F91-W137 AromaticContact CZ-CH2 3.15Å; F91-W137 HydrophobicContact CZ-CH2 3.15Å; F91-W137 AromaticContact CZ-CZ2 3.58Å; F91-W137 HydrophobicContact CZ-CZ2 3.58Å; F91-W137 AromaticContact CZ-CZ3 3.8Å; F91-W137 HydrophobicContact CZ-CZ3 3.8Å; F91-N167 HydrophobicContact CB-CB 4.12Å; F91-N167 HydrophobicContact CD1-CB 4.5Å; F91-N167 HydrophobicContact CD2-CB 4.22Å; F91-N167 WeakPolarHBondContact CE2-O 3.42Å; F91-N167 HydrophobicContact CG-CB 3.99Å; F91-F168 VanDerWaalsContact CA-CZ 3.46Å; F91-F168 HydrophobicContact CB-CD2 4.15Å; F91-F168 HydrophobicContact CB-CE2 3.41Å; F91-F168 VanDerWaalsContact CB-CE2 3.41Å; F91-F168 HydrophobicContact CB-CZ 3.76Å; F91-F168 AromaticContact CD2-CD1 3.93Å; F91-F168 HydrophobicContact CD2-CD1 3.93Å; F91-F168 AromaticContact CD2-CD2 3.71Å; F91-F168 HydrophobicContact CD2-CD2 3.71Å; F91-F168 AromaticContact CD2-CE1 3.75Å; F91-F168 HydrophobicContact CD2-CE1 3.75Å; F91-F168 AromaticContact CD2-CE2 3.56Å; F91-F168 HydrophobicContact CD2-CE2 3.56Å; F91-F168 AromaticContact CD2-CG 3.94Å; F91-F168 HydrophobicContact CD2-CG 3.94Å; F91-F168 AromaticContact CD2-CZ 3.6Å; F91-F168 HydrophobicContact CD2-CZ 3.6Å; F91-F168 HydrophobicContact CE2-CD1 4.41Å; F91-F168 HydrophobicContact CE2-CE1 4.46Å; F91-F168 HydrophobicContact CG-CD2 4.34Å; F91-F168 AromaticContact CG-CE2 3.96Å; F91-F168 HydrophobicContact CG-CE2 3.96Å; F91-F168 HydrophobicContact CG-CZ 4.17Å; F91-L172 HydrophobicContact CE2-CD1 4.05Å; F91-L172 HydrophobicContact CZ-CD1 4.44Å
92	L	95.1	Very high	92.7	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-64.3	-36	-176.7	-67.9	168.5	0	0	0	111.2	L56 I88 D89 Y96 F121 V133 K134 W137	L56-L92 HydrophobicContact CD1-CB 3.92Å; L56-L92 HydrophobicContact CD2-CB 4.48Å; L56-L92 HydrophobicContact CD2-CD1 4.28Å; I88-L92 HydrophobicContact CD1-CD1 4.11Å; I88-L92 HydrophobicContact CG1-CD1 3.69Å; I88-L92 HydrophobicContact CG1-CG 4.01Å; I88-L92 WeakPolarHBondContact O-CB 3.42Å; I88-L92 WeakPolarHBondContact O-CG 3.46Å; I88-L92 PolarHBondContact O-N 3.45Å; D89-L92 PolarHBondContact O-N 3.29Å; L92-Y96 VanDerWaalsContact O-CB 3.26Å; L92-Y96 WeakPolarHBondContact O-CB 3.42Å; L92-Y96 PolarHBondContact O-N 3.46Å; L92-F121 HydrophobicContact CB-CE2 4.25Å; L92-F121 HydrophobicContact CD2-CD2 4.27Å; L92-F121 HydrophobicContact CD2-CE2 3.63Å; L92-F121 HydrophobicContact CD2-CZ 4.4Å; L92-F121 HydrophobicContact CG-CE2 4.48Å; L92-F121 WeakPolarHBondContact O-CZ 3.18Å; L92-V133 HydrophobicContact CD1-CG1 3.75Å; L92-V133 HydrophobicContact CD2-CG1 4.14Å; L92-V133 HydrophobicContact CG-CG1 4.37Å; L92-K134 HydrophobicContact CD1-CG 4.15Å; L92-W137 HydrophobicContact CD2-CB 4.15Å; L92-W137 HydrophobicContact CD2-CD2 4.47Å; L92-W137 HydrophobicContact CD2-CG 4.33Å
93	M	95.6	Very high	92.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63.7	-48.8	176.2	-167.4	63.4	-125.5	0	0	111.6	I37 V55 L56 D89 G90 F91 Y96 V97 M125 F299 Y308	I37-M93 HydrophobicContact CD1-CE 4.11Å; V55-M93 HydrophobicContact CG1-SD 3.61Å; L56-M93 HydrophobicContact CD1-CB 3.92Å; L56-M93 HydrophobicContact CD1-SD 4.27Å; D89-M93 WeakPolarHBondContact O-CB 3.38Å; D89-M93 PolarHBondContact O-N 3.48Å; G90-M93 PolarHBondContact O-N 3.44Å; F91-M93 VanDerWaalsContact C-N 3.28Å; F91-M93 PolarHBondContact O-N 3Å; M93-Y96 HydrophobicContact CE-CD1 3.87Å; M93-Y96 PolarHBondContact O-N 2.88Å; M93-V97 HydrophobicContact CE-CG2 3.6Å; M93-V97 WeakPolarHBondContact O-CG2 3.34Å; M93-V97 PolarHBondContact O-N 3.5Å; M93-V97 VanDerWaalsContact O-N 3.08Å; M93-M125 HydrophobicContact SD-CE 4.42Å; M93-F299 HydrophobicContact CB-CE1 4.25Å; M93-F299 HydrophobicContact CE-CE1 4.46Å; M93-F299 HydrophobicContact CE-CE2 4.12Å; M93-F299 HydrophobicContact CE-CZ 3.74Å; M93-F299 HydrophobicContact CG-CD1 4.18Å; M93-F299 HydrophobicContact CG-CE1 3.27Å; M93-F299 HydrophobicContact CG-CZ 3.48Å; M93-F299 VanDerWaalsContact CG-CZ 3.48Å; M93-F299 HydrophobicContact SD-CZ 4.21Å; M93-Y308 HydrophobicContact CG-CG 4.32Å
94	I	95.1	Very high	92	Very high	4 Å²	4	17.3 Å²	17.3	2%	0.021	10%	0.098	C	C	.	.	H	α-helix	trans	-61.9	-46.5	176.9	-69.7	166.8	0	0	0	110.6	G90 F91 Y96 V97 I98 F168 T286 A297 F299 V332	G90-I94 WeakPolarHBondContact O-CG1 3.29Å; G90-I94 PolarHBondContact O-N 2.78Å; G90-I94 VanDerWaalsContact O-N 3.1Å; F91-I94 PolarHBondContact O-N 3.38Å; I94-Y96 VanDerWaalsContact C-N 3.3Å; I94-Y96 PolarHBondContact O-N 3.36Å; I94-V97 PolarHBondContact O-N 2.82Å; I94-I98 HydrophobicContact CG2-CD1 3.63Å; I94-I98 HydrophobicContact CG2-CG1 4.25Å; I94-I98 VanDerWaalsContact O-CG1 3.25Å; I94-I98 WeakPolarHBondContact O-CG1 3.47Å; I94-I98 PolarHBondContact O-N 2.94Å; I94-F168 HydrophobicContact CD1-CE1 4.27Å; I94-F168 HydrophobicContact CD1-CZ 4.01Å; I94-T286 HydrophobicContact CD1-CG2 3.89Å; I94-A297 HydrophobicContact CD1-CB 3.89Å; I94-A297 HydrophobicContact CG1-CB 4.2Å; I94-F299 HydrophobicContact CG1-CB 4.34Å; I94-F299 HydrophobicContact CG1-CD1 4.15Å; I94-V332 HydrophobicContact CD1-CG2 4.47Å; I94-V332 HydrophobicContact CG2-CB 4.42Å; I94-V332 HydrophobicContact CG2-CG1 4.2Å; I94-V332 HydrophobicContact CG2-CG2 4.19Å
95	L	94.9	Very high	92.2	Very high	3 Å²	3	15.7 Å²	15.7	2%	0.016	9%	0.089	C	C	.	.	H	α-helix	trans	-59.7	-41.3	178.4	179.8	62.7	0	0	0	111.9	F91 L99 L113 F121 W137 F253	F91-L95 HydrophobicContact CE1-CB 4.39Å; F91-L95 HydrophobicContact CE1-CD2 3.82Å; F91-L95 HydrophobicContact CZ-CB 4.3Å; F91-L95 HydrophobicContact CZ-CD2 3.88Å; F91-L95 WeakPolarHBondContact O-CB 3.14Å; F91-L95 PolarHBondContact O-N 2.95Å; L95-L99 HydrophobicContact CD1-CD1 4.02Å; L95-L99 HydrophobicContact CD1-CG 4.28Å; L95-L99 HydrophobicContact CG-CD1 3.99Å; L95-L99 WeakPolarHBondContact O-CB 3.34Å; L95-L99 WeakPolarHBondContact O-CG 2.78Å; L95-L99 PolarHBondContact O-N 3.4Å; L95-L113 HydrophobicContact CD2-CD1 4.44Å; L95-F121 HydrophobicContact CB-CZ 4.37Å; L95-F121 HydrophobicContact CD2-CE1 4.12Å; L95-F121 HydrophobicContact CD2-CZ 4.19Å; L95-F121 HydrophobicContact CG-CE1 4Å; L95-F121 HydrophobicContact CG-CZ 4.24Å; L95-W137 HydrophobicContact CD2-CZ3 4.45Å; L95-F253 HydrophobicContact CD1-CE1 4.41Å; L95-F253 HydrophobicContact CD1-CZ 4.48Å
96	Y	96.1	Very high	92.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.1	-46.6	177.1	176.3	-105.3	0	0	0	111.9	L33 F34 L92 M93 I94 L99 R100 F121 L122 M125 D126	L33-Y96 HydrophobicContact CB-CE1 4.35Å; L33-Y96 WeakPolarHBondContact CB-OH 3.38Å; L33-Y96 HydrophobicContact CD2-CE1 3.91Å; L33-Y96 HydrophobicContact CG-CE1 3.96Å; L33-Y96 PolarHBondContact N-OH 3.33Å; F34-Y96 HydrophobicContact CB-CE1 3.82Å; F34-Y96 WeakPolarHBondContact CB-OH 3.47Å; F34-Y96 HydrophobicContact CD2-CE1 4.48Å; F34-Y96 PolarHBondContact N-OH 2.92Å; L92-Y96 VanDerWaalsContact O-CB 3.26Å; L92-Y96 WeakPolarHBondContact O-CB 3.42Å; L92-Y96 PolarHBondContact O-N 3.46Å; M93-Y96 HydrophobicContact CE-CD1 3.87Å; M93-Y96 PolarHBondContact O-N 2.88Å; I94-Y96 VanDerWaalsContact C-N 3.3Å; I94-Y96 PolarHBondContact O-N 3.36Å; Y96-L99 PolarHBondContact O-N 3.24Å; Y96-R100 HydrophobicContact CD1-CG 4.47Å; Y96-R100 HydrophobicContact CD2-CG 4.11Å; Y96-R100 HydrophobicContact CE1-CG 4.09Å; Y96-R100 HydrophobicContact CE2-CG 3.7Å; Y96-R100 HydrophobicContact CG-CG 4.48Å; Y96-R100 WeakPolarHBondContact O-CB 3.45Å; Y96-R100 WeakPolarHBondContact O-CG 3.11Å; Y96-R100 PolarHBondContact O-N 3.34Å; Y96-F121 HydrophobicContact CD2-CE1 4.44Å; Y96-L122 HydrophobicContact CD2-CD2 3.89Å; Y96-L122 HydrophobicContact CE2-CD2 4.14Å; Y96-M125 HydrophobicContact CD1-CE 3.96Å; Y96-M125 HydrophobicContact CD2-CB 3.35Å; Y96-M125 HydrophobicContact CD2-CE 4.05Å; Y96-M125 HydrophobicContact CD2-CG 3.65Å; Y96-M125 HydrophobicContact CE2-CB 3.37Å; Y96-M125 HydrophobicContact CE2-CG 4.21Å; Y96-M125 HydrophobicContact CG-CB 4.17Å; Y96-M125 HydrophobicContact CG-CE 3.63Å; Y96-M125 HydrophobicContact CG-CG 4.18Å; Y96-D126 WeakPolarHBondContact CE2-OD1 3.24Å; Y96-D126 PolarHBondContact OH-OD1 3.15Å
97	V	95.1	Very high	92.2	Very high	6 Å²	6	27.8 Å²	27.8	4%	0.036	14%	0.136	C	C	.	.	H	α-helix	trans	-62.8	-48.9	178.4	168.4	0	0	0	0	111	F34 M93 I94 L99 R100 D101 F299 Q300 I301	F34-V97 HydrophobicContact CE2-CG1 4.22Å; F34-V97 HydrophobicContact CE2-CG2 4.46Å; M93-V97 HydrophobicContact CE-CG2 3.6Å; M93-V97 WeakPolarHBondContact O-CG2 3.34Å; M93-V97 PolarHBondContact O-N 3.5Å; M93-V97 VanDerWaalsContact O-N 3.08Å; I94-V97 PolarHBondContact O-N 2.82Å; V97-L99 VanDerWaalsContact C-N 3.3Å; V97-L99 PolarHBondContact O-N 2.89Å; V97-R100 PolarHBondContact O-N 3.24Å; V97-D101 WeakPolarHBondContact O-CB 3.48Å; V97-D101 PolarHBondContact O-N 3Å; V97-F299 HydrophobicContact CB-CD2 4.3Å; V97-F299 HydrophobicContact CG1-CD2 4.14Å; V97-F299 HydrophobicContact CG2-CD2 3.62Å; V97-F299 HydrophobicContact CG2-CE2 3.67Å; V97-F299 HydrophobicContact CG2-CG 4.26Å; V97-F299 HydrophobicContact CG2-CZ 4.36Å; V97-Q300 WeakPolarHBondContact CG1-O 3.48Å; V97-I301 HydrophobicContact CG1-CG1 4.1Å; V97-I301 HydrophobicContact CG2-CD1 4.25Å; V97-I301 HydrophobicContact CG2-CG1 4.47Å
98	I	93.6	Very high	92.3	Very high	5 Å²	5	30.8 Å²	30.8	3%	0.026	15%	0.149	C	C	.	.	H	α-helix	trans	-53.3	-49.9	177.4	-69.5	170	0	0	0	110.7	I94 N102 F105 F253 V332 I334	I94-I98 HydrophobicContact CG2-CD1 3.63Å; I94-I98 HydrophobicContact CG2-CG1 4.25Å; I94-I98 VanDerWaalsContact O-CG1 3.25Å; I94-I98 WeakPolarHBondContact O-CG1 3.47Å; I94-I98 PolarHBondContact O-N 2.94Å; I98-N102 WeakPolarHBondContact O-CB 3.3Å; I98-N102 PolarHBondContact O-N 2.74Å; I98-N102 VanDerWaalsContact O-N 3.15Å; I98-N102 PolarHBondContact O-ND2 3.42Å; I98-F105 HydrophobicContact CG2-CD2 3.91Å; I98-F105 HydrophobicContact CG2-CE2 4.43Å; I98-F253 HydrophobicContact CD1-CD1 4.2Å; I98-F253 HydrophobicContact CD1-CG 4.24Å; I98-F253 HydrophobicContact CG2-CD1 3.89Å; I98-F253 HydrophobicContact CG2-CE1 4.35Å; I98-V332 HydrophobicContact CD1-CG1 3.8Å; I98-I334 HydrophobicContact CB-CD1 4.35Å; I98-I334 HydrophobicContact CD1-CD1 4.47Å; I98-I334 HydrophobicContact CD1-CG1 4.48Å; I98-I334 HydrophobicContact CG1-CD1 3.66Å; I98-I334 HydrophobicContact CG1-CG1 4.18Å; I98-I334 HydrophobicContact CG2-CD1 4.31Å
99	L	94.1	Very high	92.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-66.3	-43.5	-178.8	-75	168.9	0	0	0	111.4	L95 Y96 V97 N102 H106 L109 V118 F121 L122	L95-L99 HydrophobicContact CD1-CD1 4.02Å; L95-L99 HydrophobicContact CD1-CG 4.28Å; L95-L99 HydrophobicContact CG-CD1 3.99Å; L95-L99 WeakPolarHBondContact O-CB 3.34Å; L95-L99 WeakPolarHBondContact O-CG 2.78Å; L95-L99 PolarHBondContact O-N 3.4Å; Y96-L99 PolarHBondContact O-N 3.24Å; V97-L99 VanDerWaalsContact C-N 3.3Å; V97-L99 PolarHBondContact O-N 2.89Å; L99-N102 CarbonylContact O-C 3.58Å; L99-H106 PolarHBondContact O-CD2 3.3Å; L99-H106 VanDerWaalsContact O-CD2 3.26Å; L99-H106 PolarHBondContact O-NE2 3.16Å; L99-L109 HydrophobicContact CD2-CB 4.39Å; L99-L109 HydrophobicContact CD2-CD1 3.45Å; L99-L109 VanDerWaalsContact CD2-CD1 3.45Å; L99-L109 HydrophobicContact CG-CD1 4.18Å; L99-V118 HydrophobicContact CD1-CG1 4.23Å; L99-V118 HydrophobicContact CD2-CG1 4.18Å; L99-F121 HydrophobicContact CD1-CD1 3.91Å; L99-F121 HydrophobicContact CD1-CE1 3.86Å; L99-L122 HydrophobicContact CB-CD2 3.88Å; L99-L122 HydrophobicContact CD1-CD2 4.14Å; L99-L122 HydrophobicContact CD1-CG 4.4Å
100	R	93.6	Very high	92.2	Very high	43 Å²	43	31.8 Å²	31.8	16%	0.162	16%	0.157	C	C	.	.	H	α-helix	trans	-68.8	-39.2	-176.8	-78	-76.8	173.7	-162.5	-7.6	113.1	F34 Y96 V97 N102 Q103 L122 D126	F34-R100 HydrophobicContact CB-CB 3.81Å; F34-R100 HydrophobicContact CB-CG 3.76Å; F34-R100 HydrophobicContact CD1-CB 3.77Å; F34-R100 HydrophobicContact CD2-CB 3.61Å; F34-R100 HydrophobicContact CD2-CG 4.32Å; F34-R100 HydrophobicContact CE1-CB 4.16Å; F34-R100 HydrophobicContact CE2-CB 4.06Å; F34-R100 HydrophobicContact CG-CB 3.45Å; F34-R100 VanDerWaalsContact CG-CB 3.45Å; F34-R100 HydrophobicContact CG-CG 4Å; F34-R100 HydrophobicContact CZ-CB 4.32Å; Y96-R100 HydrophobicContact CD1-CG 4.47Å; Y96-R100 HydrophobicContact CD2-CG 4.11Å; Y96-R100 HydrophobicContact CE1-CG 4.09Å; Y96-R100 HydrophobicContact CE2-CG 3.7Å; Y96-R100 HydrophobicContact CG-CG 4.48Å; Y96-R100 WeakPolarHBondContact O-CB 3.45Å; Y96-R100 WeakPolarHBondContact O-CG 3.11Å; Y96-R100 PolarHBondContact O-N 3.34Å; V97-R100 PolarHBondContact O-N 3.24Å; R100-N102 VanDerWaalsContact C-N 3.34Å; R100-Q103 PolarHBondContact O-NE2 2.93Å; R100-Q103 VanDerWaalsContact O-NE2 3.07Å; R100-L122 HydrophobicContact CG-CD2 4.24Å; R100-L122 PolarHBondContact NH2-O 2.7Å; R100-D126 IonicContact CZ-OD1 3.98Å; R100-D126 IonicContact CZ-OD2 3.76Å; R100-D126 IonicContact NE-OD1 2.7Å; R100-D126 PolarHBondContact NE-OD1 2.81Å; R100-D126 IonicContact NE-OD2 3.21Å; R100-D126 IonicContact NH1-OD2 2.81Å; R100-D126 IonicContact NH2-OD1 2.66Å; R100-D126 PolarHBondContact NH2-OD1 3.41Å; R100-D126 VanDerWaalsContact NH2-OD1 3.09Å; R100-D126 IonicContact NH2-OD2 3.53Å; R100-D126 PolarHBondContact NH2-OD2 2.84Å
101	D	90.8	Very high	92.1	Very high	54 Å²	54	37.1 Å²	37.1	29%	0.289	19%	0.19	S	C	.	.	H	α-helix	trans	-77.3	-24.5	-178.5	-155.4	42.2	0	0	0	112.4	F34 R38 V97	F34-D101 HydrophobicContact CE2-CB 4.4Å; F34-D101 HydrophobicContact CZ-CB 3.79Å; R38-D101 IonicContact CZ-OD1 2.83Å; R38-D101 IonicContact NH2-OD1 3.7Å; R38-D101 PolarHBondContact NH2-OD1 2.97Å; V97-D101 WeakPolarHBondContact O-CB 3.48Å; V97-D101 PolarHBondContact O-N 3Å
102	N	89.4	Confident	91.9	Very high	26 Å²	26	39.5 Å²	39.5	14%	0.139	20%	0.2	C	C	.	.			trans	-124.3	85.5	-177.4	-64.4	-89.5	0	0	0	112.2	I98 L99 R100 G104 F105	I98-N102 WeakPolarHBondContact O-CB 3.3Å; I98-N102 PolarHBondContact O-N 2.74Å; I98-N102 VanDerWaalsContact O-N 3.15Å; I98-N102 PolarHBondContact O-ND2 3.42Å; L99-N102 CarbonylContact O-C 3.58Å; R100-N102 VanDerWaalsContact C-N 3.34Å; N102-G104 PolarHBondContact O-N 2.89Å; N102-G104 VanDerWaalsContact O-N 3.09Å; N102-F105 HydrophobicContact CB-CB 4.35Å; N102-F105 HydrophobicContact CB-CD1 4.42Å; N102-F105 HydrophobicContact CB-CD2 3.2Å; N102-F105 HydrophobicContact CB-CE2 3.36Å; N102-F105 HydrophobicContact CB-CG 3.76Å; N102-F105 HydrophobicContact CB-CZ 4.09Å; N102-F105 VanDerWaalsContact CG-CE2 3.42Å; N102-F105 WeakPolarHBondContact O-CB 3.43Å; N102-F105 PolarHBondContact O-N 2.8Å
103	Q	82.6	Confident	91.5	Very high	118 Å²	118	39.9 Å²	39.9	55%	0.551	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-30.8	-177.8	-63.3	-63.8	-40.4	0	0	113.9	R100 F105 H106	R100-Q103 PolarHBondContact O-NE2 2.93Å; R100-Q103 VanDerWaalsContact O-NE2 3.07Å; Q103-F105 VanDerWaalsContact C-N 3.27Å; Q103-F105 PolarHBondContact O-N 2.94Å; Q103-H106 PolarHBondContact O-N 3.41Å; Q103-H106 PolarHBondContact OE1-CE1 2.9Å
104	G	86	Confident	91.2	Very high	49 Å²	49	41.3 Å²	41.3	51%	0.505	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-31	176.6	0	0	0	0	0	113.5	N102 H106	N102-G104 PolarHBondContact O-N 2.89Å; N102-G104 VanDerWaalsContact O-N 3.09Å; G104-H106 VanDerWaalsContact C-N 3.28Å; G104-H106 PolarHBondContact O-N 3.05Å
105	F	92.3	Very high	91.1	Very high	12 Å²	12	47.4 Å²	47.4	5%	0.053	24%	0.243	C	C	.	.	H	α-helix	trans	-74.3	-16.8	-175.3	-63.2	-16.6	0	0	0	113.8	I98 N102 Q103 R107 E108 L109 A252 I334	I98-F105 HydrophobicContact CG2-CD2 3.91Å; I98-F105 HydrophobicContact CG2-CE2 4.43Å; N102-F105 HydrophobicContact CB-CB 4.35Å; N102-F105 HydrophobicContact CB-CD1 4.42Å; N102-F105 HydrophobicContact CB-CD2 3.2Å; N102-F105 HydrophobicContact CB-CE2 3.36Å; N102-F105 HydrophobicContact CB-CG 3.76Å; N102-F105 HydrophobicContact CB-CZ 4.09Å; N102-F105 VanDerWaalsContact CG-CE2 3.42Å; N102-F105 WeakPolarHBondContact O-CB 3.43Å; N102-F105 PolarHBondContact O-N 2.8Å; Q103-F105 VanDerWaalsContact C-N 3.27Å; Q103-F105 PolarHBondContact O-N 2.94Å; F105-R107 VanDerWaalsContact C-N 3.26Å; F105-R107 PolarHBondContact O-N 3.01Å; F105-E108 PolarHBondContact O-N 2.66Å; F105-L109 HydrophobicContact CB-CD1 4.05Å; F105-L109 WeakPolarHBondContact O-CB 3.38Å; F105-L109 PolarHBondContact O-N 3.06Å; F105-A252 HydrophobicContact CB-CB 4.16Å; F105-A252 HydrophobicContact CD1-CB 3.51Å; F105-A252 HydrophobicContact CD2-CB 3.94Å; F105-A252 HydrophobicContact CE1-CB 3.79Å; F105-A252 HydrophobicContact CE2-CB 4.22Å; F105-A252 HydrophobicContact CG-CB 3.6Å; F105-A252 HydrophobicContact CZ-CB 4.15Å; F105-I334 HydrophobicContact CE2-CG2 3.37Å; F105-I334 HydrophobicContact CZ-CG2 3.68Å
106	H	91.6	Very high	90.9	Very high	40 Å²	40	53.6 Å²	53.6	19%	0.185	27%	0.272	C	S	.	.	H	α-helix	trans	-56.2	-46.1	176.6	-65.9	-172.2	0	0	0	110.7	L99 Q103 G104 A110 V118	L99-H106 PolarHBondContact O-CD2 3.3Å; L99-H106 VanDerWaalsContact O-CD2 3.26Å; L99-H106 PolarHBondContact O-NE2 3.16Å; Q103-H106 PolarHBondContact O-N 3.41Å; Q103-H106 PolarHBondContact OE1-CE1 2.9Å; G104-H106 VanDerWaalsContact C-N 3.28Å; G104-H106 PolarHBondContact O-N 3.05Å; H106-A110 WeakPolarHBondContact O-CB 3.09Å; H106-A110 PolarHBondContact O-N 3.17Å; H106-V118 HydrophobicContact CB-CG1 4.49Å
107	R	90.6	Very high	90.8	Very high	217 Å²	217	54.2 Å²	54.2	82%	0.819	28%	0.275	S	S	*	.	H	α-helix	trans	-70.4	-41	-179.2	-65.9	-176.7	-178.7	-177.7	1.6	111.6	F105	F105-R107 VanDerWaalsContact C-N 3.26Å; F105-R107 PolarHBondContact O-N 3.01Å
108	E	91.8	Very high	90.7	Very high	64 Å²	64	54.1 Å²	54.1	30%	0.299	27%	0.274	S	S	.	.	H	α-helix	trans	-63	-49.5	177.9	-67.4	-178.2	-127.5	0	0	111.1	F105 A110 V111 F112 R335	F105-E108 PolarHBondContact O-N 2.66Å; E108-A110 PolarHBondContact O-N 3.29Å; E108-V111 WeakPolarHBondContact O-CB 3.22Å; E108-V111 PolarHBondContact O-N 2.79Å; E108-F112 VanDerWaalsContact O-CD2 3.3Å; E108-F112 WeakPolarHBondContact O-CD2 3.34Å; E108-R335 VanDerWaalsContact CD-NH2 3.25Å; E108-R335 IonicContact OE1-CZ 3.87Å; E108-R335 IonicContact OE1-NH2 2.77Å; E108-R335 PolarHBondContact OE1-NH2 3.29Å; E108-R335 IonicContact OE2-CZ 3.37Å; E108-R335 IonicContact OE2-NH1 2.97Å; E108-R335 PolarHBondContact OE2-NH1 3.19Å; E108-R335 IonicContact OE2-NH2 2.95Å; E108-R335 PolarHBondContact OE2-NH2 2.74Å
109	L	91.1	Very high	90.7	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-71.9	-29.6	-179	-73.6	159.1	0	0	0	112.6	L99 F105 V111 F112 L113 L175 F253	L99-L109 HydrophobicContact CD2-CB 4.39Å; L99-L109 HydrophobicContact CD2-CD1 3.45Å; L99-L109 VanDerWaalsContact CD2-CD1 3.45Å; L99-L109 HydrophobicContact CG-CD1 4.18Å; F105-L109 HydrophobicContact CB-CD1 4.05Å; F105-L109 WeakPolarHBondContact O-CB 3.38Å; F105-L109 PolarHBondContact O-N 3.06Å; L109-V111 PolarHBondContact O-N 2.9Å; L109-F112 PolarHBondContact O-N 2.8Å; L109-L113 HydrophobicContact CB-CD1 4.38Å; L109-L113 HydrophobicContact CD2-CD1 4.43Å; L109-L113 WeakPolarHBondContact O-CB 3.4Å; L109-L113 PolarHBondContact O-N 3.01Å; L109-L175 HydrophobicContact CD2-CD1 4.2Å; L109-L175 HydrophobicContact CD2-CD2 3.76Å; L109-F253 HydrophobicContact CD1-CD1 4.32Å; L109-F253 HydrophobicContact CD1-CE1 3.73Å; L109-F253 HydrophobicContact CD2-CD1 4.37Å; L109-F253 HydrophobicContact CD2-CE1 3.46Å; L109-F253 VanDerWaalsContact CD2-CE1 3.46Å; L109-F253 HydrophobicContact CD2-CZ 3.97Å; L109-F253 HydrophobicContact CG-CE1 4.18Å
110	A	91.6	Very high	90.8	Very high	20 Å²	20	61.2 Å²	61.2	17%	0.165	31%	0.307	C	S	.	.	H	α-helix	trans	-59.3	-26.8	173.9	0	0	0	0	0	113.1	H106 E108 F112 G114 K115 V118	H106-A110 WeakPolarHBondContact O-CB 3.09Å; H106-A110 PolarHBondContact O-N 3.17Å; E108-A110 PolarHBondContact O-N 3.29Å; A110-F112 VanDerWaalsContact C-N 3.28Å; A110-F112 PolarHBondContact O-N 3.3Å; A110-G114 CarbonylContact O-C 3.59Å; A110-G114 WeakPolarHBondContact O-CA 3.38Å; A110-G114 PolarHBondContact O-N 3.06Å; A110-K115 HydrophobicContact CB-CB 4.12Å; A110-K115 PolarHBondContact O-N 3.38Å; A110-V118 HydrophobicContact CB-CG2 4.39Å
111	V	90.1	Very high	90.9	Very high	115 Å²	115	59.1 Å²	59.1	70%	0.697	30%	0.299	S	S	*	.	H	α-helix	trans	-64.8	-34.3	174.3	177.6	0	0	0	0	111.4	E108 L109	E108-V111 WeakPolarHBondContact O-CB 3.22Å; E108-V111 PolarHBondContact O-N 2.79Å; L109-V111 PolarHBondContact O-N 2.9Å
112	F	87.9	Confident	91.2	Very high	53 Å²	53	57.2 Å²	57.2	23%	0.232	29%	0.289	C	S	.	.	H	α-helix	trans	-98.4	-40	-174.6	-58.5	-78.1	0	0	0	113.2	E108 L109 A110 N174 L175 H248	E108-F112 VanDerWaalsContact O-CD2 3.3Å; E108-F112 WeakPolarHBondContact O-CD2 3.34Å; L109-F112 PolarHBondContact O-N 2.8Å; A110-F112 VanDerWaalsContact C-N 3.28Å; A110-F112 PolarHBondContact O-N 3.3Å; F112-N174 HydrophobicContact CD1-CB 3.9Å; F112-N174 HydrophobicContact CE1-CB 4.31Å; F112-L175 HydrophobicContact CD1-CB 4.45Å; F112-L175 HydrophobicContact CD2-CB 4.42Å; F112-L175 HydrophobicContact CD2-CD1 3.59Å; F112-L175 HydrophobicContact CE2-CD1 3.56Å; F112-L175 HydrophobicContact CG-CB 4.27Å; F112-L175 HydrophobicContact CG-CD1 4.28Å; F112-L175 HydrophobicContact CZ-CD1 4.23Å; F112-H248 HydrophobicContact CE1-CB 4.42Å; F112-H248 AromaticContact CE1-CD2 3.71Å; F112-H248 HydrophobicContact CZ-CB 3.9Å
113	L	87.8	Confident	91.5	Very high	8 Å²	8	61 Å²	61	4%	0.042	30%	0.302	C	S	.	.	H	α-helix	trans	-92.6	-22.6	-177.4	-59.6	-178.1	0	0	0	112.6	L95 L109 F117 V118 W137 L172	L95-L113 HydrophobicContact CD2-CD1 4.44Å; L109-L113 HydrophobicContact CB-CD1 4.38Å; L109-L113 HydrophobicContact CD2-CD1 4.43Å; L109-L113 WeakPolarHBondContact O-CB 3.4Å; L109-L113 PolarHBondContact O-N 3.01Å; L113-F117 HydrophobicContact CB-CD1 3.77Å; L113-F117 HydrophobicContact CB-CE1 4.34Å; L113-F117 HydrophobicContact CD1-CD1 4.35Å; L113-F117 HydrophobicContact CD1-CE1 4.16Å; L113-F117 WeakPolarHBondContact O-CB 3.17Å; L113-V118 HydrophobicContact CB-CG2 4.1Å; L113-V118 HydrophobicContact CD1-CG2 4.44Å; L113-W137 HydrophobicContact CD2-CZ3 4.42Å; L113-L172 HydrophobicContact CD2-CD2 3.86Å
114	G	90.1	Very high	92.1	Very high	31 Å²	31	55.5 Å²	55.5	32%	0.32	28%	0.276	S	S	.	.			trans	97.3	133.5	-172.5	0	0	0	0	0	111.7	A110 Q116 F117 V118	A110-G114 CarbonylContact O-C 3.59Å; A110-G114 WeakPolarHBondContact O-CA 3.38Å; A110-G114 PolarHBondContact O-N 3.06Å; G114-Q116 PolarHBondContact O-N 2.98Å; G114-F117 WeakPolarHBondContact O-CB 3.39Å; G114-F117 PolarHBondContact O-N 3.4Å; G114-F117 VanDerWaalsContact O-N 3.15Å; G114-V118 PolarHBondContact O-N 2.68Å; G114-V118 VanDerWaalsContact O-N 3.09Å
115	K	92.1	Very high	92.6	Very high	132 Å²	132	53.1 Å²	53.1	57%	0.574	25%	0.252	S	S	*	.	H	α-helix	trans	-54.6	-50.7	-179.8	-178.7	-177.7	171.1	-175	0	112.8	A110 F117 V118 E119	A110-K115 HydrophobicContact CB-CB 4.12Å; A110-K115 PolarHBondContact O-N 3.38Å; K115-F117 VanDerWaalsContact C-N 3.26Å; K115-F117 PolarHBondContact O-N 3.18Å; K115-V118 PolarHBondContact O-N 3.26Å; K115-E119 VanDerWaalsContact CE-CD 3.47Å; K115-E119 WeakPolarHBondContact CE-OE1 3.48Å; K115-E119 HydrophobicContact CG-CG 4.44Å; K115-E119 IonicContact NZ-OE1 2.76Å; K115-E119 WeakPolarHBondContact O-CG 3.17Å; K115-E119 PolarHBondContact O-N 3.31Å
116	Q	91.5	Very high	92.8	Very high	133 Å²	133	53.8 Å²	53.8	62%	0.621	26%	0.256	S	S	*	.	H	α-helix	trans	-60.8	-36.9	179.4	-70.6	176.9	-14.5	0	0	112.1	G114 H120	G114-Q116 PolarHBondContact O-N 2.98Å; Q116-H120 WeakPolarHBondContact O-CB 3.27Å; Q116-H120 PolarHBondContact O-N 3.06Å
117	F	92.4	Very high	92.9	Very high	13 Å²	13	54.3 Å²	54.3	6%	0.057	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-51	175.8	173.4	-84.6	0	0	0	110.6	L113 G114 K115 E119 H120 F121 L136 W137 N140	L113-F117 HydrophobicContact CB-CD1 3.77Å; L113-F117 HydrophobicContact CB-CE1 4.34Å; L113-F117 HydrophobicContact CD1-CD1 4.35Å; L113-F117 HydrophobicContact CD1-CE1 4.16Å; L113-F117 WeakPolarHBondContact O-CB 3.17Å; G114-F117 WeakPolarHBondContact O-CB 3.39Å; G114-F117 PolarHBondContact O-N 3.4Å; G114-F117 VanDerWaalsContact O-N 3.15Å; K115-F117 VanDerWaalsContact C-N 3.26Å; K115-F117 PolarHBondContact O-N 3.18Å; F117-E119 PolarHBondContact O-N 3.41Å; F117-H120 PolarHBondContact O-N 2.96Å; F117-F121 HydrophobicContact CE1-CB 4.17Å; F117-F121 HydrophobicContact CE1-CG 4.46Å; F117-F121 HydrophobicContact CZ-CB 4.32Å; F117-F121 WeakPolarHBondContact O-CB 3.23Å; F117-F121 PolarHBondContact O-N 2.91Å; F117-L136 HydrophobicContact CD2-CD1 4.3Å; F117-L136 HydrophobicContact CD2-CD2 4.07Å; F117-L136 HydrophobicContact CD2-CG 3.89Å; F117-L136 HydrophobicContact CE2-CD2 3.95Å; F117-L136 HydrophobicContact CE2-CG 3.73Å; F117-W137 HydrophobicContact CE1-CE3 4.35Å; F117-W137 HydrophobicContact CE1-CZ3 4.4Å; F117-W137 HydrophobicContact CE2-CE3 4.12Å; F117-W137 AromaticContact CZ-CE3 3.57Å; F117-W137 HydrophobicContact CZ-CE3 3.57Å; F117-W137 HydrophobicContact CZ-CZ3 4.04Å; F117-N140 HydrophobicContact CD2-CB 4.46Å; F117-N140 HydrophobicContact CE2-CB 4.5Å
118	V	93.8	Very high	93.1	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.024	24%	0.236	C	C	.	.	H	α-helix	trans	-62	-46.7	-177.7	175.3	0	0	0	0	111.1	L99 H106 A110 L113 G114 K115 L122	L99-V118 HydrophobicContact CD1-CG1 4.23Å; L99-V118 HydrophobicContact CD2-CG1 4.18Å; H106-V118 HydrophobicContact CB-CG1 4.49Å; A110-V118 HydrophobicContact CB-CG2 4.39Å; L113-V118 HydrophobicContact CB-CG2 4.1Å; L113-V118 HydrophobicContact CD1-CG2 4.44Å; G114-V118 PolarHBondContact O-N 2.68Å; G114-V118 VanDerWaalsContact O-N 3.09Å; K115-V118 PolarHBondContact O-N 3.26Å; V118-L122 HydrophobicContact CG1-CD1 4.17Å; V118-L122 WeakPolarHBondContact O-CB 3.48Å; V118-L122 WeakPolarHBondContact O-CG 3.45Å; V118-L122 PolarHBondContact O-N 3.12Å; V118-L122 VanDerWaalsContact O-N 3.07Å
119	E	94.2	Very high	93.2	Very high	105 Å²	105	45 Å²	45	49%	0.491	24%	0.235	S	C	.	.	H	α-helix	trans	-62.5	-46.1	179.4	-70.4	174.3	160.9	0	0	111.5	K115 F117 Y123	K115-E119 VanDerWaalsContact CE-CD 3.47Å; K115-E119 WeakPolarHBondContact CE-OE1 3.48Å; K115-E119 HydrophobicContact CG-CG 4.44Å; K115-E119 IonicContact NZ-OE1 2.76Å; K115-E119 WeakPolarHBondContact O-CG 3.17Å; K115-E119 PolarHBondContact O-N 3.31Å; F117-E119 PolarHBondContact O-N 3.41Å; E119-Y123 WeakPolarHBondContact O-CB 3.2Å; E119-Y123 PolarHBondContact O-N 3.2Å; E119-Y123 VanDerWaalsContact O-N 3.07Å
120	H	95.5	Very high	93.3	Very high	48 Å²	48	46 Å²	46	22%	0.222	24%	0.239	C	C	.	.	H	α-helix	trans	-71.1	-38.8	-179	-161.9	57.2	0	0	0	112.5	Q116 F117 L122 Y123 L124 L136	Q116-H120 WeakPolarHBondContact O-CB 3.27Å; Q116-H120 PolarHBondContact O-N 3.06Å; F117-H120 PolarHBondContact O-N 2.96Å; H120-L122 PolarHBondContact O-N 3.41Å; H120-Y123 PolarHBondContact O-N 3.41Å; H120-L124 WeakPolarHBondContact O-CB 3.31Å; H120-L124 VanDerWaalsContact O-CG 3.27Å; H120-L124 WeakPolarHBondContact O-CG 3.33Å; H120-L124 PolarHBondContact O-N 3.01Å; H120-L136 HydrophobicContact CB-CD2 4.37Å
121	F	96.3	Very high	93.4	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-55.9	-50.7	173.3	167.4	-106.4	0	0	0	111.4	L92 L95 Y96 L99 F117 Y123 L124 M125 V133 L136	L92-F121 HydrophobicContact CB-CE2 4.25Å; L92-F121 HydrophobicContact CD2-CD2 4.27Å; L92-F121 HydrophobicContact CD2-CE2 3.63Å; L92-F121 HydrophobicContact CD2-CZ 4.4Å; L92-F121 HydrophobicContact CG-CE2 4.48Å; L92-F121 WeakPolarHBondContact O-CZ 3.18Å; L95-F121 HydrophobicContact CB-CZ 4.37Å; L95-F121 HydrophobicContact CD2-CE1 4.12Å; L95-F121 HydrophobicContact CD2-CZ 4.19Å; L95-F121 HydrophobicContact CG-CE1 4Å; L95-F121 HydrophobicContact CG-CZ 4.24Å; Y96-F121 HydrophobicContact CD2-CE1 4.44Å; L99-F121 HydrophobicContact CD1-CD1 3.91Å; L99-F121 HydrophobicContact CD1-CE1 3.86Å; F117-F121 HydrophobicContact CE1-CB 4.17Å; F117-F121 HydrophobicContact CE1-CG 4.46Å; F117-F121 HydrophobicContact CZ-CB 4.32Å; F117-F121 WeakPolarHBondContact O-CB 3.23Å; F117-F121 PolarHBondContact O-N 2.91Å; F121-Y123 VanDerWaalsContact C-N 3.34Å; F121-Y123 PolarHBondContact O-N 2.98Å; F121-L124 PolarHBondContact O-N 2.77Å; F121-M125 HydrophobicContact CD2-CG 4.17Å; F121-M125 HydrophobicContact CE1-CG 4.43Å; F121-M125 HydrophobicContact CE2-CG 3.69Å; F121-M125 HydrophobicContact CE2-SD 4.26Å; F121-M125 HydrophobicContact CZ-CG 3.85Å; F121-M125 WeakPolarHBondContact O-CB 3.3Å; F121-M125 WeakPolarHBondContact O-CG 3.37Å; F121-M125 PolarHBondContact O-N 2.83Å; F121-V133 HydrophobicContact CD2-CG1 3.72Å; F121-V133 HydrophobicContact CE2-CG1 3.59Å; F121-L136 HydrophobicContact CB-CD2 4.08Å
122	L	95.9	Very high	93.6	Very high	13 Å²	13	42.9 Å²	42.9	7%	0.068	22%	0.218	C	C	.	.	H	α-helix	trans	-63.3	-39.7	179.3	-73.9	177.7	0	0	0	112.4	Y96 L99 R100 V118 H120 D126	Y96-L122 HydrophobicContact CD2-CD2 3.89Å; Y96-L122 HydrophobicContact CE2-CD2 4.14Å; L99-L122 HydrophobicContact CB-CD2 3.88Å; L99-L122 HydrophobicContact CD1-CD2 4.14Å; L99-L122 HydrophobicContact CD1-CG 4.4Å; R100-L122 HydrophobicContact CG-CD2 4.24Å; R100-L122 PolarHBondContact NH2-O 2.7Å; V118-L122 HydrophobicContact CG1-CD1 4.17Å; V118-L122 WeakPolarHBondContact O-CB 3.48Å; V118-L122 WeakPolarHBondContact O-CG 3.45Å; V118-L122 PolarHBondContact O-N 3.12Å; V118-L122 VanDerWaalsContact O-N 3.07Å; H120-L122 PolarHBondContact O-N 3.41Å; L122-D126 PolarHBondContact O-N 2.82Å; L122-D126 VanDerWaalsContact O-N 3.1Å
123	Y	96	Very high	94	Very high	107 Å²	107	40.3 Å²	40.3	42%	0.42	21%	0.207	S	C	.	.	H	α-helix	trans	-62.9	-47.9	175.5	168.3	-97.7	0	0	0	112.3	E119 H120 F121 D126 S127	E119-Y123 WeakPolarHBondContact O-CB 3.2Å; E119-Y123 PolarHBondContact O-N 3.2Å; E119-Y123 VanDerWaalsContact O-N 3.07Å; H120-Y123 PolarHBondContact O-N 3.41Å; F121-Y123 VanDerWaalsContact C-N 3.34Å; F121-Y123 PolarHBondContact O-N 2.98Å; Y123-D126 PolarHBondContact O-N 2.99Å; Y123-S127 VanDerWaalsContact O-CB 3.32Å; Y123-S127 WeakPolarHBondContact O-CB 3.5Å; Y123-S127 PolarHBondContact O-N 3.49Å; Y123-S127 PolarHBondContact O-OG 3.29Å
124	L	96.4	Very high	94.3	Very high	1 Å²	1	40 Å²	40	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-66.5	-39.7	-178.6	-69.9	172.2	0	0	0	111.6	H120 F121 S127 C128 D129 T132 V133 L136	H120-L124 WeakPolarHBondContact O-CB 3.31Å; H120-L124 VanDerWaalsContact O-CG 3.27Å; H120-L124 WeakPolarHBondContact O-CG 3.33Å; H120-L124 PolarHBondContact O-N 3.01Å; F121-L124 PolarHBondContact O-N 2.77Å; L124-S127 CarbonylContact O-C 3.54Å; L124-S127 PolarHBondContact O-N 3.25Å; L124-C128 PolarHBondContact O-N 3.22Å; L124-D129 HydrophobicContact CD2-CB 3.96Å; L124-D129 PolarHBondContact O-N 3.46Å; L124-T132 HydrophobicContact CD1-CG2 3.7Å; L124-T132 HydrophobicContact CD2-CG2 3.92Å; L124-T132 HydrophobicContact CG-CG2 4.48Å; L124-V133 HydrophobicContact CB-CG2 3.42Å; L124-V133 VanDerWaalsContact CB-CG2 3.42Å; L124-V133 HydrophobicContact CD1-CG2 4.4Å; L124-L136 HydrophobicContact CD1-CD2 4.1Å
125	M	96.5	Very high	94.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.1	-46.8	173.7	-76	-64.9	-71.5	0	0	111.7	L33 L56 M93 Y96 F121 S127 C128 Y130 V133	L33-M125 HydrophobicContact CD2-CE 4.18Å; L33-M125 WeakPolarHBondContact CD2-O 3.36Å; L56-M125 HydrophobicContact CD1-CE 3.72Å; L56-M125 HydrophobicContact CD1-SD 4.15Å; L56-M125 HydrophobicContact CD2-SD 3.93Å; L56-M125 HydrophobicContact CG-CE 4.07Å; L56-M125 HydrophobicContact CG-SD 4.12Å; M93-M125 HydrophobicContact SD-CE 4.42Å; Y96-M125 HydrophobicContact CD1-CE 3.96Å; Y96-M125 HydrophobicContact CD2-CB 3.35Å; Y96-M125 HydrophobicContact CD2-CE 4.05Å; Y96-M125 HydrophobicContact CD2-CG 3.65Å; Y96-M125 HydrophobicContact CE2-CB 3.37Å; Y96-M125 HydrophobicContact CE2-CG 4.21Å; Y96-M125 HydrophobicContact CG-CB 4.17Å; Y96-M125 HydrophobicContact CG-CE 3.63Å; Y96-M125 HydrophobicContact CG-CG 4.18Å; F121-M125 HydrophobicContact CD2-CG 4.17Å; F121-M125 HydrophobicContact CE1-CG 4.43Å; F121-M125 HydrophobicContact CE2-CG 3.69Å; F121-M125 HydrophobicContact CE2-SD 4.26Å; F121-M125 HydrophobicContact CZ-CG 3.85Å; F121-M125 WeakPolarHBondContact O-CB 3.3Å; F121-M125 WeakPolarHBondContact O-CG 3.37Å; F121-M125 PolarHBondContact O-N 2.83Å; M125-S127 VanDerWaalsContact C-N 3.27Å; M125-S127 PolarHBondContact O-N 3.21Å; M125-C128 PolarHBondContact O-N 3.09Å; M125-C128 VanDerWaalsContact O-N 3.11Å; M125-Y130 HydrophobicContact SD-CD1 4.27Å; M125-Y130 HydrophobicContact SD-CE1 4.45Å; M125-V133 HydrophobicContact CG-CG1 4.19Å; M125-V133 HydrophobicContact CG-CG2 3.95Å; M125-V133 HydrophobicContact SD-CB 4.34Å; M125-V133 HydrophobicContact SD-CG1 3.79Å; M125-V133 HydrophobicContact SD-CG2 3.83Å
126	D	95.6	Very high	94.4	Very high	26 Å²	26	33.4 Å²	33.4	14%	0.139	17%	0.168	C	C	.	.	H	α-helix	trans	-65.2	-31.6	176.6	-75.7	5	0	0	0	113.2	R29 T32 Y96 R100 L122 Y123 C128	R29-D126 PolarHBondContact NH1-O 3.32Å; T32-D126 WeakPolarHBondContact CB-OD2 3.37Å; T32-D126 VanDerWaalsContact CG2-OD2 3.28Å; T32-D126 WeakPolarHBondContact CG2-OD2 3.25Å; Y96-D126 WeakPolarHBondContact CE2-OD1 3.24Å; Y96-D126 PolarHBondContact OH-OD1 3.15Å; R100-D126 IonicContact CZ-OD1 3.98Å; R100-D126 IonicContact CZ-OD2 3.76Å; R100-D126 IonicContact NE-OD1 2.7Å; R100-D126 PolarHBondContact NE-OD1 2.81Å; R100-D126 IonicContact NE-OD2 3.21Å; R100-D126 IonicContact NH1-OD2 2.81Å; R100-D126 IonicContact NH2-OD1 2.66Å; R100-D126 PolarHBondContact NH2-OD1 3.41Å; R100-D126 VanDerWaalsContact NH2-OD1 3.09Å; R100-D126 IonicContact NH2-OD2 3.53Å; R100-D126 PolarHBondContact NH2-OD2 2.84Å; L122-D126 PolarHBondContact O-N 2.82Å; L122-D126 VanDerWaalsContact O-N 3.1Å; Y123-D126 PolarHBondContact O-N 2.99Å; D126-C128 PolarHBondContact O-N 3.33Å
127	S	94.3	Very high	94.3	Very high	50 Å²	50	27 Å²	27	35%	0.35	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-3.3	176.8	-55.1	0	0	0	0	112.7	Y123 L124 M125 D129	Y123-S127 VanDerWaalsContact O-CB 3.32Å; Y123-S127 WeakPolarHBondContact O-CB 3.5Å; Y123-S127 PolarHBondContact O-N 3.49Å; Y123-S127 PolarHBondContact O-OG 3.29Å; L124-S127 CarbonylContact O-C 3.54Å; L124-S127 PolarHBondContact O-N 3.25Å; M125-S127 VanDerWaalsContact C-N 3.27Å; M125-S127 PolarHBondContact O-N 3.21Å; S127-D129 PolarHBondContact O-N 2.92Å
128	C	93.6	Very high	94.1	Very high	34 Å²	34	26.7 Å²	26.7	23%	0.23	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	25.2	-175.4	-55.8	0	0	0	0	114.3	R29 L124 M125 D126 Y130	R29-C128 PolarHBondContact NH1-SG 2.83Å; L124-C128 PolarHBondContact O-N 3.22Å; M125-C128 PolarHBondContact O-N 3.09Å; M125-C128 VanDerWaalsContact O-N 3.11Å; D126-C128 PolarHBondContact O-N 3.33Å; C128-Y130 HydrophobicContact CB-CE1 4.3Å; C128-Y130 HydrophobicContact CB-CE2 3.83Å; C128-Y130 WeakPolarHBondContact O-CD2 3.18Å; C128-Y130 PolarHBondContact O-N 3.49Å; C128-Y130 PolarHBondContact SG-OH 3.33Å; C128-Y130 VanDerWaalsContact SG-OH 3.33Å
129	D	94.3	Very high	93.7	Very high	52 Å²	52	31.2 Å²	31.2	28%	0.278	15%	0.154	S	C	.	.			trans	-86.2	64.3	178	-170.9	-7.3	0	0	0	110.9	L124 S127 T131 T132 V133	L124-D129 HydrophobicContact CD2-CB 3.96Å; L124-D129 PolarHBondContact O-N 3.46Å; S127-D129 PolarHBondContact O-N 2.92Å; D129-T131 PolarHBondContact O-N 3.35Å; D129-T132 VanDerWaalsContact CG-CB 3.43Å; D129-T132 PolarHBondContact O-N 3.26Å; D129-T132 VanDerWaalsContact OD1-CB 3.23Å; D129-T132 WeakPolarHBondContact OD1-CB 3.28Å; D129-T132 PolarHBondContact OD1-N 2.94Å; D129-T132 PolarHBondContact OD1-OG1 3.35Å; D129-T132 WeakPolarHBondContact OD2-CB 3.33Å; D129-T132 PolarHBondContact OD2-OG1 3.07Å; D129-V133 WeakPolarHBondContact O-CG2 3.33Å; D129-V133 PolarHBondContact O-N 3.21Å
130	Y	94.4	Very high	93.2	Very high	22 Å²	22	27.8 Å²	27.8	9%	0.086	14%	0.139	C	C	.	.	H	α-helix	trans	-66	-34.2	-166.6	-58.9	-51.7	0	0	0	114.2	L33 V55 L56 P57 M125 C128 T132 V133 K134	L33-Y130 HydrophobicContact CD2-CE1 4.3Å; V55-Y130 HydrophobicContact CG1-CE1 4Å; L56-Y130 HydrophobicContact CB-CD1 4.48Å; L56-Y130 HydrophobicContact CD2-CD1 3.78Å; L56-Y130 HydrophobicContact CD2-CG 4.24Å; L56-Y130 HydrophobicContact CG-CD1 3.87Å; L56-Y130 HydrophobicContact CG-CE1 4.37Å; L56-Y130 HydrophobicContact CG-CG 4.46Å; P57-Y130 HydrophobicContact CG-CD2 4.3Å; M125-Y130 HydrophobicContact SD-CD1 4.27Å; M125-Y130 HydrophobicContact SD-CE1 4.45Å; C128-Y130 HydrophobicContact CB-CE1 4.3Å; C128-Y130 HydrophobicContact CB-CE2 3.83Å; C128-Y130 WeakPolarHBondContact O-CD2 3.18Å; C128-Y130 PolarHBondContact O-N 3.49Å; C128-Y130 PolarHBondContact SG-OH 3.33Å; C128-Y130 VanDerWaalsContact SG-OH 3.33Å; Y130-T132 VanDerWaalsContact C-N 3.33Å; Y130-V133 WeakPolarHBondContact O-CB 3.25Å; Y130-V133 PolarHBondContact O-N 2.83Å; Y130-K134 WeakPolarHBondContact O-CD 3.48Å; Y130-K134 WeakPolarHBondContact O-CG 3.37Å; Y130-K134 PolarHBondContact O-N 2.8Å
131	T	93.8	Very high	92.7	Very high	40 Å²	40	25.7 Å²	25.7	25%	0.245	13%	0.129	C	C	.	.	H	α-helix	trans	-64.9	-42.5	175.6	-57.6	0	0	0	0	110.2	V61 F62 D129 K134 M135	V61-T131 WeakPolarHBondContact O-CG2 3.27Å; F62-T131 HydrophobicContact CB-CG2 4.23Å; D129-T131 PolarHBondContact O-N 3.35Å; T131-K134 PolarHBondContact O-N 3.45Å; T131-M135 WeakPolarHBondContact O-CG 3.43Å; T131-M135 PolarHBondContact O-N 3.14Å
132	T	94	Very high	91.9	Very high	28 Å²	28	29.5 Å²	29.5	17%	0.172	15%	0.148	C	C	.	.	H	α-helix	trans	-67.9	-36	176.9	-53.7	0	0	0	0	111.5	L124 D129 Y130 K134 M135 L136	L124-T132 HydrophobicContact CD1-CG2 3.7Å; L124-T132 HydrophobicContact CD2-CG2 3.92Å; L124-T132 HydrophobicContact CG-CG2 4.48Å; D129-T132 VanDerWaalsContact CG-CB 3.43Å; D129-T132 PolarHBondContact O-N 3.26Å; D129-T132 VanDerWaalsContact OD1-CB 3.23Å; D129-T132 WeakPolarHBondContact OD1-CB 3.28Å; D129-T132 PolarHBondContact OD1-N 2.94Å; D129-T132 PolarHBondContact OD1-OG1 3.35Å; D129-T132 WeakPolarHBondContact OD2-CB 3.33Å; D129-T132 PolarHBondContact OD2-OG1 3.07Å; Y130-T132 VanDerWaalsContact C-N 3.33Å; T132-K134 PolarHBondContact O-N 2.94Å; T132-M135 PolarHBondContact O-N 2.87Å; T132-L136 VanDerWaalsContact O-CB 3.3Å; T132-L136 WeakPolarHBondContact O-CB 3.36Å; T132-L136 PolarHBondContact O-N 3.39Å
133	V	95.6	Very high	90.9	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-56	-50.3	170.9	177.2	0	0	0	0	111	L56 L92 F121 L124 M125 D129 Y130 M135 L136 W137	L56-V133 HydrophobicContact CD2-CG1 4.38Å; L92-V133 HydrophobicContact CD1-CG1 3.75Å; L92-V133 HydrophobicContact CD2-CG1 4.14Å; L92-V133 HydrophobicContact CG-CG1 4.37Å; F121-V133 HydrophobicContact CD2-CG1 3.72Å; F121-V133 HydrophobicContact CE2-CG1 3.59Å; L124-V133 HydrophobicContact CB-CG2 3.42Å; L124-V133 VanDerWaalsContact CB-CG2 3.42Å; L124-V133 HydrophobicContact CD1-CG2 4.4Å; M125-V133 HydrophobicContact CG-CG1 4.19Å; M125-V133 HydrophobicContact CG-CG2 3.95Å; M125-V133 HydrophobicContact SD-CB 4.34Å; M125-V133 HydrophobicContact SD-CG1 3.79Å; M125-V133 HydrophobicContact SD-CG2 3.83Å; D129-V133 WeakPolarHBondContact O-CG2 3.33Å; D129-V133 PolarHBondContact O-N 3.21Å; Y130-V133 WeakPolarHBondContact O-CB 3.25Å; Y130-V133 PolarHBondContact O-N 2.83Å; V133-M135 PolarHBondContact O-N 2.73Å; V133-L136 WeakPolarHBondContact O-CB 3.31Å; V133-L136 PolarHBondContact O-N 2.93Å; V133-W137 PolarHBondContact O-N 2.97Å
134	K	93.8	Very high	89.9	Confident	1 Å²	1	31.3 Å²	31.3	0%	0.004	17%	0.167	C	C	.	.	H	α-helix	trans	-59.1	-48.5	178.4	-70.2	158	171.6	162.4	0	110.9	P57 G59 L82 I88 D89 L92 Y130 T131 T132 L136 W137 I138	P57-K134 PolarHBondContact O-NZ 3.46Å; G59-K134 PolarHBondContact O-NZ 3.14Å; L82-K134 HydrophobicContact CD1-CB 3.99Å; L82-K134 HydrophobicContact CD1-CD 4.09Å; I88-K134 HydrophobicContact CD1-CB 4.38Å; D89-K134 WeakPolarHBondContact OD1-CE 3.44Å; D89-K134 IonicContact OD1-NZ 3.4Å; D89-K134 IonicContact OD2-NZ 3.93Å; L92-K134 HydrophobicContact CD1-CG 4.15Å; Y130-K134 WeakPolarHBondContact O-CD 3.48Å; Y130-K134 WeakPolarHBondContact O-CG 3.37Å; Y130-K134 PolarHBondContact O-N 2.8Å; T131-K134 PolarHBondContact O-N 3.45Å; T132-K134 PolarHBondContact O-N 2.94Å; K134-L136 VanDerWaalsContact C-N 3.33Å; K134-L136 PolarHBondContact O-N 3.33Å; K134-W137 PolarHBondContact O-N 3.27Å; K134-I138 HydrophobicContact CB-CD1 4.42Å; K134-I138 WeakPolarHBondContact O-CD1 3.35Å; K134-I138 VanDerWaalsContact O-CG1 3.23Å; K134-I138 WeakPolarHBondContact O-CG1 3.48Å; K134-I138 PolarHBondContact O-N 3.03Å
135	M	91.7	Very high	88.8	Confident	5 Å²	5	42.6 Å²	42.6	3%	0.025	21%	0.209	C	C	.	.	H	α-helix	trans	-63	-38.8	179.3	-68.8	-35.2	-65.4	0	0	112.5	F62 L82 T131 T132 V133 W137 I138 W139	F62-M135 HydrophobicContact CB-CG 4.16Å; F62-M135 HydrophobicContact CD1-CE 3.91Å; F62-M135 HydrophobicContact CD1-CG 4.12Å; F62-M135 HydrophobicContact CD1-SD 3.49Å; F62-M135 WeakPolarHBondContact CD1-SD 3.45Å; F62-M135 HydrophobicContact CD2-CE 4.12Å; F62-M135 HydrophobicContact CD2-CG 4.48Å; F62-M135 HydrophobicContact CD2-SD 4.45Å; F62-M135 HydrophobicContact CE1-CE 3.5Å; F62-M135 VanDerWaalsContact CE1-CE 3.5Å; F62-M135 HydrophobicContact CE1-SD 3.58Å; F62-M135 VanDerWaalsContact CE1-SD 3.58Å; F62-M135 HydrophobicContact CE2-CE 3.72Å; F62-M135 HydrophobicContact CG-CE 4.2Å; F62-M135 HydrophobicContact CG-CG 4.01Å; F62-M135 HydrophobicContact CG-SD 3.95Å; F62-M135 HydrophobicContact CZ-CE 3.38Å; F62-M135 HydrophobicContact CZ-SD 4.11Å; L82-M135 HydrophobicContact CD1-SD 3.7Å; L82-M135 HydrophobicContact CD2-SD 3.8Å; L82-M135 HydrophobicContact CG-SD 4.16Å; T131-M135 WeakPolarHBondContact O-CG 3.43Å; T131-M135 PolarHBondContact O-N 3.14Å; T132-M135 PolarHBondContact O-N 2.87Å; V133-M135 PolarHBondContact O-N 2.73Å; M135-W137 VanDerWaalsContact C-N 3.29Å; M135-W137 PolarHBondContact O-N 2.88Å; M135-I138 HydrophobicContact CE-CB 4.41Å; M135-I138 HydrophobicContact CE-CD1 4.3Å; M135-I138 HydrophobicContact CE-CG2 4.29Å; M135-I138 PolarHBondContact O-N 3.33Å; M135-I138 HydrophobicContact SD-CD1 3.89Å; M135-W139 HydrophobicContact CB-CE3 3.9Å; M135-W139 HydrophobicContact CB-CZ3 3.96Å; M135-W139 HydrophobicContact CE-CD2 4.48Å; M135-W139 HydrophobicContact CE-CE3 3.36Å; M135-W139 HydrophobicContact CE-CH2 3.91Å; M135-W139 HydrophobicContact CE-CZ3 3.03Å; M135-W139 HydrophobicContact CG-CE3 4.44Å; M135-W139 HydrophobicContact CG-CZ3 4.06Å; M135-W139 WeakPolarHBondContact O-CB 3.48Å; M135-W139 PolarHBondContact O-N 2.55Å; M135-W139 HydrophobicContact SD-CZ3 4.31Å
136	L	92.1	Very high	87.6	Confident	19 Å²	19	43.9 Å²	43.9	10%	0.099	22%	0.215	C	C	.	.	H	α-helix	trans	-57	-44.6	176.1	179.9	67.5	0	0	0	111	F117 H120 F121 L124 T132 V133 K134 N140	F117-L136 HydrophobicContact CD2-CD1 4.3Å; F117-L136 HydrophobicContact CD2-CD2 4.07Å; F117-L136 HydrophobicContact CD2-CG 3.89Å; F117-L136 HydrophobicContact CE2-CD2 3.95Å; F117-L136 HydrophobicContact CE2-CG 3.73Å; H120-L136 HydrophobicContact CB-CD2 4.37Å; F121-L136 HydrophobicContact CB-CD2 4.08Å; L124-L136 HydrophobicContact CD1-CD2 4.1Å; T132-L136 VanDerWaalsContact O-CB 3.3Å; T132-L136 WeakPolarHBondContact O-CB 3.36Å; T132-L136 PolarHBondContact O-N 3.39Å; V133-L136 WeakPolarHBondContact O-CB 3.31Å; V133-L136 PolarHBondContact O-N 2.93Å; K134-L136 VanDerWaalsContact C-N 3.33Å; K134-L136 PolarHBondContact O-N 3.33Å; L136-N140 VanDerWaalsContact O-CB 3.31Å; L136-N140 WeakPolarHBondContact O-CB 3.39Å; L136-N140 PolarHBondContact O-N 3.25Å
137	W	91	Very high	86.4	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67.9	-52.5	175.2	-178.2	-98.7	0	0	0	111.9	I88 F91 L92 L95 L113 F117 V133 K134 M135 W139 N140 R141 N167 N171	I88-W137 HydrophobicContact CD1-CB 4.04Å; I88-W137 VanDerWaalsContact CD1-CD1 3.44Å; I88-W137 HydrophobicContact CD1-CG 4.03Å; I88-W137 HydrophobicContact CG1-CG 4.41Å; F91-W137 HydrophobicContact CD1-CD2 4.43Å; F91-W137 HydrophobicContact CD1-CH2 4.14Å; F91-W137 AromaticContact CD1-CZ2 3.87Å; F91-W137 HydrophobicContact CD1-CZ2 3.87Å; F91-W137 AromaticContact CE1-CD2 3.98Å; F91-W137 HydrophobicContact CE1-CD2 3.98Å; F91-W137 AromaticContact CE1-CE2 3.67Å; F91-W137 AromaticContact CE1-CE3 3.89Å; F91-W137 HydrophobicContact CE1-CE3 3.89Å; F91-W137 AromaticContact CE1-CH2 3.08Å; F91-W137 HydrophobicContact CE1-CH2 3.08Å; F91-W137 AromaticContact CE1-CZ2 3.24Å; F91-W137 HydrophobicContact CE1-CZ2 3.24Å; F91-W137 AromaticContact CE1-CZ3 3.45Å; F91-W137 HydrophobicContact CE1-CZ3 3.45Å; F91-W137 VanDerWaalsContact CE1-CZ3 3.45Å; F91-W137 HydrophobicContact CE2-CH2 4.26Å; F91-W137 HydrophobicContact CE2-CZ2 4.43Å; F91-W137 AromaticContact CZ-CH2 3.15Å; F91-W137 HydrophobicContact CZ-CH2 3.15Å; F91-W137 AromaticContact CZ-CZ2 3.58Å; F91-W137 HydrophobicContact CZ-CZ2 3.58Å; F91-W137 AromaticContact CZ-CZ3 3.8Å; F91-W137 HydrophobicContact CZ-CZ3 3.8Å; L92-W137 HydrophobicContact CD2-CB 4.15Å; L92-W137 HydrophobicContact CD2-CD2 4.47Å; L92-W137 HydrophobicContact CD2-CG 4.33Å; L95-W137 HydrophobicContact CD2-CZ3 4.45Å; L113-W137 HydrophobicContact CD2-CZ3 4.42Å; F117-W137 HydrophobicContact CE1-CE3 4.35Å; F117-W137 HydrophobicContact CE1-CZ3 4.4Å; F117-W137 HydrophobicContact CE2-CE3 4.12Å; F117-W137 AromaticContact CZ-CE3 3.57Å; F117-W137 HydrophobicContact CZ-CE3 3.57Å; F117-W137 HydrophobicContact CZ-CZ3 4.04Å; V133-W137 PolarHBondContact O-N 2.97Å; K134-W137 PolarHBondContact O-N 3.27Å; M135-W137 VanDerWaalsContact C-N 3.29Å; M135-W137 PolarHBondContact O-N 2.88Å; W137-W139 PolarHBondContact O-N 3.09Å; W137-N140 WeakPolarHBondContact O-CB 3.4Å; W137-N140 PolarHBondContact O-N 2.81Å; W137-N140 VanDerWaalsContact O-N 3.14Å; W137-R141 HydrophobicContact CD2-CG 4.14Å; W137-R141 HydrophobicContact CG-CG 4.34Å; W137-R141 HydrophobicContact CZ2-CG 4.32Å; W137-R141 WeakPolarHBondContact O-CG 3.11Å; W137-R141 PolarHBondContact O-N 2.78Å; W137-N167 PolarHBondContact NE1-OD1 3.48Å; W137-N171 HydrophobicContact CH2-CB 4.15Å; W137-N171 HydrophobicContact CZ2-CB 3.68Å
138	I	88	Confident	85.3	Confident	5 Å²	5	48.5 Å²	48.5	3%	0.026	22%	0.223	C	C	.	.	H	α-helix	trans	-54.3	-50.4	-178	-67.1	162.8	0	0	0	110.8	L82 I88 K134 M135 N140 R141 M142 Y147 L160	L82-I138 HydrophobicContact CD1-CD1 4.27Å; L82-I138 HydrophobicContact CD2-CD1 4.03Å; I88-I138 HydrophobicContact CD1-CD1 4.26Å; I88-I138 HydrophobicContact CD1-CG1 3.84Å; K134-I138 HydrophobicContact CB-CD1 4.42Å; K134-I138 WeakPolarHBondContact O-CD1 3.35Å; K134-I138 VanDerWaalsContact O-CG1 3.23Å; K134-I138 WeakPolarHBondContact O-CG1 3.48Å; K134-I138 PolarHBondContact O-N 3.03Å; M135-I138 HydrophobicContact CE-CB 4.41Å; M135-I138 HydrophobicContact CE-CD1 4.3Å; M135-I138 HydrophobicContact CE-CG2 4.29Å; M135-I138 PolarHBondContact O-N 3.33Å; M135-I138 HydrophobicContact SD-CD1 3.89Å; I138-N140 PolarHBondContact O-N 3.33Å; I138-R141 PolarHBondContact O-N 3.48Å; I138-M142 HydrophobicContact CG2-CG 4.12Å; I138-M142 VanDerWaalsContact O-CB 3.3Å; I138-M142 WeakPolarHBondContact O-CB 3.17Å; I138-M142 VanDerWaalsContact O-CG 3.24Å; I138-M142 WeakPolarHBondContact O-CG 3.41Å; I138-M142 PolarHBondContact O-N 2.97Å; I138-Y147 HydrophobicContact CB-CE1 4.47Å; I138-Y147 HydrophobicContact CG1-CE1 4.11Å; I138-Y147 HydrophobicContact CG1-CE2 4.41Å; I138-Y147 HydrophobicContact CG2-CD1 4.19Å; I138-Y147 HydrophobicContact CG2-CE1 3.91Å; I138-L160 HydrophobicContact CD1-CD1 3.7Å; I138-L160 HydrophobicContact CD1-CD2 4.47Å; I138-L160 HydrophobicContact CG1-CD1 4.43Å
139	W	84.9	Confident	84.5	Confident	100 Å²	100	48.3 Å²	48.3	38%	0.379	22%	0.222	S	C	.	.	H	α-helix	trans	-63.2	-43.1	179.5	-109.3	-81.2	0	0	0	112.4	F62 I64 M135 W137 R141 S143	F62-W139 HydrophobicContact CD2-CH2 4.03Å; F62-W139 HydrophobicContact CD2-CZ3 4.14Å; F62-W139 AromaticContact CE2-CH2 3.56Å; F62-W139 HydrophobicContact CE2-CH2 3.56Å; F62-W139 AromaticContact CE2-CZ3 3.9Å; F62-W139 HydrophobicContact CE2-CZ3 3.9Å; F62-W139 HydrophobicContact CZ-CH2 4.4Å; I64-W139 HydrophobicContact CG2-CH2 4.28Å; M135-W139 HydrophobicContact CB-CE3 3.9Å; M135-W139 HydrophobicContact CB-CZ3 3.96Å; M135-W139 HydrophobicContact CE-CD2 4.48Å; M135-W139 HydrophobicContact CE-CE3 3.36Å; M135-W139 HydrophobicContact CE-CH2 3.91Å; M135-W139 HydrophobicContact CE-CZ3 3.03Å; M135-W139 HydrophobicContact CG-CE3 4.44Å; M135-W139 HydrophobicContact CG-CZ3 4.06Å; M135-W139 WeakPolarHBondContact O-CB 3.48Å; M135-W139 PolarHBondContact O-N 2.55Å; M135-W139 HydrophobicContact SD-CZ3 4.31Å; W137-W139 PolarHBondContact O-N 3.09Å; W139-R141 VanDerWaalsContact C-N 3.27Å; W139-R141 PolarHBondContact O-N 3.08Å; W139-S143 WeakPolarHBondContact O-CB 3.5Å; W139-S143 PolarHBondContact O-N 2.53Å
140	N	84.1	Confident	83.9	Confident	33 Å²	33	52 Å²	52	18%	0.176	24%	0.237	C	C	.	.	H	α-helix	trans	-57.6	-44.3	177.7	-169.2	-87	0	0	0	110.7	F117 L136 W137 I138 S143 K144	F117-N140 HydrophobicContact CD2-CB 4.46Å; F117-N140 HydrophobicContact CE2-CB 4.5Å; L136-N140 VanDerWaalsContact O-CB 3.31Å; L136-N140 WeakPolarHBondContact O-CB 3.39Å; L136-N140 PolarHBondContact O-N 3.25Å; W137-N140 WeakPolarHBondContact O-CB 3.4Å; W137-N140 PolarHBondContact O-N 2.81Å; W137-N140 VanDerWaalsContact O-N 3.14Å; I138-N140 PolarHBondContact O-N 3.33Å; N140-S143 PolarHBondContact O-OG 2.88Å; N140-K144 WeakPolarHBondContact O-CG 3.38Å; N140-K144 WeakPolarHBondContact OD1-CE 3.28Å; N140-K144 PolarHBondContact OD1-NZ 2.79Å
141	R	84.6	Confident	83.3	Confident	4 Å²	4	55 Å²	55	2%	0.015	26%	0.255	C	S	.	.	H	α-helix	trans	-75.8	-41.8	-177.3	-58.7	-35.7	-174.6	159.5	-5.2	112.9	W137 I138 W139 S143 K144 R145 Q146 Y147 N171	W137-R141 HydrophobicContact CD2-CG 4.14Å; W137-R141 HydrophobicContact CG-CG 4.34Å; W137-R141 HydrophobicContact CZ2-CG 4.32Å; W137-R141 WeakPolarHBondContact O-CG 3.11Å; W137-R141 PolarHBondContact O-N 2.78Å; I138-R141 PolarHBondContact O-N 3.48Å; W139-R141 VanDerWaalsContact C-N 3.27Å; W139-R141 PolarHBondContact O-N 3.08Å; R141-S143 VanDerWaalsContact C-N 3.29Å; R141-S143 PolarHBondContact O-N 3.31Å; R141-K144 CarbonylContact O-C 3.56Å; R141-K144 PolarHBondContact O-N 2.98Å; R141-R145 PolarHBondContact O-N 3.25Å; R141-R145 VanDerWaalsContact O-N 3.11Å; R141-Q146 PolarHBondContact O-N 3.31Å; R141-Y147 HydrophobicContact CB-CD2 3.73Å; R141-Y147 HydrophobicContact CB-CG 4.14Å; R141-Y147 HydrophobicContact CG-CD2 4.36Å; R141-N171 WeakPolarHBondContact CD-OD1 3.31Å; R141-N171 WeakPolarHBondContact CG-OD1 3.36Å; R141-N171 PolarHBondContact NE-OD1 2.9Å; R141-N171 PolarHBondContact NH1-O 3.36Å; R141-N171 PolarHBondContact NH2-O 2.89Å
142	M	78.4	Confident	82.8	Confident	80 Å²	80	56.6 Å²	56.6	39%	0.394	26%	0.259	S	S	.	.	H	α-helix	trans	-57	-42.8	172.8	-76.3	-73.6	-96.5	0	0	111.7	I138 K144 R145 Y147 I151	I138-M142 HydrophobicContact CG2-CG 4.12Å; I138-M142 VanDerWaalsContact O-CB 3.3Å; I138-M142 WeakPolarHBondContact O-CB 3.17Å; I138-M142 VanDerWaalsContact O-CG 3.24Å; I138-M142 WeakPolarHBondContact O-CG 3.41Å; I138-M142 PolarHBondContact O-N 2.97Å; M142-K144 PolarHBondContact O-N 3.43Å; M142-R145 PolarHBondContact O-N 3.1Å; M142-Y147 HydrophobicContact CG-CD1 3.91Å; M142-Y147 HydrophobicContact CG-CG 4.12Å; M142-Y147 HydrophobicContact SD-CD1 3.92Å; M142-Y147 HydrophobicContact SD-CG 4.3Å; M142-I151 HydrophobicContact CE-CD1 4.27Å
143	S	76.1	Confident	82.2	Confident	71 Å²	71	63.1 Å²	63.1	50%	0.497	29%	0.287	S	S	.	.	H	α-helix	trans	-60.6	-28.9	178	79.3	0	0	0	0	113.3	W139 N140 R141	W139-S143 WeakPolarHBondContact O-CB 3.5Å; W139-S143 PolarHBondContact O-N 2.53Å; N140-S143 PolarHBondContact O-OG 2.88Å; R141-S143 VanDerWaalsContact C-N 3.29Å; R141-S143 PolarHBondContact O-N 3.31Å
144	K	74.9	Confident	81.5	Confident	87 Å²	87	68.5 Å²	68.5	38%	0.378	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-0.3	178.5	-65.2	171.6	-179.2	168	0	113	N140 R141 M142 Q146	N140-K144 WeakPolarHBondContact O-CG 3.38Å; N140-K144 WeakPolarHBondContact OD1-CE 3.28Å; N140-K144 PolarHBondContact OD1-NZ 2.79Å; R141-K144 CarbonylContact O-C 3.56Å; R141-K144 PolarHBondContact O-N 2.98Å; M142-K144 PolarHBondContact O-N 3.43Å; K144-Q146 HydrophobicContact CB-CB 4.35Å; K144-Q146 HydrophobicContact CB-CG 3.82Å; K144-Q146 VanDerWaalsContact CD-OE1 3.25Å; K144-Q146 PolarHBondContact O-N 3Å
145	R	72.8	Confident	80.9	Confident	237 Å²	237	70.8 Å²	70.8	89%	0.894	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	31.3	-172.1	-52	179.1	178.4	-175.7	-1.7	113.1	R141 M142	R141-R145 PolarHBondContact O-N 3.25Å; R141-R145 VanDerWaalsContact O-N 3.11Å; M142-R145 PolarHBondContact O-N 3.1Å
146	Q	71.1	Confident	80.6	Confident	28 Å²	28	73.5 Å²	73.5	13%	0.131	36%	0.364	C	S	.	.			trans	-107.5	24.8	-179.3	-62.8	174.7	-39.8	0	0	111.5	R141 K144 N171 E173	R141-Q146 PolarHBondContact O-N 3.31Å; K144-Q146 HydrophobicContact CB-CB 4.35Å; K144-Q146 HydrophobicContact CB-CG 3.82Å; K144-Q146 VanDerWaalsContact CD-OE1 3.25Å; K144-Q146 PolarHBondContact O-N 3Å; Q146-N171 VanDerWaalsContact CB-OD1 3.22Å; Q146-N171 WeakPolarHBondContact CB-OD1 3.26Å; Q146-N171 PolarHBondContact O-ND2 3.45Å; Q146-N171 PolarHBondContact O-OD1 3.47Å; Q146-N171 VanDerWaalsContact O-OD1 3.04Å; Q146-E173 PolarHBondContact NE2-OE1 3.07Å
147	Y	71	Confident	80.5	Confident	15 Å²	15	74.3 Å²	74.3	6%	0.059	37%	0.367	C	S	.	.			trans	-135.6	123.6	-178.1	-154	-106.3	0	0	0	109.4	I138 R141 M142 L160	I138-Y147 HydrophobicContact CB-CE1 4.47Å; I138-Y147 HydrophobicContact CG1-CE1 4.11Å; I138-Y147 HydrophobicContact CG1-CE2 4.41Å; I138-Y147 HydrophobicContact CG2-CD1 4.19Å; I138-Y147 HydrophobicContact CG2-CE1 3.91Å; R141-Y147 HydrophobicContact CB-CD2 3.73Å; R141-Y147 HydrophobicContact CB-CG 4.14Å; R141-Y147 HydrophobicContact CG-CD2 4.36Å; M142-Y147 HydrophobicContact CG-CD1 3.91Å; M142-Y147 HydrophobicContact CG-CG 4.12Å; M142-Y147 HydrophobicContact SD-CD1 3.92Å; M142-Y147 HydrophobicContact SD-CG 4.3Å; Y147-L160 HydrophobicContact CE1-CD2 3.72Å; Y147-L160 WeakPolarHBondContact OH-CD2 3.2Å
148	R	71.1	Confident	80.3	Confident	158 Å²	158	75.3 Å²	75.3	60%	0.596	37%	0.373	S	S	*	.			trans	-107.4	132.2	169.1	-57.9	-168.1	-170.5	149.2	7.5	108	N163 E166	R148-N163 PolarHBondContact O-ND2 2.89Å; R148-N163 PolarHBondContact O-OD1 3.36Å; R148-E166 WeakPolarHBondContact CB-OE2 3.35Å; R148-E166 WeakPolarHBondContact CD-OE1 3.49Å; R148-E166 VanDerWaalsContact CG-OE1 3.29Å; R148-E166 WeakPolarHBondContact CG-OE1 3.34Å; R148-E166 IonicContact CZ-OE1 3.48Å; R148-E166 PolarHBondContact N-OE2 2.82Å; R148-E166 VanDerWaalsContact N-OE2 3.14Å; R148-E166 IonicContact NE-OE1 3.69Å; R148-E166 IonicContact NH1-OE1 3.92Å
149	S	76.4	Confident	80.4	Confident	30 Å²	30	76.6 Å²	76.6	21%	0.21	38%	0.38	C	S	.	.			trans	-155.2	145.7	176.2	58.5	0	0	0	0	108.4	I151 D159	S149-I151 PolarHBondContact O-N 3.35Å; S149-D159 WeakPolarHBondContact CB-O 3.28Å
150	E	82	Confident	80.5	Confident	128 Å²	128	71.9 Å²	71.9	60%	0.598	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	122.5	172.1	-60	-168.4	177.7	0	0	108.9	H152 D159	E150-H152 IonicContact OE2-CE1 3.8Å; E150-H152 IonicContact OE2-NE2 3.52Å; E150-D159 HydrophobicContact CB-CB 4.2Å; E150-D159 PolarHBondContact N-O 3.25Å; E150-D159 PolarHBondContact O-N 3.36Å
151	I	82.8	Confident	80.5	Confident	87 Å²	87	74.1 Å²	74.1	45%	0.446	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	106.4	179.1	-58.4	176.7	0	0	0	107.9	M142 S149 Q153	M142-I151 HydrophobicContact CE-CD1 4.27Å; S149-I151 PolarHBondContact O-N 3.35Å; I151-Q153 HydrophobicContact CG2-CG 3.98Å; I151-Q153 PolarHBondContact O-N 3.07Å
152	H	83.3	Confident	80.1	Confident	72 Å²	72	75.9 Å²	75.9	33%	0.333	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	83.7	175	-54.7	-71.7	0	0	0	109.5	E150 A154 A155 M156 E157	E150-H152 IonicContact OE2-CE1 3.8Å; E150-H152 IonicContact OE2-NE2 3.52Å; H152-A154 VanDerWaalsContact C-N 3.27Å; H152-A154 PolarHBondContact O-N 3.1Å; H152-A155 HydrophobicContact CB-CB 4.12Å; H152-A155 CarbonylContact O-C 3.44Å; H152-A155 PolarHBondContact O-N 2.92Å; H152-A155 VanDerWaalsContact O-N 3.08Å; H152-M156 PolarHBondContact O-N 3.31Å; H152-E157 HydrophobicContact CB-CB 4.25Å; H152-E157 PolarHBondContact N-O 2.99Å; H152-E157 PolarHBondContact O-N 3.49Å
153	Q	80.1	Confident	80.2	Confident	166 Å²	166	72.5 Å²	72.5	78%	0.776	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-36.8	-173.9	-64.3	-179.9	4	0	0	113.9	I151 M156	I151-Q153 HydrophobicContact CG2-CG 3.98Å; I151-Q153 PolarHBondContact O-N 3.07Å; Q153-M156 PolarHBondContact O-N 3.45Å
154	A	80.6	Confident	80.4	Confident	112 Å²	112	69.2 Å²	69.2	93%	0.926	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-32.8	179.6	0	0	0	0	0	113	H152	H152-A154 VanDerWaalsContact C-N 3.27Å; H152-A154 PolarHBondContact O-N 3.1Å
155	A	81.1	Confident	80.5	Confident	49 Å²	49	67.3 Å²	67.3	41%	0.405	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-12.3	177.4	0	0	0	0	0	112.5	H152 E157	H152-A155 HydrophobicContact CB-CB 4.12Å; H152-A155 CarbonylContact O-C 3.44Å; H152-A155 PolarHBondContact O-N 2.92Å; H152-A155 VanDerWaalsContact O-N 3.08Å; A155-E157 VanDerWaalsContact C-N 3.35Å; A155-E157 HydrophobicContact CB-CB 4.32Å; A155-E157 HydrophobicContact CB-CG 3.77Å
156	M	86.4	Confident	80.8	Confident	62 Å²	62	57 Å²	57	31%	0.305	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	45.9	-172.4	-53.2	-155.9	61.3	0	0	112.4	V78 E79 V80 Q81 H152 Q153	V78-M156 HydrophobicContact CB-CE 3.43Å; V78-M156 VanDerWaalsContact CB-CE 3.43Å; V78-M156 HydrophobicContact CB-SD 4.19Å; V78-M156 HydrophobicContact CG1-CE 3.09Å; V78-M156 HydrophobicContact CG1-SD 3.16Å; V78-M156 WeakPolarHBondContact CG1-SD 3.48Å; V78-M156 HydrophobicContact CG2-CE 4.33Å; E79-M156 WeakPolarHBondContact O-CB 3.39Å; E79-M156 WeakPolarHBondContact O-CE 3.46Å; V80-M156 CarbonylContact C-O 3.58Å; V80-M156 VanDerWaalsContact CA-O 3.31Å; V80-M156 WeakPolarHBondContact CA-O 2.98Å; V80-M156 HydrophobicContact CG2-CE 3.99Å; Q81-M156 PolarHBondContact N-O 3.07Å; H152-M156 PolarHBondContact O-N 3.31Å; Q153-M156 PolarHBondContact O-N 3.45Å
157	E	89.6	Confident	81.2	Confident	37 Å²	37	55.6 Å²	55.6	17%	0.173	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	141.3	-175.1	-62	172.9	176.9	0	0	110.5	Q81 K83 H152 A155	Q81-E157 HydrophobicContact CB-CG 4.23Å; Q81-E157 WeakPolarHBondContact O-CA 3.28Å; K83-E157 HydrophobicContact CD-CG 4.47Å; K83-E157 WeakPolarHBondContact CD-OE2 3.35Å; K83-E157 VanDerWaalsContact CE-OE1 3.27Å; K83-E157 WeakPolarHBondContact CE-OE1 3.47Å; K83-E157 VanDerWaalsContact CE-OE2 3.3Å; K83-E157 WeakPolarHBondContact CE-OE2 3.41Å; K83-E157 IonicContact NZ-OE1 3.17Å; K83-E157 PolarHBondContact NZ-OE1 2.84Å; K83-E157 IonicContact NZ-OE2 3.87Å; K83-E157 PolarHBondContact NZ-OE2 3.27Å; H152-E157 HydrophobicContact CB-CB 4.25Å; H152-E157 PolarHBondContact N-O 2.99Å; H152-E157 PolarHBondContact O-N 3.49Å; A155-E157 VanDerWaalsContact C-N 3.35Å; A155-E157 HydrophobicContact CB-CB 4.32Å; A155-E157 HydrophobicContact CB-CG 3.77Å
158	I	88.2	Confident	81.4	Confident	21 Å²	21	55 Å²	55	11%	0.108	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	113.7	166.6	-50.9	178.5	0	0	0	106.8	F62 V80 Q81 L82 K83 L160	F62-I158 HydrophobicContact CE1-CD1 4.09Å; F62-I158 HydrophobicContact CZ-CD1 3.87Å; V80-I158 HydrophobicContact CG1-CD1 3.94Å; V80-I158 HydrophobicContact CG1-CG1 3.79Å; Q81-I158 PolarHBondContact O-N 3.37Å; L82-I158 HydrophobicContact CD2-CB 4.19Å; L82-I158 HydrophobicContact CD2-CD1 4.36Å; K83-I158 PolarHBondContact N-O 3.33Å; I158-L160 HydrophobicContact CB-CD2 4.47Å; I158-L160 HydrophobicContact CG2-CD2 3.55Å
159	D	88.4	Confident	81.5	Confident	32 Å²	32	47.6 Å²	47.6	17%	0.171	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	122.8	174.7	-169.3	-21.2	0	0	0	109.7	N84 S149 E150 F161	N84-D159 VanDerWaalsContact CB-OD1 3.28Å; N84-D159 WeakPolarHBondContact CB-OD1 3.18Å; N84-D159 PolarHBondContact ND2-OD1 2.9Å; N84-D159 PolarHBondContact ND2-OD2 3.17Å; S149-D159 WeakPolarHBondContact CB-O 3.28Å; E150-D159 HydrophobicContact CB-CB 4.2Å; E150-D159 PolarHBondContact N-O 3.25Å; E150-D159 PolarHBondContact O-N 3.36Å; D159-F161 VanDerWaalsContact OD1-CB 3.28Å; D159-F161 WeakPolarHBondContact OD1-CB 3.38Å; D159-F161 PolarHBondContact OD1-N 3.37Å
160	L	87.4	Confident	81.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.273	C	S	.	.			trans	-103.7	10.2	-176	-52.8	-171.1	0	0	0	113.6	K83 T85 T87 I88 I138 Y147 I158 N163	K83-L160 PolarHBondContact O-N 3.12Å; T85-L160 HydrophobicContact CG2-CD1 3.88Å; T87-L160 PolarHBondContact OG1-O 3.48Å; I88-L160 HydrophobicContact CG2-CD1 3.84Å; I138-L160 HydrophobicContact CD1-CD1 3.7Å; I138-L160 HydrophobicContact CD1-CD2 4.47Å; I138-L160 HydrophobicContact CG1-CD1 4.43Å; Y147-L160 HydrophobicContact CE1-CD2 3.72Å; Y147-L160 WeakPolarHBondContact OH-CD2 3.2Å; I158-L160 HydrophobicContact CB-CD2 4.47Å; I158-L160 HydrophobicContact CG2-CD2 3.55Å; L160-N163 PolarHBondContact O-ND2 3.27Å
161	F	84.9	Confident	81.2	Confident	80 Å²	80	43.5 Å²	43.5	35%	0.351	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	147.4	179	-166.1	-106.9	0	0	0	112.1	N84 D159 N163 F288 H293 Y295	N84-F161 HydrophobicContact CB-CB 3.71Å; N84-F161 HydrophobicContact CB-CD2 4.24Å; N84-F161 HydrophobicContact CB-CG 4.45Å; D159-F161 VanDerWaalsContact OD1-CB 3.28Å; D159-F161 WeakPolarHBondContact OD1-CB 3.38Å; D159-F161 PolarHBondContact OD1-N 3.37Å; F161-N163 VanDerWaalsContact C-N 3.28Å; F161-N163 PolarHBondContact O-N 3.14Å; F161-F288 HydrophobicContact CZ-CE2 4.22Å; F161-H293 VanDerWaalsContact CE2-O 3.23Å; F161-H293 WeakPolarHBondContact CE2-O 3.38Å; F161-H293 HydrophobicContact CZ-CB 4.39Å; F161-Y295 HydrophobicContact CE2-CD2 4.3Å; F161-Y295 HydrophobicContact CE2-CE2 4.12Å; F161-Y295 HydrophobicContact CZ-CE2 4.34Å
162	G	76.1	Confident	81	Confident	42 Å²	42	39.7 Å²	39.7	43%	0.433	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	-5.5	173.9	0	0	0	0	0	116.3	E164	G162-E164 VanDerWaalsContact C-N 3.25Å; G162-E164 PolarHBondContact O-N 3.15Å
163	N	79	Confident	80.8	Confident	8 Å²	8	39.2 Å²	39.2	4%	0.043	22%	0.224	C	C	.	.			trans	-83.7	9.2	-176.8	-67.3	-39.2	0	0	0	115.5	R148 L160 F161 H165 E166 N167	R148-N163 PolarHBondContact O-ND2 2.89Å; R148-N163 PolarHBondContact O-OD1 3.36Å; L160-N163 PolarHBondContact O-ND2 3.27Å; F161-N163 VanDerWaalsContact C-N 3.28Å; F161-N163 PolarHBondContact O-N 3.14Å; N163-H165 PolarHBondContact O-N 2.91Å; N163-E166 PolarHBondContact O-N 2.83Å; N163-E166 PolarHBondContact OD1-OE2 2.99Å; N163-N167 PolarHBondContact O-N 3.39Å; N163-N167 PolarHBondContact O-ND2 3.08Å; N163-N167 VanDerWaalsContact O-ND2 3.1Å
164	E	81.3	Confident	80.9	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.009	21%	0.205	C	C	.	.	H	α-helix	trans	-56.6	-53.4	-175.5	162.3	45.2	-168.7	0	0	111.6	T87 G162 E166 N167 F168 T286 Y295 S329 S330	T87-E164 HydrophobicContact CG2-CB 3.89Å; G162-E164 VanDerWaalsContact C-N 3.25Å; G162-E164 PolarHBondContact O-N 3.15Å; E164-E166 VanDerWaalsContact C-N 3.31Å; E164-E166 PolarHBondContact O-N 2.8Å; E164-N167 WeakPolarHBondContact O-CB 3.45Å; E164-N167 PolarHBondContact O-N 2.8Å; E164-N167 VanDerWaalsContact O-N 3.15Å; E164-F168 VanDerWaalsContact CD-CE2 3.4Å; E164-F168 WeakPolarHBondContact O-CD2 3.44Å; E164-F168 PolarHBondContact O-N 3.23Å; E164-F168 WeakPolarHBondContact OE1-CD2 3.44Å; E164-F168 WeakPolarHBondContact OE1-CE2 3.49Å; E164-F168 WeakPolarHBondContact OE2-CD2 3.18Å; E164-F168 WeakPolarHBondContact OE2-CE2 3.18Å; E164-T286 WeakPolarHBondContact OE1-CB 3.22Å; E164-T286 WeakPolarHBondContact OE1-CG2 3.47Å; E164-T286 PolarHBondContact OE1-OG1 2.89Å; E164-Y295 HydrophobicContact CB-CD1 3.95Å; E164-Y295 HydrophobicContact CB-CE1 3.66Å; E164-Y295 HydrophobicContact CB-CE2 4.5Å; E164-Y295 HydrophobicContact CB-CG 4.48Å; E164-Y295 HydrophobicContact CG-CD1 3.86Å; E164-Y295 HydrophobicContact CG-CE1 3.64Å; E164-S329 WeakPolarHBondContact CG-OG 3.37Å; E164-S330 PolarHBondContact OE1-OG 3.06Å
165	H	77.6	Confident	81.3	Confident	48 Å²	48	29.7 Å²	29.7	22%	0.222	16%	0.163	C	C	.	.	H	α-helix	trans	-57.5	-45.6	179.1	-174.5	69.9	0	0	0	111.9	N163 N167 F168 T169 N257	N163-H165 PolarHBondContact O-N 2.91Å; H165-N167 VanDerWaalsContact C-N 3.31Å; H165-N167 PolarHBondContact O-N 3.04Å; H165-F168 PolarHBondContact O-N 3.19Å; H165-F168 VanDerWaalsContact O-N 3.16Å; H165-T169 PolarHBondContact CD2-OG1 3.42Å; H165-T169 WeakPolarHBondContact CE1-CG2 3.46Å; H165-T169 PolarHBondContact CE1-OG1 2.96Å; H165-T169 VanDerWaalsContact CE1-OG1 3.27Å; H165-T169 WeakPolarHBondContact ND1-CG2 3.45Å; H165-T169 PolarHBondContact NE2-OG1 3.31Å; H165-T169 WeakPolarHBondContact O-CB 3.48Å; H165-T169 PolarHBondContact O-N 2.7Å; H165-T169 PolarHBondContact O-OG1 3.12Å; H165-N257 VanDerWaalsContact CE1-CG 3.5Å; H165-N257 PolarHBondContact CE1-ND2 2.94Å; H165-N257 PolarHBondContact ND1-ND2 2.79Å
166	E	79.2	Confident	81.7	Confident	19 Å²	19	27.4 Å²	27.4	9%	0.089	14%	0.144	C	C	.	.	H	α-helix	trans	-60.5	-39.8	179.9	-61.9	-174.4	177.2	0	0	112	R148 N163 E164 F168 E170 N171	R148-E166 WeakPolarHBondContact CB-OE2 3.35Å; R148-E166 WeakPolarHBondContact CD-OE1 3.49Å; R148-E166 VanDerWaalsContact CG-OE1 3.29Å; R148-E166 WeakPolarHBondContact CG-OE1 3.34Å; R148-E166 IonicContact CZ-OE1 3.48Å; R148-E166 PolarHBondContact N-OE2 2.82Å; R148-E166 VanDerWaalsContact N-OE2 3.14Å; R148-E166 IonicContact NE-OE1 3.69Å; R148-E166 IonicContact NH1-OE1 3.92Å; N163-E166 PolarHBondContact O-N 2.83Å; N163-E166 PolarHBondContact OD1-OE2 2.99Å; E164-E166 VanDerWaalsContact C-N 3.31Å; E164-E166 PolarHBondContact O-N 2.8Å; E166-F168 VanDerWaalsContact C-N 3.31Å; E166-F168 PolarHBondContact O-N 3.06Å; E166-E170 PolarHBondContact O-N 3.47Å; E166-N171 VanDerWaalsContact O-CB 3.27Å; E166-N171 WeakPolarHBondContact O-CB 3.38Å; E166-N171 VanDerWaalsContact O-CG 3.32Å; E166-N171 PolarHBondContact O-N 3.44Å; E166-N171 PolarHBondContact O-ND2 3.04Å
167	N	79.4	Confident	82	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.1	-39.5	177	-72	-40.2	0	0	0	112.3	F91 W137 N163 E164 H165	F91-N167 HydrophobicContact CB-CB 4.12Å; F91-N167 HydrophobicContact CD1-CB 4.5Å; F91-N167 HydrophobicContact CD2-CB 4.22Å; F91-N167 WeakPolarHBondContact CE2-O 3.42Å; F91-N167 HydrophobicContact CG-CB 3.99Å; W137-N167 PolarHBondContact NE1-OD1 3.48Å; N163-N167 PolarHBondContact O-N 3.39Å; N163-N167 PolarHBondContact O-ND2 3.08Å; N163-N167 VanDerWaalsContact O-ND2 3.1Å; E164-N167 WeakPolarHBondContact O-CB 3.45Å; E164-N167 PolarHBondContact O-N 2.8Å; E164-N167 VanDerWaalsContact O-N 3.15Å; H165-N167 VanDerWaalsContact C-N 3.31Å; H165-N167 PolarHBondContact O-N 3.04Å
168	F	74.1	Confident	82.2	Confident	2 Å²	2	22.7 Å²	22.7	1%	0.009	12%	0.121	C	C	.	.	H	α-helix	trans	-95.2	-18.8	-174.6	-79.5	-94.6	0	0	0	114.6	F91 I94 E164 H165 E166 M176 I255 T286 V332	F91-F168 VanDerWaalsContact CA-CZ 3.46Å; F91-F168 HydrophobicContact CB-CD2 4.15Å; F91-F168 HydrophobicContact CB-CE2 3.41Å; F91-F168 VanDerWaalsContact CB-CE2 3.41Å; F91-F168 HydrophobicContact CB-CZ 3.76Å; F91-F168 AromaticContact CD2-CD1 3.93Å; F91-F168 HydrophobicContact CD2-CD1 3.93Å; F91-F168 AromaticContact CD2-CD2 3.71Å; F91-F168 HydrophobicContact CD2-CD2 3.71Å; F91-F168 AromaticContact CD2-CE1 3.75Å; F91-F168 HydrophobicContact CD2-CE1 3.75Å; F91-F168 AromaticContact CD2-CE2 3.56Å; F91-F168 HydrophobicContact CD2-CE2 3.56Å; F91-F168 AromaticContact CD2-CG 3.94Å; F91-F168 HydrophobicContact CD2-CG 3.94Å; F91-F168 AromaticContact CD2-CZ 3.6Å; F91-F168 HydrophobicContact CD2-CZ 3.6Å; F91-F168 HydrophobicContact CE2-CD1 4.41Å; F91-F168 HydrophobicContact CE2-CE1 4.46Å; F91-F168 HydrophobicContact CG-CD2 4.34Å; F91-F168 AromaticContact CG-CE2 3.96Å; F91-F168 HydrophobicContact CG-CE2 3.96Å; F91-F168 HydrophobicContact CG-CZ 4.17Å; I94-F168 HydrophobicContact CD1-CE1 4.27Å; I94-F168 HydrophobicContact CD1-CZ 4.01Å; E164-F168 VanDerWaalsContact CD-CE2 3.4Å; E164-F168 WeakPolarHBondContact O-CD2 3.44Å; E164-F168 PolarHBondContact O-N 3.23Å; E164-F168 WeakPolarHBondContact OE1-CD2 3.44Å; E164-F168 WeakPolarHBondContact OE1-CE2 3.49Å; E164-F168 WeakPolarHBondContact OE2-CD2 3.18Å; E164-F168 WeakPolarHBondContact OE2-CE2 3.18Å; H165-F168 PolarHBondContact O-N 3.19Å; H165-F168 VanDerWaalsContact O-N 3.16Å; E166-F168 VanDerWaalsContact C-N 3.31Å; E166-F168 PolarHBondContact O-N 3.06Å; F168-M176 WeakPolarHBondContact O-CE 3.34Å; F168-I255 HydrophobicContact CB-CD1 4.05Å; F168-I255 HydrophobicContact CB-CG2 3.97Å; F168-I255 HydrophobicContact CD1-CD1 3.56Å; F168-I255 HydrophobicContact CD1-CG1 4.01Å; F168-I255 HydrophobicContact CD1-CG2 3.94Å; F168-I255 HydrophobicContact CG-CD1 4.24Å; F168-I255 HydrophobicContact CG-CG2 4.36Å; F168-I255 WeakPolarHBondContact O-CD1 3.49Å; F168-T286 HydrophobicContact CE1-CG2 4.22Å; F168-T286 HydrophobicContact CE2-CG2 3.57Å; F168-T286 HydrophobicContact CZ-CG2 3.34Å; F168-V332 HydrophobicContact CD1-CG2 4.22Å; F168-V332 HydrophobicContact CE1-CG2 3.81Å
169	T	73.1	Confident	82.6	Confident	3 Å²	3	22.4 Å²	22.4	2%	0.018	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.2	-69.3	-176.9	69.9	0	0	0	0	112.4	H165 N171 L172 E173	H165-T169 PolarHBondContact CD2-OG1 3.42Å; H165-T169 WeakPolarHBondContact CE1-CG2 3.46Å; H165-T169 PolarHBondContact CE1-OG1 2.96Å; H165-T169 VanDerWaalsContact CE1-OG1 3.27Å; H165-T169 WeakPolarHBondContact ND1-CG2 3.45Å; H165-T169 PolarHBondContact NE2-OG1 3.31Å; H165-T169 WeakPolarHBondContact O-CB 3.48Å; H165-T169 PolarHBondContact O-N 2.7Å; H165-T169 PolarHBondContact O-OG1 3.12Å; T169-N171 VanDerWaalsContact C-N 3.33Å; T169-N171 PolarHBondContact O-N 3.39Å; T169-L172 CarbonylContact O-C 3.57Å; T169-L172 PolarHBondContact O-N 3.08Å; T169-L172 VanDerWaalsContact O-N 3.12Å; T169-E173 PolarHBondContact O-N 2.88Å; T169-E173 VanDerWaalsContact O-N 3.15Å
170	E	74.3	Confident	83	Confident	67 Å²	67	21 Å²	21	31%	0.313	11%	0.113	S	C	.	.	G	3₁₀ helix	trans	-62	-41.3	-174.6	-62.9	-165.6	172.4	0	0	111.7	E166 L172 E173	E166-E170 PolarHBondContact O-N 3.47Å; E170-L172 PolarHBondContact O-N 2.99Å; E170-L172 VanDerWaalsContact O-N 3.17Å; E170-E173 VanDerWaalsContact O-CB 3.31Å; E170-E173 WeakPolarHBondContact O-CB 3.42Å; E170-E173 VanDerWaalsContact O-CG 3.28Å; E170-E173 WeakPolarHBondContact O-CG 3.28Å; E170-E173 PolarHBondContact O-N 2.78Å
171	N	77.7	Confident	83.4	Confident	5 Å²	5	25.1 Å²	25.1	3%	0.027	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-70.2	-13.4	-179	-77.2	-48.4	0	0	0	114	W137 R141 Q146 E166 T169	W137-N171 HydrophobicContact CH2-CB 4.15Å; W137-N171 HydrophobicContact CZ2-CB 3.68Å; R141-N171 WeakPolarHBondContact CD-OD1 3.31Å; R141-N171 WeakPolarHBondContact CG-OD1 3.36Å; R141-N171 PolarHBondContact NE-OD1 2.9Å; R141-N171 PolarHBondContact NH1-O 3.36Å; R141-N171 PolarHBondContact NH2-O 2.89Å; Q146-N171 VanDerWaalsContact CB-OD1 3.22Å; Q146-N171 WeakPolarHBondContact CB-OD1 3.26Å; Q146-N171 PolarHBondContact O-ND2 3.45Å; Q146-N171 PolarHBondContact O-OD1 3.47Å; Q146-N171 VanDerWaalsContact O-OD1 3.04Å; E166-N171 VanDerWaalsContact O-CB 3.27Å; E166-N171 WeakPolarHBondContact O-CB 3.38Å; E166-N171 VanDerWaalsContact O-CG 3.32Å; E166-N171 PolarHBondContact O-N 3.44Å; E166-N171 PolarHBondContact O-ND2 3.04Å; T169-N171 VanDerWaalsContact C-N 3.33Å; T169-N171 PolarHBondContact O-N 3.39Å
172	L	79.7	Confident	84	Confident	6 Å²	6	21.4 Å²	21.4	3%	0.031	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-118.9	17.8	179.1	-61.3	177.2	0	0	0	112.5	F91 L113 T169 E170 N174 L175 M176 F253 I255	F91-L172 HydrophobicContact CE2-CD1 4.05Å; F91-L172 HydrophobicContact CZ-CD1 4.44Å; L113-L172 HydrophobicContact CD2-CD2 3.86Å; T169-L172 CarbonylContact O-C 3.57Å; T169-L172 PolarHBondContact O-N 3.08Å; T169-L172 VanDerWaalsContact O-N 3.12Å; E170-L172 PolarHBondContact O-N 2.99Å; E170-L172 VanDerWaalsContact O-N 3.17Å; L172-N174 PolarHBondContact O-N 3.42Å; L172-L175 WeakPolarHBondContact O-CB 3.38Å; L172-L175 PolarHBondContact O-N 3.23Å; L172-M176 HydrophobicContact CB-CE 4.33Å; L172-M176 PolarHBondContact O-N 3.41Å; L172-F253 HydrophobicContact CD1-CE2 3.73Å; L172-F253 HydrophobicContact CD1-CZ 3.91Å; L172-I255 HydrophobicContact CD1-CD1 3.53Å
173	E	77.7	Confident	85	Confident	62 Å²	62	23.2 Å²	23.2	29%	0.29	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-27.7	-171.7	61.1	172.7	175.6	0	0	115.8	Q146 T169 E170 S177 T199	Q146-E173 PolarHBondContact NE2-OE1 3.07Å; T169-E173 PolarHBondContact O-N 2.88Å; T169-E173 VanDerWaalsContact O-N 3.15Å; E170-E173 VanDerWaalsContact O-CB 3.31Å; E170-E173 WeakPolarHBondContact O-CB 3.42Å; E170-E173 VanDerWaalsContact O-CG 3.28Å; E170-E173 WeakPolarHBondContact O-CG 3.28Å; E170-E173 PolarHBondContact O-N 2.78Å; E173-S177 WeakPolarHBondContact O-CB 3.36Å; E173-T199 CarbonylContact C-O 3.5Å; E173-T199 HydrophobicContact CB-CG2 3.93Å; E173-T199 CarbonylContact O-C 3.5Å; E173-T199 WeakPolarHBondContact O-CA 3.47Å
174	N	83.4	Confident	85.9	Confident	72 Å²	72	22.9 Å²	22.9	39%	0.385	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-31.5	179.5	-70	-47.5	0	0	0	112.1	F112 L172 S177 H248	F112-N174 HydrophobicContact CD1-CB 3.9Å; F112-N174 HydrophobicContact CE1-CB 4.31Å; L172-N174 PolarHBondContact O-N 3.42Å; N174-S177 PolarHBondContact O-N 2.76Å; N174-S177 PolarHBondContact O-OG 3.01Å; N174-H248 PolarHBondContact O-CD2 3.36Å
175	L	88.9	Confident	86.6	Confident	6 Å²	6	26.9 Å²	26.9	3%	0.031	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-48.2	-178.8	176.3	66.6	0	0	0	110.8	L109 F112 L172 S177 P251 F253	L109-L175 HydrophobicContact CD2-CD1 4.2Å; L109-L175 HydrophobicContact CD2-CD2 3.76Å; F112-L175 HydrophobicContact CD1-CB 4.45Å; F112-L175 HydrophobicContact CD2-CB 4.42Å; F112-L175 HydrophobicContact CD2-CD1 3.59Å; F112-L175 HydrophobicContact CE2-CD1 3.56Å; F112-L175 HydrophobicContact CG-CB 4.27Å; F112-L175 HydrophobicContact CG-CD1 4.28Å; F112-L175 HydrophobicContact CZ-CD1 4.23Å; L172-L175 WeakPolarHBondContact O-CB 3.38Å; L172-L175 PolarHBondContact O-N 3.23Å; L175-S177 VanDerWaalsContact C-N 3.35Å; L175-P251 HydrophobicContact CD1-CB 3.9Å; L175-P251 HydrophobicContact CG-CB 4.01Å; L175-F253 HydrophobicContact CD2-CD1 4.49Å; L175-F253 HydrophobicContact CD2-CD2 4.35Å; L175-F253 HydrophobicContact CD2-CE1 3.97Å; L175-F253 HydrophobicContact CD2-CE2 3.77Å; L175-F253 HydrophobicContact CD2-CZ 3.56Å
176	M	89.7	Confident	87.5	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.005	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	12.4	-176.7	-60.4	-175.8	-71.3	0	0	113.2	F168 L172 T178 V254 I255	F168-M176 WeakPolarHBondContact O-CE 3.34Å; L172-M176 HydrophobicContact CB-CE 4.33Å; L172-M176 PolarHBondContact O-N 3.41Å; M176-T178 PolarHBondContact O-N 2.99Å; M176-V254 HydrophobicContact SD-CG1 4.36Å; M176-I255 HydrophobicContact CE-CB 4.2Å; M176-I255 HydrophobicContact CE-CD1 4.3Å; M176-I255 HydrophobicContact SD-CB 4.09Å; M176-I255 HydrophobicContact SD-CG1 4.48Å; M176-I255 PolarHBondContact SD-N 2.84Å
177	S	92.1	Very high	88.2	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.17	C	C	.	.			trans	-65.4	137.1	-174.9	66.5	0	0	0	0	111.9	E173 N174 L175 K198 C247	E173-S177 WeakPolarHBondContact O-CB 3.36Å; N174-S177 PolarHBondContact O-N 2.76Å; N174-S177 PolarHBondContact O-OG 3.01Å; L175-S177 VanDerWaalsContact C-N 3.35Å; S177-K198 CarbonylContact C-O 3.59Å; S177-K198 VanDerWaalsContact CA-O 3.22Å; S177-K198 WeakPolarHBondContact CA-O 3.32Å; S177-C247 PolarHBondContact O-N 3.27Å; S177-C247 PolarHBondContact O-SG 3.17Å; S177-C247 WeakPolarHBondContact OG-CB 3.48Å; S177-C247 PolarHBondContact OG-SG 3.36Å
178	T	94.2	Very high	88.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	158.2	178.8	62.2	0	0	0	0	111.4	M176 K197 K198 F222 F223 R244 V245 F246 C247	M176-T178 PolarHBondContact O-N 2.99Å; T178-K197 CarbonylContact O-C 3.58Å; T178-K197 WeakPolarHBondContact O-CA 3.22Å; T178-K198 PolarHBondContact N-O 2.76Å; T178-K198 PolarHBondContact O-N 3.44Å; T178-F222 HydrophobicContact CG2-CE1 4.44Å; T178-F223 HydrophobicContact CG2-CE1 3.87Å; T178-F223 HydrophobicContact CG2-CZ 3.99Å; T178-R244 HydrophobicContact CG2-CG 4.27Å; T178-R244 WeakPolarHBondContact OG1-CD 3.47Å; T178-R244 PolarHBondContact OG1-NH1 2.6Å; T178-V245 CarbonylContact C-O 3.56Å; T178-V245 WeakPolarHBondContact CA-O 3.25Å; T178-V245 WeakPolarHBondContact CB-O 3.34Å; T178-F246 HydrophobicContact CG2-CD1 3.61Å; T178-F246 HydrophobicContact CG2-CE1 3.84Å; T178-F246 HydrophobicContact CG2-CG 4.36Å; T178-C247 VanDerWaalsContact C-SG 3.59Å
179	T	96.1	Very high	89.9	Confident	16 Å²	16	42.4 Å²	42.4	10%	0.098	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	145.9	173.3	-163.9	0	0	0	0	110.7	K195 V196 R244 V245	T179-K195 WeakPolarHBondContact OG1-CE 3.2Å; T179-K195 VanDerWaalsContact OG1-CG 3.24Å; T179-K195 WeakPolarHBondContact OG1-CG 3.47Å; T179-V196 CarbonylContact C-O 3.5Å; T179-V196 WeakPolarHBondContact CA-O 3.48Å; T179-R244 WeakPolarHBondContact O-CA 3.41Å; T179-V245 HydrophobicContact CG2-CG2 3.78Å; T179-V245 PolarHBondContact N-O 3.24Å; T179-V245 PolarHBondContact O-N 3.38Å
180	Q	96.5	Very high	90.8	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.009	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	129.7	175	-169.4	171.5	36.4	0	0	107.9	V196 S224 F241 S242 R244	Q180-V196 PolarHBondContact N-O 2.84Å; Q180-V196 PolarHBondContact O-N 3.42Å; Q180-S224 PolarHBondContact NE2-O 2.81Å; Q180-S224 VanDerWaalsContact NE2-O 3.1Å; Q180-F241 HydrophobicContact CG-CB 4.22Å; Q180-F241 HydrophobicContact CG-CD1 4.25Å; Q180-S242 VanDerWaalsContact CG-O 3.27Å; Q180-S242 WeakPolarHBondContact CG-O 3.5Å; Q180-S242 PolarHBondContact NE2-O 3.34Å; Q180-R244 HydrophobicContact CB-CB 4.12Å; Q180-R244 HydrophobicContact CB-CG 4.33Å; Q180-R244 HydrophobicContact CG-CB 4.24Å
181	E	97.6	Very high	91.7	Very high	86 Å²	86	46.2 Å²	46.2	40%	0.402	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	150	177.3	-62.9	-175.7	160.4	0	0	109	F193 Q194 K195 F241 S242	E181-F193 HydrophobicContact CB-CE2 4.22Å; E181-F193 HydrophobicContact CB-CZ 4.28Å; E181-F193 HydrophobicContact CG-CZ 4.16Å; E181-Q194 CarbonylContact C-O 3.59Å; E181-Q194 WeakPolarHBondContact CA-O 3.18Å; E181-K195 HydrophobicContact CG-CG 4.41Å; E181-F241 WeakPolarHBondContact O-CA 3.42Å; E181-S242 PolarHBondContact N-OG 3.47Å; E181-S242 PolarHBondContact O-N 3.17Å; E181-S242 PolarHBondContact O-OG 3.34Å
182	S	96.9	Very high	92.6	Very high	3 Å²	3	50.3 Å²	50.3	2%	0.021	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	150.1	175.6	73.3	0	0	0	0	112.5	F193 Q194 R239 E240	S182-F193 WeakPolarHBondContact O-CA 3.27Å; S182-Q194 PolarHBondContact N-O 2.96Å; S182-Q194 PolarHBondContact O-N 2.75Å; S182-R239 PolarHBondContact OG-NH1 3.31Å; S182-E240 CarbonylContact C-O 3.6Å; S182-E240 WeakPolarHBondContact CA-O 3.2Å; S182-E240 VanDerWaalsContact CB-O 3.31Å; S182-E240 WeakPolarHBondContact CB-O 3.46Å
183	L	97.4	Very high	93.3	Very high	79 Å²	79	55.9 Å²	55.9	41%	0.414	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	126.6	-179.7	-174.9	69	0	0	0	110.2	R192 R239 E240	L183-R192 CarbonylContact C-O 3.57Å; L183-R192 WeakPolarHBondContact CA-O 3.46Å; L183-R192 HydrophobicContact CD1-CG 4.06Å; L183-R239 WeakPolarHBondContact O-CA 3.27Å; L183-E240 PolarHBondContact N-O 3.04Å; L183-E240 PolarHBondContact O-N 3.33Å
184	C	97.3	Very high	94.2	Very high	1 Å²	1	55 Å²	55	1%	0.007	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	137.8	170.8	-170.9	0	0	0	0	111	N186 C189 R192 L238	C184-N186 VanDerWaalsContact C-N 3.3Å; C184-N186 PolarHBondContact SG-N 3.11Å; C184-C189 HydrophobicContact CB-CB 4.01Å; C184-R192 HydrophobicContact CB-CG 4.2Å; C184-R192 PolarHBondContact N-O 3.27Å; C184-R192 WeakPolarHBondContact O-CG 3.46Å; C184-R192 PolarHBondContact O-NE 3.33Å; C184-L238 CarbonylContact C-O 3.51Å; C184-L238 WeakPolarHBondContact CA-O 3.17Å
185	T	96.9	Very high	94.8	Very high	87 Å²	87	57.8 Å²	57.8	53%	0.534	29%	0.285	S	S	.	.	S	Bend	trans	-68.8	-30.1	175.4	58.4	0	0	0	0	112.2	R187 L238	T185-R187 PolarHBondContact O-N 3.48Å; T185-L238 HydrophobicContact CG2-CB 4.23Å; T185-L238 WeakPolarHBondContact CG2-O 3.45Å; T185-L238 PolarHBondContact N-O 2.85Å; T185-L238 PolarHBondContact OG1-N 3.33Å; T185-L238 PolarHBondContact OG1-O 3.47Å
186	N	95.6	Very high	95	Very high	41 Å²	41	59.3 Å²	59.3	22%	0.219	29%	0.294	C	S	.	.			trans	-71.6	120.2	175	-174.3	-22.7	0	0	0	109.9	C184 D188 C189 D236	C184-N186 VanDerWaalsContact C-N 3.3Å; C184-N186 PolarHBondContact SG-N 3.11Å; N186-D188 VanDerWaalsContact C-N 3.3Å; N186-D188 PolarHBondContact O-N 3.4Å; N186-D188 PolarHBondContact OD1-N 3.38Å; N186-C189 HydrophobicContact CB-CB 4.33Å; N186-C189 VanDerWaalsContact O-CB 3.25Å; N186-C189 WeakPolarHBondContact O-CB 3.47Å; N186-C189 PolarHBondContact O-N 2.92Å; N186-D236 PolarHBondContact ND2-OD1 3.1Å
187	R	92.9	Very high	95.2	Very high	198 Å²	198	64.8 Å²	64.8	75%	0.747	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-26.6	-176	-66.4	-170.5	176.1	-171.9	-0.2	113.3	T185 C189	T185-R187 PolarHBondContact O-N 3.48Å; R187-C189 VanDerWaalsContact C-N 3.32Å
188	D	94.6	Very high	95.2	Very high	148 Å²	148	69.7 Å²	69.7	79%	0.791	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	2.5	-178.3	-55.3	-39.6	0	0	0	111.9	N186	N186-D188 VanDerWaalsContact C-N 3.3Å; N186-D188 PolarHBondContact O-N 3.4Å; N186-D188 PolarHBondContact OD1-N 3.38Å
189	C	95.3	Very high	94.8	Very high	7 Å²	7	72.1 Å²	72.1	5%	0.047	35%	0.354	C	S	.	.			trans	-59.4	121.8	173.6	-177.3	0	0	0	0	109.7	C184 N186 R187 S191 R192	C184-C189 HydrophobicContact CB-CB 4.01Å; N186-C189 HydrophobicContact CB-CB 4.33Å; N186-C189 VanDerWaalsContact O-CB 3.25Å; N186-C189 WeakPolarHBondContact O-CB 3.47Å; N186-C189 PolarHBondContact O-N 2.92Å; R187-C189 VanDerWaalsContact C-N 3.32Å; C189-S191 PolarHBondContact O-N 3.31Å; C189-R192 HydrophobicContact CB-CB 4.15Å; C189-R192 WeakPolarHBondContact O-CB 3.03Å; C189-R192 PolarHBondContact O-N 2.62Å; C189-R192 VanDerWaalsContact O-N 3.13Å
190	P	92.4	Very high	94.2	Very high	109 Å²	109	72.1 Å²	72.1	71%	0.708	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-32.1	-176.2	24.1	-34	0	0	0	112.1
191	S	93.4	Very high	93.7	Very high	41 Å²	41	72.1 Å²	72.1	29%	0.287	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	48.3	177.2	-48.6	0	0	0	0	110.2	C189 F193 Q194 E232 R239	C189-S191 PolarHBondContact O-N 3.31Å; S191-F193 PolarHBondContact O-N 3.13Å; S191-Q194 WeakPolarHBondContact O-CG 3.22Å; S191-Q194 PolarHBondContact O-NE2 3.41Å; S191-E232 VanDerWaalsContact CB-CD 3.42Å; S191-E232 WeakPolarHBondContact CB-OE2 3.31Å; S191-E232 PolarHBondContact OG-OE2 2.94Å; S191-R239 PolarHBondContact O-NH1 2.9Å; S191-R239 PolarHBondContact O-NH2 3.24Å
192	R	95.1	Very high	93.2	Very high	92 Å²	92	72.1 Å²	72.1	35%	0.347	36%	0.357	S	S	.	.			trans	-55.2	-50.4	-174.1	-172.4	176.9	178	-157.9	-8.4	112.1	L183 C184 C189 R239	L183-R192 CarbonylContact C-O 3.57Å; L183-R192 WeakPolarHBondContact CA-O 3.46Å; L183-R192 HydrophobicContact CD1-CG 4.06Å; C184-R192 HydrophobicContact CB-CG 4.2Å; C184-R192 PolarHBondContact N-O 3.27Å; C184-R192 WeakPolarHBondContact O-CG 3.46Å; C184-R192 PolarHBondContact O-NE 3.33Å; C189-R192 HydrophobicContact CB-CB 4.15Å; C189-R192 WeakPolarHBondContact O-CB 3.03Å; C189-R192 PolarHBondContact O-N 2.62Å; C189-R192 VanDerWaalsContact O-N 3.13Å; R192-R239 PolarHBondContact O-NH1 2.95Å
193	F	96.3	Very high	92.7	Very high	122 Å²	122	72.3 Å²	72.3	54%	0.535	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	132.1	171.8	-179.4	-97	0	0	0	109.8	E181 S182 S191	E181-F193 HydrophobicContact CB-CE2 4.22Å; E181-F193 HydrophobicContact CB-CZ 4.28Å; E181-F193 HydrophobicContact CG-CZ 4.16Å; S182-F193 WeakPolarHBondContact O-CA 3.27Å; S191-F193 PolarHBondContact O-N 3.13Å
194	Q	95.3	Very high	92.1	Very high	45 Å²	45	71.7 Å²	71.7	21%	0.21	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	145.3	173.6	-57.4	-177.8	12.4	0	0	110.8	E181 S182 S191 E232	E181-Q194 CarbonylContact C-O 3.59Å; E181-Q194 WeakPolarHBondContact CA-O 3.18Å; S182-Q194 PolarHBondContact N-O 2.96Å; S182-Q194 PolarHBondContact O-N 2.75Å; S191-Q194 WeakPolarHBondContact O-CG 3.22Å; S191-Q194 PolarHBondContact O-NE2 3.41Å; Q194-E232 PolarHBondContact NE2-OE1 3.3Å
195	K	96.1	Very high	91.3	Very high	130 Å²	130	73.2 Å²	73.2	57%	0.565	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	108.3	169.3	-174.2	169.6	-175.7	163.1	0	109.1	T179 E181	T179-K195 WeakPolarHBondContact OG1-CE 3.2Å; T179-K195 VanDerWaalsContact OG1-CG 3.24Å; T179-K195 WeakPolarHBondContact OG1-CG 3.47Å; E181-K195 HydrophobicContact CG-CG 4.41Å
196	V	93.7	Very high	90.3	Very high	38 Å²	38	70.8 Å²	70.8	23%	0.23	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	111.6	-178	-176.7	0	0	0	0	108.9	T179 Q180 F241	T179-V196 CarbonylContact C-O 3.5Å; T179-V196 WeakPolarHBondContact CA-O 3.48Å; Q180-V196 PolarHBondContact N-O 2.84Å; Q180-V196 PolarHBondContact O-N 3.42Å; V196-F241 HydrophobicContact CG2-CE1 4.38Å
197	K	94	Very high	89.2	Confident	115 Å²	115	78.6 Å²	78.6	50%	0.5	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	137.6	170.3	-169.3	178.7	179.1	-173.5	0	109.8	T178	T178-K197 CarbonylContact O-C 3.58Å; T178-K197 WeakPolarHBondContact O-CA 3.22Å
198	K	91.5	Very high	88.2	Confident	104 Å²	104	77.3 Å²	77.3	45%	0.452	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.8	166.4	-67.3	-69.1	-173.4	174.3	0	108.1	S177 T178 F222	S177-K198 CarbonylContact C-O 3.59Å; S177-K198 VanDerWaalsContact CA-O 3.22Å; S177-K198 WeakPolarHBondContact CA-O 3.32Å; T178-K198 PolarHBondContact N-O 2.76Å; T178-K198 PolarHBondContact O-N 3.44Å; K198-F222 HydrophobicContact CB-CZ 4.2Å; K198-F222 HydrophobicContact CG-CZ 4.28Å
199	T	86.6	Confident	86.9	Confident	51 Å²	51	75.7 Å²	75.7	31%	0.313	38%	0.383	S	S	.	.	S	Bend	trans	-89.6	-22.1	-179.9	38.8	0	0	0	0	112.9	E173	E173-T199 CarbonylContact C-O 3.5Å; E173-T199 HydrophobicContact CB-CG2 3.93Å; E173-T199 CarbonylContact O-C 3.5Å; E173-T199 WeakPolarHBondContact O-CA 3.47Å
200	T	82.4	Confident	85.7	Confident	16 Å²	16	77.3 Å²	77.3	10%	0.098	39%	0.394	C	S	.	.	S	Bend	trans	-132.3	161.9	-177.9	66.8	0	0	0	0	110.1	N202	T200-N202 VanDerWaalsContact OG1-CG 3.26Å; T200-N202 PolarHBondContact OG1-ND2 2.84Å; T200-N202 PolarHBondContact OG1-OD1 2.9Å
201	I	87.3	Confident	84.4	Confident	2 Å²	2	81.9 Å²	81.9	1%	0.01	41%	0.406	C	S	.	.			trans	-98.7	96.3	172.3	-55.1	-178.2	0	0	0	107.5	I203 F222 F223 F246 V254 L256	I201-I203 HydrophobicContact CG2-CG2 4.13Å; I201-F222 HydrophobicContact CB-CE1 4.43Å; I201-F222 HydrophobicContact CG1-CE1 4.24Å; I201-F222 HydrophobicContact CG2-CD1 4.05Å; I201-F222 HydrophobicContact CG2-CE1 4.11Å; I201-F222 HydrophobicContact CG2-CG 4.45Å; I201-F223 HydrophobicContact CD1-CE2 4.05Å; I201-F223 HydrophobicContact CD1-CZ 3.91Å; I201-F223 HydrophobicContact CG2-CE2 4.44Å; I201-F246 HydrophobicContact CD1-CE1 3.92Å; I201-F246 HydrophobicContact CD1-CZ 4.08Å; I201-V254 HydrophobicContact CD1-CG1 3.54Å; I201-V254 HydrophobicContact CD1-CG2 4.37Å; I201-L256 HydrophobicContact CG2-CD2 4.11Å
202	N	85.8	Confident	83.4	Confident	86 Å²	86	88.1 Å²	88.1	46%	0.46	43%	0.428	S	S	.	.			trans	-100	102.2	178	-63.5	-14	0	0	0	108	T200	T200-N202 VanDerWaalsContact OG1-CG 3.26Å; T200-N202 PolarHBondContact OG1-ND2 2.84Å; T200-N202 PolarHBondContact OG1-OD1 2.9Å
203	I	87.8	Confident	83	Confident	6 Å²	6	84.9 Å²	84.9	3%	0.031	42%	0.417	C	S	.	.			trans	-99	136.4	171.2	58.7	171.8	0	0	0	109.1	I201 I215 A218 V219 F222 L256 W261	I201-I203 HydrophobicContact CG2-CG2 4.13Å; I203-I215 HydrophobicContact CD1-CG2 4.17Å; I203-A218 HydrophobicContact CB-CB 3.96Å; I203-A218 HydrophobicContact CG2-CB 4.32Å; I203-V219 HydrophobicContact CD1-CG2 3.86Å; I203-V219 HydrophobicContact CG2-CG2 3.85Å; I203-F222 HydrophobicContact CG2-CB 4.35Å; I203-L256 HydrophobicContact CD1-CB 4.24Å; I203-L256 HydrophobicContact CD1-CD1 3.79Å; I203-L256 HydrophobicContact CD1-CD2 4.12Å; I203-L256 HydrophobicContact CD1-CG 4.27Å; I203-W261 HydrophobicContact CB-CZ2 4.16Å; I203-W261 HydrophobicContact CD1-CZ2 3.76Å; I203-W261 HydrophobicContact CG1-CZ2 3.84Å; I203-W261 PolarHBondContact O-NE1 2.8Å
204	S	84.1	Confident	82.6	Confident	66 Å²	66	79.3 Å²	79.3	46%	0.462	39%	0.393	S	S	.	.			trans	-107.2	151.5	175.6	-65.4	0	0	0	0	109.3	Q260 W261	S204-Q260 PolarHBondContact OG-OE1 3.05Å; S204-W261 VanDerWaalsContact C-CZ2 3.44Å; S204-W261 WeakPolarHBondContact O-CZ2 3.44Å
205	P	81.1	Confident	82.3	Confident	34 Å²	34	77.1 Å²	77.1	22%	0.221	38%	0.383	C	S	.	.			trans	-58.2	137	173	24.4	-33.2	0	0	0	109.6	W261	P205-W261 HydrophobicContact CB-CD2 4.03Å; P205-W261 HydrophobicContact CB-CE3 3.88Å; P205-W261 HydrophobicContact CB-CZ3 4.17Å
206	P	75.6	Confident	82	Confident	36 Å²	36	72.4 Å²	72.4	23%	0.234	36%	0.363	C	S	.	.			trans	-66.1	144.6	-179.1	28.3	-34.2	0	0	0	110.3	E208 P210 P214	P206-E208 WeakPolarHBondContact CB-O 3.5Å; P206-E208 PolarHBondContact O-N 3Å; P206-P210 HydrophobicContact CG-CG 4.39Å; P206-P214 HydrophobicContact CG-CB 4.26Å
207	H	72.3	Confident	81.8	Confident	204 Å²	204	72.4 Å²	72.4	94%	0.944	36%	0.364	S	S	*	.	S	Bend	trans	-63.3	-31	179.7	-68.1	-57.1	0	0	0	113.2
208	E	72.4	Confident	81.7	Confident	172 Å²	172	67.2 Å²	67.2	80%	0.804	34%	0.343	S	S	*	.	S	Bend	trans	-122.9	129.6	170.5	-68.8	-179.1	-178.5	0	0	107.9	P206 P210	P206-E208 WeakPolarHBondContact CB-O 3.5Å; P206-E208 PolarHBondContact O-N 3Å; E208-P210 WeakPolarHBondContact O-CD 3.45Å
209	L	67.7	Low	81.7	Confident	113 Å²	113	62.3 Å²	62.3	59%	0.592	32%	0.322	S	S	*	.			trans	-63.2	120.2	179.8	-73.4	169.4	0	0	0	109.3	D265	L209-D265 WeakPolarHBondContact CD2-O 3.35Å
210	P	68.3	Low	81.9	Confident	42 Å²	42	63.8 Å²	63.8	27%	0.273	33%	0.328	S	S	.	.			trans	-65.6	156	178.9	26.8	-33	0	0	0	110.1	P206 E208 K212 P214	P206-P210 HydrophobicContact CG-CG 4.39Å; E208-P210 WeakPolarHBondContact O-CD 3.45Å; P210-K212 PolarHBondContact O-N 2.84Å; P210-P214 HydrophobicContact CG-CB 4.13Å
211	H	66.7	Low	82.3	Confident	205 Å²	205	69 Å²	69	95%	0.949	35%	0.351	S	S	*	.	S	Bend	trans	-64.1	-8.3	170	-64.1	-57.7	0	0	0	113.6
212	K	72.4	Confident	82.6	Confident	172 Å²	172	70.2 Å²	70.2	75%	0.748	36%	0.356	S	S	*	.	S	Bend	trans	-116.2	-167	-176.6	-65.3	-172.7	179.6	179.3	0	110.6	P210 P214	P210-K212 PolarHBondContact O-N 2.84Å; K212-P214 WeakPolarHBondContact O-CD 3.35Å
213	D	85.9	Confident	82.9	Confident	23 Å²	23	66.3 Å²	66.3	12%	0.123	34%	0.335	C	S	.	.			trans	-57.9	116.9	173.5	-169.8	-44.7	0	0	0	112.2	I215 Q216 S217 Y268 P270	D213-I215 WeakPolarHBondContact OD1-CA 3.41Å; D213-I215 PolarHBondContact OD1-N 2.96Å; D213-Q216 HydrophobicContact CB-CB 3.85Å; D213-Q216 PolarHBondContact OD1-N 3.04Å; D213-S217 VanDerWaalsContact O-CB 3.3Å; D213-S217 WeakPolarHBondContact O-CB 3.42Å; D213-S217 PolarHBondContact O-N 3.25Å; D213-S217 PolarHBondContact O-OG 3.32Å; D213-Y268 WeakPolarHBondContact CA-OH 3.48Å; D213-Y268 WeakPolarHBondContact CB-OH 3.3Å; D213-Y268 WeakPolarHBondContact OD2-CE2 3.23Å; D213-Y268 PolarHBondContact OD2-OH 3.11Å; D213-P270 WeakPolarHBondContact OD2-CB 3.47Å; D213-P270 WeakPolarHBondContact OD2-CG 3.45Å
214	P	87.3	Confident	83.2	Confident	5 Å²	5	67.9 Å²	67.9	3%	0.032	35%	0.347	C	S	.	.	H	α-helix	trans	-70.5	-33.8	-177.9	29.4	-35	0	0	0	112.9	P206 P210 K212 A218 W261 L266	P206-P214 HydrophobicContact CG-CB 4.26Å; P210-P214 HydrophobicContact CG-CB 4.13Å; K212-P214 WeakPolarHBondContact O-CD 3.35Å; P214-A218 WeakPolarHBondContact O-CB 3.18Å; P214-A218 PolarHBondContact O-N 3.15Å; P214-W261 HydrophobicContact CB-CZ3 4.2Å; P214-L266 HydrophobicContact CG-CD2 4.11Å
215	I	89.6	Confident	83.7	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-71.9	-48.7	179.7	-71.1	169	0	0	0	109.6	I203 D213 S217 A218 V219 L256 M258 W261 L266 V269 P270 L273 L331	I203-I215 HydrophobicContact CD1-CG2 4.17Å; D213-I215 WeakPolarHBondContact OD1-CA 3.41Å; D213-I215 PolarHBondContact OD1-N 2.96Å; I215-S217 VanDerWaalsContact C-N 3.29Å; I215-S217 PolarHBondContact O-N 2.77Å; I215-A218 PolarHBondContact O-N 3.29Å; I215-V219 WeakPolarHBondContact O-CB 3.35Å; I215-V219 WeakPolarHBondContact O-CG2 3.2Å; I215-V219 PolarHBondContact O-N 3.26Å; I215-L256 HydrophobicContact CG2-CD1 3.7Å; I215-M258 HydrophobicContact CD1-CE 3.83Å; I215-M258 HydrophobicContact CG1-CE 4.17Å; I215-W261 HydrophobicContact CG1-CE3 4.5Å; I215-W261 HydrophobicContact CG1-CH2 4.16Å; I215-W261 HydrophobicContact CG1-CZ3 4.03Å; I215-L266 HydrophobicContact CD1-CD2 3.66Å; I215-L266 HydrophobicContact CG1-CD2 3.75Å; I215-V269 HydrophobicContact CD1-CG1 4.5Å; I215-P270 HydrophobicContact CB-CG 3.99Å; I215-P270 HydrophobicContact CD1-CG 4.37Å; I215-P270 HydrophobicContact CG2-CG 4.04Å; I215-L273 HydrophobicContact CG2-CD1 4.07Å; I215-L331 HydrophobicContact CD1-CD1 4.02Å
216	Q	90.4	Very high	84.3	Confident	30 Å²	30	70 Å²	70	14%	0.14	35%	0.352	C	S	.	.	H	α-helix	trans	-60.6	-40.9	176.7	-175.8	63.5	62.4	0	0	111.1	D213 V219 D220 A274	D213-Q216 HydrophobicContact CB-CB 3.85Å; D213-Q216 PolarHBondContact OD1-N 3.04Å; Q216-V219 PolarHBondContact O-N 2.88Å; Q216-D220 PolarHBondContact NE2-OD1 3.32Å; Q216-D220 WeakPolarHBondContact O-CB 3.28Å; Q216-D220 PolarHBondContact O-N 3.37Å; Q216-A274 PolarHBondContact NE2-O 2.93Å
217	S	89.8	Confident	85.3	Confident	38 Å²	38	73.2 Å²	73.2	27%	0.266	37%	0.367	S	S	.	.	H	α-helix	trans	-63	-43.8	178.7	-58.4	0	0	0	0	112.1	D213 I215 V219 D220 E221	D213-S217 VanDerWaalsContact O-CB 3.3Å; D213-S217 WeakPolarHBondContact O-CB 3.42Å; D213-S217 PolarHBondContact O-N 3.25Å; D213-S217 PolarHBondContact O-OG 3.32Å; I215-S217 VanDerWaalsContact C-N 3.29Å; I215-S217 PolarHBondContact O-N 2.77Å; S217-V219 VanDerWaalsContact C-N 3.32Å; S217-V219 PolarHBondContact O-N 3.22Å; S217-D220 PolarHBondContact O-N 3.01Å; S217-E221 PolarHBondContact O-N 3.48Å
218	A	90.6	Very high	86.4	Confident	7 Å²	7	67.6 Å²	67.6	6%	0.058	34%	0.343	C	S	.	.	H	α-helix	trans	-66.9	-35.3	178	0	0	0	0	0	112.3	I203 P214 I215 F222 W261	I203-A218 HydrophobicContact CB-CB 3.96Å; I203-A218 HydrophobicContact CG2-CB 4.32Å; P214-A218 WeakPolarHBondContact O-CB 3.18Å; P214-A218 PolarHBondContact O-N 3.15Å; I215-A218 PolarHBondContact O-N 3.29Å; A218-F222 PolarHBondContact O-N 3.21Å; A218-F222 VanDerWaalsContact O-N 3.12Å; A218-W261 HydrophobicContact CB-CH2 3.79Å; A218-W261 HydrophobicContact CB-CZ2 3.87Å
219	V	92	Very high	87.5	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-65.5	-47.4	172	165.5	0	0	0	0	111.2	I203 I215 Q216 S217 E221 F222 F223 L256 L273 L275	I203-V219 HydrophobicContact CD1-CG2 3.86Å; I203-V219 HydrophobicContact CG2-CG2 3.85Å; I215-V219 WeakPolarHBondContact O-CB 3.35Å; I215-V219 WeakPolarHBondContact O-CG2 3.2Å; I215-V219 PolarHBondContact O-N 3.26Å; Q216-V219 PolarHBondContact O-N 2.88Å; S217-V219 VanDerWaalsContact C-N 3.32Å; S217-V219 PolarHBondContact O-N 3.22Å; V219-E221 VanDerWaalsContact C-N 3.3Å; V219-E221 PolarHBondContact O-N 3.29Å; V219-F222 WeakPolarHBondContact O-CB 3.4Å; V219-F222 PolarHBondContact O-N 3.43Å; V219-F222 VanDerWaalsContact O-N 3.11Å; V219-F223 HydrophobicContact CG1-CD2 4.15Å; V219-F223 HydrophobicContact CG1-CE2 4.43Å; V219-F223 WeakPolarHBondContact O-CD2 3.23Å; V219-F223 PolarHBondContact O-N 3.01Å; V219-F223 VanDerWaalsContact O-N 3.14Å; V219-L256 HydrophobicContact CG2-CD1 4.32Å; V219-L256 HydrophobicContact CG2-CD2 4.24Å; V219-L273 HydrophobicContact CB-CD1 4.44Å; V219-L273 HydrophobicContact CG2-CD1 4.09Å; V219-L273 HydrophobicContact CG2-CD2 4.39Å; V219-L275 HydrophobicContact CG1-CD2 3.18Å; V219-L275 HydrophobicContact CG1-CG 4.15Å
220	D	91.1	Very high	88.8	Confident	83 Å²	83	61 Å²	61	44%	0.444	31%	0.314	S	S	.	.	H	α-helix	trans	-58.5	-43.9	178.6	-72.5	-17.5	0	0	0	110.8	Q216 S217 F222 F223 S224	Q216-D220 PolarHBondContact NE2-OD1 3.32Å; Q216-D220 WeakPolarHBondContact O-CB 3.28Å; Q216-D220 PolarHBondContact O-N 3.37Å; S217-D220 PolarHBondContact O-N 3.01Å; D220-F222 VanDerWaalsContact C-N 3.34Å; D220-F222 PolarHBondContact O-N 3.19Å; D220-F223 PolarHBondContact O-N 3.38Å; D220-F223 VanDerWaalsContact O-N 3.16Å; D220-S224 VanDerWaalsContact O-CB 3.27Å; D220-S224 WeakPolarHBondContact O-CB 3.42Å; D220-S224 PolarHBondContact O-N 2.98Å
221	E	91.1	Very high	90	Very high	124 Å²	124	64 Å²	64	58%	0.579	34%	0.336	S	S	*	.	H	α-helix	trans	-61.9	-38.6	175.9	-170.7	-169.8	160.3	0	0	112.7	S217 V219 F223 S224	S217-E221 PolarHBondContact O-N 3.48Å; V219-E221 VanDerWaalsContact C-N 3.3Å; V219-E221 PolarHBondContact O-N 3.29Å; E221-F223 PolarHBondContact O-N 3.36Å; E221-S224 PolarHBondContact O-OG 3.33Å
222	F	92.4	Very high	91.4	Very high	28 Å²	28	56.5 Å²	56.5	12%	0.123	30%	0.301	C	S	.	.	H	α-helix	trans	-62.8	-35.8	176.6	-177.1	-95.6	0	0	0	111.7	T178 K198 I201 I203 A218 V219 D220 R244	T178-F222 HydrophobicContact CG2-CE1 4.44Å; K198-F222 HydrophobicContact CB-CZ 4.2Å; K198-F222 HydrophobicContact CG-CZ 4.28Å; I201-F222 HydrophobicContact CB-CE1 4.43Å; I201-F222 HydrophobicContact CG1-CE1 4.24Å; I201-F222 HydrophobicContact CG2-CD1 4.05Å; I201-F222 HydrophobicContact CG2-CE1 4.11Å; I201-F222 HydrophobicContact CG2-CG 4.45Å; I203-F222 HydrophobicContact CG2-CB 4.35Å; A218-F222 PolarHBondContact O-N 3.21Å; A218-F222 VanDerWaalsContact O-N 3.12Å; V219-F222 WeakPolarHBondContact O-CB 3.4Å; V219-F222 PolarHBondContact O-N 3.43Å; V219-F222 VanDerWaalsContact O-N 3.11Å; D220-F222 VanDerWaalsContact C-N 3.34Å; D220-F222 PolarHBondContact O-N 3.19Å; F222-R244 WeakPolarHBondContact O-CD 3.44Å; F222-R244 PolarHBondContact O-NE 3.04Å; F222-R244 VanDerWaalsContact O-NE 3.12Å
223	F	93.3	Very high	92.3	Very high	5 Å²	5	56.8 Å²	56.8	2%	0.022	31%	0.31	C	S	.	.	H	α-helix	trans	-91.8	-23.1	-176.7	-79.4	-83.6	0	0	0	114.8	T178 I201 V219 D220 E221 Q243 R244 F246 L275 C276	T178-F223 HydrophobicContact CG2-CE1 3.87Å; T178-F223 HydrophobicContact CG2-CZ 3.99Å; I201-F223 HydrophobicContact CD1-CE2 4.05Å; I201-F223 HydrophobicContact CD1-CZ 3.91Å; I201-F223 HydrophobicContact CG2-CE2 4.44Å; V219-F223 HydrophobicContact CG1-CD2 4.15Å; V219-F223 HydrophobicContact CG1-CE2 4.43Å; V219-F223 WeakPolarHBondContact O-CD2 3.23Å; V219-F223 PolarHBondContact O-N 3.01Å; V219-F223 VanDerWaalsContact O-N 3.14Å; D220-F223 PolarHBondContact O-N 3.38Å; D220-F223 VanDerWaalsContact O-N 3.16Å; E221-F223 PolarHBondContact O-N 3.36Å; F223-Q243 PolarHBondContact O-NE2 2.86Å; F223-Q243 PolarHBondContact O-OE1 3.32Å; F223-R244 HydrophobicContact CD1-CB 3.93Å; F223-R244 HydrophobicContact CD1-CG 3.91Å; F223-R244 WeakPolarHBondContact CD1-O 3.44Å; F223-R244 HydrophobicContact CE1-CG 4.12Å; F223-R244 PolarHBondContact O-N 3.14Å; F223-F246 HydrophobicContact CE1-CE1 4.44Å; F223-F246 HydrophobicContact CE1-CE2 4.17Å; F223-F246 HydrophobicContact CE1-CZ 4.08Å; F223-F246 AromaticContact CZ-CE1 4Å; F223-F246 HydrophobicContact CZ-CE1 4Å; F223-F246 HydrophobicContact CZ-CE2 4.1Å; F223-F246 AromaticContact CZ-CZ 3.6Å; F223-F246 HydrophobicContact CZ-CZ 3.6Å; F223-L275 HydrophobicContact CD2-CD2 3.91Å; F223-L275 HydrophobicContact CE2-CD2 3.41Å; F223-L275 VanDerWaalsContact CE2-CD2 3.41Å; F223-L275 HydrophobicContact CZ-CD2 4.09Å; F223-C276 WeakPolarHBondContact CD1-SG 3.3Å; F223-C276 WeakPolarHBondContact CE1-SG 3.18Å
224	S	92.4	Very high	92.5	Very high	39 Å²	39	59.6 Å²	59.6	27%	0.273	35%	0.345	S	S	.	.	S	Bend	trans	-67.5	155.9	-171	74.4	0	0	0	0	113.5	Q180 D220 E221	Q180-S224 PolarHBondContact NE2-O 2.81Å; Q180-S224 VanDerWaalsContact NE2-O 3.1Å; D220-S224 VanDerWaalsContact O-CB 3.27Å; D220-S224 WeakPolarHBondContact O-CB 3.42Å; D220-S224 PolarHBondContact O-N 2.98Å; E221-S224 PolarHBondContact O-OG 3.33Å
225	P	95.2	Very high	92.8	Very high	75 Å²	75	60.3 Å²	60.3	49%	0.487	35%	0.349	S	S	.	.			trans	-62.4	150.9	162	-12.9	31.2	0	0	0	109.1	F241 Q243	P225-F241 WeakPolarHBondContact CA-O 3.27Å; P225-F241 VanDerWaalsContact CB-O 3.29Å; P225-F241 WeakPolarHBondContact CB-O 3.39Å; P225-Q243 VanDerWaalsContact CD-OE1 3.29Å; P225-Q243 HydrophobicContact CG-CB 4.36Å
226	K	94.6	Very high	93	Very high	70 Å²	70	66.7 Å²	66.7	30%	0.304	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	154.3	177.6	54.9	-169.9	168.1	-161.5	0	112.3	L228 F241	K226-L228 HydrophobicContact CD-CD1 4.08Å; K226-L228 HydrophobicContact CD-CG 4.49Å; K226-L228 HydrophobicContact CG-CD1 4.38Å; K226-L228 HydrophobicContact CG-CG 4.41Å; K226-F241 HydrophobicContact CG-CB 3.78Å; K226-F241 HydrophobicContact CG-CD2 3.86Å; K226-F241 HydrophobicContact CG-CG 3.95Å; K226-F241 PolarHBondContact N-O 2.92Å; K226-F241 WeakPolarHBondContact O-CB 3.43Å; K226-F241 WeakPolarHBondContact O-CD2 3.16Å; K226-F241 PolarHBondContact O-N 3.33Å
227	L	96	Very high	93.2	Very high	103 Å²	103	65.5 Å²	65.5	54%	0.539	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	115.7	177	-171.9	67.3	0	0	0	108.1	L238 R239 E240	L227-L238 HydrophobicContact CD1-CB 3.91Å; L227-L238 HydrophobicContact CD2-CD1 4.19Å; L227-L238 HydrophobicContact CG-CB 4.34Å; L227-R239 WeakPolarHBondContact CA-O 3.48Å; L227-E240 HydrophobicContact CD1-CB 3.91Å; L227-E240 HydrophobicContact CD1-CG 4.49Å
228	L	95.3	Very high	93.6	Very high	85 Å²	85	67.2 Å²	67.2	45%	0.445	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	162.9	-177.3	-59	176.8	0	0	0	110.3	K226 L238 R239 F241	K226-L228 HydrophobicContact CD-CD1 4.08Å; K226-L228 HydrophobicContact CD-CG 4.49Å; K226-L228 HydrophobicContact CG-CD1 4.38Å; K226-L228 HydrophobicContact CG-CG 4.41Å; L228-L238 CarbonylContact O-C 3.47Å; L228-R239 PolarHBondContact N-O 3.35Å; L228-R239 PolarHBondContact O-N 3.23Å; L228-F241 HydrophobicContact CB-CE2 4.21Å; L228-F241 HydrophobicContact CD1-CD2 4.46Å; L228-F241 HydrophobicContact CD1-CE2 3.92Å; L228-F241 HydrophobicContact CG-CE2 4.24Å
229	L	96.1	Very high	93.9	Very high	136 Å²	136	67 Å²	67	71%	0.712	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	139.1	167.1	-72.3	165.7	0	0	0	109.8	S231 L238	L229-S231 PolarHBondContact O-N 3.48Å; L229-L238 HydrophobicContact CD2-CD2 3.99Å
230	C	95	Very high	94.1	Very high	11 Å²	11	72.9 Å²	72.9	7%	0.074	41%	0.411	C	S	.	.			trans	-65.1	127.6	177.1	-170.1	0	0	0	0	110.1	E232 C235 G237 R239	C230-E232 VanDerWaalsContact C-N 3.29Å; C230-E232 PolarHBondContact O-N 3.42Å; C230-C235 HydrophobicContact CB-CB 4.17Å; C230-C235 VanDerWaalsContact SG-SG 3.63Å; C230-G237 WeakPolarHBondContact CB-O 3.5Å; C230-G237 PolarHBondContact N-O 2.97Å; C230-R239 PolarHBondContact SG-NH2 3.45Å
231	S	93.9	Very high	94.4	Very high	106 Å²	106	70.2 Å²	70.2	74%	0.741	40%	0.395	S	S	*	.			trans	-84.4	-0.7	178.9	58.2	0	0	0	0	114	L229	L229-S231 PolarHBondContact O-N 3.48Å
232	E	94.2	Very high	94.7	Very high	47 Å²	47	66.6 Å²	66.6	22%	0.22	38%	0.384	C	S	.	.	S	Bend	trans	-69.9	133.9	179.1	-63.8	-64.1	135.5	0	0	110.2	S191 Q194 C230 G234 C235	S191-E232 VanDerWaalsContact CB-CD 3.42Å; S191-E232 WeakPolarHBondContact CB-OE2 3.31Å; S191-E232 PolarHBondContact OG-OE2 2.94Å; Q194-E232 PolarHBondContact NE2-OE1 3.3Å; C230-E232 VanDerWaalsContact C-N 3.29Å; C230-E232 PolarHBondContact O-N 3.42Å; E232-G234 PolarHBondContact O-N 3.21Å; E232-C235 HydrophobicContact CB-CB 3.89Å; E232-C235 VanDerWaalsContact O-CB 3.27Å; E232-C235 WeakPolarHBondContact O-CB 3.37Å; E232-C235 PolarHBondContact O-N 3.43Å
233	L	92.1	Very high	94.8	Very high	177 Å²	177	69.5 Å²	69.5	93%	0.927	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	126.4	-177.3	-171.4	72.9	0	0	0	110.8	C235	L233-C235 PolarHBondContact O-N 3.16Å
234	G	90.8	Very high	94.9	Very high	83 Å²	83	69.7 Å²	69.7	86%	0.856	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	7.7	-179.2	0	0	0	0	0	114.6	E232	E232-G234 PolarHBondContact O-N 3.21Å
235	C	94.1	Very high	95	Very high	19 Å²	19	71.3 Å²	71.3	13%	0.128	41%	0.406	C	S	.	.			trans	-99.5	130	172.7	-166.4	0	0	0	0	110.6	C230 E232 L233	C230-C235 HydrophobicContact CB-CB 4.17Å; C230-C235 VanDerWaalsContact SG-SG 3.63Å; E232-C235 HydrophobicContact CB-CB 3.89Å; E232-C235 VanDerWaalsContact O-CB 3.27Å; E232-C235 WeakPolarHBondContact O-CB 3.37Å; E232-C235 PolarHBondContact O-N 3.43Å; L233-C235 PolarHBondContact O-N 3.16Å
236	D	92.9	Very high	94.9	Very high	134 Å²	134	68.7 Å²	68.7	72%	0.717	39%	0.387	S	S	*	.			trans	-108.2	4.5	176.3	61.1	-14.4	0	0	0	112.6	N186	N186-D236 PolarHBondContact ND2-OD1 3.1Å
237	G	94.4	Very high	94.9	Very high	6 Å²	6	67.6 Å²	67.6	6%	0.062	39%	0.388	C	S	.	.			trans	-69.4	162.9	-179	0	0	0	0	0	113.1	C230	C230-G237 WeakPolarHBondContact CB-O 3.5Å; C230-G237 PolarHBondContact N-O 2.97Å
238	L	97.4	Very high	94.6	Very high	74 Å²	74	68.3 Å²	68.3	39%	0.387	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	140	167.7	-64.8	171.5	0	0	0	108.9	C184 T185 L227 L228 L229	C184-L238 CarbonylContact C-O 3.51Å; C184-L238 WeakPolarHBondContact CA-O 3.17Å; T185-L238 HydrophobicContact CG2-CB 4.23Å; T185-L238 WeakPolarHBondContact CG2-O 3.45Å; T185-L238 PolarHBondContact N-O 2.85Å; T185-L238 PolarHBondContact OG1-N 3.33Å; T185-L238 PolarHBondContact OG1-O 3.47Å; L227-L238 HydrophobicContact CD1-CB 3.91Å; L227-L238 HydrophobicContact CD2-CD1 4.19Å; L227-L238 HydrophobicContact CG-CB 4.34Å; L228-L238 CarbonylContact O-C 3.47Å; L229-L238 HydrophobicContact CD2-CD2 3.99Å
239	R	96.9	Very high	94.4	Very high	3 Å²	3	65.8 Å²	65.8	1%	0.011	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	114.8	176.4	-178.5	173.3	-68.7	-74.8	-3.5	109.4	S182 L183 S191 R192 L227 L228 C230 F241	S182-R239 PolarHBondContact OG-NH1 3.31Å; L183-R239 WeakPolarHBondContact O-CA 3.27Å; S191-R239 PolarHBondContact O-NH1 2.9Å; S191-R239 PolarHBondContact O-NH2 3.24Å; R192-R239 PolarHBondContact O-NH1 2.95Å; L227-R239 WeakPolarHBondContact CA-O 3.48Å; L228-R239 PolarHBondContact N-O 3.35Å; L228-R239 PolarHBondContact O-N 3.23Å; C230-R239 PolarHBondContact SG-NH2 3.45Å; R239-F241 HydrophobicContact CB-CE2 4.13Å; R239-F241 VanDerWaalsContact CD-CZ 3.48Å; R239-F241 HydrophobicContact CG-CD2 4.15Å; R239-F241 HydrophobicContact CG-CE2 3.59Å; R239-F241 HydrophobicContact CG-CZ 3.91Å
240	E	97.4	Very high	94.2	Very high	123 Å²	123	61.1 Å²	61.1	58%	0.575	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	127.7	175.3	-173	177.7	-174.6	0	0	109.2	S182 L183 L227	S182-E240 CarbonylContact C-O 3.6Å; S182-E240 WeakPolarHBondContact CA-O 3.2Å; S182-E240 VanDerWaalsContact CB-O 3.31Å; S182-E240 WeakPolarHBondContact CB-O 3.46Å; L183-E240 PolarHBondContact N-O 3.04Å; L183-E240 PolarHBondContact O-N 3.33Å; L227-E240 HydrophobicContact CD1-CB 3.91Å; L227-E240 HydrophobicContact CD1-CG 4.49Å
241	F	97.3	Very high	94.1	Very high	26 Å²	26	60.9 Å²	60.9	11%	0.114	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	133.1	175.7	-68	-100.3	0	0	0	109.3	Q180 E181 V196 P225 K226 L228 R239	Q180-F241 HydrophobicContact CG-CB 4.22Å; Q180-F241 HydrophobicContact CG-CD1 4.25Å; E181-F241 WeakPolarHBondContact O-CA 3.42Å; V196-F241 HydrophobicContact CG2-CE1 4.38Å; P225-F241 WeakPolarHBondContact CA-O 3.27Å; P225-F241 VanDerWaalsContact CB-O 3.29Å; P225-F241 WeakPolarHBondContact CB-O 3.39Å; K226-F241 HydrophobicContact CG-CB 3.78Å; K226-F241 HydrophobicContact CG-CD2 3.86Å; K226-F241 HydrophobicContact CG-CG 3.95Å; K226-F241 PolarHBondContact N-O 2.92Å; K226-F241 WeakPolarHBondContact O-CB 3.43Å; K226-F241 WeakPolarHBondContact O-CD2 3.16Å; K226-F241 PolarHBondContact O-N 3.33Å; L228-F241 HydrophobicContact CB-CE2 4.21Å; L228-F241 HydrophobicContact CD1-CD2 4.46Å; L228-F241 HydrophobicContact CD1-CE2 3.92Å; L228-F241 HydrophobicContact CG-CE2 4.24Å; R239-F241 HydrophobicContact CB-CE2 4.13Å; R239-F241 VanDerWaalsContact CD-CZ 3.48Å; R239-F241 HydrophobicContact CG-CD2 4.15Å; R239-F241 HydrophobicContact CG-CE2 3.59Å; R239-F241 HydrophobicContact CG-CZ 3.91Å
242	S	96.6	Very high	94	Very high	49 Å²	49	55.9 Å²	55.9	34%	0.343	32%	0.324	S	S	.	.			trans	-72	174.3	174.2	65.9	0	0	0	0	112	Q180 E181 R244	Q180-S242 VanDerWaalsContact CG-O 3.27Å; Q180-S242 WeakPolarHBondContact CG-O 3.5Å; Q180-S242 PolarHBondContact NE2-O 3.34Å; E181-S242 PolarHBondContact N-OG 3.47Å; E181-S242 PolarHBondContact O-N 3.17Å; E181-S242 PolarHBondContact O-OG 3.34Å; S242-R244 PolarHBondContact O-N 2.97Å
243	Q	94.8	Very high	94	Very high	89 Å²	89	53.8 Å²	53.8	42%	0.416	31%	0.314	S	S	.	.			trans	-57.4	130	166.7	-178.7	69.4	30.7	0	0	109.4	F223 P225	F223-Q243 PolarHBondContact O-NE2 2.86Å; F223-Q243 PolarHBondContact O-OE1 3.32Å; P225-Q243 VanDerWaalsContact CD-OE1 3.29Å; P225-Q243 HydrophobicContact CG-CB 4.36Å
244	R	95.4	Very high	94	Very high	9 Å²	9	45.3 Å²	45.3	3%	0.034	27%	0.27	C	S	.	.			trans	-72.6	142.4	173.1	178.8	177.2	-68.5	-74.2	-9.9	109.9	T178 T179 Q180 F222 F223 S242	T178-R244 HydrophobicContact CG2-CG 4.27Å; T178-R244 WeakPolarHBondContact OG1-CD 3.47Å; T178-R244 PolarHBondContact OG1-NH1 2.6Å; T179-R244 WeakPolarHBondContact O-CA 3.41Å; Q180-R244 HydrophobicContact CB-CB 4.12Å; Q180-R244 HydrophobicContact CB-CG 4.33Å; Q180-R244 HydrophobicContact CG-CB 4.24Å; F222-R244 WeakPolarHBondContact O-CD 3.44Å; F222-R244 PolarHBondContact O-NE 3.04Å; F222-R244 VanDerWaalsContact O-NE 3.12Å; F223-R244 HydrophobicContact CD1-CB 3.93Å; F223-R244 HydrophobicContact CD1-CG 3.91Å; F223-R244 WeakPolarHBondContact CD1-O 3.44Å; F223-R244 HydrophobicContact CE1-CG 4.12Å; F223-R244 PolarHBondContact O-N 3.14Å; S242-R244 PolarHBondContact O-N 2.97Å
245	V	94.4	Very high	94	Very high	72 Å²	72	41.5 Å²	41.5	44%	0.436	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	154.7	-179.4	-60.9	0	0	0	0	111.4	T178 T179	T178-V245 CarbonylContact C-O 3.56Å; T178-V245 WeakPolarHBondContact CA-O 3.25Å; T178-V245 WeakPolarHBondContact CB-O 3.34Å; T179-V245 HydrophobicContact CG2-CG2 3.78Å; T179-V245 PolarHBondContact N-O 3.24Å; T179-V245 PolarHBondContact O-N 3.38Å
246	F	94.2	Very high	93.9	Very high	20 Å²	20	40.6 Å²	40.6	9%	0.088	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	140.5	172.8	-68.5	-72.7	0	0	0	111.5	T178 I201 F223 H248 G249 P251 V254 C276	T178-F246 HydrophobicContact CG2-CD1 3.61Å; T178-F246 HydrophobicContact CG2-CE1 3.84Å; T178-F246 HydrophobicContact CG2-CG 4.36Å; I201-F246 HydrophobicContact CD1-CE1 3.92Å; I201-F246 HydrophobicContact CD1-CZ 4.08Å; F223-F246 HydrophobicContact CE1-CE1 4.44Å; F223-F246 HydrophobicContact CE1-CE2 4.17Å; F223-F246 HydrophobicContact CE1-CZ 4.08Å; F223-F246 AromaticContact CZ-CE1 4Å; F223-F246 HydrophobicContact CZ-CE1 4Å; F223-F246 HydrophobicContact CZ-CE2 4.1Å; F223-F246 AromaticContact CZ-CZ 3.6Å; F223-F246 HydrophobicContact CZ-CZ 3.6Å; F246-H248 VanDerWaalsContact C-N 3.31Å; F246-H248 PolarHBondContact O-N 2.84Å; F246-G249 WeakPolarHBondContact CB-O 3.37Å; F246-P251 HydrophobicContact CD1-CG 4.25Å; F246-P251 HydrophobicContact CE1-CG 3.92Å; F246-P251 HydrophobicContact CZ-CG 4.18Å; F246-V254 HydrophobicContact CZ-CG2 4.32Å; F246-C276 HydrophobicContact CE2-CB 4.38Å
247	C	93.3	Very high	93.6	Very high	47 Å²	47	35.1 Å²	35.1	32%	0.318	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-28.9	-177.7	-61.9	0	0	0	0	113.2	S177 T178	S177-C247 PolarHBondContact O-N 3.27Å; S177-C247 PolarHBondContact O-SG 3.17Å; S177-C247 WeakPolarHBondContact OG-CB 3.48Å; S177-C247 PolarHBondContact OG-SG 3.36Å; T178-C247 VanDerWaalsContact C-SG 3.59Å
248	H	91.2	Very high	93.2	Very high	118 Å²	118	34.9 Å²	34.9	55%	0.546	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.8	22.1	-172.2	-58.2	-66.3	0	0	0	112.6	F112 N174 F246	F112-H248 HydrophobicContact CE1-CB 4.42Å; F112-H248 AromaticContact CE1-CD2 3.71Å; F112-H248 HydrophobicContact CZ-CB 3.9Å; N174-H248 PolarHBondContact O-CD2 3.36Å; F246-H248 VanDerWaalsContact C-N 3.31Å; F246-H248 PolarHBondContact O-N 2.84Å
249	G	90.8	Very high	92.4	Very high	33 Å²	33	37.6 Å²	37.6	34%	0.34	20%	0.202	S	C	.	.	S	Bend	trans	81.6	175	-168.3	0	0	0	0	0	112.5	F246	F246-G249 WeakPolarHBondContact CB-O 3.37Å
250	P	91.4	Very high	91.6	Very high	38 Å²	38	43.3 Å²	43.3	25%	0.247	23%	0.229	C	C	.	.	S	Bend	trans	-59.1	123.8	179.1	28.1	-36.7	0	0	0	109.4	Y280 R335	P250-Y280 WeakPolarHBondContact CB-OH 3.38Å; P250-R335 PolarHBondContact O-NH1 3.38Å
251	P	92.8	Very high	90.9	Very high	6 Å²	6	38 Å²	38	4%	0.039	20%	0.204	C	C	.	.			trans	-71.4	158.1	-177.4	29.6	-36.7	0	0	0	112	L175 F246 F253 V254 Y280	L175-P251 HydrophobicContact CD1-CB 3.9Å; L175-P251 HydrophobicContact CG-CB 4.01Å; F246-P251 HydrophobicContact CD1-CG 4.25Å; F246-P251 HydrophobicContact CE1-CG 3.92Å; F246-P251 HydrophobicContact CZ-CG 4.18Å; P251-F253 WeakPolarHBondContact CB-O 3.42Å; P251-F253 PolarHBondContact O-N 3.36Å; P251-V254 HydrophobicContact CG-CG2 3.52Å; P251-Y280 WeakPolarHBondContact CD-OH 3.41Å; P251-Y280 VanDerWaalsContact O-CE1 3.29Å; P251-Y280 WeakPolarHBondContact O-CE1 3.44Å; P251-Y280 PolarHBondContact O-OH 2.73Å
252	A	92.6	Very high	89.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	-56.4	-36.7	176.6	0	0	0	0	0	112.9	F105 R335	F105-A252 HydrophobicContact CB-CB 4.16Å; F105-A252 HydrophobicContact CD1-CB 3.51Å; F105-A252 HydrophobicContact CD2-CB 3.94Å; F105-A252 HydrophobicContact CE1-CB 3.79Å; F105-A252 HydrophobicContact CE2-CB 4.22Å; F105-A252 HydrophobicContact CG-CB 3.6Å; F105-A252 HydrophobicContact CZ-CB 4.15Å; A252-R335 WeakPolarHBondContact O-CB 3.27Å; A252-R335 PolarHBondContact O-N 3.47Å
253	F	92.9	Very high	88.5	Confident	3 Å²	3	44.3 Å²	44.3	1%	0.013	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	159.7	171.7	62.5	-97.1	0	0	0	110.1	L95 I98 L109 L172 L175 P251 I255 V332 Y333 I334	L95-F253 HydrophobicContact CD1-CE1 4.41Å; L95-F253 HydrophobicContact CD1-CZ 4.48Å; I98-F253 HydrophobicContact CD1-CD1 4.2Å; I98-F253 HydrophobicContact CD1-CG 4.24Å; I98-F253 HydrophobicContact CG2-CD1 3.89Å; I98-F253 HydrophobicContact CG2-CE1 4.35Å; L109-F253 HydrophobicContact CD1-CD1 4.32Å; L109-F253 HydrophobicContact CD1-CE1 3.73Å; L109-F253 HydrophobicContact CD2-CD1 4.37Å; L109-F253 HydrophobicContact CD2-CE1 3.46Å; L109-F253 VanDerWaalsContact CD2-CE1 3.46Å; L109-F253 HydrophobicContact CD2-CZ 3.97Å; L109-F253 HydrophobicContact CG-CE1 4.18Å; L172-F253 HydrophobicContact CD1-CE2 3.73Å; L172-F253 HydrophobicContact CD1-CZ 3.91Å; L175-F253 HydrophobicContact CD2-CD1 4.49Å; L175-F253 HydrophobicContact CD2-CD2 4.35Å; L175-F253 HydrophobicContact CD2-CE1 3.97Å; L175-F253 HydrophobicContact CD2-CE2 3.77Å; L175-F253 HydrophobicContact CD2-CZ 3.56Å; P251-F253 WeakPolarHBondContact CB-O 3.42Å; P251-F253 PolarHBondContact O-N 3.36Å; F253-I255 HydrophobicContact CD2-CD1 4.1Å; F253-I255 HydrophobicContact CD2-CG1 4.05Å; F253-I255 HydrophobicContact CE2-CD1 3.65Å; F253-I255 HydrophobicContact CE2-CG1 4.13Å; F253-V332 HydrophobicContact CD2-CG1 4.34Å; F253-Y333 CarbonylContact C-O 3.43Å; F253-Y333 WeakPolarHBondContact CA-O 3.17Å; F253-Y333 VanDerWaalsContact CB-O 3.31Å; F253-Y333 WeakPolarHBondContact CB-O 3.16Å; F253-I334 HydrophobicContact CB-CG1 4.22Å
254	V	92.6	Very high	87.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	140.7	177	171.3	0	0	0	0	108.6	M176 I201 F246 P251 L256 L275 Y280 Y333	M176-V254 HydrophobicContact SD-CG1 4.36Å; I201-V254 HydrophobicContact CD1-CG1 3.54Å; I201-V254 HydrophobicContact CD1-CG2 4.37Å; F246-V254 HydrophobicContact CZ-CG2 4.32Å; P251-V254 HydrophobicContact CG-CG2 3.52Å; V254-L256 HydrophobicContact CG1-CD2 4.04Å; V254-L275 HydrophobicContact CB-CD1 4.04Å; V254-L275 HydrophobicContact CG1-CD1 4.03Å; V254-L275 HydrophobicContact CG2-CD1 3.78Å; V254-Y280 HydrophobicContact CB-CD1 4.49Å; V254-Y280 HydrophobicContact CB-CE1 4.44Å; V254-Y280 HydrophobicContact CG2-CD1 4.26Å; V254-Y280 HydrophobicContact CG2-CE1 3.78Å; V254-Y333 PolarHBondContact N-O 2.88Å; V254-Y333 PolarHBondContact O-N 3.2Å
255	I	91.6	Very high	86.1	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	128.8	176.2	-57.6	152.9	0	0	0	108.9	F168 L172 M176 F253 L331 V332	F168-I255 HydrophobicContact CB-CD1 4.05Å; F168-I255 HydrophobicContact CB-CG2 3.97Å; F168-I255 HydrophobicContact CD1-CD1 3.56Å; F168-I255 HydrophobicContact CD1-CG1 4.01Å; F168-I255 HydrophobicContact CD1-CG2 3.94Å; F168-I255 HydrophobicContact CG-CD1 4.24Å; F168-I255 HydrophobicContact CG-CG2 4.36Å; F168-I255 WeakPolarHBondContact O-CD1 3.49Å; L172-I255 HydrophobicContact CD1-CD1 3.53Å; M176-I255 HydrophobicContact CE-CB 4.2Å; M176-I255 HydrophobicContact CE-CD1 4.3Å; M176-I255 HydrophobicContact SD-CB 4.09Å; M176-I255 HydrophobicContact SD-CG1 4.48Å; M176-I255 PolarHBondContact SD-N 2.84Å; F253-I255 HydrophobicContact CD2-CD1 4.1Å; F253-I255 HydrophobicContact CD2-CG1 4.05Å; F253-I255 HydrophobicContact CE2-CD1 3.65Å; F253-I255 HydrophobicContact CE2-CG1 4.13Å; I255-L331 CarbonylContact C-O 3.32Å; I255-L331 VanDerWaalsContact CA-O 3.28Å; I255-L331 WeakPolarHBondContact CA-O 3.49Å; I255-V332 HydrophobicContact CG1-CG1 4.18Å; I255-V332 HydrophobicContact CG1-CG2 4.22Å
256	L	90.2	Very high	85.2	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	124.6	172.9	-53.6	-178.3	0	0	0	108.7	I201 I203 I215 V219 V254 M258 L273 S330 L331 Y333	I201-L256 HydrophobicContact CG2-CD2 4.11Å; I203-L256 HydrophobicContact CD1-CB 4.24Å; I203-L256 HydrophobicContact CD1-CD1 3.79Å; I203-L256 HydrophobicContact CD1-CD2 4.12Å; I203-L256 HydrophobicContact CD1-CG 4.27Å; I215-L256 HydrophobicContact CG2-CD1 3.7Å; V219-L256 HydrophobicContact CG2-CD1 4.32Å; V219-L256 HydrophobicContact CG2-CD2 4.24Å; V254-L256 HydrophobicContact CG1-CD2 4.04Å; L256-M258 HydrophobicContact CB-SD 3.98Å; L256-M258 PolarHBondContact O-N 3.17Å; L256-L273 HydrophobicContact CD1-CD2 3.94Å; L256-L273 HydrophobicContact CD2-CD2 4.5Å; L256-S330 WeakPolarHBondContact O-CA 2.91Å; L256-L331 HydrophobicContact CB-CB 4.39Å; L256-L331 PolarHBondContact N-O 2.86Å; L256-L331 PolarHBondContact O-N 2.88Å; L256-Y333 HydrophobicContact CD1-CD2 4.06Å; L256-Y333 HydrophobicContact CD1-CE2 3.62Å; L256-Y333 HydrophobicContact CG-CD2 4.21Å; L256-Y333 HydrophobicContact CG-CE2 4.19Å
257	N	86.8	Confident	84	Confident	20 Å²	20	50.8 Å²	50.8	11%	0.107	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	118.8	172	178.8	13.4	0	0	0	109.6	H165 Q259	H165-N257 VanDerWaalsContact CE1-CG 3.5Å; H165-N257 PolarHBondContact CE1-ND2 2.94Å; H165-N257 PolarHBondContact ND1-ND2 2.79Å; N257-Q259 VanDerWaalsContact OD1-CB 3.27Å; N257-Q259 WeakPolarHBondContact OD1-CB 3.01Å; N257-Q259 PolarHBondContact OD1-N 2.96Å
258	M	86.5	Confident	83.3	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.271	C	S	.	.			trans	-104.6	1	-178.2	-56.8	-49.4	-68.8	0	0	113.1	I215 L256 Q260 W261 L266 L328 S329 L331	I215-M258 HydrophobicContact CD1-CE 3.83Å; I215-M258 HydrophobicContact CG1-CE 4.17Å; L256-M258 HydrophobicContact CB-SD 3.98Å; L256-M258 PolarHBondContact O-N 3.17Å; M258-Q260 PolarHBondContact O-N 3.31Å; M258-W261 HydrophobicContact CE-CB 3.81Å; M258-W261 HydrophobicContact CE-CD2 3.64Å; M258-W261 HydrophobicContact CE-CE3 4.15Å; M258-W261 HydrophobicContact CE-CG 3.48Å; M258-W261 VanDerWaalsContact CE-CG 3.48Å; M258-W261 WeakPolarHBondContact O-CA 3.18Å; M258-W261 WeakPolarHBondContact O-CB 2.96Å; M258-W261 PolarHBondContact O-N 3.16Å; M258-W261 HydrophobicContact SD-CG 4.33Å; M258-L266 HydrophobicContact CE-CD1 3.72Å; M258-L328 CarbonylContact C-O 3.45Å; M258-L328 HydrophobicContact CB-CB 3.81Å; M258-L328 VanDerWaalsContact CB-O 3.25Å; M258-L328 WeakPolarHBondContact CB-O 3.4Å; M258-L328 HydrophobicContact CG-CB 4.2Å; M258-S329 WeakPolarHBondContact CA-O 3.46Å; M258-S329 WeakPolarHBondContact CB-O 3.31Å; M258-S329 PolarHBondContact N-O 2.83Å; M258-L331 HydrophobicContact CE-CD1 4.01Å; M258-L331 HydrophobicContact CG-CB 4.38Å; M258-L331 HydrophobicContact CG-CD1 3.86Å; M258-L331 HydrophobicContact CG-CG 3.67Å; M258-L331 HydrophobicContact SD-CD1 3.77Å; M258-L331 HydrophobicContact SD-CG 4.21Å
259	Q	80.1	Confident	83	Confident	131 Å²	131	50.6 Å²	50.6	61%	0.612	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-27	-176.5	-168.7	179.6	-1.8	0	0	114.2	N257 S329	N257-Q259 VanDerWaalsContact OD1-CB 3.27Å; N257-Q259 WeakPolarHBondContact OD1-CB 3.01Å; N257-Q259 PolarHBondContact OD1-N 2.96Å; Q259-S329 PolarHBondContact N-O 3.21Å
260	Q	80.4	Confident	82.9	Confident	123 Å²	123	49.3 Å²	49.3	58%	0.575	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-10.6	176	-65.7	-174.9	-7.5	0	0	113.6	S204 M258	S204-Q260 PolarHBondContact OG-OE1 3.05Å; M258-Q260 PolarHBondContact O-N 3.31Å
261	W	82.8	Confident	82.7	Confident	12 Å²	12	51.7 Å²	51.7	5%	0.045	25%	0.249	C	C	.	.	S	Bend	trans	-92	124.5	-177.4	-65.3	71.7	0	0	0	109	I203 S204 P205 P214 I215 A218 M258 L266	I203-W261 HydrophobicContact CB-CZ2 4.16Å; I203-W261 HydrophobicContact CD1-CZ2 3.76Å; I203-W261 HydrophobicContact CG1-CZ2 3.84Å; I203-W261 PolarHBondContact O-NE1 2.8Å; S204-W261 VanDerWaalsContact C-CZ2 3.44Å; S204-W261 WeakPolarHBondContact O-CZ2 3.44Å; P205-W261 HydrophobicContact CB-CD2 4.03Å; P205-W261 HydrophobicContact CB-CE3 3.88Å; P205-W261 HydrophobicContact CB-CZ3 4.17Å; P214-W261 HydrophobicContact CB-CZ3 4.2Å; I215-W261 HydrophobicContact CG1-CE3 4.5Å; I215-W261 HydrophobicContact CG1-CH2 4.16Å; I215-W261 HydrophobicContact CG1-CZ3 4.03Å; A218-W261 HydrophobicContact CB-CH2 3.79Å; A218-W261 HydrophobicContact CB-CZ2 3.87Å; M258-W261 HydrophobicContact CE-CB 3.81Å; M258-W261 HydrophobicContact CE-CD2 3.64Å; M258-W261 HydrophobicContact CE-CE3 4.15Å; M258-W261 HydrophobicContact CE-CG 3.48Å; M258-W261 VanDerWaalsContact CE-CG 3.48Å; M258-W261 WeakPolarHBondContact O-CA 3.18Å; M258-W261 WeakPolarHBondContact O-CB 2.96Å; M258-W261 PolarHBondContact O-N 3.16Å; M258-W261 HydrophobicContact SD-CG 4.33Å; W261-L266 HydrophobicContact CB-CD1 4.15Å; W261-L266 HydrophobicContact CE3-CD1 4.38Å; W261-L266 HydrophobicContact CE3-CD2 3.55Å; W261-L266 HydrophobicContact CE3-CG 4.06Å; W261-L266 HydrophobicContact CZ3-CD2 3.8Å
262	R	75.6	Confident	82.6	Confident	170 Å²	170	55.1 Å²	55.1	64%	0.642	27%	0.265	S	S	*	.			trans	-82.5	144.3	174.7	-51.9	-179.2	174.1	177	-1.3	109	E264 D265	R262-E264 VanDerWaalsContact CB-OE2 3.31Å; R262-E264 WeakPolarHBondContact CB-OE2 3.49Å; R262-E264 PolarHBondContact O-N 3.33Å; R262-D265 HydrophobicContact CB-CB 4.43Å; R262-D265 VanDerWaalsContact CB-OD2 3.27Å; R262-D265 WeakPolarHBondContact CB-OD2 3.27Å; R262-D265 WeakPolarHBondContact CG-OD2 3.4Å; R262-D265 WeakPolarHBondContact O-CB 3.49Å; R262-D265 PolarHBondContact O-N 2.95Å
263	S	68.3	Low	82.6	Confident	37 Å²	37	55.2 Å²	55.2	26%	0.259	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-56.7	-34	175.8	35.1	0	0	0	0	112	D265 L266	S263-D265 VanDerWaalsContact C-N 3.26Å; S263-D265 PolarHBondContact O-N 3.36Å; S263-L266 PolarHBondContact O-N 2.99Å
264	E	71.4	Confident	82.6	Confident	150 Å²	150	57.6 Å²	57.6	70%	0.701	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-68.9	-24.7	178.1	-56.7	83.6	177.1	0	0	112.8	R262 L266	R262-E264 VanDerWaalsContact CB-OE2 3.31Å; R262-E264 WeakPolarHBondContact CB-OE2 3.49Å; R262-E264 PolarHBondContact O-N 3.33Å; E264-L266 VanDerWaalsContact C-N 3.29Å
265	D	68.9	Low	82.4	Confident	53 Å²	53	57.7 Å²	57.7	28%	0.283	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-82.3	-10.8	178.1	-58.1	-29.9	0	0	0	111.7	L209 R262 S263	L209-D265 WeakPolarHBondContact CD2-O 3.35Å; R262-D265 HydrophobicContact CB-CB 4.43Å; R262-D265 VanDerWaalsContact CB-OD2 3.27Å; R262-D265 WeakPolarHBondContact CB-OD2 3.27Å; R262-D265 WeakPolarHBondContact CG-OD2 3.4Å; R262-D265 WeakPolarHBondContact O-CB 3.49Å; R262-D265 PolarHBondContact O-N 2.95Å; S263-D265 VanDerWaalsContact C-N 3.26Å; S263-D265 PolarHBondContact O-N 3.36Å
266	L	74.6	Confident	82	Confident	19 Å²	19	59.2 Å²	59.2	10%	0.099	30%	0.296	C	S	.	.			trans	-111.3	102.8	-177.6	-70.5	172.8	0	0	0	111	P214 I215 M258 W261 S263 E264 Y268 L328	P214-L266 HydrophobicContact CG-CD2 4.11Å; I215-L266 HydrophobicContact CD1-CD2 3.66Å; I215-L266 HydrophobicContact CG1-CD2 3.75Å; M258-L266 HydrophobicContact CE-CD1 3.72Å; W261-L266 HydrophobicContact CB-CD1 4.15Å; W261-L266 HydrophobicContact CE3-CD1 4.38Å; W261-L266 HydrophobicContact CE3-CD2 3.55Å; W261-L266 HydrophobicContact CE3-CG 4.06Å; W261-L266 HydrophobicContact CZ3-CD2 3.8Å; S263-L266 PolarHBondContact O-N 2.99Å; E264-L266 VanDerWaalsContact C-N 3.29Å; L266-Y268 VanDerWaalsContact C-N 3.28Å; L266-Y268 PolarHBondContact O-N 2.94Å; L266-L328 HydrophobicContact CD1-CD1 3.92Å
267	S	70.3	Confident	81.7	Confident	104 Å²	104	69 Å²	69	73%	0.727	34%	0.342	S	S	*	.	S	Bend	trans	-69.8	-25.7	174.1	55.3	0	0	0	0	113.4
268	Y	78.1	Confident	81.9	Confident	113 Å²	113	71.7 Å²	71.7	44%	0.443	35%	0.354	S	S	.	.			trans	-162.8	166.3	171.4	66.8	-81.4	0	0	0	110.2	D213 L266 P270	D213-Y268 WeakPolarHBondContact CA-OH 3.48Å; D213-Y268 WeakPolarHBondContact CB-OH 3.3Å; D213-Y268 WeakPolarHBondContact OD2-CE2 3.23Å; D213-Y268 PolarHBondContact OD2-OH 3.11Å; L266-Y268 VanDerWaalsContact C-N 3.28Å; L266-Y268 PolarHBondContact O-N 2.94Å; Y268-P270 HydrophobicContact CE2-CB 4.31Å
269	V	84.6	Confident	82.3	Confident	48 Å²	48	78.4 Å²	78.4	29%	0.291	38%	0.379	S	S	.	.			trans	-103.8	125.9	168.5	-177.8	0	0	0	0	108.6	I215 Y271 L282 L328 L331	I215-V269 HydrophobicContact CD1-CG1 4.5Å; V269-Y271 PolarHBondContact O-N 3.42Å; V269-L282 HydrophobicContact CG1-CD2 3.76Å; V269-L328 HydrophobicContact CG2-CD1 3.54Å; V269-L331 HydrophobicContact CG1-CD1 3.61Å; V269-L331 HydrophobicContact CG1-CD2 3.86Å; V269-L331 HydrophobicContact CG1-CG 4.4Å
270	P	87.7	Confident	83	Confident	6 Å²	6	72.1 Å²	72.1	4%	0.039	35%	0.35	C	S	.	.			trans	-66.2	132.3	178.4	18.6	-23.5	0	0	0	111.5	D213 I215 Y268 H272 Y333	D213-P270 WeakPolarHBondContact OD2-CB 3.47Å; D213-P270 WeakPolarHBondContact OD2-CG 3.45Å; I215-P270 HydrophobicContact CB-CG 3.99Å; I215-P270 HydrophobicContact CD1-CG 4.37Å; I215-P270 HydrophobicContact CG2-CG 4.04Å; Y268-P270 HydrophobicContact CE2-CB 4.31Å; P270-H272 WeakPolarHBondContact CB-O 3.24Å; P270-H272 PolarHBondContact O-N 3.41Å; P270-Y333 VanDerWaalsContact O-CE1 3.31Å; P270-Y333 WeakPolarHBondContact O-CE1 3.23Å; P270-Y333 PolarHBondContact O-OH 3.48Å
271	Y	88.1	Confident	83.6	Confident	89 Å²	89	68.1 Å²	68.1	35%	0.349	33%	0.332	S	S	.	.	S	Bend	trans	-72.1	-20.3	170.2	-167.8	-111.7	0	0	0	112.3	V269 L281 L282 Q300	V269-Y271 PolarHBondContact O-N 3.42Å; Y271-L281 WeakPolarHBondContact O-CA 3.34Å; Y271-L282 HydrophobicContact CD2-CB 3.94Å; Y271-L282 HydrophobicContact CE2-CB 4.35Å; Y271-L282 WeakPolarHBondContact CE2-O 3.34Å; Y271-L282 PolarHBondContact O-N 2.81Å; Y271-Q300 VanDerWaalsContact CE2-NE2 3.31Å; Y271-Q300 PolarHBondContact OH-OE1 2.66Å
272	H	91.4	Very high	84.1	Confident	78 Å²	78	68.3 Å²	68.3	36%	0.361	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131.3	-176.8	-58.8	106	0	0	0	110.8	P270 R279 Y280 L281	P270-H272 WeakPolarHBondContact CB-O 3.24Å; P270-H272 PolarHBondContact O-N 3.41Å; H272-R279 PolarHBondContact CD2-NE 2.97Å; H272-R279 PolarHBondContact CD2-NH2 3.09Å; H272-R279 PolarHBondContact CE1-NH2 2.77Å; H272-R279 PolarHBondContact NE2-NH2 2.99Å; H272-Y280 WeakPolarHBondContact CA-O 3.41Å; H272-L281 WeakPolarHBondContact CD2-CD2 3.34Å
273	L	92.6	Very high	84.8	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	125.6	175.9	-166.6	73.9	0	0	0	110	I215 V219 L256 L275 Y280 Y333	I215-L273 HydrophobicContact CG2-CD1 4.07Å; V219-L273 HydrophobicContact CB-CD1 4.44Å; V219-L273 HydrophobicContact CG2-CD1 4.09Å; V219-L273 HydrophobicContact CG2-CD2 4.39Å; L256-L273 HydrophobicContact CD1-CD2 3.94Å; L256-L273 HydrophobicContact CD2-CD2 4.5Å; L273-L275 HydrophobicContact CD2-CD1 3.68Å; L273-L275 HydrophobicContact CD2-CD2 4.43Å; L273-L275 HydrophobicContact CD2-CG 3.93Å; L273-L275 HydrophobicContact CG-CD1 4.35Å; L273-L275 HydrophobicContact CG-CG 4.15Å; L273-Y280 PolarHBondContact N-O 3.19Å; L273-Y280 PolarHBondContact O-N 2.91Å; L273-Y333 HydrophobicContact CB-CD1 3.65Å; L273-Y333 HydrophobicContact CB-CE1 3.75Å; L273-Y333 HydrophobicContact CB-CG 4.2Å; L273-Y333 HydrophobicContact CD2-CD1 4.36Å; L273-Y333 HydrophobicContact CD2-CD2 4.08Å; L273-Y333 HydrophobicContact CD2-CE2 4.34Å; L273-Y333 HydrophobicContact CD2-CG 4.09Å
274	A	92	Very high	86	Confident	53 Å²	53	59.9 Å²	59.9	44%	0.438	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	123.9	172.7	0	0	0	0	0	109.7	Q216 H278	Q216-A274 PolarHBondContact NE2-O 2.93Å; A274-H278 WeakPolarHBondContact CA-O 3.33Å
275	L	89.4	Confident	87	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	113.1	-178.2	-77.8	171.2	0	0	0	109.8	V219 F223 V254 L273 Q277 H278 Y280	V219-L275 HydrophobicContact CG1-CD2 3.18Å; V219-L275 HydrophobicContact CG1-CG 4.15Å; F223-L275 HydrophobicContact CD2-CD2 3.91Å; F223-L275 HydrophobicContact CE2-CD2 3.41Å; F223-L275 VanDerWaalsContact CE2-CD2 3.41Å; F223-L275 HydrophobicContact CZ-CD2 4.09Å; V254-L275 HydrophobicContact CB-CD1 4.04Å; V254-L275 HydrophobicContact CG1-CD1 4.03Å; V254-L275 HydrophobicContact CG2-CD1 3.78Å; L273-L275 HydrophobicContact CD2-CD1 3.68Å; L273-L275 HydrophobicContact CD2-CD2 4.43Å; L273-L275 HydrophobicContact CD2-CG 3.93Å; L273-L275 HydrophobicContact CG-CD1 4.35Å; L273-L275 HydrophobicContact CG-CG 4.15Å; L275-Q277 VanDerWaalsContact C-N 3.33Å; L275-Q277 PolarHBondContact O-N 3.48Å; L275-H278 PolarHBondContact N-O 2.88Å; L275-H278 WeakPolarHBondContact O-CB 3.43Å; L275-H278 PolarHBondContact O-N 3.22Å; L275-Y280 HydrophobicContact CB-CD2 3.88Å; L275-Y280 HydrophobicContact CB-CE2 3.77Å; L275-Y280 HydrophobicContact CD1-CD2 3.77Å; L275-Y280 HydrophobicContact CD1-CE2 3.92Å; L275-Y280 HydrophobicContact CD1-CG 4.15Å; L275-Y280 HydrophobicContact CG-CD2 4.27Å; L275-Y280 HydrophobicContact CG-CE2 4.46Å
276	C	82.1	Confident	88	Confident	34 Å²	34	50.7 Å²	50.7	23%	0.23	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	51.3	176.6	-67.5	0	0	0	0	113.3	F223 F246 H278	F223-C276 WeakPolarHBondContact CD1-SG 3.3Å; F223-C276 WeakPolarHBondContact CE1-SG 3.18Å; F246-C276 HydrophobicContact CE2-CB 4.38Å; C276-H278 PolarHBondContact O-N 2.81Å; C276-H278 PolarHBondContact O-ND1 2.83Å
277	Q	84.4	Confident	88.7	Confident	206 Å²	206	49.9 Å²	49.9	96%	0.963	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	4.7	-177.5	-50.5	173	-9	0	0	115.9	L275	L275-Q277 VanDerWaalsContact C-N 3.33Å; L275-Q277 PolarHBondContact O-N 3.48Å
278	H	90.7	Very high	89.5	Confident	76 Å²	76	46.8 Å²	46.8	35%	0.352	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	146.6	175.1	-60.6	76.3	0	0	0	110.1	A274 L275 C276 Y280	A274-H278 WeakPolarHBondContact CA-O 3.33Å; L275-H278 PolarHBondContact N-O 2.88Å; L275-H278 WeakPolarHBondContact O-CB 3.43Å; L275-H278 PolarHBondContact O-N 3.22Å; C276-H278 PolarHBondContact O-N 2.81Å; C276-H278 PolarHBondContact O-ND1 2.83Å; H278-Y280 HydrophobicContact CB-CD2 4.37Å; H278-Y280 HydrophobicContact CB-CE2 3.8Å
279	R	94.1	Very high	89.8	Confident	141 Å²	141	42.9 Å²	42.9	53%	0.532	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	136.6	174.4	-173.7	179.9	178.9	125.2	-12.2	109.1	H272 A336	H272-R279 PolarHBondContact CD2-NE 2.97Å; H272-R279 PolarHBondContact CD2-NH2 3.09Å; H272-R279 PolarHBondContact CE1-NH2 2.77Å; H272-R279 PolarHBondContact NE2-NH2 2.99Å; R279-A336 HydrophobicContact CB-CB 4.22Å; R279-A336 HydrophobicContact CG-CB 4.38Å; R279-A336 VanDerWaalsContact O-CB 3.27Å; R279-A336 WeakPolarHBondContact O-CB 3.3Å; R279-A336 PolarHBondContact O-N 2.75Å
280	Y	95.1	Very high	89.7	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	147.5	172.8	-68.7	-111.2	0	0	0	110.5	P250 P251 V254 H272 L273 L275 H278 I334 R335	P250-Y280 WeakPolarHBondContact CB-OH 3.38Å; P251-Y280 WeakPolarHBondContact CD-OH 3.41Å; P251-Y280 VanDerWaalsContact O-CE1 3.29Å; P251-Y280 WeakPolarHBondContact O-CE1 3.44Å; P251-Y280 PolarHBondContact O-OH 2.73Å; V254-Y280 HydrophobicContact CB-CD1 4.49Å; V254-Y280 HydrophobicContact CB-CE1 4.44Å; V254-Y280 HydrophobicContact CG2-CD1 4.26Å; V254-Y280 HydrophobicContact CG2-CE1 3.78Å; H272-Y280 WeakPolarHBondContact CA-O 3.41Å; L273-Y280 PolarHBondContact N-O 3.19Å; L273-Y280 PolarHBondContact O-N 2.91Å; L275-Y280 HydrophobicContact CB-CD2 3.88Å; L275-Y280 HydrophobicContact CB-CE2 3.77Å; L275-Y280 HydrophobicContact CD1-CD2 3.77Å; L275-Y280 HydrophobicContact CD1-CE2 3.92Å; L275-Y280 HydrophobicContact CD1-CG 4.15Å; L275-Y280 HydrophobicContact CG-CD2 4.27Å; L275-Y280 HydrophobicContact CG-CE2 4.46Å; H278-Y280 HydrophobicContact CB-CD2 4.37Å; H278-Y280 HydrophobicContact CB-CE2 3.8Å; Y280-I334 CarbonylContact C-O 3.47Å; Y280-I334 WeakPolarHBondContact CA-O 3.41Å; Y280-I334 WeakPolarHBondContact CB-O 3.29Å; Y280-R335 VanDerWaalsContact CD1-CA 3.44Å; Y280-R335 HydrophobicContact CD1-CB 4.01Å; Y280-R335 HydrophobicContact CE1-CB 3.56Å; Y280-R335 HydrophobicContact CE1-CG 4.13Å; Y280-R335 HydrophobicContact CE2-CG 4.37Å
281	L	93.3	Very high	89.6	Confident	39 Å²	39	54.2 Å²	54.2	20%	0.204	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	136.4	-178	-55.8	-178	0	0	0	110.3	Y271 H272 E283 Y333 I334 A336	Y271-L281 WeakPolarHBondContact O-CA 3.34Å; H272-L281 WeakPolarHBondContact CD2-CD2 3.34Å; L281-E283 HydrophobicContact CB-CG 4.15Å; L281-E283 PolarHBondContact O-N 3.35Å; L281-Y333 CarbonylContact O-C 3.56Å; L281-Y333 WeakPolarHBondContact O-CA 3.44Å; L281-I334 PolarHBondContact N-O 3.16Å; L281-I334 PolarHBondContact O-N 3.08Å; L281-A336 HydrophobicContact CD1-CB 4.39Å; L281-A336 HydrophobicContact CD2-CB 4.48Å; L281-A336 HydrophobicContact CG-CB 4.11Å
282	L	92.7	Very high	89.5	Confident	15 Å²	15	54.3 Å²	54.3	8%	0.079	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	114.8	173.8	179.6	68.2	0	0	0	110	V269 Y271 W305 L331 Y333	V269-L282 HydrophobicContact CG1-CD2 3.76Å; Y271-L282 HydrophobicContact CD2-CB 3.94Å; Y271-L282 HydrophobicContact CE2-CB 4.35Å; Y271-L282 WeakPolarHBondContact CE2-O 3.34Å; Y271-L282 PolarHBondContact O-N 2.81Å; L282-W305 HydrophobicContact CD2-CH2 4.37Å; L282-W305 HydrophobicContact CD2-CZ2 4.35Å; L282-W305 HydrophobicContact CG-CH2 4.17Å; L282-W305 HydrophobicContact CG-CZ2 4.44Å; L282-L331 HydrophobicContact CD1-CB 4.18Å; L282-L331 HydrophobicContact CD1-CD2 3.93Å; L282-Y333 HydrophobicContact CB-CD1 4.04Å; L282-Y333 HydrophobicContact CB-CE1 3.72Å; L282-Y333 HydrophobicContact CD1-CD2 4.44Å; L282-Y333 HydrophobicContact CD1-CE1 4.17Å; L282-Y333 HydrophobicContact CD1-CE2 4.07Å
283	E	92.3	Very high	89.2	Confident	31 Å²	31	56.4 Å²	56.4	15%	0.145	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	-10.3	-171.6	-71.5	-87.8	-178.4	0	0	112.3	L281 F299 Q300 V332 I334	L281-E283 HydrophobicContact CB-CG 4.15Å; L281-E283 PolarHBondContact O-N 3.35Å; E283-F299 CarbonylContact O-C 3.51Å; E283-F299 WeakPolarHBondContact O-CA 3.36Å; E283-F299 WeakPolarHBondContact O-CB 3.49Å; E283-Q300 PolarHBondContact O-N 3.46Å; E283-Q300 WeakPolarHBondContact OE2-CB 3.17Å; E283-V332 PolarHBondContact N-O 2.83Å; E283-I334 HydrophobicContact CB-CB 4.35Å; E283-I334 HydrophobicContact CB-CD1 3.38Å; E283-I334 HydrophobicContact CB-CG1 3.72Å; E283-I334 HydrophobicContact CG-CB 3.99Å; E283-I334 HydrophobicContact CG-CD1 3.59Å; E283-I334 HydrophobicContact CG-CG1 3.91Å
284	G	92.6	Very high	89	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	160.4	174.1	0	0	0	0	0	113.5	A298 V332	G284-A298 CarbonylContact C-O 3.59Å; G284-A298 WeakPolarHBondContact CA-O 3.5Å; G284-V332 PolarHBondContact N-O 3.22Å; G284-V332 VanDerWaalsContact N-O 3.17Å; G284-V332 WeakPolarHBondContact O-CA 3.34Å; G284-V332 PolarHBondContact O-N 2.74Å
285	A	91.4	Very high	88.9	Confident	7 Å²	7	55.3 Å²	55.3	6%	0.058	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	149.2	172.9	0	0	0	0	0	110.2	L287 A297 A298 S330 L331	A285-L287 HydrophobicContact CB-CD2 4.42Å; A285-A297 CarbonylContact O-C 3.57Å; A285-A297 WeakPolarHBondContact O-CA 3.47Å; A285-A298 PolarHBondContact N-O 3.14Å; A285-A298 PolarHBondContact O-N 3.14Å; A285-S330 CarbonylContact C-O 3.52Å; A285-S330 VanDerWaalsContact CA-O 3.23Å; A285-S330 WeakPolarHBondContact CA-O 3.18Å; A285-L331 HydrophobicContact CB-CD2 4.03Å
286	T	90.7	Very high	89	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.012	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	143.1	164.9	56.9	0	0	0	0	109.8	I94 E164 F168 S296 S329 S330	I94-T286 HydrophobicContact CD1-CG2 3.89Å; E164-T286 WeakPolarHBondContact OE1-CB 3.22Å; E164-T286 WeakPolarHBondContact OE1-CG2 3.47Å; E164-T286 PolarHBondContact OE1-OG1 2.89Å; F168-T286 HydrophobicContact CE1-CG2 4.22Å; F168-T286 HydrophobicContact CE2-CG2 3.57Å; F168-T286 HydrophobicContact CZ-CG2 3.34Å; T286-S296 WeakPolarHBondContact CA-O 3.18Å; T286-S329 PolarHBondContact O-N 2.9Å; T286-S329 WeakPolarHBondContact OG1-CB 3.32Å; T286-S330 PolarHBondContact N-O 2.87Å; T286-S330 PolarHBondContact O-N 2.88Å; T286-S330 WeakPolarHBondContact OG1-CB 3.31Å; T286-S330 PolarHBondContact OG1-N 3.03Å; T286-S330 VanDerWaalsContact OG1-N 3.13Å; T286-S330 PolarHBondContact OG1-OG 2.72Å
287	L	88.4	Confident	89.5	Confident	3 Å²	3	53.9 Å²	53.9	2%	0.016	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	133.4	-168	-55.7	176.3	0	0	0	108.5	A285 Y295 S296 A298 P323 L326 L328	A285-L287 HydrophobicContact CB-CD2 4.42Å; L287-Y295 CarbonylContact O-C 3.59Å; L287-Y295 WeakPolarHBondContact O-CA 3.05Å; L287-S296 PolarHBondContact N-O 3.34Å; L287-S296 PolarHBondContact O-N 3.29Å; L287-A298 HydrophobicContact CD1-CB 4.33Å; L287-P323 HydrophobicContact CD1-CB 3.84Å; L287-P323 HydrophobicContact CD1-CG 4.2Å; L287-L326 HydrophobicContact CB-CB 3.74Å; L287-L326 HydrophobicContact CB-CD1 3.72Å; L287-L326 HydrophobicContact CB-CG 4.39Å; L287-L326 HydrophobicContact CD1-CB 4.3Å; L287-L326 HydrophobicContact CD1-CD1 3.84Å; L287-L326 HydrophobicContact CD2-CB 4.2Å; L287-L326 HydrophobicContact CG-CB 4.28Å; L287-L326 HydrophobicContact CG-CD1 4.37Å; L287-L328 HydrophobicContact CD2-CD2 3.77Å
288	F	87.6	Confident	89.9	Confident	39 Å²	39	44 Å²	44	17%	0.171	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	123.2	176.1	-176.6	-116.5	0	0	0	110.9	F161 M290 Y295 L327	F161-F288 HydrophobicContact CZ-CE2 4.22Å; F288-M290 HydrophobicContact CD1-CG 3.99Å; F288-M290 HydrophobicContact CE1-CB 4.48Å; F288-M290 HydrophobicContact CE1-CG 3.81Å; F288-Y295 HydrophobicContact CB-CD1 4.18Å; F288-Y295 HydrophobicContact CB-CE1 3.9Å; F288-Y295 HydrophobicContact CD2-CD1 4.03Å; F288-Y295 AromaticContact CD2-CD2 3.81Å; F288-Y295 HydrophobicContact CD2-CD2 3.81Å; F288-Y295 AromaticContact CD2-CE1 3.75Å; F288-Y295 HydrophobicContact CD2-CE1 3.75Å; F288-Y295 AromaticContact CD2-CE2 3.51Å; F288-Y295 HydrophobicContact CD2-CE2 3.51Å; F288-Y295 HydrophobicContact CD2-CG 4.07Å; F288-Y295 AromaticContact CD2-CZ 3.48Å; F288-Y295 VanDerWaalsContact CD2-CZ 3.48Å; F288-Y295 HydrophobicContact CE2-CD2 4.16Å; F288-Y295 AromaticContact CE2-CE2 3.71Å; F288-Y295 HydrophobicContact CE2-CE2 3.71Å; F288-Y295 HydrophobicContact CG-CE1 4.1Å; F288-L327 HydrophobicContact CB-CB 4.45Å; F288-L327 HydrophobicContact CD1-CD1 4.4Å; F288-L327 PolarHBondContact N-O 3.06Å
289	N	85.6	Confident	90	Very high	31 Å²	31	40.5 Å²	40.5	17%	0.166	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	111.5	169.4	-173.7	-19.9	0	0	0	109.2	E291 E292 H293 H294 L326	N289-E291 VanDerWaalsContact C-N 3.33Å; N289-E291 PolarHBondContact O-N 3.08Å; N289-E291 WeakPolarHBondContact OD1-CB 3.32Å; N289-E291 PolarHBondContact OD1-N 3.06Å; N289-E292 HydrophobicContact CB-CB 4.26Å; N289-E292 VanDerWaalsContact ND2-CD 3.32Å; N289-E292 WeakPolarHBondContact ND2-CG 3.19Å; N289-E292 PolarHBondContact ND2-OE2 2.86Å; N289-E292 PolarHBondContact OD1-N 2.96Å; N289-H293 VanDerWaalsContact O-CA 3.23Å; N289-H293 WeakPolarHBondContact O-CA 3.15Å; N289-H293 PolarHBondContact O-N 2.56Å; N289-H294 PolarHBondContact N-O 2.61Å; N289-H294 PolarHBondContact O-N 3.26Å; N289-L326 HydrophobicContact CB-CD2 4.43Å
290	M	82.5	Confident	89.8	Confident	114 Å²	114	34.1 Å²	34.1	56%	0.562	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-31.4	178.1	-77.7	-171.4	-79.9	0	0	113.4	F288 H293 L327	F288-M290 HydrophobicContact CD1-CG 3.99Å; F288-M290 HydrophobicContact CE1-CB 4.48Å; F288-M290 HydrophobicContact CE1-CG 3.81Å; M290-H293 PolarHBondContact O-CE1 3.28Å; M290-H293 PolarHBondContact O-ND1 3.41Å; M290-L327 HydrophobicContact CE-CD1 3.33Å; M290-L327 HydrophobicContact CE-CD2 4.21Å; M290-L327 HydrophobicContact CE-CG 3.71Å; M290-L327 HydrophobicContact CG-CD1 3.68Å; M290-L327 HydrophobicContact SD-CD1 3.52Å; M290-L327 VanDerWaalsContact SD-CD1 3.52Å
291	E	84.7	Confident	89.6	Confident	178 Å²	178	34.2 Å²	34.2	83%	0.832	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-51	-178.6	-62	-175.6	171.6	0	0	110.2	N289 H293	N289-E291 VanDerWaalsContact C-N 3.33Å; N289-E291 PolarHBondContact O-N 3.08Å; N289-E291 WeakPolarHBondContact OD1-CB 3.32Å; N289-E291 PolarHBondContact OD1-N 3.06Å; E291-H293 VanDerWaalsContact C-N 3.28Å; E291-H293 PolarHBondContact O-N 2.75Å; E291-H293 PolarHBondContact O-ND1 2.96Å
292	E	84.9	Confident	89.3	Confident	91 Å²	91	36.2 Å²	36.2	43%	0.425	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-8.5	-179.1	-65.8	177.8	151.9	0	0	113.1	N289 H294 R312	N289-E292 HydrophobicContact CB-CB 4.26Å; N289-E292 VanDerWaalsContact ND2-CD 3.32Å; N289-E292 WeakPolarHBondContact ND2-CG 3.19Å; N289-E292 PolarHBondContact ND2-OE2 2.86Å; N289-E292 PolarHBondContact OD1-N 2.96Å; E292-H294 HydrophobicContact CB-CB 4Å; E292-H294 PolarHBondContact O-N 2.71Å; E292-R312 IonicContact OE1-NH2 3.81Å; E292-R312 PolarHBondContact OE1-NH2 2.9Å
293	H	86.3	Confident	89	Confident	122 Å²	122	38.1 Å²	38.1	57%	0.565	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.7	49.2	-170.9	-71.7	58.9	0	0	0	111.2	F161 N289 M290 E291	F161-H293 VanDerWaalsContact CE2-O 3.23Å; F161-H293 WeakPolarHBondContact CE2-O 3.38Å; F161-H293 HydrophobicContact CZ-CB 4.39Å; N289-H293 VanDerWaalsContact O-CA 3.23Å; N289-H293 WeakPolarHBondContact O-CA 3.15Å; N289-H293 PolarHBondContact O-N 2.56Å; M290-H293 PolarHBondContact O-CE1 3.28Å; M290-H293 PolarHBondContact O-ND1 3.41Å; E291-H293 VanDerWaalsContact C-N 3.28Å; E291-H293 PolarHBondContact O-N 2.75Å; E291-H293 PolarHBondContact O-ND1 2.96Å
294	H	88.6	Confident	88.8	Confident	5 Å²	5	38.8 Å²	38.8	2%	0.023	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	140.1	-170.6	179.6	66.2	0	0	0	111.9	C86 N289 E292 D309 L311	C86-H294 WeakPolarHBondContact CB-CE1 3.33Å; C86-H294 VanDerWaalsContact CB-ND1 3.32Å; C86-H294 WeakPolarHBondContact CB-ND1 3.33Å; N289-H294 PolarHBondContact N-O 2.61Å; N289-H294 PolarHBondContact O-N 3.26Å; E292-H294 HydrophobicContact CB-CB 4Å; E292-H294 PolarHBondContact O-N 2.71Å; H294-D309 IonicContact CD2-OD1 2.68Å; H294-D309 IonicContact NE2-OD1 2.73Å; H294-D309 PolarHBondContact NE2-OD1 2.89Å; H294-L311 HydrophobicContact CB-CD1 3.93Å; H294-L311 HydrophobicContact CB-CD2 4.43Å; H294-L311 HydrophobicContact CB-CG 4.42Å; H294-L311 VanDerWaalsContact CE1-CG 3.44Å; H294-L311 WeakPolarHBondContact CE1-CG 3.44Å; H294-L311 VanDerWaalsContact ND1-CD2 3.29Å; H294-L311 WeakPolarHBondContact ND1-CD2 2.67Å; H294-L311 WeakPolarHBondContact ND1-CG 3.35Å
295	Y	89.7	Confident	88.6	Confident	26 Å²	26	40 Å²	40	10%	0.102	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	126.4	171.9	-72.7	-91	0	0	0	110.8	C86 T87 F161 E164 L287 F288	C86-Y295 WeakPolarHBondContact CB-O 3.39Å; T87-Y295 HydrophobicContact CG2-CD2 3.46Å; T87-Y295 VanDerWaalsContact CG2-CD2 3.46Å; T87-Y295 HydrophobicContact CG2-CE2 3.85Å; T87-Y295 HydrophobicContact CG2-CG 3.92Å; F161-Y295 HydrophobicContact CE2-CD2 4.3Å; F161-Y295 HydrophobicContact CE2-CE2 4.12Å; F161-Y295 HydrophobicContact CZ-CE2 4.34Å; E164-Y295 HydrophobicContact CB-CD1 3.95Å; E164-Y295 HydrophobicContact CB-CE1 3.66Å; E164-Y295 HydrophobicContact CB-CE2 4.5Å; E164-Y295 HydrophobicContact CB-CG 4.48Å; E164-Y295 HydrophobicContact CG-CD1 3.86Å; E164-Y295 HydrophobicContact CG-CE1 3.64Å; L287-Y295 CarbonylContact O-C 3.59Å; L287-Y295 WeakPolarHBondContact O-CA 3.05Å; F288-Y295 HydrophobicContact CB-CD1 4.18Å; F288-Y295 HydrophobicContact CB-CE1 3.9Å; F288-Y295 HydrophobicContact CD2-CD1 4.03Å; F288-Y295 AromaticContact CD2-CD2 3.81Å; F288-Y295 HydrophobicContact CD2-CD2 3.81Å; F288-Y295 AromaticContact CD2-CE1 3.75Å; F288-Y295 HydrophobicContact CD2-CE1 3.75Å; F288-Y295 AromaticContact CD2-CE2 3.51Å; F288-Y295 HydrophobicContact CD2-CE2 3.51Å; F288-Y295 HydrophobicContact CD2-CG 4.07Å; F288-Y295 AromaticContact CD2-CZ 3.48Å; F288-Y295 VanDerWaalsContact CD2-CZ 3.48Å; F288-Y295 HydrophobicContact CE2-CD2 4.16Å; F288-Y295 AromaticContact CE2-CE2 3.71Å; F288-Y295 HydrophobicContact CE2-CE2 3.71Å; F288-Y295 HydrophobicContact CG-CE1 4.1Å
296	S	91.2	Very high	88.6	Confident	5 Å²	5	39.8 Å²	39.8	4%	0.035	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	169.7	170.9	62.3	0	0	0	0	110.3	T286 L287 H307 Y308	T286-S296 WeakPolarHBondContact CA-O 3.18Å; L287-S296 PolarHBondContact N-O 3.34Å; L287-S296 PolarHBondContact O-N 3.29Å; S296-H307 VanDerWaalsContact CB-NE2 3.32Å; S296-H307 WeakPolarHBondContact CB-NE2 3.34Å; S296-H307 PolarHBondContact OG-NE2 3.35Å; S296-H307 VanDerWaalsContact OG-NE2 3.09Å; S296-Y308 WeakPolarHBondContact CA-O 3.44Å; S296-Y308 WeakPolarHBondContact CB-O 3.11Å
297	A	92.9	Very high	88.7	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	149	178.4	0	0	0	0	0	111.1	I94 A285 H307 Y308	I94-A297 HydrophobicContact CD1-CB 3.89Å; I94-A297 HydrophobicContact CG1-CB 4.2Å; A285-A297 CarbonylContact O-C 3.57Å; A285-A297 WeakPolarHBondContact O-CA 3.47Å; A297-H307 CarbonylContact O-C 3.43Å; A297-H307 WeakPolarHBondContact O-CA 3.28Å; A297-H307 PolarHBondContact O-CD2 2.97Å; A297-H307 VanDerWaalsContact O-CD2 3.31Å; A297-Y308 HydrophobicContact CB-CD1 4.26Å; A297-Y308 PolarHBondContact N-O 3.35Å; A297-Y308 PolarHBondContact O-N 3.47Å
298	A	92.6	Very high	88.9	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	143.7	168.9	0	0	0	0	0	109.4	G284 A285 L287 W305 M306 P323	G284-A298 CarbonylContact C-O 3.59Å; G284-A298 WeakPolarHBondContact CA-O 3.5Å; A285-A298 PolarHBondContact N-O 3.14Å; A285-A298 PolarHBondContact O-N 3.14Å; L287-A298 HydrophobicContact CD1-CB 4.33Å; A298-W305 HydrophobicContact CB-CE3 4.11Å; A298-W305 HydrophobicContact CB-CZ3 4.2Å; A298-M306 CarbonylContact C-O 3.43Å; A298-M306 WeakPolarHBondContact CA-O 2.92Å; A298-P323 HydrophobicContact CB-CG 3.32Å
299	F	93.3	Very high	88.9	Confident	1 Å²	1	39.3 Å²	39.3	0%	0.004	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	160.8	-179	49.1	-92.3	0	0	0	111.5	M93 I94 V97 E283 I301 M306 L316	M93-F299 HydrophobicContact CB-CE1 4.25Å; M93-F299 HydrophobicContact CE-CE1 4.46Å; M93-F299 HydrophobicContact CE-CE2 4.12Å; M93-F299 HydrophobicContact CE-CZ 3.74Å; M93-F299 HydrophobicContact CG-CD1 4.18Å; M93-F299 HydrophobicContact CG-CE1 3.27Å; M93-F299 HydrophobicContact CG-CZ 3.48Å; M93-F299 VanDerWaalsContact CG-CZ 3.48Å; M93-F299 HydrophobicContact SD-CZ 4.21Å; I94-F299 HydrophobicContact CG1-CB 4.34Å; I94-F299 HydrophobicContact CG1-CD1 4.15Å; V97-F299 HydrophobicContact CB-CD2 4.3Å; V97-F299 HydrophobicContact CG1-CD2 4.14Å; V97-F299 HydrophobicContact CG2-CD2 3.62Å; V97-F299 HydrophobicContact CG2-CE2 3.67Å; V97-F299 HydrophobicContact CG2-CG 4.26Å; V97-F299 HydrophobicContact CG2-CZ 4.36Å; E283-F299 CarbonylContact O-C 3.51Å; E283-F299 WeakPolarHBondContact O-CA 3.36Å; E283-F299 WeakPolarHBondContact O-CB 3.49Å; F299-I301 HydrophobicContact CD2-CD1 4.35Å; F299-I301 HydrophobicContact CD2-CG1 4.2Å; F299-I301 HydrophobicContact CE2-CD1 3.99Å; F299-I301 HydrophobicContact CE2-CG1 4.33Å; F299-M306 HydrophobicContact CD2-CB 3.96Å; F299-M306 HydrophobicContact CD2-CG 4.5Å; F299-M306 HydrophobicContact CE2-CB 3.57Å; F299-M306 HydrophobicContact CE2-CG 4.09Å; F299-M306 HydrophobicContact CZ-CB 3.97Å; F299-M306 PolarHBondContact N-O 2.86Å; F299-M306 PolarHBondContact O-N 2.78Å; F299-L316 HydrophobicContact CE1-CD1 4.36Å; F299-L316 HydrophobicContact CE2-CD1 4.31Å; F299-L316 HydrophobicContact CZ-CD1 3.57Å
300	Q	90.4	Very high	88.8	Confident	8 Å²	8	38 Å²	38	4%	0.037	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	144.7	177.5	-65.8	-167	-7.2	0	0	112.6	V97 Y271 E283 C304 W305	V97-Q300 WeakPolarHBondContact CG1-O 3.48Å; Y271-Q300 VanDerWaalsContact CE2-NE2 3.31Å; Y271-Q300 PolarHBondContact OH-OE1 2.66Å; E283-Q300 PolarHBondContact O-N 3.46Å; E283-Q300 WeakPolarHBondContact OE2-CB 3.17Å; Q300-C304 CarbonylContact C-O 3.47Å; Q300-C304 VanDerWaalsContact CA-O 3.28Å; Q300-C304 WeakPolarHBondContact CA-O 3.39Å; Q300-W305 HydrophobicContact CG-CD2 3.66Å; Q300-W305 HydrophobicContact CG-CE3 3.88Å; Q300-W305 HydrophobicContact CG-CG 4.22Å; Q300-W305 HydrophobicContact CG-CH2 3.96Å; Q300-W305 HydrophobicContact CG-CZ2 3.75Å; Q300-W305 HydrophobicContact CG-CZ3 4.03Å
301	I	90.6	Very high	88.8	Confident	1 Å²	1	35 Å²	35	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	122.5	164.1	-60.5	179.5	0	0	0	106.2	F34 I37 R38 I41 V97 F299 G303 C304 M306	F34-I301 HydrophobicContact CD2-CD1 4.27Å; F34-I301 HydrophobicContact CE2-CD1 3.92Å; F34-I301 HydrophobicContact CE2-CG1 3.98Å; F34-I301 HydrophobicContact CE2-CG2 4.2Å; F34-I301 HydrophobicContact CZ-CG2 4.1Å; I37-I301 HydrophobicContact CB-CD1 4.41Å; I37-I301 HydrophobicContact CG2-CD1 3.59Å; R38-I301 HydrophobicContact CB-CG2 4.21Å; R38-I301 HydrophobicContact CG-CG2 4.49Å; I41-I301 HydrophobicContact CD1-CB 3.76Å; I41-I301 HydrophobicContact CD1-CG2 3.8Å; V97-I301 HydrophobicContact CG1-CG1 4.1Å; V97-I301 HydrophobicContact CG2-CD1 4.25Å; V97-I301 HydrophobicContact CG2-CG1 4.47Å; F299-I301 HydrophobicContact CD2-CD1 4.35Å; F299-I301 HydrophobicContact CD2-CG1 4.2Å; F299-I301 HydrophobicContact CE2-CD1 3.99Å; F299-I301 HydrophobicContact CE2-CG1 4.33Å; I301-G303 PolarHBondContact O-N 3.19Å; I301-G303 VanDerWaalsContact O-N 3.16Å; I301-C304 PolarHBondContact N-O 2.86Å; I301-C304 WeakPolarHBondContact O-CB 3.41Å; I301-C304 PolarHBondContact O-N 3.1Å; I301-M306 HydrophobicContact CD1-CG 4.39Å
302	D	87.1	Confident	88.6	Confident	81 Å²	81	32.7 Å²	32.7	43%	0.433	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	34.2	-178.6	-61.2	-10.7	0	0	0	114	R38 C304	R38-D302 VanDerWaalsContact CD-OD2 3.23Å; R38-D302 WeakPolarHBondContact CD-OD2 3.29Å; R38-D302 WeakPolarHBondContact CG-OD2 3.11Å; R38-D302 IonicContact CZ-OD1 3.55Å; R38-D302 IonicContact CZ-OD2 2.6Å; R38-D302 VanDerWaalsContact NE-CG 3.27Å; R38-D302 IonicContact NE-OD1 3.67Å; R38-D302 PolarHBondContact NE-OD1 3.4Å; R38-D302 IonicContact NE-OD2 3.86Å; R38-D302 PolarHBondContact NE-OD2 3.04Å; R38-D302 IonicContact NH2-OD1 3.73Å; R38-D302 PolarHBondContact NH2-OD1 3.49Å; R38-D302 IonicContact NH2-OD2 4Å; D302-C304 PolarHBondContact O-N 3.1Å
303	G	85.4	Confident	88.3	Confident	56 Å²	56	32.4 Å²	32.4	58%	0.577	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	78	-2.2	-177.9	0	0	0	0	0	114.8	I301	I301-G303 PolarHBondContact O-N 3.19Å; I301-G303 VanDerWaalsContact O-N 3.16Å
304	C	87.6	Confident	88.1	Confident	45 Å²	45	30.6 Å²	30.6	30%	0.304	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	135.2	172.4	-66.9	0	0	0	0	110.6	I41 Q300 I301 D302 L318	I41-C304 HydrophobicContact CG2-CB 3.97Å; Q300-C304 CarbonylContact C-O 3.47Å; Q300-C304 VanDerWaalsContact CA-O 3.28Å; Q300-C304 WeakPolarHBondContact CA-O 3.39Å; I301-C304 PolarHBondContact N-O 2.86Å; I301-C304 WeakPolarHBondContact O-CB 3.41Å; I301-C304 PolarHBondContact O-N 3.1Å; D302-C304 PolarHBondContact O-N 3.1Å; C304-L318 HydrophobicContact CB-CD1 3.76Å
305	W	89.5	Confident	88.1	Confident	25 Å²	25	30.4 Å²	30.4	10%	0.095	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	131	175	-80.2	100.5	0	0	0	110.7	L282 A298 Q300 L319	L282-W305 HydrophobicContact CD2-CH2 4.37Å; L282-W305 HydrophobicContact CD2-CZ2 4.35Å; L282-W305 HydrophobicContact CG-CH2 4.17Å; L282-W305 HydrophobicContact CG-CZ2 4.44Å; A298-W305 HydrophobicContact CB-CE3 4.11Å; A298-W305 HydrophobicContact CB-CZ3 4.2Å; Q300-W305 HydrophobicContact CG-CD2 3.66Å; Q300-W305 HydrophobicContact CG-CE3 3.88Å; Q300-W305 HydrophobicContact CG-CG 4.22Å; Q300-W305 HydrophobicContact CG-CH2 3.96Å; Q300-W305 HydrophobicContact CG-CZ2 3.75Å; Q300-W305 HydrophobicContact CG-CZ3 4.03Å; W305-L319 HydrophobicContact CB-CB 3.96Å; W305-L319 HydrophobicContact CB-CD1 4.16Å; W305-L319 WeakPolarHBondContact O-CB 3.44Å; W305-L319 PolarHBondContact O-N 3.37Å
306	M	91.1	Very high	88.2	Confident	3 Å²	3	29.1 Å²	29.1	2%	0.015	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	144.1	171.2	-61.1	-66.5	-64.2	0	0	108.8	I37 I41 A298 F299 I301 L316 I317 L318	I37-M306 HydrophobicContact CG2-CE 4.14Å; I41-M306 HydrophobicContact CD1-CG 4.29Å; I41-M306 HydrophobicContact CD1-SD 3.85Å; I41-M306 HydrophobicContact CG1-SD 3.95Å; A298-M306 CarbonylContact C-O 3.43Å; A298-M306 WeakPolarHBondContact CA-O 2.92Å; F299-M306 HydrophobicContact CD2-CB 3.96Å; F299-M306 HydrophobicContact CD2-CG 4.5Å; F299-M306 HydrophobicContact CE2-CB 3.57Å; F299-M306 HydrophobicContact CE2-CG 4.09Å; F299-M306 HydrophobicContact CZ-CB 3.97Å; F299-M306 PolarHBondContact N-O 2.86Å; F299-M306 PolarHBondContact O-N 2.78Å; I301-M306 HydrophobicContact CD1-CG 4.39Å; M306-L316 HydrophobicContact CB-CD1 4.02Å; M306-L316 HydrophobicContact CE-CD1 3.75Å; M306-L316 HydrophobicContact CE-CD2 4.14Å; M306-L316 HydrophobicContact CE-CG 3.59Å; M306-I317 CarbonylContact C-O 3.58Å; M306-I317 WeakPolarHBondContact CA-O 3.47Å; M306-L318 HydrophobicContact SD-CB 4.02Å; M306-L318 HydrophobicContact SD-CD1 3.72Å
307	H	91.9	Very high	88.2	Confident	29 Å²	29	31.1 Å²	31.1	13%	0.134	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	125.2	172.3	-179.3	-124.1	0	0	0	109.7	S296 A297 L316 I317 L319	S296-H307 VanDerWaalsContact CB-NE2 3.32Å; S296-H307 WeakPolarHBondContact CB-NE2 3.34Å; S296-H307 PolarHBondContact OG-NE2 3.35Å; S296-H307 VanDerWaalsContact OG-NE2 3.09Å; A297-H307 CarbonylContact O-C 3.43Å; A297-H307 WeakPolarHBondContact O-CA 3.28Å; A297-H307 PolarHBondContact O-CD2 2.97Å; A297-H307 VanDerWaalsContact O-CD2 3.31Å; H307-L316 CarbonylContact O-C 3.58Å; H307-L316 WeakPolarHBondContact O-CA 3.43Å; H307-I317 PolarHBondContact N-O 3.31Å; H307-I317 PolarHBondContact O-N 2.78Å; H307-L319 HydrophobicContact CB-CD1 3.87Å; H307-L319 HydrophobicContact CB-CD2 3.72Å; H307-L319 HydrophobicContact CB-CG 3.79Å
308	Y	92.8	Very high	87.9	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	120.3	173.6	169.5	-100.7	0	0	0	110.3	V55 L56 D89 M93 S296 A297 G310 N315	V55-Y308 WeakPolarHBondContact O-CE2 3.33Å; L56-Y308 HydrophobicContact CB-CE2 4.43Å; L56-Y308 PolarHBondContact O-OH 3.19Å; D89-Y308 HydrophobicContact CB-CE1 3.6Å; D89-Y308 VanDerWaalsContact CB-OH 3.32Å; D89-Y308 WeakPolarHBondContact CB-OH 3.44Å; M93-Y308 HydrophobicContact CG-CG 4.32Å; S296-Y308 WeakPolarHBondContact CA-O 3.44Å; S296-Y308 WeakPolarHBondContact CB-O 3.11Å; A297-Y308 HydrophobicContact CB-CD1 4.26Å; A297-Y308 PolarHBondContact N-O 3.35Å; A297-Y308 PolarHBondContact O-N 3.47Å; Y308-G310 WeakPolarHBondContact OH-CA 3.22Å; Y308-N315 CarbonylContact C-O 3.59Å; Y308-N315 WeakPolarHBondContact CA-O 3.28Å; Y308-N315 HydrophobicContact CD2-CB 4.43Å; Y308-N315 WeakPolarHBondContact CD2-O 3.36Å; Y308-N315 HydrophobicContact CE2-CB 4.08Å
309	D	88.6	Confident	87.4	Confident	4 Å²	4	34.7 Å²	34.7	2%	0.021	20%	0.195	C	C	.	.			trans	-128.5	96.1	178	174.6	4.5	0	0	0	110.4	H294 L311 R312 N315	H294-D309 IonicContact CD2-OD1 2.68Å; H294-D309 IonicContact NE2-OD1 2.73Å; H294-D309 PolarHBondContact NE2-OD1 2.89Å; D309-L311 PolarHBondContact O-N 2.9Å; D309-L311 WeakPolarHBondContact OD1-CB 3.29Å; D309-L311 WeakPolarHBondContact OD1-CG 3.48Å; D309-L311 PolarHBondContact OD1-N 3.37Å; D309-L311 VanDerWaalsContact OD1-N 3.1Å; D309-R312 PolarHBondContact O-N 3.14Å; D309-R312 WeakPolarHBondContact OD2-CD 3.23Å; D309-R312 IonicContact OD2-CZ 3.09Å; D309-R312 IonicContact OD2-NE 2.88Å; D309-R312 PolarHBondContact OD2-NE 2.91Å; D309-R312 IonicContact OD2-NH1 2.55Å; D309-R312 PolarHBondContact OD2-NH1 3.02Å; D309-N315 PolarHBondContact N-O 3.26Å; D309-N315 VanDerWaalsContact O-CA 3.28Å; D309-N315 WeakPolarHBondContact O-CA 3.5Å; D309-N315 WeakPolarHBondContact O-CB 3.48Å
310	G	82.9	Confident	86.2	Confident	3 Å²	3	41 Å²	41	3%	0.031	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-13.6	-174.9	0	0	0	0	0	115.6	W58 Y308 R312	W58-G310 WeakPolarHBondContact CB-O 3.32Å; W58-G310 PolarHBondContact N-O 3.04Å; Y308-G310 WeakPolarHBondContact OH-CA 3.22Å; G310-R312 VanDerWaalsContact C-N 3.33Å; G310-R312 PolarHBondContact O-N 2.8Å
311	L	82.1	Confident	85.1	Confident	53 Å²	53	47 Å²	47	28%	0.277	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-31.7	-178.6	-61.7	180	0	0	0	113.2	W58 H294 D309	W58-L311 HydrophobicContact CD2-CD2 4.08Å; W58-L311 HydrophobicContact CE3-CD2 3.27Å; W58-L311 HydrophobicContact CE3-CG 4.45Å; W58-L311 HydrophobicContact CH2-CD2 3.49Å; W58-L311 VanDerWaalsContact CH2-CD2 3.49Å; W58-L311 HydrophobicContact CZ2-CD2 4.27Å; W58-L311 HydrophobicContact CZ3-CD2 2.97Å; W58-L311 HydrophobicContact CZ3-CG 4.34Å; H294-L311 HydrophobicContact CB-CD1 3.93Å; H294-L311 HydrophobicContact CB-CD2 4.43Å; H294-L311 HydrophobicContact CB-CG 4.42Å; H294-L311 VanDerWaalsContact CE1-CG 3.44Å; H294-L311 WeakPolarHBondContact CE1-CG 3.44Å; H294-L311 VanDerWaalsContact ND1-CD2 3.29Å; H294-L311 WeakPolarHBondContact ND1-CD2 2.67Å; H294-L311 WeakPolarHBondContact ND1-CG 3.35Å; D309-L311 PolarHBondContact O-N 2.9Å; D309-L311 WeakPolarHBondContact OD1-CB 3.29Å; D309-L311 WeakPolarHBondContact OD1-CG 3.48Å; D309-L311 PolarHBondContact OD1-N 3.37Å; D309-L311 VanDerWaalsContact OD1-N 3.1Å
312	R	81.7	Confident	83.9	Confident	129 Å²	129	50.5 Å²	50.5	49%	0.487	27%	0.273	S	S	.	.	S	Bend	trans	-105.5	162.4	-165.2	-59.9	179.6	-178.1	130.7	1.4	110.8	E292 D309 G310 D314 N315	E292-R312 IonicContact OE1-NH2 3.81Å; E292-R312 PolarHBondContact OE1-NH2 2.9Å; D309-R312 PolarHBondContact O-N 3.14Å; D309-R312 WeakPolarHBondContact OD2-CD 3.23Å; D309-R312 IonicContact OD2-CZ 3.09Å; D309-R312 IonicContact OD2-NE 2.88Å; D309-R312 PolarHBondContact OD2-NE 2.91Å; D309-R312 IonicContact OD2-NH1 2.55Å; D309-R312 PolarHBondContact OD2-NH1 3.02Å; G310-R312 VanDerWaalsContact C-N 3.33Å; G310-R312 PolarHBondContact O-N 2.8Å; R312-D314 VanDerWaalsContact C-N 3.35Å; R312-N315 WeakPolarHBondContact O-CB 3.28Å
313	S	77.5	Confident	82.8	Confident	85 Å²	85	48.8 Å²	48.8	59%	0.594	27%	0.267	S	S	*	.	S	Bend	trans	-67.7	-40.6	172.8	52.3	0	0	0	0	111.1	P54 N315	P54-S313 WeakPolarHBondContact CG-O 3.16Å; S313-N315 VanDerWaalsContact C-N 3.25Å; S313-N315 PolarHBondContact O-N 3.01Å; S313-N315 VanDerWaalsContact O-N 3.1Å
314	D	82.6	Confident	81.5	Confident	84 Å²	84	53.1 Å²	53.1	45%	0.449	27%	0.272	S	S	.	.	S	Bend	trans	-89.8	68.9	176.5	-58.9	-9.7	0	0	0	108.3	R312 L316	R312-D314 VanDerWaalsContact C-N 3.35Å; D314-L316 VanDerWaalsContact C-N 3.34Å; D314-L316 PolarHBondContact O-N 2.82Å
315	N	89.3	Confident	80	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.293	C	S	.	.			trans	-87.4	3.4	-167.8	64.9	10.3	0	0	0	115	P54 V55 Y308 D309 R312 S313	P54-N315 WeakPolarHBondContact CA-OD1 3.4Å; V55-N315 PolarHBondContact N-ND2 2.88Å; V55-N315 PolarHBondContact N-OD1 3.48Å; V55-N315 PolarHBondContact O-ND2 2.83Å; Y308-N315 CarbonylContact C-O 3.59Å; Y308-N315 WeakPolarHBondContact CA-O 3.28Å; Y308-N315 HydrophobicContact CD2-CB 4.43Å; Y308-N315 WeakPolarHBondContact CD2-O 3.36Å; Y308-N315 HydrophobicContact CE2-CB 4.08Å; D309-N315 PolarHBondContact N-O 3.26Å; D309-N315 VanDerWaalsContact O-CA 3.28Å; D309-N315 WeakPolarHBondContact O-CA 3.5Å; D309-N315 WeakPolarHBondContact O-CB 3.48Å; R312-N315 WeakPolarHBondContact O-CB 3.28Å; S313-N315 VanDerWaalsContact C-N 3.25Å; S313-N315 PolarHBondContact O-N 3.01Å; S313-N315 VanDerWaalsContact O-N 3.1Å
316	L	91.7	Very high	78.5	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	112.6	179.1	-179.7	61	0	0	0	109.4	I37 S50 F51 V55 F299 M306 H307 D314	I37-L316 HydrophobicContact CD1-CD2 3.73Å; I37-L316 HydrophobicContact CG1-CD2 3.87Å; I37-L316 HydrophobicContact CG2-CD2 4.12Å; S50-L316 CarbonylContact C-O 3.52Å; S50-L316 WeakPolarHBondContact CA-O 3.4Å; F51-L316 HydrophobicContact CB-CB 4.01Å; F51-L316 HydrophobicContact CB-CD2 3.94Å; F51-L316 HydrophobicContact CB-CG 4.01Å; F51-L316 HydrophobicContact CD1-CD2 3.94Å; F51-L316 HydrophobicContact CG-CD2 4.12Å; F51-L316 PolarHBondContact N-O 3.42Å; V55-L316 HydrophobicContact CG2-CD2 4.1Å; F299-L316 HydrophobicContact CE1-CD1 4.36Å; F299-L316 HydrophobicContact CE2-CD1 4.31Å; F299-L316 HydrophobicContact CZ-CD1 3.57Å; M306-L316 HydrophobicContact CB-CD1 4.02Å; M306-L316 HydrophobicContact CE-CD1 3.75Å; M306-L316 HydrophobicContact CE-CD2 4.14Å; M306-L316 HydrophobicContact CE-CG 3.59Å; H307-L316 CarbonylContact O-C 3.58Å; H307-L316 WeakPolarHBondContact O-CA 3.43Å; D314-L316 VanDerWaalsContact C-N 3.34Å; D314-L316 PolarHBondContact O-N 2.82Å
317	I	89.6	Confident	77.3	Confident	46 Å²	46	61.5 Å²	61.5	24%	0.236	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	134.9	-167	-57	175.2	0	0	0	109.7	R49 M306 H307	R49-I317 HydrophobicContact CB-CG2 4.43Å; R49-I317 CarbonylContact O-C 3.5Å; R49-I317 WeakPolarHBondContact O-CA 3.45Å; R49-I317 WeakPolarHBondContact O-CG2 3.41Å; M306-I317 CarbonylContact C-O 3.58Å; M306-I317 WeakPolarHBondContact CA-O 3.47Å; H307-I317 PolarHBondContact N-O 3.31Å; H307-I317 PolarHBondContact O-N 2.78Å
318	L	88.4	Confident	76.9	Confident	33 Å²	33	62 Å²	62	17%	0.173	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	127.1	170.7	178.8	66.1	0	0	0	109.9	I41 R49 C304 M306	I41-L318 HydrophobicContact CG1-CD1 4.45Å; I41-L318 HydrophobicContact CG2-CD1 4.43Å; R49-L318 PolarHBondContact O-N 2.78Å; C304-L318 HydrophobicContact CB-CD1 3.76Å; M306-L318 HydrophobicContact SD-CB 4.02Å; M306-L318 HydrophobicContact SD-CD1 3.72Å
319	L	81.6	Confident	76.6	Confident	42 Å²	42	62.3 Å²	62.3	22%	0.22	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.8	176.7	-58.5	-179.3	0	0	0	111.2	W305 H307 K321 P323	W305-L319 HydrophobicContact CB-CB 3.96Å; W305-L319 HydrophobicContact CB-CD1 4.16Å; W305-L319 WeakPolarHBondContact O-CB 3.44Å; W305-L319 PolarHBondContact O-N 3.37Å; H307-L319 HydrophobicContact CB-CD1 3.87Å; H307-L319 HydrophobicContact CB-CD2 3.72Å; H307-L319 HydrophobicContact CB-CG 3.79Å; L319-K321 WeakPolarHBondContact CB-O 3.49Å; L319-K321 PolarHBondContact O-N 3.24Å; L319-P323 HydrophobicContact CD1-CB 4.33Å; L319-P323 HydrophobicContact CD1-CG 3.68Å
320	H	68.4	Low	76.6	Confident	135 Å²	135	62.2 Å²	62.2	63%	0.625	32%	0.319	S	S	*	.	S	Bend	trans	-73.3	-17.1	173.7	-65.5	-71	0	0	0	113.2	R49	R49-H320 PolarHBondContact NE-NE2 3.48Å
321	K	66.3	Low	77	Confident	132 Å²	132	62.1 Å²	62.1	57%	0.574	32%	0.318	S	S	*	.	S	Bend	trans	-143.4	157.1	178.3	-67.5	-176.9	-179.6	178.4	0	109	L319 E324	L319-K321 WeakPolarHBondContact CB-O 3.49Å; L319-K321 PolarHBondContact O-N 3.24Å; K321-E324 WeakPolarHBondContact CD-OE1 3.23Å; K321-E324 IonicContact NZ-OE1 2.74Å
322	P	65.5	Low	77.5	Confident	76 Å²	76	59.7 Å²	59.7	49%	0.494	31%	0.305	S	S	.	.	S	Bend	trans	-51.4	149.6	167.9	-21	31.3	0	0	0	110.8	E324	P322-E324 PolarHBondContact O-N 2.9Å; P322-E324 VanDerWaalsContact O-N 3.07Å
323	P	64.1	Low	78.1	Confident	45 Å²	45	53.5 Å²	53.5	29%	0.292	28%	0.282	S	S	.	.			trans	-53.9	117.7	-180	-16.7	23.5	0	0	0	111.1	L287 A298 L319 L325	L287-P323 HydrophobicContact CD1-CB 3.84Å; L287-P323 HydrophobicContact CD1-CG 4.2Å; A298-P323 HydrophobicContact CB-CG 3.32Å; L319-P323 HydrophobicContact CD1-CB 4.33Å; L319-P323 HydrophobicContact CD1-CG 3.68Å; P323-L325 PolarHBondContact O-N 3.49Å
324	E	58.8	Low	78.9	Confident	147 Å²	147	49.9 Å²	49.9	69%	0.687	26%	0.256	S	S	*	.			trans	-81.1	107.6	175.3	-70	-179.4	-172.7	0	0	108.7	K321 P322 L326	K321-E324 WeakPolarHBondContact CD-OE1 3.23Å; K321-E324 IonicContact NZ-OE1 2.74Å; P322-E324 PolarHBondContact O-N 2.9Å; P322-E324 VanDerWaalsContact O-N 3.07Å; E324-L326 PolarHBondContact O-N 3.43Å
325	L	55.8	Low	79.5	Confident	142 Å²	142	48.2 Å²	48.2	74%	0.743	24%	0.243	S	C	*	.			trans	48.5	62	159.1	-65.1	162.9	0	0	0	118.1	P323	P323-L325 PolarHBondContact O-N 3.49Å
326	L	57.4	Low	79.5	Confident	56 Å²	56	49.3 Å²	49.3	29%	0.293	25%	0.253	S	S	.	.	S	Bend	trans	-86.5	156.7	144.3	-72.3	174.6	0	0	0	109	L287 N289 E324 L328	L287-L326 HydrophobicContact CB-CB 3.74Å; L287-L326 HydrophobicContact CB-CD1 3.72Å; L287-L326 HydrophobicContact CB-CG 4.39Å; L287-L326 HydrophobicContact CD1-CB 4.3Å; L287-L326 HydrophobicContact CD1-CD1 3.84Å; L287-L326 HydrophobicContact CD2-CB 4.2Å; L287-L326 HydrophobicContact CG-CB 4.28Å; L287-L326 HydrophobicContact CG-CD1 4.37Å; N289-L326 HydrophobicContact CB-CD2 4.43Å; E324-L326 PolarHBondContact O-N 3.43Å; L326-L328 PolarHBondContact O-N 2.93Å
327	L	67.1	Low	78.9	Confident	50 Å²	50	52.9 Å²	52.9	26%	0.262	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	115.9	174	-77.4	-174.6	0	0	0	108.7	F288 M290 S329	F288-L327 HydrophobicContact CB-CB 4.45Å; F288-L327 HydrophobicContact CD1-CD1 4.4Å; F288-L327 PolarHBondContact N-O 3.06Å; M290-L327 HydrophobicContact CE-CD1 3.33Å; M290-L327 HydrophobicContact CE-CD2 4.21Å; M290-L327 HydrophobicContact CE-CG 3.71Å; M290-L327 HydrophobicContact CG-CD1 3.68Å; M290-L327 HydrophobicContact SD-CD1 3.52Å; M290-L327 VanDerWaalsContact SD-CD1 3.52Å; L327-S329 PolarHBondContact O-N 3.49Å
328	L	82.2	Confident	77.5	Confident	40 Å²	40	59.1 Å²	59.1	21%	0.209	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	118.4	176.9	-64.4	170.4	0	0	0	108	M258 L266 V269 L287 L326 L331	M258-L328 CarbonylContact C-O 3.45Å; M258-L328 HydrophobicContact CB-CB 3.81Å; M258-L328 VanDerWaalsContact CB-O 3.25Å; M258-L328 WeakPolarHBondContact CB-O 3.4Å; M258-L328 HydrophobicContact CG-CB 4.2Å; L266-L328 HydrophobicContact CD1-CD1 3.92Å; V269-L328 HydrophobicContact CG2-CD1 3.54Å; L287-L328 HydrophobicContact CD2-CD2 3.77Å; L326-L328 PolarHBondContact O-N 2.93Å; L328-L331 HydrophobicContact CD1-CD2 4.38Å; L328-L331 HydrophobicContact CD2-CD2 4.05Å
329	S	86.4	Confident	75.3	Confident	7 Å²	7	70 Å²	70	5%	0.049	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-50.8	173.1	179	0	0	0	0	109.9	E164 M258 Q259 T286 L327	E164-S329 WeakPolarHBondContact CG-OG 3.37Å; M258-S329 WeakPolarHBondContact CA-O 3.46Å; M258-S329 WeakPolarHBondContact CB-O 3.31Å; M258-S329 PolarHBondContact N-O 2.83Å; Q259-S329 PolarHBondContact N-O 3.21Å; T286-S329 PolarHBondContact O-N 2.9Å; T286-S329 WeakPolarHBondContact OG1-CB 3.32Å; L327-S329 PolarHBondContact O-N 3.49Å
330	S	89.4	Confident	74.9	Confident	1 Å²	1	71.5 Å²	71.5	1%	0.007	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	146.1	179.4	-52.5	0	0	0	0	110.8	E164 L256 A285 T286	E164-S330 PolarHBondContact OE1-OG 3.06Å; L256-S330 WeakPolarHBondContact O-CA 2.91Å; A285-S330 CarbonylContact C-O 3.52Å; A285-S330 VanDerWaalsContact CA-O 3.23Å; A285-S330 WeakPolarHBondContact CA-O 3.18Å; T286-S330 PolarHBondContact N-O 2.87Å; T286-S330 PolarHBondContact O-N 2.88Å; T286-S330 WeakPolarHBondContact OG1-CB 3.31Å; T286-S330 PolarHBondContact OG1-N 3.03Å; T286-S330 VanDerWaalsContact OG1-N 3.13Å; T286-S330 PolarHBondContact OG1-OG 2.72Å
331	L	91.3	Very high	75.3	Confident	2 Å²	2	68.1 Å²	68.1	1%	0.01	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	135.5	168.6	-65	171.1	0	0	0	110	I215 I255 L256 M258 V269 L282 A285 L328 Y333	I215-L331 HydrophobicContact CD1-CD1 4.02Å; I255-L331 CarbonylContact C-O 3.32Å; I255-L331 VanDerWaalsContact CA-O 3.28Å; I255-L331 WeakPolarHBondContact CA-O 3.49Å; L256-L331 HydrophobicContact CB-CB 4.39Å; L256-L331 PolarHBondContact N-O 2.86Å; L256-L331 PolarHBondContact O-N 2.88Å; M258-L331 HydrophobicContact CE-CD1 4.01Å; M258-L331 HydrophobicContact CG-CB 4.38Å; M258-L331 HydrophobicContact CG-CD1 3.86Å; M258-L331 HydrophobicContact CG-CG 3.67Å; M258-L331 HydrophobicContact SD-CD1 3.77Å; M258-L331 HydrophobicContact SD-CG 4.21Å; V269-L331 HydrophobicContact CG1-CD1 3.61Å; V269-L331 HydrophobicContact CG1-CD2 3.86Å; V269-L331 HydrophobicContact CG1-CG 4.4Å; L282-L331 HydrophobicContact CD1-CB 4.18Å; L282-L331 HydrophobicContact CD1-CD2 3.93Å; A285-L331 HydrophobicContact CB-CD2 4.03Å; L328-L331 HydrophobicContact CD1-CD2 4.38Å; L328-L331 HydrophobicContact CD2-CD2 4.05Å; L331-Y333 HydrophobicContact CB-CD2 4.19Å; L331-Y333 HydrophobicContact CB-CE2 3.62Å; L331-Y333 HydrophobicContact CD1-CE2 4.11Å; L331-Y333 HydrophobicContact CG-CE2 4.48Å
332	V	93.3	Very high	75.8	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.006	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	113.3	-176.5	-168.1	0	0	0	0	109.6	I94 I98 F168 F253 I255 E283 G284	I94-V332 HydrophobicContact CD1-CG2 4.47Å; I94-V332 HydrophobicContact CG2-CB 4.42Å; I94-V332 HydrophobicContact CG2-CG1 4.2Å; I94-V332 HydrophobicContact CG2-CG2 4.19Å; I98-V332 HydrophobicContact CD1-CG1 3.8Å; F168-V332 HydrophobicContact CD1-CG2 4.22Å; F168-V332 HydrophobicContact CE1-CG2 3.81Å; F253-V332 HydrophobicContact CD2-CG1 4.34Å; I255-V332 HydrophobicContact CG1-CG1 4.18Å; I255-V332 HydrophobicContact CG1-CG2 4.22Å; E283-V332 PolarHBondContact N-O 2.83Å; G284-V332 PolarHBondContact N-O 3.22Å; G284-V332 VanDerWaalsContact N-O 3.17Å; G284-V332 WeakPolarHBondContact O-CA 3.34Å; G284-V332 PolarHBondContact O-N 2.74Å
333	Y	94.1	Very high	76.4	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	125.8	-179.6	-72.3	-92.8	0	0	0	110.1	F253 V254 L256 P270 L273 L281 L282 L331	F253-Y333 CarbonylContact C-O 3.43Å; F253-Y333 WeakPolarHBondContact CA-O 3.17Å; F253-Y333 VanDerWaalsContact CB-O 3.31Å; F253-Y333 WeakPolarHBondContact CB-O 3.16Å; V254-Y333 PolarHBondContact N-O 2.88Å; V254-Y333 PolarHBondContact O-N 3.2Å; L256-Y333 HydrophobicContact CD1-CD2 4.06Å; L256-Y333 HydrophobicContact CD1-CE2 3.62Å; L256-Y333 HydrophobicContact CG-CD2 4.21Å; L256-Y333 HydrophobicContact CG-CE2 4.19Å; P270-Y333 VanDerWaalsContact O-CE1 3.31Å; P270-Y333 WeakPolarHBondContact O-CE1 3.23Å; P270-Y333 PolarHBondContact O-OH 3.48Å; L273-Y333 HydrophobicContact CB-CD1 3.65Å; L273-Y333 HydrophobicContact CB-CE1 3.75Å; L273-Y333 HydrophobicContact CB-CG 4.2Å; L273-Y333 HydrophobicContact CD2-CD1 4.36Å; L273-Y333 HydrophobicContact CD2-CD2 4.08Å; L273-Y333 HydrophobicContact CD2-CE2 4.34Å; L273-Y333 HydrophobicContact CD2-CG 4.09Å; L281-Y333 CarbonylContact O-C 3.56Å; L281-Y333 WeakPolarHBondContact O-CA 3.44Å; L282-Y333 HydrophobicContact CB-CD1 4.04Å; L282-Y333 HydrophobicContact CB-CE1 3.72Å; L282-Y333 HydrophobicContact CD1-CD2 4.44Å; L282-Y333 HydrophobicContact CD1-CE1 4.17Å; L282-Y333 HydrophobicContact CD1-CE2 4.07Å; L331-Y333 HydrophobicContact CB-CD2 4.19Å; L331-Y333 HydrophobicContact CB-CE2 3.62Å; L331-Y333 HydrophobicContact CD1-CE2 4.11Å; L331-Y333 HydrophobicContact CG-CE2 4.48Å
334	I	94.2	Very high	77.1	Confident	9 Å²	9	65.1 Å²	65.1	5%	0.046	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	140.8	178.4	-63.7	177.4	0	0	0	110	I98 F105 F253 Y280 L281 E283 A336	I98-I334 HydrophobicContact CB-CD1 4.35Å; I98-I334 HydrophobicContact CD1-CD1 4.47Å; I98-I334 HydrophobicContact CD1-CG1 4.48Å; I98-I334 HydrophobicContact CG1-CD1 3.66Å; I98-I334 HydrophobicContact CG1-CG1 4.18Å; I98-I334 HydrophobicContact CG2-CD1 4.31Å; F105-I334 HydrophobicContact CE2-CG2 3.37Å; F105-I334 HydrophobicContact CZ-CG2 3.68Å; F253-I334 HydrophobicContact CB-CG1 4.22Å; Y280-I334 CarbonylContact C-O 3.47Å; Y280-I334 WeakPolarHBondContact CA-O 3.41Å; Y280-I334 WeakPolarHBondContact CB-O 3.29Å; L281-I334 PolarHBondContact N-O 3.16Å; L281-I334 PolarHBondContact O-N 3.08Å; E283-I334 HydrophobicContact CB-CB 4.35Å; E283-I334 HydrophobicContact CB-CD1 3.38Å; E283-I334 HydrophobicContact CB-CG1 3.72Å; E283-I334 HydrophobicContact CG-CB 3.99Å; E283-I334 HydrophobicContact CG-CD1 3.59Å; E283-I334 HydrophobicContact CG-CG1 3.91Å; I334-A336 PolarHBondContact O-N 2.73Å
335	R	94.1	Very high	78.4	Confident	48 Å²	48	59.6 Å²	59.6	18%	0.181	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	119.6	175.9	-167	173.5	68	-138.8	-7.2	108.9	E108 P250 A252 Y280 S337	E108-R335 VanDerWaalsContact CD-NH2 3.25Å; E108-R335 IonicContact OE1-CZ 3.87Å; E108-R335 IonicContact OE1-NH2 2.77Å; E108-R335 PolarHBondContact OE1-NH2 3.29Å; E108-R335 IonicContact OE2-CZ 3.37Å; E108-R335 IonicContact OE2-NH1 2.97Å; E108-R335 PolarHBondContact OE2-NH1 3.19Å; E108-R335 IonicContact OE2-NH2 2.95Å; E108-R335 PolarHBondContact OE2-NH2 2.74Å; P250-R335 PolarHBondContact O-NH1 3.38Å; A252-R335 WeakPolarHBondContact O-CB 3.27Å; A252-R335 PolarHBondContact O-N 3.47Å; Y280-R335 VanDerWaalsContact CD1-CA 3.44Å; Y280-R335 HydrophobicContact CD1-CB 4.01Å; Y280-R335 HydrophobicContact CE1-CB 3.56Å; Y280-R335 HydrophobicContact CE1-CG 4.13Å; Y280-R335 HydrophobicContact CE2-CG 4.37Å; R335-S337 PolarHBondContact O-N 2.68Å
336	A	90.6	Very high	80	Confident	24 Å²	24	53.7 Å²	53.7	20%	0.198	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-59.9	134.4	177.7	0	0	0	0	0	109	R279 L281 I334	R279-A336 HydrophobicContact CB-CB 4.22Å; R279-A336 HydrophobicContact CG-CB 4.38Å; R279-A336 VanDerWaalsContact O-CB 3.27Å; R279-A336 WeakPolarHBondContact O-CB 3.3Å; R279-A336 PolarHBondContact O-N 2.75Å; L281-A336 HydrophobicContact CD1-CB 4.39Å; L281-A336 HydrophobicContact CD2-CB 4.48Å; L281-A336 HydrophobicContact CG-CB 4.11Å; I334-A336 PolarHBondContact O-N 2.73Å
337	S	79.3	Confident	81.7	Confident	75 Å²	75	53.5 Å²	53.5	52%	0.524	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-70.1	134.6	166.1	-20.2	0	0	0	0	107.6	R335 K339	R335-S337 PolarHBondContact O-N 2.68Å; S337-K339 PolarHBondContact O-N 3.44Å
338	D	59.2	Low	82.9	Confident	176 Å²	176	53.8 Å²	53.8	94%	0.941	28%	0.276	S	S	*	.			trans	-64.5	90	162.7	-62.5	-36.2	0	0	0	106.6
339	K	41.3	Very low	83	Confident	263 Å²	263	55.1 Å²	55.1	100%	1.143	28%	0.282	S	S	*	.			trans	-82.1	0	171.4	-82	-172	179.5	174.6	0	110.2	S337	S337-K339 PolarHBondContact O-N 3.44Å

Retrieved 339 of 339 residues in 503.6 ms (Link to these results)

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