A0A5K4F1T7_SCHMA Loading...

TFIIIC_sub6 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F1T7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 310 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	28.8	Very low	23.6	Very low	247 Å²	247	151.3 Å²	151.3	100%	1.217	82%	0.819	S	S	*	*				0	113.8	0	-155.7	169	86.3	0	0	106.3
2	L	24.6	Very low	23.9	Very low	174 Å²	174	143.9 Å²	143.9	91%	0.911	81%	0.805	S	S	*	*			trans	-62.4	134.9	-160.1	-96.3	82.5	0	0	0	113.7	S4	L2-S4 PolarHBondContact O-N 3.36Å
3	L	20.6	Very low	24.5	Very low	152 Å²	152	149.3 Å²	149.3	80%	0.796	82%	0.815	S	S	*	*			trans	-55.3	115	160.8	-134.1	84.7	0	0	0	109.2	L5	L3-L5 HydrophobicContact CD2-CD1 4.01Å
4	S	24	Very low	25.2	Very low	119 Å²	119	148.6 Å²	148.6	83%	0.832	80%	0.801	S	S	*	*			trans	-94.9	97	160.9	63.4	0	0	0	0	109.4	L2	L2-S4 PolarHBondContact O-N 3.36Å
5	L	22.1	Very low	25.7	Very low	129 Å²	129	147.6 Å²	147.6	68%	0.675	79%	0.789	S	S	*	*			trans	-61.3	151.9	145.9	-107.9	82.2	0	0	0	108.3	L3	L3-L5 HydrophobicContact CD2-CD1 4.01Å
6	N	23	Very low	26.4	Very low	148 Å²	148	142.9 Å²	142.9	79%	0.791	76%	0.762	S	S	*	*			trans	98.4	82.6	169.9	-51.2	-46	0	0	0	116.5
7	L	22	Very low	26.8	Very low	157 Å²	157	139.5 Å²	139.5	82%	0.822	74%	0.744	S	S	*	*				-155.6	85.5	122.4	-150.8	69.2	0	0	0	110	L9	L7-L9 HydrophobicContact CD2-CD1 4.15Å; L7-L9 HydrophobicContact CG-CD1 4.17Å; L7-L9 PolarHBondContact O-N 2.78Å
8	L	22.8	Very low	27.2	Very low	144 Å²	144	140.1 Å²	140.1	75%	0.754	74%	0.735	S	S	*	*			trans	-79.8	86.3	167.4	-168	81.2	0	0	0	107.2
9	L	22.3	Very low	27.8	Very low	145 Å²	145	134.5 Å²	134.5	76%	0.759	71%	0.712	S	S	*	*			trans	-86.2	112	170.9	-134.9	97	0	0	0	109.1	L7	L7-L9 HydrophobicContact CD2-CD1 4.15Å; L7-L9 HydrophobicContact CG-CD1 4.17Å; L7-L9 PolarHBondContact O-N 2.78Å
10	I	26	Very low	28.4	Very low	139 Å²	139	129.1 Å²	129.1	71%	0.713	68%	0.683	S	S	*	*			trans	-75.4	116.2	178.4	-64.7	162.1	0	0	0	108.3
11	C	23.6	Very low	29	Very low	110 Å²	110	128.4 Å²	128.4	74%	0.743	68%	0.679	S	S	*	*			trans	-150.6	134.5	155.8	-146.5	0	0	0	0	110.6
12	G	27.4	Very low	29.9	Very low	63 Å²	63	122.1 Å²	122.1	65%	0.649	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	156	-162	0	0	0	0	0	115.8	F14	G12-F14 PolarHBondContact O-N 2.85Å
13	K	32	Very low	31.2	Very low	214 Å²	214	114.9 Å²	114.9	93%	0.93	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.5	-13.4	176.3	-67.3	-177.3	173.5	178.3	0	119
14	F	33.2	Very low	32.6	Very low	140 Å²	140	109.3 Å²	109.3	61%	0.614	58%	0.58	S	S	*	*			trans	-105.1	1.1	-174.6	-87.1	-84.8	0	0	0	117.3	G12 I16 L17 Y18	G12-F14 PolarHBondContact O-N 2.85Å; F14-I16 VanDerWaalsContact C-N 3.32Å; F14-I16 PolarHBondContact O-N 2.98Å; F14-L17 HydrophobicContact CD1-CB 4.21Å; F14-L17 HydrophobicContact CD1-CD2 4.11Å; F14-L17 HydrophobicContact CE1-CD2 4.02Å; F14-L17 PolarHBondContact O-N 3.1Å; F14-Y18 PolarHBondContact O-N 3.39Å
15	Q	33.7	Very low	33.8	Very low	133 Å²	133	105.9 Å²	105.9	62%	0.621	56%	0.56	S	S	*	*	H	α-helix	trans	-62.1	-36	-174.5	-73	-143.8	-19.4	0	0	114.3	Y18 A19	Q15-Y18 PolarHBondContact O-N 3.08Å; Q15-A19 WeakPolarHBondContact O-CB 3.48Å; Q15-A19 PolarHBondContact O-N 3.07Å
16	I	36.5	Very low	35.4	Very low	72 Å²	72	102.6 Å²	102.6	37%	0.369	55%	0.545	S	S	.	.	H	α-helix	trans	-66.2	-44.5	179	-70	154.8	0	0	0	110.4	F14 Y18 A19 I20	F14-I16 VanDerWaalsContact C-N 3.32Å; F14-I16 PolarHBondContact O-N 2.98Å; I16-Y18 PolarHBondContact O-N 2.83Å; I16-A19 PolarHBondContact O-N 3.2Å; I16-I20 HydrophobicContact CG2-CD1 3.52Å; I16-I20 HydrophobicContact CG2-CG1 4.45Å; I16-I20 WeakPolarHBondContact O-CB 3.21Å; I16-I20 WeakPolarHBondContact O-CD1 3.38Å; I16-I20 WeakPolarHBondContact O-CG1 3.25Å; I16-I20 PolarHBondContact O-N 2.99Å
17	L	32.9	Very low	36.7	Very low	85 Å²	85	97.2 Å²	97.2	45%	0.445	52%	0.515	S	S	.	.	H	α-helix	trans	-67.8	-38	-179.9	-147.7	82.8	0	0	0	111.9	F14 I20 L21	F14-L17 HydrophobicContact CD1-CB 4.21Å; F14-L17 HydrophobicContact CD1-CD2 4.11Å; F14-L17 HydrophobicContact CE1-CD2 4.02Å; F14-L17 PolarHBondContact O-N 3.1Å; L17-I20 PolarHBondContact O-N 2.94Å; L17-L21 HydrophobicContact CD2-CD1 4.38Å; L17-L21 HydrophobicContact CG-CD1 4.33Å; L17-L21 WeakPolarHBondContact O-CB 3.4Å; L17-L21 WeakPolarHBondContact O-CG 3.29Å; L17-L21 PolarHBondContact O-N 3.42Å
18	Y	34.6	Very low	38.2	Very low	150 Å²	150	93.9 Å²	93.9	59%	0.588	50%	0.497	S	S	*	.	H	α-helix	trans	-69.1	-40.3	179.3	-168.7	-95	0	0	0	112	F14 Q15 I16 L21 K22	F14-Y18 PolarHBondContact O-N 3.39Å; Q15-Y18 PolarHBondContact O-N 3.08Å; I16-Y18 PolarHBondContact O-N 2.83Å; Y18-L21 PolarHBondContact O-N 2.73Å; Y18-K22 HydrophobicContact CD1-CD 4.38Å; Y18-K22 HydrophobicContact CE1-CD 3.64Å; Y18-K22 VanDerWaalsContact O-CB 3.26Å; Y18-K22 WeakPolarHBondContact O-CB 3.35Å; Y18-K22 PolarHBondContact O-N 2.65Å; Y18-K22 PolarHBondContact OH-NZ 2.84Å; Y18-K22 VanDerWaalsContact OH-NZ 3.15Å
19	A	37.7	Very low	39.7	Very low	35 Å²	35	92 Å²	92	29%	0.289	49%	0.488	S	S	.	.	H	α-helix	trans	-64	-44	172.5	0	0	0	0	0	111.3	Q15 I16 L21 K22 V23 V59	Q15-A19 WeakPolarHBondContact O-CB 3.48Å; Q15-A19 PolarHBondContact O-N 3.07Å; I16-A19 PolarHBondContact O-N 3.2Å; A19-L21 VanDerWaalsContact C-N 3.31Å; A19-L21 PolarHBondContact O-N 2.86Å; A19-K22 PolarHBondContact O-N 3.29Å; A19-V23 WeakPolarHBondContact O-CB 3.32Å; A19-V23 VanDerWaalsContact O-CG2 3.27Å; A19-V23 WeakPolarHBondContact O-CG2 3.41Å; A19-V23 PolarHBondContact O-N 2.83Å; A19-V23 VanDerWaalsContact O-N 3.1Å; A19-V59 HydrophobicContact CB-CG2 4.49Å
20	I	39.6	Very low	41.2	Very low	26 Å²	26	86.5 Å²	86.5	13%	0.133	46%	0.46	C	S	.	.	H	α-helix	trans	-65.5	-28.8	177.7	-69.1	166	0	0	0	112.7	I16 L17 P24 I70 M73	I16-I20 HydrophobicContact CG2-CD1 3.52Å; I16-I20 HydrophobicContact CG2-CG1 4.45Å; I16-I20 WeakPolarHBondContact O-CB 3.21Å; I16-I20 WeakPolarHBondContact O-CD1 3.38Å; I16-I20 WeakPolarHBondContact O-CG1 3.25Å; I16-I20 PolarHBondContact O-N 2.99Å; L17-I20 PolarHBondContact O-N 2.94Å; I20-P24 WeakPolarHBondContact O-CD 3.19Å; I20-P24 WeakPolarHBondContact O-CG 3.41Å; I20-I70 HydrophobicContact CD1-CG2 3.58Å; I20-M73 HydrophobicContact CG2-CE 3.54Å
21	L	42.1	Very low	42.3	Very low	115 Å²	115	84 Å²	84	60%	0.602	45%	0.447	S	S	*	.	H	α-helix	trans	-85.2	-33.3	176.7	-82.2	161.2	0	0	0	112.6	L17 Y18 A19 P24 A25	L17-L21 HydrophobicContact CD2-CD1 4.38Å; L17-L21 HydrophobicContact CG-CD1 4.33Å; L17-L21 WeakPolarHBondContact O-CB 3.4Å; L17-L21 WeakPolarHBondContact O-CG 3.29Å; L17-L21 PolarHBondContact O-N 3.42Å; Y18-L21 PolarHBondContact O-N 2.73Å; A19-L21 VanDerWaalsContact C-N 3.31Å; A19-L21 PolarHBondContact O-N 2.86Å; L21-P24 WeakPolarHBondContact O-CD 3.45Å; L21-A25 WeakPolarHBondContact O-CB 3.32Å; L21-A25 PolarHBondContact O-N 3.25Å
22	K	47.2	Very low	43.5	Very low	114 Å²	114	84.6 Å²	84.6	50%	0.496	44%	0.443	S	S	.	.	H	α-helix	trans	-75.3	-33.2	-177.3	-157.7	160	-171.6	169.8	0	112.3	Y18 A19 A25 T26	Y18-K22 HydrophobicContact CD1-CD 4.38Å; Y18-K22 HydrophobicContact CE1-CD 3.64Å; Y18-K22 VanDerWaalsContact O-CB 3.26Å; Y18-K22 WeakPolarHBondContact O-CB 3.35Å; Y18-K22 PolarHBondContact O-N 2.65Å; Y18-K22 PolarHBondContact OH-NZ 2.84Å; Y18-K22 VanDerWaalsContact OH-NZ 3.15Å; A19-K22 PolarHBondContact O-N 3.29Å; K22-A25 PolarHBondContact O-N 2.85Å; K22-T26 PolarHBondContact O-N 3.23Å; K22-T26 PolarHBondContact O-OG1 3.32Å
23	V	51.2	Low	44.4	Very low	23 Å²	23	90 Å²	90	14%	0.139	45%	0.445	C	S	.	.	H	α-helix	trans	-64.7	-49.8	177.9	164	0	0	0	0	112.7	A19 A25 T26 F27 V52 L56	A19-V23 WeakPolarHBondContact O-CB 3.32Å; A19-V23 VanDerWaalsContact O-CG2 3.27Å; A19-V23 WeakPolarHBondContact O-CG2 3.41Å; A19-V23 PolarHBondContact O-N 2.83Å; A19-V23 VanDerWaalsContact O-N 3.1Å; V23-A25 PolarHBondContact O-N 2.83Å; V23-T26 PolarHBondContact O-N 2.9Å; V23-T26 PolarHBondContact O-OG1 2.86Å; V23-F27 VanDerWaalsContact O-CB 3.26Å; V23-F27 WeakPolarHBondContact O-CB 3.49Å; V23-F27 PolarHBondContact O-N 3.46Å; V23-V52 HydrophobicContact CG1-CG1 3.64Å; V23-L56 HydrophobicContact CG1-CD1 3.61Å; V23-L56 HydrophobicContact CG1-CG 4.19Å
24	P	50.4	Low	44.7	Very low	34 Å²	34	84.2 Å²	84.2	22%	0.221	43%	0.432	C	S	.	.	H	α-helix	trans	-62.8	-39.5	172.4	-21.9	31	0	0	0	112.4	I20 L21 F27 I28	I20-P24 WeakPolarHBondContact O-CD 3.19Å; I20-P24 WeakPolarHBondContact O-CG 3.41Å; L21-P24 WeakPolarHBondContact O-CD 3.45Å; P24-F27 PolarHBondContact O-N 3Å; P24-I28 VanDerWaalsContact O-CB 3.29Å; P24-I28 WeakPolarHBondContact O-CB 3.5Å; P24-I28 WeakPolarHBondContact O-CG1 3.45Å; P24-I28 PolarHBondContact O-N 2.94Å
25	A	49.5	Very low	45.2	Very low	48 Å²	48	86 Å²	86	40%	0.397	45%	0.447	S	S	.	.	H	α-helix	trans	-62.1	-46.3	178.4	0	0	0	0	0	111.5	L21 K22 V23 I28 D29	L21-A25 WeakPolarHBondContact O-CB 3.32Å; L21-A25 PolarHBondContact O-N 3.25Å; K22-A25 PolarHBondContact O-N 2.85Å; V23-A25 PolarHBondContact O-N 2.83Å; A25-I28 PolarHBondContact O-N 2.74Å; A25-D29 WeakPolarHBondContact O-CB 3.39Å; A25-D29 PolarHBondContact O-N 2.97Å
26	T	55.1	Low	45.2	Very low	60 Å²	60	88.1 Å²	88.1	37%	0.368	45%	0.454	S	S	.	.	H	α-helix	trans	-66.9	-35.8	174.6	29.6	0	0	0	0	112.6	K22 V23 D29 V30	K22-T26 PolarHBondContact O-N 3.23Å; K22-T26 PolarHBondContact O-OG1 3.32Å; V23-T26 PolarHBondContact O-N 2.9Å; V23-T26 PolarHBondContact O-OG1 2.86Å; T26-D29 PolarHBondContact O-N 2.79Å; T26-V30 WeakPolarHBondContact O-CB 3.45Å; T26-V30 VanDerWaalsContact O-CG2 3.23Å; T26-V30 WeakPolarHBondContact O-CG2 3.24Å; T26-V30 PolarHBondContact O-N 2.88Å
27	F	52	Low	45.2	Very low	35 Å²	35	91 Å²	91	15%	0.154	47%	0.47	C	S	.	.	H	α-helix	trans	-66.6	-41.9	175.5	-172.3	-100.1	0	0	0	112.3	V23 P24 V30 L31 L49	V23-F27 VanDerWaalsContact O-CB 3.26Å; V23-F27 WeakPolarHBondContact O-CB 3.49Å; V23-F27 PolarHBondContact O-N 3.46Å; P24-F27 PolarHBondContact O-N 3Å; F27-V30 PolarHBondContact O-N 3.46Å; F27-L31 HydrophobicContact CD1-CD1 3.71Å; F27-L31 HydrophobicContact CD1-CG 4.34Å; F27-L31 HydrophobicContact CE1-CD1 3.38Å; F27-L31 HydrophobicContact CE1-CG 4.15Å; F27-L31 HydrophobicContact CZ-CD1 4.11Å; F27-L31 WeakPolarHBondContact O-CG 3.14Å; F27-L31 PolarHBondContact O-N 2.93Å; F27-L49 HydrophobicContact CD2-CD2 4.43Å; F27-L49 HydrophobicContact CE2-CD2 4Å
28	I	53.2	Low	45.5	Very low	86 Å²	86	98.5 Å²	98.5	44%	0.441	49%	0.492	S	S	.	.	H	α-helix	trans	-67	-40.4	175.7	-70.7	168.9	0	0	0	110.6	P24 A25 V30 L31 N32	P24-I28 VanDerWaalsContact O-CB 3.29Å; P24-I28 WeakPolarHBondContact O-CB 3.5Å; P24-I28 WeakPolarHBondContact O-CG1 3.45Å; P24-I28 PolarHBondContact O-N 2.94Å; A25-I28 PolarHBondContact O-N 2.74Å; I28-V30 VanDerWaalsContact C-N 3.32Å; I28-V30 PolarHBondContact O-N 3.45Å; I28-L31 PolarHBondContact O-N 2.84Å; I28-N32 VanDerWaalsContact CG2-ND2 3.34Å; I28-N32 WeakPolarHBondContact CG2-ND2 3.48Å; I28-N32 VanDerWaalsContact O-CB 3.3Å; I28-N32 WeakPolarHBondContact O-CB 3.33Å; I28-N32 PolarHBondContact O-N 3.4Å; I28-N32 PolarHBondContact O-ND2 3.05Å
29	D	53.4	Low	45.8	Very low	106 Å²	106	98.3 Å²	98.3	57%	0.567	50%	0.501	S	S	*	.	H	α-helix	trans	-63.6	-38.1	175.3	-77.9	-20.5	0	0	0	111.9	A25 T26 Y33	A25-D29 WeakPolarHBondContact O-CB 3.39Å; A25-D29 PolarHBondContact O-N 2.97Å; T26-D29 PolarHBondContact O-N 2.79Å; D29-Y33 PolarHBondContact O-N 3.41Å; D29-Y33 VanDerWaalsContact O-N 3.16Å
30	V	54.8	Low	46	Very low	29 Å²	29	99.5 Å²	99.5	18%	0.176	52%	0.517	C	S	.	.	H	α-helix	trans	-67.1	-40	173.7	169.6	0	0	0	0	111.1	T26 F27 I28 L49	T26-V30 WeakPolarHBondContact O-CB 3.45Å; T26-V30 VanDerWaalsContact O-CG2 3.23Å; T26-V30 WeakPolarHBondContact O-CG2 3.24Å; T26-V30 PolarHBondContact O-N 2.88Å; F27-V30 PolarHBondContact O-N 3.46Å; I28-V30 VanDerWaalsContact C-N 3.32Å; I28-V30 PolarHBondContact O-N 3.45Å; V30-L49 HydrophobicContact CG1-CD1 4.42Å
31	L	47.4	Very low	46.3	Very low	85 Å²	85	101 Å²	101	45%	0.445	52%	0.524	S	S	.	.	H	α-helix	trans	-70.7	-33.7	177	-73.8	177	0	0	0	113.4	F27 I28 Y33 Y84	F27-L31 HydrophobicContact CD1-CD1 3.71Å; F27-L31 HydrophobicContact CD1-CG 4.34Å; F27-L31 HydrophobicContact CE1-CD1 3.38Å; F27-L31 HydrophobicContact CE1-CG 4.15Å; F27-L31 HydrophobicContact CZ-CD1 4.11Å; F27-L31 WeakPolarHBondContact O-CG 3.14Å; F27-L31 PolarHBondContact O-N 2.93Å; I28-L31 PolarHBondContact O-N 2.84Å; L31-Y33 VanDerWaalsContact C-N 3.34Å; L31-Y84 HydrophobicContact CD2-CE2 4.23Å
32	N	50.3	Low	46.4	Very low	124 Å²	124	99.1 Å²	99.1	66%	0.663	51%	0.514	S	S	*	.	H	α-helix	trans	-82.3	-9.9	179.6	-80.9	-31.7	0	0	0	113.4	I28 S34	I28-N32 VanDerWaalsContact CG2-ND2 3.34Å; I28-N32 WeakPolarHBondContact CG2-ND2 3.48Å; I28-N32 VanDerWaalsContact O-CB 3.3Å; I28-N32 WeakPolarHBondContact O-CB 3.33Å; I28-N32 PolarHBondContact O-N 3.4Å; I28-N32 PolarHBondContact O-ND2 3.05Å; N32-S34 PolarHBondContact O-N 3.31Å; N32-S34 VanDerWaalsContact O-N 3.12Å
33	Y	45.8	Very low	46.4	Very low	177 Å²	177	99.1 Å²	99.1	69%	0.694	52%	0.524	S	S	*	.	S	Bend	trans	-70.2	112.4	177.6	-140.6	-95.5	0	0	0	110.4	D29 L31 L35	D29-Y33 PolarHBondContact O-N 3.41Å; D29-Y33 VanDerWaalsContact O-N 3.16Å; L31-Y33 VanDerWaalsContact C-N 3.34Å; Y33-L35 PolarHBondContact O-N 3.42Å
34	S	37.2	Very low	46.2	Very low	92 Å²	92	103.1 Å²	103.1	64%	0.643	54%	0.544	S	S	*	.			trans	-56.8	127.8	-173.2	-169.8	0	0	0	0	112.1	N32 K36	N32-S34 PolarHBondContact O-N 3.31Å; N32-S34 VanDerWaalsContact O-N 3.12Å; S34-K36 PolarHBondContact O-N 3.42Å
35	L	43.9	Very low	46.3	Very low	177 Å²	177	103.8 Å²	103.8	93%	0.927	55%	0.546	S	S	*	.	S	Bend	trans	-68.1	43.3	-177.5	-143.3	117.9	0	0	0	113.5	Y33	Y33-L35 PolarHBondContact O-N 3.42Å
36	K	35.3	Very low	46.4	Very low	177 Å²	177	104.6 Å²	104.6	77%	0.77	54%	0.539	S	S	*	.			trans	-110.6	-0.9	-167.6	-126.2	179.5	-175.2	-179.8	0	116.1	S34	S34-K36 PolarHBondContact O-N 3.42Å
37	N	35.9	Very low	46.4	Very low	134 Å²	134	107.4 Å²	107.4	72%	0.717	55%	0.551	S	S	*	*	S	Bend	trans	-129.4	126.3	176.3	-89.1	-22.7	0	0	0	114.4	I41	N37-I41 HydrophobicContact CB-CD1 4Å
38	R	39.8	Very low	46.7	Very low	241 Å²	241	110.1 Å²	110.1	91%	0.909	56%	0.564	S	S	*	*			trans	-72.7	144.1	-170.9	-76.4	-176.4	170.6	-163	-1.7	113.1	G40	R38-G40 VanDerWaalsContact C-N 3.33Å; R38-G40 PolarHBondContact O-N 2.84Å
39	L	39.2	Very low	47	Very low	146 Å²	146	106.8 Å²	106.8	76%	0.764	55%	0.547	S	S	*	.	S	Bend	trans	68.7	-31.2	155.4	-125.5	71.5	0	0	0	119.9
40	G	43.6	Very low	47.6	Very low	61 Å²	61	103.7 Å²	103.7	63%	0.629	53%	0.534	S	S	*	.	S	Bend	trans	-87.3	-19.4	-178.2	0	0	0	0	0	116	R38	R38-G40 VanDerWaalsContact C-N 3.33Å; R38-G40 PolarHBondContact O-N 2.84Å
41	I	44.4	Very low	48.1	Very low	57 Å²	57	103.9 Å²	103.9	29%	0.292	54%	0.542	S	S	.	.	S	Bend	trans	-93.1	-23.6	-165.5	-61.7	175.2	0	0	0	112.5	N37 T43 L44 D45	N37-I41 HydrophobicContact CB-CD1 4Å; I41-T43 VanDerWaalsContact C-N 3.33Å; I41-T43 PolarHBondContact O-N 3.14Å; I41-L44 PolarHBondContact O-N 3.03Å; I41-D45 WeakPolarHBondContact CG2-OD2 3.19Å; I41-D45 PolarHBondContact O-N 2.81Å
42	I	45.4	Very low	49	Very low	76 Å²	76	101.1 Å²	101.1	39%	0.39	53%	0.528	S	S	.	.	H	α-helix	trans	-66.1	-33.9	-171.5	-57.7	173	0	0	0	112.4	L44 Y46	I42-L44 VanDerWaalsContact C-N 3.34Å; I42-Y46 WeakPolarHBondContact O-CB 3.26Å; I42-Y46 PolarHBondContact O-N 3.3Å; I42-Y46 VanDerWaalsContact O-N 3.14Å
43	T	46.9	Very low	49.5	Very low	113 Å²	113	96.2 Å²	96.2	69%	0.693	50%	0.502	S	S	*	.	H	α-helix	trans	-72.3	-31.4	177.1	-24.5	0	0	0	0	111.7	I41 L47	I41-T43 VanDerWaalsContact C-N 3.33Å; I41-T43 PolarHBondContact O-N 3.14Å; T43-L47 WeakPolarHBondContact O-CB 3.42Å; T43-L47 PolarHBondContact O-N 3.36Å; T43-L47 VanDerWaalsContact O-N 3.13Å
44	L	47.1	Very low	50.4	Low	107 Å²	107	92.9 Å²	92.9	56%	0.56	50%	0.495	S	S	*	.	H	α-helix	trans	-76.1	-43.4	179.6	-160.6	74.8	0	0	0	110.8	I41 I42 Y46 L47 Q48	I41-L44 PolarHBondContact O-N 3.03Å; I42-L44 VanDerWaalsContact C-N 3.34Å; L44-Y46 VanDerWaalsContact C-N 3.35Å; L44-Y46 PolarHBondContact O-N 3.04Å; L44-L47 PolarHBondContact O-N 2.87Å; L44-Q48 WeakPolarHBondContact O-CB 3.41Å; L44-Q48 WeakPolarHBondContact O-CG 3.44Å; L44-Q48 PolarHBondContact O-N 2.86Å
45	D	53.2	Low	51.5	Low	49 Å²	49	93 Å²	93	26%	0.262	49%	0.485	S	S	.	.	H	α-helix	trans	-62.7	-42.3	176.6	-67.2	-13.5	0	0	0	111.2	I41 Q48 L49	I41-D45 WeakPolarHBondContact CG2-OD2 3.19Å; I41-D45 PolarHBondContact O-N 2.81Å; D45-Q48 PolarHBondContact O-N 2.79Å; D45-L49 WeakPolarHBondContact O-CB 3.39Å; D45-L49 PolarHBondContact O-N 2.92Å
46	Y	51	Low	52.4	Low	64 Å²	64	85.1 Å²	85.1	25%	0.251	44%	0.444	S	S	.	.	H	α-helix	trans	-66.9	-39.1	177.3	-162.7	-91.3	0	0	0	112.1	I42 L44 L49 S50 I100	I42-Y46 WeakPolarHBondContact O-CB 3.26Å; I42-Y46 PolarHBondContact O-N 3.3Å; I42-Y46 VanDerWaalsContact O-N 3.14Å; L44-Y46 VanDerWaalsContact C-N 3.35Å; L44-Y46 PolarHBondContact O-N 3.04Å; Y46-L49 PolarHBondContact O-N 3.47Å; Y46-S50 WeakPolarHBondContact O-CB 3.49Å; Y46-S50 PolarHBondContact O-N 3.03Å; Y46-S50 PolarHBondContact O-OG 3.06Å; Y46-I100 HydrophobicContact CE1-CD1 4.23Å; Y46-I100 HydrophobicContact CE1-CG2 4.46Å
47	L	55.6	Low	53.6	Low	119 Å²	119	77.9 Å²	77.9	62%	0.623	42%	0.416	S	S	*	.	H	α-helix	trans	-65.7	-41.2	176.4	-161.7	72.9	0	0	0	110.9	T43 L44 S50 G51	T43-L47 WeakPolarHBondContact O-CB 3.42Å; T43-L47 PolarHBondContact O-N 3.36Å; T43-L47 VanDerWaalsContact O-N 3.13Å; L44-L47 PolarHBondContact O-N 2.87Å; L47-S50 PolarHBondContact O-N 2.77Å; L47-S50 PolarHBondContact O-OG 3.03Å; L47-G51 PolarHBondContact O-N 3.4Å
48	Q	57	Low	54.7	Low	93 Å²	93	78.3 Å²	78.3	44%	0.435	41%	0.407	S	S	.	.	H	α-helix	trans	-63.9	-46.1	174.7	-76.8	-177.7	-54.8	0	0	112	L44 D45 S50 G51 V52	L44-Q48 WeakPolarHBondContact O-CB 3.41Å; L44-Q48 WeakPolarHBondContact O-CG 3.44Å; L44-Q48 PolarHBondContact O-N 2.86Å; D45-Q48 PolarHBondContact O-N 2.79Å; Q48-S50 PolarHBondContact O-N 2.91Å; Q48-G51 PolarHBondContact O-N 3.44Å; Q48-V52 VanDerWaalsContact O-CG2 3.31Å; Q48-V52 WeakPolarHBondContact O-CG2 3.49Å; Q48-V52 PolarHBondContact O-N 2.78Å
49	L	60.3	Low	55.6	Low	15 Å²	15	68.3 Å²	68.3	8%	0.079	37%	0.373	C	S	.	.	H	α-helix	trans	-60.6	-43.4	175	-96.2	140.3	0	0	0	112	F27 V30 D45 Y46 G51 V52 M53 Y84	F27-L49 HydrophobicContact CD2-CD2 4.43Å; F27-L49 HydrophobicContact CE2-CD2 4Å; V30-L49 HydrophobicContact CG1-CD1 4.42Å; D45-L49 WeakPolarHBondContact O-CB 3.39Å; D45-L49 PolarHBondContact O-N 2.92Å; Y46-L49 PolarHBondContact O-N 3.47Å; L49-G51 PolarHBondContact O-N 2.93Å; L49-V52 PolarHBondContact O-N 2.96Å; L49-M53 VanDerWaalsContact O-CG 3.27Å; L49-M53 WeakPolarHBondContact O-CG 3.27Å; L49-M53 PolarHBondContact O-N 2.73Å; L49-Y84 HydrophobicContact CD1-CD1 4.41Å; L49-Y84 HydrophobicContact CD1-CE1 4.16Å
50	S	66.3	Low	56.6	Low	41 Å²	41	64.3 Å²	64.3	29%	0.287	35%	0.352	S	S	.	.	H	α-helix	trans	-64.9	-38.4	177.3	74	0	0	0	0	112.5	Y46 L47 Q48 M53 I54	Y46-S50 WeakPolarHBondContact O-CB 3.49Å; Y46-S50 PolarHBondContact O-N 3.03Å; Y46-S50 PolarHBondContact O-OG 3.06Å; L47-S50 PolarHBondContact O-N 2.77Å; L47-S50 PolarHBondContact O-OG 3.03Å; Q48-S50 PolarHBondContact O-N 2.91Å; S50-M53 PolarHBondContact O-N 3.44Å; S50-I54 VanDerWaalsContact O-CG1 3.28Å; S50-I54 WeakPolarHBondContact O-CG1 3.46Å; S50-I54 PolarHBondContact O-N 3.17Å
51	G	64.8	Low	57.3	Low	33 Å²	33	65.7 Å²	65.7	34%	0.34	35%	0.351	S	S	.	.	H	α-helix	trans	-65.6	-41.2	175.6	0	0	0	0	0	112.4	L47 Q48 L49 M53 I54 E55	L47-G51 PolarHBondContact O-N 3.4Å; Q48-G51 PolarHBondContact O-N 3.44Å; L49-G51 PolarHBondContact O-N 2.93Å; G51-M53 VanDerWaalsContact C-N 3.35Å; G51-M53 PolarHBondContact O-N 2.77Å; G51-I54 PolarHBondContact O-N 2.91Å; G51-E55 PolarHBondContact O-N 2.79Å; G51-E55 VanDerWaalsContact O-N 3.09Å
52	V	65.4	Low	57.7	Low	27 Å²	27	70.2 Å²	70.2	16%	0.164	37%	0.373	C	S	.	.	H	α-helix	trans	-61.3	-43.2	174.5	168.3	0	0	0	0	111.1	V23 Q48 L49 E55 L56	V23-V52 HydrophobicContact CG1-CG1 3.64Å; Q48-V52 VanDerWaalsContact O-CG2 3.31Å; Q48-V52 WeakPolarHBondContact O-CG2 3.49Å; Q48-V52 PolarHBondContact O-N 2.78Å; L49-V52 PolarHBondContact O-N 2.96Å; V52-E55 PolarHBondContact O-N 2.77Å; V52-L56 HydrophobicContact CG1-CD1 3.79Å; V52-L56 WeakPolarHBondContact O-CB 3.4Å; V52-L56 PolarHBondContact O-N 2.87Å
53	M	62	Low	57.9	Low	22 Å²	22	68.8 Å²	68.8	11%	0.108	37%	0.365	C	S	.	.	H	α-helix	trans	-66	-37.2	178.2	-70.2	-68.9	-71.5	0	0	113	L49 S50 G51 S57 L78 T104	L49-M53 VanDerWaalsContact O-CG 3.27Å; L49-M53 WeakPolarHBondContact O-CG 3.27Å; L49-M53 PolarHBondContact O-N 2.73Å; S50-M53 PolarHBondContact O-N 3.44Å; G51-M53 VanDerWaalsContact C-N 3.35Å; G51-M53 PolarHBondContact O-N 2.77Å; M53-S57 WeakPolarHBondContact O-CB 3.25Å; M53-S57 PolarHBondContact O-N 2.87Å; M53-S57 PolarHBondContact O-OG 2.56Å; M53-L78 HydrophobicContact CE-CD1 4.13Å; M53-L78 HydrophobicContact CE-CD2 4.43Å; M53-L78 HydrophobicContact CE-CG 3.81Å; M53-L78 HydrophobicContact SD-CD1 4.13Å; M53-L78 HydrophobicContact SD-CG 4.29Å; M53-T104 HydrophobicContact CE-CG2 4.48Å
54	I	64.1	Low	57.9	Low	106 Å²	106	72.4 Å²	72.4	54%	0.544	37%	0.371	S	S	.	.	H	α-helix	trans	-65.2	-45.6	176.1	-70.3	165	0	0	0	110.5	S50 G51 S57 R58	S50-I54 VanDerWaalsContact O-CG1 3.28Å; S50-I54 WeakPolarHBondContact O-CG1 3.46Å; S50-I54 PolarHBondContact O-N 3.17Å; G51-I54 PolarHBondContact O-N 2.91Å; I54-S57 PolarHBondContact O-N 2.75Å; I54-R58 PolarHBondContact O-N 3.08Å
55	E	59.6	Low	57.8	Low	96 Å²	96	77.4 Å²	77.4	45%	0.449	38%	0.384	S	S	.	.	H	α-helix	trans	-70.7	-37	179.8	-74.2	-56.9	160.7	0	0	112.9	G51 V52 S57 R58 V59	G51-E55 PolarHBondContact O-N 2.79Å; G51-E55 VanDerWaalsContact O-N 3.09Å; V52-E55 PolarHBondContact O-N 2.77Å; E55-S57 VanDerWaalsContact C-N 3.34Å; E55-S57 PolarHBondContact O-N 2.9Å; E55-R58 WeakPolarHBondContact O-CB 3.34Å; E55-R58 PolarHBondContact O-N 3.38Å; E55-R58 IonicContact OE1-NH1 2.73Å; E55-V59 WeakPolarHBondContact O-CG2 3.36Å; E55-V59 PolarHBondContact O-N 3.29Å
56	L	62.6	Low	57.5	Low	11 Å²	11	76.6 Å²	76.6	6%	0.058	38%	0.384	C	S	.	.	H	α-helix	trans	-58.2	-45.6	169.6	-97.7	149.4	0	0	0	111.8	V23 V52 R58 V59 I60 V74 I77 L78	V23-L56 HydrophobicContact CG1-CD1 3.61Å; V23-L56 HydrophobicContact CG1-CG 4.19Å; V52-L56 HydrophobicContact CG1-CD1 3.79Å; V52-L56 WeakPolarHBondContact O-CB 3.4Å; V52-L56 PolarHBondContact O-N 2.87Å; L56-R58 VanDerWaalsContact C-N 3.26Å; L56-R58 PolarHBondContact O-N 2.89Å; L56-V59 PolarHBondContact O-N 3.06Å; L56-I60 VanDerWaalsContact O-CG1 3.3Å; L56-I60 WeakPolarHBondContact O-CG1 3.43Å; L56-I60 PolarHBondContact O-N 3.34Å; L56-V74 HydrophobicContact CD2-CB 4.36Å; L56-V74 HydrophobicContact CD2-CG1 3.58Å; L56-V74 HydrophobicContact CD2-CG2 4.29Å; L56-I77 HydrophobicContact CD1-CG2 4.18Å; L56-L78 HydrophobicContact CB-CD1 3.98Å; L56-L78 HydrophobicContact CD1-CD1 4.45Å; L56-L78 HydrophobicContact CD2-CD1 4.32Å
57	S	60.8	Low	57.6	Low	25 Å²	25	76.8 Å²	76.8	18%	0.175	39%	0.394	C	S	.	.	H	α-helix	trans	-61.7	-37.5	176.7	-59.5	0	0	0	0	111.6	M53 I54 E55 I60 S61	M53-S57 WeakPolarHBondContact O-CB 3.25Å; M53-S57 PolarHBondContact O-N 2.87Å; M53-S57 PolarHBondContact O-OG 2.56Å; I54-S57 PolarHBondContact O-N 2.75Å; E55-S57 VanDerWaalsContact C-N 3.34Å; E55-S57 PolarHBondContact O-N 2.9Å; S57-I60 PolarHBondContact O-N 2.74Å; S57-S61 WeakPolarHBondContact O-CB 3.46Å; S57-S61 PolarHBondContact O-N 3.18Å; S57-S61 PolarHBondContact O-OG 3.11Å
58	R	58.9	Low	57.9	Low	142 Å²	142	76 Å²	76	54%	0.536	40%	0.395	S	S	.	.	H	α-helix	trans	-63.7	-44.9	175.3	-124.8	179.9	172	167.2	-1	111.9	I54 E55 L56 I60 S61 M62	I54-R58 PolarHBondContact O-N 3.08Å; E55-R58 WeakPolarHBondContact O-CB 3.34Å; E55-R58 PolarHBondContact O-N 3.38Å; E55-R58 IonicContact OE1-NH1 2.73Å; L56-R58 VanDerWaalsContact C-N 3.26Å; L56-R58 PolarHBondContact O-N 2.89Å; R58-I60 PolarHBondContact O-N 3.4Å; R58-S61 WeakPolarHBondContact CA-OG 3.2Å; R58-S61 PolarHBondContact O-N 3.01Å; R58-S61 PolarHBondContact O-OG 3.5Å; R58-M62 WeakPolarHBondContact O-CG 3.49Å; R58-M62 PolarHBondContact O-N 3.36Å
59	V	59.8	Low	57.8	Low	32 Å²	32	75.7 Å²	75.7	19%	0.194	40%	0.401	C	S	.	.	H	α-helix	trans	-60.6	-44.6	176	172.9	0	0	0	0	111.1	A19 E55 L56 M62 Q63	A19-V59 HydrophobicContact CB-CG2 4.49Å; E55-V59 WeakPolarHBondContact O-CG2 3.36Å; E55-V59 PolarHBondContact O-N 3.29Å; L56-V59 PolarHBondContact O-N 3.06Å; V59-M62 PolarHBondContact O-N 2.85Å; V59-Q63 WeakPolarHBondContact O-CB 3.23Å
60	I	59.7	Low	57.8	Low	62 Å²	62	77.4 Å²	77.4	32%	0.318	41%	0.41	S	S	.	.	H	α-helix	trans	-62.5	-45.9	177.5	-62.4	163.4	0	0	0	110.8	L56 S57 R58 M62 Q63 V74 L78	L56-I60 VanDerWaalsContact O-CG1 3.3Å; L56-I60 WeakPolarHBondContact O-CG1 3.43Å; L56-I60 PolarHBondContact O-N 3.34Å; S57-I60 PolarHBondContact O-N 2.74Å; R58-I60 PolarHBondContact O-N 3.4Å; I60-M62 VanDerWaalsContact C-N 3.27Å; I60-M62 PolarHBondContact O-N 3.47Å; I60-Q63 PolarHBondContact O-N 3.48Å; I60-V74 HydrophobicContact CD1-CG1 3.52Å; I60-V74 HydrophobicContact CG1-CG1 3.5Å; I60-L78 HydrophobicContact CD1-CD1 4.27Å
61	S	59.3	Low	57.5	Low	89 Å²	89	79.5 Å²	79.5	62%	0.622	42%	0.417	S	S	*	.	H	α-helix	trans	-66.9	-25	-178.4	66.5	0	0	0	0	114.1	S57 R58 Q63	S57-S61 WeakPolarHBondContact O-CB 3.46Å; S57-S61 PolarHBondContact O-N 3.18Å; S57-S61 PolarHBondContact O-OG 3.11Å; R58-S61 WeakPolarHBondContact CA-OG 3.2Å; R58-S61 PolarHBondContact O-N 3.01Å; R58-S61 PolarHBondContact O-OG 3.5Å; S61-Q63 VanDerWaalsContact C-N 3.3Å
62	M	52.7	Low	57.4	Low	153 Å²	153	85.1 Å²	85.1	75%	0.754	43%	0.428	S	S	*	.	H	α-helix	trans	-78.8	-13.7	178.8	-74.4	-112	161.9	0	0	113	R58 V59 I60 K64	R58-M62 WeakPolarHBondContact O-CG 3.49Å; R58-M62 PolarHBondContact O-N 3.36Å; V59-M62 PolarHBondContact O-N 2.85Å; I60-M62 VanDerWaalsContact C-N 3.27Å; I60-M62 PolarHBondContact O-N 3.47Å; M62-K64 PolarHBondContact O-N 3.1Å
63	Q	49.4	Very low	57.3	Low	45 Å²	45	88.3 Å²	88.3	21%	0.21	44%	0.442	C	S	.	.			trans	-111.3	73.2	-155.6	-152.4	145.8	-10.1	0	0	114.2	V59 I60 S61 Y65 A66	V59-Q63 WeakPolarHBondContact O-CB 3.23Å; I60-Q63 PolarHBondContact O-N 3.48Å; S61-Q63 VanDerWaalsContact C-N 3.3Å; Q63-Y65 PolarHBondContact O-N 2.72Å; Q63-Y65 VanDerWaalsContact O-N 3.12Å; Q63-A66 HydrophobicContact CB-CB 4.44Å; Q63-A66 HydrophobicContact CG-CB 3.49Å; Q63-A66 VanDerWaalsContact CG-CB 3.49Å
64	K	46	Very low	57.4	Low	189 Å²	189	87.7 Å²	87.7	82%	0.822	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	3.4	161.3	-94.4	-176.9	174.7	-179.8	0	114.4	M62	M62-K64 PolarHBondContact O-N 3.1Å
65	Y	45.1	Very low	57.5	Low	213 Å²	213	85.9 Å²	85.9	84%	0.835	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.6	18.2	-168.7	-61.4	-76.5	0	0	0	115.6	Q63	Q63-Y65 PolarHBondContact O-N 2.72Å; Q63-Y65 VanDerWaalsContact O-N 3.12Å
66	A	46.7	Very low	57.9	Low	31 Å²	31	82.7 Å²	82.7	26%	0.256	42%	0.421	S	S	.	.			trans	-79.1	142.1	175.9	0	0	0	0	0	111.8	Q63 L71	Q63-A66 HydrophobicContact CB-CB 4.44Å; Q63-A66 HydrophobicContact CG-CB 3.49Å; Q63-A66 VanDerWaalsContact CG-CB 3.49Å; A66-L71 HydrophobicContact CB-CD1 4.28Å
67	S	54.6	Low	58.3	Low	68 Å²	68	84.1 Å²	84.1	48%	0.476	43%	0.429	S	S	.	.			trans	-65.2	140.1	163.1	53.7	0	0	0	0	110.6	P69 I70	S67-P69 VanDerWaalsContact C-N 3.33Å; S67-P69 WeakPolarHBondContact O-CD 3.46Å; S67-P69 VanDerWaalsContact O-N 3.12Å; S67-I70 PolarHBondContact O-N 3.46Å; S67-I70 VanDerWaalsContact O-N 3.15Å
68	T	61.7	Low	58.7	Low	104 Å²	104	84.2 Å²	84.2	64%	0.638	43%	0.427	S	S	*	.	H	α-helix	trans	-42.8	-39.9	-179	-5.3	0	0	0	0	116.4	L71 R72	T68-L71 PolarHBondContact O-N 3.39Å; T68-R72 PolarHBondContact O-N 2.76Å
69	P	54.2	Low	58.9	Low	86 Å²	86	80.8 Å²	80.8	56%	0.558	42%	0.417	S	S	*	.	H	α-helix	trans	-70.2	-33.1	-177.6	24.4	-34.5	0	0	0	114.1	S67 L71 R72 M73	S67-P69 VanDerWaalsContact C-N 3.33Å; S67-P69 WeakPolarHBondContact O-CD 3.46Å; S67-P69 VanDerWaalsContact O-N 3.12Å; P69-L71 VanDerWaalsContact C-N 3.31Å; P69-R72 PolarHBondContact O-N 2.74Å; P69-M73 PolarHBondContact O-N 2.94Å; P69-M73 VanDerWaalsContact O-N 3.1Å
70	I	59.8	Low	59.1	Low	51 Å²	51	83.6 Å²	83.6	26%	0.262	43%	0.434	S	S	.	.	H	α-helix	trans	-68.4	-38	178.7	-64.7	173.9	0	0	0	109.9	I20 S67 M73 V74	I20-I70 HydrophobicContact CD1-CG2 3.58Å; S67-I70 PolarHBondContact O-N 3.46Å; S67-I70 VanDerWaalsContact O-N 3.15Å; I70-M73 PolarHBondContact O-N 2.91Å; I70-V74 HydrophobicContact CG2-CG2 4.46Å; I70-V74 WeakPolarHBondContact O-CB 3.35Å; I70-V74 WeakPolarHBondContact O-CG2 3.24Å; I70-V74 PolarHBondContact O-N 3.29Å
71	L	59.8	Low	59.5	Low	84 Å²	84	80.7 Å²	80.7	44%	0.44	42%	0.419	S	S	.	.	H	α-helix	trans	-60	-48.2	176.6	-144.5	89.7	0	0	0	110.9	A66 T68 P69 M73 V74 E75	A66-L71 HydrophobicContact CB-CD1 4.28Å; T68-L71 PolarHBondContact O-N 3.39Å; P69-L71 VanDerWaalsContact C-N 3.31Å; L71-M73 VanDerWaalsContact C-N 3.34Å; L71-M73 PolarHBondContact O-N 2.91Å; L71-V74 PolarHBondContact O-N 2.87Å; L71-E75 VanDerWaalsContact O-CB 3.27Å; L71-E75 WeakPolarHBondContact O-CB 3.37Å; L71-E75 PolarHBondContact O-N 2.99Å
72	R	63	Low	60	Low	152 Å²	152	77.8 Å²	77.8	57%	0.574	40%	0.396	S	S	*	.	H	α-helix	trans	-62.6	-37.9	178	-72.7	-168.7	-171.9	175.8	1.7	113.2	T68 P69 E75 G76	T68-R72 PolarHBondContact O-N 2.76Å; P69-R72 PolarHBondContact O-N 2.74Å; R72-E75 PolarHBondContact O-N 2.84Å; R72-G76 PolarHBondContact O-N 2.99Å
73	M	63.9	Low	60.6	Low	94 Å²	94	74.1 Å²	74.1	46%	0.463	38%	0.382	S	S	.	.	H	α-helix	trans	-66.4	-44.3	178.5	-170.8	-174.6	123.2	0	0	111.2	I20 P69 I70 L71 E75 G76 I77	I20-M73 HydrophobicContact CG2-CE 3.54Å; P69-M73 PolarHBondContact O-N 2.94Å; P69-M73 VanDerWaalsContact O-N 3.1Å; I70-M73 PolarHBondContact O-N 2.91Å; L71-M73 VanDerWaalsContact C-N 3.34Å; L71-M73 PolarHBondContact O-N 2.91Å; M73-E75 VanDerWaalsContact C-N 3.33Å; M73-G76 PolarHBondContact O-N 2.83Å; M73-I77 HydrophobicContact CE-CD1 3.93Å; M73-I77 HydrophobicContact CG-CD1 4.35Å; M73-I77 WeakPolarHBondContact O-CG1 3.1Å; M73-I77 PolarHBondContact O-N 3.46Å; M73-I77 VanDerWaalsContact O-N 3.09Å
74	V	64.6	Low	61.5	Low	8 Å²	8	76.1 Å²	76.1	5%	0.048	39%	0.388	C	S	.	.	H	α-helix	trans	-63.6	-40.8	176.2	164.7	0	0	0	0	111.1	L56 I60 I70 L71 I77 L78	L56-V74 HydrophobicContact CD2-CB 4.36Å; L56-V74 HydrophobicContact CD2-CG1 3.58Å; L56-V74 HydrophobicContact CD2-CG2 4.29Å; I60-V74 HydrophobicContact CD1-CG1 3.52Å; I60-V74 HydrophobicContact CG1-CG1 3.5Å; I70-V74 HydrophobicContact CG2-CG2 4.46Å; I70-V74 WeakPolarHBondContact O-CB 3.35Å; I70-V74 WeakPolarHBondContact O-CG2 3.24Å; I70-V74 PolarHBondContact O-N 3.29Å; L71-V74 PolarHBondContact O-N 2.87Å; V74-I77 PolarHBondContact O-N 2.61Å; V74-L78 PolarHBondContact O-N 3.2Å
75	E	64.7	Low	62.4	Low	69 Å²	69	68.1 Å²	68.1	32%	0.322	36%	0.356	S	S	.	.	H	α-helix	trans	-60.7	-45.8	175.6	-168.7	178.9	169.7	0	0	112.1	L71 R72 M73 I77 L78 Q79 W112	L71-E75 VanDerWaalsContact O-CB 3.27Å; L71-E75 WeakPolarHBondContact O-CB 3.37Å; L71-E75 PolarHBondContact O-N 2.99Å; R72-E75 PolarHBondContact O-N 2.84Å; M73-E75 VanDerWaalsContact C-N 3.33Å; E75-I77 PolarHBondContact O-N 2.8Å; E75-L78 WeakPolarHBondContact O-CB 3.42Å; E75-L78 PolarHBondContact O-N 2.89Å; E75-Q79 WeakPolarHBondContact O-CG 3.48Å; E75-Q79 PolarHBondContact O-N 2.81Å; E75-W112 HydrophobicContact CG-CH2 4.22Å; E75-W112 HydrophobicContact CG-CZ2 3.87Å; E75-W112 WeakPolarHBondContact OE1-CH2 3.39Å; E75-W112 WeakPolarHBondContact OE1-CZ2 3.39Å
76	G	69.7	Low	63.2	Low	28 Å²	28	58.3 Å²	58.3	29%	0.289	32%	0.318	S	S	.	.	H	α-helix	trans	-62.4	-41.2	175.6	0	0	0	0	0	113.2	R72 M73 L78 Q79 V80	R72-G76 PolarHBondContact O-N 2.99Å; M73-G76 PolarHBondContact O-N 2.83Å; G76-L78 VanDerWaalsContact C-N 3.3Å; G76-L78 PolarHBondContact O-N 2.75Å; G76-Q79 PolarHBondContact O-N 2.97Å; G76-V80 WeakPolarHBondContact O-CG2 3.43Å; G76-V80 PolarHBondContact O-N 3.31Å; G76-V80 VanDerWaalsContact O-N 3.08Å
77	I	69.1	Low	63.9	Low	42 Å²	42	59.7 Å²	59.7	22%	0.215	33%	0.326	C	S	.	.	H	α-helix	trans	-63.7	-38.6	176.4	-68	166.1	0	0	0	111	L56 M73 V74 E75 S81	L56-I77 HydrophobicContact CD1-CG2 4.18Å; M73-I77 HydrophobicContact CE-CD1 3.93Å; M73-I77 HydrophobicContact CG-CD1 4.35Å; M73-I77 WeakPolarHBondContact O-CG1 3.1Å; M73-I77 PolarHBondContact O-N 3.46Å; M73-I77 VanDerWaalsContact O-N 3.09Å; V74-I77 PolarHBondContact O-N 2.61Å; E75-I77 PolarHBondContact O-N 2.8Å; I77-S81 WeakPolarHBondContact O-CB 3.45Å; I77-S81 PolarHBondContact O-N 2.88Å; I77-S81 PolarHBondContact O-OG 3.38Å
78	L	69	Low	64.2	Low	26 Å²	26	59.2 Å²	59.2	14%	0.136	32%	0.317	C	S	.	.	H	α-helix	trans	-65.2	-44.4	178.1	-133.9	87	0	0	0	111.5	M53 L56 I60 V74 E75 G76 S81 F82	M53-L78 HydrophobicContact CE-CD1 4.13Å; M53-L78 HydrophobicContact CE-CD2 4.43Å; M53-L78 HydrophobicContact CE-CG 3.81Å; M53-L78 HydrophobicContact SD-CD1 4.13Å; M53-L78 HydrophobicContact SD-CG 4.29Å; L56-L78 HydrophobicContact CB-CD1 3.98Å; L56-L78 HydrophobicContact CD1-CD1 4.45Å; L56-L78 HydrophobicContact CD2-CD1 4.32Å; I60-L78 HydrophobicContact CD1-CD1 4.27Å; V74-L78 PolarHBondContact O-N 3.2Å; E75-L78 WeakPolarHBondContact O-CB 3.42Å; E75-L78 PolarHBondContact O-N 2.89Å; G76-L78 VanDerWaalsContact C-N 3.3Å; G76-L78 PolarHBondContact O-N 2.75Å; L78-S81 PolarHBondContact O-N 3.29Å; L78-F82 WeakPolarHBondContact O-CB 3.47Å; L78-F82 PolarHBondContact O-N 3.39Å
79	Q	64.6	Low	64	Low	70 Å²	70	55.2 Å²	55.2	33%	0.327	29%	0.293	S	S	.	.	H	α-helix	trans	-61.6	-47.7	178.2	-73.8	178.6	-9	0	0	111.7	E75 G76 S81 F82 V83 C118	E75-Q79 WeakPolarHBondContact O-CG 3.48Å; E75-Q79 PolarHBondContact O-N 2.81Å; G76-Q79 PolarHBondContact O-N 2.97Å; Q79-S81 VanDerWaalsContact C-N 3.33Å; Q79-S81 PolarHBondContact O-N 3.3Å; Q79-F82 PolarHBondContact O-N 2.84Å; Q79-V83 WeakPolarHBondContact O-CG2 3.33Å; Q79-V83 PolarHBondContact O-N 3.05Å; Q79-C118 PolarHBondContact NE2-SG 3.45Å; Q79-C118 VanDerWaalsContact NE2-SG 3.41Å
80	V	64.1	Low	63.9	Low	91 Å²	91	57 Å²	57	55%	0.552	30%	0.297	S	S	*	.	H	α-helix	trans	-62.2	-42.4	178.1	174.9	0	0	0	0	111	G76 F82 V83 Y84	G76-V80 WeakPolarHBondContact O-CG2 3.43Å; G76-V80 PolarHBondContact O-N 3.31Å; G76-V80 VanDerWaalsContact O-N 3.08Å; V80-F82 VanDerWaalsContact C-N 3.33Å; V80-F82 PolarHBondContact O-N 2.85Å; V80-V83 PolarHBondContact O-N 3.47Å; V80-Y84 WeakPolarHBondContact O-CB 3.32Å; V80-Y84 PolarHBondContact O-N 3.47Å
81	S	68.2	Low	63.6	Low	1 Å²	1	63.9 Å²	63.9	1%	0.007	33%	0.325	C	S	.	.	H	α-helix	trans	-65	-36.8	178.1	-60.4	0	0	0	0	112.2	I77 L78 Q79 S85	I77-S81 WeakPolarHBondContact O-CB 3.45Å; I77-S81 PolarHBondContact O-N 2.88Å; I77-S81 PolarHBondContact O-OG 3.38Å; L78-S81 PolarHBondContact O-N 3.29Å; Q79-S81 VanDerWaalsContact C-N 3.33Å; Q79-S81 PolarHBondContact O-N 3.3Å; S81-S85 WeakPolarHBondContact O-CB 3.34Å; S81-S85 PolarHBondContact O-N 2.82Å; S81-S85 PolarHBondContact O-OG 3.36Å
82	F	69.1	Low	63	Low	29 Å²	29	64.6 Å²	64.6	13%	0.127	33%	0.325	C	S	.	.	H	α-helix	trans	-65.9	-49.5	175.5	-178.4	-100.7	0	0	0	111.7	L78 Q79 V80 Y84 S85 C86 L101 A105 I108 W122	L78-F82 WeakPolarHBondContact O-CB 3.47Å; L78-F82 PolarHBondContact O-N 3.39Å; Q79-F82 PolarHBondContact O-N 2.84Å; V80-F82 VanDerWaalsContact C-N 3.33Å; V80-F82 PolarHBondContact O-N 2.85Å; F82-Y84 VanDerWaalsContact C-N 3.28Å; F82-Y84 PolarHBondContact O-N 3.36Å; F82-S85 WeakPolarHBondContact O-CB 3.25Å; F82-S85 PolarHBondContact O-N 2.83Å; F82-S85 VanDerWaalsContact O-N 3.15Å; F82-C86 VanDerWaalsContact CZ-SG 3.6Å; F82-C86 PolarHBondContact O-N 3.3Å; F82-C86 PolarHBondContact O-SG 3.46Å; F82-C86 VanDerWaalsContact O-SG 3.42Å; F82-L101 HydrophobicContact CE2-CD2 4.04Å; F82-A105 HydrophobicContact CE2-CB 4.49Å; F82-I108 HydrophobicContact CD2-CD1 3.87Å; F82-I108 HydrophobicContact CE2-CD1 4.12Å; F82-I108 HydrophobicContact CG-CD1 4.37Å; F82-W122 HydrophobicContact CZ-CE3 4.07Å; F82-W122 HydrophobicContact CZ-CZ3 4.31Å
83	V	66.2	Low	62.3	Low	75 Å²	75	66.9 Å²	66.9	46%	0.455	34%	0.344	S	S	.	.	H	α-helix	trans	-59.5	-41	177.6	174	0	0	0	0	111.2	Q79 V80 C86 S87	Q79-V83 WeakPolarHBondContact O-CG2 3.33Å; Q79-V83 PolarHBondContact O-N 3.05Å; V80-V83 PolarHBondContact O-N 3.47Å; V83-C86 PolarHBondContact O-N 2.86Å; V83-S87 WeakPolarHBondContact O-CB 3.47Å; V83-S87 PolarHBondContact O-N 2.85Å; V83-S87 PolarHBondContact O-OG 3.22Å
84	Y	66.5	Low	61.6	Low	87 Å²	87	66.1 Å²	66.1	34%	0.341	35%	0.345	S	S	.	.	H	α-helix	trans	-63.5	-44.9	176.1	-172.4	-101.9	0	0	0	111.9	L31 L49 V80 F82 S87 I88	L31-Y84 HydrophobicContact CD2-CE2 4.23Å; L49-Y84 HydrophobicContact CD1-CD1 4.41Å; L49-Y84 HydrophobicContact CD1-CE1 4.16Å; V80-Y84 WeakPolarHBondContact O-CB 3.32Å; V80-Y84 PolarHBondContact O-N 3.47Å; F82-Y84 VanDerWaalsContact C-N 3.28Å; F82-Y84 PolarHBondContact O-N 3.36Å; Y84-S87 WeakPolarHBondContact O-CB 3.03Å; Y84-S87 PolarHBondContact O-N 2.85Å; Y84-I88 HydrophobicContact CD1-CD1 3.76Å; Y84-I88 HydrophobicContact CE1-CD1 3.25Å; Y84-I88 HydrophobicContact CE1-CG1 4.23Å; Y84-I88 PolarHBondContact O-N 2.92Å
85	S	65	Low	60.9	Low	21 Å²	21	77.3 Å²	77.3	15%	0.147	39%	0.386	C	S	.	.	H	α-helix	trans	-62.3	-45.3	177.1	-58.2	0	0	0	0	111.6	S81 F82 S87 I88 V89	S81-S85 WeakPolarHBondContact O-CB 3.34Å; S81-S85 PolarHBondContact O-N 2.82Å; S81-S85 PolarHBondContact O-OG 3.36Å; F82-S85 WeakPolarHBondContact O-CB 3.25Å; F82-S85 PolarHBondContact O-N 2.83Å; F82-S85 VanDerWaalsContact O-N 3.15Å; S85-S87 VanDerWaalsContact C-N 3.31Å; S85-S87 PolarHBondContact O-N 2.97Å; S85-I88 PolarHBondContact O-N 2.92Å; S85-V89 WeakPolarHBondContact O-CG2 3.46Å; S85-V89 PolarHBondContact O-N 3.24Å; S85-V89 VanDerWaalsContact O-N 3.11Å
86	C	62	Low	60.3	Low	8 Å²	8	79.6 Å²	79.6	5%	0.054	40%	0.401	C	S	.	.	H	α-helix	trans	-59.8	-40.7	174.4	-72.1	0	0	0	0	111.9	F82 V83 V89 L90 L101 M125	F82-C86 VanDerWaalsContact CZ-SG 3.6Å; F82-C86 PolarHBondContact O-N 3.3Å; F82-C86 PolarHBondContact O-SG 3.46Å; F82-C86 VanDerWaalsContact O-SG 3.42Å; V83-C86 PolarHBondContact O-N 2.86Å; C86-V89 PolarHBondContact O-N 2.82Å; C86-L90 WeakPolarHBondContact O-CB 3.17Å; C86-L90 PolarHBondContact O-N 3.47Å; C86-L101 WeakPolarHBondContact SG-CD2 3.23Å; C86-M125 HydrophobicContact CB-CE 3.72Å; C86-M125 HydrophobicContact CB-SD 4.24Å
87	S	61.4	Low	59.4	Low	59 Å²	59	79 Å²	79	41%	0.413	39%	0.393	S	S	.	.	H	α-helix	trans	-66.2	-38.2	179.7	-60.7	0	0	0	0	112.7	V83 Y84 S85 K91	V83-S87 WeakPolarHBondContact O-CB 3.47Å; V83-S87 PolarHBondContact O-N 2.85Å; V83-S87 PolarHBondContact O-OG 3.22Å; Y84-S87 WeakPolarHBondContact O-CB 3.03Å; Y84-S87 PolarHBondContact O-N 2.85Å; S85-S87 VanDerWaalsContact C-N 3.31Å; S85-S87 PolarHBondContact O-N 2.97Å; S87-K91 PolarHBondContact O-N 2.79Å
88	I	60.8	Low	58.5	Low	58 Å²	58	82.6 Å²	82.6	30%	0.297	41%	0.405	S	S	.	.	H	α-helix	trans	-65	-42.7	174.6	-72.2	175.8	0	0	0	110.7	Y84 S85 K91 K92	Y84-I88 HydrophobicContact CD1-CD1 3.76Å; Y84-I88 HydrophobicContact CE1-CD1 3.25Å; Y84-I88 HydrophobicContact CE1-CG1 4.23Å; Y84-I88 PolarHBondContact O-N 2.92Å; S85-I88 PolarHBondContact O-N 2.92Å; I88-K91 PolarHBondContact O-N 2.89Å; I88-K92 PolarHBondContact O-N 2.68Å
89	V	58.5	Low	57.7	Low	21 Å²	21	90.9 Å²	90.9	13%	0.127	44%	0.435	C	S	.	.	H	α-helix	trans	-70.7	-36.3	-179.9	178.2	0	0	0	0	111.7	S85 C86 K91 K92 A97 L101	S85-V89 WeakPolarHBondContact O-CG2 3.46Å; S85-V89 PolarHBondContact O-N 3.24Å; S85-V89 VanDerWaalsContact O-N 3.11Å; C86-V89 PolarHBondContact O-N 2.82Å; V89-K91 VanDerWaalsContact C-N 3.27Å; V89-K91 PolarHBondContact O-N 3.06Å; V89-K92 CarbonylContact O-C 3.17Å; V89-K92 PolarHBondContact O-N 3.37Å; V89-K92 VanDerWaalsContact O-N 3.11Å; V89-A97 HydrophobicContact CB-CB 4.31Å; V89-A97 HydrophobicContact CG1-CB 3.72Å; V89-A97 HydrophobicContact CG2-CB 3.6Å; V89-L101 HydrophobicContact CB-CD1 3.57Å; V89-L101 HydrophobicContact CG1-CD1 3.64Å; V89-L101 HydrophobicContact CG2-CD1 3.54Å; V89-L101 HydrophobicContact CG2-CG 4.48Å
90	L	52.7	Low	57.2	Low	123 Å²	123	91.6 Å²	91.6	64%	0.644	44%	0.44	S	S	*	.	H	α-helix	trans	-60.4	-36.6	173.4	-108.8	119.8	0	0	0	112.5	C86 K92 M125	C86-L90 WeakPolarHBondContact O-CB 3.17Å; C86-L90 PolarHBondContact O-N 3.47Å; L90-K92 VanDerWaalsContact C-N 3.29Å; L90-K92 PolarHBondContact O-N 3.48Å; L90-M125 HydrophobicContact CD1-CE 3.96Å
91	K	53.4	Low	56.8	Low	195 Å²	195	88.2 Å²	88.2	85%	0.848	42%	0.418	S	S	*	.	H	α-helix	trans	-73.2	-17.9	177	-94.1	-176.7	174.6	176.6	0	114.1	S87 I88 V89	S87-K91 PolarHBondContact O-N 2.79Å; I88-K91 PolarHBondContact O-N 2.89Å; V89-K91 VanDerWaalsContact C-N 3.27Å; V89-K91 PolarHBondContact O-N 3.06Å
92	K	47.3	Very low	56.3	Low	99 Å²	99	93.4 Å²	93.4	43%	0.43	44%	0.441	S	S	.	.	S	Bend	trans	-135.2	96.7	-179.1	-95.8	-176.5	171.7	-176.8	0	109.3	I88 V89 L90 V94	I88-K92 PolarHBondContact O-N 2.68Å; V89-K92 CarbonylContact O-C 3.17Å; V89-K92 PolarHBondContact O-N 3.37Å; V89-K92 VanDerWaalsContact O-N 3.11Å; L90-K92 VanDerWaalsContact C-N 3.29Å; L90-K92 PolarHBondContact O-N 3.48Å; K92-V94 HydrophobicContact CB-CG2 4.15Å; K92-V94 PolarHBondContact O-N 3.04Å
93	M	47.9	Very low	55.5	Low	201 Å²	201	101.8 Å²	101.8	99%	0.99	47%	0.472	S	S	*	.			trans	-54	81.8	165	-97.8	-172.5	140.8	0	0	110.3
94	V	48.5	Very low	55	Low	78 Å²	78	100.3 Å²	100.3	47%	0.473	46%	0.463	S	S	.	.			trans	-123.1	111.2	174.4	-179.3	0	0	0	0	106.3	K92 D96 A97	K92-V94 HydrophobicContact CB-CG2 4.15Å; K92-V94 PolarHBondContact O-N 3.04Å; V94-D96 HydrophobicContact CG1-CB 4.48Å; V94-D96 PolarHBondContact O-N 3.14Å; V94-D96 VanDerWaalsContact O-N 3.14Å; V94-A97 WeakPolarHBondContact O-CB 3.13Å; V94-A97 PolarHBondContact O-N 3.48Å
95	W	50.9	Low	54.3	Low	242 Å²	242	96.4 Å²	96.4	92%	0.917	45%	0.449	S	S	*	.	H	α-helix	trans	-56	-31.2	-171.8	-140.4	58.6	0	0	0	113.1	A97 Y98	W95-A97 PolarHBondContact O-N 2.9Å; W95-Y98 WeakPolarHBondContact O-CB 3.45Å; W95-Y98 PolarHBondContact O-N 3.11Å
96	D	50.8	Low	53.7	Low	118 Å²	118	101.3 Å²	101.3	63%	0.631	47%	0.468	S	S	*	.	H	α-helix	trans	-69.7	-29.1	178.4	-78.4	-34	0	0	0	114.1	V94 Y98 R99	V94-D96 HydrophobicContact CG1-CB 4.48Å; V94-D96 PolarHBondContact O-N 3.14Å; V94-D96 VanDerWaalsContact O-N 3.14Å; D96-Y98 PolarHBondContact O-N 3.44Å; D96-R99 PolarHBondContact O-N 3.36Å
97	A	51.9	Low	53.2	Low	16 Å²	16	106.8 Å²	106.8	13%	0.132	49%	0.487	C	S	.	.	H	α-helix	trans	-69.2	-27.3	178.6	0	0	0	0	0	111.9	V89 V94 W95 R99 I100 L101	V89-A97 HydrophobicContact CB-CB 4.31Å; V89-A97 HydrophobicContact CG1-CB 3.72Å; V89-A97 HydrophobicContact CG2-CB 3.6Å; V94-A97 WeakPolarHBondContact O-CB 3.13Å; V94-A97 PolarHBondContact O-N 3.48Å; W95-A97 PolarHBondContact O-N 2.9Å; A97-R99 VanDerWaalsContact C-N 3.32Å; A97-R99 PolarHBondContact O-N 3.31Å; A97-I100 PolarHBondContact O-N 3.29Å; A97-L101 WeakPolarHBondContact O-CB 3.46Å; A97-L101 PolarHBondContact O-N 2.93Å
98	Y	50.7	Low	52.7	Low	117 Å²	117	105.7 Å²	105.7	46%	0.459	48%	0.476	S	S	.	.	H	α-helix	trans	-64.9	-36.5	177.7	-150	-89.7	0	0	0	111.9	W95 D96 I100 F102 L129	W95-Y98 WeakPolarHBondContact O-CB 3.45Å; W95-Y98 PolarHBondContact O-N 3.11Å; D96-Y98 PolarHBondContact O-N 3.44Å; Y98-I100 VanDerWaalsContact C-N 3.35Å; Y98-I100 PolarHBondContact O-N 3.35Å; Y98-F102 VanDerWaalsContact O-CB 3.23Å; Y98-F102 WeakPolarHBondContact O-CB 3.4Å; Y98-F102 PolarHBondContact O-N 2.89Å; Y98-L129 HydrophobicContact CE2-CD1 4.32Å
99	R	51.8	Low	52.1	Low	200 Å²	200	106.9 Å²	106.9	76%	0.755	48%	0.483	S	S	*	.	H	α-helix	trans	-66.6	-36.4	178.8	-114.7	-175	177.3	-171.7	0.6	112.7	D96 A97 R103	D96-R99 PolarHBondContact O-N 3.36Å; A97-R99 VanDerWaalsContact C-N 3.32Å; A97-R99 PolarHBondContact O-N 3.31Å; R99-R103 PolarHBondContact O-N 3.42Å
100	I	53.5	Low	51.4	Low	85 Å²	85	112.2 Å²	112.2	44%	0.436	51%	0.511	S	S	.	.	H	α-helix	trans	-77.5	-46.3	179.7	-62.6	173.7	0	0	0	109.7	Y46 A97 Y98 F102 R103 T104	Y46-I100 HydrophobicContact CE1-CD1 4.23Å; Y46-I100 HydrophobicContact CE1-CG2 4.46Å; A97-I100 PolarHBondContact O-N 3.29Å; Y98-I100 VanDerWaalsContact C-N 3.35Å; Y98-I100 PolarHBondContact O-N 3.35Å; I100-F102 VanDerWaalsContact C-N 3.26Å; I100-F102 PolarHBondContact O-N 3.01Å; I100-R103 WeakPolarHBondContact O-CB 3.2Å; I100-R103 PolarHBondContact O-N 3.27Å; I100-T104 PolarHBondContact O-N 2.87Å; I100-T104 PolarHBondContact O-OG1 3.3Å
101	L	56.4	Low	51.1	Low	20 Å²	20	109.4 Å²	109.4	11%	0.105	50%	0.501	C	S	.	.	H	α-helix	trans	-55.5	-41.8	173	-95	163.8	0	0	0	112.3	F82 C86 V89 A97 R103 T104 A105	F82-L101 HydrophobicContact CE2-CD2 4.04Å; C86-L101 WeakPolarHBondContact SG-CD2 3.23Å; V89-L101 HydrophobicContact CB-CD1 3.57Å; V89-L101 HydrophobicContact CG1-CD1 3.64Å; V89-L101 HydrophobicContact CG2-CD1 3.54Å; V89-L101 HydrophobicContact CG2-CG 4.48Å; A97-L101 WeakPolarHBondContact O-CB 3.46Å; A97-L101 PolarHBondContact O-N 2.93Å; L101-R103 VanDerWaalsContact C-N 3.32Å; L101-R103 PolarHBondContact O-N 3.24Å; L101-T104 PolarHBondContact O-N 3.41Å; L101-A105 VanDerWaalsContact O-CB 3.22Å; L101-A105 WeakPolarHBondContact O-CB 3.3Å; L101-A105 PolarHBondContact O-N 3.42Å
102	F	56.6	Low	50.7	Low	110 Å²	110	104.6 Å²	104.6	48%	0.482	48%	0.478	S	S	.	.	H	α-helix	trans	-61.1	-40.9	176.1	-168.3	-93.2	0	0	0	111.6	Y98 I100 F106	Y98-F102 VanDerWaalsContact O-CB 3.23Å; Y98-F102 WeakPolarHBondContact O-CB 3.4Å; Y98-F102 PolarHBondContact O-N 2.89Å; I100-F102 VanDerWaalsContact C-N 3.26Å; I100-F102 PolarHBondContact O-N 3.01Å; F102-F106 HydrophobicContact CE1-CD2 4.07Å; F102-F106 HydrophobicContact CZ-CD2 4.24Å; F102-F106 WeakPolarHBondContact O-CB 3.22Å; F102-F106 PolarHBondContact O-N 3.46Å
103	R	53	Low	50.3	Low	204 Å²	204	109.3 Å²	109.3	77%	0.77	50%	0.502	S	S	*	.	H	α-helix	trans	-67	-41.3	175.8	-78.5	-173.2	174.8	-143.6	-1.5	112.6	R99 I100 L101 W107	R99-R103 PolarHBondContact O-N 3.42Å; I100-R103 WeakPolarHBondContact O-CB 3.2Å; I100-R103 PolarHBondContact O-N 3.27Å; L101-R103 VanDerWaalsContact C-N 3.32Å; L101-R103 PolarHBondContact O-N 3.24Å; R103-W107 VanDerWaalsContact O-CB 3.32Å; R103-W107 WeakPolarHBondContact O-CB 3.42Å; R103-W107 PolarHBondContact O-N 3.35Å
104	T	54.9	Low	49.8	Very low	45 Å²	45	107.3 Å²	107.3	28%	0.276	50%	0.495	S	S	.	.	H	α-helix	trans	-67.9	-41.8	178.4	-34.1	0	0	0	0	111	M53 I100 L101 W107 I108	M53-T104 HydrophobicContact CE-CG2 4.48Å; I100-T104 PolarHBondContact O-N 2.87Å; I100-T104 PolarHBondContact O-OG1 3.3Å; L101-T104 PolarHBondContact O-N 3.41Å; T104-W107 PolarHBondContact O-N 3.21Å; T104-I108 HydrophobicContact CG2-CD1 4.49Å; T104-I108 VanDerWaalsContact O-CG1 3.27Å; T104-I108 WeakPolarHBondContact O-CG1 3.49Å; T104-I108 PolarHBondContact O-N 2.95Å
105	A	52.9	Low	49.3	Very low	4 Å²	4	105.7 Å²	105.7	3%	0.033	49%	0.494	C	S	.	.	H	α-helix	trans	-65.7	-43.5	176.7	0	0	0	0	0	112.1	F82 L101 W107 I108 L109 W122	F82-A105 HydrophobicContact CE2-CB 4.49Å; L101-A105 VanDerWaalsContact O-CB 3.22Å; L101-A105 WeakPolarHBondContact O-CB 3.3Å; L101-A105 PolarHBondContact O-N 3.42Å; A105-W107 VanDerWaalsContact C-N 3.29Å; A105-W107 PolarHBondContact O-N 3.45Å; A105-I108 PolarHBondContact O-N 3.02Å; A105-L109 PolarHBondContact O-N 2.79Å; A105-W122 HydrophobicContact CB-CD2 4.16Å; A105-W122 HydrophobicContact CB-CE3 3.84Å; A105-W122 HydrophobicContact CB-CH2 3.55Å; A105-W122 HydrophobicContact CB-CZ2 3.9Å; A105-W122 HydrophobicContact CB-CZ3 3.52Å
106	F	52.7	Low	48.5	Very low	125 Å²	125	95.6 Å²	95.6	55%	0.548	47%	0.465	S	S	.	.	H	α-helix	trans	-63.8	-36.2	176.8	-155.1	-85.7	0	0	0	111.7	F102 L109 D110	F102-F106 HydrophobicContact CE1-CD2 4.07Å; F102-F106 HydrophobicContact CZ-CD2 4.24Å; F102-F106 WeakPolarHBondContact O-CB 3.22Å; F102-F106 PolarHBondContact O-N 3.46Å; F106-L109 WeakPolarHBondContact O-CB 3.4Å; F106-L109 PolarHBondContact O-N 3.41Å; F106-D110 PolarHBondContact O-N 2.89Å
107	W	51.4	Low	48.1	Very low	122 Å²	122	93.5 Å²	93.5	46%	0.462	46%	0.459	S	S	.	.	H	α-helix	trans	-70.7	-36.5	176.6	-161.6	81	0	0	0	112.9	R103 T104 A105 L109 D110 S111	R103-W107 VanDerWaalsContact O-CB 3.32Å; R103-W107 WeakPolarHBondContact O-CB 3.42Å; R103-W107 PolarHBondContact O-N 3.35Å; T104-W107 PolarHBondContact O-N 3.21Å; A105-W107 VanDerWaalsContact C-N 3.29Å; A105-W107 PolarHBondContact O-N 3.45Å; W107-L109 VanDerWaalsContact C-N 3.33Å; W107-D110 PolarHBondContact O-N 2.78Å; W107-S111 WeakPolarHBondContact O-CB 3.49Å; W107-S111 PolarHBondContact O-N 3.44Å; W107-S111 VanDerWaalsContact O-N 3.14Å; W107-S111 PolarHBondContact O-OG 2.89Å
108	I	50.8	Low	47.6	Very low	36 Å²	36	94.1 Å²	94.1	19%	0.185	46%	0.463	C	S	.	.	H	α-helix	trans	-65.3	-38.8	171.4	-67.7	164.3	0	0	0	110.4	F82 T104 A105 S111 C118	F82-I108 HydrophobicContact CD2-CD1 3.87Å; F82-I108 HydrophobicContact CE2-CD1 4.12Å; F82-I108 HydrophobicContact CG-CD1 4.37Å; T104-I108 HydrophobicContact CG2-CD1 4.49Å; T104-I108 VanDerWaalsContact O-CG1 3.27Å; T104-I108 WeakPolarHBondContact O-CG1 3.49Å; T104-I108 PolarHBondContact O-N 2.95Å; A105-I108 PolarHBondContact O-N 3.02Å; I108-S111 PolarHBondContact O-N 2.84Å; I108-C118 HydrophobicContact CG2-CB 4.41Å
109	L	48.3	Very low	47.1	Very low	84 Å²	84	92.5 Å²	92.5	44%	0.44	46%	0.459	S	S	.	.	H	α-helix	trans	-63	-42.3	176.4	-128.3	90.5	0	0	0	112.2	A105 F106 W107 S111	A105-L109 PolarHBondContact O-N 2.79Å; F106-L109 WeakPolarHBondContact O-CB 3.4Å; F106-L109 PolarHBondContact O-N 3.41Å; W107-L109 VanDerWaalsContact C-N 3.33Å; L109-S111 VanDerWaalsContact C-N 3.33Å
110	D	43.2	Very low	46.5	Very low	132 Å²	132	87 Å²	87	71%	0.706	45%	0.448	S	S	*	.	H	α-helix	trans	-75.6	-23.2	-177.4	-155.1	53.3	0	0	0	112.6	F106 W107	F106-D110 PolarHBondContact O-N 2.89Å; W107-D110 PolarHBondContact O-N 2.78Å
111	S	45.9	Very low	46	Very low	64 Å²	64	86.2 Å²	86.2	45%	0.448	45%	0.447	S	S	.	.	H	α-helix	trans	-83.8	-11.5	-177.5	-60.7	0	0	0	0	114.1	W107 I108 L109	W107-S111 WeakPolarHBondContact O-CB 3.49Å; W107-S111 PolarHBondContact O-N 3.44Å; W107-S111 VanDerWaalsContact O-N 3.14Å; W107-S111 PolarHBondContact O-OG 2.89Å; I108-S111 PolarHBondContact O-N 2.84Å; L109-S111 VanDerWaalsContact C-N 3.33Å
112	W	45.2	Very low	45.3	Very low	95 Å²	95	87.9 Å²	87.9	36%	0.36	45%	0.452	S	S	.	.			trans	-127.5	94	-175.9	-84.3	-2.6	0	0	0	112.4	E75 N114 C118	E75-W112 HydrophobicContact CG-CH2 4.22Å; E75-W112 HydrophobicContact CG-CZ2 3.87Å; E75-W112 WeakPolarHBondContact OE1-CH2 3.39Å; E75-W112 WeakPolarHBondContact OE1-CZ2 3.39Å; W112-N114 PolarHBondContact O-N 3.05Å; W112-C118 HydrophobicContact CZ3-CB 4Å; W112-C118 WeakPolarHBondContact CZ3-SG 3.32Å
113	E	38.2	Very low	44.9	Very low	198 Å²	198	86.2 Å²	86.2	93%	0.925	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-11.6	174.4	-90.3	-178.3	146.9	0	0	114.6
114	N	39	Very low	44.3	Very low	158 Å²	158	80.2 Å²	80.2	85%	0.845	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.1	12.7	-172.3	-68.9	-16.6	0	0	0	116	W112 G116	W112-N114 PolarHBondContact O-N 3.05Å; N114-G116 PolarHBondContact O-N 3.37Å
115	G	36.9	Very low	43.5	Very low	45 Å²	45	80.4 Å²	80.4	46%	0.464	43%	0.432	S	S	.	.			trans	58.2	47	168.3	0	0	0	0	0	115.7
116	G	35.3	Very low	42.8	Very low	29 Å²	29	81.8 Å²	81.8	30%	0.299	44%	0.44	S	S	.	.			trans	-63.9	173.1	175.3	0	0	0	0	0	114.3	N114 C118 H119	N114-G116 PolarHBondContact O-N 3.37Å; G116-C118 PolarHBondContact O-N 3.34Å; G116-H119 WeakPolarHBondContact O-CB 3.48Å; G116-H119 PolarHBondContact O-N 3.43Å
117	S	41.7	Very low	42.1	Very low	74 Å²	74	78.3 Å²	78.3	52%	0.517	43%	0.431	S	S	.	.	H	α-helix	trans	-52.7	-18.6	-166.9	77.6	0	0	0	0	117	H119 T120 T121	S117-H119 VanDerWaalsContact C-N 3.31Å; S117-T120 PolarHBondContact O-N 3.36Å; S117-T120 PolarHBondContact O-OG1 3.3Å; S117-T121 PolarHBondContact O-N 3Å; S117-T121 PolarHBondContact O-OG1 2.96Å
118	C	41.3	Very low	41.4	Very low	30 Å²	30	78.2 Å²	78.2	20%	0.203	44%	0.438	C	S	.	.	H	α-helix	trans	-63.9	-34.5	171.2	-53.8	0	0	0	0	112.4	Q79 I108 W112 G116 T121 W122	Q79-C118 PolarHBondContact NE2-SG 3.45Å; Q79-C118 VanDerWaalsContact NE2-SG 3.41Å; I108-C118 HydrophobicContact CG2-CB 4.41Å; W112-C118 HydrophobicContact CZ3-CB 4Å; W112-C118 WeakPolarHBondContact CZ3-SG 3.32Å; G116-C118 PolarHBondContact O-N 3.34Å; C118-T121 PolarHBondContact O-N 2.83Å; C118-W122 WeakPolarHBondContact O-CB 3.37Å; C118-W122 PolarHBondContact O-N 3.01Å
119	H	39.7	Very low	40.7	Very low	83 Å²	83	81 Å²	81	38%	0.384	45%	0.453	S	S	.	.	H	α-helix	trans	-64.6	-44.7	177.5	-176.2	-100.2	0	0	0	110.9	G116 S117 W122 I123	G116-H119 WeakPolarHBondContact O-CB 3.48Å; G116-H119 PolarHBondContact O-N 3.43Å; S117-H119 VanDerWaalsContact C-N 3.31Å; H119-W122 PolarHBondContact O-N 3.01Å; H119-I123 WeakPolarHBondContact CE1-CD1 3.38Å; H119-I123 WeakPolarHBondContact O-CB 3.48Å; H119-I123 WeakPolarHBondContact O-CG1 3.48Å; H119-I123 PolarHBondContact O-N 3.29Å
120	T	39.8	Very low	40.2	Very low	85 Å²	85	85 Å²	85	52%	0.521	47%	0.472	S	S	.	.	H	α-helix	trans	-62.6	-45.5	173.8	-14	0	0	0	0	110.7	S117 W122 I123 T124	S117-T120 PolarHBondContact O-N 3.36Å; S117-T120 PolarHBondContact O-OG1 3.3Å; T120-W122 VanDerWaalsContact C-N 3.34Å; T120-W122 PolarHBondContact O-N 3.38Å; T120-I123 PolarHBondContact O-N 2.95Å; T120-T124 WeakPolarHBondContact O-CB 3.42Å; T120-T124 PolarHBondContact O-N 3.33Å; T120-T124 PolarHBondContact O-OG1 3.02Å
121	T	43.2	Very low	39.7	Very low	68 Å²	68	84.8 Å²	84.8	42%	0.417	47%	0.47	S	S	.	.	H	α-helix	trans	-61.8	-39.9	178	-53.6	0	0	0	0	112.2	S117 C118 M125	S117-T121 PolarHBondContact O-N 3Å; S117-T121 PolarHBondContact O-OG1 2.96Å; C118-T121 PolarHBondContact O-N 2.83Å; T121-M125 WeakPolarHBondContact O-CB 3.27Å; T121-M125 WeakPolarHBondContact O-CG 3.32Å; T121-M125 PolarHBondContact O-N 3.46Å
122	W	41.5	Very low	38.8	Very low	54 Å²	54	84.8 Å²	84.8	21%	0.205	48%	0.481	C	S	.	.	H	α-helix	trans	-70.2	-42.6	175.8	174.4	-101.8	0	0	0	112.8	F82 A105 C118 H119 T120 T124 M125 T126	F82-W122 HydrophobicContact CZ-CE3 4.07Å; F82-W122 HydrophobicContact CZ-CZ3 4.31Å; A105-W122 HydrophobicContact CB-CD2 4.16Å; A105-W122 HydrophobicContact CB-CE3 3.84Å; A105-W122 HydrophobicContact CB-CH2 3.55Å; A105-W122 HydrophobicContact CB-CZ2 3.9Å; A105-W122 HydrophobicContact CB-CZ3 3.52Å; C118-W122 WeakPolarHBondContact O-CB 3.37Å; C118-W122 PolarHBondContact O-N 3.01Å; H119-W122 PolarHBondContact O-N 3.01Å; T120-W122 VanDerWaalsContact C-N 3.34Å; T120-W122 PolarHBondContact O-N 3.38Å; W122-T124 VanDerWaalsContact C-N 3.3Å; W122-T124 PolarHBondContact O-N 3.11Å; W122-M125 PolarHBondContact O-N 2.86Å; W122-T126 HydrophobicContact CD2-CG2 3.96Å; W122-T126 VanDerWaalsContact CE2-CG2 3.46Å; W122-T126 HydrophobicContact CE3-CG2 4.46Å; W122-T126 HydrophobicContact CG-CG2 4.47Å; W122-T126 HydrophobicContact CH2-CG2 4.16Å; W122-T126 HydrophobicContact CZ2-CG2 3.59Å; W122-T126 WeakPolarHBondContact O-CB 3.5Å; W122-T126 WeakPolarHBondContact O-CG2 3.35Å; W122-T126 PolarHBondContact O-N 2.95Å; W122-T126 PolarHBondContact O-OG1 3.15Å
123	I	47.8	Very low	37.8	Very low	76 Å²	76	88.9 Å²	88.9	39%	0.39	50%	0.501	S	S	.	.	H	α-helix	trans	-59.7	-43.9	174	-74.6	177.3	0	0	0	110.3	H119 T120 T126 S127	H119-I123 WeakPolarHBondContact CE1-CD1 3.38Å; H119-I123 WeakPolarHBondContact O-CB 3.48Å; H119-I123 WeakPolarHBondContact O-CG1 3.48Å; H119-I123 PolarHBondContact O-N 3.29Å; T120-I123 PolarHBondContact O-N 2.95Å; I123-T126 WeakPolarHBondContact CA-OG1 3.41Å; I123-T126 PolarHBondContact O-N 3.03Å; I123-T126 PolarHBondContact O-OG1 3.35Å; I123-T126 VanDerWaalsContact O-OG1 3.1Å; I123-S127 VanDerWaalsContact O-CB 3.27Å; I123-S127 WeakPolarHBondContact O-CB 3.34Å; I123-S127 PolarHBondContact O-N 2.8Å; I123-S127 PolarHBondContact O-OG 2.96Å
124	T	39.8	Very low	37.1	Very low	77 Å²	77	87.5 Å²	87.5	47%	0.472	50%	0.499	S	S	.	.	H	α-helix	trans	-63.9	-45.1	177.2	-53.9	0	0	0	0	111	T120 W122 T126 S127 I128	T120-T124 WeakPolarHBondContact O-CB 3.42Å; T120-T124 PolarHBondContact O-N 3.33Å; T120-T124 PolarHBondContact O-OG1 3.02Å; W122-T124 VanDerWaalsContact C-N 3.3Å; W122-T124 PolarHBondContact O-N 3.11Å; T124-T126 PolarHBondContact O-N 3.34Å; T124-S127 PolarHBondContact O-N 3.14Å; T124-I128 HydrophobicContact CG2-CD1 4.12Å; T124-I128 WeakPolarHBondContact O-CD1 3.47Å; T124-I128 VanDerWaalsContact O-CG1 3.25Å; T124-I128 WeakPolarHBondContact O-CG1 3.43Å; T124-I128 PolarHBondContact O-N 3.42Å
125	M	38.1	Very low	36.3	Very low	49 Å²	49	88.3 Å²	88.3	24%	0.241	50%	0.498	C	S	.	.	H	α-helix	trans	-63.8	-39.3	176.4	-81.2	-171.3	128.2	0	0	113.4	C86 L90 T121 W122 I128 L129	C86-M125 HydrophobicContact CB-CE 3.72Å; C86-M125 HydrophobicContact CB-SD 4.24Å; L90-M125 HydrophobicContact CD1-CE 3.96Å; T121-M125 WeakPolarHBondContact O-CB 3.27Å; T121-M125 WeakPolarHBondContact O-CG 3.32Å; T121-M125 PolarHBondContact O-N 3.46Å; W122-M125 PolarHBondContact O-N 2.86Å; M125-I128 PolarHBondContact O-N 3Å; M125-L129 WeakPolarHBondContact O-CG 2.99Å; M125-L129 PolarHBondContact O-N 3.45Å
126	T	39.2	Very low	35.6	Very low	33 Å²	33	95.2 Å²	95.2	20%	0.202	52%	0.515	C	S	.	.	H	α-helix	trans	-73.3	-32.3	177.9	46.2	0	0	0	0	112.3	W122 I123 T124 L129 M130	W122-T126 HydrophobicContact CD2-CG2 3.96Å; W122-T126 VanDerWaalsContact CE2-CG2 3.46Å; W122-T126 HydrophobicContact CE3-CG2 4.46Å; W122-T126 HydrophobicContact CG-CG2 4.47Å; W122-T126 HydrophobicContact CH2-CG2 4.16Å; W122-T126 HydrophobicContact CZ2-CG2 3.59Å; W122-T126 WeakPolarHBondContact O-CB 3.5Å; W122-T126 WeakPolarHBondContact O-CG2 3.35Å; W122-T126 PolarHBondContact O-N 2.95Å; W122-T126 PolarHBondContact O-OG1 3.15Å; I123-T126 WeakPolarHBondContact CA-OG1 3.41Å; I123-T126 PolarHBondContact O-N 3.03Å; I123-T126 PolarHBondContact O-OG1 3.35Å; I123-T126 VanDerWaalsContact O-OG1 3.1Å; T124-T126 PolarHBondContact O-N 3.34Å; T126-L129 PolarHBondContact O-N 3.25Å; T126-M130 PolarHBondContact O-N 3.43Å
127	S	37.4	Very low	35.1	Very low	53 Å²	53	99.1 Å²	99.1	37%	0.371	54%	0.538	S	S	.	.	H	α-helix	trans	-66.4	-40.5	172.6	-58.4	0	0	0	0	111.6	I123 T124 L129 M130 N131	I123-S127 VanDerWaalsContact O-CB 3.27Å; I123-S127 WeakPolarHBondContact O-CB 3.34Å; I123-S127 PolarHBondContact O-N 2.8Å; I123-S127 PolarHBondContact O-OG 2.96Å; T124-S127 PolarHBondContact O-N 3.14Å; S127-L129 VanDerWaalsContact C-N 3.33Å; S127-L129 PolarHBondContact O-N 2.91Å; S127-M130 PolarHBondContact O-N 3.37Å; S127-N131 WeakPolarHBondContact O-CB 3.17Å; S127-N131 PolarHBondContact O-N 3.03Å
128	I	37.2	Very low	34.2	Very low	119 Å²	119	100.4 Å²	100.4	61%	0.61	55%	0.547	S	S	*	.	H	α-helix	trans	-63.8	-38.6	172.9	-67.1	164.2	0	0	0	111.2	T124 M125	T124-I128 HydrophobicContact CG2-CD1 4.12Å; T124-I128 WeakPolarHBondContact O-CD1 3.47Å; T124-I128 VanDerWaalsContact O-CG1 3.25Å; T124-I128 WeakPolarHBondContact O-CG1 3.43Å; T124-I128 PolarHBondContact O-N 3.42Å; M125-I128 PolarHBondContact O-N 3Å
129	L	36.6	Very low	33.3	Very low	94 Å²	94	110.1 Å²	110.1	49%	0.492	58%	0.579	S	S	.	*	H	α-helix	trans	-70.6	-35.7	177	-80.8	161.2	0	0	0	113.4	Y98 M125 T126 S127	Y98-L129 HydrophobicContact CE2-CD1 4.32Å; M125-L129 WeakPolarHBondContact O-CG 2.99Å; M125-L129 PolarHBondContact O-N 3.45Å; T126-L129 PolarHBondContact O-N 3.25Å; S127-L129 VanDerWaalsContact C-N 3.33Å; S127-L129 PolarHBondContact O-N 2.91Å
130	M	37.6	Very low	32.6	Very low	169 Å²	169	111.1 Å²	111.1	83%	0.833	60%	0.596	S	S	*	*	H	α-helix	trans	-84.1	-28.6	-179.4	-75.8	-151.3	169	0	0	113.8	T126 S127 G132	T126-M130 PolarHBondContact O-N 3.43Å; S127-M130 PolarHBondContact O-N 3.37Å; M130-G132 VanDerWaalsContact C-N 3.33Å
131	N	33.3	Very low	32	Very low	127 Å²	127	111.9 Å²	111.9	68%	0.679	60%	0.604	S	S	*	*	S	Bend	trans	-93.4	11.8	179.7	-65.3	-23.9	0	0	0	113.6	S127 K133	S127-N131 WeakPolarHBondContact O-CB 3.17Å; S127-N131 PolarHBondContact O-N 3.03Å; N131-K133 PolarHBondContact O-N 3.37Å
132	G	26.2	Very low	31.2	Very low	64 Å²	64	115.1 Å²	115.1	66%	0.66	63%	0.626	S	S	*	*			trans	-69.1	57.1	170.8	0	0	0	0	0	113.6	M130	M130-G132 VanDerWaalsContact C-N 3.33Å
133	K	23.3	Very low	30.5	Very low	181 Å²	181	116 Å²	116	79%	0.787	65%	0.652	S	S	*	*			trans	-154.8	104.8	156.2	-129.9	173.8	-173.5	173.2	0	110.1	N131 Q135	N131-K133 PolarHBondContact O-N 3.37Å; K133-Q135 PolarHBondContact O-N 3.08Å
134	L	24.3	Very low	29.5	Very low	169 Å²	169	122.1 Å²	122.1	89%	0.885	68%	0.676	S	S	*	*			trans	-56.4	86.4	156.2	-119.5	143.8	0	0	0	108.2	K136	L134-K136 PolarHBondContact O-N 3.48Å
135	Q	22.7	Very low	28.9	Very low	176 Å²	176	123.9 Å²	123.9	82%	0.822	69%	0.691	S	S	*	*			trans	-73.3	104.6	156.3	-98.9	-170.5	1.1	0	0	106.3	K133 S137	K133-Q135 PolarHBondContact O-N 3.08Å; Q135-S137 PolarHBondContact O-N 2.77Å
136	K	22.4	Very low	28.6	Very low	190 Å²	190	126.9 Å²	126.9	83%	0.826	72%	0.715	S	S	*	*			trans	-51.1	98.4	153.8	-81.7	175.3	174.7	173.6	0	107.2	L134 S138	L134-K136 PolarHBondContact O-N 3.48Å; K136-S138 PolarHBondContact O-N 2.71Å
137	S	23.1	Very low	28.1	Very low	111 Å²	111	130.7 Å²	130.7	78%	0.776	74%	0.738	S	S	*	*			trans	-66.9	87.4	157.9	-176.3	0	0	0	0	106.2	Q135 R139	Q135-S137 PolarHBondContact O-N 2.77Å; S137-R139 PolarHBondContact O-N 2.82Å
138	S	23.3	Very low	27.6	Very low	101 Å²	101	134.6 Å²	134.6	71%	0.706	76%	0.755	S	S	*	*			trans	-64.6	96.7	157.1	45.4	0	0	0	0	105.6	K136 S140	K136-S138 PolarHBondContact O-N 2.71Å; S138-S140 PolarHBondContact O-N 3.02Å
139	R	23.5	Very low	27.2	Very low	234 Å²	234	136.7 Å²	136.7	88%	0.883	77%	0.767	S	S	*	*			trans	-67.1	84.9	162.4	-144.3	176.6	-164.8	177.7	4.5	105.9	S137 S141	S137-R139 PolarHBondContact O-N 2.82Å; R139-S141 VanDerWaalsContact C-N 3.33Å; R139-S141 PolarHBondContact O-N 3.44Å
140	S	25.3	Very low	26.7	Very low	104 Å²	104	136.7 Å²	136.7	73%	0.727	78%	0.775	S	S	*	*			trans	-62.1	102	163.9	46.9	0	0	0	0	106.8	S138	S138-S140 PolarHBondContact O-N 3.02Å
141	S	26.5	Very low	26.3	Very low	101 Å²	101	137.3 Å²	137.3	71%	0.706	77%	0.773	S	S	*	*			trans	-56.1	138.8	157.8	-64.8	0	0	0	0	107.8	R139 G143	R139-S141 VanDerWaalsContact C-N 3.33Å; R139-S141 PolarHBondContact O-N 3.44Å; S141-G143 PolarHBondContact O-N 3.23Å
142	P	26.3	Very low	26.2	Very low	135 Å²	135	140 Å²	140	88%	0.877	78%	0.779	S	S	*	*			trans	-71.7	84	170.2	28.9	-29.8	0	0	0	108.2	K144	P142-K144 PolarHBondContact O-N 3.02Å
143	G	27.6	Very low	26.1	Very low	72 Å²	72	141.6 Å²	141.6	74%	0.742	78%	0.78	S	S	*	*			trans	-81.2	99.3	173	0	0	0	0	0	110.2	S141	S141-G143 PolarHBondContact O-N 3.23Å
144	K	25.9	Very low	26.2	Very low	205 Å²	205	138.3 Å²	138.3	89%	0.891	78%	0.78	S	S	*	*			trans	-27.3	132.3	164.8	-68.5	164	173.7	172.9	0	115.6	P142	P142-K144 PolarHBondContact O-N 3.02Å
145	S	28.1	Very low	26.5	Very low	114 Å²	114	135.3 Å²	135.3	80%	0.797	78%	0.78	S	S	*	*			trans	-160.3	165.3	138.7	80.6	0	0	0	0	109
146	P	31.6	Very low	26.7	Very low	113 Å²	113	136.4 Å²	136.4	73%	0.734	78%	0.782	S	S	*	*				-119	176	-106.4	26.2	-5.2	0	0	0	113.7
147	T	28.7	Very low	27.2	Very low	113 Å²	113	132.4 Å²	132.4	69%	0.693	78%	0.775	S	S	*	*			trans	127.9	109	144	-41.8	0	0	0	0	114.8
148	N	25.5	Very low	27.7	Very low	135 Å²	135	132.7 Å²	132.7	72%	0.722	78%	0.777	S	S	*	*			trans	56.4	111.2	144.9	-56.4	-9.6	0	0	0	120
149	N	30.4	Very low	27.8	Very low	163 Å²	163	135.9 Å²	135.9	87%	0.872	78%	0.781	S	S	*	*				-161.6	135.9	98.8	-88.1	-21.8	0	0	0	111.6
150	S	24.5	Very low	28.1	Very low	94 Å²	94	130.9 Å²	130.9	66%	0.657	78%	0.779	S	S	*	*			trans	-66.9	143.5	173.1	52.7	0	0	0	0	112.4
151	F	30.7	Very low	27.9	Very low	181 Å²	181	131.1 Å²	131.1	79%	0.794	78%	0.776	S	S	*	*				-175.1	130.4	119.5	-103.8	-77.2	0	0	0	111.2
152	K	29.8	Very low	27.9	Very low	184 Å²	184	132 Å²	132	80%	0.8	78%	0.781	S	S	*	*			trans	0.2	154	152.9	-71.6	169.2	172.1	175.1	0	119
153	S	25.1	Very low	27.9	Very low	98 Å²	98	130.6 Å²	130.6	69%	0.685	77%	0.774	S	S	*	*			cis	-175.7	160.1	-6.7	53.6	0	0	0	0	108.8
154	S	25.8	Very low	27.7	Very low	112 Å²	112	132.5 Å²	132.5	78%	0.783	78%	0.776	S	S	*	*			trans	65.5	109.3	151.9	68.2	0	0	0	0	121.4
155	A	30.4	Very low	27.8	Very low	106 Å²	106	127.6 Å²	127.6	88%	0.876	77%	0.767	S	S	*	*				171.8	136.7	104.4	0	0	0	0	0	111.3
156	K	25.9	Very low	27.6	Very low	199 Å²	199	129.9 Å²	129.9	87%	0.865	77%	0.765	S	S	*	*			trans	-107.4	-176.4	168.4	-129	-163.7	174.1	173.6	0	106.5
157	P	34	Very low	27.4	Very low	105 Å²	105	133.8 Å²	133.8	68%	0.682	77%	0.771	S	S	*	*			cis	-131.6	172.9	-41	28.7	-9.9	0	0	0	112.5
158	S	32.5	Very low	27.1	Very low	118 Å²	118	137.2 Å²	137.2	83%	0.825	78%	0.776	S	S	*	*			trans	-169.2	122.6	142.7	51.1	0	0	0	0	113.1
159	Q	26.6	Very low	27.2	Very low	168 Å²	168	136.8 Å²	136.8	79%	0.785	78%	0.781	S	S	*	*			trans	-68.1	168.4	152.8	-76.4	177.7	-75.2	0	0	109.9
160	P	29.6	Very low	27	Very low	129 Å²	129	138.8 Å²	138.8	84%	0.838	78%	0.782	S	S	*	*				-142.9	155.5	98.2	33.2	-15.8	0	0	0	116.1
161	T	21.6	Very low	27.1	Very low	109 Å²	109	142.6 Å²	142.6	67%	0.669	79%	0.789	S	S	*	*			trans	-61.8	146.5	168.2	-50.9	0	0	0	0	114
162	C	25.6	Very low	26.8	Very low	120 Å²	120	141.4 Å²	141.4	81%	0.811	79%	0.791	S	S	*	*			trans	-166.2	115.1	142.1	-97	0	0	0	0	107
163	S	27.3	Very low	26.7	Very low	105 Å²	105	144.2 Å²	144.2	73%	0.734	80%	0.797	S	S	*	*				106.1	115.4	64.5	-72.7	0	0	0	0	110.9
164	S	21.7	Very low	26.7	Very low	111 Å²	111	147.7 Å²	147.7	78%	0.776	81%	0.808	S	S	*	*			trans	-44.9	141.9	168.6	166.3	0	0	0	0	114.8
165	S	29.1	Very low	26.7	Very low	102 Å²	102	147.4 Å²	147.4	71%	0.713	80%	0.804	S	S	*	*			trans	-149.2	119.3	141.9	64	0	0	0	0	112
166	H	24.1	Very low	26.6	Very low	163 Å²	163	148 Å²	148	76%	0.755	80%	0.803	S	S	*	*			trans	-37.2	130.4	163.8	-85.6	-85.6	0	0	0	115.1
167	F	25.8	Very low	26.9	Very low	194 Å²	194	144.5 Å²	144.5	85%	0.851	79%	0.789	S	S	*	*			trans	-116.7	115.2	146.8	-87	-86.9	0	0	0	108.3
168	K	23.3	Very low	27	Very low	185 Å²	185	147.8 Å²	147.8	80%	0.804	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-82.2	135.4	164.6	-80.8	178.2	172.6	-179.8	0	107.9
169	P	27.4	Very low	27.3	Very low	126 Å²	126	145.7 Å²	145.7	82%	0.818	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-82.4	129.3	158.6	-1.8	20.8	0	0	0	109
170	F	26.8	Very low	28.1	Very low	206 Å²	206	142.4 Å²	142.4	90%	0.904	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-71.6	133	168.2	-119.4	-98.3	0	0	0	109.2
171	E	25.6	Very low	28.6	Very low	173 Å²	173	139.8 Å²	139.8	81%	0.808	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-72.5	129.6	162.1	-72.3	175.8	144.4	0	0	109.3
172	D	25.3	Very low	29.6	Very low	156 Å²	156	138.4 Å²	138.4	83%	0.834	73%	0.727	S	S	*	*			trans	163.6	104.2	137.8	-90.2	-20.9	0	0	0	111.1
173	R	27.9	Very low	30.2	Very low	244 Å²	244	139.5 Å²	139.5	92%	0.921	72%	0.715	S	S	*	*				174.5	123.1	121.4	-103.5	-180	177.6	176.4	-0.1	111.4	C175	R173-C175 PolarHBondContact O-N 3.09Å
174	N	25.3	Very low	30.8	Very low	171 Å²	171	139.8 Å²	139.8	91%	0.914	71%	0.708	S	S	*	*			trans	-48.2	108	159.8	-80.1	-21.6	0	0	0	111
175	C	25.4	Very low	31.2	Very low	105 Å²	105	141.4 Å²	141.4	71%	0.709	71%	0.708	S	S	*	*			trans	-126.4	114	150.4	-124	0	0	0	0	105.3	R173 E177	R173-C175 PolarHBondContact O-N 3.09Å; C175-E177 PolarHBondContact O-N 3.4Å
176	S	27.5	Very low	31.3	Very low	120 Å²	120	141 Å²	141	84%	0.839	71%	0.705	S	S	*	*			trans	-72.4	71.6	170.2	56.5	0	0	0	0	108.1	Q178	S176-Q178 PolarHBondContact O-N 3.35Å
177	E	33.1	Very low	32	Very low	125 Å²	125	140.7 Å²	140.7	58%	0.584	71%	0.708	S	S	*	*			trans	-71.2	108.6	164.5	-77.4	-177.8	169.4	0	0	106.8	C175 N179	C175-E177 PolarHBondContact O-N 3.4Å; E177-N179 WeakPolarHBondContact CB-ND2 3.37Å; E177-N179 PolarHBondContact O-N 2.95Å; E177-N179 PolarHBondContact OE2-ND2 2.89Å
178	Q	35.9	Very low	32.5	Very low	174 Å²	174	138.6 Å²	138.6	81%	0.813	71%	0.706	S	S	*	*			trans	-71.2	77.7	167.6	-67.1	-177.7	0.8	0	0	107.9	S176 L180	S176-Q178 PolarHBondContact O-N 3.35Å; Q178-L180 PolarHBondContact O-N 3.44Å
179	N	38	Very low	33.3	Very low	74 Å²	74	137.7 Å²	137.7	40%	0.396	71%	0.71	S	S	.	*			trans	-76.1	106.8	173.4	-75.5	-47.6	0	0	0	108.1	E177 E181	E177-N179 WeakPolarHBondContact CB-ND2 3.37Å; E177-N179 PolarHBondContact O-N 2.95Å; E177-N179 PolarHBondContact OE2-ND2 2.89Å; N179-E181 PolarHBondContact O-N 3.03Å
180	L	44.9	Very low	34.4	Very low	99 Å²	99	137.6 Å²	137.6	52%	0.518	71%	0.706	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.9	100.6	175.1	-162.6	71.1	0	0	0	108.4	Q178 L182 L223	Q178-L180 PolarHBondContact O-N 3.44Å; L180-L182 HydrophobicContact CD2-CD2 3.99Å; L180-L182 HydrophobicContact CD2-CG 4.3Å; L180-L182 HydrophobicContact CG-CD2 4.18Å; L180-L182 HydrophobicContact CG-CG 4.38Å; L180-L182 PolarHBondContact O-N 3.1Å; L180-L223 PolarHBondContact N-O 3.39Å; L180-L223 PolarHBondContact O-N 3.31Å
181	E	38.2	Very low	35.5	Very low	73 Å²	73	131.9 Å²	131.9	34%	0.341	69%	0.692	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.1	105	168.2	-78.2	-171.9	-179.9	0	0	109.2	N179 Y183 R222	N179-E181 PolarHBondContact O-N 3.03Å; E181-Y183 HydrophobicContact CB-CD2 4.42Å; E181-Y183 HydrophobicContact CB-CE2 3.96Å; E181-Y183 PolarHBondContact O-N 3.42Å; E181-Y183 VanDerWaalsContact OE2-CE2 3.29Å; E181-Y183 WeakPolarHBondContact OE2-CE2 3.45Å; E181-Y183 PolarHBondContact OE2-OH 3.28Å; E181-R222 IonicContact OE1-CZ 2.87Å; E181-R222 IonicContact OE1-NH1 3.72Å; E181-R222 PolarHBondContact OE1-NH1 3.4Å; E181-R222 IonicContact OE1-NH2 2.73Å; E181-R222 PolarHBondContact OE1-NH2 2.94Å
182	L	43.8	Very low	37.1	Very low	80 Å²	80	131.7 Å²	131.7	42%	0.419	70%	0.697	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.2	104.7	172.8	-67.8	175.6	0	0	0	109.3	L180 I221 L223	L180-L182 HydrophobicContact CD2-CD2 3.99Å; L180-L182 HydrophobicContact CD2-CG 4.3Å; L180-L182 HydrophobicContact CG-CD2 4.18Å; L180-L182 HydrophobicContact CG-CG 4.38Å; L180-L182 PolarHBondContact O-N 3.1Å; L182-I221 PolarHBondContact N-O 3.47Å; L182-L223 HydrophobicContact CD1-CD1 3.74Å
183	Y	37.3	Very low	39.2	Very low	144 Å²	144	131.2 Å²	131.2	57%	0.565	69%	0.694	S	S	*	*			trans	-81.7	115.3	164.1	-70.5	-93.1	0	0	0	108.1	E181 N185 V220	E181-Y183 HydrophobicContact CB-CD2 4.42Å; E181-Y183 HydrophobicContact CB-CE2 3.96Å; E181-Y183 PolarHBondContact O-N 3.42Å; E181-Y183 VanDerWaalsContact OE2-CE2 3.29Å; E181-Y183 WeakPolarHBondContact OE2-CE2 3.45Å; E181-Y183 PolarHBondContact OE2-OH 3.28Å; Y183-N185 PolarHBondContact O-N 2.97Å; Y183-V220 HydrophobicContact CE1-CG2 4.43Å
184	L	39.9	Very low	41.5	Very low	110 Å²	110	130 Å²	130	58%	0.576	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	9.1	-177.9	-79.2	177.2	0	0	0	115.6
185	N	30	Very low	43.9	Very low	145 Å²	145	130.2 Å²	130.2	78%	0.775	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.1	12.4	-173.8	-90.4	-19.8	0	0	0	116.9	Y183	Y183-N185 PolarHBondContact O-N 2.97Å
186	S	31.9	Very low	46.3	Very low	95 Å²	95	129.7 Å²	129.7	66%	0.664	68%	0.679	S	S	*	*			trans	-158.7	98	175.8	-173.4	0	0	0	0	113.7
187	L	39.8	Very low	48.6	Very low	156 Å²	156	131 Å²	131	82%	0.817	68%	0.675	S	S	*	*			trans	-124.9	71.6	161.1	-164.6	75.7	0	0	0	108.7
188	N	35.6	Very low	50.5	Low	150 Å²	150	131.8 Å²	131.8	80%	0.802	68%	0.683	S	S	*	*			trans	-144.9	66.7	174.1	-77.7	-37	0	0	0	109.4
189	N	40.4	Very low	52.4	Low	165 Å²	165	131.4 Å²	131.4	88%	0.882	68%	0.681	S	S	*	*			trans	174.7	92.9	153	-111	-15.6	0	0	0	110
190	V	50.5	Low	54.4	Low	124 Å²	124	134 Å²	134	75%	0.752	69%	0.691	S	S	*	*			trans	-128.8	133.9	160.5	-165.4	0	0	0	0	106.4
191	S	48.5	Very low	56.3	Low	86 Å²	86	132.5 Å²	132.5	60%	0.601	69%	0.685	S	S	*	*			trans	-61.6	144	-171.1	59.7	0	0	0	0	113.5	D193	S191-D193 PolarHBondContact O-N 3.04Å
192	D	60	Low	58.5	Low	170 Å²	170	131.2 Å²	131.2	91%	0.909	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	12.6	-164.9	-134.6	8.9	0	0	0	117.6
193	D	69.3	Low	60.7	Low	145 Å²	145	131 Å²	131	78%	0.775	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-1	-171.7	-71.3	-29.3	0	0	0	114.6	S191	S191-D193 PolarHBondContact O-N 3.04Å
194	W	76.2	Confident	63.1	Low	218 Å²	218	127.6 Å²	127.6	83%	0.826	67%	0.669	S	S	*	*			trans	-118.8	118.1	178.5	-61.9	89.7	0	0	0	110.3
195	E	76.7	Confident	65.4	Low	177 Å²	177	124.9 Å²	124.9	83%	0.827	66%	0.655	S	S	*	*			trans	-79.3	123.6	171.9	-171.4	176.4	-171.3	0	0	109.3	I197	E195-I197 PolarHBondContact O-N 3.26Å; E195-I197 VanDerWaalsContact O-N 3.08Å
196	V	75.7	Confident	68	Low	94 Å²	94	119.4 Å²	119.4	57%	0.57	63%	0.628	S	S	*	*			trans	-72.6	103.3	174.7	-177	0	0	0	0	108.4	E199	V196-E199 HydrophobicContact CG1-CG 3.38Å
197	I	75.5	Confident	70.5	Confident	147 Å²	147	118.8 Å²	118.8	75%	0.754	61%	0.614	S	S	*	*			trans	-72.4	-37.9	-175.5	-53.7	176.8	0	0	0	111	E195	E195-I197 PolarHBondContact O-N 3.26Å; E195-I197 VanDerWaalsContact O-N 3.08Å
198	N	72.8	Confident	72.1	Confident	141 Å²	141	113.3 Å²	113.3	75%	0.754	60%	0.596	S	S	*	*			trans	-146	127.8	-179.6	-77.9	-32.5	0	0	0	110.6
199	E	76.4	Confident	73.5	Confident	166 Å²	166	108 Å²	108	78%	0.776	57%	0.567	S	S	*	*			trans	-108.6	129.1	164.2	-64.2	-174.2	165.4	0	0	108.6	V196	V196-E199 HydrophobicContact CG1-CG 3.38Å
200	E	78.6	Confident	74.4	Confident	129 Å²	129	107.8 Å²	107.8	60%	0.603	57%	0.565	S	S	*	*			trans	-113.4	133.3	172.1	-71.6	-162.7	169.5	0	0	110.2	K294	E200-K294 IonicContact OE1-NZ 3.53Å; E200-K294 PolarHBondContact OE1-NZ 3.1Å; E200-K294 IonicContact OE2-NZ 3.76Å; E200-K294 PolarHBondContact OE2-NZ 3.14Å
201	V	84.7	Confident	75.1	Confident	67 Å²	67	107.5 Å²	107.5	41%	0.406	56%	0.556	S	S	.	*			trans	-102.2	128.6	171.2	178.9	0	0	0	0	107.9	F253 A290 S292	V201-F253 HydrophobicContact CG1-CD2 4.09Å; V201-F253 HydrophobicContact CG1-CE2 3.71Å; V201-F253 HydrophobicContact CG1-CZ 4.23Å; V201-A290 HydrophobicContact CB-CB 4.24Å; V201-A290 HydrophobicContact CG1-CB 4.13Å; V201-A290 HydrophobicContact CG2-CB 3.81Å; V201-S292 WeakPolarHBondContact O-CB 3.37Å; V201-S292 PolarHBondContact O-OG 3.13Å
202	L	85.7	Confident	75.8	Confident	47 Å²	47	110.5 Å²	110.5	25%	0.246	57%	0.565	C	S	.	*			trans	-111.2	135.4	177.8	-76.2	154.5	0	0	0	109.4	Y244 K294	L202-Y244 HydrophobicContact CD1-CE1 4.48Å; L202-Y244 HydrophobicContact CD2-CE1 4.23Å; L202-K294 HydrophobicContact CD2-CB 3.49Å; L202-K294 VanDerWaalsContact CD2-CB 3.49Å; L202-K294 HydrophobicContact CD2-CD 4.33Å
203	Y	89.4	Confident	76.1	Confident	75 Å²	75	108.6 Å²	108.6	29%	0.294	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.7	121.8	163.6	176.9	-101.3	0	0	0	108.5	D205 Y251 F253 K294 S295 L296	Y203-D205 HydrophobicContact CE1-CB 3.87Å; Y203-Y251 HydrophobicContact CD1-CD2 4.3Å; Y203-Y251 AromaticContact CD1-CE1 4Å; Y203-Y251 HydrophobicContact CD1-CE1 4Å; Y203-Y251 AromaticContact CD1-CE2 3.68Å; Y203-Y251 HydrophobicContact CD1-CE2 3.68Å; Y203-Y251 AromaticContact CD1-CZ 3.53Å; Y203-Y251 HydrophobicContact CD2-CD1 4.06Å; Y203-Y251 HydrophobicContact CD2-CE1 4.18Å; Y203-Y251 HydrophobicContact CD2-CG 4.24Å; Y203-Y251 HydrophobicContact CE1-CE1 4.12Å; Y203-Y251 HydrophobicContact CE1-CE2 4.49Å; Y203-Y251 AromaticContact CE1-CZ 3.9Å; Y203-Y251 HydrophobicContact CE2-CD1 4.45Å; Y203-Y251 HydrophobicContact CE2-CE1 4.32Å; Y203-Y251 HydrophobicContact CG-CD1 4.11Å; Y203-Y251 AromaticContact CG-CD2 3.87Å; Y203-Y251 HydrophobicContact CG-CD2 3.87Å; Y203-Y251 HydrophobicContact CG-CE1 4.02Å; Y203-Y251 AromaticContact CG-CE2 3.74Å; Y203-Y251 HydrophobicContact CG-CE2 3.74Å; Y203-Y251 HydrophobicContact CG-CG 4.04Å; Y203-Y251 AromaticContact CG-CZ 3.84Å; Y203-F253 HydrophobicContact CD2-CE1 4.24Å; Y203-F253 HydrophobicContact CD2-CZ 4.24Å; Y203-K294 PolarHBondContact N-O 3.28Å; Y203-S295 CarbonylContact O-C 3.5Å; Y203-S295 VanDerWaalsContact O-CA 3.24Å; Y203-S295 WeakPolarHBondContact O-CA 3.27Å; Y203-L296 PolarHBondContact O-N 3.45Å
204	V	88.2	Confident	75.9	Confident	72 Å²	72	103.1 Å²	103.1	44%	0.436	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	117.8	178.4	-178.2	0	0	0	0	108.8	L296 F298	V204-L296 WeakPolarHBondContact CA-O 3.34Å; V204-F298 HydrophobicContact CG1-CD2 3.64Å; V204-F298 HydrophobicContact CG1-CE2 3.83Å
205	D	87.3	Confident	75.6	Confident	53 Å²	53	97.5 Å²	97.5	28%	0.283	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	133.7	169.2	-172.3	28.1	0	0	0	108.9	Y203 Q207 L296 T297 F298	Y203-D205 HydrophobicContact CE1-CB 3.87Å; D205-Q207 PolarHBondContact OD2-NE2 2.83Å; D205-L296 PolarHBondContact N-O 2.86Å; D205-T297 HydrophobicContact CB-CG2 4.37Å; D205-T297 CarbonylContact O-C 3.5Å; D205-T297 WeakPolarHBondContact O-CA 3.46Å; D205-F298 PolarHBondContact O-N 3.32Å
206	C	85.7	Confident	75.3	Confident	30 Å²	30	91.5 Å²	91.5	20%	0.203	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	104.7	177.5	-157.8	0	0	0	0	111.1	L209 M233 F240 F298	C206-L209 HydrophobicContact CB-CD1 3.79Å; C206-L209 WeakPolarHBondContact SG-CD1 3.27Å; C206-M233 HydrophobicContact CB-CE 3.96Å; C206-M233 WeakPolarHBondContact SG-CE 3.37Å; C206-F240 WeakPolarHBondContact SG-CD1 3.3Å; C206-F240 VanDerWaalsContact SG-CE1 3.55Å; C206-F298 HydrophobicContact CB-CB 4.32Å; C206-F298 VanDerWaalsContact SG-CB 3.59Å
207	Q	84.1	Confident	75	Confident	83 Å²	83	91.7 Å²	91.7	39%	0.388	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	136.7	-176	-59.4	-179	0.5	0	0	110.6	D205 T297 F298 Q299	D205-Q207 PolarHBondContact OD2-NE2 2.83Å; Q207-T297 HydrophobicContact CG-CG2 4.12Å; Q207-T297 VanDerWaalsContact NE2-CG2 3.26Å; Q207-F298 WeakPolarHBondContact CB-O 3.34Å; Q207-F298 PolarHBondContact N-O 3.48Å; Q207-Q299 HydrophobicContact CB-CG 4.45Å
208	G	73.4	Confident	74.9	Confident	41 Å²	41	89.5 Å²	89.5	42%	0.423	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	9.5	177.9	0	0	0	0	0	115.2	L210	G208-L210 PolarHBondContact O-N 2.95Å
209	L	65.3	Low	75	Confident	38 Å²	38	83.8 Å²	83.8	20%	0.199	46%	0.458	C	S	.	.			trans	-78.4	101.8	161.9	-103.2	147.5	0	0	0	108.6	C206 I214 L215 F240	C206-L209 HydrophobicContact CB-CD1 3.79Å; C206-L209 WeakPolarHBondContact SG-CD1 3.27Å; L209-I214 HydrophobicContact CD2-CB 3.53Å; L209-I214 HydrophobicContact CD2-CD1 3.93Å; L209-I214 HydrophobicContact CD2-CG1 4.29Å; L209-I214 HydrophobicContact CD2-CG2 3.52Å; L209-L215 HydrophobicContact CD1-CD1 4.2Å; L209-L215 HydrophobicContact CD1-CG 4.39Å; L209-L215 HydrophobicContact CD2-CD1 4.44Å; L209-L215 HydrophobicContact CD2-CG 4.15Å; L209-F240 HydrophobicContact CD1-CE1 4.22Å; L209-F240 HydrophobicContact CD1-CE2 4.36Å; L209-F240 HydrophobicContact CD1-CZ 3.81Å; L209-F240 HydrophobicContact CG-CE1 4.27Å; L209-F240 HydrophobicContact CG-CZ 3.8Å
210	L	58.3	Low	75.2	Confident	160 Å²	160	78.2 Å²	78.2	84%	0.838	44%	0.435	S	S	*	.			trans	-107.5	-3.5	-176.4	-99	133.6	0	0	0	113.6	G208	G208-L210 PolarHBondContact O-N 2.95Å
211	E	65.9	Low	75.6	Confident	119 Å²	119	73.5 Å²	73.5	56%	0.556	41%	0.414	S	S	*	.			trans	-116.2	112.6	-176.8	-69.3	168.6	-167.9	0	0	109	D213 I214	E211-D213 PolarHBondContact O-N 2.99Å; E211-I214 HydrophobicContact CB-CD1 3.77Å; E211-I214 HydrophobicContact CB-CG1 3.93Å; E211-I214 PolarHBondContact O-N 3.42Å
212	D	62.9	Low	75.9	Confident	148 Å²	148	74.8 Å²	74.8	79%	0.791	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-53.5	-25	179	-69.8	-26.1	0	0	0	112.1	I214	D212-I214 VanDerWaalsContact C-N 3.25Å; D212-I214 PolarHBondContact O-N 2.87Å
213	D	65.9	Low	76.1	Confident	131 Å²	131	73.7 Å²	73.7	70%	0.701	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-67	-20.9	-179.2	-49.1	20.9	0	0	0	113.4	E211	E211-D213 PolarHBondContact O-N 2.99Å
214	I	65.1	Low	76.2	Confident	29 Å²	29	71.9 Å²	71.9	15%	0.149	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-86.3	-26.5	-171.6	-57.4	174.3	0	0	0	111.8	L209 E211 D212 S219 V235	L209-I214 HydrophobicContact CD2-CB 3.53Å; L209-I214 HydrophobicContact CD2-CD1 3.93Å; L209-I214 HydrophobicContact CD2-CG1 4.29Å; L209-I214 HydrophobicContact CD2-CG2 3.52Å; E211-I214 HydrophobicContact CB-CD1 3.77Å; E211-I214 HydrophobicContact CB-CG1 3.93Å; E211-I214 PolarHBondContact O-N 3.42Å; D212-I214 VanDerWaalsContact C-N 3.25Å; D212-I214 PolarHBondContact O-N 2.87Å; I214-S219 WeakPolarHBondContact O-CB 3.28Å; I214-S219 PolarHBondContact O-OG 3.28Å; I214-V235 HydrophobicContact CG2-CB 3.88Å; I214-V235 HydrophobicContact CG2-CG1 3.41Å; I214-V235 VanDerWaalsContact CG2-CG1 3.41Å; I214-V235 WeakPolarHBondContact O-CG1 3.34Å
215	L	69.8	Low	76.4	Confident	100 Å²	100	73.2 Å²	73.2	52%	0.524	41%	0.407	S	S	.	.	S	Bend	trans	-108.9	51.2	178.6	-67.4	176.1	0	0	0	111.6	L209 I221 V235	L209-L215 HydrophobicContact CD1-CD1 4.2Å; L209-L215 HydrophobicContact CD1-CG 4.39Å; L209-L215 HydrophobicContact CD2-CD1 4.44Å; L209-L215 HydrophobicContact CD2-CG 4.15Å; L215-I221 HydrophobicContact CD2-CD1 4.3Å; L215-V235 HydrophobicContact CD2-CG1 4.21Å
216	T	70	Confident	76.5	Confident	51 Å²	51	73.7 Å²	73.7	31%	0.313	41%	0.409	S	S	.	.			trans	-75.5	154.3	165.8	67.9	0	0	0	0	110.7	S218 S219	T216-S218 PolarHBondContact O-N 3.35Å; T216-S218 PolarHBondContact OG1-OG 2.9Å; T216-S219 WeakPolarHBondContact CA-OG 3.34Å; T216-S219 PolarHBondContact N-OG 3.37Å; T216-S219 VanDerWaalsContact O-CB 3.25Å; T216-S219 WeakPolarHBondContact O-CB 3.4Å; T216-S219 PolarHBondContact O-N 3.48Å; T216-S219 PolarHBondContact O-OG 3.02Å; T216-S219 PolarHBondContact OG1-OG 3.47Å
217	P	69.8	Low	76.6	Confident	98 Å²	98	80.7 Å²	80.7	64%	0.636	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-20	174.1	-25.7	34.2	0	0	0	114.5
218	S	73.7	Confident	77	Confident	102 Å²	102	78.3 Å²	78.3	71%	0.713	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-5.2	175.5	43.2	0	0	0	0	114.4	T216 V220	T216-S218 PolarHBondContact O-N 3.35Å; T216-S218 PolarHBondContact OG1-OG 2.9Å; S218-V220 PolarHBondContact O-N 2.97Å
219	S	75.2	Confident	77.9	Confident	20 Å²	20	83.3 Å²	83.3	14%	0.14	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-74.5	127.5	-175.7	-41.9	0	0	0	0	109.6	I214 T216 I221	I214-S219 WeakPolarHBondContact O-CB 3.28Å; I214-S219 PolarHBondContact O-OG 3.28Å; T216-S219 WeakPolarHBondContact CA-OG 3.34Å; T216-S219 PolarHBondContact N-OG 3.37Å; T216-S219 VanDerWaalsContact O-CB 3.25Å; T216-S219 WeakPolarHBondContact O-CB 3.4Å; T216-S219 PolarHBondContact O-N 3.48Å; T216-S219 PolarHBondContact O-OG 3.02Å; T216-S219 PolarHBondContact OG1-OG 3.47Å; S219-I221 PolarHBondContact O-N 3.35Å
220	V	81.1	Confident	79.3	Confident	49 Å²	49	87 Å²	87	30%	0.297	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-79.7	120.2	173.7	-179	0	0	0	0	108.2	Y183 S218 R222	Y183-V220 HydrophobicContact CE1-CG2 4.43Å; S218-V220 PolarHBondContact O-N 2.97Å; V220-R222 HydrophobicContact CG1-CG 4.22Å
221	I	86.4	Confident	81.1	Confident	31 Å²	31	79.3 Å²	79.3	16%	0.159	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	122.3	171.7	-59	171.3	0	0	0	107.1	L182 L215 S219 M233 V235	L182-I221 PolarHBondContact N-O 3.47Å; L215-I221 HydrophobicContact CD2-CD1 4.3Å; S219-I221 PolarHBondContact O-N 3.35Å; I221-M233 HydrophobicContact CG2-CG 3.76Å; I221-M233 HydrophobicContact CG2-SD 3.67Å; I221-V235 HydrophobicContact CG1-CG1 4.26Å; I221-V235 HydrophobicContact CG1-CG2 4.22Å; I221-V235 HydrophobicContact CG2-CG2 4.31Å
222	R	90.7	Very high	82.4	Confident	93 Å²	93	76.3 Å²	76.3	35%	0.351	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.8	174.9	-60.8	174.6	177.7	-81.1	-14	108.5	E181 V220 M233 Q234	E181-R222 IonicContact OE1-CZ 2.87Å; E181-R222 IonicContact OE1-NH1 3.72Å; E181-R222 PolarHBondContact OE1-NH1 3.4Å; E181-R222 IonicContact OE1-NH2 2.73Å; E181-R222 PolarHBondContact OE1-NH2 2.94Å; V220-R222 HydrophobicContact CG1-CG 4.22Å; R222-M233 CarbonylContact O-C 3.55Å; R222-M233 WeakPolarHBondContact O-CA 3.4Å; R222-Q234 HydrophobicContact CB-CB 4.25Å; R222-Q234 PolarHBondContact N-O 3.37Å; R222-Q234 PolarHBondContact O-N 3Å
223	L	90.7	Very high	83.8	Confident	24 Å²	24	69.9 Å²	69.9	13%	0.126	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	131.8	170.6	-70.6	162.9	0	0	0	108.2	L180 L182 I226 L232 M233 F298	L180-L223 PolarHBondContact N-O 3.39Å; L180-L223 PolarHBondContact O-N 3.31Å; L182-L223 HydrophobicContact CD1-CD1 3.74Å; L223-I226 HydrophobicContact CD1-CD1 4.12Å; L223-L232 WeakPolarHBondContact CA-O 3.44Å; L223-M233 HydrophobicContact CD2-CB 3.9Å; L223-M233 HydrophobicContact CD2-CG 3.96Å; L223-M233 HydrophobicContact CD2-SD 4.22Å; L223-F298 HydrophobicContact CD2-CE2 4.23Å; L223-F298 HydrophobicContact CD2-CZ 3.77Å
224	V	92	Very high	84.9	Confident	38 Å²	38	67.2 Å²	67.2	23%	0.23	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	131.3	-179.1	-176.1	0	0	0	0	107.9	I226 L232	V224-I226 PolarHBondContact O-N 3.35Å; V224-L232 HydrophobicContact CB-CB 4.2Å; V224-L232 PolarHBondContact N-O 3.09Å; V224-L232 PolarHBondContact O-N 3.18Å
225	D	91.8	Very high	85.9	Confident	99 Å²	99	65.8 Å²	65.8	53%	0.529	35%	0.352	S	S	.	.			trans	55	51.2	174.3	-162.9	14.9	0	0	0	112.8	E227 S228 P231	D225-E227 PolarHBondContact O-N 3.5Å; D225-S228 VanDerWaalsContact O-CB 3.24Å; D225-S228 WeakPolarHBondContact O-CB 3.49Å; D225-S228 PolarHBondContact O-N 2.97Å; D225-S228 WeakPolarHBondContact OD2-CB 3.31Å; D225-P231 WeakPolarHBondContact O-CA 3.37Å; D225-P231 WeakPolarHBondContact O-CB 3.4Å
226	I	89	Confident	86.6	Confident	64 Å²	64	63.3 Å²	63.3	33%	0.328	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-28.4	-174.3	-160.7	163.7	0	0	0	112.7	L223 V224 S228 Y244	L223-I226 HydrophobicContact CD1-CD1 4.12Å; V224-I226 PolarHBondContact O-N 3.35Å; I226-S228 VanDerWaalsContact C-N 3.27Å; I226-S228 PolarHBondContact O-N 2.93Å; I226-Y244 PolarHBondContact O-OH 3.33Å
227	E	87.7	Confident	87.2	Confident	176 Å²	176	66.7 Å²	66.7	82%	0.822	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-12.1	179.5	-59	-172.8	166.7	0	0	113.3	D225	D225-E227 PolarHBondContact O-N 3.5Å
228	S	92.5	Very high	88	Confident	34 Å²	34	62.2 Å²	62.2	24%	0.238	34%	0.344	C	S	.	.	S	Bend	trans	-70.2	157.1	176.3	171.3	0	0	0	0	112.1	D225 I226 K230 P231 Y244	D225-S228 VanDerWaalsContact O-CB 3.24Å; D225-S228 WeakPolarHBondContact O-CB 3.49Å; D225-S228 PolarHBondContact O-N 2.97Å; D225-S228 WeakPolarHBondContact OD2-CB 3.31Å; I226-S228 VanDerWaalsContact C-N 3.27Å; I226-S228 PolarHBondContact O-N 2.93Å; S228-K230 PolarHBondContact O-N 3.21Å; S228-K230 PolarHBondContact OG-N 2.96Å; S228-K230 VanDerWaalsContact OG-N 3.11Å; S228-P231 WeakPolarHBondContact O-CD 3.41Å; S228-Y244 WeakPolarHBondContact O-CE2 3.49Å
229	N	92.3	Very high	88.8	Confident	145 Å²	145	58.5 Å²	58.5	78%	0.775	32%	0.317	S	S	*	.	S	Bend	trans	-63.2	-18.9	170.5	-65.1	-35.4	0	0	0	112.7
230	K	95.1	Very high	89.6	Confident	115 Å²	115	57.6 Å²	57.6	50%	0.5	31%	0.31	S	S	.	.	S	Bend	trans	-133.8	67.8	-178.1	-70.7	178.2	163	-120.1	0	110.4	S228 E241 G242	S228-K230 PolarHBondContact O-N 3.21Å; S228-K230 PolarHBondContact OG-N 2.96Å; S228-K230 VanDerWaalsContact OG-N 3.11Å; K230-E241 HydrophobicContact CB-CG 4.1Å; K230-E241 HydrophobicContact CG-CG 4.42Å; K230-E241 IonicContact NZ-OE1 3.46Å; K230-E241 PolarHBondContact NZ-OE1 3.31Å; K230-E241 IonicContact NZ-OE2 3.7Å; K230-G242 WeakPolarHBondContact CA-O 3.26Å
231	P	95.2	Very high	90.3	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.311	C	S	.	.			trans	-65.1	152	-179.9	31.5	-36.4	0	0	0	109.7	D225 S228 G242 Y244 L296 F298	D225-P231 WeakPolarHBondContact O-CA 3.37Å; D225-P231 WeakPolarHBondContact O-CB 3.4Å; S228-P231 WeakPolarHBondContact O-CD 3.41Å; P231-G242 WeakPolarHBondContact CD-O 3.39Å; P231-G242 WeakPolarHBondContact O-CA 3.29Å; P231-G242 PolarHBondContact O-N 3.37Å; P231-Y244 HydrophobicContact CG-CE2 4.17Å; P231-L296 HydrophobicContact CG-CD1 3.69Å; P231-L296 HydrophobicContact CG-CD2 4.08Å; P231-L296 HydrophobicContact CG-CG 4.47Å; P231-F298 HydrophobicContact CG-CE1 4.4Å; P231-F298 HydrophobicContact CG-CZ 4.29Å
232	L	94.6	Very high	90.7	Very high	56 Å²	56	57 Å²	57	29%	0.293	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	141.8	176.2	-61.7	175.8	0	0	0	110.1	L223 V224 F240 E241 I301	L223-L232 WeakPolarHBondContact CA-O 3.44Å; V224-L232 HydrophobicContact CB-CB 4.2Å; V224-L232 PolarHBondContact N-O 3.09Å; V224-L232 PolarHBondContact O-N 3.18Å; L232-F240 WeakPolarHBondContact CA-O 3.3Å; L232-F240 WeakPolarHBondContact CD2-O 3.45Å; L232-E241 HydrophobicContact CD2-CB 4.07Å; L232-E241 HydrophobicContact CD2-CG 4.27Å; L232-I301 HydrophobicContact CD2-CD1 3.96Å
233	M	91.7	Very high	90.9	Very high	12 Å²	12	55.3 Å²	55.3	6%	0.059	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	137.6	170.3	-176.9	172.9	66.2	0	0	109.4	C206 I221 R222 L223 V235 V239 F240 F298	C206-M233 HydrophobicContact CB-CE 3.96Å; C206-M233 WeakPolarHBondContact SG-CE 3.37Å; I221-M233 HydrophobicContact CG2-CG 3.76Å; I221-M233 HydrophobicContact CG2-SD 3.67Å; R222-M233 CarbonylContact O-C 3.55Å; R222-M233 WeakPolarHBondContact O-CA 3.4Å; L223-M233 HydrophobicContact CD2-CB 3.9Å; L223-M233 HydrophobicContact CD2-CG 3.96Å; L223-M233 HydrophobicContact CD2-SD 4.22Å; M233-V235 HydrophobicContact CE-CG2 4.17Å; M233-V235 HydrophobicContact CG-CG2 4.08Å; M233-V235 HydrophobicContact SD-CG2 4.21Å; M233-V239 CarbonylContact O-C 3.55Å; M233-V239 WeakPolarHBondContact O-CA 3.23Å; M233-F240 HydrophobicContact CB-CB 4.35Å; M233-F240 HydrophobicContact CE-CD2 4.23Å; M233-F240 HydrophobicContact CE-CG 4.34Å; M233-F240 PolarHBondContact N-O 3.06Å; M233-F240 PolarHBondContact O-N 3.47Å; M233-F298 HydrophobicContact CB-CD1 3.62Å; M233-F298 HydrophobicContact CB-CD2 4.43Å; M233-F298 HydrophobicContact CB-CE1 3.36Å; M233-F298 HydrophobicContact CB-CE2 4.19Å; M233-F298 HydrophobicContact CB-CG 4.16Å; M233-F298 HydrophobicContact CB-CZ 3.67Å; M233-F298 HydrophobicContact CE-CB 3.95Å; M233-F298 HydrophobicContact CE-CD1 4.33Å; M233-F298 HydrophobicContact CE-CD2 3.8Å; M233-F298 HydrophobicContact CE-CE2 4.37Å; M233-F298 HydrophobicContact CE-CG 3.77Å; M233-F298 HydrophobicContact SD-CD2 4.19Å; M233-F298 HydrophobicContact SD-CE2 4.17Å
234	Q	89.1	Confident	91	Very high	75 Å²	75	58.7 Å²	58.7	35%	0.35	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	128.2	171.3	-177.1	-176.1	0.5	0	0	109.8	R222 G236 A238 V239	R222-Q234 HydrophobicContact CB-CB 4.25Å; R222-Q234 PolarHBondContact N-O 3.37Å; R222-Q234 PolarHBondContact O-N 3Å; Q234-G236 WeakPolarHBondContact CG-O 3.4Å; Q234-G236 PolarHBondContact NE2-O 2.94Å; Q234-A238 WeakPolarHBondContact CA-O 3.21Å; Q234-V239 HydrophobicContact CG-CG2 4.37Å
235	V	85.7	Confident	90.8	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	107.6	172.9	-162.9	0	0	0	0	107.9	I214 L215 I221 M233 A238 F240	I214-V235 HydrophobicContact CG2-CB 3.88Å; I214-V235 HydrophobicContact CG2-CG1 3.41Å; I214-V235 VanDerWaalsContact CG2-CG1 3.41Å; I214-V235 WeakPolarHBondContact O-CG1 3.34Å; L215-V235 HydrophobicContact CD2-CG1 4.21Å; I221-V235 HydrophobicContact CG1-CG1 4.26Å; I221-V235 HydrophobicContact CG1-CG2 4.22Å; I221-V235 HydrophobicContact CG2-CG2 4.31Å; M233-V235 HydrophobicContact CE-CG2 4.17Å; M233-V235 HydrophobicContact CG-CG2 4.08Å; M233-V235 HydrophobicContact SD-CG2 4.21Å; V235-A238 PolarHBondContact N-O 3.4Å; V235-A238 PolarHBondContact O-N 3.19Å; V235-F240 HydrophobicContact CB-CE2 4.47Å; V235-F240 HydrophobicContact CG2-CE2 4.3Å
236	G	84	Confident	90.4	Very high	47 Å²	47	63.7 Å²	63.7	49%	0.485	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	-124.3	-170.5	0	0	0	0	0	111.9	Q234	Q234-G236 WeakPolarHBondContact CG-O 3.4Å; Q234-G236 PolarHBondContact NE2-O 2.94Å
237	P	83.2	Confident	89.9	Confident	123 Å²	123	62.1 Å²	62.1	80%	0.799	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-7.9	177.9	34.8	-35	0	0	0	114
238	A	86.2	Confident	89.9	Confident	3 Å²	3	60 Å²	60	3%	0.025	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	136.5	-177.2	0	0	0	0	0	111	Q234 V235 F240	Q234-A238 WeakPolarHBondContact CA-O 3.21Å; V235-A238 PolarHBondContact N-O 3.4Å; V235-A238 PolarHBondContact O-N 3.19Å; A238-F240 HydrophobicContact CB-CE2 3.53Å; A238-F240 HydrophobicContact CB-CZ 3.77Å
239	V	90.7	Very high	89.7	Confident	24 Å²	24	60.6 Å²	60.6	15%	0.145	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	140.9	177.7	-174.4	0	0	0	0	109	M233 Q234 I301 L303	M233-V239 CarbonylContact O-C 3.55Å; M233-V239 WeakPolarHBondContact O-CA 3.23Å; Q234-V239 HydrophobicContact CG-CG2 4.37Å; V239-I301 HydrophobicContact CB-CG1 4.28Å; V239-I301 HydrophobicContact CG1-CD1 4.05Å; V239-I301 HydrophobicContact CG1-CG1 3.95Å; V239-I301 PolarHBondContact O-N 3.33Å; V239-L303 HydrophobicContact CG1-CD1 4.5Å; V239-L303 HydrophobicContact CG1-CD2 4.49Å; V239-L303 HydrophobicContact CG2-CD1 4.16Å
240	F	92.8	Very high	89.6	Confident	1 Å²	1	57.7 Å²	57.7	0%	0.004	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	143.5	-176.7	-54.7	-100.9	0	0	0	110.2	C206 L209 L232 M233 V235 A238 F298 Q299 R300	C206-F240 WeakPolarHBondContact SG-CD1 3.3Å; C206-F240 VanDerWaalsContact SG-CE1 3.55Å; L209-F240 HydrophobicContact CD1-CE1 4.22Å; L209-F240 HydrophobicContact CD1-CE2 4.36Å; L209-F240 HydrophobicContact CD1-CZ 3.81Å; L209-F240 HydrophobicContact CG-CE1 4.27Å; L209-F240 HydrophobicContact CG-CZ 3.8Å; L232-F240 WeakPolarHBondContact CA-O 3.3Å; L232-F240 WeakPolarHBondContact CD2-O 3.45Å; M233-F240 HydrophobicContact CB-CB 4.35Å; M233-F240 HydrophobicContact CE-CD2 4.23Å; M233-F240 HydrophobicContact CE-CG 4.34Å; M233-F240 PolarHBondContact N-O 3.06Å; M233-F240 PolarHBondContact O-N 3.47Å; V235-F240 HydrophobicContact CB-CE2 4.47Å; V235-F240 HydrophobicContact CG2-CE2 4.3Å; A238-F240 HydrophobicContact CB-CE2 3.53Å; A238-F240 HydrophobicContact CB-CZ 3.77Å; F240-F298 HydrophobicContact CB-CB 3.87Å; F240-F298 HydrophobicContact CB-CD1 3.78Å; F240-F298 HydrophobicContact CB-CG 4.2Å; F240-F298 HydrophobicContact CG-CB 4.45Å; F240-Q299 CarbonylContact C-O 3.55Å; F240-Q299 WeakPolarHBondContact CA-O 3.49Å; F240-R300 VanDerWaalsContact CD1-CA 3.47Å; F240-R300 HydrophobicContact CD1-CB 3.83Å; F240-R300 HydrophobicContact CD1-CG 4.43Å; F240-R300 HydrophobicContact CE1-CB 3.71Å; F240-R300 HydrophobicContact CE1-CG 4.12Å; F240-R300 HydrophobicContact CZ-CG 4.49Å
241	E	95.4	Very high	89.3	Confident	66 Å²	66	56.3 Å²	56.3	31%	0.308	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	129.4	169.2	-174.6	178.1	95.2	0	0	108.9	K230 L232 F298 Q299 I301	K230-E241 HydrophobicContact CB-CG 4.1Å; K230-E241 HydrophobicContact CG-CG 4.42Å; K230-E241 IonicContact NZ-OE1 3.46Å; K230-E241 PolarHBondContact NZ-OE1 3.31Å; K230-E241 IonicContact NZ-OE2 3.7Å; L232-E241 HydrophobicContact CD2-CB 4.07Å; L232-E241 HydrophobicContact CD2-CG 4.27Å; E241-F298 WeakPolarHBondContact O-CA 3.42Å; E241-Q299 PolarHBondContact N-O 3.48Å; E241-Q299 PolarHBondContact O-N 3.02Å; E241-I301 HydrophobicContact CB-CD1 4.21Å; E241-I301 HydrophobicContact CB-CG2 3.75Å
242	G	94.8	Very high	89.1	Confident	2 Å²	2	61 Å²	61	2%	0.021	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	156.2	-179.8	0	0	0	0	0	112.2	K230 P231 T297 F298	K230-G242 WeakPolarHBondContact CA-O 3.26Å; P231-G242 WeakPolarHBondContact CD-O 3.39Å; P231-G242 WeakPolarHBondContact O-CA 3.29Å; P231-G242 PolarHBondContact O-N 3.37Å; G242-T297 CarbonylContact C-O 3.53Å; G242-T297 VanDerWaalsContact CA-O 3.26Å; G242-T297 WeakPolarHBondContact CA-O 3.26Å; G242-F298 VanDerWaalsContact CA-CD1 3.43Å; G242-F298 VanDerWaalsContact N-CD1 3.35Å
243	H	94.4	Very high	88.8	Confident	58 Å²	58	61.3 Å²	61.3	27%	0.269	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	135.6	167	55.8	-51.9	0	0	0	108.8	E245 T297	H243-E245 IonicContact CD2-OE1 2.65Å; H243-E245 IonicContact NE2-OE1 3.06Å; H243-E245 PolarHBondContact NE2-OE1 2.79Å; H243-T297 WeakPolarHBondContact CE1-CB 3.34Å; H243-T297 VanDerWaalsContact CE1-CG2 3.43Å; H243-T297 WeakPolarHBondContact CE1-CG2 3.48Å; H243-T297 PolarHBondContact CE1-O 2.98Å; H243-T297 PolarHBondContact N-O 2.9Å; H243-T297 PolarHBondContact ND1-O 3.41Å; H243-T297 PolarHBondContact O-N 3.42Å
244	Y	92.3	Very high	88.7	Confident	95 Å²	95	66.3 Å²	66.3	37%	0.373	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	133.4	176.7	-71.2	-78.8	0	0	0	110.1	L202 I226 S228 P231 L296	L202-Y244 HydrophobicContact CD1-CE1 4.48Å; L202-Y244 HydrophobicContact CD2-CE1 4.23Å; I226-Y244 PolarHBondContact O-OH 3.33Å; S228-Y244 WeakPolarHBondContact O-CE2 3.49Å; P231-Y244 HydrophobicContact CG-CE2 4.17Å; Y244-L296 HydrophobicContact CD1-CB 4.34Å; Y244-L296 HydrophobicContact CD1-CD1 3.98Å; Y244-L296 HydrophobicContact CD2-CD1 4.26Å; Y244-L296 HydrophobicContact CE1-CB 4.24Å; Y244-L296 HydrophobicContact CE1-CD1 3.94Å; Y244-L296 HydrophobicContact CE1-CD2 4.21Å; Y244-L296 HydrophobicContact CE1-CG 4.36Å; Y244-L296 HydrophobicContact CE2-CD1 4.22Å; Y244-L296 HydrophobicContact CG-CD1 4.15Å
245	E	88.7	Confident	88.5	Confident	86 Å²	86	66 Å²	66	40%	0.402	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	134.3	176.6	-66	-175.1	136.2	0	0	109.9	H243 S295 T297	H243-E245 IonicContact CD2-OE1 2.65Å; H243-E245 IonicContact NE2-OE1 3.06Å; H243-E245 PolarHBondContact NE2-OE1 2.79Å; E245-S295 WeakPolarHBondContact CB-OG 3.33Å; E245-S295 PolarHBondContact N-O 3Å; E245-S295 PolarHBondContact O-N 3.37Å; E245-S295 PolarHBondContact O-OG 3.38Å; E245-T297 PolarHBondContact OE2-OG1 3.49Å
246	D	83.1	Confident	88	Confident	156 Å²	156	70.4 Å²	70.4	83%	0.834	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	126.2	169.1	-77.3	-28.1	0	0	0	109.3
247	T	79.5	Confident	86.9	Confident	30 Å²	30	72.2 Å²	72.2	18%	0.184	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	136.6	-180	57	0	0	0	0	112.2	G249 Y251 S293 S295	T247-G249 PolarHBondContact O-N 3.49Å; T247-Y251 HydrophobicContact CG2-CD2 4.4Å; T247-Y251 HydrophobicContact CG2-CE2 3.4Å; T247-Y251 VanDerWaalsContact CG2-CE2 3.4Å; T247-S293 PolarHBondContact N-O 2.94Å; T247-S293 VanDerWaalsContact OG1-C 3.22Å; T247-S293 PolarHBondContact OG1-O 3.49Å; T247-S295 WeakPolarHBondContact CG2-OG 3.12Å
248	V	85.8	Confident	85.3	Confident	132 Å²	132	69.1 Å²	69.1	80%	0.8	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	93.5	169.5	-177.8	0	0	0	0	107.8
249	G	90.2	Very high	83.1	Confident	47 Å²	47	74.8 Å²	74.8	49%	0.485	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	121	-150.2	178.7	0	0	0	0	0	112.2	T247	T247-G249 PolarHBondContact O-N 3.49Å
250	T	88.6	Confident	80.7	Confident	84 Å²	84	79.9 Å²	79.9	52%	0.515	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	124.8	-176.9	-51.8	0	0	0	0	108.8	L252 K291 S292	T250-L252 HydrophobicContact CG2-CD2 4.21Å; T250-K291 HydrophobicContact CG2-CB 3.78Å; T250-K291 HydrophobicContact CG2-CD 4.26Å; T250-K291 HydrophobicContact CG2-CG 4.36Å; T250-S292 CarbonylContact C-O 3.55Å; T250-S292 WeakPolarHBondContact CA-O 3.01Å
251	Y	89.2	Confident	77.9	Confident	86 Å²	86	86 Å²	86	34%	0.337	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	137.2	166.4	-64.5	-76.4	0	0	0	109.9	Y203 T247 K291 S292	Y203-Y251 HydrophobicContact CD1-CD2 4.3Å; Y203-Y251 AromaticContact CD1-CE1 4Å; Y203-Y251 HydrophobicContact CD1-CE1 4Å; Y203-Y251 AromaticContact CD1-CE2 3.68Å; Y203-Y251 HydrophobicContact CD1-CE2 3.68Å; Y203-Y251 AromaticContact CD1-CZ 3.53Å; Y203-Y251 HydrophobicContact CD2-CD1 4.06Å; Y203-Y251 HydrophobicContact CD2-CE1 4.18Å; Y203-Y251 HydrophobicContact CD2-CG 4.24Å; Y203-Y251 HydrophobicContact CE1-CE1 4.12Å; Y203-Y251 HydrophobicContact CE1-CE2 4.49Å; Y203-Y251 AromaticContact CE1-CZ 3.9Å; Y203-Y251 HydrophobicContact CE2-CD1 4.45Å; Y203-Y251 HydrophobicContact CE2-CE1 4.32Å; Y203-Y251 HydrophobicContact CG-CD1 4.11Å; Y203-Y251 AromaticContact CG-CD2 3.87Å; Y203-Y251 HydrophobicContact CG-CD2 3.87Å; Y203-Y251 HydrophobicContact CG-CE1 4.02Å; Y203-Y251 AromaticContact CG-CE2 3.74Å; Y203-Y251 HydrophobicContact CG-CE2 3.74Å; Y203-Y251 HydrophobicContact CG-CG 4.04Å; Y203-Y251 AromaticContact CG-CZ 3.84Å; T247-Y251 HydrophobicContact CG2-CD2 4.4Å; T247-Y251 HydrophobicContact CG2-CE2 3.4Å; T247-Y251 VanDerWaalsContact CG2-CE2 3.4Å; Y251-K291 CarbonylContact O-C 3.5Å; Y251-K291 WeakPolarHBondContact O-CA 3.48Å; Y251-K291 WeakPolarHBondContact O-CB 2.71Å; Y251-S292 PolarHBondContact N-O 2.75Å; Y251-S292 PolarHBondContact O-N 3.44Å
252	L	90.4	Very high	74.9	Confident	97 Å²	97	89.8 Å²	89.8	51%	0.508	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	126.1	174.9	-59.7	176.9	0	0	0	108.3	T250 F254 Y288 K291	T250-L252 HydrophobicContact CG2-CD2 4.21Å; L252-F254 HydrophobicContact CB-CD2 4.38Å; L252-F254 HydrophobicContact CB-CE2 3.54Å; L252-F254 HydrophobicContact CB-CZ 4.04Å; L252-F254 HydrophobicContact CD1-CE2 4.43Å; L252-F254 HydrophobicContact CD1-CZ 4.33Å; L252-Y288 HydrophobicContact CD2-CE2 4.06Å; L252-K291 HydrophobicContact CD2-CB 3.76Å
253	F	88.3	Confident	71.7	Confident	63 Å²	63	95.4 Å²	95.4	28%	0.276	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	131.4	-179.4	-57.4	-87.8	0	0	0	109.3	V201 Y203 V289 A290	V201-F253 HydrophobicContact CG1-CD2 4.09Å; V201-F253 HydrophobicContact CG1-CE2 3.71Å; V201-F253 HydrophobicContact CG1-CZ 4.23Å; Y203-F253 HydrophobicContact CD2-CE1 4.24Å; Y203-F253 HydrophobicContact CD2-CZ 4.24Å; F253-V289 HydrophobicContact CB-CB 4.23Å; F253-V289 PolarHBondContact O-N 2.99Å; F253-A290 HydrophobicContact CB-CB 4.44Å; F253-A290 HydrophobicContact CD2-CB 4.05Å; F253-A290 WeakPolarHBondContact CD2-O 3.34Å; F253-A290 PolarHBondContact N-O 3.33Å
254	F	89.8	Confident	68.6	Low	118 Å²	118	99.8 Å²	99.8	52%	0.518	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	129.5	179	-61.7	-91.8	0	0	0	109.9	L252 R287 Y288	L252-F254 HydrophobicContact CB-CD2 4.38Å; L252-F254 HydrophobicContact CB-CE2 3.54Å; L252-F254 HydrophobicContact CB-CZ 4.04Å; L252-F254 HydrophobicContact CD1-CE2 4.43Å; L252-F254 HydrophobicContact CD1-CZ 4.33Å; F254-R287 CarbonylContact C-O 3.53Å; F254-R287 VanDerWaalsContact CA-O 3.25Å; F254-R287 WeakPolarHBondContact CA-O 3.44Å; F254-Y288 HydrophobicContact CE1-CD2 4.14Å; F254-Y288 HydrophobicContact CZ-CD2 4.37Å
255	D	84.8	Confident	65.6	Low	67 Å²	67	100.9 Å²	100.9	36%	0.358	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.4	134.6	168.1	-79.3	-23.7	0	0	0	108.3	T286 R287 V289	D255-T286 CarbonylContact O-C 3.49Å; D255-T286 WeakPolarHBondContact O-CA 3.43Å; D255-R287 HydrophobicContact CB-CB 4.41Å; D255-R287 PolarHBondContact N-O 2.9Å; D255-R287 PolarHBondContact O-N 2.64Å; D255-R287 IonicContact OD2-CZ 2.75Å; D255-R287 IonicContact OD2-NE 2.89Å; D255-R287 IonicContact OD2-NH2 3.74Å; D255-R287 PolarHBondContact OD2-NH2 3.22Å; D255-V289 HydrophobicContact CB-CG2 3.72Å; D255-V289 VanDerWaalsContact N-CG2 3.29Å; D255-V289 WeakPolarHBondContact OD1-CG2 3.45Å; D255-V289 VanDerWaalsContact OD2-CG2 3.23Å; D255-V289 WeakPolarHBondContact OD2-CG2 3.36Å
256	N	76.1	Confident	63.1	Low	94 Å²	94	104.4 Å²	104.4	50%	0.503	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99	110.6	169.9	-155.7	7.4	0	0	0	107.9	S258	N256-S258 PolarHBondContact O-N 3.43Å
257	N	59.6	Low	60.5	Low	84 Å²	84	106.5 Å²	106.5	45%	0.449	59%	0.585	S	S	.	*			trans	-76.4	40.4	-180	-68.3	-12.3	0	0	0	111.9	T259 T285	N257-T259 VanDerWaalsContact C-N 3.29Å; N257-T259 PolarHBondContact O-N 3.12Å; N257-T285 PolarHBondContact N-O 3.19Å
258	S	50.4	Low	58.1	Low	58 Å²	58	108.4 Å²	108.4	41%	0.406	61%	0.611	S	S	.	*			trans	-74.4	92.6	169.6	66.4	0	0	0	0	108	N256 L260	N256-S258 PolarHBondContact O-N 3.43Å; S258-L260 PolarHBondContact O-N 3.12Å
259	T	40.7	Very low	55.6	Low	123 Å²	123	107.1 Å²	107.1	76%	0.755	61%	0.614	S	S	*	*			trans	-61.1	69.3	149	40.9	0	0	0	0	108.1	N257 N261	N257-T259 VanDerWaalsContact C-N 3.29Å; N257-T259 PolarHBondContact O-N 3.12Å; T259-N261 PolarHBondContact O-N 3.16Å
260	L	40.2	Very low	52.8	Low	131 Å²	131	110.2 Å²	110.2	69%	0.686	63%	0.629	S	S	*	*			trans	-73.2	88.3	163	-161.3	95.6	0	0	0	105	S258 N262	S258-L260 PolarHBondContact O-N 3.12Å; L260-N262 VanDerWaalsContact C-N 3.33Å; L260-N262 PolarHBondContact O-N 2.82Å
261	N	34.3	Very low	50.2	Low	128 Å²	128	112.4 Å²	112.4	68%	0.684	64%	0.641	S	S	*	*			trans	-48.4	104.8	162.1	-63.2	-32	0	0	0	106.7	T259 T263	T259-N261 PolarHBondContact O-N 3.16Å; N261-T263 PolarHBondContact O-N 2.93Å
262	N	31.9	Very low	47.6	Very low	146 Å²	146	112.4 Å²	112.4	78%	0.781	66%	0.659	S	S	*	*			trans	-68.9	48	171	-86.6	-18.7	0	0	0	110.9	L260 L264	L260-N262 VanDerWaalsContact C-N 3.33Å; L260-N262 PolarHBondContact O-N 2.82Å; N262-L264 PolarHBondContact O-N 3.24Å
263	T	28.2	Very low	45	Very low	120 Å²	120	114.3 Å²	114.3	74%	0.736	68%	0.677	S	S	*	*			trans	-94.9	86.5	162.5	-42.6	0	0	0	0	106.3	N261	N261-T263 PolarHBondContact O-N 2.93Å
264	L	29.3	Very low	42.5	Very low	151 Å²	151	119 Å²	119	79%	0.791	70%	0.704	S	S	*	*			trans	-44.2	125.9	158.8	-73	159.4	0	0	0	108	N262 I266	N262-L264 PolarHBondContact O-N 3.24Å; L264-I266 PolarHBondContact O-N 3.44Å
265	P	29.3	Very low	39.9	Very low	118 Å²	118	124.6 Å²	124.6	77%	0.766	72%	0.722	S	S	*	*			trans	-67.9	112.7	171.1	24.3	-23.8	0	0	0	106.8	E267	P265-E267 PolarHBondContact O-N 3.41Å
266	I	35.1	Very low	37.5	Very low	160 Å²	160	130.9 Å²	130.9	82%	0.821	75%	0.746	S	S	*	*			trans	-57.9	110	169.8	-65.9	173.2	0	0	0	106.7	L264 G268	L264-I266 PolarHBondContact O-N 3.44Å; I266-G268 PolarHBondContact O-N 2.77Å; I266-G268 VanDerWaalsContact O-N 3.14Å
267	E	28.8	Very low	35.5	Very low	199 Å²	199	135.9 Å²	135.9	93%	0.93	77%	0.769	S	S	*	*	S	Bend	trans	-57.2	113	164	-84.3	-178.4	141.4	0	0	108.6	P265	P265-E267 PolarHBondContact O-N 3.41Å
268	G	29.1	Very low	34.4	Very low	71 Å²	71	137.9 Å²	137.9	73%	0.732	78%	0.78	S	S	*	*			trans	140.2	73	164.1	0	0	0	0	0	115.6	I266	I266-G268 PolarHBondContact O-N 2.77Å; I266-G268 VanDerWaalsContact O-N 3.14Å
269	A	33.5	Very low	34	Very low	104 Å²	104	142.5 Å²	142.5	86%	0.86	80%	0.8	S	S	*	*			trans	-167.3	124.5	139.2	0	0	0	0	0	110.8
270	S	32.2	Very low	34.1	Very low	113 Å²	113	144 Å²	144	79%	0.79	80%	0.798	S	S	*	*			trans	-60.8	143.6	172.9	-179.2	0	0	0	0	112.8
271	V	32.7	Very low	34.5	Very low	129 Å²	129	143.1 Å²	143.1	78%	0.782	80%	0.798	S	S	*	*				147.1	118.7	127.2	175.1	0	0	0	0	112.3
272	A	34.4	Very low	35.2	Very low	86 Å²	86	141.4 Å²	141.4	71%	0.711	79%	0.794	S	S	*	*			trans	73.7	122.8	157.7	0	0	0	0	0	120.9	L274	A272-L274 PolarHBondContact O-N 3.33Å
273	P	37.2	Very low	36.1	Very low	137 Å²	137	142.7 Å²	142.7	89%	0.89	80%	0.796	S	S	*	*			trans	-89.7	97.3	172.1	33.9	-26.8	0	0	0	110.6
274	L	35.8	Very low	37.6	Very low	161 Å²	161	142.7 Å²	142.7	84%	0.843	79%	0.787	S	S	*	*			trans	-98.9	111.2	166.4	-166	67.3	0	0	0	110.3	A272 K276	A272-L274 PolarHBondContact O-N 3.33Å; L274-K276 PolarHBondContact O-N 3.44Å
275	R	33.2	Very low	39.5	Very low	237 Å²	237	139.1 Å²	139.1	89%	0.894	77%	0.771	S	S	*	*			trans	-28.5	113.7	167.8	-61.4	171	178.6	156.9	-0.8	113.6
276	K	34.8	Very low	41.9	Very low	198 Å²	198	138 Å²	138	86%	0.861	76%	0.762	S	S	*	*			trans	-131.8	123.3	146.1	-72.3	-169.1	179.4	-179.2	0	108.3	L274 D278	L274-K276 PolarHBondContact O-N 3.44Å; K276-D278 PolarHBondContact O-N 3.15Å
277	M	33.8	Very low	44.3	Very low	200 Å²	200	136.9 Å²	136.9	99%	0.985	75%	0.748	S	S	*	*			trans	-73.2	105.9	177.6	-164.3	145.6	168.6	0	0	106.4
278	D	38	Very low	47.2	Very low	125 Å²	125	132.9 Å²	132.9	67%	0.668	73%	0.725	S	S	*	*			trans	-90.3	112.3	-173.4	-147.6	6	0	0	0	109	K276 Q280	K276-D278 PolarHBondContact O-N 3.15Å; D278-Q280 VanDerWaalsContact OD1-CG 3.32Å; D278-Q280 WeakPolarHBondContact OD1-CG 3.37Å
279	D	41.1	Very low	49.9	Very low	155 Å²	155	132.6 Å²	132.6	83%	0.829	71%	0.709	S	S	*	*			trans	-95.7	38.9	170.8	-154.8	16.3	0	0	0	110	T281	D279-T281 PolarHBondContact O-N 2.99Å
280	Q	44	Very low	52.5	Low	156 Å²	156	128.4 Å²	128.4	73%	0.729	67%	0.674	S	S	*	*			trans	-98.5	73.8	175.1	-68.7	-167	28.9	0	0	109.6	D278 P282	D278-Q280 VanDerWaalsContact OD1-CG 3.32Å; D278-Q280 WeakPolarHBondContact OD1-CG 3.37Å; Q280-P282 VanDerWaalsContact O-CD 3.3Å; Q280-P282 WeakPolarHBondContact O-CD 3.27Å
281	T	47.5	Very low	55.2	Low	111 Å²	111	129.5 Å²	129.5	68%	0.681	67%	0.665	S	S	*	*			trans	-72.2	116.4	160.2	-42.6	0	0	0	0	106.2	D279 Q283	D279-T281 PolarHBondContact O-N 2.99Å; T281-Q283 PolarHBondContact O-N 3.47Å
282	P	49.9	Very low	57.7	Low	93 Å²	93	123.7 Å²	123.7	60%	0.604	63%	0.63	S	S	*	*			trans	-61.3	108.9	177.6	22.8	-29.9	0	0	0	107.8	Q280 H284	Q280-P282 VanDerWaalsContact O-CD 3.3Å; Q280-P282 WeakPolarHBondContact O-CD 3.27Å; P282-H284 PolarHBondContact O-N 3.36Å
283	Q	51.1	Low	60.2	Low	172 Å²	172	123 Å²	123	80%	0.804	62%	0.62	S	S	*	*			trans	-71	83.4	173.3	-71.5	-171.4	-2.9	0	0	107.4	T281 T285	T281-Q283 PolarHBondContact O-N 3.47Å; Q283-T285 VanDerWaalsContact C-N 3.3Å; Q283-T285 PolarHBondContact O-N 3.48Å
284	H	59	Low	62.5	Low	121 Å²	121	120.4 Å²	120.4	56%	0.56	60%	0.595	S	S	*	*			trans	-62.9	98	167.1	-76.9	-78	0	0	0	107.7	P282	P282-H284 PolarHBondContact O-N 3.36Å
285	T	69.3	Low	65.1	Low	75 Å²	75	113 Å²	113	46%	0.46	56%	0.556	S	S	.	*			trans	-96.1	115.6	173.1	45.8	0	0	0	0	107.5	N257 Q283	N257-T285 PolarHBondContact N-O 3.19Å; Q283-T285 VanDerWaalsContact C-N 3.3Å; Q283-T285 PolarHBondContact O-N 3.48Å
286	T	78.6	Confident	67.9	Low	94 Å²	94	101.8 Å²	101.8	58%	0.577	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	131.7	168.9	44.9	0	0	0	0	108.7	D255	D255-T286 CarbonylContact O-C 3.49Å; D255-T286 WeakPolarHBondContact O-CA 3.43Å
287	R	87.3	Confident	70.6	Confident	137 Å²	137	92.5 Å²	92.5	52%	0.517	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	126.9	-180	-174.9	-176.8	75.4	118.1	1.2	108.9	F254 D255 V289	F254-R287 CarbonylContact C-O 3.53Å; F254-R287 VanDerWaalsContact CA-O 3.25Å; F254-R287 WeakPolarHBondContact CA-O 3.44Å; D255-R287 HydrophobicContact CB-CB 4.41Å; D255-R287 PolarHBondContact N-O 2.9Å; D255-R287 PolarHBondContact O-N 2.64Å; D255-R287 IonicContact OD2-CZ 2.75Å; D255-R287 IonicContact OD2-NE 2.89Å; D255-R287 IonicContact OD2-NH2 3.74Å; D255-R287 PolarHBondContact OD2-NH2 3.22Å; R287-V289 PolarHBondContact O-N 3.26Å
288	Y	87.7	Confident	73.4	Confident	116 Å²	116	83 Å²	83	46%	0.455	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	132.2	170	169.7	-98.3	0	0	0	110.1	L252 F254 A290 K291	L252-Y288 HydrophobicContact CD2-CE2 4.06Å; F254-Y288 HydrophobicContact CE1-CD2 4.14Å; F254-Y288 HydrophobicContact CZ-CD2 4.37Å; Y288-A290 WeakPolarHBondContact CE2-O 3.18Å; Y288-A290 VanDerWaalsContact OH-C 3.25Å; Y288-K291 HydrophobicContact CE2-CB 4.47Å; Y288-K291 WeakPolarHBondContact OH-CB 3.42Å; Y288-K291 WeakPolarHBondContact OH-CG 3.45Å; Y288-K291 PolarHBondContact OH-N 2.89Å
289	V	86.2	Confident	76	Confident	64 Å²	64	81.6 Å²	81.6	39%	0.388	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	-56.9	-176.2	-179.3	0	0	0	0	110.5	F253 D255 R287	F253-V289 HydrophobicContact CB-CB 4.23Å; F253-V289 PolarHBondContact O-N 2.99Å; D255-V289 HydrophobicContact CB-CG2 3.72Å; D255-V289 VanDerWaalsContact N-CG2 3.29Å; D255-V289 WeakPolarHBondContact OD1-CG2 3.45Å; D255-V289 VanDerWaalsContact OD2-CG2 3.23Å; D255-V289 WeakPolarHBondContact OD2-CG2 3.36Å; R287-V289 PolarHBondContact O-N 3.26Å
290	A	87.9	Confident	78.4	Confident	16 Å²	16	79.7 Å²	79.7	13%	0.132	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	170.6	-171.7	0	0	0	0	0	111.5	V201 F253 Y288	V201-A290 HydrophobicContact CB-CB 4.24Å; V201-A290 HydrophobicContact CG1-CB 4.13Å; V201-A290 HydrophobicContact CG2-CB 3.81Å; F253-A290 HydrophobicContact CB-CB 4.44Å; F253-A290 HydrophobicContact CD2-CB 4.05Å; F253-A290 WeakPolarHBondContact CD2-O 3.34Å; F253-A290 PolarHBondContact N-O 3.33Å; Y288-A290 WeakPolarHBondContact CE2-O 3.18Å; Y288-A290 VanDerWaalsContact OH-C 3.25Å
291	K	89.5	Confident	80.7	Confident	136 Å²	136	74.5 Å²	74.5	59%	0.591	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.4	152.6	169.2	68.2	178.4	-176.8	176.3	0	110.3	T250 Y251 L252 Y288	T250-K291 HydrophobicContact CG2-CB 3.78Å; T250-K291 HydrophobicContact CG2-CD 4.26Å; T250-K291 HydrophobicContact CG2-CG 4.36Å; Y251-K291 CarbonylContact O-C 3.5Å; Y251-K291 WeakPolarHBondContact O-CA 3.48Å; Y251-K291 WeakPolarHBondContact O-CB 2.71Å; L252-K291 HydrophobicContact CD2-CB 3.76Å; Y288-K291 HydrophobicContact CE2-CB 4.47Å; Y288-K291 WeakPolarHBondContact OH-CB 3.42Å; Y288-K291 WeakPolarHBondContact OH-CG 3.45Å; Y288-K291 PolarHBondContact OH-N 2.89Å
292	S	85.8	Confident	82.8	Confident	7 Å²	7	76.8 Å²	76.8	5%	0.049	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	139.4	172.3	-171.9	0	0	0	0	111.4	V201 T250 Y251 K294	V201-S292 WeakPolarHBondContact O-CB 3.37Å; V201-S292 PolarHBondContact O-OG 3.13Å; T250-S292 CarbonylContact C-O 3.55Å; T250-S292 WeakPolarHBondContact CA-O 3.01Å; Y251-S292 PolarHBondContact N-O 2.75Å; Y251-S292 PolarHBondContact O-N 3.44Å; S292-K294 PolarHBondContact OG-N 3.45Å; S292-K294 PolarHBondContact OG-O 3.3Å
293	S	86.4	Confident	84.7	Confident	71 Å²	71	78.5 Å²	78.5	50%	0.497	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-1.5	169.4	56.5	0	0	0	0	112.6	T247	T247-S293 PolarHBondContact N-O 2.94Å; T247-S293 VanDerWaalsContact OG1-C 3.22Å; T247-S293 PolarHBondContact OG1-O 3.49Å
294	K	85.6	Confident	86.5	Confident	84 Å²	84	79.5 Å²	79.5	37%	0.365	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.3	-178.9	-65.4	-177	-171.4	170.1	0	108.9	E200 L202 Y203 S292	E200-K294 IonicContact OE1-NZ 3.53Å; E200-K294 PolarHBondContact OE1-NZ 3.1Å; E200-K294 IonicContact OE2-NZ 3.76Å; E200-K294 PolarHBondContact OE2-NZ 3.14Å; L202-K294 HydrophobicContact CD2-CB 3.49Å; L202-K294 VanDerWaalsContact CD2-CB 3.49Å; L202-K294 HydrophobicContact CD2-CD 4.33Å; Y203-K294 PolarHBondContact N-O 3.28Å; S292-K294 PolarHBondContact OG-N 3.45Å; S292-K294 PolarHBondContact OG-O 3.3Å
295	S	90.7	Very high	87.9	Confident	4 Å²	4	78.4 Å²	78.4	3%	0.028	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	147.7	170.5	54.4	0	0	0	0	111.4	Y203 E245 T247	Y203-S295 CarbonylContact O-C 3.5Å; Y203-S295 VanDerWaalsContact O-CA 3.24Å; Y203-S295 WeakPolarHBondContact O-CA 3.27Å; E245-S295 WeakPolarHBondContact CB-OG 3.33Å; E245-S295 PolarHBondContact N-O 3Å; E245-S295 PolarHBondContact O-N 3.37Å; E245-S295 PolarHBondContact O-OG 3.38Å; T247-S295 WeakPolarHBondContact CG2-OG 3.12Å
296	L	91.7	Very high	88.8	Confident	2 Å²	2	84.5 Å²	84.5	1%	0.01	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	110.9	171.3	179.2	57.5	0	0	0	108.1	Y203 V204 D205 P231 Y244 F298	Y203-L296 PolarHBondContact O-N 3.45Å; V204-L296 WeakPolarHBondContact CA-O 3.34Å; D205-L296 PolarHBondContact N-O 2.86Å; P231-L296 HydrophobicContact CG-CD1 3.69Å; P231-L296 HydrophobicContact CG-CD2 4.08Å; P231-L296 HydrophobicContact CG-CG 4.47Å; Y244-L296 HydrophobicContact CD1-CB 4.34Å; Y244-L296 HydrophobicContact CD1-CD1 3.98Å; Y244-L296 HydrophobicContact CD2-CD1 4.26Å; Y244-L296 HydrophobicContact CE1-CB 4.24Å; Y244-L296 HydrophobicContact CE1-CD1 3.94Å; Y244-L296 HydrophobicContact CE1-CD2 4.21Å; Y244-L296 HydrophobicContact CE1-CG 4.36Å; Y244-L296 HydrophobicContact CE2-CD1 4.22Å; Y244-L296 HydrophobicContact CG-CD1 4.15Å; L296-F298 HydrophobicContact CD1-CE2 4.43Å; L296-F298 HydrophobicContact CD1-CZ 4.48Å; L296-F298 HydrophobicContact CD2-CD2 4.49Å; L296-F298 HydrophobicContact CD2-CE2 3.44Å; L296-F298 VanDerWaalsContact CD2-CE2 3.44Å; L296-F298 HydrophobicContact CD2-CZ 3.6Å; L296-F298 HydrophobicContact CG-CD2 4.13Å; L296-F298 HydrophobicContact CG-CE2 3.52Å; L296-F298 HydrophobicContact CG-CZ 3.94Å
297	T	92.5	Very high	88.9	Confident	3 Å²	3	88.4 Å²	88.4	2%	0.018	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	126.5	-177.2	-58.6	0	0	0	0	108.9	D205 Q207 G242 H243 E245	D205-T297 HydrophobicContact CB-CG2 4.37Å; D205-T297 CarbonylContact O-C 3.5Å; D205-T297 WeakPolarHBondContact O-CA 3.46Å; Q207-T297 HydrophobicContact CG-CG2 4.12Å; Q207-T297 VanDerWaalsContact NE2-CG2 3.26Å; G242-T297 CarbonylContact C-O 3.53Å; G242-T297 VanDerWaalsContact CA-O 3.26Å; G242-T297 WeakPolarHBondContact CA-O 3.26Å; H243-T297 WeakPolarHBondContact CE1-CB 3.34Å; H243-T297 VanDerWaalsContact CE1-CG2 3.43Å; H243-T297 WeakPolarHBondContact CE1-CG2 3.48Å; H243-T297 PolarHBondContact CE1-O 2.98Å; H243-T297 PolarHBondContact N-O 2.9Å; H243-T297 PolarHBondContact ND1-O 3.41Å; H243-T297 PolarHBondContact O-N 3.42Å; E245-T297 PolarHBondContact OE2-OG1 3.49Å
298	F	92.4	Very high	88.2	Confident	0 Å²	0	84.6 Å²	84.6	0%	0	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	133	179.7	-81.4	-78.9	0	0	0	111.3	V204 D205 C206 Q207 L223 P231 M233 F240 E241 G242 L296	V204-F298 HydrophobicContact CG1-CD2 3.64Å; V204-F298 HydrophobicContact CG1-CE2 3.83Å; D205-F298 PolarHBondContact O-N 3.32Å; C206-F298 HydrophobicContact CB-CB 4.32Å; C206-F298 VanDerWaalsContact SG-CB 3.59Å; Q207-F298 WeakPolarHBondContact CB-O 3.34Å; Q207-F298 PolarHBondContact N-O 3.48Å; L223-F298 HydrophobicContact CD2-CE2 4.23Å; L223-F298 HydrophobicContact CD2-CZ 3.77Å; P231-F298 HydrophobicContact CG-CE1 4.4Å; P231-F298 HydrophobicContact CG-CZ 4.29Å; M233-F298 HydrophobicContact CB-CD1 3.62Å; M233-F298 HydrophobicContact CB-CD2 4.43Å; M233-F298 HydrophobicContact CB-CE1 3.36Å; M233-F298 HydrophobicContact CB-CE2 4.19Å; M233-F298 HydrophobicContact CB-CG 4.16Å; M233-F298 HydrophobicContact CB-CZ 3.67Å; M233-F298 HydrophobicContact CE-CB 3.95Å; M233-F298 HydrophobicContact CE-CD1 4.33Å; M233-F298 HydrophobicContact CE-CD2 3.8Å; M233-F298 HydrophobicContact CE-CE2 4.37Å; M233-F298 HydrophobicContact CE-CG 3.77Å; M233-F298 HydrophobicContact SD-CD2 4.19Å; M233-F298 HydrophobicContact SD-CE2 4.17Å; F240-F298 HydrophobicContact CB-CB 3.87Å; F240-F298 HydrophobicContact CB-CD1 3.78Å; F240-F298 HydrophobicContact CB-CG 4.2Å; F240-F298 HydrophobicContact CG-CB 4.45Å; E241-F298 WeakPolarHBondContact O-CA 3.42Å; G242-F298 VanDerWaalsContact CA-CD1 3.43Å; G242-F298 VanDerWaalsContact N-CD1 3.35Å; L296-F298 HydrophobicContact CD1-CE2 4.43Å; L296-F298 HydrophobicContact CD1-CZ 4.48Å; L296-F298 HydrophobicContact CD2-CD2 4.49Å; L296-F298 HydrophobicContact CD2-CE2 3.44Å; L296-F298 VanDerWaalsContact CD2-CE2 3.44Å; L296-F298 HydrophobicContact CD2-CZ 3.6Å; L296-F298 HydrophobicContact CG-CD2 4.13Å; L296-F298 HydrophobicContact CG-CE2 3.52Å; L296-F298 HydrophobicContact CG-CZ 3.94Å
299	Q	92.7	Very high	86.7	Confident	96 Å²	96	87 Å²	87	45%	0.449	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	137	174.2	-69.2	179.3	15.1	0	0	110.4	Q207 F240 E241 I301	Q207-Q299 HydrophobicContact CB-CG 4.45Å; F240-Q299 CarbonylContact C-O 3.55Å; F240-Q299 WeakPolarHBondContact CA-O 3.49Å; E241-Q299 PolarHBondContact N-O 3.48Å; E241-Q299 PolarHBondContact O-N 3.02Å; Q299-I301 PolarHBondContact O-N 3.05Å
300	R	91	Very high	84.8	Confident	115 Å²	115	96.3 Å²	96.3	43%	0.434	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	131.5	-178.5	-170.1	175	-178.5	172.7	2.9	110.9	F240	F240-R300 VanDerWaalsContact CD1-CA 3.47Å; F240-R300 HydrophobicContact CD1-CB 3.83Å; F240-R300 HydrophobicContact CD1-CG 4.43Å; F240-R300 HydrophobicContact CE1-CB 3.71Å; F240-R300 HydrophobicContact CE1-CG 4.12Å; F240-R300 HydrophobicContact CZ-CG 4.49Å
301	I	92.5	Very high	84.6	Confident	47 Å²	47	100.4 Å²	100.4	24%	0.241	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	158.6	174.5	61.5	161.8	0	0	0	111.1	L232 V239 E241 Q299 L303	L232-I301 HydrophobicContact CD2-CD1 3.96Å; V239-I301 HydrophobicContact CB-CG1 4.28Å; V239-I301 HydrophobicContact CG1-CD1 4.05Å; V239-I301 HydrophobicContact CG1-CG1 3.95Å; V239-I301 PolarHBondContact O-N 3.33Å; E241-I301 HydrophobicContact CB-CD1 4.21Å; E241-I301 HydrophobicContact CB-CG2 3.75Å; Q299-I301 PolarHBondContact O-N 3.05Å; I301-L303 HydrophobicContact CD1-CD2 3.96Å
302	F	91.3	Very high	84.3	Confident	159 Å²	159	98.5 Å²	98.5	70%	0.697	50%	0.5	S	S	*	.			trans	-116.5	116.8	171.9	-64.6	-84.2	0	0	0	108.8	K304	F302-K304 PolarHBondContact O-N 3.24Å
303	L	89.1	Confident	84.3	Confident	129 Å²	129	103.6 Å²	103.6	68%	0.675	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-67.7	128.5	178.3	-59.9	177.1	0	0	0	109.5	V239 I301	V239-L303 HydrophobicContact CG1-CD1 4.5Å; V239-L303 HydrophobicContact CG1-CD2 4.49Å; V239-L303 HydrophobicContact CG2-CD1 4.16Å; I301-L303 HydrophobicContact CD1-CD2 3.96Å
304	K	89.2	Confident	84.1	Confident	194 Å²	194	105.5 Å²	105.5	84%	0.843	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-103.3	138	171.8	-66	-176.2	-179.1	179.4	0	108.8	F302 K306	F302-K304 PolarHBondContact O-N 3.24Å; K304-K306 PolarHBondContact O-N 3.28Å
305	A	88.1	Confident	84	Confident	97 Å²	97	106.8 Å²	106.8	80%	0.802	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-59.2	134.3	169.9	0	0	0	0	0	108.9	E307	A305-E307 PolarHBondContact O-N 3.15Å
306	K	89	Confident	83.6	Confident	204 Å²	204	113.7 Å²	113.7	89%	0.887	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-67.5	116.7	172.3	-171.3	174.2	-179.3	177.4	0	107.3	K304 G308	K304-K306 PolarHBondContact O-N 3.28Å; K306-G308 PolarHBondContact O-N 3.33Å; K306-G308 VanDerWaalsContact O-N 3.1Å
307	E	80.1	Confident	83	Confident	176 Å²	176	121.6 Å²	121.6	82%	0.822	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-57.4	119.3	172	-74.6	180	175.4	0	0	107.6	A305 N309	A305-E307 PolarHBondContact O-N 3.15Å; E307-N309 PolarHBondContact O-N 3.38Å; E307-N309 VanDerWaalsContact O-N 3.08Å
308	G	71.8	Confident	82.3	Confident	56 Å²	56	130.8 Å²	130.8	58%	0.577	66%	0.656	S	S	*	*			trans	-63.6	112.8	176.7	0	0	0	0	0	107.8	K306 H310	K306-G308 PolarHBondContact O-N 3.33Å; K306-G308 VanDerWaalsContact O-N 3.1Å; G308-H310 PolarHBondContact O-N 3.22Å
309	N	58	Low	81.5	Confident	168 Å²	168	141.7 Å²	141.7	90%	0.898	71%	0.71	S	S	*	*			trans	-63.1	94.8	162.4	-79.2	-5.8	0	0	0	106.8	E307	E307-N309 PolarHBondContact O-N 3.38Å; E307-N309 VanDerWaalsContact O-N 3.08Å
310	H	44.6	Very low	80.4	Confident	259 Å²	259	145.8 Å²	145.8	100%	1.199	73%	0.734	S	S	*	*			trans	-74.7	0	164.8	-81.1	-63.7	0	0	0	110.4	G308	G308-H310 PolarHBondContact O-N 3.22Å

Retrieved 310 of 310 residues in 135.9 ms (Link to these results)

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