A0A077YWU6_TRITR Loading...

Nucleosome assembly protein 1 1

AlphaFold DB , UniProt , Accession A0A077YWU6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 329 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	44.2	Very low	46.9	Very low	249 Å²	249	131.5 Å²	131.5	100%	1.227	78%	0.782	S	S	*	*				0	93.7	0	-73.8	-177.4	170.9	0	0	106.4
2	A	42.2	Very low	47.6	Very low	109 Å²	109	129.9 Å²	129.9	90%	0.901	77%	0.766	S	S	*	*			trans	-84.3	111.2	174.7	0	0	0	0	0	106.6
3	S	42.2	Very low	48.8	Very low	120 Å²	120	129.6 Å²	129.6	84%	0.839	76%	0.759	S	S	*	*			trans	-88.3	111.5	172.7	-138.8	0	0	0	0	106.8	E5	S3-E5 PolarHBondContact O-N 2.95Å
4	S	45.5	Very low	50	Low	111 Å²	111	125.3 Å²	125.3	78%	0.776	73%	0.731	S	S	*	*			trans	-71.7	115.3	170.8	50.7	0	0	0	0	109.1	S6	S4-S6 PolarHBondContact O-N 3.46Å
5	E	41.5	Very low	51	Low	190 Å²	190	123.4 Å²	123.4	89%	0.888	72%	0.724	S	S	*	*			trans	-64.8	115.2	164.2	-73.8	171.1	146.4	0	0	108.2	S3 E7	S3-E5 PolarHBondContact O-N 2.95Å; E5-E7 PolarHBondContact O-N 3.16Å
6	S	46.7	Very low	52.1	Low	113 Å²	113	122.3 Å²	122.3	79%	0.79	71%	0.714	S	S	*	*			trans	-75.5	106.7	168.4	53.5	0	0	0	0	108.1	S4 S8	S4-S6 PolarHBondContact O-N 3.46Å; S6-S8 PolarHBondContact O-N 2.81Å; S6-S8 VanDerWaalsContact O-N 3.12Å
7	E	45.9	Very low	52.8	Low	182 Å²	182	116.5 Å²	116.5	85%	0.85	68%	0.68	S	S	*	*			trans	-58.9	112.1	167.5	-74.1	178.1	152.8	0	0	108.5	E5 V9	E5-E7 PolarHBondContact O-N 3.16Å; E7-V9 PolarHBondContact O-N 2.69Å
8	S	47.4	Very low	53.4	Low	114 Å²	114	115.1 Å²	115.1	80%	0.797	67%	0.668	S	S	*	*			trans	-69	98.8	168.6	55.4	0	0	0	0	107.7	S6 D10	S6-S8 PolarHBondContact O-N 2.81Å; S6-S8 VanDerWaalsContact O-N 3.12Å; S8-D10 PolarHBondContact O-N 3.01Å
9	V	52.3	Low	53.7	Low	113 Å²	113	116.8 Å²	116.8	69%	0.685	67%	0.669	S	S	*	*			trans	-56.2	121.8	167.7	-176.4	0	0	0	0	106.9	E7 C11	E7-V9 PolarHBondContact O-N 2.69Å; V9-C11 PolarHBondContact O-N 2.91Å; V9-C11 PolarHBondContact O-SG 2.78Å
10	D	52.6	Low	53.8	Low	94 Å²	94	113.2 Å²	113.2	50%	0.503	65%	0.651	S	S	.	*			trans	-73	78.5	-179.8	-170.5	18.1	0	0	0	109.2	S8 L12 N13	S8-D10 PolarHBondContact O-N 3.01Å; D10-L12 PolarHBondContact O-N 3.13Å; D10-L12 WeakPolarHBondContact OD1-CB 3.32Å; D10-N13 PolarHBondContact O-N 3.28Å; D10-N13 PolarHBondContact OD2-ND2 3.47Å
11	C	55.5	Low	54	Low	51 Å²	51	115.5 Å²	115.5	35%	0.345	66%	0.662	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.5	-1	179.1	-53.7	0	0	0	0	113.1	V9 N13 I17	V9-C11 PolarHBondContact O-N 2.91Å; V9-C11 PolarHBondContact O-SG 2.78Å; C11-N13 VanDerWaalsContact C-N 3.34Å; C11-I17 HydrophobicContact CB-CD1 3.97Å; C11-I17 WeakPolarHBondContact O-CD1 3.39Å
12	L	55.7	Low	54.7	Low	113 Å²	113	112.6 Å²	112.6	59%	0.592	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-21.2	177.9	-75.5	158.3	0	0	0	112.9	D10 K37	D10-L12 PolarHBondContact O-N 3.13Å; D10-L12 WeakPolarHBondContact OD1-CB 3.32Å; L12-K37 HydrophobicContact CD2-CD 3.98Å
13	N	63.5	Low	55.4	Low	126 Å²	126	109.4 Å²	109.4	67%	0.674	61%	0.614	S	S	*	*	S	Bend	trans	-128	9.1	-170.4	-67.4	-50.9	0	0	0	114.6	D10 C11 P15	D10-N13 PolarHBondContact O-N 3.28Å; D10-N13 PolarHBondContact OD2-ND2 3.47Å; C11-N13 VanDerWaalsContact C-N 3.34Å; N13-P15 WeakPolarHBondContact O-CD 3.44Å
14	D	65.1	Low	56.7	Low	69 Å²	69	112.4 Å²	112.4	37%	0.369	62%	0.621	S	S	.	*			trans	-80.9	109.2	176.8	-177.9	2.5	0	0	0	110	N16 I17	D14-N16 PolarHBondContact O-N 3.49Å; D14-N16 VanDerWaalsContact O-N 3.12Å; D14-N16 VanDerWaalsContact OD1-CB 3.28Å; D14-N16 WeakPolarHBondContact OD1-CB 3.38Å; D14-N16 PolarHBondContact OD1-N 2.78Å; D14-N16 PolarHBondContact OD1-ND2 3.03Å; D14-I17 HydrophobicContact CB-CD1 3.74Å; D14-I17 HydrophobicContact CB-CG1 3.84Å; D14-I17 PolarHBondContact O-N 3.3Å
15	P	65.5	Low	58.1	Low	97 Å²	97	110.7 Å²	110.7	63%	0.63	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-64.5	-14.8	-179.5	29.5	-35.9	0	0	0	112.6	N13	N13-P15 WeakPolarHBondContact O-CD 3.44Å
16	N	68.7	Low	59.8	Low	106 Å²	106	105.7 Å²	105.7	57%	0.567	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-83.3	-12.3	-178.6	-53.1	-61.3	0	0	0	113.1	D14 L18 H19	D14-N16 PolarHBondContact O-N 3.49Å; D14-N16 VanDerWaalsContact O-N 3.12Å; D14-N16 VanDerWaalsContact OD1-CB 3.28Å; D14-N16 WeakPolarHBondContact OD1-CB 3.38Å; D14-N16 PolarHBondContact OD1-N 2.78Å; D14-N16 PolarHBondContact OD1-ND2 3.03Å; N16-L18 PolarHBondContact O-N 3.09Å; N16-H19 CarbonylContact O-C 3.57Å; N16-H19 PolarHBondContact O-N 3.01Å
17	I	63.2	Low	61.5	Low	24 Å²	24	107 Å²	107	12%	0.123	59%	0.586	C	S	.	*	G	3₁₀ helix	trans	-61.3	-30.8	-176.8	-70.8	170.7	0	0	0	112.5	C11 D14 Y33	C11-I17 HydrophobicContact CB-CD1 3.97Å; C11-I17 WeakPolarHBondContact O-CD1 3.39Å; D14-I17 HydrophobicContact CB-CD1 3.74Å; D14-I17 HydrophobicContact CB-CG1 3.84Å; D14-I17 PolarHBondContact O-N 3.3Å; I17-Y33 HydrophobicContact CG2-CD2 4.22Å
18	L	63.7	Low	63.2	Low	91 Å²	91	103 Å²	103	48%	0.476	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-95.7	-10.7	177.7	-66	176	0	0	0	113.1	N16 P29 Y33	N16-L18 PolarHBondContact O-N 3.09Å; L18-P29 HydrophobicContact CD2-CB 4.47Å; L18-Y33 HydrophobicContact CD2-CD1 4.49Å; L18-Y33 HydrophobicContact CD2-CG 3.99Å
19	H	58.5	Low	65	Low	147 Å²	147	98.4 Å²	98.4	68%	0.681	54%	0.535	S	S	*	.			trans	-106.5	76.3	178.4	-80.2	-67	0	0	0	109.6	N16	N16-H19 CarbonylContact O-C 3.57Å; N16-H19 PolarHBondContact O-N 3.01Å
20	S	55.9	Low	66.6	Low	45 Å²	45	95.8 Å²	95.8	32%	0.315	52%	0.517	S	S	.	.			trans	-103.8	111.9	162	61	0	0	0	0	109.7	E22 T23 P29	S20-E22 PolarHBondContact O-N 3.25Å; S20-T23 PolarHBondContact OG-OG1 3.43Å; S20-P29 WeakPolarHBondContact OG-CG 3.48Å
21	N	58.2	Low	68.3	Low	162 Å²	162	96.3 Å²	96.3	87%	0.866	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	9.5	170.9	-69.2	-15.7	0	0	0	112.5
22	E	58.5	Low	69.7	Low	187 Å²	187	99.8 Å²	99.8	87%	0.874	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.3	6.2	-165.5	-62	-171.5	162.3	0	0	114.1	S20	S20-E22 PolarHBondContact O-N 3.25Å
23	T	58.5	Low	71.2	Confident	43 Å²	43	97.5 Å²	97.5	26%	0.264	51%	0.513	S	S	.	.			trans	-118.5	122.7	-175.4	56.9	0	0	0	0	111.3	S20 D25 E28	S20-T23 PolarHBondContact OG-OG1 3.43Å; T23-D25 PolarHBondContact O-N 3.32Å; T23-E28 VanDerWaalsContact CB-OE2 3.29Å; T23-E28 WeakPolarHBondContact CB-OE2 3.46Å; T23-E28 HydrophobicContact CG2-CB 4.35Å; T23-E28 HydrophobicContact CG2-CG 4.14Å; T23-E28 WeakPolarHBondContact CG2-OE2 3.3Å
24	D	67.7	Low	72.4	Confident	182 Å²	182	93.6 Å²	93.6	97%	0.973	49%	0.492	S	S	*	.	S	Bend	trans	-64.7	-18.4	173	-75.7	-20.4	0	0	0	112.4
25	D	74.8	Confident	73.6	Confident	75 Å²	75	94.3 Å²	94.3	40%	0.401	51%	0.508	S	S	.	.			trans	-93.9	107.7	175.4	-173.6	-11.5	0	0	0	110.7	T23 F27 E28	T23-D25 PolarHBondContact O-N 3.32Å; D25-F27 PolarHBondContact O-N 3.22Å; D25-F27 PolarHBondContact OD1-N 3.27Å; D25-E28 HydrophobicContact CB-CB 4.06Å; D25-E28 WeakPolarHBondContact O-CB 3.35Å; D25-E28 PolarHBondContact O-N 3.18Å; D25-E28 VanDerWaalsContact O-N 3.09Å
26	A	77.7	Confident	74.7	Confident	86 Å²	86	94.1 Å²	94.1	71%	0.711	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-17.6	178.6	0	0	0	0	0	114.1
27	F	82.5	Confident	75.6	Confident	141 Å²	141	90.4 Å²	90.4	62%	0.618	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-12.7	179.9	-55.9	-70.6	0	0	0	113.8	D25 P29 L30 I31	D25-F27 PolarHBondContact O-N 3.22Å; D25-F27 PolarHBondContact OD1-N 3.27Å; F27-P29 VanDerWaalsContact C-CD 3.42Å; F27-L30 PolarHBondContact O-N 3.49Å; F27-L30 VanDerWaalsContact O-N 3.14Å; F27-I31 HydrophobicContact CB-CD1 4.27Å; F27-I31 WeakPolarHBondContact O-CG1 3.29Å; F27-I31 PolarHBondContact O-N 3.28Å
28	E	81.6	Confident	77	Confident	98 Å²	98	93.2 Å²	93.2	46%	0.458	50%	0.5	S	S	.	.	H	α-helix	trans	-54.7	-43.7	-179.2	-175.5	166	-161.1	0	0	113.6	T23 D25 L30 I31 H32	T23-E28 VanDerWaalsContact CB-OE2 3.29Å; T23-E28 WeakPolarHBondContact CB-OE2 3.46Å; T23-E28 HydrophobicContact CG2-CB 4.35Å; T23-E28 HydrophobicContact CG2-CG 4.14Å; T23-E28 WeakPolarHBondContact CG2-OE2 3.3Å; D25-E28 HydrophobicContact CB-CB 4.06Å; D25-E28 WeakPolarHBondContact O-CB 3.35Å; D25-E28 PolarHBondContact O-N 3.18Å; D25-E28 VanDerWaalsContact O-N 3.09Å; E28-L30 VanDerWaalsContact C-N 3.33Å; E28-L30 PolarHBondContact O-N 3.12Å; E28-I31 PolarHBondContact O-N 2.6Å; E28-H32 WeakPolarHBondContact O-CB 3.4Å; E28-H32 PolarHBondContact O-N 2.93Å
29	P	84.5	Confident	78.4	Confident	16 Å²	16	98.4 Å²	98.4	10%	0.104	51%	0.513	C	S	.	.	H	α-helix	trans	-61.7	-41.2	177.8	-16.5	26.5	0	0	0	112.2	L18 S20 F27 H32 Y33	L18-P29 HydrophobicContact CD2-CB 4.47Å; S20-P29 WeakPolarHBondContact OG-CG 3.48Å; F27-P29 VanDerWaalsContact C-CD 3.42Å; P29-H32 PolarHBondContact O-N 3.09Å; P29-Y33 WeakPolarHBondContact O-CB 3.39Å; P29-Y33 PolarHBondContact O-N 3.01Å
30	L	86.4	Confident	80.2	Confident	59 Å²	59	95 Å²	95	31%	0.309	50%	0.504	S	S	.	.	H	α-helix	trans	-67.6	-39.8	177.7	178.3	62.2	0	0	0	111.3	F27 E28 Y33 L34	F27-L30 PolarHBondContact O-N 3.49Å; F27-L30 VanDerWaalsContact O-N 3.14Å; E28-L30 VanDerWaalsContact C-N 3.33Å; E28-L30 PolarHBondContact O-N 3.12Å; L30-Y33 HydrophobicContact CD1-CD1 4.36Å; L30-Y33 PolarHBondContact O-N 3.45Å; L30-L34 HydrophobicContact CD1-CD1 3.98Å; L30-L34 HydrophobicContact CD1-CG 4.14Å; L30-L34 HydrophobicContact CG-CD1 3.98Å; L30-L34 HydrophobicContact CG-CG 4.49Å; L30-L34 WeakPolarHBondContact O-CB 3.46Å; L30-L34 WeakPolarHBondContact O-CG 3.38Å; L30-L34 PolarHBondContact O-N 2.88Å
31	I	87.8	Confident	82	Confident	105 Å²	105	94 Å²	94	54%	0.538	50%	0.496	S	S	.	.	H	α-helix	trans	-62.6	-46.7	176.1	-68.8	166.4	0	0	0	109.8	F27 E28 L34 A35	F27-I31 HydrophobicContact CB-CD1 4.27Å; F27-I31 WeakPolarHBondContact O-CG1 3.29Å; F27-I31 PolarHBondContact O-N 3.28Å; E28-I31 PolarHBondContact O-N 2.6Å; I31-L34 PolarHBondContact O-N 3.14Å; I31-A35 PolarHBondContact O-N 3.37Å
32	H	86.2	Confident	83.6	Confident	123 Å²	123	92.4 Å²	92.4	57%	0.569	48%	0.478	S	S	*	.	H	α-helix	trans	-61.2	-45.9	177.4	-173.9	-101	0	0	0	111.5	E28 P29 L34 A35	E28-H32 WeakPolarHBondContact O-CB 3.4Å; E28-H32 PolarHBondContact O-N 2.93Å; P29-H32 PolarHBondContact O-N 3.09Å; H32-L34 VanDerWaalsContact C-N 3.27Å; H32-L34 PolarHBondContact O-N 3.3Å; H32-A35 WeakPolarHBondContact O-CB 3.49Å; H32-A35 PolarHBondContact O-N 2.99Å
33	Y	86.8	Confident	85.4	Confident	66 Å²	66	85.3 Å²	85.3	26%	0.259	46%	0.455	S	S	.	.	H	α-helix	trans	-57.5	-37.7	174.7	172.2	-103.1	0	0	0	113.1	I17 L18 P29 L30 K37 I45	I17-Y33 HydrophobicContact CG2-CD2 4.22Å; L18-Y33 HydrophobicContact CD2-CD1 4.49Å; L18-Y33 HydrophobicContact CD2-CG 3.99Å; P29-Y33 WeakPolarHBondContact O-CB 3.39Å; P29-Y33 PolarHBondContact O-N 3.01Å; L30-Y33 HydrophobicContact CD1-CD1 4.36Å; L30-Y33 PolarHBondContact O-N 3.45Å; Y33-K37 WeakPolarHBondContact O-CG 3.4Å; Y33-K37 PolarHBondContact O-NZ 3.44Å; Y33-I45 HydrophobicContact CE1-CD1 4.37Å
34	L	89.3	Confident	87.2	Confident	44 Å²	44	91.1 Å²	91.1	23%	0.23	47%	0.473	C	S	.	.	H	α-helix	trans	-82.8	-17.8	-177.4	-71.8	174.9	0	0	0	113.9	L30 I31 H32 D36 K37 I45	L30-L34 HydrophobicContact CD1-CD1 3.98Å; L30-L34 HydrophobicContact CD1-CG 4.14Å; L30-L34 HydrophobicContact CG-CD1 3.98Å; L30-L34 HydrophobicContact CG-CG 4.49Å; L30-L34 WeakPolarHBondContact O-CB 3.46Å; L30-L34 WeakPolarHBondContact O-CG 3.38Å; L30-L34 PolarHBondContact O-N 2.88Å; I31-L34 PolarHBondContact O-N 3.14Å; H32-L34 VanDerWaalsContact C-N 3.27Å; H32-L34 PolarHBondContact O-N 3.3Å; L34-D36 VanDerWaalsContact C-N 3.3Å; L34-D36 PolarHBondContact O-N 2.85Å; L34-K37 PolarHBondContact O-N 3.48Å; L34-K37 VanDerWaalsContact O-N 3.15Å; L34-I45 HydrophobicContact CD2-CD1 3.68Å
35	A	89.7	Confident	88.5	Confident	84 Å²	84	84.6 Å²	84.6	69%	0.694	44%	0.437	S	S	*	.	H	α-helix	trans	-60.5	-34.2	-169	0	0	0	0	0	114	I31 H32	I31-A35 PolarHBondContact O-N 3.37Å; H32-A35 WeakPolarHBondContact O-CB 3.49Å; H32-A35 PolarHBondContact O-N 2.99Å
36	D	87.9	Confident	89.5	Confident	92 Å²	92	84.6 Å²	84.6	49%	0.492	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	0.9	179.8	68.9	-25.3	0	0	0	113.3	L34	L34-D36 VanDerWaalsContact C-N 3.3Å; L34-D36 PolarHBondContact O-N 2.85Å
37	K	88.8	Confident	90.5	Very high	28 Å²	28	83 Å²	83	12%	0.122	42%	0.424	C	S	.	.	S	Bend	trans	-92.3	142.4	-175	-55.5	-63.5	-177.4	-81.6	0	111.7	L12 Y33 L34 V41	L12-K37 HydrophobicContact CD2-CD 3.98Å; Y33-K37 WeakPolarHBondContact O-CG 3.4Å; Y33-K37 PolarHBondContact O-NZ 3.44Å; L34-K37 PolarHBondContact O-N 3.48Å; L34-K37 VanDerWaalsContact O-N 3.15Å; K37-V41 HydrophobicContact CB-CB 4.04Å; K37-V41 HydrophobicContact CB-CG1 4.12Å; K37-V41 HydrophobicContact CB-CG2 4.27Å; K37-V41 HydrophobicContact CG-CG1 4.44Å
38	P	92.7	Very high	91.2	Very high	84 Å²	84	82 Å²	82	55%	0.545	42%	0.424	S	S	.	.			trans	-71	152.6	179.8	32.2	-37.1	0	0	0	111	P40 V41	P38-P40 VanDerWaalsContact C-N 3.26Å; P38-P40 WeakPolarHBondContact O-CD 3.39Å; P38-V41 HydrophobicContact CG-CG2 4.02Å; P38-V41 WeakPolarHBondContact O-CB 3.33Å; P38-V41 PolarHBondContact O-N 3.33Å
39	W	92.5	Very high	92	Very high	200 Å²	200	82 Å²	82	76%	0.758	42%	0.423	S	S	*	.	H	α-helix	trans	-44.6	-37.1	179.8	-75.6	105.6	0	0	0	116	V41 R42 G43	W39-V41 VanDerWaalsContact C-N 3.26Å; W39-V41 PolarHBondContact O-N 3Å; W39-R42 PolarHBondContact O-N 2.99Å; W39-G43 PolarHBondContact O-N 3.42Å
40	P	96.4	Very high	92.6	Very high	76 Å²	76	87.4 Å²	87.4	49%	0.494	45%	0.446	S	S	.	.	H	α-helix	trans	-59.3	-29.6	174.9	-27	37.4	0	0	0	114.8	P38 G43 R44	P38-P40 VanDerWaalsContact C-N 3.26Å; P38-P40 WeakPolarHBondContact O-CD 3.39Å; P40-G43 PolarHBondContact O-N 3.28Å; P40-R44 VanDerWaalsContact O-CG 3.29Å; P40-R44 WeakPolarHBondContact O-CG 3.25Å; P40-R44 PolarHBondContact O-N 2.94Å
41	V	93.3	Very high	93.2	Very high	23 Å²	23	88.3 Å²	88.3	14%	0.139	45%	0.454	C	S	.	.	H	α-helix	trans	-67	-47.7	176.2	175.9	0	0	0	0	110.3	K37 P38 W39 G43 R44 I45	K37-V41 HydrophobicContact CB-CB 4.04Å; K37-V41 HydrophobicContact CB-CG1 4.12Å; K37-V41 HydrophobicContact CB-CG2 4.27Å; K37-V41 HydrophobicContact CG-CG1 4.44Å; P38-V41 HydrophobicContact CG-CG2 4.02Å; P38-V41 WeakPolarHBondContact O-CB 3.33Å; P38-V41 PolarHBondContact O-N 3.33Å; W39-V41 VanDerWaalsContact C-N 3.26Å; W39-V41 PolarHBondContact O-N 3Å; V41-G43 VanDerWaalsContact C-N 3.28Å; V41-G43 PolarHBondContact O-N 3.49Å; V41-R44 WeakPolarHBondContact O-CB 3.43Å; V41-R44 PolarHBondContact O-N 2.96Å; V41-R44 VanDerWaalsContact O-N 3.14Å; V41-I45 HydrophobicContact CG1-CD1 4.37Å; V41-I45 PolarHBondContact O-N 2.86Å; V41-I45 VanDerWaalsContact O-N 3.07Å
42	R	91.8	Very high	93.7	Very high	128 Å²	128	87.2 Å²	87.2	48%	0.483	45%	0.447	S	S	.	.	H	α-helix	trans	-59.6	-40	173.2	-175.4	177.1	177.8	175.3	2.5	111.9	W39 R44 I45 N46	W39-R42 PolarHBondContact O-N 2.99Å; R42-R44 VanDerWaalsContact C-N 3.34Å; R42-R44 PolarHBondContact O-N 3.49Å; R42-I45 PolarHBondContact O-N 3.06Å; R42-N46 PolarHBondContact O-N 3.03Å
43	G	95.9	Very high	94.2	Very high	39 Å²	39	83.7 Å²	83.7	40%	0.402	43%	0.432	S	S	.	.	H	α-helix	trans	-59.9	-41.2	174.4	0	0	0	0	0	113.1	W39 P40 V41 N46 A47	W39-G43 PolarHBondContact O-N 3.42Å; P40-G43 PolarHBondContact O-N 3.28Å; V41-G43 VanDerWaalsContact C-N 3.28Å; V41-G43 PolarHBondContact O-N 3.49Å; G43-N46 PolarHBondContact O-N 2.86Å; G43-A47 PolarHBondContact O-N 2.87Å
44	R	97.6	Very high	94.7	Very high	165 Å²	165	85.4 Å²	85.4	62%	0.623	45%	0.445	S	S	*	.	H	α-helix	trans	-64.9	-42.3	175.2	-70.3	166.3	-170.7	149	0.7	112.1	P40 V41 R42 N46 A47 L48	P40-R44 VanDerWaalsContact O-CG 3.29Å; P40-R44 WeakPolarHBondContact O-CG 3.25Å; P40-R44 PolarHBondContact O-N 2.94Å; V41-R44 WeakPolarHBondContact O-CB 3.43Å; V41-R44 PolarHBondContact O-N 2.96Å; V41-R44 VanDerWaalsContact O-N 3.14Å; R42-R44 VanDerWaalsContact C-N 3.34Å; R42-R44 PolarHBondContact O-N 3.49Å; R44-N46 VanDerWaalsContact C-N 3.34Å; R44-N46 PolarHBondContact O-N 3.29Å; R44-A47 WeakPolarHBondContact O-CB 3.32Å; R44-A47 PolarHBondContact O-N 3.02Å; R44-L48 WeakPolarHBondContact O-CG 3.4Å; R44-L48 PolarHBondContact O-N 2.96Å
45	I	95.1	Very high	95.2	Very high	44 Å²	44	88.3 Å²	88.3	23%	0.226	46%	0.458	C	S	.	.	H	α-helix	trans	-61.5	-42.9	175.8	-69.3	161.5	0	0	0	111.1	Y33 L34 V41 R42 A47 L48 K49	Y33-I45 HydrophobicContact CE1-CD1 4.37Å; L34-I45 HydrophobicContact CD2-CD1 3.68Å; V41-I45 HydrophobicContact CG1-CD1 4.37Å; V41-I45 PolarHBondContact O-N 2.86Å; V41-I45 VanDerWaalsContact O-N 3.07Å; R42-I45 PolarHBondContact O-N 3.06Å; I45-A47 VanDerWaalsContact C-N 3.33Å; I45-A47 PolarHBondContact O-N 3.03Å; I45-L48 WeakPolarHBondContact O-CB 3.14Å; I45-L48 PolarHBondContact O-N 3.35Å; I45-K49 PolarHBondContact O-N 3.17Å
46	N	95.7	Very high	95.5	Very high	75 Å²	75	84.9 Å²	84.9	40%	0.401	43%	0.428	S	S	.	.	H	α-helix	trans	-62.9	-40.7	174.6	-73.6	-13.5	0	0	0	111.7	R42 G43 R44 L48 K49 H50	R42-N46 PolarHBondContact O-N 3.03Å; G43-N46 PolarHBondContact O-N 2.86Å; R44-N46 VanDerWaalsContact C-N 3.34Å; R44-N46 PolarHBondContact O-N 3.29Å; N46-L48 VanDerWaalsContact C-N 3.3Å; N46-L48 PolarHBondContact O-N 3.32Å; N46-K49 WeakPolarHBondContact O-CB 3.49Å; N46-K49 PolarHBondContact O-N 3.22Å; N46-K49 VanDerWaalsContact O-N 3.14Å; N46-H50 PolarHBondContact O-CD2 3.01Å; N46-H50 PolarHBondContact O-N 3.12Å; N46-H50 VanDerWaalsContact O-N 3.09Å
47	A	98.2	Very high	96	Very high	53 Å²	53	83.2 Å²	83.2	44%	0.438	42%	0.421	S	S	.	.	H	α-helix	trans	-60.8	-38.3	174.1	0	0	0	0	0	112.2	G43 R44 I45 H50 V51	G43-A47 PolarHBondContact O-N 2.87Å; R44-A47 WeakPolarHBondContact O-CB 3.32Å; R44-A47 PolarHBondContact O-N 3.02Å; I45-A47 VanDerWaalsContact C-N 3.33Å; I45-A47 PolarHBondContact O-N 3.03Å; A47-H50 WeakPolarHBondContact O-CB 3.5Å; A47-H50 PolarHBondContact O-N 3.34Å; A47-V51 WeakPolarHBondContact O-CG2 3.38Å; A47-V51 PolarHBondContact O-N 2.84Å; A47-V51 VanDerWaalsContact O-N 3.1Å
48	L	98.1	Very high	96.4	Very high	119 Å²	119	87.2 Å²	87.2	62%	0.623	44%	0.443	S	S	*	.	H	α-helix	trans	-63.4	-39	173	-67.8	174.9	0	0	0	112.2	R44 I45 N46 H50 V51 Q52	R44-L48 WeakPolarHBondContact O-CG 3.4Å; R44-L48 PolarHBondContact O-N 2.96Å; I45-L48 WeakPolarHBondContact O-CB 3.14Å; I45-L48 PolarHBondContact O-N 3.35Å; N46-L48 VanDerWaalsContact C-N 3.3Å; N46-L48 PolarHBondContact O-N 3.32Å; L48-H50 VanDerWaalsContact C-N 3.32Å; L48-H50 PolarHBondContact O-N 3.48Å; L48-V51 PolarHBondContact O-N 3.19Å; L48-Q52 PolarHBondContact O-N 2.89Å
49	K	97.3	Very high	96.6	Very high	99 Å²	99	86.4 Å²	86.4	43%	0.43	43%	0.432	S	S	.	.	H	α-helix	trans	-62.9	-36.2	174	-70	-174.4	175.1	-169.4	0	112.7	I45 N46 Q52 I53 L208	I45-K49 PolarHBondContact O-N 3.17Å; N46-K49 WeakPolarHBondContact O-CB 3.49Å; N46-K49 PolarHBondContact O-N 3.22Å; N46-K49 VanDerWaalsContact O-N 3.14Å; K49-Q52 PolarHBondContact O-N 2.98Å; K49-I53 WeakPolarHBondContact O-CG1 3.47Å; K49-I53 PolarHBondContact O-N 3.27Å; K49-L208 HydrophobicContact CD-CD1 4.21Å; K49-L208 HydrophobicContact CG-CD1 4.41Å
50	H	97.6	Very high	96.8	Very high	129 Å²	129	77.2 Å²	77.2	60%	0.597	40%	0.398	S	S	*	.	H	α-helix	trans	-62.9	-46.7	172.3	-78.5	-81.2	0	0	0	111.6	N46 A47 L48 Q52 I53 D54	N46-H50 PolarHBondContact O-CD2 3.01Å; N46-H50 PolarHBondContact O-N 3.12Å; N46-H50 VanDerWaalsContact O-N 3.09Å; A47-H50 WeakPolarHBondContact O-CB 3.5Å; A47-H50 PolarHBondContact O-N 3.34Å; L48-H50 VanDerWaalsContact C-N 3.32Å; L48-H50 PolarHBondContact O-N 3.48Å; H50-Q52 VanDerWaalsContact C-N 3.28Å; H50-Q52 PolarHBondContact O-N 3.01Å; H50-I53 PolarHBondContact O-N 3.03Å; H50-D54 PolarHBondContact O-N 2.88Å; H50-D54 VanDerWaalsContact O-N 3.1Å
51	V	98.3	Very high	96.9	Very high	78 Å²	78	77.9 Å²	77.9	47%	0.473	40%	0.395	S	S	.	.	H	α-helix	trans	-58.7	-41.4	175.1	174.4	0	0	0	0	111.2	A47 L48 I53 D54 Q55	A47-V51 WeakPolarHBondContact O-CG2 3.38Å; A47-V51 PolarHBondContact O-N 2.84Å; A47-V51 VanDerWaalsContact O-N 3.1Å; L48-V51 PolarHBondContact O-N 3.19Å; V51-I53 PolarHBondContact O-N 3.4Å; V51-D54 PolarHBondContact O-N 3.35Å; V51-Q55 WeakPolarHBondContact O-CG 3.36Å; V51-Q55 PolarHBondContact O-N 2.98Å
52	Q	98.1	Very high	97.1	Very high	82 Å²	82	83.1 Å²	83.1	38%	0.383	42%	0.416	S	S	.	.	H	α-helix	trans	-60.7	-42.6	176.8	-174.4	65.4	58.8	0	0	112	L48 K49 H50 D54 Q55 L56 L208	L48-Q52 PolarHBondContact O-N 2.89Å; K49-Q52 PolarHBondContact O-N 2.98Å; H50-Q52 VanDerWaalsContact C-N 3.28Å; H50-Q52 PolarHBondContact O-N 3.01Å; Q52-D54 VanDerWaalsContact C-N 3.33Å; Q52-D54 PolarHBondContact O-N 2.61Å; Q52-Q55 WeakPolarHBondContact O-CB 3.32Å; Q52-Q55 PolarHBondContact O-N 2.84Å; Q52-L56 HydrophobicContact CG-CD1 4.16Å; Q52-L56 HydrophobicContact CG-CG 4.49Å; Q52-L56 VanDerWaalsContact O-CG 3.3Å; Q52-L56 WeakPolarHBondContact O-CG 3.4Å; Q52-L56 PolarHBondContact O-N 2.93Å; Q52-L208 HydrophobicContact CB-CD2 3.95Å; Q52-L208 HydrophobicContact CG-CD2 3.62Å
53	I	97.7	Very high	97.3	Very high	49 Å²	49	81.2 Å²	81.2	25%	0.251	41%	0.409	S	S	.	.	H	α-helix	trans	-62.8	-41.1	176.8	-68.5	168.2	0	0	0	111.1	K49 H50 V51 Q55 L56 T57 P207 L208	K49-I53 WeakPolarHBondContact O-CG1 3.47Å; K49-I53 PolarHBondContact O-N 3.27Å; H50-I53 PolarHBondContact O-N 3.03Å; V51-I53 PolarHBondContact O-N 3.4Å; I53-Q55 VanDerWaalsContact C-N 3.31Å; I53-Q55 PolarHBondContact O-N 3.48Å; I53-L56 PolarHBondContact O-N 2.64Å; I53-T57 WeakPolarHBondContact O-CB 3.32Å; I53-T57 PolarHBondContact O-N 3.05Å; I53-T57 PolarHBondContact O-OG1 3.49Å; I53-P207 HydrophobicContact CD1-CB 4.49Å; I53-P207 HydrophobicContact CD1-CG 3.83Å; I53-P207 HydrophobicContact CG1-CB 4.15Å; I53-P207 HydrophobicContact CG1-CG 4Å; I53-P207 HydrophobicContact CG2-CB 4.22Å; I53-L208 HydrophobicContact CG1-CD2 3.82Å; I53-L208 HydrophobicContact CG1-CG 4.16Å
54	D	97.8	Very high	97.3	Very high	103 Å²	103	82.4 Å²	82.4	55%	0.551	40%	0.404	S	S	*	.	H	α-helix	trans	-63.4	-39.5	175.8	-65.3	-21	0	0	0	111	H50 V51 Q52 T57 L58	H50-D54 PolarHBondContact O-N 2.88Å; H50-D54 VanDerWaalsContact O-N 3.1Å; V51-D54 PolarHBondContact O-N 3.35Å; Q52-D54 VanDerWaalsContact C-N 3.33Å; Q52-D54 PolarHBondContact O-N 2.61Å; D54-T57 PolarHBondContact O-N 3.34Å; D54-L58 WeakPolarHBondContact O-CG 3.47Å; D54-L58 PolarHBondContact O-N 2.9Å
55	Q	97.9	Very high	97.2	Very high	104 Å²	104	80.9 Å²	80.9	49%	0.486	40%	0.402	S	S	.	.	H	α-helix	trans	-62.5	-47.6	174.3	-72.3	177.9	-57.9	0	0	112.4	V51 Q52 I53 T57 L58 E59	V51-Q55 WeakPolarHBondContact O-CG 3.36Å; V51-Q55 PolarHBondContact O-N 2.98Å; Q52-Q55 WeakPolarHBondContact O-CB 3.32Å; Q52-Q55 PolarHBondContact O-N 2.84Å; I53-Q55 VanDerWaalsContact C-N 3.31Å; I53-Q55 PolarHBondContact O-N 3.48Å; Q55-T57 VanDerWaalsContact C-N 3.27Å; Q55-T57 PolarHBondContact O-N 3.26Å; Q55-L58 WeakPolarHBondContact O-CB 3.37Å; Q55-L58 PolarHBondContact O-N 3.14Å; Q55-E59 PolarHBondContact O-N 3.32Å
56	L	97.9	Very high	97.3	Very high	13 Å²	13	81.3 Å²	81.3	7%	0.068	41%	0.406	C	S	.	.	H	α-helix	trans	-65.1	-33.6	179.4	-64.6	170.7	0	0	0	111.7	Q52 I53 E59 S60 V202 P207 L208 Y210	Q52-L56 HydrophobicContact CG-CD1 4.16Å; Q52-L56 HydrophobicContact CG-CG 4.49Å; Q52-L56 VanDerWaalsContact O-CG 3.3Å; Q52-L56 WeakPolarHBondContact O-CG 3.4Å; Q52-L56 PolarHBondContact O-N 2.93Å; I53-L56 PolarHBondContact O-N 2.64Å; L56-E59 PolarHBondContact O-N 3.29Å; L56-S60 WeakPolarHBondContact O-CB 3.43Å; L56-S60 PolarHBondContact O-N 3.46Å; L56-V202 HydrophobicContact CB-CG2 4.41Å; L56-V202 WeakPolarHBondContact O-CG2 3.3Å; L56-P207 WeakPolarHBondContact CD1-O 3.16Å; L56-L208 HydrophobicContact CD1-CD2 4.33Å; L56-Y210 HydrophobicContact CB-CD1 4.32Å; L56-Y210 HydrophobicContact CD2-CD1 4.12Å
57	T	97.3	Very high	97.3	Very high	57 Å²	57	78.4 Å²	78.4	35%	0.35	39%	0.39	S	S	.	.	H	α-helix	trans	-64.5	-47	173.7	-58.4	0	0	0	0	111.1	I53 D54 Q55 E59 S60 E61	I53-T57 WeakPolarHBondContact O-CB 3.32Å; I53-T57 PolarHBondContact O-N 3.05Å; I53-T57 PolarHBondContact O-OG1 3.49Å; D54-T57 PolarHBondContact O-N 3.34Å; Q55-T57 VanDerWaalsContact C-N 3.27Å; Q55-T57 PolarHBondContact O-N 3.26Å; T57-E59 VanDerWaalsContact C-N 3.3Å; T57-E59 PolarHBondContact O-N 2.97Å; T57-S60 PolarHBondContact O-N 2.87Å; T57-E61 WeakPolarHBondContact O-CG 3.24Å; T57-E61 PolarHBondContact O-N 3.34Å
58	L	97.5	Very high	97.2	Very high	112 Å²	112	81.6 Å²	81.6	59%	0.586	40%	0.396	S	S	*	.	H	α-helix	trans	-61.4	-38.1	174.7	-73.8	171.7	0	0	0	112.4	D54 Q55 E61 F62	D54-L58 WeakPolarHBondContact O-CG 3.47Å; D54-L58 PolarHBondContact O-N 2.9Å; Q55-L58 WeakPolarHBondContact O-CB 3.37Å; Q55-L58 PolarHBondContact O-N 3.14Å; L58-E61 PolarHBondContact O-N 2.84Å; L58-F62 WeakPolarHBondContact O-CB 3.44Å; L58-F62 PolarHBondContact O-N 3Å
59	E	97.6	Very high	97.2	Very high	66 Å²	66	80.1 Å²	80.1	31%	0.308	39%	0.388	S	S	.	.	H	α-helix	trans	-63.9	-45.6	175.6	-172.9	-177.5	160.3	0	0	111.8	Q55 L56 T57 E61 F62 R63 Y210	Q55-E59 PolarHBondContact O-N 3.32Å; L56-E59 PolarHBondContact O-N 3.29Å; T57-E59 VanDerWaalsContact C-N 3.3Å; T57-E59 PolarHBondContact O-N 2.97Å; E59-E61 PolarHBondContact O-N 3.36Å; E59-F62 WeakPolarHBondContact O-CB 3.26Å; E59-F62 PolarHBondContact O-N 2.93Å; E59-F62 VanDerWaalsContact O-N 3.16Å; E59-R63 WeakPolarHBondContact O-CG 3.41Å; E59-R63 PolarHBondContact O-N 3.03Å; E59-R63 IonicContact OE1-CZ 2.75Å; E59-R63 VanDerWaalsContact OE1-CZ 3.24Å; E59-R63 IonicContact OE1-NE 3.55Å; E59-R63 PolarHBondContact OE1-NE 2.9Å; E59-R63 IonicContact OE1-NH2 2.8Å; E59-R63 PolarHBondContact OE1-NH2 3.47Å; E59-Y210 HydrophobicContact CG-CE1 4.32Å
60	S	96.8	Very high	97.1	Very high	7 Å²	7	79.3 Å²	79.3	5%	0.049	39%	0.386	C	S	.	.	H	α-helix	trans	-59.1	-44.9	175.3	179.2	0	0	0	0	111.9	L56 T57 F62 R63 Q64 I200 E201 Y210	L56-S60 WeakPolarHBondContact O-CB 3.43Å; L56-S60 PolarHBondContact O-N 3.46Å; T57-S60 PolarHBondContact O-N 2.87Å; S60-F62 VanDerWaalsContact C-N 3.33Å; S60-F62 PolarHBondContact O-N 2.93Å; S60-R63 PolarHBondContact O-N 2.79Å; S60-Q64 WeakPolarHBondContact O-CG 3.46Å; S60-Q64 PolarHBondContact O-N 2.94Å; S60-I200 PolarHBondContact OG-O 3.42Å; S60-E201 WeakPolarHBondContact OG-CA 3.46Å; S60-Y210 WeakPolarHBondContact CA-OH 3.27Å
61	E	96.9	Very high	97.1	Very high	90 Å²	90	76 Å²	76	42%	0.421	37%	0.371	S	S	.	.	H	α-helix	trans	-60.6	-40.4	173.9	-71.7	-178.1	-168.6	0	0	112.7	T57 L58 E59 K65	T57-E61 WeakPolarHBondContact O-CG 3.24Å; T57-E61 PolarHBondContact O-N 3.34Å; L58-E61 PolarHBondContact O-N 2.84Å; E59-E61 PolarHBondContact O-N 3.36Å; E61-K65 WeakPolarHBondContact O-CG 3.43Å; E61-K65 PolarHBondContact O-N 3.27Å; E61-K65 VanDerWaalsContact O-N 3.14Å
62	F	97.6	Very high	97	Very high	134 Å²	134	76.9 Å²	76.9	59%	0.588	37%	0.371	S	S	*	.	H	α-helix	trans	-61.4	-47.9	175.1	167.7	-101.6	0	0	0	111.2	L58 E59 S60 Q64 K65 V66	L58-F62 WeakPolarHBondContact O-CB 3.44Å; L58-F62 PolarHBondContact O-N 3Å; E59-F62 WeakPolarHBondContact O-CB 3.26Å; E59-F62 PolarHBondContact O-N 2.93Å; E59-F62 VanDerWaalsContact O-N 3.16Å; S60-F62 VanDerWaalsContact C-N 3.33Å; S60-F62 PolarHBondContact O-N 2.93Å; F62-Q64 VanDerWaalsContact C-N 3.34Å; F62-Q64 PolarHBondContact O-N 2.85Å; F62-K65 PolarHBondContact O-N 3.06Å; F62-K65 VanDerWaalsContact O-N 3.16Å; F62-V66 HydrophobicContact CD1-CG2 4.31Å; F62-V66 HydrophobicContact CD2-CG2 4.33Å; F62-V66 HydrophobicContact CE1-CG2 3.83Å; F62-V66 HydrophobicContact CE2-CG2 3.85Å; F62-V66 HydrophobicContact CZ-CG2 3.58Å; F62-V66 WeakPolarHBondContact O-CG2 3.48Å; F62-V66 PolarHBondContact O-N 2.99Å
63	R	96	Very high	97	Very high	88 Å²	88	79.3 Å²	79.3	33%	0.332	38%	0.377	S	S	.	.	H	α-helix	trans	-64.4	-36.6	-179.9	-69.4	176.1	-178	-89.9	9.7	112.4	E59 S60 V66 H67 I200 Y210	E59-R63 WeakPolarHBondContact O-CG 3.41Å; E59-R63 PolarHBondContact O-N 3.03Å; E59-R63 IonicContact OE1-CZ 2.75Å; E59-R63 VanDerWaalsContact OE1-CZ 3.24Å; E59-R63 IonicContact OE1-NE 3.55Å; E59-R63 PolarHBondContact OE1-NE 2.9Å; E59-R63 IonicContact OE1-NH2 2.8Å; E59-R63 PolarHBondContact OE1-NH2 3.47Å; S60-R63 PolarHBondContact O-N 2.79Å; R63-V66 PolarHBondContact O-N 3.35Å; R63-H67 WeakPolarHBondContact O-CB 3.35Å; R63-H67 PolarHBondContact O-N 2.98Å; R63-I200 HydrophobicContact CB-CG2 3.68Å; R63-Y210 WeakPolarHBondContact CD-OH 3.3Å
64	Q	95.8	Very high	96.9	Very high	64 Å²	64	78.5 Å²	78.5	30%	0.299	38%	0.381	S	S	.	.	H	α-helix	trans	-60.3	-46	171.8	-72.1	176.8	4	0	0	111.7	S60 F62 V66 H67 E68 I200 E201	S60-Q64 WeakPolarHBondContact O-CG 3.46Å; S60-Q64 PolarHBondContact O-N 2.94Å; F62-Q64 VanDerWaalsContact C-N 3.34Å; F62-Q64 PolarHBondContact O-N 2.85Å; Q64-V66 PolarHBondContact O-N 2.86Å; Q64-H67 WeakPolarHBondContact O-CB 3.47Å; Q64-H67 PolarHBondContact O-N 3.26Å; Q64-E68 WeakPolarHBondContact O-CG 3.31Å; Q64-E68 PolarHBondContact O-N 3.44Å; Q64-I200 HydrophobicContact CG-CB 4.12Å; Q64-I200 HydrophobicContact CG-CG2 3.71Å; Q64-E201 VanDerWaalsContact NE2-CG 3.29Å
65	K	96.8	Very high	96.8	Very high	133 Å²	133	76.9 Å²	76.9	58%	0.578	38%	0.382	S	S	*	.	H	α-helix	trans	-64.6	-37.8	176.6	-71.3	174	-176.5	166.2	0	112.7	E61 F62 H67 E68 L69	E61-K65 WeakPolarHBondContact O-CG 3.43Å; E61-K65 PolarHBondContact O-N 3.27Å; E61-K65 VanDerWaalsContact O-N 3.14Å; F62-K65 PolarHBondContact O-N 3.06Å; F62-K65 VanDerWaalsContact O-N 3.16Å; K65-H67 VanDerWaalsContact C-N 3.34Å; K65-E68 PolarHBondContact O-N 2.88Å; K65-L69 WeakPolarHBondContact O-CB 3.46Å; K65-L69 PolarHBondContact O-N 3.02Å
66	V	96.5	Very high	96.7	Very high	52 Å²	52	77.3 Å²	77.3	32%	0.315	38%	0.382	S	S	.	.	H	α-helix	trans	-61	-45.6	173	170.8	0	0	0	0	110.3	F62 R63 Q64 E68 L69 Q70	F62-V66 HydrophobicContact CD1-CG2 4.31Å; F62-V66 HydrophobicContact CD2-CG2 4.33Å; F62-V66 HydrophobicContact CE1-CG2 3.83Å; F62-V66 HydrophobicContact CE2-CG2 3.85Å; F62-V66 HydrophobicContact CZ-CG2 3.58Å; F62-V66 WeakPolarHBondContact O-CG2 3.48Å; F62-V66 PolarHBondContact O-N 2.99Å; R63-V66 PolarHBondContact O-N 3.35Å; Q64-V66 PolarHBondContact O-N 2.86Å; V66-E68 PolarHBondContact O-N 3.13Å; V66-L69 WeakPolarHBondContact O-CB 3.46Å; V66-L69 PolarHBondContact O-N 3.06Å; V66-Q70 HydrophobicContact CG1-CG 4.33Å; V66-Q70 WeakPolarHBondContact O-CG 3.47Å; V66-Q70 PolarHBondContact O-N 3.18Å
67	H	95.5	Very high	96.7	Very high	15 Å²	15	80.4 Å²	80.4	7%	0.069	40%	0.396	C	S	.	.	H	α-helix	trans	-62.6	-42.2	178.2	-174.2	66.6	0	0	0	112.5	R63 Q64 K65 L69 Q70 M71 T171 I200	R63-H67 WeakPolarHBondContact O-CB 3.35Å; R63-H67 PolarHBondContact O-N 2.98Å; Q64-H67 WeakPolarHBondContact O-CB 3.47Å; Q64-H67 PolarHBondContact O-N 3.26Å; K65-H67 VanDerWaalsContact C-N 3.34Å; H67-L69 VanDerWaalsContact C-N 3.34Å; H67-L69 PolarHBondContact O-N 2.73Å; H67-Q70 PolarHBondContact O-N 3.1Å; H67-M71 WeakPolarHBondContact O-CG 3.45Å; H67-M71 PolarHBondContact O-N 2.7Å; H67-T171 PolarHBondContact CE1-O 2.82Å; H67-T171 PolarHBondContact NE2-O 3.2Å; H67-I200 HydrophobicContact CB-CD1 3.92Å
68	E	96.3	Very high	96.6	Very high	120 Å²	120	83.4 Å²	83.4	56%	0.561	40%	0.404	S	S	*	.	H	α-helix	trans	-59.2	-44.1	172	-71.8	176.3	173.2	0	0	112.2	Q64 K65 V66 M71 E72	Q64-E68 WeakPolarHBondContact O-CG 3.31Å; Q64-E68 PolarHBondContact O-N 3.44Å; K65-E68 PolarHBondContact O-N 2.88Å; V66-E68 PolarHBondContact O-N 3.13Å; E68-M71 HydrophobicContact CG-CE 4.31Å; E68-M71 PolarHBondContact O-N 2.67Å; E68-E72 PolarHBondContact O-N 2.91Å
69	L	97.5	Very high	96.6	Very high	88 Å²	88	81.9 Å²	81.9	46%	0.461	40%	0.401	S	S	.	.	H	α-helix	trans	-66	-40	177.8	-169	66.8	0	0	0	111.8	K65 V66 H67 M71 E72 Y73	K65-L69 WeakPolarHBondContact O-CB 3.46Å; K65-L69 PolarHBondContact O-N 3.02Å; V66-L69 WeakPolarHBondContact O-CB 3.46Å; V66-L69 PolarHBondContact O-N 3.06Å; H67-L69 VanDerWaalsContact C-N 3.34Å; H67-L69 PolarHBondContact O-N 2.73Å; L69-M71 VanDerWaalsContact C-N 3.34Å; L69-M71 PolarHBondContact O-N 2.99Å; L69-E72 WeakPolarHBondContact O-CB 3.37Å; L69-E72 PolarHBondContact O-N 2.92Å; L69-Y73 HydrophobicContact CD1-CD2 3.87Å; L69-Y73 HydrophobicContact CD1-CE2 3.62Å; L69-Y73 HydrophobicContact CG-CD2 4.07Å; L69-Y73 HydrophobicContact CG-CE2 4.17Å; L69-Y73 WeakPolarHBondContact O-CD2 3.46Å; L69-Y73 PolarHBondContact O-N 3Å
70	Q	96.2	Very high	96.6	Very high	82 Å²	82	84.4 Å²	84.4	38%	0.383	42%	0.416	S	S	.	.	H	α-helix	trans	-61.3	-42.3	174.4	-73.7	179.8	-23.2	0	0	111.1	V66 H67 Y73 G74 L170 R292	V66-Q70 HydrophobicContact CG1-CG 4.33Å; V66-Q70 WeakPolarHBondContact O-CG 3.47Å; V66-Q70 PolarHBondContact O-N 3.18Å; H67-Q70 PolarHBondContact O-N 3.1Å; Q70-Y73 PolarHBondContact O-N 3.42Å; Q70-G74 PolarHBondContact O-N 3.47Å; Q70-L170 HydrophobicContact CB-CD1 3.48Å; Q70-L170 VanDerWaalsContact CB-CD1 3.48Å; Q70-R292 VanDerWaalsContact OE1-NH2 3.14Å
71	M	96.6	Very high	96.7	Very high	58 Å²	58	85.1 Å²	85.1	29%	0.286	42%	0.42	S	S	.	.	H	α-helix	trans	-61.1	-43.6	173.7	-73	-169.1	-67.5	0	0	112	H67 E68 L69 A75 L170	H67-M71 WeakPolarHBondContact O-CG 3.45Å; H67-M71 PolarHBondContact O-N 2.7Å; E68-M71 HydrophobicContact CG-CE 4.31Å; E68-M71 PolarHBondContact O-N 2.67Å; L69-M71 VanDerWaalsContact C-N 3.34Å; L69-M71 PolarHBondContact O-N 2.99Å; M71-A75 PolarHBondContact O-N 3.32Å; M71-A75 VanDerWaalsContact O-N 3.16Å; M71-L170 HydrophobicContact CG-CB 3.62Å; M71-L170 HydrophobicContact CG-CD1 4.27Å
72	E	97.1	Very high	96.7	Very high	98 Å²	98	82.7 Å²	82.7	46%	0.458	41%	0.409	S	S	.	.	H	α-helix	trans	-60.4	-48.8	177.9	-172.6	-162.3	144.4	0	0	111.8	E68 L69 A75 K76	E68-E72 PolarHBondContact O-N 2.91Å; L69-E72 WeakPolarHBondContact O-CB 3.37Å; L69-E72 PolarHBondContact O-N 2.92Å; E72-A75 WeakPolarHBondContact O-CB 3.44Å; E72-A75 PolarHBondContact O-N 3.37Å; E72-K76 PolarHBondContact O-N 2.84Å; E72-K76 WeakPolarHBondContact OE1-CE 3.46Å; E72-K76 IonicContact OE1-NZ 3.34Å; E72-K76 PolarHBondContact OE1-NZ 2.78Å
73	Y	97.1	Very high	96.8	Very high	133 Å²	133	80 Å²	80	52%	0.522	40%	0.397	S	S	.	.	H	α-helix	trans	-73.8	-33.4	-178.5	-84.7	-102.6	0	0	0	112.4	L69 Q70 A75 K76 E77	L69-Y73 HydrophobicContact CD1-CD2 3.87Å; L69-Y73 HydrophobicContact CD1-CE2 3.62Å; L69-Y73 HydrophobicContact CG-CD2 4.07Å; L69-Y73 HydrophobicContact CG-CE2 4.17Å; L69-Y73 WeakPolarHBondContact O-CD2 3.46Å; L69-Y73 PolarHBondContact O-N 3Å; Q70-Y73 PolarHBondContact O-N 3.42Å; Y73-A75 PolarHBondContact O-N 3.16Å; Y73-K76 HydrophobicContact CD1-CD 4.47Å; Y73-K76 CarbonylContact O-C 3.55Å; Y73-K76 WeakPolarHBondContact O-CA 3.33Å; Y73-K76 WeakPolarHBondContact O-CB 3.11Å; Y73-K76 PolarHBondContact O-N 3.48Å; Y73-E77 WeakPolarHBondContact O-CB 3.11Å; Y73-E77 PolarHBondContact O-N 3.15Å
74	G	95.5	Very high	96.9	Very high	32 Å²	32	77.8 Å²	77.8	33%	0.33	39%	0.389	S	S	.	.	H	α-helix	trans	-59.3	-35.7	171.5	0	0	0	0	0	112.4	Q70 K76 E77 K78	Q70-G74 PolarHBondContact O-N 3.47Å; G74-K76 VanDerWaalsContact C-N 3.33Å; G74-K76 PolarHBondContact O-N 2.95Å; G74-E77 PolarHBondContact O-N 3.43Å; G74-K78 PolarHBondContact O-N 2.76Å
75	A	96.2	Very high	97	Very high	69 Å²	69	78.4 Å²	78.4	57%	0.57	39%	0.389	S	S	*	.	H	α-helix	trans	-66.2	-33.7	173.4	0	0	0	0	0	113	M71 E72 Y73	M71-A75 PolarHBondContact O-N 3.32Å; M71-A75 VanDerWaalsContact O-N 3.16Å; E72-A75 WeakPolarHBondContact O-CB 3.44Å; E72-A75 PolarHBondContact O-N 3.37Å; Y73-A75 PolarHBondContact O-N 3.16Å
76	K	97.2	Very high	97.1	Very high	112 Å²	112	74.1 Å²	74.1	49%	0.487	37%	0.372	S	S	.	.	H	α-helix	trans	-75.4	-31.3	174.9	-63.7	174.5	-171.3	163	0	112.4	E72 Y73 G74 P79	E72-K76 PolarHBondContact O-N 2.84Å; E72-K76 WeakPolarHBondContact OE1-CE 3.46Å; E72-K76 IonicContact OE1-NZ 3.34Å; E72-K76 PolarHBondContact OE1-NZ 2.78Å; Y73-K76 HydrophobicContact CD1-CD 4.47Å; Y73-K76 CarbonylContact O-C 3.55Å; Y73-K76 WeakPolarHBondContact O-CA 3.33Å; Y73-K76 WeakPolarHBondContact O-CB 3.11Å; Y73-K76 PolarHBondContact O-N 3.48Å; G74-K76 VanDerWaalsContact C-N 3.33Å; G74-K76 PolarHBondContact O-N 2.95Å; K76-P79 VanDerWaalsContact O-CD 3.3Å; K76-P79 WeakPolarHBondContact O-CD 3.44Å
77	E	96.4	Very high	97.1	Very high	78 Å²	78	74.2 Å²	74.2	36%	0.364	37%	0.37	S	S	.	.	H	α-helix	trans	-75.9	-30.5	178.3	-163	-172.7	178.2	0	0	112	Y73 G74 P79 L80 L81	Y73-E77 WeakPolarHBondContact O-CB 3.11Å; Y73-E77 PolarHBondContact O-N 3.15Å; G74-E77 PolarHBondContact O-N 3.43Å; E77-P79 VanDerWaalsContact C-CD 3.46Å; E77-P79 VanDerWaalsContact O-N 3.13Å; E77-L80 WeakPolarHBondContact O-CA 3.42Å; E77-L80 VanDerWaalsContact O-CB 3.27Å; E77-L80 WeakPolarHBondContact O-CB 3.49Å; E77-L80 PolarHBondContact O-N 2.83Å; E77-L81 HydrophobicContact CG-CD1 4.25Å; E77-L81 HydrophobicContact CG-CD2 4.45Å; E77-L81 HydrophobicContact CG-CG 4.06Å; E77-L81 PolarHBondContact O-N 3.16Å; E77-L81 VanDerWaalsContact O-N 3.14Å
78	K	96.5	Very high	97.3	Very high	120 Å²	120	74 Å²	74	52%	0.522	37%	0.37	S	S	.	.	H	α-helix	trans	-44.8	-47.7	-176.9	-176.4	-171	174.5	-153.8	0	114.7	G74 L80 L81 D82	G74-K78 PolarHBondContact O-N 2.76Å; K78-L80 VanDerWaalsContact C-N 3.29Å; K78-L80 PolarHBondContact O-N 2.86Å; K78-L81 PolarHBondContact O-N 3.14Å; K78-D82 WeakPolarHBondContact O-CB 3.5Å; K78-D82 VanDerWaalsContact O-CG 3.26Å; K78-D82 PolarHBondContact O-N 3.24Å
79	P	97.8	Very high	97.3	Very high	81 Å²	81	71 Å²	71	53%	0.526	36%	0.358	S	S	.	.	H	α-helix	trans	-62.9	-31.5	177.9	-21.3	34.7	0	0	0	113.8	K76 E77 K83	K76-P79 VanDerWaalsContact O-CD 3.3Å; K76-P79 WeakPolarHBondContact O-CD 3.44Å; E77-P79 VanDerWaalsContact C-CD 3.46Å; E77-P79 VanDerWaalsContact O-N 3.13Å; P79-K83 WeakPolarHBondContact O-CB 3.48Å; P79-K83 PolarHBondContact O-N 3.43Å
80	L	97.5	Very high	97.2	Very high	119 Å²	119	68.1 Å²	68.1	62%	0.623	35%	0.348	S	S	*	.	H	α-helix	trans	-68.7	-44.5	175.7	-57.3	175.1	0	0	0	110.4	E77 K78 D82 K83 R84	E77-L80 WeakPolarHBondContact O-CA 3.42Å; E77-L80 VanDerWaalsContact O-CB 3.27Å; E77-L80 WeakPolarHBondContact O-CB 3.49Å; E77-L80 PolarHBondContact O-N 2.83Å; K78-L80 VanDerWaalsContact C-N 3.29Å; K78-L80 PolarHBondContact O-N 2.86Å; L80-D82 VanDerWaalsContact C-N 3.35Å; L80-K83 PolarHBondContact O-N 2.83Å; L80-R84 PolarHBondContact O-N 3.01Å
81	L	97.7	Very high	97.3	Very high	22 Å²	22	68.2 Å²	68.2	12%	0.115	36%	0.358	C	S	.	.	H	α-helix	trans	-67.2	-35.4	176.4	-58.8	-179.8	0	0	0	112	E77 K78 R84 R85 R167	E77-L81 HydrophobicContact CG-CD1 4.25Å; E77-L81 HydrophobicContact CG-CD2 4.45Å; E77-L81 HydrophobicContact CG-CG 4.06Å; E77-L81 PolarHBondContact O-N 3.16Å; E77-L81 VanDerWaalsContact O-N 3.14Å; K78-L81 PolarHBondContact O-N 3.14Å; L81-R84 WeakPolarHBondContact O-CB 3.27Å; L81-R84 PolarHBondContact O-N 3.34Å; L81-R85 PolarHBondContact O-N 3.34Å; L81-R167 VanDerWaalsContact C-NH2 3.33Å; L81-R167 PolarHBondContact O-NH2 3.19Å
82	D	98	Very high	97.3	Very high	39 Å²	39	69.3 Å²	69.3	21%	0.209	36%	0.36	C	S	.	.	H	α-helix	trans	-63.1	-44.9	172.2	-71.2	-16.3	0	0	0	111.5	K78 L80 R84 R85 D86 R167	K78-D82 WeakPolarHBondContact O-CB 3.5Å; K78-D82 VanDerWaalsContact O-CG 3.26Å; K78-D82 PolarHBondContact O-N 3.24Å; L80-D82 VanDerWaalsContact C-N 3.35Å; D82-R84 VanDerWaalsContact C-N 3.35Å; D82-R84 PolarHBondContact O-N 3.47Å; D82-R85 WeakPolarHBondContact O-CB 3.44Å; D82-R85 PolarHBondContact O-N 2.75Å; D82-R85 IonicContact OD1-NH1 3.24Å; D82-D86 PolarHBondContact O-N 3.29Å; D82-R167 IonicContact OD1-CZ 2.83Å; D82-R167 IonicContact OD1-NH1 2.62Å; D82-R167 PolarHBondContact OD1-NH1 3.15Å; D82-R167 IonicContact OD1-NH2 2.7Å; D82-R167 PolarHBondContact OD1-NH2 2.8Å
83	K	98.1	Very high	97.2	Very high	77 Å²	77	72 Å²	72	34%	0.335	37%	0.373	S	S	.	.	H	α-helix	trans	-61.8	-41.4	172.8	-173.9	-178.9	-179.2	-175.6	0	112.2	P79 L80 R85 D86 I87 E98	P79-K83 WeakPolarHBondContact O-CB 3.48Å; P79-K83 PolarHBondContact O-N 3.43Å; L80-K83 PolarHBondContact O-N 2.83Å; K83-R85 VanDerWaalsContact C-N 3.35Å; K83-R85 PolarHBondContact O-N 2.98Å; K83-D86 PolarHBondContact O-N 3.1Å; K83-I87 HydrophobicContact CG-CD1 4.17Å; K83-I87 WeakPolarHBondContact O-CG1 3.5Å; K83-I87 PolarHBondContact O-N 2.88Å; K83-E98 WeakPolarHBondContact CE-OE1 3.39Å; K83-E98 IonicContact NZ-OE1 3.98Å; K83-E98 PolarHBondContact NZ-OE1 2.99Å
84	R	98.3	Very high	97.2	Very high	41 Å²	41	67.3 Å²	67.3	16%	0.155	36%	0.358	C	S	.	.	H	α-helix	trans	-57.3	-47.5	174.9	-179.3	-178.8	71.5	-174.7	4.8	111.1	L80 L81 D82 D86 I87 I88 I296	L80-R84 PolarHBondContact O-N 3.01Å; L81-R84 WeakPolarHBondContact O-CB 3.27Å; L81-R84 PolarHBondContact O-N 3.34Å; D82-R84 VanDerWaalsContact C-N 3.35Å; D82-R84 PolarHBondContact O-N 3.47Å; R84-D86 VanDerWaalsContact C-N 3.33Å; R84-D86 PolarHBondContact O-N 2.96Å; R84-I87 PolarHBondContact O-N 3.47Å; R84-I88 HydrophobicContact CG-CD1 3.75Å; R84-I88 WeakPolarHBondContact O-CD1 3.43Å; R84-I88 VanDerWaalsContact O-CG1 3.26Å; R84-I88 WeakPolarHBondContact O-CG1 3.47Å; R84-I88 PolarHBondContact O-N 3.3Å; R84-I296 PolarHBondContact NH1-O 2.86Å; R84-I296 PolarHBondContact NH2-O 3.28Å
85	R	98.2	Very high	97.2	Very high	77 Å²	77	68.8 Å²	68.8	29%	0.291	36%	0.363	S	S	.	.	H	α-helix	trans	-56.8	-47.9	174.6	177.5	-159.1	65.3	-140.5	-5.4	111.3	L81 D82 K83 I87 I88 D89 D165	L81-R85 PolarHBondContact O-N 3.34Å; D82-R85 WeakPolarHBondContact O-CB 3.44Å; D82-R85 PolarHBondContact O-N 2.75Å; D82-R85 IonicContact OD1-NH1 3.24Å; K83-R85 VanDerWaalsContact C-N 3.35Å; K83-R85 PolarHBondContact O-N 2.98Å; R85-I87 VanDerWaalsContact C-N 3.26Å; R85-I87 PolarHBondContact O-N 3.15Å; R85-I88 PolarHBondContact O-N 3.4Å; R85-I88 VanDerWaalsContact O-N 3.12Å; R85-D89 PolarHBondContact O-N 3.37Å; R85-D165 WeakPolarHBondContact CD-OD2 3.38Å; R85-D165 HydrophobicContact CG-CB 4.08Å; R85-D165 WeakPolarHBondContact CG-OD2 3.4Å
86	D	98.2	Very high	97.1	Very high	43 Å²	43	69.2 Å²	69.2	23%	0.23	37%	0.367	C	S	.	.	H	α-helix	trans	-66.2	-29.2	-176.1	-62.4	-11.5	0	0	0	112.2	D82 K83 R84 D89 G90 S91 Y92	D82-D86 PolarHBondContact O-N 3.29Å; K83-D86 PolarHBondContact O-N 3.1Å; R84-D86 VanDerWaalsContact C-N 3.33Å; R84-D86 PolarHBondContact O-N 2.96Å; D86-D89 WeakPolarHBondContact CA-OD1 3.48Å; D86-G90 CarbonylContact O-C 3.59Å; D86-G90 PolarHBondContact O-N 3.35Å; D86-S91 WeakPolarHBondContact CA-OG 3.37Å; D86-S91 WeakPolarHBondContact CB-OG 3.47Å; D86-S91 PolarHBondContact O-N 3.22Å; D86-S91 PolarHBondContact O-OG 2.91Å; D86-Y92 PolarHBondContact O-N 3Å
87	I	98.3	Very high	96.9	Very high	54 Å²	54	66.2 Å²	66.2	28%	0.277	37%	0.368	S	S	.	.	H	α-helix	trans	-69.5	-48.9	169.7	-69	163.2	0	0	0	110.5	K83 R84 R85 D89 G90 Y92 P94 I134	K83-I87 HydrophobicContact CG-CD1 4.17Å; K83-I87 WeakPolarHBondContact O-CG1 3.5Å; K83-I87 PolarHBondContact O-N 2.88Å; R84-I87 PolarHBondContact O-N 3.47Å; R85-I87 VanDerWaalsContact C-N 3.26Å; R85-I87 PolarHBondContact O-N 3.15Å; I87-D89 VanDerWaalsContact C-N 3.33Å; I87-D89 PolarHBondContact O-N 2.78Å; I87-G90 PolarHBondContact O-N 2.86Å; I87-Y92 HydrophobicContact CD1-CD1 4.26Å; I87-Y92 HydrophobicContact CG1-CD1 3.62Å; I87-Y92 HydrophobicContact CG1-CE1 4.34Å; I87-P94 HydrophobicContact CG1-CG 4.41Å; I87-P94 HydrophobicContact CG2-CG 4.49Å; I87-I134 HydrophobicContact CG2-CD1 4.34Å
88	I	98.3	Very high	96.8	Very high	12 Å²	12	66.2 Å²	66.2	6%	0.062	37%	0.368	C	S	.	.	H	α-helix	trans	-61.1	-40.8	-177.9	-68.3	161.3	0	0	0	111.4	R84 R85 G90 G133 I134 F137	R84-I88 HydrophobicContact CG-CD1 3.75Å; R84-I88 WeakPolarHBondContact O-CD1 3.43Å; R84-I88 VanDerWaalsContact O-CG1 3.26Å; R84-I88 WeakPolarHBondContact O-CG1 3.47Å; R84-I88 PolarHBondContact O-N 3.3Å; R85-I88 PolarHBondContact O-N 3.4Å; R85-I88 VanDerWaalsContact O-N 3.12Å; I88-G90 VanDerWaalsContact C-N 3.35Å; I88-G133 CarbonylContact O-C 3.53Å; I88-G133 VanDerWaalsContact O-CA 3.32Å; I88-G133 WeakPolarHBondContact O-CA 3.45Å; I88-I134 PolarHBondContact O-N 2.89Å; I88-F137 HydrophobicContact CD1-CD1 3.43Å; I88-F137 VanDerWaalsContact CD1-CD1 3.43Å; I88-F137 HydrophobicContact CD1-CD2 4.38Å; I88-F137 HydrophobicContact CD1-CE1 3.4Å; I88-F137 VanDerWaalsContact CD1-CE1 3.4Å; I88-F137 HydrophobicContact CD1-CE2 4.35Å; I88-F137 HydrophobicContact CD1-CG 3.95Å; I88-F137 HydrophobicContact CD1-CZ 3.89Å; I88-F137 HydrophobicContact CG1-CD1 3.96Å; I88-F137 HydrophobicContact CG1-CD2 4.16Å; I88-F137 HydrophobicContact CG1-CE1 4.21Å; I88-F137 HydrophobicContact CG1-CE2 4.39Å; I88-F137 HydrophobicContact CG1-CG 3.93Å; I88-F137 HydrophobicContact CG1-CZ 4.41Å; I88-F137 HydrophobicContact CG2-CB 3.73Å; I88-F137 HydrophobicContact CG2-CD1 4.22Å; I88-F137 HydrophobicContact CG2-CG 4.03Å
89	D	96.5	Very high	96.6	Very high	57 Å²	57	64.9 Å²	64.9	31%	0.305	37%	0.37	S	S	.	.	H	α-helix	trans	-83.7	-10.5	179.4	76.7	8.7	0	0	0	114.2	R85 D86 I87 S91	R85-D89 PolarHBondContact O-N 3.37Å; D86-D89 WeakPolarHBondContact CA-OD1 3.48Å; I87-D89 VanDerWaalsContact C-N 3.33Å; I87-D89 PolarHBondContact O-N 2.78Å; D89-S91 WeakPolarHBondContact OD1-CB 3.4Å; D89-S91 PolarHBondContact OD1-N 2.91Å; D89-S91 PolarHBondContact OD1-OG 2.83Å
90	G	96.7	Very high	96.3	Very high	26 Å²	26	67.5 Å²	67.5	27%	0.268	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	11.7	178.6	0	0	0	0	0	114.9	D86 I87 I88 Y92	D86-G90 CarbonylContact O-C 3.59Å; D86-G90 PolarHBondContact O-N 3.35Å; I87-G90 PolarHBondContact O-N 2.86Å; I88-G90 VanDerWaalsContact C-N 3.35Å; G90-Y92 VanDerWaalsContact C-N 3.34Å
91	S	96.9	Very high	96	Very high	85 Å²	85	66 Å²	66	59%	0.594	37%	0.368	S	S	*	.	S	Bend	trans	-76.2	-22.4	174.1	62.6	0	0	0	0	113.3	D86 D89	D86-S91 WeakPolarHBondContact CA-OG 3.37Å; D86-S91 WeakPolarHBondContact CB-OG 3.47Å; D86-S91 PolarHBondContact O-N 3.22Å; D86-S91 PolarHBondContact O-OG 2.91Å; D89-S91 WeakPolarHBondContact OD1-CB 3.4Å; D89-S91 PolarHBondContact OD1-N 2.91Å; D89-S91 PolarHBondContact OD1-OG 2.83Å
92	Y	97.4	Very high	95.6	Very high	80 Å²	80	69.3 Å²	69.3	31%	0.314	39%	0.392	S	S	.	.	S	Bend	trans	-111.5	122.5	168.9	-179.6	-95.9	0	0	0	110.6	D86 I87 G90 P94 E98	D86-Y92 PolarHBondContact O-N 3Å; I87-Y92 HydrophobicContact CD1-CD1 4.26Å; I87-Y92 HydrophobicContact CG1-CD1 3.62Å; I87-Y92 HydrophobicContact CG1-CE1 4.34Å; G90-Y92 VanDerWaalsContact C-N 3.34Å; Y92-P94 WeakPolarHBondContact O-CD 3.42Å; Y92-E98 PolarHBondContact OH-OE1 3.31Å; Y92-E98 PolarHBondContact OH-OE2 2.81Å
93	Q	95.4	Very high	95.1	Very high	156 Å²	156	72.9 Å²	72.9	73%	0.729	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-91.5	119.1	171.8	-173.3	62.2	41.8	0	0	109.4
94	P	96.1	Very high	94.6	Very high	34 Å²	34	73 Å²	73	22%	0.221	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-55.9	140.9	174.9	-26.8	36	0	0	0	112.4	I87 Y92 E98 T99	I87-P94 HydrophobicContact CG1-CG 4.41Å; I87-P94 HydrophobicContact CG2-CG 4.49Å; Y92-P94 WeakPolarHBondContact O-CD 3.42Å; P94-E98 HydrophobicContact CB-CB 3.99Å; P94-T99 HydrophobicContact CB-CG2 3.79Å
95	S	95.6	Very high	94.2	Very high	62 Å²	62	74 Å²	74	43%	0.434	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-70.5	163	171.3	66.6	0	0	0	0	111.3	G97 E98 T99	S95-G97 PolarHBondContact O-N 3.47Å; S95-G97 VanDerWaalsContact O-N 3.16Å; S95-E98 VanDerWaalsContact CB-OE2 3.32Å; S95-E98 WeakPolarHBondContact CB-OE2 3.45Å; S95-E98 PolarHBondContact N-OE2 3.33Å; S95-E98 PolarHBondContact O-N 3.23Å; S95-E98 VanDerWaalsContact OG-CD 3.31Å; S95-E98 WeakPolarHBondContact OG-CG 3.36Å; S95-E98 PolarHBondContact OG-OE2 3.49Å; S95-T99 PolarHBondContact O-N 2.88Å
96	A	93.8	Very high	93.7	Very high	79 Å²	79	75.4 Å²	75.4	65%	0.653	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-54.3	-37.5	-178.3	0	0	0	0	0	113.4	E98 T99	A96-E98 VanDerWaalsContact C-N 3.33Å; A96-T99 PolarHBondContact O-N 3.2Å; A96-T99 PolarHBondContact O-OG1 2.96Å
97	G	93.7	Very high	93.3	Very high	49 Å²	49	76.2 Å²	76.2	51%	0.505	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-75.8	-18.5	177.7	0	0	0	0	0	114.3	S95	S95-G97 PolarHBondContact O-N 3.47Å; S95-G97 VanDerWaalsContact O-N 3.16Å
98	E	93.9	Very high	92.9	Very high	77 Å²	77	74 Å²	74	36%	0.36	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-87.5	-14.9	175.8	-68	167.9	127	0	0	112.7	K83 Y92 P94 S95 A96	K83-E98 WeakPolarHBondContact CE-OE1 3.39Å; K83-E98 IonicContact NZ-OE1 3.98Å; K83-E98 PolarHBondContact NZ-OE1 2.99Å; Y92-E98 PolarHBondContact OH-OE1 3.31Å; Y92-E98 PolarHBondContact OH-OE2 2.81Å; P94-E98 HydrophobicContact CB-CB 3.99Å; S95-E98 VanDerWaalsContact CB-OE2 3.32Å; S95-E98 WeakPolarHBondContact CB-OE2 3.45Å; S95-E98 PolarHBondContact N-OE2 3.33Å; S95-E98 PolarHBondContact O-N 3.23Å; S95-E98 VanDerWaalsContact OG-CD 3.31Å; S95-E98 WeakPolarHBondContact OG-CG 3.36Å; S95-E98 PolarHBondContact OG-OE2 3.49Å; A96-E98 VanDerWaalsContact C-N 3.33Å
99	T	92.5	Very high	92.5	Very high	92 Å²	92	80.5 Å²	80.5	56%	0.564	50%	0.504	S	S	*	.	S	Bend	trans	-90.2	-5	173.3	55.8	0	0	0	0	112.8	P94 S95 A96	P94-T99 HydrophobicContact CB-CG2 3.79Å; S95-T99 PolarHBondContact O-N 2.88Å; A96-T99 PolarHBondContact O-N 3.2Å; A96-T99 PolarHBondContact O-OG1 2.96Å
100	E	92	Very high	92.3	Very high	137 Å²	137	82.5 Å²	82.5	64%	0.64	51%	0.511	S	S	*	.	S	Bend	trans	-75	145.7	171.8	-69.8	172.9	-165.2	0	0	109.8	C102	E100-C102 PolarHBondContact O-N 2.84Å
101	N	90.6	Very high	92.1	Very high	87 Å²	87	85 Å²	85	47%	0.465	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-55.3	131.8	176.6	-66.4	-11	0	0	0	110.4	A103 A108 D112	N101-A103 PolarHBondContact O-N 2.83Å; N101-A108 HydrophobicContact CB-CB 3.74Å; N101-D112 PolarHBondContact ND2-OD2 2.94Å
102	C	88.8	Confident	91.9	Very high	92 Å²	92	84.7 Å²	84.7	62%	0.622	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-64.9	132.5	-177.1	-75.7	0	0	0	0	110.7	E100 G104 D105	E100-C102 PolarHBondContact O-N 2.84Å; C102-G104 PolarHBondContact O-N 3.12Å; C102-D105 HydrophobicContact CB-CB 4.15Å; C102-D105 WeakPolarHBondContact O-CB 3.09Å; C102-D105 PolarHBondContact O-N 2.86Å
103	A	87.6	Confident	91.7	Very high	113 Å²	113	87.8 Å²	87.8	93%	0.934	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	114.1	172.7	0	0	0	0	0	110.1	N101	N101-A103 PolarHBondContact O-N 2.83Å
104	G	87.9	Confident	91.7	Very high	80 Å²	80	85.5 Å²	85.5	83%	0.825	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.2	-4.3	-178.5	0	0	0	0	0	114.9	C102 S106	C102-G104 PolarHBondContact O-N 3.12Å; G104-S106 PolarHBondContact O-N 2.8Å
105	D	90.7	Very high	91.5	Very high	62 Å²	62	87.4 Å²	87.4	33%	0.332	52%	0.524	S	S	.	.			trans	-74.6	104.7	164.8	-175	-18.9	0	0	0	108.6	C102 L107 A108	C102-D105 HydrophobicContact CB-CB 4.15Å; C102-D105 WeakPolarHBondContact O-CB 3.09Å; C102-D105 PolarHBondContact O-N 2.86Å; D105-L107 VanDerWaalsContact C-N 3.27Å; D105-L107 PolarHBondContact O-N 3.49Å; D105-L107 PolarHBondContact OD1-N 3.01Å; D105-A108 HydrophobicContact CB-CB 4.08Å; D105-A108 PolarHBondContact OD1-N 3.42Å
106	S	87.7	Confident	91.5	Very high	107 Å²	107	89 Å²	89	75%	0.748	53%	0.525	S	S	*	.	S	Bend	trans	-75.1	-16.2	-177.4	50.9	0	0	0	0	113.6	G104	G104-S106 PolarHBondContact O-N 2.8Å
107	L	89.8	Confident	91.6	Very high	59 Å²	59	90.5 Å²	90.5	31%	0.309	52%	0.518	S	S	.	.	S	Bend	trans	-99.8	-16.6	-175.4	-64.2	173.5	0	0	0	112.2	D105 E109 E110 I111 E306	D105-L107 VanDerWaalsContact C-N 3.27Å; D105-L107 PolarHBondContact O-N 3.49Å; D105-L107 PolarHBondContact OD1-N 3.01Å; L107-E109 VanDerWaalsContact C-N 3.35Å; L107-E109 PolarHBondContact O-N 3.07Å; L107-E110 PolarHBondContact O-N 3.31Å; L107-E110 VanDerWaalsContact O-N 3.14Å; L107-I111 HydrophobicContact CB-CD1 4.11Å; L107-I111 WeakPolarHBondContact O-CB 3.34Å; L107-I111 VanDerWaalsContact O-CG1 3.32Å; L107-I111 WeakPolarHBondContact O-CG1 3.11Å; L107-I111 PolarHBondContact O-N 2.99Å; L107-E306 HydrophobicContact CD1-CB 4.44Å; L107-E306 HydrophobicContact CD1-CG 3.54Å
108	A	89.9	Confident	91.7	Very high	8 Å²	8	94.5 Å²	94.5	7%	0.066	52%	0.519	C	S	.	.	H	α-helix	trans	-54.5	-45	-178.1	0	0	0	0	0	114	N101 D105 D112	N101-A108 HydrophobicContact CB-CB 3.74Å; D105-A108 HydrophobicContact CB-CB 4.08Å; D105-A108 PolarHBondContact OD1-N 3.42Å; A108-D112 WeakPolarHBondContact O-CB 3.23Å; A108-D112 PolarHBondContact O-N 2.84Å
109	E	90	Very high	91.7	Very high	149 Å²	149	96.7 Å²	96.7	70%	0.696	52%	0.524	S	S	*	.	H	α-helix	trans	-65.6	-42.1	178.4	-67.4	-175	173.5	0	0	111.7	L107 D112 E113	L107-E109 VanDerWaalsContact C-N 3.35Å; L107-E109 PolarHBondContact O-N 3.07Å; E109-D112 PolarHBondContact O-N 2.66Å; E109-E113 WeakPolarHBondContact O-CG 3.08Å; E109-E113 PolarHBondContact O-N 3.16Å
110	E	91.5	Very high	91.8	Very high	98 Å²	98	98.6 Å²	98.6	46%	0.458	53%	0.526	S	S	.	.	H	α-helix	trans	-65	-44.1	177.9	179.9	175.8	179.4	0	0	111.8	L107 D112 E113 Q114	L107-E110 PolarHBondContact O-N 3.31Å; L107-E110 VanDerWaalsContact O-N 3.14Å; E110-D112 VanDerWaalsContact C-N 3.32Å; E110-D112 PolarHBondContact O-N 3.06Å; E110-E113 PolarHBondContact O-N 3.3Å; E110-Q114 HydrophobicContact CG-CG 4.36Å; E110-Q114 WeakPolarHBondContact O-CB 3.27Å; E110-Q114 WeakPolarHBondContact O-CG 3.45Å; E110-Q114 PolarHBondContact O-N 3.3Å; E110-Q114 PolarHBondContact OE1-NE2 3.03Å
111	I	91.8	Very high	92	Very high	79 Å²	79	98 Å²	98	41%	0.405	52%	0.523	S	S	.	.	H	α-helix	trans	-61.1	-43.2	176.6	-68.9	169.4	0	0	0	110.4	L107 L115	L107-I111 HydrophobicContact CB-CD1 4.11Å; L107-I111 WeakPolarHBondContact O-CB 3.34Å; L107-I111 VanDerWaalsContact O-CG1 3.32Å; L107-I111 WeakPolarHBondContact O-CG1 3.11Å; L107-I111 PolarHBondContact O-N 2.99Å; I111-L115 WeakPolarHBondContact O-CB 3.47Å; I111-L115 PolarHBondContact O-N 3.44Å
112	D	92.4	Very high	92.3	Very high	79 Å²	79	96.6 Å²	96.6	42%	0.422	52%	0.516	S	S	.	.	H	α-helix	trans	-63.1	-43.8	177.4	-80.4	-23.4	0	0	0	111.9	N101 A108 E109 E110 L115 E116	N101-D112 PolarHBondContact ND2-OD2 2.94Å; A108-D112 WeakPolarHBondContact O-CB 3.23Å; A108-D112 PolarHBondContact O-N 2.84Å; E109-D112 PolarHBondContact O-N 2.66Å; E110-D112 VanDerWaalsContact C-N 3.32Å; E110-D112 PolarHBondContact O-N 3.06Å; D112-L115 PolarHBondContact O-N 2.76Å; D112-E116 WeakPolarHBondContact O-CB 3.47Å; D112-E116 PolarHBondContact O-N 3.44Å
113	E	94.1	Very high	92.5	Very high	144 Å²	144	97.1 Å²	97.1	67%	0.673	52%	0.518	S	S	*	.	H	α-helix	trans	-62.7	-49.8	176.5	-74.5	-177	179.8	0	0	111.8	E109 E110 L115 E116 E117	E109-E113 WeakPolarHBondContact O-CG 3.08Å; E109-E113 PolarHBondContact O-N 3.16Å; E110-E113 PolarHBondContact O-N 3.3Å; E113-L115 VanDerWaalsContact C-N 3.33Å; E113-L115 PolarHBondContact O-N 3.16Å; E113-E116 PolarHBondContact O-N 2.88Å; E113-E117 PolarHBondContact O-N 3.48Å
114	Q	94.8	Very high	92.8	Very high	108 Å²	108	99 Å²	99	51%	0.505	51%	0.513	S	S	.	.	H	α-helix	trans	-63.9	-37.7	178.3	-70.4	-173	21.7	0	0	112.1	E110 E117 Y118	E110-Q114 HydrophobicContact CG-CG 4.36Å; E110-Q114 WeakPolarHBondContact O-CB 3.27Å; E110-Q114 WeakPolarHBondContact O-CG 3.45Å; E110-Q114 PolarHBondContact O-N 3.3Å; E110-Q114 PolarHBondContact OE1-NE2 3.03Å; Q114-E117 PolarHBondContact O-N 3.07Å; Q114-Y118 VanDerWaalsContact O-CB 3.25Å; Q114-Y118 WeakPolarHBondContact O-CB 3.47Å; Q114-Y118 PolarHBondContact O-N 3.35Å
115	L	93.5	Very high	93	Very high	74 Å²	74	99.4 Å²	99.4	39%	0.387	50%	0.495	S	S	.	.	H	α-helix	trans	-64.5	-42.8	176.5	177.7	62.5	0	0	0	111.5	I111 D112 E113 Y118 R119	I111-L115 WeakPolarHBondContact O-CB 3.47Å; I111-L115 PolarHBondContact O-N 3.44Å; D112-L115 PolarHBondContact O-N 2.76Å; E113-L115 VanDerWaalsContact C-N 3.33Å; E113-L115 PolarHBondContact O-N 3.16Å; L115-Y118 PolarHBondContact O-N 3.05Å; L115-R119 WeakPolarHBondContact O-CB 3.05Å; L115-R119 VanDerWaalsContact O-CG 3.3Å; L115-R119 WeakPolarHBondContact O-CG 3.49Å; L115-R119 PolarHBondContact O-N 3.04Å
116	E	94.3	Very high	92.9	Very high	96 Å²	96	102.5 Å²	102.5	45%	0.449	52%	0.517	S	S	.	.	H	α-helix	trans	-66	-44.8	177.1	-177.3	55.7	-148.8	0	0	111	D112 E113 Y118 R119 Q120	D112-E116 WeakPolarHBondContact O-CB 3.47Å; D112-E116 PolarHBondContact O-N 3.44Å; E113-E116 PolarHBondContact O-N 2.88Å; E116-Y118 PolarHBondContact O-N 2.85Å; E116-R119 PolarHBondContact O-N 3Å; E116-Q120 WeakPolarHBondContact O-CG 3.47Å; E116-Q120 PolarHBondContact O-N 3.49Å; E116-Q120 PolarHBondContact OE1-NE2 3.46Å
117	E	96.7	Very high	93.1	Very high	110 Å²	110	102.3 Å²	102.3	51%	0.514	51%	0.511	S	S	.	.	H	α-helix	trans	-58.6	-47.8	173.8	-176.1	175.2	-176.8	0	0	111.5	E113 Q114 R119 Q120 Q121	E113-E117 PolarHBondContact O-N 3.48Å; Q114-E117 PolarHBondContact O-N 3.07Å; E117-R119 VanDerWaalsContact C-N 3.3Å; E117-R119 PolarHBondContact O-N 2.94Å; E117-Q120 PolarHBondContact O-N 3.34Å; E117-Q120 VanDerWaalsContact O-N 3.13Å; E117-Q121 HydrophobicContact CG-CG 4.46Å; E117-Q121 WeakPolarHBondContact O-CG 3.38Å; E117-Q121 PolarHBondContact O-N 2.79Å; E117-Q121 PolarHBondContact OE1-NE2 2.92Å
118	Y	95.7	Very high	93.2	Very high	133 Å²	133	104.5 Å²	104.5	52%	0.522	52%	0.523	S	S	.	.	H	α-helix	trans	-59.7	-40.1	178.8	-173	-95.4	0	0	0	112	Q114 L115 E116 Q121 N122 I125	Q114-Y118 VanDerWaalsContact O-CB 3.25Å; Q114-Y118 WeakPolarHBondContact O-CB 3.47Å; Q114-Y118 PolarHBondContact O-N 3.35Å; L115-Y118 PolarHBondContact O-N 3.05Å; E116-Y118 PolarHBondContact O-N 2.85Å; Y118-Q121 PolarHBondContact O-N 3.48Å; Y118-N122 VanDerWaalsContact O-CB 3.32Å; Y118-N122 WeakPolarHBondContact O-CB 3.35Å; Y118-N122 PolarHBondContact O-N 3.45Å; Y118-N122 PolarHBondContact O-ND2 2.77Å; Y118-I125 HydrophobicContact CD1-CD1 3.99Å; Y118-I125 HydrophobicContact CE1-CD1 3.5Å; Y118-I125 VanDerWaalsContact CE1-CD1 3.5Å
119	R	94.1	Very high	93.3	Very high	124 Å²	124	113.1 Å²	113.1	47%	0.468	56%	0.561	S	S	.	*	H	α-helix	trans	-65.8	-39.3	175.6	-77.4	174.9	174.8	177.8	3.1	112.5	L115 E116 E117 N122	L115-R119 WeakPolarHBondContact O-CB 3.05Å; L115-R119 VanDerWaalsContact O-CG 3.3Å; L115-R119 WeakPolarHBondContact O-CG 3.49Å; L115-R119 PolarHBondContact O-N 3.04Å; E116-R119 PolarHBondContact O-N 3Å; E117-R119 VanDerWaalsContact C-N 3.3Å; E117-R119 PolarHBondContact O-N 2.94Å; R119-N122 CarbonylContact O-C 3.51Å; R119-N122 VanDerWaalsContact O-C 3.3Å; R119-N122 PolarHBondContact O-N 3.22Å
120	Q	94.8	Very high	93.5	Very high	132 Å²	132	109.8 Å²	109.8	62%	0.617	56%	0.56	S	S	*	*	H	α-helix	trans	-65.5	-39.6	176.2	-70.5	175.2	21.6	0	0	111.8	E116 E117 N122	E116-Q120 WeakPolarHBondContact O-CG 3.47Å; E116-Q120 PolarHBondContact O-N 3.49Å; E116-Q120 PolarHBondContact OE1-NE2 3.46Å; E117-Q120 PolarHBondContact O-N 3.34Å; E117-Q120 VanDerWaalsContact O-N 3.13Å; Q120-N122 VanDerWaalsContact C-N 3.31Å
121	Q	96.3	Very high	93.6	Very high	123 Å²	123	108.6 Å²	108.6	58%	0.575	56%	0.559	S	S	*	*	H	α-helix	trans	-72.3	-23.8	176.2	-65.7	-179.4	10.2	0	0	112.9	E117 Y118 P123	E117-Q121 HydrophobicContact CG-CG 4.46Å; E117-Q121 WeakPolarHBondContact O-CG 3.38Å; E117-Q121 PolarHBondContact O-N 2.79Å; E117-Q121 PolarHBondContact OE1-NE2 2.92Å; Y118-Q121 PolarHBondContact O-N 3.48Å; Q121-P123 VanDerWaalsContact C-CD 3.42Å; Q121-P123 VanDerWaalsContact O-CD 3.29Å; Q121-P123 WeakPolarHBondContact O-CD 3.25Å
122	N	96.1	Very high	93.7	Very high	58 Å²	58	109.9 Å²	109.9	31%	0.31	57%	0.57	S	S	.	*			trans	-121.8	65.1	-176.6	-63.3	-83	0	0	0	112.7	Y118 R119 Q120 N124 I125	Y118-N122 VanDerWaalsContact O-CB 3.32Å; Y118-N122 WeakPolarHBondContact O-CB 3.35Å; Y118-N122 PolarHBondContact O-N 3.45Å; Y118-N122 PolarHBondContact O-ND2 2.77Å; R119-N122 CarbonylContact O-C 3.51Å; R119-N122 VanDerWaalsContact O-C 3.3Å; R119-N122 PolarHBondContact O-N 3.22Å; Q120-N122 VanDerWaalsContact C-N 3.31Å; N122-N124 PolarHBondContact O-N 3.16Å; N122-I125 HydrophobicContact CB-CD1 3.42Å; N122-I125 VanDerWaalsContact CB-CD1 3.42Å; N122-I125 HydrophobicContact CB-CG1 3.84Å; N122-I125 WeakPolarHBondContact O-CB 3.37Å; N122-I125 WeakPolarHBondContact O-CG1 3.33Å; N122-I125 PolarHBondContact O-N 3.14Å; N122-I125 VanDerWaalsContact O-N 3.09Å
123	P	92.9	Very high	93.9	Very high	103 Å²	103	107.5 Å²	107.5	67%	0.669	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-10.5	-173.1	28.5	-37.2	0	0	0	114.7	Q121 I125	Q121-P123 VanDerWaalsContact C-CD 3.42Å; Q121-P123 VanDerWaalsContact O-CD 3.29Å; Q121-P123 WeakPolarHBondContact O-CD 3.25Å; P123-I125 VanDerWaalsContact C-N 3.33Å
124	N	94.3	Very high	94.1	Very high	154 Å²	154	103.6 Å²	103.6	82%	0.824	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-5.8	177.1	-64.3	-42.8	0	0	0	113.1	N122 T126	N122-N124 PolarHBondContact O-N 3.16Å; N124-T126 PolarHBondContact O-N 3.18Å
125	I	91.3	Very high	94.2	Very high	88 Å²	88	102.2 Å²	102.2	45%	0.451	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-65.2	120.7	175.7	-67.9	174.4	0	0	0	108.8	Y118 N122 P123	Y118-I125 HydrophobicContact CD1-CD1 3.99Å; Y118-I125 HydrophobicContact CE1-CD1 3.5Å; Y118-I125 VanDerWaalsContact CE1-CD1 3.5Å; N122-I125 HydrophobicContact CB-CD1 3.42Å; N122-I125 VanDerWaalsContact CB-CD1 3.42Å; N122-I125 HydrophobicContact CB-CG1 3.84Å; N122-I125 WeakPolarHBondContact O-CB 3.37Å; N122-I125 WeakPolarHBondContact O-CG1 3.33Å; N122-I125 PolarHBondContact O-N 3.14Å; N122-I125 VanDerWaalsContact O-N 3.09Å; P123-I125 VanDerWaalsContact C-N 3.33Å
126	T	90	Very high	94.4	Very high	127 Å²	127	102.9 Å²	102.9	78%	0.779	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-99.2	124.2	174.3	-53.5	0	0	0	0	109.1	N124 N128	N124-T126 PolarHBondContact O-N 3.18Å; T126-N128 PolarHBondContact O-N 3.03Å
127	V	90.2	Very high	94.6	Very high	103 Å²	103	98.8 Å²	98.8	62%	0.624	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-68.3	121.4	174.3	-179.9	0	0	0	0	108.9	E129	V127-E129 PolarHBondContact O-N 2.69Å
128	N	92.2	Very high	94.7	Very high	105 Å²	105	93.6 Å²	93.6	56%	0.561	51%	0.508	S	S	*	.			trans	-86.5	92.2	175.9	-177.5	8.3	0	0	0	110.3	T126 A130 V131	T126-N128 PolarHBondContact O-N 3.03Å; N128-A130 PolarHBondContact O-N 3.35Å; N128-A130 VanDerWaalsContact O-N 3.09Å; N128-A130 WeakPolarHBondContact OD1-CB 3.27Å; N128-A130 PolarHBondContact OD1-N 3.32Å; N128-A130 VanDerWaalsContact OD1-N 3.12Å; N128-V131 HydrophobicContact CB-CG2 3.92Å; N128-V131 WeakPolarHBondContact O-CG2 3.42Å; N128-V131 PolarHBondContact O-N 2.95Å
129	E	92.2	Very high	94.9	Very high	188 Å²	188	88 Å²	88	88%	0.879	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-11.2	178.2	-62	-173.8	173.4	0	0	114	V127 V131	V127-E129 PolarHBondContact O-N 2.69Å; E129-V131 VanDerWaalsContact C-N 3.33Å
130	A	93.5	Very high	95.1	Very high	80 Å²	80	84.2 Å²	84.2	66%	0.661	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-0.7	177.5	0	0	0	0	0	113.6	N128 V132	N128-A130 PolarHBondContact O-N 3.35Å; N128-A130 VanDerWaalsContact O-N 3.09Å; N128-A130 WeakPolarHBondContact OD1-CB 3.27Å; N128-A130 PolarHBondContact OD1-N 3.32Å; N128-A130 VanDerWaalsContact OD1-N 3.12Å; A130-V132 PolarHBondContact O-N 3.41Å
131	V	94.6	Very high	95.2	Very high	73 Å²	73	77.9 Å²	77.9	44%	0.442	45%	0.448	S	S	.	.			trans	-66.5	131.5	174.8	174.5	0	0	0	0	109.7	N128 E129 P135	N128-V131 HydrophobicContact CB-CG2 3.92Å; N128-V131 WeakPolarHBondContact O-CG2 3.42Å; N128-V131 PolarHBondContact O-N 2.95Å; E129-V131 VanDerWaalsContact C-N 3.33Å; V131-P135 HydrophobicContact CG1-CG 3.62Å
132	V	94.6	Very high	95.3	Very high	105 Å²	105	72 Å²	72	64%	0.636	42%	0.421	S	S	*	.			trans	-116.1	131.6	177.7	178.9	0	0	0	0	108.9	A130	A130-V132 PolarHBondContact O-N 3.41Å
133	G	96.5	Very high	95.4	Very high	30 Å²	30	75.6 Å²	75.6	31%	0.309	43%	0.43	S	S	.	.	S	Bend	trans	65.2	-149.4	-177.9	0	0	0	0	0	112.7	I88 P135	I88-G133 CarbonylContact O-C 3.53Å; I88-G133 VanDerWaalsContact O-CA 3.32Å; I88-G133 WeakPolarHBondContact O-CA 3.45Å; G133-P135 WeakPolarHBondContact O-CD 3.47Å
134	I	97.6	Very high	95.6	Very high	62 Å²	62	72.2 Å²	72.2	32%	0.318	41%	0.406	S	S	.	.			trans	-116.7	94.6	177.7	-51.4	175.1	0	0	0	108.3	I87 I88 F137 F303	I87-I134 HydrophobicContact CG2-CD1 4.34Å; I88-I134 PolarHBondContact O-N 2.89Å; I134-F137 HydrophobicContact CB-CB 4.36Å; I134-F137 HydrophobicContact CB-CD2 4.49Å; I134-F137 HydrophobicContact CD1-CD2 4.47Å; I134-F137 HydrophobicContact CG2-CB 4.16Å; I134-F137 HydrophobicContact CG2-CD2 4.06Å; I134-F137 PolarHBondContact O-N 3.13Å; I134-F303 HydrophobicContact CG2-CE1 4.09Å; I134-F303 HydrophobicContact CG2-CE2 4.03Å; I134-F303 HydrophobicContact CG2-CZ 3.56Å
135	P	97.2	Very high	95.7	Very high	78 Å²	78	65 Å²	65	51%	0.506	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	145.3	179.1	-24.6	34.2	0	0	0	112.3	V131 G133 F137	V131-P135 HydrophobicContact CG1-CG 3.62Å; G133-P135 WeakPolarHBondContact O-CD 3.47Å; P135-F137 PolarHBondContact O-N 3.43Å
136	L	97.6	Very high	95.9	Very high	89 Å²	89	64.5 Å²	64.5	47%	0.466	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	9.5	176.2	-51.7	179.6	0	0	0	115.9	W138 L139 T140	L136-W138 PolarHBondContact O-N 2.93Å; L136-L139 HydrophobicContact CD2-CD2 4.31Å; L136-L139 PolarHBondContact O-N 3.35Å; L136-T140 PolarHBondContact O-N 3.13Å; L136-T140 PolarHBondContact O-OG1 3.27Å
137	F	98.7	Very high	95.9	Very high	9 Å²	9	59.9 Å²	59.9	4%	0.039	34%	0.343	C	S	.	.	H	α-helix	trans	-43.7	-57.8	-175.9	-179.1	-90.6	0	0	0	113.8	I88 I134 P135 T140 A141 A299 V300 F303	I88-F137 HydrophobicContact CD1-CD1 3.43Å; I88-F137 VanDerWaalsContact CD1-CD1 3.43Å; I88-F137 HydrophobicContact CD1-CD2 4.38Å; I88-F137 HydrophobicContact CD1-CE1 3.4Å; I88-F137 VanDerWaalsContact CD1-CE1 3.4Å; I88-F137 HydrophobicContact CD1-CE2 4.35Å; I88-F137 HydrophobicContact CD1-CG 3.95Å; I88-F137 HydrophobicContact CD1-CZ 3.89Å; I88-F137 HydrophobicContact CG1-CD1 3.96Å; I88-F137 HydrophobicContact CG1-CD2 4.16Å; I88-F137 HydrophobicContact CG1-CE1 4.21Å; I88-F137 HydrophobicContact CG1-CE2 4.39Å; I88-F137 HydrophobicContact CG1-CG 3.93Å; I88-F137 HydrophobicContact CG1-CZ 4.41Å; I88-F137 HydrophobicContact CG2-CB 3.73Å; I88-F137 HydrophobicContact CG2-CD1 4.22Å; I88-F137 HydrophobicContact CG2-CG 4.03Å; I134-F137 HydrophobicContact CB-CB 4.36Å; I134-F137 HydrophobicContact CB-CD2 4.49Å; I134-F137 HydrophobicContact CD1-CD2 4.47Å; I134-F137 HydrophobicContact CG2-CB 4.16Å; I134-F137 HydrophobicContact CG2-CD2 4.06Å; I134-F137 PolarHBondContact O-N 3.13Å; P135-F137 PolarHBondContact O-N 3.43Å; F137-T140 PolarHBondContact O-N 2.82Å; F137-A141 WeakPolarHBondContact O-CB 3.38Å; F137-A141 PolarHBondContact O-N 2.75Å; F137-A299 HydrophobicContact CE1-CB 3.91Å; F137-A299 HydrophobicContact CZ-CB 4.09Å; F137-V300 HydrophobicContact CZ-CB 4.39Å; F137-F303 HydrophobicContact CB-CD2 4.26Å; F137-F303 HydrophobicContact CB-CE2 4.34Å; F137-F303 HydrophobicContact CD2-CB 3.95Å; F137-F303 HydrophobicContact CD2-CD1 4.02Å; F137-F303 AromaticContact CD2-CD2 3.55Å; F137-F303 HydrophobicContact CD2-CD2 3.55Å; F137-F303 HydrophobicContact CD2-CE1 4.45Å; F137-F303 HydrophobicContact CD2-CE2 4.03Å; F137-F303 AromaticContact CD2-CG 3.54Å; F137-F303 HydrophobicContact CD2-CG 3.54Å; F137-F303 HydrophobicContact CD2-CZ 4.46Å; F137-F303 HydrophobicContact CE2-CB 3.61Å; F137-F303 HydrophobicContact CE2-CD1 4.04Å; F137-F303 HydrophobicContact CE2-CD2 4.12Å; F137-F303 AromaticContact CE2-CG 3.64Å; F137-F303 HydrophobicContact CE2-CG 3.64Å; F137-F303 HydrophobicContact CG-CD2 4.08Å; F137-F303 HydrophobicContact CG-CG 4.43Å; F137-F303 HydrophobicContact CZ-CB 4.13Å; F137-F303 WeakPolarHBondContact O-CD2 3.43Å
138	W	98.8	Very high	96.3	Very high	1 Å²	1	55 Å²	55	0%	0.004	31%	0.314	C	S	.	.	H	α-helix	trans	-71.4	-33.8	-177.9	-70.7	106.5	0	0	0	113.7	L136 A141 L142 L163 K164 D165 I166 L295 A299	L136-W138 PolarHBondContact O-N 2.93Å; W138-A141 PolarHBondContact O-N 2.91Å; W138-L142 VanDerWaalsContact O-CB 3.27Å; W138-L142 WeakPolarHBondContact O-CB 3.23Å; W138-L142 WeakPolarHBondContact O-CD1 3.5Å; W138-L142 WeakPolarHBondContact O-CG 3.17Å; W138-L142 PolarHBondContact O-N 3.15Å; W138-L163 HydrophobicContact CB-CB 4.25Å; W138-L163 HydrophobicContact CB-CD2 3.68Å; W138-L163 HydrophobicContact CB-CG 3.86Å; W138-L163 HydrophobicContact CG-CD2 4.36Å; W138-L163 HydrophobicContact CG-CG 4.25Å; W138-K164 VanDerWaalsContact CD1-C 3.44Å; W138-K164 PolarHBondContact NE1-O 2.95Å; W138-D165 WeakPolarHBondContact CZ2-OD1 3.46Å; W138-D165 VanDerWaalsContact NE1-CA 3.32Å; W138-I166 HydrophobicContact CD2-CB 4.49Å; W138-I166 HydrophobicContact CD2-CD1 3.99Å; W138-I166 HydrophobicContact CD2-CG1 3.82Å; W138-I166 HydrophobicContact CE3-CB 4.2Å; W138-I166 HydrophobicContact CE3-CD1 3.43Å; W138-I166 VanDerWaalsContact CE3-CD1 3.43Å; W138-I166 HydrophobicContact CE3-CG1 3.68Å; W138-I166 HydrophobicContact CG-CG1 4.32Å; W138-I166 HydrophobicContact CH2-CB 4Å; W138-I166 HydrophobicContact CH2-CG1 4.35Å; W138-I166 HydrophobicContact CZ2-CB 4.34Å; W138-I166 HydrophobicContact CZ3-CB 3.95Å; W138-I166 HydrophobicContact CZ3-CD1 3.84Å; W138-I166 HydrophobicContact CZ3-CG1 3.97Å; W138-L295 HydrophobicContact CE3-CD2 4.14Å; W138-L295 HydrophobicContact CZ3-CD2 3.71Å; W138-A299 HydrophobicContact CE3-CB 4.4Å; W138-A299 HydrophobicContact CH2-CB 3.8Å; W138-A299 HydrophobicContact CZ3-CB 3.6Å
139	L	98.5	Very high	96.5	Very high	16 Å²	16	51.3 Å²	51.3	8%	0.084	30%	0.298	C	S	.	.	H	α-helix	trans	-63.7	-45.2	176	171.9	59	0	0	0	110.4	L136 L142 R143 E157 L160	L136-L139 HydrophobicContact CD2-CD2 4.31Å; L136-L139 PolarHBondContact O-N 3.35Å; L139-L142 PolarHBondContact O-N 2.78Å; L139-R143 HydrophobicContact CD1-CG 4.15Å; L139-R143 WeakPolarHBondContact O-CB 3.46Å; L139-R143 WeakPolarHBondContact O-CG 3.5Å; L139-R143 PolarHBondContact O-N 3.21Å; L139-E157 HydrophobicContact CD1-CB 4.46Å; L139-E157 HydrophobicContact CD1-CG 4.4Å; L139-E157 HydrophobicContact CD2-CB 4.21Å; L139-L160 HydrophobicContact CD1-CB 3.81Å; L139-L160 HydrophobicContact CD1-CD1 4.11Å
140	T	98.5	Very high	96.7	Very high	44 Å²	44	50.5 Å²	50.5	27%	0.27	29%	0.294	S	S	.	.	H	α-helix	trans	-62.3	-49.5	176.1	-57.4	0	0	0	0	110.7	L136 F137 L142 R143 N144 F303	L136-T140 PolarHBondContact O-N 3.13Å; L136-T140 PolarHBondContact O-OG1 3.27Å; F137-T140 PolarHBondContact O-N 2.82Å; T140-L142 VanDerWaalsContact C-N 3.33Å; T140-L142 PolarHBondContact O-N 3.45Å; T140-R143 PolarHBondContact O-N 2.89Å; T140-R143 VanDerWaalsContact O-N 3.1Å; T140-N144 WeakPolarHBondContact O-CB 3.32Å; T140-N144 PolarHBondContact O-N 3.04Å; T140-F303 HydrophobicContact CG2-CD2 3.92Å; T140-F303 HydrophobicContact CG2-CE2 4.23Å
141	A	98.5	Very high	96.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59.4	-41.2	178.6	0	0	0	0	0	112.9	F137 W138 R143 N144 C145 L295 F303	F137-A141 WeakPolarHBondContact O-CB 3.38Å; F137-A141 PolarHBondContact O-N 2.75Å; W138-A141 PolarHBondContact O-N 2.91Å; A141-R143 VanDerWaalsContact C-N 3.34Å; A141-N144 PolarHBondContact O-N 3.22Å; A141-C145 WeakPolarHBondContact O-CB 3.44Å; A141-C145 PolarHBondContact O-N 3.43Å; A141-L295 WeakPolarHBondContact O-CD1 3.42Å; A141-F303 HydrophobicContact CB-CB 4.38Å
142	L	98.4	Very high	97	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66.5	-34.8	176.3	-71.1	166.9	0	0	0	112.5	W138 L139 T140 I148 A149 I152 L160 L163 I166 L291 L295	W138-L142 VanDerWaalsContact O-CB 3.27Å; W138-L142 WeakPolarHBondContact O-CB 3.23Å; W138-L142 WeakPolarHBondContact O-CD1 3.5Å; W138-L142 WeakPolarHBondContact O-CG 3.17Å; W138-L142 PolarHBondContact O-N 3.15Å; L139-L142 PolarHBondContact O-N 2.78Å; T140-L142 VanDerWaalsContact C-N 3.33Å; T140-L142 PolarHBondContact O-N 3.45Å; L142-I148 HydrophobicContact CB-CG2 4.19Å; L142-I148 HydrophobicContact CD2-CG2 3.59Å; L142-I148 HydrophobicContact CG-CG2 4.49Å; L142-A149 PolarHBondContact O-N 3.16Å; L142-I152 HydrophobicContact CB-CD1 3.66Å; L142-L160 HydrophobicContact CD1-CD2 4.23Å; L142-L163 HydrophobicContact CD1-CD2 3.65Å; L142-I166 HydrophobicContact CD1-CD1 4.18Å; L142-I166 HydrophobicContact CD2-CD1 3.91Å; L142-I166 HydrophobicContact CG-CD1 4.22Å; L142-L291 HydrophobicContact CD2-CD2 3.78Å; L142-L295 HydrophobicContact CD2-CD1 3.83Å; L142-L295 HydrophobicContact CD2-CD2 4.27Å; L142-L295 HydrophobicContact CG-CD1 4.35Å
143	R	97.5	Very high	97.1	Very high	132 Å²	132	43.3 Å²	43.3	50%	0.498	24%	0.241	S	C	.	.	H	α-helix	trans	-75.4	-25.3	178.3	-84.1	-170.3	55	175.8	-13.2	113.8	L139 T140 A141 C145 A149 E157	L139-R143 HydrophobicContact CD1-CG 4.15Å; L139-R143 WeakPolarHBondContact O-CB 3.46Å; L139-R143 WeakPolarHBondContact O-CG 3.5Å; L139-R143 PolarHBondContact O-N 3.21Å; T140-R143 PolarHBondContact O-N 2.89Å; T140-R143 VanDerWaalsContact O-N 3.1Å; A141-R143 VanDerWaalsContact C-N 3.34Å; R143-C145 VanDerWaalsContact C-N 3.32Å; R143-A149 VanDerWaalsContact O-CB 3.32Å; R143-A149 WeakPolarHBondContact O-CB 3.43Å; R143-E157 IonicContact CZ-OE1 2.79Å; R143-E157 IonicContact NE-OE1 2.67Å; R143-E157 IonicContact NH1-OE1 3.2Å; R143-E157 PolarHBondContact NH1-OE1 3.23Å
144	N	97.4	Very high	97.1	Very high	33 Å²	33	47.6 Å²	47.6	18%	0.176	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	3	178.1	-70.8	2.2	0	0	0	112.2	T140 A141 Y302 M308	T140-N144 WeakPolarHBondContact O-CB 3.32Å; T140-N144 PolarHBondContact O-N 3.04Å; A141-N144 PolarHBondContact O-N 3.22Å; N144-Y302 WeakPolarHBondContact CB-O 3.06Å; N144-Y302 PolarHBondContact ND2-O 3.43Å; N144-Y302 WeakPolarHBondContact O-CD1 3.36Å; N144-M308 HydrophobicContact CB-CG 3.82Å; N144-M308 HydrophobicContact CB-SD 3.75Å; N144-M308 VanDerWaalsContact CG-SD 3.56Å; N144-M308 WeakPolarHBondContact O-CG 3.13Å
145	C	96.6	Very high	97	Very high	1 Å²	1	51 Å²	51	1%	0.007	27%	0.274	C	S	.	.	S	Bend	trans	-107.5	113.5	178.3	-177.7	0	0	0	0	109.4	A141 R143 I148 A149 T290 L295 Y302	A141-C145 WeakPolarHBondContact O-CB 3.44Å; A141-C145 PolarHBondContact O-N 3.43Å; R143-C145 VanDerWaalsContact C-N 3.32Å; C145-I148 HydrophobicContact CB-CB 4.25Å; C145-I148 HydrophobicContact CB-CG1 4.24Å; C145-I148 WeakPolarHBondContact O-CB 3.44Å; C145-I148 PolarHBondContact O-N 2.79Å; C145-I148 VanDerWaalsContact O-N 3.16Å; C145-A149 WeakPolarHBondContact O-CB 3.38Å; C145-A149 PolarHBondContact O-N 3.1Å; C145-T290 WeakPolarHBondContact SG-CG2 3.35Å; C145-L295 HydrophobicContact CB-CD1 3.59Å; C145-Y302 HydrophobicContact CB-CD1 3.69Å; C145-Y302 HydrophobicContact CB-CE1 3.74Å; C145-Y302 HydrophobicContact CB-CG 4.31Å
146	D	93.9	Very high	97	Very high	78 Å²	78	47.3 Å²	47.3	42%	0.417	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	153.2	177.1	-60.6	-42.2	0	0	0	111.4	I148	D146-I148 PolarHBondContact O-N 2.91Å
147	G	91.9	Very high	97	Very high	30 Å²	30	45.6 Å²	45.6	31%	0.309	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	-37.1	-167.2	0	0	0	0	0	114.3
148	I	97	Very high	96.9	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-45	174.3	-52.2	-57.8	0	0	0	110.8	L142 C145 D146 E150 T151 I152 V287 T290 L291	L142-I148 HydrophobicContact CB-CG2 4.19Å; L142-I148 HydrophobicContact CD2-CG2 3.59Å; L142-I148 HydrophobicContact CG-CG2 4.49Å; C145-I148 HydrophobicContact CB-CB 4.25Å; C145-I148 HydrophobicContact CB-CG1 4.24Å; C145-I148 WeakPolarHBondContact O-CB 3.44Å; C145-I148 PolarHBondContact O-N 2.79Å; C145-I148 VanDerWaalsContact O-N 3.16Å; D146-I148 PolarHBondContact O-N 2.91Å; I148-E150 PolarHBondContact O-N 3Å; I148-T151 WeakPolarHBondContact O-CB 3.31Å; I148-T151 PolarHBondContact O-N 2.86Å; I148-T151 PolarHBondContact O-OG1 2.69Å; I148-I152 HydrophobicContact CG2-CD1 4.32Å; I148-V287 HydrophobicContact CD1-CB 4.31Å; I148-V287 HydrophobicContact CD1-CG1 3.7Å; I148-T290 HydrophobicContact CD1-CG2 4.02Å; I148-T290 HydrophobicContact CG1-CG2 3.81Å; I148-L291 HydrophobicContact CD1-CD2 4.1Å; I148-L291 HydrophobicContact CD1-CG 3.79Å; I148-L291 HydrophobicContact CG1-CD2 4.36Å
149	A	96.9	Very high	96.9	Very high	28 Å²	28	47.4 Å²	47.4	23%	0.231	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-54.8	-39	180	0	0	0	0	0	112.2	L142 R143 C145 T151 I152	L142-A149 PolarHBondContact O-N 3.16Å; R143-A149 VanDerWaalsContact O-CB 3.32Å; R143-A149 WeakPolarHBondContact O-CB 3.43Å; C145-A149 WeakPolarHBondContact O-CB 3.38Å; C145-A149 PolarHBondContact O-N 3.1Å; A149-T151 PolarHBondContact O-N 3.35Å; A149-I152 PolarHBondContact O-N 2.65Å
150	E	95.7	Very high	96.9	Very high	172 Å²	172	46.7 Å²	46.7	80%	0.804	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-62	-26.5	178.7	-59.6	-171.8	163.6	0	0	113.6	I148 I152	I148-E150 PolarHBondContact O-N 3Å; E150-I152 VanDerWaalsContact C-N 3.34Å
151	T	96.5	Very high	96.9	Very high	42 Å²	42	47.2 Å²	47.2	26%	0.258	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-81.8	-15.4	178.3	71.5	0	0	0	0	112.8	I148 A149 S256 F257 V287	I148-T151 WeakPolarHBondContact O-CB 3.31Å; I148-T151 PolarHBondContact O-N 2.86Å; I148-T151 PolarHBondContact O-OG1 2.69Å; A149-T151 PolarHBondContact O-N 3.35Å; T151-S256 CarbonylContact O-C 3.45Å; T151-F257 VanDerWaalsContact O-CA 3.23Å; T151-F257 WeakPolarHBondContact O-CA 3.31Å; T151-F257 PolarHBondContact O-N 2.97Å; T151-F257 WeakPolarHBondContact OG1-CD2 3.41Å; T151-V287 HydrophobicContact CG2-CG2 3.85Å
152	I	98.2	Very high	96.8	Very high	24 Å²	24	47.8 Å²	47.8	12%	0.123	26%	0.263	C	S	.	.			trans	-94.1	120.9	-173.4	-63.1	171.1	0	0	0	110.5	L142 I148 A149 E150 D156 E157 L160 F257	L142-I152 HydrophobicContact CB-CD1 3.66Å; I148-I152 HydrophobicContact CG2-CD1 4.32Å; A149-I152 PolarHBondContact O-N 2.65Å; E150-I152 VanDerWaalsContact C-N 3.34Å; I152-D156 HydrophobicContact CG2-CB 4.31Å; I152-E157 HydrophobicContact CG2-CG 4.45Å; I152-L160 HydrophobicContact CD1-CD1 4.01Å; I152-L160 HydrophobicContact CG1-CD1 4.02Å; I152-L160 HydrophobicContact CG2-CD1 3.85Å; I152-F257 HydrophobicContact CG1-CB 4.11Å; I152-F257 HydrophobicContact CG1-CD2 3.92Å; I152-F257 HydrophobicContact CG1-CG 4.24Å
153	T	97.5	Very high	96.8	Very high	40 Å²	40	48.3 Å²	48.3	25%	0.245	27%	0.265	C	S	.	.			trans	-95.4	159.7	171.9	75.2	0	0	0	0	111.5	K155 D156 E157 A255	T153-K155 PolarHBondContact O-N 2.82Å; T153-K155 PolarHBondContact OG1-N 3.47Å; T153-D156 WeakPolarHBondContact CB-OD2 3.48Å; T153-D156 PolarHBondContact N-OD2 3Å; T153-D156 WeakPolarHBondContact O-CB 3.44Å; T153-D156 PolarHBondContact O-N 3.18Å; T153-D156 VanDerWaalsContact OG1-CG 3.23Å; T153-D156 PolarHBondContact OG1-OD2 3.16Å; T153-E157 PolarHBondContact O-N 3.12Å; T153-A255 HydrophobicContact CG2-CB 4.31Å; T153-A255 WeakPolarHBondContact CG2-O 3.33Å
154	V	96.4	Very high	96.9	Very high	121 Å²	121	46.4 Å²	46.4	73%	0.733	26%	0.261	S	S	*	.	H	α-helix	trans	-52.5	-28.9	174.2	-179.3	0	0	0	0	112.9	D156	V154-D156 VanDerWaalsContact C-N 3.35Å
155	K	95.4	Very high	96.9	Very high	133 Å²	133	45 Å²	45	58%	0.578	25%	0.253	S	S	*	.	H	α-helix	trans	-76	-25.4	178.4	-65.5	-179.7	-176.9	168.2	0	113.1	T153 L231	T153-K155 PolarHBondContact O-N 2.82Å; T153-K155 PolarHBondContact OG1-N 3.47Å; K155-L231 HydrophobicContact CB-CD2 4.15Å
156	D	98.1	Very high	97	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-77	-32.1	-179.1	-56.6	-44.3	0	0	0	111.2	I152 T153 V154 A158 A159 L160 S256 F257 F258	I152-D156 HydrophobicContact CG2-CB 4.31Å; T153-D156 WeakPolarHBondContact CB-OD2 3.48Å; T153-D156 PolarHBondContact N-OD2 3Å; T153-D156 WeakPolarHBondContact O-CB 3.44Å; T153-D156 PolarHBondContact O-N 3.18Å; T153-D156 VanDerWaalsContact OG1-CG 3.23Å; T153-D156 PolarHBondContact OG1-OD2 3.16Å; V154-D156 VanDerWaalsContact C-N 3.35Å; D156-A158 VanDerWaalsContact C-N 3.26Å; D156-A158 PolarHBondContact O-N 3.33Å; D156-A158 VanDerWaalsContact O-N 3.15Å; D156-A159 WeakPolarHBondContact O-CA 3.39Å; D156-A159 WeakPolarHBondContact O-CB 3.49Å; D156-A159 PolarHBondContact O-N 3.04Å; D156-L160 HydrophobicContact CB-CD1 4.04Å; D156-L160 PolarHBondContact O-N 2.63Å; D156-S256 PolarHBondContact OD1-OG 3.21Å; D156-S256 WeakPolarHBondContact OD2-CA 3.49Å; D156-F257 HydrophobicContact CB-CB 4.29Å; D156-F257 PolarHBondContact OD2-N 3.24Å; D156-F258 HydrophobicContact CB-CD2 4.34Å; D156-F258 HydrophobicContact CB-CE2 3.93Å; D156-F258 WeakPolarHBondContact OD1-CD2 3.39Å
157	E	97.6	Very high	97.2	Very high	54 Å²	54	42.3 Å²	42.3	25%	0.252	24%	0.237	S	C	.	.	H	α-helix	trans	-50.2	-44.3	-176.7	-63.5	-171	153.2	0	0	113	L139 R143 I152 T153 A159 L160 S161	L139-E157 HydrophobicContact CD1-CB 4.46Å; L139-E157 HydrophobicContact CD1-CG 4.4Å; L139-E157 HydrophobicContact CD2-CB 4.21Å; R143-E157 IonicContact CZ-OE1 2.79Å; R143-E157 IonicContact NE-OE1 2.67Å; R143-E157 IonicContact NH1-OE1 3.2Å; R143-E157 PolarHBondContact NH1-OE1 3.23Å; I152-E157 HydrophobicContact CG2-CG 4.45Å; T153-E157 PolarHBondContact O-N 3.12Å; E157-A159 VanDerWaalsContact C-N 3.32Å; E157-A159 PolarHBondContact O-N 3.24Å; E157-L160 CarbonylContact O-C 3.3Å; E157-L160 PolarHBondContact O-N 3.12Å; E157-S161 WeakPolarHBondContact O-CB 3.47Å; E157-S161 PolarHBondContact O-N 3.01Å
158	A	96.3	Very high	97.5	Very high	47 Å²	47	42.6 Å²	42.6	39%	0.388	23%	0.234	S	C	.	.	H	α-helix	trans	-67.7	-31.6	-179.4	0	0	0	0	0	112.8	D156 S161 Y186	D156-A158 VanDerWaalsContact C-N 3.26Å; D156-A158 PolarHBondContact O-N 3.33Å; D156-A158 VanDerWaalsContact O-N 3.15Å; A158-S161 PolarHBondContact O-OG 3.43Å; A158-Y186 HydrophobicContact CB-CE2 3.97Å; A158-Y186 WeakPolarHBondContact CB-OH 3.43Å
159	A	98	Very high	97.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-76.4	-42	172.4	0	0	0	0	0	111.5	D156 E157 S161 A162 Y186 F187 L231 F258	D156-A159 WeakPolarHBondContact O-CA 3.39Å; D156-A159 WeakPolarHBondContact O-CB 3.49Å; D156-A159 PolarHBondContact O-N 3.04Å; E157-A159 VanDerWaalsContact C-N 3.32Å; E157-A159 PolarHBondContact O-N 3.24Å; A159-S161 PolarHBondContact O-N 3.46Å; A159-A162 WeakPolarHBondContact O-CB 3.43Å; A159-A162 PolarHBondContact O-N 3.16Å; A159-Y186 HydrophobicContact CB-CD1 4.25Å; A159-Y186 HydrophobicContact CB-CD2 3.54Å; A159-Y186 HydrophobicContact CB-CE2 3.96Å; A159-Y186 HydrophobicContact CB-CG 3.71Å; A159-F187 HydrophobicContact CB-CE1 4.39Å; A159-L231 HydrophobicContact CB-CD1 3.9Å; A159-F258 HydrophobicContact CB-CE2 3.75Å; A159-F258 HydrophobicContact CB-CZ 3.56Å
160	L	98.5	Very high	97.4	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-66	-23.4	176.7	-71.6	172.2	0	0	0	113	L139 L142 I152 D156 E157 A162 L163 F181 F257 F258	L139-L160 HydrophobicContact CD1-CB 3.81Å; L139-L160 HydrophobicContact CD1-CD1 4.11Å; L142-L160 HydrophobicContact CD1-CD2 4.23Å; I152-L160 HydrophobicContact CD1-CD1 4.01Å; I152-L160 HydrophobicContact CG1-CD1 4.02Å; I152-L160 HydrophobicContact CG2-CD1 3.85Å; D156-L160 HydrophobicContact CB-CD1 4.04Å; D156-L160 PolarHBondContact O-N 2.63Å; E157-L160 CarbonylContact O-C 3.3Å; E157-L160 PolarHBondContact O-N 3.12Å; L160-A162 PolarHBondContact O-N 2.96Å; L160-A162 VanDerWaalsContact O-N 3.1Å; L160-L163 HydrophobicContact CD2-CD2 4.22Å; L160-L163 WeakPolarHBondContact O-CB 3.31Å; L160-L163 PolarHBondContact O-N 3.42Å; L160-F181 HydrophobicContact CD2-CE1 4.42Å; L160-F181 HydrophobicContact CD2-CZ 4.31Å; L160-F257 HydrophobicContact CD1-CD1 4.38Å; L160-F257 HydrophobicContact CD1-CG 4.43Å; L160-F257 HydrophobicContact CD2-CD1 3.88Å; L160-F257 HydrophobicContact CD2-CE1 3.86Å; L160-F258 HydrophobicContact CD2-CZ 4.2Å; L160-F258 HydrophobicContact CG-CZ 4.22Å
161	S	97.9	Very high	97.4	Very high	56 Å²	56	39.8 Å²	39.8	39%	0.392	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-21.4	172.7	76.6	0	0	0	0	113.4	E157 A158 A159	E157-S161 WeakPolarHBondContact O-CB 3.47Å; E157-S161 PolarHBondContact O-N 3.01Å; A158-S161 PolarHBondContact O-OG 3.43Å; A159-S161 PolarHBondContact O-N 3.46Å
162	A	98	Very high	97.2	Very high	12 Å²	12	46 Å²	46	10%	0.099	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-1	175.8	0	0	0	0	0	113.7	A159 L160 F181 A182 N184	A159-A162 WeakPolarHBondContact O-CB 3.43Å; A159-A162 PolarHBondContact O-N 3.16Å; L160-A162 PolarHBondContact O-N 2.96Å; L160-A162 VanDerWaalsContact O-N 3.1Å; A162-F181 HydrophobicContact CB-CD1 4.31Å; A162-F181 WeakPolarHBondContact O-CA 3.4Å; A162-A182 PolarHBondContact O-N 2.91Å; A162-N184 HydrophobicContact CB-CB 3.62Å
163	L	98.5	Very high	96.9	Very high	11 Å²	11	51 Å²	51	6%	0.058	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	128.3	179	-171.1	60.6	0	0	0	110.2	W138 L142 L160 I166 F179 F181	W138-L163 HydrophobicContact CB-CB 4.25Å; W138-L163 HydrophobicContact CB-CD2 3.68Å; W138-L163 HydrophobicContact CB-CG 3.86Å; W138-L163 HydrophobicContact CG-CD2 4.36Å; W138-L163 HydrophobicContact CG-CG 4.25Å; L142-L163 HydrophobicContact CD1-CD2 3.65Å; L160-L163 HydrophobicContact CD2-CD2 4.22Å; L160-L163 WeakPolarHBondContact O-CB 3.31Å; L160-L163 PolarHBondContact O-N 3.42Å; L163-I166 HydrophobicContact CD1-CG1 4.32Å; L163-I166 HydrophobicContact CD2-CD1 3.83Å; L163-I166 HydrophobicContact CD2-CG1 3.9Å; L163-I166 HydrophobicContact CG-CG1 4.28Å; L163-F179 HydrophobicContact CD1-CB 3.89Å; L163-F179 HydrophobicContact CD1-CD1 4.23Å; L163-F179 HydrophobicContact CD2-CD1 4.39Å; L163-F181 HydrophobicContact CB-CD1 4.18Å; L163-F181 HydrophobicContact CB-CE1 3.88Å; L163-F181 HydrophobicContact CB-CZ 4.44Å; L163-F181 HydrophobicContact CD1-CD1 4.21Å; L163-F181 HydrophobicContact CD1-CD2 4.13Å; L163-F181 HydrophobicContact CD1-CE1 3.88Å; L163-F181 HydrophobicContact CD1-CE2 3.79Å; L163-F181 HydrophobicContact CD1-CG 4.35Å; L163-F181 HydrophobicContact CD1-CZ 3.66Å; L163-F181 HydrophobicContact CG-CE1 4.4Å
164	K	98.1	Very high	96.8	Very high	91 Å²	91	49.1 Å²	49.1	40%	0.396	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	-33.7	-174.2	-64.6	-53.4	-168.6	179.6	0	113.1	W138 Y180 A182	W138-K164 VanDerWaalsContact CD1-C 3.44Å; W138-K164 PolarHBondContact NE1-O 2.95Å; K164-Y180 PolarHBondContact N-O 2.75Å; K164-A182 HydrophobicContact CD-CB 4.3Å; K164-A182 HydrophobicContact CG-CB 3.94Å
165	D	98.7	Very high	96.9	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.016	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	150.2	-179.2	-157.2	2.6	0	0	0	110.6	R85 W138 R167 Y180	R85-D165 WeakPolarHBondContact CD-OD2 3.38Å; R85-D165 HydrophobicContact CG-CB 4.08Å; R85-D165 WeakPolarHBondContact CG-OD2 3.4Å; W138-D165 WeakPolarHBondContact CZ2-OD1 3.46Å; W138-D165 VanDerWaalsContact NE1-CA 3.32Å; D165-R167 VanDerWaalsContact CG-NE 3.31Å; D165-R167 IonicContact OD1-NE 2.93Å; D165-R167 PolarHBondContact OD1-NE 2.91Å; D165-R167 VanDerWaalsContact OD1-NE 3.15Å; D165-R167 IonicContact OD2-CZ 2.93Å; D165-R167 IonicContact OD2-NE 3.56Å; D165-R167 PolarHBondContact OD2-NE 2.82Å; D165-R167 IonicContact OD2-NH2 2.6Å; D165-R167 PolarHBondContact OD2-NH2 2.59Å; D165-Y180 HydrophobicContact CB-CD2 3.8Å; D165-Y180 HydrophobicContact CB-CG 4.17Å; D165-Y180 PolarHBondContact N-O 3.22Å; D165-Y180 PolarHBondContact O-N 3.26Å
166	I	98.6	Very high	97	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	126.1	168.7	-48.7	177.2	0	0	0	107.3	W138 L142 L163 S178 F179 L295 I296	W138-I166 HydrophobicContact CD2-CB 4.49Å; W138-I166 HydrophobicContact CD2-CD1 3.99Å; W138-I166 HydrophobicContact CD2-CG1 3.82Å; W138-I166 HydrophobicContact CE3-CB 4.2Å; W138-I166 HydrophobicContact CE3-CD1 3.43Å; W138-I166 VanDerWaalsContact CE3-CD1 3.43Å; W138-I166 HydrophobicContact CE3-CG1 3.68Å; W138-I166 HydrophobicContact CG-CG1 4.32Å; W138-I166 HydrophobicContact CH2-CB 4Å; W138-I166 HydrophobicContact CH2-CG1 4.35Å; W138-I166 HydrophobicContact CZ2-CB 4.34Å; W138-I166 HydrophobicContact CZ3-CB 3.95Å; W138-I166 HydrophobicContact CZ3-CD1 3.84Å; W138-I166 HydrophobicContact CZ3-CG1 3.97Å; L142-I166 HydrophobicContact CD1-CD1 4.18Å; L142-I166 HydrophobicContact CD2-CD1 3.91Å; L142-I166 HydrophobicContact CG-CD1 4.22Å; L163-I166 HydrophobicContact CD1-CG1 4.32Å; L163-I166 HydrophobicContact CD2-CD1 3.83Å; L163-I166 HydrophobicContact CD2-CG1 3.9Å; L163-I166 HydrophobicContact CG-CG1 4.28Å; I166-S178 CarbonylContact C-O 3.56Å; I166-S178 WeakPolarHBondContact CA-O 3.39Å; I166-F179 HydrophobicContact CB-CD1 4.49Å; I166-F179 HydrophobicContact CD1-CD1 4.02Å; I166-F179 HydrophobicContact CD1-CE1 3.91Å; I166-F179 HydrophobicContact CG1-CD1 3.87Å; I166-F179 HydrophobicContact CG1-CE1 4.2Å; I166-F179 HydrophobicContact CG2-CD1 3.95Å; I166-F179 HydrophobicContact CG2-CE1 3.82Å; I166-F179 HydrophobicContact CG2-CG 4.38Å; I166-F179 HydrophobicContact CG2-CZ 4.16Å; I166-L295 HydrophobicContact CD1-CD2 4.23Å; I166-I296 HydrophobicContact CB-CD1 4.49Å; I166-I296 HydrophobicContact CB-CG1 4.29Å; I166-I296 HydrophobicContact CG2-CD1 3.69Å; I166-I296 HydrophobicContact CG2-CG1 3.93Å
167	R	98.1	Very high	97	Very high	23 Å²	23	39.2 Å²	39.2	9%	0.087	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	138.1	-180	-63.6	-60.8	178.5	107.9	19	112	L81 D82 D165 L177 S178 Y180	L81-R167 VanDerWaalsContact C-NH2 3.33Å; L81-R167 PolarHBondContact O-NH2 3.19Å; D82-R167 IonicContact OD1-CZ 2.83Å; D82-R167 IonicContact OD1-NH1 2.62Å; D82-R167 PolarHBondContact OD1-NH1 3.15Å; D82-R167 IonicContact OD1-NH2 2.7Å; D82-R167 PolarHBondContact OD1-NH2 2.8Å; D165-R167 VanDerWaalsContact CG-NE 3.31Å; D165-R167 IonicContact OD1-NE 2.93Å; D165-R167 PolarHBondContact OD1-NE 2.91Å; D165-R167 VanDerWaalsContact OD1-NE 3.15Å; D165-R167 IonicContact OD2-CZ 2.93Å; D165-R167 IonicContact OD2-NE 3.56Å; D165-R167 PolarHBondContact OD2-NE 2.82Å; D165-R167 IonicContact OD2-NH2 2.6Å; D165-R167 PolarHBondContact OD2-NH2 2.59Å; R167-L177 CarbonylContact O-C 3.59Å; R167-L177 WeakPolarHBondContact O-CA 3.21Å; R167-S178 PolarHBondContact N-O 2.86Å; R167-S178 PolarHBondContact O-N 2.9Å; R167-Y180 HydrophobicContact CB-CE2 4.11Å; R167-Y180 HydrophobicContact CG-CD2 4.5Å; R167-Y180 HydrophobicContact CG-CE2 3.8Å
168	C	97.8	Very high	97.1	Very high	37 Å²	37	37.3 Å²	37.3	25%	0.25	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	125.6	165.4	-179.4	0	0	0	0	109.1	N176 L177 I296	C168-N176 CarbonylContact C-O 3.54Å; C168-N176 WeakPolarHBondContact CA-O 3.13Å; C168-L177 HydrophobicContact CB-CD2 3.84Å; C168-I296 HydrophobicContact CB-CD1 3.86Å
169	S	95.9	Very high	97.2	Very high	55 Å²	55	35.1 Å²	35.1	39%	0.385	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	114.8	176.8	-43.7	0	0	0	0	108.7	F175 N176	S169-F175 CarbonylContact O-C 3.56Å; S169-F175 VanDerWaalsContact O-CA 3.31Å; S169-F175 WeakPolarHBondContact O-CA 3.31Å; S169-N176 PolarHBondContact N-O 2.83Å; S169-N176 PolarHBondContact O-N 2.97Å
170	L	96	Very high	97.2	Very high	47 Å²	47	39.6 Å²	39.6	25%	0.246	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	140.4	174.8	-59.9	-175.6	0	0	0	110.4	Q70 M71 F175 R292	Q70-L170 HydrophobicContact CB-CD1 3.48Å; Q70-L170 VanDerWaalsContact CB-CD1 3.48Å; M71-L170 HydrophobicContact CG-CB 3.62Å; M71-L170 HydrophobicContact CG-CD1 4.27Å; L170-F175 HydrophobicContact CD2-CB 3.65Å; L170-R292 VanDerWaalsContact CD2-CZ 3.46Å
171	T	94.6	Very high	97.2	Very high	39 Å²	39	40 Å²	40	24%	0.239	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	167.8	173.2	74	0	0	0	0	108.8	H67 E173 G174	H67-T171 PolarHBondContact CE1-O 2.82Å; H67-T171 PolarHBondContact NE2-O 3.2Å; T171-E173 PolarHBondContact O-N 2.62Å; T171-E173 VanDerWaalsContact O-N 3.13Å; T171-E173 PolarHBondContact OG1-N 3.06Å; T171-G174 PolarHBondContact N-O 2.92Å; T171-G174 PolarHBondContact O-N 2.72Å; T171-G174 VanDerWaalsContact O-O 3.08Å; T171-G174 PolarHBondContact OG1-N 3.24Å; T171-G174 VanDerWaalsContact OG1-N 3.13Å; T171-G174 PolarHBondContact OG1-O 2.85Å
172	K	92.9	Very high	97.2	Very high	172 Å²	172	38.6 Å²	38.6	75%	0.748	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-32.6	177.7	-172.3	-176.9	176.5	-167.9	0	112.7
173	E	92.1	Very high	97.2	Very high	128 Å²	128	44.4 Å²	44.4	60%	0.598	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.6	16.2	-171.2	-62.2	176.8	176.5	0	0	112	T171 L197 L198	T171-E173 PolarHBondContact O-N 2.62Å; T171-E173 VanDerWaalsContact O-N 3.13Å; T171-E173 PolarHBondContact OG1-N 3.06Å; E173-L197 HydrophobicContact CB-CD2 4.5Å; E173-L197 CarbonylContact O-C 3.56Å; E173-L197 VanDerWaalsContact O-CA 3.28Å; E173-L197 WeakPolarHBondContact O-CA 3.37Å; E173-L198 PolarHBondContact O-N 3.33Å
174	G	95.6	Very high	97.1	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151.9	-135.8	-178.7	0	0	0	0	0	113.4	T171 Y196	T171-G174 PolarHBondContact N-O 2.92Å; T171-G174 PolarHBondContact O-N 2.72Å; T171-G174 VanDerWaalsContact O-O 3.08Å; T171-G174 PolarHBondContact OG1-N 3.24Å; T171-G174 VanDerWaalsContact OG1-N 3.13Å; T171-G174 PolarHBondContact OG1-O 2.85Å; G174-Y196 VanDerWaalsContact CA-O 3.3Å; G174-Y196 WeakPolarHBondContact CA-O 3.34Å
175	F	97.4	Very high	97.1	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.009	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	159.6	-179.1	65.8	-82.3	0	0	0	113.3	S169 L170 L177 Y196 L198 F285 A288	S169-F175 CarbonylContact O-C 3.56Å; S169-F175 VanDerWaalsContact O-CA 3.31Å; S169-F175 WeakPolarHBondContact O-CA 3.31Å; L170-F175 HydrophobicContact CD2-CB 3.65Å; F175-L177 HydrophobicContact CD2-CD2 4.5Å; F175-L177 HydrophobicContact CD2-CG 4.36Å; F175-L177 HydrophobicContact CE2-CD1 4.42Å; F175-L177 HydrophobicContact CE2-CG 4.21Å; F175-Y196 HydrophobicContact CD2-CD2 4.19Å; F175-Y196 HydrophobicContact CE1-CD2 4.27Å; F175-Y196 HydrophobicContact CE1-CG 4.09Å; F175-Y196 AromaticContact CE2-CD2 3.47Å; F175-Y196 HydrophobicContact CE2-CD2 3.47Å; F175-Y196 VanDerWaalsContact CE2-CD2 3.47Å; F175-Y196 HydrophobicContact CE2-CE2 4.15Å; F175-Y196 HydrophobicContact CE2-CG 4.13Å; F175-Y196 AromaticContact CZ-CD2 3.52Å; F175-Y196 HydrophobicContact CZ-CD2 3.52Å; F175-Y196 HydrophobicContact CZ-CE2 4.28Å; F175-Y196 AromaticContact CZ-CG 3.71Å; F175-Y196 HydrophobicContact CZ-CG 3.71Å; F175-Y196 PolarHBondContact N-O 3.36Å; F175-Y196 PolarHBondContact O-N 3.46Å; F175-L198 HydrophobicContact CD1-CD1 4.01Å; F175-L198 HydrophobicContact CE1-CD1 4.06Å; F175-L198 HydrophobicContact CE1-CG 4.49Å; F175-F285 HydrophobicContact CE1-CE2 4.02Å; F175-F285 HydrophobicContact CZ-CE2 4.1Å; F175-A288 HydrophobicContact CE2-CB 4.3Å; F175-A288 HydrophobicContact CZ-CB 4.22Å
176	N	97.8	Very high	97.1	Very high	44 Å²	44	48.1 Å²	48.1	24%	0.235	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	131.7	178.5	-66.5	-38.6	0	0	0	110.9	C168 S169 K194 E195	C168-N176 CarbonylContact C-O 3.54Å; C168-N176 WeakPolarHBondContact CA-O 3.13Å; S169-N176 PolarHBondContact N-O 2.83Å; S169-N176 PolarHBondContact O-N 2.97Å; N176-K194 CarbonylContact C-O 3.52Å; N176-K194 WeakPolarHBondContact CA-O 3.32Å; N176-E195 WeakPolarHBondContact OD1-CA 3.33Å; N176-E195 WeakPolarHBondContact OD1-CB 3.48Å; N176-E195 WeakPolarHBondContact OD1-CG 3.37Å
177	L	98.6	Very high	97.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	135	167.1	-60.3	172.2	0	0	0	109.5	R167 C168 F175 F179 T193 K194 Y196 F260 A288 L291 I296	R167-L177 CarbonylContact O-C 3.59Å; R167-L177 WeakPolarHBondContact O-CA 3.21Å; C168-L177 HydrophobicContact CB-CD2 3.84Å; F175-L177 HydrophobicContact CD2-CD2 4.5Å; F175-L177 HydrophobicContact CD2-CG 4.36Å; F175-L177 HydrophobicContact CE2-CD1 4.42Å; F175-L177 HydrophobicContact CE2-CG 4.21Å; L177-F179 HydrophobicContact CB-CE2 3.86Å; L177-T193 VanDerWaalsContact O-CA 3.31Å; L177-T193 WeakPolarHBondContact O-CA 3.45Å; L177-K194 HydrophobicContact CB-CB 4.31Å; L177-K194 PolarHBondContact N-O 2.72Å; L177-K194 PolarHBondContact O-N 3.37Å; L177-Y196 HydrophobicContact CD1-CE2 4.24Å; L177-F260 HydrophobicContact CD1-CE1 4.12Å; L177-F260 HydrophobicContact CD1-CZ 3.92Å; L177-A288 HydrophobicContact CD1-CB 4.05Å; L177-L291 HydrophobicContact CD1-CB 4.37Å; L177-L291 HydrophobicContact CD1-CD1 3.93Å; L177-I296 HydrophobicContact CD2-CD1 3.9Å
178	S	98.6	Very high	97.1	Very high	15 Å²	15	51.4 Å²	51.4	11%	0.105	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	121.5	179.5	-64.9	0	0	0	0	110.2	I166 R167	I166-S178 CarbonylContact C-O 3.56Å; I166-S178 WeakPolarHBondContact CA-O 3.39Å; R167-S178 PolarHBondContact N-O 2.86Å; R167-S178 PolarHBondContact O-N 2.9Å
179	F	98.8	Very high	97.2	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	111	-178	-63.9	-105.7	0	0	0	108.9	L163 I166 L177 F181 V191 L192 F257 F260 F261 L291	L163-F179 HydrophobicContact CD1-CB 3.89Å; L163-F179 HydrophobicContact CD1-CD1 4.23Å; L163-F179 HydrophobicContact CD2-CD1 4.39Å; I166-F179 HydrophobicContact CB-CD1 4.49Å; I166-F179 HydrophobicContact CD1-CD1 4.02Å; I166-F179 HydrophobicContact CD1-CE1 3.91Å; I166-F179 HydrophobicContact CG1-CD1 3.87Å; I166-F179 HydrophobicContact CG1-CE1 4.2Å; I166-F179 HydrophobicContact CG2-CD1 3.95Å; I166-F179 HydrophobicContact CG2-CE1 3.82Å; I166-F179 HydrophobicContact CG2-CG 4.38Å; I166-F179 HydrophobicContact CG2-CZ 4.16Å; L177-F179 HydrophobicContact CB-CE2 3.86Å; F179-F181 HydrophobicContact CB-CD2 4.36Å; F179-F181 HydrophobicContact CB-CE2 3.7Å; F179-F181 HydrophobicContact CB-CZ 4.49Å; F179-F181 WeakPolarHBondContact O-CD2 3.44Å; F179-V191 CarbonylContact O-C 3.57Å; F179-V191 VanDerWaalsContact O-CA 3.25Å; F179-V191 WeakPolarHBondContact O-CA 3.44Å; F179-L192 HydrophobicContact CB-CB 4.35Å; F179-L192 PolarHBondContact N-O 2.82Å; F179-L192 PolarHBondContact O-N 2.9Å; F179-F257 HydrophobicContact CD1-CZ 4.49Å; F179-F257 HydrophobicContact CE1-CE1 4.46Å; F179-F257 AromaticContact CE1-CZ 3.81Å; F179-F257 HydrophobicContact CE1-CZ 3.81Å; F179-F257 HydrophobicContact CZ-CZ 4.23Å; F179-F260 HydrophobicContact CE2-CE1 4.13Å; F179-F260 HydrophobicContact CZ-CE1 4.17Å; F179-F261 HydrophobicContact CB-CZ 4.45Å; F179-F261 HydrophobicContact CD1-CZ 4.33Å; F179-F261 AromaticContact CD2-CE1 3.53Å; F179-F261 HydrophobicContact CD2-CE1 3.53Å; F179-F261 AromaticContact CD2-CZ 3.48Å; F179-F261 HydrophobicContact CD2-CZ 3.48Å; F179-F261 VanDerWaalsContact CD2-CZ 3.48Å; F179-F261 HydrophobicContact CE1-CZ 4.44Å; F179-F261 AromaticContact CE2-CE1 3.66Å; F179-F261 HydrophobicContact CE2-CE1 3.66Å; F179-F261 AromaticContact CE2-CZ 3.62Å; F179-F261 HydrophobicContact CE2-CZ 3.62Å; F179-F261 HydrophobicContact CG-CE1 4.32Å; F179-F261 AromaticContact CG-CZ 3.86Å; F179-F261 HydrophobicContact CG-CZ 3.86Å; F179-F261 HydrophobicContact CZ-CZ 4.09Å; F179-L291 HydrophobicContact CE1-CD1 4.42Å; F179-L291 HydrophobicContact CZ-CD1 3.72Å
180	Y	98.7	Very high	97.3	Very high	94 Å²	94	53 Å²	53	37%	0.369	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	119.4	-174.3	-63.1	-96.2	0	0	0	110.1	K164 D165 R167 V191	K164-Y180 PolarHBondContact N-O 2.75Å; D165-Y180 HydrophobicContact CB-CD2 3.8Å; D165-Y180 HydrophobicContact CB-CG 4.17Å; D165-Y180 PolarHBondContact N-O 3.22Å; D165-Y180 PolarHBondContact O-N 3.26Å; R167-Y180 HydrophobicContact CB-CE2 4.11Å; R167-Y180 HydrophobicContact CG-CD2 4.5Å; R167-Y180 HydrophobicContact CG-CE2 3.8Å; Y180-V191 HydrophobicContact CD1-CG1 4.33Å; Y180-V191 HydrophobicContact CD1-CG2 3.56Å; Y180-V191 HydrophobicContact CE1-CG1 4.27Å; Y180-V191 HydrophobicContact CE1-CG2 3.75Å; Y180-V191 HydrophobicContact CG-CG2 4.39Å
181	F	98.6	Very high	97.4	Very high	10 Å²	10	52.9 Å²	52.9	4%	0.044	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	138.5	-179.2	-71.7	-91.6	0	0	0	111.4	L160 A162 L163 F179 F187 T190 L192 F258	L160-F181 HydrophobicContact CD2-CE1 4.42Å; L160-F181 HydrophobicContact CD2-CZ 4.31Å; A162-F181 HydrophobicContact CB-CD1 4.31Å; A162-F181 WeakPolarHBondContact O-CA 3.4Å; L163-F181 HydrophobicContact CB-CD1 4.18Å; L163-F181 HydrophobicContact CB-CE1 3.88Å; L163-F181 HydrophobicContact CB-CZ 4.44Å; L163-F181 HydrophobicContact CD1-CD1 4.21Å; L163-F181 HydrophobicContact CD1-CD2 4.13Å; L163-F181 HydrophobicContact CD1-CE1 3.88Å; L163-F181 HydrophobicContact CD1-CE2 3.79Å; L163-F181 HydrophobicContact CD1-CG 4.35Å; L163-F181 HydrophobicContact CD1-CZ 3.66Å; L163-F181 HydrophobicContact CG-CE1 4.4Å; F179-F181 HydrophobicContact CB-CD2 4.36Å; F179-F181 HydrophobicContact CB-CE2 3.7Å; F179-F181 HydrophobicContact CB-CZ 4.49Å; F179-F181 WeakPolarHBondContact O-CD2 3.44Å; F181-F187 HydrophobicContact CB-CE2 3.97Å; F181-F187 HydrophobicContact CB-CZ 4.36Å; F181-F187 HydrophobicContact CD1-CE2 4.18Å; F181-F187 AromaticContact CD1-CZ 3.7Å; F181-F187 HydrophobicContact CD1-CZ 3.7Å; F181-F187 AromaticContact CD2-CE2 3.9Å; F181-F187 HydrophobicContact CD2-CE2 3.9Å; F181-F187 AromaticContact CD2-CZ 3.86Å; F181-F187 HydrophobicContact CD2-CZ 3.86Å; F181-F187 AromaticContact CE1-CZ 3.83Å; F181-F187 HydrophobicContact CE1-CZ 3.83Å; F181-F187 HydrophobicContact CE2-CE2 4.42Å; F181-F187 AromaticContact CE2-CZ 3.98Å; F181-F187 HydrophobicContact CE2-CZ 3.98Å; F181-F187 AromaticContact CG-CE2 3.75Å; F181-F187 HydrophobicContact CG-CE2 3.75Å; F181-F187 AromaticContact CG-CZ 3.71Å; F181-F187 HydrophobicContact CG-CZ 3.71Å; F181-F187 AromaticContact CZ-CZ 3.96Å; F181-F187 HydrophobicContact CZ-CZ 3.96Å; F181-T190 PolarHBondContact N-O 2.7Å; F181-L192 HydrophobicContact CD2-CD1 4.45Å; F181-L192 HydrophobicContact CD2-CG 4.21Å; F181-L192 HydrophobicContact CE2-CB 4.39Å; F181-L192 HydrophobicContact CE2-CD1 3.79Å; F181-L192 HydrophobicContact CE2-CG 3.92Å; F181-L192 HydrophobicContact CZ-CD1 4.4Å; F181-F258 HydrophobicContact CZ-CE1 4.07Å
182	A	97.7	Very high	97.6	Very high	26 Å²	26	51 Å²	51	22%	0.215	27%	0.268	C	S	.	.			trans	-67.9	160.4	161	0	0	0	0	0	110.6	A162 K164 N184	A162-A182 PolarHBondContact O-N 2.91Å; K164-A182 HydrophobicContact CD-CB 4.3Å; K164-A182 HydrophobicContact CG-CB 3.94Å; A182-N184 PolarHBondContact O-N 3.46Å; A182-N184 VanDerWaalsContact O-N 3.16Å; A182-N184 PolarHBondContact O-ND2 2.94Å; A182-N184 VanDerWaalsContact O-ND2 3.14Å
183	P	98	Very high	97.9	Very high	134 Å²	134	45.8 Å²	45.8	87%	0.87	25%	0.25	S	S	*	.	S	Bend	trans	-51.1	124.3	171.9	-26.5	35.1	0	0	0	111.3
184	N	97.6	Very high	98.1	Very high	20 Å²	20	39.7 Å²	39.7	11%	0.107	22%	0.222	C	C	.	.			trans	-135.3	174.7	-174	65.4	73.3	0	0	0	111.6	A162 A182 Y186 F187 K226	A162-N184 HydrophobicContact CB-CB 3.62Å; A182-N184 PolarHBondContact O-N 3.46Å; A182-N184 VanDerWaalsContact O-N 3.16Å; A182-N184 PolarHBondContact O-ND2 2.94Å; A182-N184 VanDerWaalsContact O-ND2 3.14Å; N184-Y186 VanDerWaalsContact C-N 3.34Å; N184-Y186 PolarHBondContact O-N 2.88Å; N184-Y186 WeakPolarHBondContact OD1-CA 3.49Å; N184-Y186 WeakPolarHBondContact OD1-CB 3.23Å; N184-Y186 PolarHBondContact OD1-N 3.09Å; N184-F187 VanDerWaalsContact ND2-CE2 3.27Å; N184-F187 WeakPolarHBondContact ND2-CE2 3.48Å; N184-F187 PolarHBondContact OD1-N 3.33Å; N184-F187 VanDerWaalsContact OD1-N 3.12Å; N184-K226 PolarHBondContact O-NZ 3.49Å
185	E	97.8	Very high	98.2	Very high	126 Å²	126	42.7 Å²	42.7	59%	0.589	24%	0.236	S	C	*	.	S	Bend	trans	-81	-6.8	-177.6	-65.4	-161.7	168.1	0	0	115.1	K226 K229	E185-K226 WeakPolarHBondContact O-CD 3.37Å; E185-K229 WeakPolarHBondContact O-CG 3.34Å; E185-K229 IonicContact OE2-NZ 2.78Å; E185-K229 PolarHBondContact OE2-NZ 3.23Å
186	Y	98.4	Very high	98.3	Very high	38 Å²	38	42.6 Å²	42.6	15%	0.149	24%	0.235	C	C	.	.	S	Bend	trans	-101.7	-45.1	-164.5	-65.7	-90.1	0	0	0	113.7	A158 A159 N184 K226 K229 L231	A158-Y186 HydrophobicContact CB-CE2 3.97Å; A158-Y186 WeakPolarHBondContact CB-OH 3.43Å; A159-Y186 HydrophobicContact CB-CD1 4.25Å; A159-Y186 HydrophobicContact CB-CD2 3.54Å; A159-Y186 HydrophobicContact CB-CE2 3.96Å; A159-Y186 HydrophobicContact CB-CG 3.71Å; N184-Y186 VanDerWaalsContact C-N 3.34Å; N184-Y186 PolarHBondContact O-N 2.88Å; N184-Y186 WeakPolarHBondContact OD1-CA 3.49Å; N184-Y186 WeakPolarHBondContact OD1-CB 3.23Å; N184-Y186 PolarHBondContact OD1-N 3.09Å; Y186-K226 WeakPolarHBondContact O-CB 3.31Å; Y186-K226 PolarHBondContact O-N 3.39Å; Y186-K229 HydrophobicContact CD1-CB 4.21Å; Y186-K229 HydrophobicContact CD1-CD 4.29Å; Y186-K229 HydrophobicContact CE1-CD 4.39Å; Y186-L231 HydrophobicContact CD1-CD1 3.84Å; Y186-L231 HydrophobicContact CD1-CD2 3.96Å; Y186-L231 HydrophobicContact CD1-CG 3.94Å; Y186-L231 HydrophobicContact CE1-CD1 4.11Å; Y186-L231 HydrophobicContact CE1-CD2 3.81Å; Y186-L231 HydrophobicContact CE1-CG 4.26Å
187	F	98.5	Very high	98.2	Very high	2 Å²	2	42 Å²	42	1%	0.009	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-143.8	167.9	-178.7	47.7	-102	0	0	0	111.1	A159 F181 N184 N189 L192 I223 D224 W225 K226 F258	A159-F187 HydrophobicContact CB-CE1 4.39Å; F181-F187 HydrophobicContact CB-CE2 3.97Å; F181-F187 HydrophobicContact CB-CZ 4.36Å; F181-F187 HydrophobicContact CD1-CE2 4.18Å; F181-F187 AromaticContact CD1-CZ 3.7Å; F181-F187 HydrophobicContact CD1-CZ 3.7Å; F181-F187 AromaticContact CD2-CE2 3.9Å; F181-F187 HydrophobicContact CD2-CE2 3.9Å; F181-F187 AromaticContact CD2-CZ 3.86Å; F181-F187 HydrophobicContact CD2-CZ 3.86Å; F181-F187 AromaticContact CE1-CZ 3.83Å; F181-F187 HydrophobicContact CE1-CZ 3.83Å; F181-F187 HydrophobicContact CE2-CE2 4.42Å; F181-F187 AromaticContact CE2-CZ 3.98Å; F181-F187 HydrophobicContact CE2-CZ 3.98Å; F181-F187 AromaticContact CG-CE2 3.75Å; F181-F187 HydrophobicContact CG-CE2 3.75Å; F181-F187 AromaticContact CG-CZ 3.71Å; F181-F187 HydrophobicContact CG-CZ 3.71Å; F181-F187 AromaticContact CZ-CZ 3.96Å; F181-F187 HydrophobicContact CZ-CZ 3.96Å; N184-F187 VanDerWaalsContact ND2-CE2 3.27Å; N184-F187 WeakPolarHBondContact ND2-CE2 3.48Å; N184-F187 PolarHBondContact OD1-N 3.33Å; N184-F187 VanDerWaalsContact OD1-N 3.12Å; F187-N189 HydrophobicContact CD2-CB 4.05Å; F187-N189 WeakPolarHBondContact CD2-O 3.18Å; F187-L192 HydrophobicContact CE1-CD1 4.46Å; F187-L192 HydrophobicContact CZ-CD1 4.17Å; F187-I223 HydrophobicContact CB-CG2 3.61Å; F187-I223 HydrophobicContact CD1-CG2 3.85Å; F187-I223 HydrophobicContact CG-CG2 3.82Å; F187-D224 VanDerWaalsContact CA-O 3.23Å; F187-D224 WeakPolarHBondContact CA-O 3.4Å; F187-D224 WeakPolarHBondContact CB-O 3.35Å; F187-W225 HydrophobicContact CB-CE3 4.42Å; F187-W225 HydrophobicContact CD1-CE3 4.18Å; F187-W225 HydrophobicContact CD1-CH2 4.4Å; F187-W225 AromaticContact CD1-CZ3 3.87Å; F187-W225 HydrophobicContact CD1-CZ3 3.87Å; F187-K226 WeakPolarHBondContact O-CE 3.34Å; F187-F258 HydrophobicContact CE1-CD1 4.36Å; F187-F258 AromaticContact CE1-CE1 3.66Å; F187-F258 HydrophobicContact CE1-CE1 3.66Å; F187-F258 HydrophobicContact CE1-CZ 4.02Å; F187-F258 HydrophobicContact CZ-CE1 4.14Å
188	T	98.4	Very high	98	Very high	90 Å²	90	43.1 Å²	43.1	55%	0.552	24%	0.237	S	C	*	.	S	Bend	trans	-97.8	-14.1	178.8	50	0	0	0	0	114.1	T190 D224 K226	T188-T190 PolarHBondContact O-N 2.96Å; T188-D224 PolarHBondContact N-O 3.35Å; T188-D224 VanDerWaalsContact N-O 3.07Å; T188-D224 WeakPolarHBondContact OG1-CB 3.38Å; T188-K226 HydrophobicContact CG2-CG 4.33Å
189	N	98.5	Very high	97.7	Very high	27 Å²	27	45.5 Å²	45.5	14%	0.144	25%	0.246	C	C	.	.			trans	-57.9	134.2	175.8	-50.2	73.5	0	0	0	110.3	F187 L192 V222 D224	F187-N189 HydrophobicContact CD2-CB 4.05Å; F187-N189 WeakPolarHBondContact CD2-O 3.18Å; N189-L192 HydrophobicContact CB-CD2 3.55Å; N189-V222 PolarHBondContact ND2-O 2.91Å; N189-D224 WeakPolarHBondContact OD1-CA 3.41Å; N189-D224 WeakPolarHBondContact OD1-CB 3.13Å; N189-D224 PolarHBondContact OD1-N 3.48Å
190	T	98.3	Very high	97.5	Very high	97 Å²	97	46.5 Å²	46.5	60%	0.595	25%	0.251	S	S	*	.	S	Bend	trans	-89.7	-19.5	168.6	53.8	0	0	0	0	111.8	F181 T188	F181-T190 PolarHBondContact N-O 2.7Å; T188-T190 PolarHBondContact O-N 2.96Å
191	V	98.6	Very high	97.3	Very high	45 Å²	45	48 Å²	48	27%	0.273	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	129.5	176.1	-168.6	0	0	0	0	109.1	F179 Y180 T193	F179-V191 CarbonylContact O-C 3.57Å; F179-V191 VanDerWaalsContact O-CA 3.25Å; F179-V191 WeakPolarHBondContact O-CA 3.44Å; Y180-V191 HydrophobicContact CD1-CG1 4.33Å; Y180-V191 HydrophobicContact CD1-CG2 3.56Å; Y180-V191 HydrophobicContact CE1-CG1 4.27Å; Y180-V191 HydrophobicContact CE1-CG2 3.75Å; Y180-V191 HydrophobicContact CG-CG2 4.39Å; V191-T193 HydrophobicContact CG1-CG2 3.98Å
192	L	98.8	Very high	97.1	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	137.8	165.2	-57.2	-175.2	0	0	0	108.7	F179 F181 F187 N189 I223 F258 F261	F179-L192 HydrophobicContact CB-CB 4.35Å; F179-L192 PolarHBondContact N-O 2.82Å; F179-L192 PolarHBondContact O-N 2.9Å; F181-L192 HydrophobicContact CD2-CD1 4.45Å; F181-L192 HydrophobicContact CD2-CG 4.21Å; F181-L192 HydrophobicContact CE2-CB 4.39Å; F181-L192 HydrophobicContact CE2-CD1 3.79Å; F181-L192 HydrophobicContact CE2-CG 3.92Å; F181-L192 HydrophobicContact CZ-CD1 4.4Å; F187-L192 HydrophobicContact CE1-CD1 4.46Å; F187-L192 HydrophobicContact CZ-CD1 4.17Å; N189-L192 HydrophobicContact CB-CD2 3.55Å; L192-I223 HydrophobicContact CD1-CD1 4.04Å; L192-I223 HydrophobicContact CD1-CG1 4.17Å; L192-I223 HydrophobicContact CD2-CG1 3.93Å; L192-I223 HydrophobicContact CD2-CG2 4.47Å; L192-F258 HydrophobicContact CD1-CD1 3.93Å; L192-F258 HydrophobicContact CD1-CE1 3.98Å; L192-F261 HydrophobicContact CB-CD1 3.94Å; L192-F261 HydrophobicContact CB-CD2 4.49Å; L192-F261 HydrophobicContact CB-CE1 3.69Å; L192-F261 HydrophobicContact CB-CE2 4.27Å; L192-F261 HydrophobicContact CB-CG 4.33Å; L192-F261 HydrophobicContact CB-CZ 3.87Å; L192-F261 HydrophobicContact CD1-CD2 3.9Å; L192-F261 HydrophobicContact CD1-CE2 3.79Å; L192-F261 HydrophobicContact CD1-CG 4.4Å; L192-F261 HydrophobicContact CD1-CZ 4.19Å
193	T	98.4	Very high	96.9	Very high	62 Å²	62	49.8 Å²	49.8	38%	0.38	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	144	-172.9	58.6	0	0	0	0	111.6	L177 V191 G220 C221	L177-T193 VanDerWaalsContact O-CA 3.31Å; L177-T193 WeakPolarHBondContact O-CA 3.45Å; V191-T193 HydrophobicContact CG1-CG2 3.98Å; T193-G220 CarbonylContact O-C 3.43Å; T193-C221 PolarHBondContact N-SG 3.22Å; T193-C221 WeakPolarHBondContact O-CB 3.36Å; T193-C221 PolarHBondContact O-SG 3.39Å
194	K	98	Very high	96.7	Very high	1 Å²	1	49.1 Å²	49.1	0%	0.004	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	130.6	170.8	-170.7	68.8	172.5	-69.2	0	108.8	N176 L177 Y196 K219 F260 D284	N176-K194 CarbonylContact C-O 3.52Å; N176-K194 WeakPolarHBondContact CA-O 3.32Å; L177-K194 HydrophobicContact CB-CB 4.31Å; L177-K194 PolarHBondContact N-O 2.72Å; L177-K194 PolarHBondContact O-N 3.37Å; K194-Y196 HydrophobicContact CB-CE2 4.32Å; K194-Y196 HydrophobicContact CD-CE2 4.47Å; K194-Y196 WeakPolarHBondContact CE-OH 3.4Å; K194-Y196 HydrophobicContact CG-CD2 4.23Å; K194-Y196 HydrophobicContact CG-CE2 3.37Å; K194-Y196 PolarHBondContact NZ-OH 3.46Å; K194-K219 WeakPolarHBondContact CA-O 3.13Å; K194-F260 HydrophobicContact CB-CE1 3.99Å; K194-F260 HydrophobicContact CB-CZ 4.44Å; K194-F260 WeakPolarHBondContact CD-O 3.26Å; K194-F260 WeakPolarHBondContact CE-O 3.41Å; K194-F260 HydrophobicContact CG-CE1 3.94Å; K194-F260 HydrophobicContact CG-CZ 3.97Å; K194-F260 PolarHBondContact NZ-O 2.87Å; K194-D284 IonicContact NZ-OD1 3.88Å; K194-D284 PolarHBondContact NZ-OD1 3.39Å; K194-D284 IonicContact NZ-OD2 3.6Å; K194-D284 PolarHBondContact NZ-OD2 2.89Å
195	E	97.8	Very high	96.4	Very high	64 Å²	64	56.5 Å²	56.5	30%	0.299	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	135.1	-178.2	168.9	171.8	-150.3	0	0	109.4	N176 L197 R218 K219	N176-E195 WeakPolarHBondContact OD1-CA 3.33Å; N176-E195 WeakPolarHBondContact OD1-CB 3.48Å; N176-E195 WeakPolarHBondContact OD1-CG 3.37Å; E195-L197 HydrophobicContact CG-CD2 4.34Å; E195-R218 CarbonylContact O-C 3.54Å; E195-R218 VanDerWaalsContact O-CA 3.23Å; E195-R218 WeakPolarHBondContact O-CA 3.49Å; E195-K219 HydrophobicContact CB-CB 4.19Å; E195-K219 PolarHBondContact N-O 2.94Å; E195-K219 PolarHBondContact O-N 3.05Å
196	Y	97.6	Very high	96.2	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	130.4	175	-67.2	-86.7	0	0	0	109.4	G174 F175 L177 K194 L215 R218 F260 D284 F285 A288	G174-Y196 VanDerWaalsContact CA-O 3.3Å; G174-Y196 WeakPolarHBondContact CA-O 3.34Å; F175-Y196 HydrophobicContact CD2-CD2 4.19Å; F175-Y196 HydrophobicContact CE1-CD2 4.27Å; F175-Y196 HydrophobicContact CE1-CG 4.09Å; F175-Y196 AromaticContact CE2-CD2 3.47Å; F175-Y196 HydrophobicContact CE2-CD2 3.47Å; F175-Y196 VanDerWaalsContact CE2-CD2 3.47Å; F175-Y196 HydrophobicContact CE2-CE2 4.15Å; F175-Y196 HydrophobicContact CE2-CG 4.13Å; F175-Y196 AromaticContact CZ-CD2 3.52Å; F175-Y196 HydrophobicContact CZ-CD2 3.52Å; F175-Y196 HydrophobicContact CZ-CE2 4.28Å; F175-Y196 AromaticContact CZ-CG 3.71Å; F175-Y196 HydrophobicContact CZ-CG 3.71Å; F175-Y196 PolarHBondContact N-O 3.36Å; F175-Y196 PolarHBondContact O-N 3.46Å; L177-Y196 HydrophobicContact CD1-CE2 4.24Å; K194-Y196 HydrophobicContact CB-CE2 4.32Å; K194-Y196 HydrophobicContact CD-CE2 4.47Å; K194-Y196 WeakPolarHBondContact CE-OH 3.4Å; K194-Y196 HydrophobicContact CG-CD2 4.23Å; K194-Y196 HydrophobicContact CG-CE2 3.37Å; K194-Y196 PolarHBondContact NZ-OH 3.46Å; Y196-L215 HydrophobicContact CD1-CD1 3.71Å; Y196-R218 HydrophobicContact CD1-CB 3.95Å; Y196-R218 HydrophobicContact CE1-CB 4.06Å; Y196-F260 HydrophobicContact CE2-CZ 4.36Å; Y196-F260 WeakPolarHBondContact OH-CE2 3.43Å; Y196-F260 WeakPolarHBondContact OH-CZ 3.3Å; Y196-D284 VanDerWaalsContact CE1-OD2 3.29Å; Y196-D284 WeakPolarHBondContact CE1-OD2 3.33Å; Y196-D284 PolarHBondContact OH-O 2.77Å; Y196-D284 PolarHBondContact OH-OD2 3.02Å; Y196-F285 AromaticContact CD1-CD2 3.77Å; Y196-F285 HydrophobicContact CD1-CD2 3.77Å; Y196-F285 HydrophobicContact CD1-CE2 4.2Å; Y196-F285 AromaticContact CE1-CD2 3.97Å; Y196-F285 HydrophobicContact CE1-CD2 3.97Å; Y196-F285 HydrophobicContact CG-CD2 4.47Å; Y196-A288 HydrophobicContact CD2-CB 4.06Å; Y196-A288 HydrophobicContact CE1-CB 4.09Å; Y196-A288 HydrophobicContact CE2-CB 3.28Å; Y196-A288 WeakPolarHBondContact OH-CB 3.46Å
197	L	96.3	Very high	96	Very high	32 Å²	32	54.6 Å²	54.6	17%	0.168	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	124.6	177.3	-59.5	177.4	0	0	0	109.2	E173 E195 V216 G217 P269	E173-L197 HydrophobicContact CB-CD2 4.5Å; E173-L197 CarbonylContact O-C 3.56Å; E173-L197 VanDerWaalsContact O-CA 3.28Å; E173-L197 WeakPolarHBondContact O-CA 3.37Å; E195-L197 HydrophobicContact CG-CD2 4.34Å; L197-V216 HydrophobicContact CB-CG2 4.04Å; L197-V216 WeakPolarHBondContact O-CG2 3.47Å; L197-V216 PolarHBondContact O-N 3.29Å; L197-G217 PolarHBondContact N-O 3.31Å; L197-G217 PolarHBondContact O-N 2.92Å; L197-P269 HydrophobicContact CD1-CG 3.47Å; L197-P269 VanDerWaalsContact CD1-CG 3.47Å
198	L	94.8	Very high	95.9	Very high	22 Å²	22	58.2 Å²	58.2	12%	0.115	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.3	-175.9	-57.7	-179.5	0	0	0	110.5	E173 F175 P213 E214 L215 F285	E173-L198 PolarHBondContact O-N 3.33Å; F175-L198 HydrophobicContact CD1-CD1 4.01Å; F175-L198 HydrophobicContact CE1-CD1 4.06Å; F175-L198 HydrophobicContact CE1-CG 4.49Å; L198-P213 HydrophobicContact CB-CB 4.47Å; L198-E214 CarbonylContact C-O 3.52Å; L198-E214 VanDerWaalsContact CA-O 3.26Å; L198-E214 WeakPolarHBondContact CA-O 3.27Å; L198-L215 HydrophobicContact CD2-CD1 4.3Å; L198-F285 HydrophobicContact CD2-CE2 3.96Å; L198-F285 HydrophobicContact CD2-CZ 4.01Å
199	K	93.4	Very high	95.6	Very high	65 Å²	65	61.5 Å²	61.5	28%	0.283	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	113.7	170.9	-178.7	-173.2	170.8	-162.1	0	109.3	P213 E214 V216	K199-P213 WeakPolarHBondContact O-CA 3.34Å; K199-E214 HydrophobicContact CB-CB 4.46Å; K199-E214 PolarHBondContact N-O 2.97Å; K199-E214 PolarHBondContact O-N 2.9Å; K199-V216 HydrophobicContact CB-CB 4.48Å; K199-V216 HydrophobicContact CB-CG1 3.5Å; K199-V216 HydrophobicContact CB-CG2 4.14Å; K199-V216 HydrophobicContact CD-CG1 4.11Å; K199-V216 HydrophobicContact CG-CG1 4.48Å
200	I	94.6	Very high	95.4	Very high	21 Å²	21	61.4 Å²	61.4	11%	0.108	32%	0.321	C	S	.	.			trans	-92.4	-19	-178.6	-52.5	174.6	0	0	0	111.5	S60 R63 Q64 H67 Y210 P213	S60-I200 PolarHBondContact OG-O 3.42Å; R63-I200 HydrophobicContact CB-CG2 3.68Å; Q64-I200 HydrophobicContact CG-CB 4.12Å; Q64-I200 HydrophobicContact CG-CG2 3.71Å; H67-I200 HydrophobicContact CB-CD1 3.92Å; I200-Y210 WeakPolarHBondContact O-CE2 3.37Å; I200-Y210 PolarHBondContact O-OH 3.19Å; I200-P213 HydrophobicContact CG1-CB 4.19Å; I200-P213 HydrophobicContact CG1-CG 4.38Å
201	E	93.8	Very high	95.2	Very high	126 Å²	126	64.1 Å²	64.1	59%	0.589	33%	0.332	S	S	*	.	S	Bend	trans	-75.5	141.8	-175.8	-69.8	178	-174.9	0	0	113.2	S60 Q64 D203	S60-E201 WeakPolarHBondContact OG-CA 3.46Å; Q64-E201 VanDerWaalsContact NE2-CG 3.29Å; E201-D203 PolarHBondContact O-N 3.38Å
202	V	94.6	Very high	94.9	Very high	26 Å²	26	62.2 Å²	62.2	16%	0.158	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-60.4	128.9	169.6	-179	0	0	0	0	110	L56 P204 P207 Y210	L56-V202 HydrophobicContact CB-CG2 4.41Å; L56-V202 WeakPolarHBondContact O-CG2 3.3Å; V202-P204 VanDerWaalsContact O-CD 3.3Å; V202-P204 WeakPolarHBondContact O-CD 3.24Å; V202-P207 VanDerWaalsContact CG1-CA 3.5Å; V202-P207 HydrophobicContact CG1-CB 3.54Å; V202-Y210 HydrophobicContact CB-CD2 4.44Å; V202-Y210 HydrophobicContact CG2-CD1 4.34Å; V202-Y210 HydrophobicContact CG2-CD2 4Å; V202-Y210 HydrophobicContact CG2-CE2 4.39Å; V202-Y210 HydrophobicContact CG2-CG 3.95Å
203	D	93.1	Very high	94.6	Very high	48 Å²	48	65 Å²	65	26%	0.257	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-70.8	117.4	172.8	-176.8	-1.4	0	0	0	110.4	E201 K205 N206 P207	E201-D203 PolarHBondContact O-N 3.38Å; D203-K205 PolarHBondContact O-N 2.69Å; D203-K205 VanDerWaalsContact O-N 3.1Å; D203-K205 WeakPolarHBondContact OD1-CB 3.28Å; D203-K205 PolarHBondContact OD1-N 3.33Å; D203-N206 CarbonylContact O-C 3.55Å; D203-N206 VanDerWaalsContact O-C 3.3Å; D203-N206 PolarHBondContact O-N 2.84Å; D203-N206 VanDerWaalsContact O-N 3.14Å; D203-P207 VanDerWaalsContact O-CA 3.25Å; D203-P207 WeakPolarHBondContact O-CA 3.46Å; D203-P207 WeakPolarHBondContact O-CD 3.23Å
204	P	92.9	Very high	94.2	Very high	119 Å²	119	67.2 Å²	67.2	77%	0.773	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-20.4	177.4	26	-36.3	0	0	0	113.9	V202	V202-P204 VanDerWaalsContact O-CD 3.3Å; V202-P204 WeakPolarHBondContact O-CD 3.24Å
205	K	93	Very high	93.9	Very high	175 Å²	175	69 Å²	69	76%	0.761	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-36.1	176.9	-63.9	-179.6	-177.4	172.8	0	112.3	D203	D203-K205 PolarHBondContact O-N 2.69Å; D203-K205 VanDerWaalsContact O-N 3.1Å; D203-K205 WeakPolarHBondContact OD1-CB 3.28Å; D203-K205 PolarHBondContact OD1-N 3.33Å
206	N	92.4	Very high	93.7	Very high	99 Å²	99	67.7 Å²	67.7	53%	0.529	35%	0.352	S	S	.	.	S	Bend	trans	-138	59.5	-174.9	-67	-45	0	0	0	111.1	D203 L208 M209	D203-N206 CarbonylContact O-C 3.55Å; D203-N206 VanDerWaalsContact O-C 3.3Å; D203-N206 PolarHBondContact O-N 2.84Å; D203-N206 VanDerWaalsContact O-N 3.14Å; N206-L208 PolarHBondContact O-N 2.88Å; N206-L208 VanDerWaalsContact O-N 3.14Å; N206-M209 HydrophobicContact CB-CB 4.26Å; N206-M209 HydrophobicContact CB-CG 3.91Å; N206-M209 WeakPolarHBondContact O-CB 3.29Å; N206-M209 PolarHBondContact O-N 3.22Å
207	P	95.4	Very high	93.5	Very high	26 Å²	26	67.7 Å²	67.7	17%	0.169	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-65.3	-26.9	-168.1	25.8	-36.1	0	0	0	113.5	I53 L56 V202 D203 M209 Y210	I53-P207 HydrophobicContact CD1-CB 4.49Å; I53-P207 HydrophobicContact CD1-CG 3.83Å; I53-P207 HydrophobicContact CG1-CB 4.15Å; I53-P207 HydrophobicContact CG1-CG 4Å; I53-P207 HydrophobicContact CG2-CB 4.22Å; L56-P207 WeakPolarHBondContact CD1-O 3.16Å; V202-P207 VanDerWaalsContact CG1-CA 3.5Å; V202-P207 HydrophobicContact CG1-CB 3.54Å; D203-P207 VanDerWaalsContact O-CA 3.25Å; D203-P207 WeakPolarHBondContact O-CA 3.46Å; D203-P207 WeakPolarHBondContact O-CD 3.23Å; P207-M209 PolarHBondContact O-N 2.83Å; P207-Y210 PolarHBondContact O-N 2.98Å
208	L	95.2	Very high	93.5	Very high	78 Å²	78	66.4 Å²	66.4	41%	0.408	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-76.1	-7.1	177.9	-66.5	173.2	0	0	0	113.6	K49 Q52 I53 L56 N206	K49-L208 HydrophobicContact CD-CD1 4.21Å; K49-L208 HydrophobicContact CG-CD1 4.41Å; Q52-L208 HydrophobicContact CB-CD2 3.95Å; Q52-L208 HydrophobicContact CG-CD2 3.62Å; I53-L208 HydrophobicContact CG1-CD2 3.82Å; I53-L208 HydrophobicContact CG1-CG 4.16Å; L56-L208 HydrophobicContact CD1-CD2 4.33Å; N206-L208 PolarHBondContact O-N 2.88Å; N206-L208 VanDerWaalsContact O-N 3.14Å
209	M	93.3	Very high	93.6	Very high	159 Å²	159	71 Å²	71	78%	0.783	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-94.4	4.9	176.6	-56	-62	-102.6	0	0	112.3	N206 P207 D211	N206-M209 HydrophobicContact CB-CB 4.26Å; N206-M209 HydrophobicContact CB-CG 3.91Å; N206-M209 WeakPolarHBondContact O-CB 3.29Å; N206-M209 PolarHBondContact O-N 3.22Å; P207-M209 PolarHBondContact O-N 2.83Å; M209-D211 PolarHBondContact O-N 2.84Å
210	Y	94	Very high	93.7	Very high	25 Å²	25	68.2 Å²	68.2	10%	0.098	35%	0.353	C	S	.	.			trans	-69.2	124.2	177.8	-177.7	-99.2	0	0	0	111.1	L56 E59 S60 R63 I200 V202 P207 G212	L56-Y210 HydrophobicContact CB-CD1 4.32Å; L56-Y210 HydrophobicContact CD2-CD1 4.12Å; E59-Y210 HydrophobicContact CG-CE1 4.32Å; S60-Y210 WeakPolarHBondContact CA-OH 3.27Å; R63-Y210 WeakPolarHBondContact CD-OH 3.3Å; I200-Y210 WeakPolarHBondContact O-CE2 3.37Å; I200-Y210 PolarHBondContact O-OH 3.19Å; V202-Y210 HydrophobicContact CB-CD2 4.44Å; V202-Y210 HydrophobicContact CG2-CD1 4.34Å; V202-Y210 HydrophobicContact CG2-CD2 4Å; V202-Y210 HydrophobicContact CG2-CE2 4.39Å; V202-Y210 HydrophobicContact CG2-CG 3.95Å; P207-Y210 PolarHBondContact O-N 2.98Å; Y210-G212 VanDerWaalsContact CE2-O 3.31Å; Y210-G212 WeakPolarHBondContact CE2-O 3.22Å
211	D	92.6	Very high	93.8	Very high	153 Å²	153	68 Å²	68	82%	0.818	35%	0.353	S	S	*	.			trans	-128.7	19.4	177.8	-162.7	25.5	0	0	0	112.6	M209	M209-D211 PolarHBondContact O-N 2.84Å
212	G	92.6	Very high	94	Very high	6 Å²	6	66.6 Å²	66.6	6%	0.062	35%	0.353	C	S	.	.	S	Bend	trans	111.8	-159.9	-177.5	0	0	0	0	0	113.7	Y210 E214	Y210-G212 VanDerWaalsContact CE2-O 3.31Å; Y210-G212 WeakPolarHBondContact CE2-O 3.22Å; G212-E214 PolarHBondContact O-N 3.39Å
213	P	91.9	Very high	94.2	Very high	59 Å²	59	66.3 Å²	66.3	38%	0.383	35%	0.351	S	S	.	.			trans	-65.5	121.9	-179	-19.7	34.6	0	0	0	111.5	L198 K199 I200	L198-P213 HydrophobicContact CB-CB 4.47Å; K199-P213 WeakPolarHBondContact O-CA 3.34Å; I200-P213 HydrophobicContact CG1-CB 4.19Å; I200-P213 HydrophobicContact CG1-CG 4.38Å
214	E	91.1	Very high	94.4	Very high	107 Å²	107	68 Å²	68	50%	0.5	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	133.9	-178.4	-178.3	-173	-176.8	0	0	110.6	L198 K199 G212 V216	L198-E214 CarbonylContact C-O 3.52Å; L198-E214 VanDerWaalsContact CA-O 3.26Å; L198-E214 WeakPolarHBondContact CA-O 3.27Å; K199-E214 HydrophobicContact CB-CB 4.46Å; K199-E214 PolarHBondContact N-O 2.97Å; K199-E214 PolarHBondContact O-N 2.9Å; G212-E214 PolarHBondContact O-N 3.39Å; E214-V216 HydrophobicContact CB-CG1 4.47Å; E214-V216 HydrophobicContact CG-CG1 4.15Å; E214-V216 PolarHBondContact O-N 2.81Å
215	L	91.8	Very high	94.7	Very high	39 Å²	39	65 Å²	65	20%	0.204	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	109	170.5	177.9	65.5	0	0	0	109.6	Y196 L198 G217 F285	Y196-L215 HydrophobicContact CD1-CD1 3.71Å; L198-L215 HydrophobicContact CD2-CD1 4.3Å; L215-G217 VanDerWaalsContact CD1-O 3.27Å; L215-G217 WeakPolarHBondContact CD1-O 3.16Å; L215-F285 HydrophobicContact CD1-CD2 4.16Å; L215-F285 HydrophobicContact CD1-CE2 4.28Å; L215-F285 HydrophobicContact CD2-CB 4.2Å; L215-F285 HydrophobicContact CD2-CD2 4.06Å; L215-F285 HydrophobicContact CD2-CG 4.26Å
216	V	92.7	Very high	94.9	Very high	36 Å²	36	60.2 Å²	60.2	22%	0.218	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	-6.9	-179	-65.5	0	0	0	0	113.6	L197 K199 E214 P269	L197-V216 HydrophobicContact CB-CG2 4.04Å; L197-V216 WeakPolarHBondContact O-CG2 3.47Å; L197-V216 PolarHBondContact O-N 3.29Å; K199-V216 HydrophobicContact CB-CB 4.48Å; K199-V216 HydrophobicContact CB-CG1 3.5Å; K199-V216 HydrophobicContact CB-CG2 4.14Å; K199-V216 HydrophobicContact CD-CG1 4.11Å; K199-V216 HydrophobicContact CG-CG1 4.48Å; E214-V216 HydrophobicContact CB-CG1 4.47Å; E214-V216 HydrophobicContact CG-CG1 4.15Å; E214-V216 PolarHBondContact O-N 2.81Å; V216-P269 WeakPolarHBondContact O-CA 3.43Å
217	G	94.1	Very high	95.1	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.7	153.6	175.8	0	0	0	0	0	112	L197 L215 L267	L197-G217 PolarHBondContact N-O 3.31Å; L197-G217 PolarHBondContact O-N 2.92Å; L215-G217 VanDerWaalsContact CD1-O 3.27Å; L215-G217 WeakPolarHBondContact CD1-O 3.16Å; G217-L267 CarbonylContact C-O 3.57Å; G217-L267 WeakPolarHBondContact CA-O 3.44Å
218	R	95.8	Very high	94.9	Very high	5 Å²	5	64.3 Å²	64.3	2%	0.019	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	141.2	175.5	56.9	126.8	-73	-166.7	-5.5	111.1	E195 Y196 D262 I265 D266 L267 L281	E195-R218 CarbonylContact O-C 3.54Å; E195-R218 VanDerWaalsContact O-CA 3.23Å; E195-R218 WeakPolarHBondContact O-CA 3.49Å; Y196-R218 HydrophobicContact CD1-CB 3.95Å; Y196-R218 HydrophobicContact CE1-CB 4.06Å; R218-D262 PolarHBondContact NH2-O 3.43Å; R218-I265 VanDerWaalsContact CZ-C 3.5Å; R218-I265 PolarHBondContact NE-O 2.77Å; R218-I265 PolarHBondContact NH1-O 3.28Å; R218-D266 IonicContact CZ-OD1 3.43Å; R218-D266 IonicContact NE-OD1 2.79Å; R218-D266 IonicContact NH2-OD1 2.69Å; R218-D266 PolarHBondContact NH2-OD1 3.14Å; R218-D266 WeakPolarHBondContact O-CA 3.49Å; R218-L267 HydrophobicContact CG-CB 3.96Å; R218-L267 PolarHBondContact N-O 3.03Å; R218-L267 PolarHBondContact O-N 2.69Å; R218-L281 HydrophobicContact CG-CD2 3.5Å; R218-L281 VanDerWaalsContact CG-CD2 3.5Å
219	K	96.9	Very high	95	Very high	119 Å²	119	63.8 Å²	63.8	52%	0.517	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	118.3	-175.9	-174.7	-176.4	177.5	-174.8	0	111.6	K194 E195 D266	K194-K219 WeakPolarHBondContact CA-O 3.13Å; E195-K219 HydrophobicContact CB-CB 4.19Å; E195-K219 PolarHBondContact N-O 2.94Å; E195-K219 PolarHBondContact O-N 3.05Å; K219-D266 VanDerWaalsContact CA-OD1 3.29Å; K219-D266 WeakPolarHBondContact CA-OD1 3.49Å
220	G	96.9	Very high	95.1	Very high	6 Å²	6	58.2 Å²	58.2	6%	0.062	33%	0.327	C	S	.	.			trans	-77.6	-166.1	172.5	0	0	0	0	0	112.7	T193 F261 D266	T193-G220 CarbonylContact O-C 3.43Å; G220-F261 CarbonylContact C-O 3.59Å; G220-F261 VanDerWaalsContact CA-O 3.29Å; G220-F261 WeakPolarHBondContact CA-O 3.4Å; G220-D266 PolarHBondContact N-OD1 2.67Å
221	C	96.9	Very high	95.3	Very high	17 Å²	17	58 Å²	58	12%	0.115	33%	0.327	C	S	.	.			trans	-137.7	142.5	173.2	73.9	0	0	0	0	110.8	T193 I223 F261	T193-C221 PolarHBondContact N-SG 3.22Å; T193-C221 WeakPolarHBondContact O-CB 3.36Å; T193-C221 PolarHBondContact O-SG 3.39Å; C221-I223 PolarHBondContact O-N 3.22Å; C221-F261 PolarHBondContact N-O 3.23Å
222	V	97.7	Very high	95.4	Very high	97 Å²	97	51.7 Å²	51.7	59%	0.588	29%	0.294	S	S	*	.			trans	-66.6	119.9	173.1	179.3	0	0	0	0	109	N189 P263	N189-V222 PolarHBondContact ND2-O 2.91Å; V222-P263 HydrophobicContact CG2-CG 3.9Å
223	I	98.3	Very high	95.5	Very high	19 Å²	19	53 Å²	53	10%	0.097	30%	0.301	C	S	.	.			trans	-84.7	119.9	171.3	-54.9	175.8	0	0	0	108.7	F187 L192 C221 W225 F258 F261	F187-I223 HydrophobicContact CB-CG2 3.61Å; F187-I223 HydrophobicContact CD1-CG2 3.85Å; F187-I223 HydrophobicContact CG-CG2 3.82Å; L192-I223 HydrophobicContact CD1-CD1 4.04Å; L192-I223 HydrophobicContact CD1-CG1 4.17Å; L192-I223 HydrophobicContact CD2-CG1 3.93Å; L192-I223 HydrophobicContact CD2-CG2 4.47Å; C221-I223 PolarHBondContact O-N 3.22Å; I223-W225 HydrophobicContact CB-CD2 4.34Å; I223-W225 HydrophobicContact CB-CZ2 4.18Å; I223-W225 HydrophobicContact CD1-CH2 4.34Å; I223-W225 HydrophobicContact CD1-CZ2 3.62Å; I223-W225 HydrophobicContact CG2-CD2 3.64Å; I223-W225 VanDerWaalsContact CG2-CE2 3.47Å; I223-W225 HydrophobicContact CG2-CE3 4.11Å; I223-W225 HydrophobicContact CG2-CG 4.04Å; I223-W225 HydrophobicContact CG2-CH2 4.28Å; I223-W225 HydrophobicContact CG2-CZ2 3.81Å; I223-W225 HydrophobicContact CG2-CZ3 4.42Å; I223-W225 PolarHBondContact O-N 3.15Å; I223-F258 HydrophobicContact CD1-CB 3.83Å; I223-F258 HydrophobicContact CD1-CD1 3.93Å; I223-F258 HydrophobicContact CD1-CG 4.3Å; I223-F261 HydrophobicContact CD1-CB 4.09Å; I223-F261 HydrophobicContact CD1-CD2 4.08Å; I223-F261 HydrophobicContact CD1-CG 4.44Å; I223-F261 HydrophobicContact CG1-CB 4.3Å
224	D	98.1	Very high	95.3	Very high	84 Å²	84	58.1 Å²	58.1	45%	0.449	31%	0.313	S	S	.	.			trans	-78.9	69.3	177.1	-63.6	-39.2	0	0	0	110.2	F187 T188 N189 K226	F187-D224 VanDerWaalsContact CA-O 3.23Å; F187-D224 WeakPolarHBondContact CA-O 3.4Å; F187-D224 WeakPolarHBondContact CB-O 3.35Å; T188-D224 PolarHBondContact N-O 3.35Å; T188-D224 VanDerWaalsContact N-O 3.07Å; T188-D224 WeakPolarHBondContact OG1-CB 3.38Å; N189-D224 WeakPolarHBondContact OD1-CA 3.41Å; N189-D224 WeakPolarHBondContact OD1-CB 3.13Å; N189-D224 PolarHBondContact OD1-N 3.48Å; D224-K226 PolarHBondContact O-N 3.41Å
225	W	98.1	Very high	94.7	Very high	55 Å²	55	56.5 Å²	56.5	21%	0.208	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-58.5	132.3	-179.6	-64.6	105.8	0	0	0	112.1	F187 I223 K229 N230 L231 T232 F258	F187-W225 HydrophobicContact CB-CE3 4.42Å; F187-W225 HydrophobicContact CD1-CE3 4.18Å; F187-W225 HydrophobicContact CD1-CH2 4.4Å; F187-W225 AromaticContact CD1-CZ3 3.87Å; F187-W225 HydrophobicContact CD1-CZ3 3.87Å; I223-W225 HydrophobicContact CB-CD2 4.34Å; I223-W225 HydrophobicContact CB-CZ2 4.18Å; I223-W225 HydrophobicContact CD1-CH2 4.34Å; I223-W225 HydrophobicContact CD1-CZ2 3.62Å; I223-W225 HydrophobicContact CG2-CD2 3.64Å; I223-W225 VanDerWaalsContact CG2-CE2 3.47Å; I223-W225 HydrophobicContact CG2-CE3 4.11Å; I223-W225 HydrophobicContact CG2-CG 4.04Å; I223-W225 HydrophobicContact CG2-CH2 4.28Å; I223-W225 HydrophobicContact CG2-CZ2 3.81Å; I223-W225 HydrophobicContact CG2-CZ3 4.42Å; I223-W225 PolarHBondContact O-N 3.15Å; W225-K229 WeakPolarHBondContact CZ3-O 3.42Å; W225-N230 HydrophobicContact CB-CB 3.99Å; W225-N230 HydrophobicContact CD2-CB 3.93Å; W225-N230 HydrophobicContact CE3-CB 4.46Å; W225-N230 HydrophobicContact CG-CB 3.69Å; W225-N230 PolarHBondContact NE1-OD1 3.34Å; W225-L231 HydrophobicContact CH2-CB 3.76Å; W225-L231 HydrophobicContact CH2-CD1 4.17Å; W225-L231 HydrophobicContact CH2-CG 3.96Å; W225-L231 HydrophobicContact CZ3-CB 4.07Å; W225-L231 HydrophobicContact CZ3-CD1 4.1Å; W225-L231 HydrophobicContact CZ3-CG 3.79Å; W225-T232 HydrophobicContact CZ2-CG2 3.94Å; W225-F258 HydrophobicContact CH2-CB 3.83Å; W225-F258 HydrophobicContact CH2-CD1 4.19Å; W225-F258 AromaticContact CH2-CD2 3.93Å; W225-F258 HydrophobicContact CH2-CD2 3.93Å; W225-F258 AromaticContact CH2-CG 3.71Å; W225-F258 HydrophobicContact CH2-CG 3.71Å; W225-F258 HydrophobicContact CZ2-CB 3.81Å; W225-F258 HydrophobicContact CZ2-CG 4.17Å
226	K	97.7	Very high	93.8	Very high	75 Å²	75	57.4 Å²	57.4	33%	0.326	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-68.8	154.8	169.4	-66.7	-177.6	-177.8	177.5	0	110.2	N184 E185 Y186 F187 T188 D224 G228 K229	N184-K226 PolarHBondContact O-NZ 3.49Å; E185-K226 WeakPolarHBondContact O-CD 3.37Å; Y186-K226 WeakPolarHBondContact O-CB 3.31Å; Y186-K226 PolarHBondContact O-N 3.39Å; F187-K226 WeakPolarHBondContact O-CE 3.34Å; T188-K226 HydrophobicContact CG2-CG 4.33Å; D224-K226 PolarHBondContact O-N 3.41Å; K226-G228 PolarHBondContact O-N 2.87Å; K226-G228 VanDerWaalsContact O-N 3.15Å; K226-K229 HydrophobicContact CB-CB 4.3Å; K226-K229 HydrophobicContact CB-CG 4.29Å; K226-K229 WeakPolarHBondContact O-CB 3.26Å; K226-K229 PolarHBondContact O-N 3.3Å
227	P	95.2	Very high	92.3	Very high	130 Å²	130	63.2 Å²	63.2	84%	0.844	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	121.9	-176.2	-28.2	35.7	0	0	0	113.3	K229	P227-K229 PolarHBondContact O-N 2.79Å
228	G	92.8	Very high	90.6	Very high	81 Å²	81	70.7 Å²	70.7	84%	0.835	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	8.2	177.5	0	0	0	0	0	115.4	K226	K226-G228 PolarHBondContact O-N 2.87Å; K226-G228 VanDerWaalsContact O-N 3.15Å
229	K	96.6	Very high	88.5	Confident	67 Å²	67	82.4 Å²	82.4	29%	0.291	41%	0.414	S	S	.	.			trans	-109.8	7.5	-177.1	-63.5	-77.8	-165.1	161.9	0	113.7	E185 Y186 W225 K226 P227 L231	E185-K229 WeakPolarHBondContact O-CG 3.34Å; E185-K229 IonicContact OE2-NZ 2.78Å; E185-K229 PolarHBondContact OE2-NZ 3.23Å; Y186-K229 HydrophobicContact CD1-CB 4.21Å; Y186-K229 HydrophobicContact CD1-CD 4.29Å; Y186-K229 HydrophobicContact CE1-CD 4.39Å; W225-K229 WeakPolarHBondContact CZ3-O 3.42Å; K226-K229 HydrophobicContact CB-CB 4.3Å; K226-K229 HydrophobicContact CB-CG 4.29Å; K226-K229 WeakPolarHBondContact O-CB 3.26Å; K226-K229 PolarHBondContact O-N 3.3Å; P227-K229 PolarHBondContact O-N 2.79Å; K229-L231 PolarHBondContact O-N 3.5Å
230	N	96.2	Very high	86.3	Confident	43 Å²	43	85 Å²	85	23%	0.23	43%	0.425	C	S	.	.			trans	-66.4	114.2	174.6	-173.4	-15	0	0	0	110.2	W225 T232 V233	W225-N230 HydrophobicContact CB-CB 3.99Å; W225-N230 HydrophobicContact CD2-CB 3.93Å; W225-N230 HydrophobicContact CE3-CB 4.46Å; W225-N230 HydrophobicContact CG-CB 3.69Å; W225-N230 PolarHBondContact NE1-OD1 3.34Å; N230-T232 PolarHBondContact OD1-N 3.1Å; N230-T232 PolarHBondContact OD1-OG1 3.48Å; N230-V233 HydrophobicContact CB-CG2 3.79Å; N230-V233 VanDerWaalsContact CG-CG2 3.49Å
231	L	96.8	Very high	84.1	Confident	19 Å²	19	93.4 Å²	93.4	10%	0.099	46%	0.463	C	S	.	.	S	Bend	trans	-81.9	-19.5	-176.9	-63.2	179.8	0	0	0	113.3	K155 A159 Y186 W225 K229 V233 V254 F258	K155-L231 HydrophobicContact CB-CD2 4.15Å; A159-L231 HydrophobicContact CB-CD1 3.9Å; Y186-L231 HydrophobicContact CD1-CD1 3.84Å; Y186-L231 HydrophobicContact CD1-CD2 3.96Å; Y186-L231 HydrophobicContact CD1-CG 3.94Å; Y186-L231 HydrophobicContact CE1-CD1 4.11Å; Y186-L231 HydrophobicContact CE1-CD2 3.81Å; Y186-L231 HydrophobicContact CE1-CG 4.26Å; W225-L231 HydrophobicContact CH2-CB 3.76Å; W225-L231 HydrophobicContact CH2-CD1 4.17Å; W225-L231 HydrophobicContact CH2-CG 3.96Å; W225-L231 HydrophobicContact CZ3-CB 4.07Å; W225-L231 HydrophobicContact CZ3-CD1 4.1Å; W225-L231 HydrophobicContact CZ3-CG 3.79Å; K229-L231 PolarHBondContact O-N 3.5Å; L231-V233 VanDerWaalsContact C-N 3.31Å; L231-V233 PolarHBondContact O-N 3.44Å; L231-V254 VanDerWaalsContact O-CG2 3.26Å; L231-V254 WeakPolarHBondContact O-CG2 3.27Å; L231-F258 HydrophobicContact CB-CD2 4.33Å; L231-F258 HydrophobicContact CD1-CD2 3.77Å; L231-F258 HydrophobicContact CD1-CE2 3.6Å
232	T	96.4	Very high	81.7	Confident	22 Å²	22	103.3 Å²	103.3	14%	0.135	50%	0.504	C	S	.	.	S	Bend	trans	-84.7	-4.5	-176.6	68.7	0	0	0	0	113.7	W225 N230 P253 V254 F258 N259	W225-T232 HydrophobicContact CZ2-CG2 3.94Å; N230-T232 PolarHBondContact OD1-N 3.1Å; N230-T232 PolarHBondContact OD1-OG1 3.48Å; T232-P253 CarbonylContact O-C 3.3Å; T232-P253 WeakPolarHBondContact O-CA 3.29Å; T232-V254 PolarHBondContact O-N 2.97Å; T232-F258 HydrophobicContact CG2-CB 3.88Å; T232-N259 WeakPolarHBondContact CB-OD1 3.15Å; T232-N259 VanDerWaalsContact CG2-OD1 3.24Å; T232-N259 WeakPolarHBondContact CG2-OD1 3.35Å
233	V	93.7	Very high	79.3	Confident	34 Å²	34	103 Å²	103	21%	0.206	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	145.1	-175.1	-62	0	0	0	0	113	N230 L231 M251 H252	N230-V233 HydrophobicContact CB-CG2 3.79Å; N230-V233 VanDerWaalsContact CG-CG2 3.49Å; L231-V233 VanDerWaalsContact C-N 3.31Å; L231-V233 PolarHBondContact O-N 3.44Å; V233-M251 HydrophobicContact CB-CB 4.31Å; V233-M251 HydrophobicContact CB-CE 4.03Å; V233-M251 HydrophobicContact CG1-CB 4.48Å; V233-M251 HydrophobicContact CG1-CE 4.11Å; V233-M251 HydrophobicContact CG2-CE 3.4Å; V233-H252 CarbonylContact C-O 3.55Å; V233-H252 WeakPolarHBondContact CA-O 3.15Å
234	R	88.5	Confident	76.9	Confident	165 Å²	165	110.6 Å²	110.6	62%	0.623	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.5	128.4	168.9	-174.9	178.6	-179	-178.8	1.9	110.5	V236 H252 V254	R234-V236 PolarHBondContact O-N 2.95Å; R234-H252 PolarHBondContact N-O 2.84Å; R234-H252 PolarHBondContact O-N 3.35Å; R234-V254 HydrophobicContact CB-CG1 3.69Å
235	N	78.4	Confident	74.6	Confident	73 Å²	73	118 Å²	118	39%	0.39	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.8	118	170.3	-71.7	-38.7	0	0	0	110.3	F237 P249 M251	N235-F237 HydrophobicContact CB-CE2 4.18Å; N235-F237 HydrophobicContact CB-CZ 4.32Å; N235-P249 HydrophobicContact CB-CB 4.19Å; N235-M251 WeakPolarHBondContact OD1-CG 3.36Å
236	V	71.2	Confident	72.4	Confident	58 Å²	58	120 Å²	120	35%	0.352	59%	0.591	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.9	110.9	171.1	-179.2	0	0	0	0	109.1	R234 K238 N250 H252	R234-V236 PolarHBondContact O-N 2.95Å; V236-K238 PolarHBondContact O-N 3.37Å; V236-N250 PolarHBondContact N-O 3.28Å; V236-H252 VanDerWaalsContact CG2-CD2 3.44Å; V236-H252 WeakPolarHBondContact CG2-CD2 3.33Å
237	F	62.8	Low	69.8	Low	158 Å²	158	120.9 Å²	120.9	69%	0.693	61%	0.606	S	S	*	*			trans	-84.7	107.3	172.4	-59.5	-80.2	0	0	0	109.3	N235 R239 P249	N235-F237 HydrophobicContact CB-CE2 4.18Å; N235-F237 HydrophobicContact CB-CZ 4.32Å; F237-R239 PolarHBondContact O-N 3.03Å; F237-P249 HydrophobicContact CD1-CB 4.3Å; F237-P249 HydrophobicContact CE1-CB 4.04Å
238	K	58.2	Low	67.9	Low	157 Å²	157	125.4 Å²	125.4	68%	0.683	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-64.8	126.9	167.6	-70.8	-171.5	179.1	-179.6	0	109	V236 K240	V236-K238 PolarHBondContact O-N 3.37Å; K238-K240 PolarHBondContact O-N 3.41Å
239	R	52.2	Low	66.2	Low	251 Å²	251	124 Å²	124	95%	0.947	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-56.7	123.3	172.7	-89.3	-178	163.2	172.9	-3.7	109	F237 Q241	F237-R239 PolarHBondContact O-N 3.03Å; R239-Q241 PolarHBondContact O-N 3.4Å
240	K	50.6	Low	64.7	Low	173 Å²	173	124.8 Å²	124.8	75%	0.752	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-57.7	122.5	-179.6	-72.8	179.6	174.8	174.7	0	111.2	K238	K238-K240 PolarHBondContact O-N 3.41Å
241	Q	50	Low	63.8	Low	183 Å²	183	127.9 Å²	127.9	86%	0.855	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-70	146.3	147.4	-89.1	-176.8	-17.8	0	0	108.7	R239 S243	R239-Q241 PolarHBondContact O-N 3.4Å; Q241-S243 PolarHBondContact O-N 3Å
242	K	45.7	Very low	63.3	Low	225 Å²	225	131.1 Å²	131.1	98%	0.978	62%	0.618	S	S	*	*	S	Bend	trans	-62.4	18.5	-161	-107.6	177.2	178.7	176.9	0	117.8
243	S	47.9	Very low	63	Low	90 Å²	90	135.3 Å²	135.3	63%	0.629	65%	0.646	S	S	*	*	S	Bend	trans	-152	124.1	-171.9	154.4	0	0	0	0	111.6	Q241	Q241-S243 PolarHBondContact O-N 3Å
244	Q	48.4	Very low	63	Low	180 Å²	180	135.6 Å²	135.6	84%	0.841	65%	0.648	S	S	*	*	S	Bend	trans	82.5	122.8	162.7	-65	179.3	-13.6	0	0	120.4
245	R	50.1	Low	63.4	Low	239 Å²	239	131.5 Å²	131.5	90%	0.902	65%	0.649	S	S	*	*	S	Bend	trans	50.1	143	157	-78.2	177.6	174.1	169.1	-2.4	119.2	C247	R245-C247 PolarHBondContact O-N 3.45Å
246	A	50.2	Low	64.3	Low	97 Å²	97	128.4 Å²	128.4	80%	0.802	63%	0.633	S	S	*	*			trans	-51.6	108.7	-179.5	0	0	0	0	0	111.1	R248	A246-R248 PolarHBondContact O-N 3.41Å
247	C	44.6	Very low	65.5	Low	93 Å²	93	125.8 Å²	125.8	63%	0.628	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-69.5	119.3	170.3	-80	0	0	0	0	108.1	R245	R245-C247 PolarHBondContact O-N 3.45Å
248	R	54.1	Low	67.2	Low	225 Å²	225	118.3 Å²	118.3	85%	0.849	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-62.3	137.9	163.8	-65.9	-178.6	178.1	-172.8	-1.8	107.7	A246 N250	A246-R248 PolarHBondContact O-N 3.41Å; R248-N250 PolarHBondContact O-N 3.25Å
249	P	57.5	Low	69	Low	53 Å²	53	113.2 Å²	113.2	34%	0.344	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-60.1	133.6	173.3	24.9	-31.1	0	0	0	108.8	N235 F237 M251	N235-P249 HydrophobicContact CB-CB 4.19Å; F237-P249 HydrophobicContact CD1-CB 4.3Å; F237-P249 HydrophobicContact CE1-CB 4.04Å; P249-M251 PolarHBondContact O-N 3.4Å
250	N	65.8	Low	71.2	Confident	82 Å²	82	102 Å²	102	44%	0.439	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	121.5	166.3	-79.8	10	0	0	0	106.8	V236 R248	V236-N250 PolarHBondContact N-O 3.28Å; R248-N250 PolarHBondContact O-N 3.25Å
251	M	77.7	Confident	73.4	Confident	109 Å²	109	93.8 Å²	93.8	54%	0.537	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	121.7	174.6	-65.9	169.5	72.7	0	0	107.2	V233 N235 P249	V233-M251 HydrophobicContact CB-CB 4.31Å; V233-M251 HydrophobicContact CB-CE 4.03Å; V233-M251 HydrophobicContact CG1-CB 4.48Å; V233-M251 HydrophobicContact CG1-CE 4.11Å; V233-M251 HydrophobicContact CG2-CE 3.4Å; N235-M251 WeakPolarHBondContact OD1-CG 3.36Å; P249-M251 PolarHBondContact O-N 3.4Å
252	H	85	Confident	75.5	Confident	87 Å²	87	87.8 Å²	87.8	40%	0.403	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	129.2	175.7	-69.5	-87.4	0	0	0	108.5	V233 R234 V236	V233-H252 CarbonylContact C-O 3.55Å; V233-H252 WeakPolarHBondContact CA-O 3.15Å; R234-H252 PolarHBondContact N-O 2.84Å; R234-H252 PolarHBondContact O-N 3.35Å; V236-H252 VanDerWaalsContact CG2-CD2 3.44Å; V236-H252 WeakPolarHBondContact CG2-CD2 3.33Å
253	P	90.4	Very high	77.8	Confident	110 Å²	110	79.3 Å²	79.3	71%	0.714	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.9	143.9	172	-24.6	34.2	0	0	0	111.2	T232	T232-P253 CarbonylContact O-C 3.3Å; T232-P253 WeakPolarHBondContact O-CA 3.29Å
254	V	94.4	Very high	79.8	Confident	40 Å²	40	79.5 Å²	79.5	24%	0.242	43%	0.43	C	S	.	.			trans	-132.5	155.9	173.4	-64.9	0	0	0	0	109.6	L231 T232 R234 S256 N259	L231-V254 VanDerWaalsContact O-CG2 3.26Å; L231-V254 WeakPolarHBondContact O-CG2 3.27Å; T232-V254 PolarHBondContact O-N 2.97Å; R234-V254 HydrophobicContact CB-CG1 3.69Å; V254-S256 PolarHBondContact O-N 3.12Å; V254-N259 PolarHBondContact O-ND2 3.38Å
255	A	95.3	Very high	81.6	Confident	78 Å²	78	73.1 Å²	73.1	65%	0.645	40%	0.401	S	S	*	.			trans	-57.8	132.9	171.9	0	0	0	0	0	109.9	T153	T153-A255 HydrophobicContact CG2-CB 4.31Å; T153-A255 WeakPolarHBondContact CG2-O 3.33Å
256	S	97.3	Very high	83.7	Confident	8 Å²	8	63.7 Å²	63.7	6%	0.056	37%	0.369	C	S	.	.			trans	-168.1	140.8	179	171.5	0	0	0	0	107.5	T151 D156 V254 F258 N259	T151-S256 CarbonylContact O-C 3.45Å; D156-S256 PolarHBondContact OD1-OG 3.21Å; D156-S256 WeakPolarHBondContact OD2-CA 3.49Å; V254-S256 PolarHBondContact O-N 3.12Å; S256-F258 PolarHBondContact O-N 2.88Å; S256-F258 VanDerWaalsContact O-N 3.12Å; S256-F258 PolarHBondContact OG-N 3.37Å; S256-N259 PolarHBondContact N-ND2 3.46Å; S256-N259 WeakPolarHBondContact O-CB 3.47Å; S256-N259 PolarHBondContact O-N 2.96Å; S256-N259 PolarHBondContact O-ND2 3.15Å
257	F	97.9	Very high	85.7	Confident	3 Å²	3	59.7 Å²	59.7	1%	0.013	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-51.3	-36	172	171.4	-98.1	0	0	0	111.4	T151 I152 D156 L160 F179 N259 F260 F261	T151-F257 VanDerWaalsContact O-CA 3.23Å; T151-F257 WeakPolarHBondContact O-CA 3.31Å; T151-F257 PolarHBondContact O-N 2.97Å; T151-F257 WeakPolarHBondContact OG1-CD2 3.41Å; I152-F257 HydrophobicContact CG1-CB 4.11Å; I152-F257 HydrophobicContact CG1-CD2 3.92Å; I152-F257 HydrophobicContact CG1-CG 4.24Å; D156-F257 HydrophobicContact CB-CB 4.29Å; D156-F257 PolarHBondContact OD2-N 3.24Å; L160-F257 HydrophobicContact CD1-CD1 4.38Å; L160-F257 HydrophobicContact CD1-CG 4.43Å; L160-F257 HydrophobicContact CD2-CD1 3.88Å; L160-F257 HydrophobicContact CD2-CE1 3.86Å; F179-F257 HydrophobicContact CD1-CZ 4.49Å; F179-F257 HydrophobicContact CE1-CE1 4.46Å; F179-F257 AromaticContact CE1-CZ 3.81Å; F179-F257 HydrophobicContact CE1-CZ 3.81Å; F179-F257 HydrophobicContact CZ-CZ 4.23Å; F257-N259 PolarHBondContact O-N 3.47Å; F257-N259 VanDerWaalsContact O-N 3.12Å; F257-F260 WeakPolarHBondContact O-CB 3.38Å; F257-F260 PolarHBondContact O-N 2.93Å; F257-F261 HydrophobicContact CD1-CE2 4.39Å; F257-F261 AromaticContact CE1-CE2 3.8Å; F257-F261 HydrophobicContact CE1-CE2 3.8Å; F257-F261 HydrophobicContact CE1-CZ 4.23Å; F257-F261 HydrophobicContact CZ-CE2 4.47Å
258	F	98	Very high	88	Confident	1 Å²	1	60.9 Å²	60.9	0%	0.004	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-70.3	-9	-176.1	-64.1	-79.7	0	0	0	114.3	D156 A159 L160 F181 F187 L192 I223 W225 L231 T232 S256 F260 F261	D156-F258 HydrophobicContact CB-CD2 4.34Å; D156-F258 HydrophobicContact CB-CE2 3.93Å; D156-F258 WeakPolarHBondContact OD1-CD2 3.39Å; A159-F258 HydrophobicContact CB-CE2 3.75Å; A159-F258 HydrophobicContact CB-CZ 3.56Å; L160-F258 HydrophobicContact CD2-CZ 4.2Å; L160-F258 HydrophobicContact CG-CZ 4.22Å; F181-F258 HydrophobicContact CZ-CE1 4.07Å; F187-F258 HydrophobicContact CE1-CD1 4.36Å; F187-F258 AromaticContact CE1-CE1 3.66Å; F187-F258 HydrophobicContact CE1-CE1 3.66Å; F187-F258 HydrophobicContact CE1-CZ 4.02Å; F187-F258 HydrophobicContact CZ-CE1 4.14Å; L192-F258 HydrophobicContact CD1-CD1 3.93Å; L192-F258 HydrophobicContact CD1-CE1 3.98Å; I223-F258 HydrophobicContact CD1-CB 3.83Å; I223-F258 HydrophobicContact CD1-CD1 3.93Å; I223-F258 HydrophobicContact CD1-CG 4.3Å; W225-F258 HydrophobicContact CH2-CB 3.83Å; W225-F258 HydrophobicContact CH2-CD1 4.19Å; W225-F258 AromaticContact CH2-CD2 3.93Å; W225-F258 HydrophobicContact CH2-CD2 3.93Å; W225-F258 AromaticContact CH2-CG 3.71Å; W225-F258 HydrophobicContact CH2-CG 3.71Å; W225-F258 HydrophobicContact CZ2-CB 3.81Å; W225-F258 HydrophobicContact CZ2-CG 4.17Å; L231-F258 HydrophobicContact CB-CD2 4.33Å; L231-F258 HydrophobicContact CD1-CD2 3.77Å; L231-F258 HydrophobicContact CD1-CE2 3.6Å; T232-F258 HydrophobicContact CG2-CB 3.88Å; S256-F258 PolarHBondContact O-N 2.88Å; S256-F258 VanDerWaalsContact O-N 3.12Å; S256-F258 PolarHBondContact OG-N 3.37Å; F258-F260 PolarHBondContact O-N 2.94Å; F258-F261 HydrophobicContact CD1-CD2 4.25Å; F258-F261 HydrophobicContact CD1-CE2 4.19Å; F258-F261 PolarHBondContact O-N 3.24Å
259	N	96.5	Very high	89.6	Confident	51 Å²	51	54.3 Å²	54.3	27%	0.273	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-62.7	-24	167.4	-69.9	-32.9	0	0	0	111.9	T232 V254 S256 F257 F261 D262	T232-N259 WeakPolarHBondContact CB-OD1 3.15Å; T232-N259 VanDerWaalsContact CG2-OD1 3.24Å; T232-N259 WeakPolarHBondContact CG2-OD1 3.35Å; V254-N259 PolarHBondContact O-ND2 3.38Å; S256-N259 PolarHBondContact N-ND2 3.46Å; S256-N259 WeakPolarHBondContact O-CB 3.47Å; S256-N259 PolarHBondContact O-N 2.96Å; S256-N259 PolarHBondContact O-ND2 3.15Å; F257-N259 PolarHBondContact O-N 3.47Å; F257-N259 VanDerWaalsContact O-N 3.12Å; N259-F261 PolarHBondContact O-N 3.44Å; N259-D262 WeakPolarHBondContact O-CB 3.39Å; N259-D262 PolarHBondContact O-N 3.42Å
260	F	97.1	Very high	91	Very high	15 Å²	15	55.8 Å²	55.8	7%	0.066	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-54.7	-25.9	173.9	-175.8	-113.8	0	0	0	113.1	L177 F179 K194 Y196 F257 F258 D284 V287 A288 L291	L177-F260 HydrophobicContact CD1-CE1 4.12Å; L177-F260 HydrophobicContact CD1-CZ 3.92Å; F179-F260 HydrophobicContact CE2-CE1 4.13Å; F179-F260 HydrophobicContact CZ-CE1 4.17Å; K194-F260 HydrophobicContact CB-CE1 3.99Å; K194-F260 HydrophobicContact CB-CZ 4.44Å; K194-F260 WeakPolarHBondContact CD-O 3.26Å; K194-F260 WeakPolarHBondContact CE-O 3.41Å; K194-F260 HydrophobicContact CG-CE1 3.94Å; K194-F260 HydrophobicContact CG-CZ 3.97Å; K194-F260 PolarHBondContact NZ-O 2.87Å; Y196-F260 HydrophobicContact CE2-CZ 4.36Å; Y196-F260 WeakPolarHBondContact OH-CE2 3.43Å; Y196-F260 WeakPolarHBondContact OH-CZ 3.3Å; F257-F260 WeakPolarHBondContact O-CB 3.38Å; F257-F260 PolarHBondContact O-N 2.93Å; F258-F260 PolarHBondContact O-N 2.94Å; F260-D284 WeakPolarHBondContact CD2-OD1 3.29Å; F260-V287 HydrophobicContact CD2-CB 4.4Å; F260-V287 HydrophobicContact CD2-CG1 3.87Å; F260-V287 HydrophobicContact CE2-CB 4.06Å; F260-V287 HydrophobicContact CE2-CG1 3.66Å; F260-V287 HydrophobicContact CZ-CG1 4.22Å; F260-A288 HydrophobicContact CE2-CB 4.37Å; F260-A288 HydrophobicContact CZ-CB 4.11Å; F260-L291 HydrophobicContact CE1-CD1 4.26Å; F260-L291 HydrophobicContact CZ-CD1 4.25Å
261	F	97.7	Very high	92.1	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-96.6	-2.2	179.4	-56.3	-76.8	0	0	0	113.9	F179 L192 G220 C221 I223 F257 F258 N259 P263	F179-F261 HydrophobicContact CB-CZ 4.45Å; F179-F261 HydrophobicContact CD1-CZ 4.33Å; F179-F261 AromaticContact CD2-CE1 3.53Å; F179-F261 HydrophobicContact CD2-CE1 3.53Å; F179-F261 AromaticContact CD2-CZ 3.48Å; F179-F261 HydrophobicContact CD2-CZ 3.48Å; F179-F261 VanDerWaalsContact CD2-CZ 3.48Å; F179-F261 HydrophobicContact CE1-CZ 4.44Å; F179-F261 AromaticContact CE2-CE1 3.66Å; F179-F261 HydrophobicContact CE2-CE1 3.66Å; F179-F261 AromaticContact CE2-CZ 3.62Å; F179-F261 HydrophobicContact CE2-CZ 3.62Å; F179-F261 HydrophobicContact CG-CE1 4.32Å; F179-F261 AromaticContact CG-CZ 3.86Å; F179-F261 HydrophobicContact CG-CZ 3.86Å; F179-F261 HydrophobicContact CZ-CZ 4.09Å; L192-F261 HydrophobicContact CB-CD1 3.94Å; L192-F261 HydrophobicContact CB-CD2 4.49Å; L192-F261 HydrophobicContact CB-CE1 3.69Å; L192-F261 HydrophobicContact CB-CE2 4.27Å; L192-F261 HydrophobicContact CB-CG 4.33Å; L192-F261 HydrophobicContact CB-CZ 3.87Å; L192-F261 HydrophobicContact CD1-CD2 3.9Å; L192-F261 HydrophobicContact CD1-CE2 3.79Å; L192-F261 HydrophobicContact CD1-CG 4.4Å; L192-F261 HydrophobicContact CD1-CZ 4.19Å; G220-F261 CarbonylContact C-O 3.59Å; G220-F261 VanDerWaalsContact CA-O 3.29Å; G220-F261 WeakPolarHBondContact CA-O 3.4Å; C221-F261 PolarHBondContact N-O 3.23Å; I223-F261 HydrophobicContact CD1-CB 4.09Å; I223-F261 HydrophobicContact CD1-CD2 4.08Å; I223-F261 HydrophobicContact CD1-CG 4.44Å; I223-F261 HydrophobicContact CG1-CB 4.3Å; F257-F261 HydrophobicContact CD1-CE2 4.39Å; F257-F261 AromaticContact CE1-CE2 3.8Å; F257-F261 HydrophobicContact CE1-CE2 3.8Å; F257-F261 HydrophobicContact CE1-CZ 4.23Å; F257-F261 HydrophobicContact CZ-CE2 4.47Å; F258-F261 HydrophobicContact CD1-CD2 4.25Å; F258-F261 HydrophobicContact CD1-CE2 4.19Å; F258-F261 PolarHBondContact O-N 3.24Å; N259-F261 PolarHBondContact O-N 3.44Å; F261-P263 WeakPolarHBondContact O-CD 3.4Å; F261-P263 VanDerWaalsContact O-N 3.11Å
262	D	94.8	Very high	92.6	Very high	58 Å²	58	59.9 Å²	59.9	31%	0.31	36%	0.36	S	S	.	.			trans	-60.8	114.4	-170	-176.9	9.8	0	0	0	111.5	R218 N259 S264 I265	R218-D262 PolarHBondContact NH2-O 3.43Å; N259-D262 WeakPolarHBondContact O-CB 3.39Å; N259-D262 PolarHBondContact O-N 3.42Å; D262-S264 PolarHBondContact O-N 3.42Å; D262-S264 VanDerWaalsContact OD1-CB 3.3Å; D262-S264 WeakPolarHBondContact OD1-CB 3.43Å; D262-S264 PolarHBondContact OD1-N 3.48Å; D262-S264 PolarHBondContact OD1-OG 3.17Å; D262-S264 PolarHBondContact OD2-OG 3.07Å; D262-I265 HydrophobicContact CB-CG1 4.24Å; D262-I265 WeakPolarHBondContact O-CG1 3.3Å
263	P	93.6	Very high	92.7	Very high	47 Å²	47	56.8 Å²	56.8	31%	0.305	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-73.7	-8.2	179.5	31.4	-35.9	0	0	0	113.2	V222 F261 I265 D266	V222-P263 HydrophobicContact CG2-CG 3.9Å; F261-P263 WeakPolarHBondContact O-CD 3.4Å; F261-P263 VanDerWaalsContact O-N 3.11Å; P263-I265 PolarHBondContact O-N 3.4Å; P263-D266 WeakPolarHBondContact CA-OD1 3.48Å; P263-D266 WeakPolarHBondContact O-CB 3.47Å; P263-D266 PolarHBondContact O-N 2.99Å
264	S	89	Confident	92.7	Very high	93 Å²	93	55 Å²	55	65%	0.65	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-67.5	-19	179.5	84.4	0	0	0	0	113.8	D262	D262-S264 PolarHBondContact O-N 3.42Å; D262-S264 VanDerWaalsContact OD1-CB 3.3Å; D262-S264 WeakPolarHBondContact OD1-CB 3.43Å; D262-S264 PolarHBondContact OD1-N 3.48Å; D262-S264 PolarHBondContact OD1-OG 3.17Å; D262-S264 PolarHBondContact OD2-OG 3.07Å
265	I	87.3	Confident	92.4	Very high	47 Å²	47	59.6 Å²	59.6	24%	0.241	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-110.1	21.6	178.5	48.1	161.1	0	0	0	111.8	R218 D262 P263	R218-I265 VanDerWaalsContact CZ-C 3.5Å; R218-I265 PolarHBondContact NE-O 2.77Å; R218-I265 PolarHBondContact NH1-O 3.28Å; D262-I265 HydrophobicContact CB-CG1 4.24Å; D262-I265 WeakPolarHBondContact O-CG1 3.3Å; P263-I265 PolarHBondContact O-N 3.4Å
266	D	93.2	Very high	92.1	Very high	41 Å²	41	63.6 Å²	63.6	22%	0.219	37%	0.365	C	S	.	.			trans	-61.7	141.4	173.1	-76.3	-8.1	0	0	0	111.4	R218 K219 G220 P263	R218-D266 IonicContact CZ-OD1 3.43Å; R218-D266 IonicContact NE-OD1 2.79Å; R218-D266 IonicContact NH2-OD1 2.69Å; R218-D266 PolarHBondContact NH2-OD1 3.14Å; R218-D266 WeakPolarHBondContact O-CA 3.49Å; K219-D266 VanDerWaalsContact CA-OD1 3.29Å; K219-D266 WeakPolarHBondContact CA-OD1 3.49Å; G220-D266 PolarHBondContact N-OD1 2.67Å; P263-D266 WeakPolarHBondContact CA-OD1 3.48Å; P263-D266 WeakPolarHBondContact O-CB 3.47Å; P263-D266 PolarHBondContact O-N 2.99Å
267	L	93.4	Very high	91.7	Very high	13 Å²	13	65.8 Å²	65.8	7%	0.068	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-116.2	120.8	175.3	-177.2	72	0	0	0	108.6	G217 R218 E271 A273 L281	G217-L267 CarbonylContact C-O 3.57Å; G217-L267 WeakPolarHBondContact CA-O 3.44Å; R218-L267 HydrophobicContact CG-CB 3.96Å; R218-L267 PolarHBondContact N-O 3.03Å; R218-L267 PolarHBondContact O-N 2.69Å; L267-E271 HydrophobicContact CD1-CB 3.85Å; L267-E271 HydrophobicContact CD1-CG 3.96Å; L267-A273 HydrophobicContact CD1-CB 4.33Å; L267-L281 HydrophobicContact CD2-CD1 3.95Å
268	L	91.7	Very high	91.2	Very high	118 Å²	118	71 Å²	71	62%	0.618	40%	0.398	S	S	*	.			trans	-85.6	149.3	176.7	-63.9	177.7	0	0	0	111.5	G270 E271	L268-G270 PolarHBondContact O-N 2.83Å; L268-G270 VanDerWaalsContact O-N 3.12Å; L268-E271 HydrophobicContact CB-CB 4.43Å; L268-E271 PolarHBondContact N-OE2 3.32Å; L268-E271 VanDerWaalsContact N-OE2 3.15Å; L268-E271 VanDerWaalsContact O-CB 3.23Å; L268-E271 WeakPolarHBondContact O-CB 3.44Å; L268-E271 PolarHBondContact O-N 2.87Å
269	P	87.8	Confident	90.9	Very high	87 Å²	87	78.1 Å²	78.1	57%	0.565	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	120.3	173.8	-29	36.7	0	0	0	113	L197 V216	L197-P269 HydrophobicContact CD1-CG 3.47Å; L197-P269 VanDerWaalsContact CD1-CG 3.47Å; V216-P269 WeakPolarHBondContact O-CA 3.43Å
270	G	86.2	Confident	90.6	Very high	84 Å²	84	80.5 Å²	80.5	87%	0.866	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.5	4.1	179.9	0	0	0	0	0	115.2	L268	L268-G270 PolarHBondContact O-N 2.83Å; L268-G270 VanDerWaalsContact O-N 3.12Å
271	E	90.3	Very high	90.4	Very high	94 Å²	94	80.6 Å²	80.6	44%	0.439	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-80	137.2	165.6	-172.4	170	-164.4	0	0	109.8	L267 L268	L267-E271 HydrophobicContact CD1-CB 3.85Å; L267-E271 HydrophobicContact CD1-CG 3.96Å; L268-E271 HydrophobicContact CB-CB 4.43Å; L268-E271 PolarHBondContact N-OE2 3.32Å; L268-E271 VanDerWaalsContact N-OE2 3.15Å; L268-E271 VanDerWaalsContact O-CB 3.23Å; L268-E271 WeakPolarHBondContact O-CB 3.44Å; L268-E271 PolarHBondContact O-N 2.87Å
272	E	87.5	Confident	90.2	Very high	183 Å²	183	83.8 Å²	83.8	86%	0.855	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-89	125.4	173.5	-69.1	176.9	178.6	0	0	108.3
273	A	87.4	Confident	90.1	Very high	21 Å²	21	83.8 Å²	83.8	17%	0.174	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-71.9	147.4	174	0	0	0	0	0	110.2	L267 Q277 E278 L281	L267-A273 HydrophobicContact CD1-CB 4.33Å; A273-Q277 HydrophobicContact CB-CB 3.99Å; A273-E278 HydrophobicContact CB-CG 3.78Å; A273-L281 HydrophobicContact CB-CD1 3.77Å
274	T	89.5	Confident	90.2	Very high	74 Å²	74	82.2 Å²	82.2	45%	0.454	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-74.6	159.1	165.5	65.4	0	0	0	0	110.6	E276 Q277 E278	T274-E276 PolarHBondContact O-N 3.11Å; T274-E276 VanDerWaalsContact O-N 3.11Å; T274-Q277 CarbonylContact O-C 3.41Å; T274-Q277 WeakPolarHBondContact O-CA 3.45Å; T274-Q277 WeakPolarHBondContact O-CB 3.49Å; T274-Q277 PolarHBondContact O-N 2.88Å; T274-Q277 WeakPolarHBondContact OG1-CG 3.11Å; T274-Q277 PolarHBondContact OG1-N 3.1Å; T274-Q277 PolarHBondContact OG1-OE1 3.22Å; T274-E278 PolarHBondContact O-N 3.14Å
275	D	89.4	Confident	90.4	Very high	136 Å²	136	80.2 Å²	80.2	73%	0.727	44%	0.444	S	S	*	.	H	α-helix	trans	-50.3	-39.4	175.9	-53.1	3.2	0	0	0	112.6	E278 E279	D275-E278 PolarHBondContact O-N 3.3Å; D275-E279 PolarHBondContact O-N 2.92Å
276	E	88.2	Confident	90.8	Very high	161 Å²	161	82 Å²	82	75%	0.752	45%	0.454	S	S	*	.	H	α-helix	trans	-67.4	-34.6	175.6	-66.5	-179.5	179.7	0	0	112.9	T274 L280	T274-E276 PolarHBondContact O-N 3.11Å; T274-E276 VanDerWaalsContact O-N 3.11Å; E276-L280 WeakPolarHBondContact O-CG 3.29Å
277	Q	88.4	Confident	91	Very high	54 Å²	54	81 Å²	81	25%	0.252	45%	0.449	S	S	.	.	H	α-helix	trans	-74.5	-36.7	175.5	-71.6	174.7	-65.6	0	0	111.1	A273 T274 E279 L280 L281	A273-Q277 HydrophobicContact CB-CB 3.99Å; T274-Q277 CarbonylContact O-C 3.41Å; T274-Q277 WeakPolarHBondContact O-CA 3.45Å; T274-Q277 WeakPolarHBondContact O-CB 3.49Å; T274-Q277 PolarHBondContact O-N 2.88Å; T274-Q277 WeakPolarHBondContact OG1-CG 3.11Å; T274-Q277 PolarHBondContact OG1-N 3.1Å; T274-Q277 PolarHBondContact OG1-OE1 3.22Å; Q277-E279 VanDerWaalsContact C-N 3.35Å; Q277-E279 PolarHBondContact O-N 3.42Å; Q277-L280 PolarHBondContact O-N 3.2Å; Q277-L281 HydrophobicContact CB-CD1 4.45Å; Q277-L281 VanDerWaalsContact O-CB 3.29Å; Q277-L281 WeakPolarHBondContact O-CB 3.22Å; Q277-L281 WeakPolarHBondContact O-CG 3.3Å; Q277-L281 PolarHBondContact O-N 3.26Å
278	E	88.8	Confident	91.2	Very high	112 Å²	112	80.3 Å²	80.3	52%	0.523	45%	0.446	S	S	.	.	H	α-helix	trans	-57.9	-45.1	179	-71.7	-177.7	170.4	0	0	111.9	A273 T274 D275 L280 L281 S282	A273-E278 HydrophobicContact CB-CG 3.78Å; T274-E278 PolarHBondContact O-N 3.14Å; D275-E278 PolarHBondContact O-N 3.3Å; E278-L280 PolarHBondContact O-N 3.1Å; E278-L281 PolarHBondContact O-N 3.17Å; E278-S282 WeakPolarHBondContact O-CB 3.35Å; E278-S282 PolarHBondContact O-N 3.47Å
279	E	90.9	Very high	91.4	Very high	152 Å²	152	81.1 Å²	81.1	71%	0.71	44%	0.44	S	S	*	.	H	α-helix	trans	-61.9	-45.1	176.5	-172.9	177.3	-170.6	0	0	111.8	D275 Q277 L281 S282 A283	D275-E279 PolarHBondContact O-N 2.92Å; Q277-E279 VanDerWaalsContact C-N 3.35Å; Q277-E279 PolarHBondContact O-N 3.42Å; E279-L281 PolarHBondContact O-N 2.96Å; E279-S282 PolarHBondContact O-N 3.47Å; E279-A283 PolarHBondContact O-N 3.21Å; E279-A283 VanDerWaalsContact O-N 3.15Å
280	L	91.1	Very high	91.9	Very high	101 Å²	101	78.4 Å²	78.4	53%	0.529	42%	0.422	S	S	.	.	H	α-helix	trans	-64.5	-39.4	176.7	-70.1	172.9	0	0	0	112.3	E276 Q277 E278 D284	E276-L280 WeakPolarHBondContact O-CG 3.29Å; Q277-L280 PolarHBondContact O-N 3.2Å; E278-L280 PolarHBondContact O-N 3.1Å; L280-D284 WeakPolarHBondContact O-CB 3.23Å; L280-D284 PolarHBondContact O-N 3.09Å
281	L	92.3	Very high	92.5	Very high	17 Å²	17	74.4 Å²	74.4	9%	0.089	38%	0.381	C	S	.	.	H	α-helix	trans	-68.2	-38	178.3	-73.1	171.2	0	0	0	111.7	R218 L267 A273 Q277 E278 E279 D284 F285	R218-L281 HydrophobicContact CG-CD2 3.5Å; R218-L281 VanDerWaalsContact CG-CD2 3.5Å; L267-L281 HydrophobicContact CD2-CD1 3.95Å; A273-L281 HydrophobicContact CB-CD1 3.77Å; Q277-L281 HydrophobicContact CB-CD1 4.45Å; Q277-L281 VanDerWaalsContact O-CB 3.29Å; Q277-L281 WeakPolarHBondContact O-CB 3.22Å; Q277-L281 WeakPolarHBondContact O-CG 3.3Å; Q277-L281 PolarHBondContact O-N 3.26Å; E278-L281 PolarHBondContact O-N 3.17Å; E279-L281 PolarHBondContact O-N 2.96Å; L281-D284 PolarHBondContact O-N 3.26Å; L281-F285 VanDerWaalsContact O-CB 3.27Å; L281-F285 WeakPolarHBondContact O-CB 3.49Å; L281-F285 PolarHBondContact O-N 3.04Å
282	S	92.4	Very high	92.7	Very high	67 Å²	67	71.6 Å²	71.6	47%	0.469	37%	0.367	S	S	.	.	H	α-helix	trans	-61.2	-54.7	175.1	-169	0	0	0	0	110.5	E278 E279 D284 F285 D286	E278-S282 WeakPolarHBondContact O-CB 3.35Å; E278-S282 PolarHBondContact O-N 3.47Å; E279-S282 PolarHBondContact O-N 3.47Å; S282-D284 VanDerWaalsContact C-N 3.3Å; S282-D284 PolarHBondContact O-N 3.03Å; S282-F285 PolarHBondContact O-N 3.14Å; S282-F285 VanDerWaalsContact O-N 3.09Å; S282-D286 PolarHBondContact O-N 3.14Å
283	A	93	Very high	93.1	Very high	57 Å²	57	66.6 Å²	66.6	47%	0.471	34%	0.343	S	S	.	.	H	α-helix	trans	-60.7	-39.1	178.7	0	0	0	0	0	112.4	E279 D286 V287	E279-A283 PolarHBondContact O-N 3.21Å; E279-A283 VanDerWaalsContact O-N 3.15Å; A283-D286 PolarHBondContact O-N 3.38Å; A283-V287 WeakPolarHBondContact O-CG2 3.37Å; A283-V287 PolarHBondContact O-N 3.4Å
284	D	95.4	Very high	93.6	Very high	14 Å²	14	68.5 Å²	68.5	8%	0.075	35%	0.35	C	S	.	.	H	α-helix	trans	-62.8	-40.4	174.8	-177.5	88.3	0	0	0	112.5	K194 Y196 F260 L280 L281 S282 A288	K194-D284 IonicContact NZ-OD1 3.88Å; K194-D284 PolarHBondContact NZ-OD1 3.39Å; K194-D284 IonicContact NZ-OD2 3.6Å; K194-D284 PolarHBondContact NZ-OD2 2.89Å; Y196-D284 VanDerWaalsContact CE1-OD2 3.29Å; Y196-D284 WeakPolarHBondContact CE1-OD2 3.33Å; Y196-D284 PolarHBondContact OH-O 2.77Å; Y196-D284 PolarHBondContact OH-OD2 3.02Å; F260-D284 WeakPolarHBondContact CD2-OD1 3.29Å; L280-D284 WeakPolarHBondContact O-CB 3.23Å; L280-D284 PolarHBondContact O-N 3.09Å; L281-D284 PolarHBondContact O-N 3.26Å; S282-D284 VanDerWaalsContact C-N 3.3Å; S282-D284 PolarHBondContact O-N 3.03Å; D284-A288 PolarHBondContact O-N 3.02Å; D284-A288 VanDerWaalsContact O-N 3.16Å
285	F	94.6	Very high	94	Very high	52 Å²	52	65 Å²	65	23%	0.228	33%	0.329	C	S	.	.	H	α-helix	trans	-72.1	-35.7	179	-169.4	-109.9	0	0	0	112.2	F175 Y196 L198 L215 L281 S282 A288 R289	F175-F285 HydrophobicContact CE1-CE2 4.02Å; F175-F285 HydrophobicContact CZ-CE2 4.1Å; Y196-F285 AromaticContact CD1-CD2 3.77Å; Y196-F285 HydrophobicContact CD1-CD2 3.77Å; Y196-F285 HydrophobicContact CD1-CE2 4.2Å; Y196-F285 AromaticContact CE1-CD2 3.97Å; Y196-F285 HydrophobicContact CE1-CD2 3.97Å; Y196-F285 HydrophobicContact CG-CD2 4.47Å; L198-F285 HydrophobicContact CD2-CE2 3.96Å; L198-F285 HydrophobicContact CD2-CZ 4.01Å; L215-F285 HydrophobicContact CD1-CD2 4.16Å; L215-F285 HydrophobicContact CD1-CE2 4.28Å; L215-F285 HydrophobicContact CD2-CB 4.2Å; L215-F285 HydrophobicContact CD2-CD2 4.06Å; L215-F285 HydrophobicContact CD2-CG 4.26Å; L281-F285 VanDerWaalsContact O-CB 3.27Å; L281-F285 WeakPolarHBondContact O-CB 3.49Å; L281-F285 PolarHBondContact O-N 3.04Å; S282-F285 PolarHBondContact O-N 3.14Å; S282-F285 VanDerWaalsContact O-N 3.09Å; F285-A288 WeakPolarHBondContact O-CB 3.25Å; F285-A288 PolarHBondContact O-N 3.07Å; F285-R289 WeakPolarHBondContact O-CB 3.41Å; F285-R289 PolarHBondContact O-N 3.31Å
286	D	95.9	Very high	94.4	Very high	85 Å²	85	58.9 Å²	58.9	46%	0.455	30%	0.296	S	S	.	.	H	α-helix	trans	-59.7	-47.3	174.2	-69.4	-29.2	0	0	0	110.8	S282 A283 A288 R289 T290	S282-D286 PolarHBondContact O-N 3.14Å; A283-D286 PolarHBondContact O-N 3.38Å; D286-A288 VanDerWaalsContact C-N 3.32Å; D286-A288 PolarHBondContact O-N 2.97Å; D286-R289 WeakPolarHBondContact O-CB 3.16Å; D286-R289 PolarHBondContact O-N 3.4Å; D286-R289 VanDerWaalsContact O-N 3.16Å; D286-T290 PolarHBondContact O-N 2.97Å; D286-T290 PolarHBondContact O-OG1 2.84Å; D286-T290 VanDerWaalsContact O-OG1 3.1Å
287	V	97.1	Very high	94.8	Very high	18 Å²	18	53.8 Å²	53.8	11%	0.109	28%	0.277	C	S	.	.	H	α-helix	trans	-57.2	-44.6	173.6	171.6	0	0	0	0	111.5	I148 T151 F260 A283 R289 L291	I148-V287 HydrophobicContact CD1-CB 4.31Å; I148-V287 HydrophobicContact CD1-CG1 3.7Å; T151-V287 HydrophobicContact CG2-CG2 3.85Å; F260-V287 HydrophobicContact CD2-CB 4.4Å; F260-V287 HydrophobicContact CD2-CG1 3.87Å; F260-V287 HydrophobicContact CE2-CB 4.06Å; F260-V287 HydrophobicContact CE2-CG1 3.66Å; F260-V287 HydrophobicContact CZ-CG1 4.22Å; A283-V287 WeakPolarHBondContact O-CG2 3.37Å; A283-V287 PolarHBondContact O-N 3.4Å; V287-R289 VanDerWaalsContact C-N 3.33Å; V287-R289 PolarHBondContact O-N 3.47Å; V287-L291 HydrophobicContact CG1-CD1 4.22Å; V287-L291 VanDerWaalsContact O-CG 3.31Å; V287-L291 WeakPolarHBondContact O-CG 3.38Å; V287-L291 PolarHBondContact O-N 2.95Å
288	A	97.6	Very high	95.2	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65.7	-37.1	179.3	0	0	0	0	0	113	F175 L177 Y196 F260 D284 F285 D286 R292	F175-A288 HydrophobicContact CE2-CB 4.3Å; F175-A288 HydrophobicContact CZ-CB 4.22Å; L177-A288 HydrophobicContact CD1-CB 4.05Å; Y196-A288 HydrophobicContact CD2-CB 4.06Å; Y196-A288 HydrophobicContact CE1-CB 4.09Å; Y196-A288 HydrophobicContact CE2-CB 3.28Å; Y196-A288 WeakPolarHBondContact OH-CB 3.46Å; F260-A288 HydrophobicContact CE2-CB 4.37Å; F260-A288 HydrophobicContact CZ-CB 4.11Å; D284-A288 PolarHBondContact O-N 3.02Å; D284-A288 VanDerWaalsContact O-N 3.16Å; F285-A288 WeakPolarHBondContact O-CB 3.25Å; F285-A288 PolarHBondContact O-N 3.07Å; D286-A288 VanDerWaalsContact C-N 3.32Å; D286-A288 PolarHBondContact O-N 2.97Å; A288-R292 VanDerWaalsContact O-CB 3.31Å; A288-R292 WeakPolarHBondContact O-CB 3.37Å; A288-R292 PolarHBondContact O-N 3.25Å
289	R	96	Very high	95.7	Very high	134 Å²	134	51.8 Å²	51.8	51%	0.506	26%	0.262	S	S	.	.	H	α-helix	trans	-65.6	-51.2	176.3	-176	-178.2	177.5	178.2	-6.8	110.5	F285 D286 V287 L291 R292 E293	F285-R289 WeakPolarHBondContact O-CB 3.41Å; F285-R289 PolarHBondContact O-N 3.31Å; D286-R289 WeakPolarHBondContact O-CB 3.16Å; D286-R289 PolarHBondContact O-N 3.4Å; D286-R289 VanDerWaalsContact O-N 3.16Å; V287-R289 VanDerWaalsContact C-N 3.33Å; V287-R289 PolarHBondContact O-N 3.47Å; R289-L291 VanDerWaalsContact C-N 3.3Å; R289-L291 PolarHBondContact O-N 3.12Å; R289-R292 PolarHBondContact O-N 3.19Å; R289-E293 HydrophobicContact CG-CG 4.11Å; R289-E293 WeakPolarHBondContact CG-OE2 3.43Å; R289-E293 IonicContact CZ-OE2 2.91Å; R289-E293 IonicContact NE-OE1 3.15Å; R289-E293 IonicContact NE-OE2 3.65Å; R289-E293 PolarHBondContact NE-OE2 3.38Å; R289-E293 IonicContact NH2-OE2 3.55Å; R289-E293 PolarHBondContact NH2-OE2 3.43Å; R289-E293 WeakPolarHBondContact O-CB 3.47Å; R289-E293 PolarHBondContact O-N 3.21Å
290	T	97.5	Very high	96	Very high	30 Å²	30	48.1 Å²	48.1	18%	0.184	25%	0.25	C	C	.	.	H	α-helix	trans	-57.4	-43.1	177.2	-57.1	0	0	0	0	111.5	C145 I148 D286 R292 D294 L295	C145-T290 WeakPolarHBondContact SG-CG2 3.35Å; I148-T290 HydrophobicContact CD1-CG2 4.02Å; I148-T290 HydrophobicContact CG1-CG2 3.81Å; D286-T290 PolarHBondContact O-N 2.97Å; D286-T290 PolarHBondContact O-OG1 2.84Å; D286-T290 VanDerWaalsContact O-OG1 3.1Å; T290-R292 PolarHBondContact O-N 3.24Å; T290-D294 WeakPolarHBondContact O-CB 3.44Å; T290-D294 PolarHBondContact O-N 2.89Å; T290-D294 VanDerWaalsContact O-N 3.07Å; T290-L295 PolarHBondContact O-N 3.24Å
291	L	98.2	Very high	96.2	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.239	C	C	.	.	I	π-helix	trans	-59.5	-46.3	174	-74	169.7	0	0	0	112.4	L142 I148 L177 F179 F260 V287 R289 L295 I296	L142-L291 HydrophobicContact CD2-CD2 3.78Å; I148-L291 HydrophobicContact CD1-CD2 4.1Å; I148-L291 HydrophobicContact CD1-CG 3.79Å; I148-L291 HydrophobicContact CG1-CD2 4.36Å; L177-L291 HydrophobicContact CD1-CB 4.37Å; L177-L291 HydrophobicContact CD1-CD1 3.93Å; F179-L291 HydrophobicContact CE1-CD1 4.42Å; F179-L291 HydrophobicContact CZ-CD1 3.72Å; F260-L291 HydrophobicContact CE1-CD1 4.26Å; F260-L291 HydrophobicContact CZ-CD1 4.25Å; V287-L291 HydrophobicContact CG1-CD1 4.22Å; V287-L291 VanDerWaalsContact O-CG 3.31Å; V287-L291 WeakPolarHBondContact O-CG 3.38Å; V287-L291 PolarHBondContact O-N 2.95Å; R289-L291 VanDerWaalsContact C-N 3.3Å; R289-L291 PolarHBondContact O-N 3.12Å; L291-L295 HydrophobicContact CD2-CD2 4.03Å; L291-I296 HydrophobicContact CB-CD1 4.49Å; L291-I296 VanDerWaalsContact O-CB 3.23Å; L291-I296 WeakPolarHBondContact O-CB 3.44Å; L291-I296 WeakPolarHBondContact O-CD1 3.42Å; L291-I296 WeakPolarHBondContact O-CG1 3.47Å; L291-I296 PolarHBondContact O-N 3.26Å
292	R	96.2	Very high	96.5	Very high	36 Å²	36	46.6 Å²	46.6	14%	0.136	24%	0.24	C	C	.	.	I	π-helix	trans	-73	-46.9	-174.9	169.3	-179.6	170.2	-171.8	-2.6	112.9	Q70 L170 A288 R289 T290 P297	Q70-R292 VanDerWaalsContact OE1-NH2 3.14Å; L170-R292 VanDerWaalsContact CD2-CZ 3.46Å; A288-R292 VanDerWaalsContact O-CB 3.31Å; A288-R292 WeakPolarHBondContact O-CB 3.37Å; A288-R292 PolarHBondContact O-N 3.25Å; R289-R292 PolarHBondContact O-N 3.19Å; T290-R292 PolarHBondContact O-N 3.24Å; R292-P297 WeakPolarHBondContact O-CD 3.17Å; R292-P297 WeakPolarHBondContact O-CG 3.48Å
293	E	95.4	Very high	96.7	Very high	78 Å²	78	46.2 Å²	46.2	36%	0.364	23%	0.23	S	C	.	.	I	π-helix	trans	-90.5	-30.6	-167.7	-61.5	-171.1	165.3	0	0	112	R289 R298	R289-E293 HydrophobicContact CG-CG 4.11Å; R289-E293 WeakPolarHBondContact CG-OE2 3.43Å; R289-E293 IonicContact CZ-OE2 2.91Å; R289-E293 IonicContact NE-OE1 3.15Å; R289-E293 IonicContact NE-OE2 3.65Å; R289-E293 PolarHBondContact NE-OE2 3.38Å; R289-E293 IonicContact NH2-OE2 3.55Å; R289-E293 PolarHBondContact NH2-OE2 3.43Å; R289-E293 WeakPolarHBondContact O-CB 3.47Å; R289-E293 PolarHBondContact O-N 3.21Å; E293-R298 PolarHBondContact O-NH1 3.14Å
294	D	97	Very high	96.8	Very high	60 Å²	60	46.6 Å²	46.6	32%	0.321	23%	0.227	S	C	.	.	I	π-helix	trans	-113.9	-65.5	-171	-50.4	-41.7	0	0	0	111.6	T290 P297 R298 Y302	T290-D294 WeakPolarHBondContact O-CB 3.44Å; T290-D294 PolarHBondContact O-N 2.89Å; T290-D294 VanDerWaalsContact O-N 3.07Å; D294-P297 WeakPolarHBondContact O-CD 3.29Å; D294-R298 WeakPolarHBondContact O-CB 3.47Å; D294-R298 PolarHBondContact O-N 3.2Å; D294-Y302 HydrophobicContact CB-CE2 4.43Å
295	L	98	Very high	96.8	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.235	C	C	.	.	I	π-helix	trans	-68.8	-51.2	-169.6	-178.8	144.5	0	0	0	113.4	W138 A141 L142 C145 I166 T290 L291 R298 A299 Y302	W138-L295 HydrophobicContact CE3-CD2 4.14Å; W138-L295 HydrophobicContact CZ3-CD2 3.71Å; A141-L295 WeakPolarHBondContact O-CD1 3.42Å; L142-L295 HydrophobicContact CD2-CD1 3.83Å; L142-L295 HydrophobicContact CD2-CD2 4.27Å; L142-L295 HydrophobicContact CG-CD1 4.35Å; C145-L295 HydrophobicContact CB-CD1 3.59Å; I166-L295 HydrophobicContact CD1-CD2 4.23Å; T290-L295 PolarHBondContact O-N 3.24Å; L291-L295 HydrophobicContact CD2-CD2 4.03Å; L295-R298 CarbonylContact O-C 3.51Å; L295-R298 PolarHBondContact O-N 3Å; L295-A299 WeakPolarHBondContact O-CA 3.28Å; L295-A299 WeakPolarHBondContact O-CB 3.45Å; L295-A299 PolarHBondContact O-N 3.36Å; L295-Y302 HydrophobicContact CB-CD2 4.36Å; L295-Y302 HydrophobicContact CB-CE2 4.33Å; L295-Y302 HydrophobicContact CG-CD2 4.43Å
296	I	98	Very high	96.7	Very high	8 Å²	8	48.2 Å²	48.2	4%	0.041	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-44	-175.5	-70.1	165.6	0	0	0	111.9	R84 I166 C168 L177 L291	R84-I296 PolarHBondContact NH1-O 2.86Å; R84-I296 PolarHBondContact NH2-O 3.28Å; I166-I296 HydrophobicContact CB-CD1 4.49Å; I166-I296 HydrophobicContact CB-CG1 4.29Å; I166-I296 HydrophobicContact CG2-CD1 3.69Å; I166-I296 HydrophobicContact CG2-CG1 3.93Å; C168-I296 HydrophobicContact CB-CD1 3.86Å; L177-I296 HydrophobicContact CD2-CD1 3.9Å; L291-I296 HydrophobicContact CB-CD1 4.49Å; L291-I296 VanDerWaalsContact O-CB 3.23Å; L291-I296 WeakPolarHBondContact O-CB 3.44Å; L291-I296 WeakPolarHBondContact O-CD1 3.42Å; L291-I296 WeakPolarHBondContact O-CG1 3.47Å; L291-I296 PolarHBondContact O-N 3.26Å
297	P	96.9	Very high	96.5	Very high	54 Å²	54	45.4 Å²	45.4	35%	0.351	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-36.1	176.6	-25	36.7	0	0	0	113.3	R292 D294	R292-P297 WeakPolarHBondContact O-CD 3.17Å; R292-P297 WeakPolarHBondContact O-CG 3.48Å; D294-P297 WeakPolarHBondContact O-CD 3.29Å
298	R	96.9	Very high	96.1	Very high	124 Å²	124	48.6 Å²	48.6	47%	0.468	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115	26.2	-171.9	-61.9	179.7	-177	81.4	-2.8	114.2	E293 D294 L295 V300 L301 Y302	E293-R298 PolarHBondContact O-NH1 3.14Å; D294-R298 WeakPolarHBondContact O-CB 3.47Å; D294-R298 PolarHBondContact O-N 3.2Å; L295-R298 CarbonylContact O-C 3.51Å; L295-R298 PolarHBondContact O-N 3Å; R298-V300 PolarHBondContact O-N 2.92Å; R298-L301 HydrophobicContact CB-CD1 4.18Å; R298-L301 HydrophobicContact CB-CG 4.47Å; R298-L301 HydrophobicContact CG-CD1 4.37Å; R298-L301 WeakPolarHBondContact O-CB 3.03Å; R298-L301 PolarHBondContact O-N 3.09Å; R298-Y302 HydrophobicContact CB-CD2 4.42Å; R298-Y302 HydrophobicContact CB-CE2 4.32Å; R298-Y302 PolarHBondContact O-N 3.19Å
299	A	98.3	Very high	95.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-54.2	-31.9	-169.5	0	0	0	0	0	115	F137 W138 L295 F303	F137-A299 HydrophobicContact CE1-CB 3.91Å; F137-A299 HydrophobicContact CZ-CB 4.09Å; W138-A299 HydrophobicContact CE3-CB 4.4Å; W138-A299 HydrophobicContact CH2-CB 3.8Å; W138-A299 HydrophobicContact CZ3-CB 3.6Å; L295-A299 WeakPolarHBondContact O-CA 3.28Å; L295-A299 WeakPolarHBondContact O-CB 3.45Å; L295-A299 PolarHBondContact O-N 3.36Å; A299-F303 WeakPolarHBondContact O-CB 3.41Å; A299-F303 PolarHBondContact O-N 2.91Å
300	V	97.3	Very high	93.6	Very high	75 Å²	75	58 Å²	58	46%	0.455	29%	0.294	S	S	.	.	H	α-helix	trans	-68.6	-36.5	177.1	65.8	0	0	0	0	112.2	F137 R298 F303 T304	F137-V300 HydrophobicContact CZ-CB 4.39Å; R298-V300 PolarHBondContact O-N 2.92Å; V300-F303 WeakPolarHBondContact O-CB 3.43Å; V300-F303 PolarHBondContact O-N 3.02Å; V300-F303 VanDerWaalsContact O-N 3.13Å; V300-T304 HydrophobicContact CG2-CG2 4.4Å; V300-T304 WeakPolarHBondContact O-CG2 3.21Å; V300-T304 PolarHBondContact O-N 3.26Å; V300-T304 PolarHBondContact O-OG1 3.32Å; V300-T304 VanDerWaalsContact O-OG1 3.06Å
301	L	96.7	Very high	91.7	Very high	58 Å²	58	62.7 Å²	62.7	30%	0.304	32%	0.318	S	S	.	.	H	α-helix	trans	-69.9	-36.5	178.8	-55.3	-177.7	0	0	0	111.2	R298 F303 T304 G305 E306 A307	R298-L301 HydrophobicContact CB-CD1 4.18Å; R298-L301 HydrophobicContact CB-CG 4.47Å; R298-L301 HydrophobicContact CG-CD1 4.37Å; R298-L301 WeakPolarHBondContact O-CB 3.03Å; R298-L301 PolarHBondContact O-N 3.09Å; L301-F303 VanDerWaalsContact C-N 3.34Å; L301-T304 WeakPolarHBondContact CA-OG1 3.38Å; L301-T304 PolarHBondContact O-OG1 2.92Å; L301-G305 CarbonylContact O-C 3.46Å; L301-G305 PolarHBondContact O-N 3.21Å; L301-E306 HydrophobicContact CB-CB 4.27Å; L301-E306 HydrophobicContact CD2-CB 4.29Å; L301-E306 PolarHBondContact O-N 3.27Å; L301-A307 HydrophobicContact CB-CB 3.59Å; L301-A307 PolarHBondContact O-N 3.26Å
302	Y	97.8	Very high	89.4	Confident	29 Å²	29	71.4 Å²	71.4	11%	0.114	36%	0.359	C	S	.	.	H	α-helix	trans	-66.9	-37.2	169.4	-74.1	-74.2	0	0	0	111.7	N144 C145 D294 L295 R298 G305 A307	N144-Y302 WeakPolarHBondContact CB-O 3.06Å; N144-Y302 PolarHBondContact ND2-O 3.43Å; N144-Y302 WeakPolarHBondContact O-CD1 3.36Å; C145-Y302 HydrophobicContact CB-CD1 3.69Å; C145-Y302 HydrophobicContact CB-CE1 3.74Å; C145-Y302 HydrophobicContact CB-CG 4.31Å; D294-Y302 HydrophobicContact CB-CE2 4.43Å; L295-Y302 HydrophobicContact CB-CD2 4.36Å; L295-Y302 HydrophobicContact CB-CE2 4.33Å; L295-Y302 HydrophobicContact CG-CD2 4.43Å; R298-Y302 HydrophobicContact CB-CD2 4.42Å; R298-Y302 HydrophobicContact CB-CE2 4.32Å; R298-Y302 PolarHBondContact O-N 3.19Å; Y302-G305 PolarHBondContact O-N 2.83Å; Y302-A307 HydrophobicContact CD1-CB 4.06Å; Y302-A307 HydrophobicContact CD2-CB 4.15Å; Y302-A307 HydrophobicContact CE1-CB 3.99Å; Y302-A307 VanDerWaalsContact CE1-O 3.27Å; Y302-A307 WeakPolarHBondContact CE1-O 3.46Å; Y302-A307 HydrophobicContact CE2-CB 4.07Å; Y302-A307 HydrophobicContact CG-CB 4.15Å
303	F	97.7	Very high	87.2	Confident	58 Å²	58	76.6 Å²	76.6	25%	0.254	39%	0.389	S	S	.	.	H	α-helix	trans	-64.9	-42.6	176.3	174.9	-95.2	0	0	0	112.8	I134 F137 T140 A141 A299 V300 L301 G305	I134-F303 HydrophobicContact CG2-CE1 4.09Å; I134-F303 HydrophobicContact CG2-CE2 4.03Å; I134-F303 HydrophobicContact CG2-CZ 3.56Å; F137-F303 HydrophobicContact CB-CD2 4.26Å; F137-F303 HydrophobicContact CB-CE2 4.34Å; F137-F303 HydrophobicContact CD2-CB 3.95Å; F137-F303 HydrophobicContact CD2-CD1 4.02Å; F137-F303 AromaticContact CD2-CD2 3.55Å; F137-F303 HydrophobicContact CD2-CD2 3.55Å; F137-F303 HydrophobicContact CD2-CE1 4.45Å; F137-F303 HydrophobicContact CD2-CE2 4.03Å; F137-F303 AromaticContact CD2-CG 3.54Å; F137-F303 HydrophobicContact CD2-CG 3.54Å; F137-F303 HydrophobicContact CD2-CZ 4.46Å; F137-F303 HydrophobicContact CE2-CB 3.61Å; F137-F303 HydrophobicContact CE2-CD1 4.04Å; F137-F303 HydrophobicContact CE2-CD2 4.12Å; F137-F303 AromaticContact CE2-CG 3.64Å; F137-F303 HydrophobicContact CE2-CG 3.64Å; F137-F303 HydrophobicContact CG-CD2 4.08Å; F137-F303 HydrophobicContact CG-CG 4.43Å; F137-F303 HydrophobicContact CZ-CB 4.13Å; F137-F303 WeakPolarHBondContact O-CD2 3.43Å; T140-F303 HydrophobicContact CG2-CD2 3.92Å; T140-F303 HydrophobicContact CG2-CE2 4.23Å; A141-F303 HydrophobicContact CB-CB 4.38Å; A299-F303 WeakPolarHBondContact O-CB 3.41Å; A299-F303 PolarHBondContact O-N 2.91Å; V300-F303 WeakPolarHBondContact O-CB 3.43Å; V300-F303 PolarHBondContact O-N 3.02Å; V300-F303 VanDerWaalsContact O-N 3.13Å; L301-F303 VanDerWaalsContact C-N 3.34Å; F303-G305 VanDerWaalsContact C-N 3.34Å
304	T	95	Very high	84.8	Confident	65 Å²	65	82.5 Å²	82.5	40%	0.399	41%	0.41	S	S	.	.	H	α-helix	trans	-78.4	-19	179	53.7	0	0	0	0	112.9	V300 L301 E306	V300-T304 HydrophobicContact CG2-CG2 4.4Å; V300-T304 WeakPolarHBondContact O-CG2 3.21Å; V300-T304 PolarHBondContact O-N 3.26Å; V300-T304 PolarHBondContact O-OG1 3.32Å; V300-T304 VanDerWaalsContact O-OG1 3.06Å; L301-T304 WeakPolarHBondContact CA-OG1 3.38Å; L301-T304 PolarHBondContact O-OG1 2.92Å; T304-E306 VanDerWaalsContact CB-OE1 3.24Å; T304-E306 WeakPolarHBondContact CB-OE1 3.44Å; T304-E306 VanDerWaalsContact OG1-CD 3.29Å; T304-E306 VanDerWaalsContact OG1-CG 3.31Å; T304-E306 WeakPolarHBondContact OG1-CG 3.35Å; T304-E306 PolarHBondContact OG1-OE1 3.45Å
305	G	93.9	Very high	82.5	Confident	24 Å²	24	88.5 Å²	88.5	25%	0.247	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.9	-5.3	-178.5	0	0	0	0	0	113.7	L301 Y302 F303 A307 M308	L301-G305 CarbonylContact O-C 3.46Å; L301-G305 PolarHBondContact O-N 3.21Å; Y302-G305 PolarHBondContact O-N 2.83Å; F303-G305 VanDerWaalsContact C-N 3.34Å; G305-A307 PolarHBondContact O-N 3.3Å; G305-M308 WeakPolarHBondContact O-CB 3.47Å; G305-M308 WeakPolarHBondContact O-CG 3.29Å; G305-M308 PolarHBondContact O-N 3.15Å; G305-M308 VanDerWaalsContact O-N 3.15Å
306	E	92.6	Very high	79.9	Confident	77 Å²	77	96.4 Å²	96.4	36%	0.36	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-17.1	-177.7	-61.2	172.5	-121.7	0	0	114.7	L107 L301 T304	L107-E306 HydrophobicContact CD1-CB 4.44Å; L107-E306 HydrophobicContact CD1-CG 3.54Å; L301-E306 HydrophobicContact CB-CB 4.27Å; L301-E306 HydrophobicContact CD2-CB 4.29Å; L301-E306 PolarHBondContact O-N 3.27Å; T304-E306 VanDerWaalsContact CB-OE1 3.24Å; T304-E306 WeakPolarHBondContact CB-OE1 3.44Å; T304-E306 VanDerWaalsContact OG1-CD 3.29Å; T304-E306 VanDerWaalsContact OG1-CG 3.31Å; T304-E306 WeakPolarHBondContact OG1-CG 3.35Å; T304-E306 PolarHBondContact OG1-OE1 3.45Å
307	A	93	Very high	77.3	Confident	26 Å²	26	105.7 Å²	105.7	22%	0.215	52%	0.516	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	12.1	175.9	0	0	0	0	0	113.2	L301 Y302 G305	L301-A307 HydrophobicContact CB-CB 3.59Å; L301-A307 PolarHBondContact O-N 3.26Å; Y302-A307 HydrophobicContact CD1-CB 4.06Å; Y302-A307 HydrophobicContact CD2-CB 4.15Å; Y302-A307 HydrophobicContact CE1-CB 3.99Å; Y302-A307 VanDerWaalsContact CE1-O 3.27Å; Y302-A307 WeakPolarHBondContact CE1-O 3.46Å; Y302-A307 HydrophobicContact CE2-CB 4.07Å; Y302-A307 HydrophobicContact CG-CB 4.15Å; G305-A307 PolarHBondContact O-N 3.3Å
308	M	89.2	Confident	75.1	Confident	85 Å²	85	110.1 Å²	110.1	42%	0.419	53%	0.532	S	S	.	.	S	Bend	trans	-71.2	143.1	168.8	-64.7	179.9	62.8	0	0	108.8	N144 G305 E310	N144-M308 HydrophobicContact CB-CG 3.82Å; N144-M308 HydrophobicContact CB-SD 3.75Å; N144-M308 VanDerWaalsContact CG-SD 3.56Å; N144-M308 WeakPolarHBondContact O-CG 3.13Å; G305-M308 WeakPolarHBondContact O-CB 3.47Å; G305-M308 WeakPolarHBondContact O-CG 3.29Å; G305-M308 PolarHBondContact O-N 3.15Å; G305-M308 VanDerWaalsContact O-N 3.15Å; M308-E310 PolarHBondContact O-N 3.26Å
309	E	74.8	Confident	72.6	Confident	152 Å²	152	112 Å²	112	71%	0.71	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-65.2	124	169.7	-62.6	-175.8	-179.3	0	0	107.3	D311	E309-D311 PolarHBondContact O-N 3.05Å; E309-D311 VanDerWaalsContact O-N 3.16Å
310	E	65	Low	70.1	Confident	179 Å²	179	120.2 Å²	120.2	84%	0.836	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-64.6	116.1	172.9	-71.9	178	-174.7	0	0	107	M308 E312	M308-E310 PolarHBondContact O-N 3.26Å; E310-E312 VanDerWaalsContact C-N 3.3Å; E310-E312 PolarHBondContact O-N 3.05Å
311	D	57.5	Low	67.9	Low	129 Å²	129	124.8 Å²	124.8	69%	0.69	61%	0.606	S	S	*	*			trans	-59.6	98.4	165.9	-75.1	-36.4	0	0	0	106.6	E309 D313	E309-D311 PolarHBondContact O-N 3.05Å; E309-D311 VanDerWaalsContact O-N 3.16Å; D311-D313 PolarHBondContact O-N 2.87Å
312	E	50.5	Low	65.7	Low	183 Å²	183	130.4 Å²	130.4	86%	0.855	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	15.8	179.2	-72.9	-175.1	165.3	0	0	113.7	E310	E310-E312 VanDerWaalsContact C-N 3.3Å; E310-E312 PolarHBondContact O-N 3.05Å
313	D	50.4	Low	63.6	Low	145 Å²	145	134.7 Å²	134.7	78%	0.775	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	16.7	-166.4	-81.3	-14.9	0	0	0	115.2	D311	D311-D313 PolarHBondContact O-N 2.87Å
314	Y	45.2	Very low	61.2	Low	201 Å²	201	141.5 Å²	141.5	79%	0.788	70%	0.698	S	S	*	*			trans	-119.9	48.1	172	-61.8	-73.2	0	0	0	113.3	E316	Y314-E316 PolarHBondContact O-N 3.33Å
315	E	46.9	Very low	59.4	Low	186 Å²	186	145.5 Å²	145.5	87%	0.869	72%	0.717	S	S	*	*			trans	-72.8	108.3	151.4	-77.1	-166.4	173.6	0	0	108.3	E317	E315-E317 PolarHBondContact O-N 3.12Å
316	E	44.3	Very low	57.2	Low	166 Å²	166	149.3 Å²	149.3	78%	0.776	74%	0.74	S	S	*	*			trans	-41.2	99.3	175.8	-66.2	170	163.3	0	0	113.4	Y314 E318	Y314-E316 PolarHBondContact O-N 3.33Å; E316-E318 HydrophobicContact CB-CB 4.47Å; E316-E318 HydrophobicContact CB-CG 4.35Å; E316-E318 PolarHBondContact O-N 3.32Å
317	E	44.1	Very low	55.6	Low	204 Å²	204	150.3 Å²	150.3	95%	0.953	76%	0.761	S	S	*	*			trans	-75.4	61.6	148.3	-73.1	-163.3	170.2	0	0	108.9	E315 E319	E315-E317 PolarHBondContact O-N 3.12Å; E317-E319 PolarHBondContact O-N 3.44Å
318	E	49.2	Very low	53.6	Low	146 Å²	146	158.5 Å²	158.5	68%	0.682	80%	0.795	S	S	*	*			trans	-82.2	100.9	166.5	-79.2	-152.4	165.9	0	0	110.4	E316	E316-E318 HydrophobicContact CB-CB 4.47Å; E316-E318 HydrophobicContact CB-CG 4.35Å; E316-E318 PolarHBondContact O-N 3.32Å
319	E	44.7	Very low	51.5	Low	164 Å²	164	167.5 Å²	167.5	77%	0.766	84%	0.836	S	S	*	*			trans	57.6	90.8	138.4	-57.7	-169.9	169	0	0	118.2	E317	E317-E319 PolarHBondContact O-N 3.44Å
320	N	46.2	Very low	50.3	Low	172 Å²	172	168.3 Å²	168.3	92%	0.92	84%	0.842	S	S	*	*			trans	-121.4	63.3	151.8	-88.6	-56.2	0	0	0	111
321	E	51.3	Low	49.6	Very low	171 Å²	171	167.7 Å²	167.7	80%	0.799	84%	0.842	S	S	*	*			trans	-139.5	118.7	157.2	-64.3	-169.7	170.3	0	0	104.7
322	E	51.5	Low	49.1	Very low	177 Å²	177	169.8 Å²	169.8	83%	0.827	85%	0.851	S	S	*	*				-171.6	162.4	65	-75.3	-172.7	147.8	0	0	110.7
323	S	51.8	Low	49.1	Very low	118 Å²	118	169.1 Å²	169.1	83%	0.825	85%	0.85	S	S	*	*			trans	101.5	74.3	148.8	75.5	0	0	0	0	119
324	E	48.5	Very low	49	Very low	202 Å²	202	170.6 Å²	170.6	94%	0.944	86%	0.855	S	S	*	*			trans	-75.4	107.3	134.6	-74.4	-172.7	160.8	0	0	108.6
325	D	56.5	Low	49.2	Very low	149 Å²	149	168.5 Å²	168.5	80%	0.797	86%	0.86	S	S	*	*			trans	-170.4	136.2	131.8	-150	-6.4	0	0	0	113
326	S	48.4	Very low	49.4	Very low	104 Å²	104	167.3 Å²	167.3	73%	0.727	86%	0.859	S	S	*	*			trans	74.9	104.8	151	73.1	0	0	0	0	121.4
327	A	59.7	Low	49.8	Very low	97 Å²	97	167.4 Å²	167.4	80%	0.802	87%	0.865	S	S	*	*			trans	-160.9	97.3	131.9	0	0	0	0	0	111.8
328	Q	50.6	Low	50.3	Low	198 Å²	198	164.3 Å²	164.3	93%	0.925	86%	0.858	S	S	*	*			trans	29	115.7	139.7	-67.1	174.6	-19.8	0	0	120
329	E	44.7	Very low	50.4	Low	274 Å²	274	166 Å²	166	100%	1.28	87%	0.874	S	S	*	*				-138.5	0	115.6	-117.7	-176.2	-177.3	0	0	110.5

Retrieved 329 of 329 residues in 1176.2 ms (Link to these results)

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