A0A077ZHF7_TRITR Loading...

Protein CNPPD1

AlphaFold DB , UniProt , Accession A0A077ZHF7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 293 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	50.7	Low	53.2	Low	202 Å²	202	113.2 Å²	113.2	100%	0.995	62%	0.622	S	S	*	*				0	-43.3	0	-81.3	-125.7	-77	0	0	111.9	N3 L4 I5	M1-N3 PolarHBondContact O-N 3.36Å; M1-L4 PolarHBondContact O-N 3.19Å; M1-L4 VanDerWaalsContact O-N 3.08Å; M1-I5 PolarHBondContact O-N 3.1Å; M1-I5 VanDerWaalsContact O-N 3.16Å
2	E	55.4	Low	53.2	Low	158 Å²	158	117.4 Å²	117.4	74%	0.738	63%	0.63	S	S	*	*	H	α-helix	trans	-54.6	-46.3	177	-73.5	178.3	149.3	0	0	114.1	L4 I5 V6	E2-L4 PolarHBondContact O-N 3.03Å; E2-L4 VanDerWaalsContact O-N 3.16Å; E2-I5 PolarHBondContact O-N 2.77Å; E2-I5 VanDerWaalsContact O-N 3.09Å; E2-V6 WeakPolarHBondContact O-CG2 3.37Å; E2-V6 PolarHBondContact O-N 2.98Å
3	N	58.6	Low	53.5	Low	143 Å²	143	112.8 Å²	112.8	77%	0.765	62%	0.617	S	S	*	*	H	α-helix	trans	-58.9	-31	177.6	-68	-8	0	0	0	113.5	M1 A7	M1-N3 PolarHBondContact O-N 3.36Å; N3-A7 WeakPolarHBondContact O-CB 3.5Å; N3-A7 PolarHBondContact O-N 3.02Å
4	L	48.3	Very low	53.4	Low	120 Å²	120	114.3 Å²	114.3	63%	0.628	62%	0.618	S	S	*	*	H	α-helix	trans	-78	-36.7	179	-144.7	113.4	0	0	0	111	M1 E2 M8	M1-L4 PolarHBondContact O-N 3.19Å; M1-L4 VanDerWaalsContact O-N 3.08Å; E2-L4 PolarHBondContact O-N 3.03Å; E2-L4 VanDerWaalsContact O-N 3.16Å; L4-M8 VanDerWaalsContact O-CB 3.27Å; L4-M8 WeakPolarHBondContact O-CB 3.49Å; L4-M8 VanDerWaalsContact O-CG 3.24Å; L4-M8 WeakPolarHBondContact O-CG 3.44Å; L4-M8 PolarHBondContact O-N 2.87Å
5	I	57.6	Low	53.5	Low	114 Å²	114	112.3 Å²	112.3	59%	0.585	61%	0.607	S	S	*	*	H	α-helix	trans	-68.7	-42.3	175.6	-64.8	171.2	0	0	0	110.4	M1 E2 M8 G9	M1-I5 PolarHBondContact O-N 3.1Å; M1-I5 VanDerWaalsContact O-N 3.16Å; E2-I5 PolarHBondContact O-N 2.77Å; E2-I5 VanDerWaalsContact O-N 3.09Å; I5-M8 PolarHBondContact O-N 3.37Å; I5-G9 PolarHBondContact O-N 2.94Å
6	V	61	Low	54.4	Low	105 Å²	105	111.2 Å²	111.2	64%	0.636	60%	0.6	S	S	*	*	H	α-helix	trans	-66	-44.3	175.2	175.7	0	0	0	0	110.7	E2 M8 G9 G10	E2-V6 WeakPolarHBondContact O-CG2 3.37Å; E2-V6 PolarHBondContact O-N 2.98Å; V6-M8 PolarHBondContact O-N 3.28Å; V6-G9 PolarHBondContact O-N 3.43Å; V6-G10 PolarHBondContact O-N 3.35Å
7	A	53.2	Low	55.3	Low	53 Å²	53	110.1 Å²	110.1	44%	0.438	59%	0.593	S	S	.	*	H	α-helix	trans	-64.4	-38.6	175.9	0	0	0	0	0	112.4	N3 K11	N3-A7 WeakPolarHBondContact O-CB 3.5Å; N3-A7 PolarHBondContact O-N 3.02Å; A7-K11 VanDerWaalsContact O-CB 3.27Å; A7-K11 WeakPolarHBondContact O-CB 3.15Å; A7-K11 VanDerWaalsContact O-CG 3.29Å; A7-K11 WeakPolarHBondContact O-CG 3.35Å; A7-K11 PolarHBondContact O-N 3.08Å
8	M	43.7	Very low	56.5	Low	123 Å²	123	112.2 Å²	112.2	61%	0.606	59%	0.591	S	S	*	*	H	α-helix	trans	-70.9	-36.4	174.2	-74.9	-142.3	-67.9	0	0	112.3	L4 I5 V6 K12	L4-M8 VanDerWaalsContact O-CB 3.27Å; L4-M8 WeakPolarHBondContact O-CB 3.49Å; L4-M8 VanDerWaalsContact O-CG 3.24Å; L4-M8 WeakPolarHBondContact O-CG 3.44Å; L4-M8 PolarHBondContact O-N 2.87Å; I5-M8 PolarHBondContact O-N 3.37Å; V6-M8 PolarHBondContact O-N 3.28Å; M8-K12 WeakPolarHBondContact O-CB 3.35Å; M8-K12 PolarHBondContact O-N 3.06Å
9	G	51.5	Low	57.7	Low	39 Å²	39	106.6 Å²	106.6	40%	0.402	56%	0.562	S	S	.	*	H	α-helix	trans	-64.7	-45.9	174.2	0	0	0	0	0	111.8	I5 V6 K12 A13	I5-G9 PolarHBondContact O-N 2.94Å; V6-G9 PolarHBondContact O-N 3.43Å; G9-K12 PolarHBondContact O-N 3.3Å; G9-A13 WeakPolarHBondContact O-CB 3.45Å; G9-A13 PolarHBondContact O-N 3.47Å
10	G	51.8	Low	58.7	Low	39 Å²	39	102.6 Å²	102.6	40%	0.402	54%	0.542	S	S	.	.	H	α-helix	trans	-60.5	-50.6	172.9	0	0	0	0	0	111.7	V6 K12 A13 E14	V6-G10 PolarHBondContact O-N 3.35Å; G10-K12 VanDerWaalsContact C-N 3.28Å; G10-K12 PolarHBondContact O-N 2.66Å; G10-A13 PolarHBondContact O-N 2.93Å; G10-E14 VanDerWaalsContact O-CB 3.24Å; G10-E14 WeakPolarHBondContact O-CB 3.35Å; G10-E14 PolarHBondContact O-N 2.89Å
11	K	52.8	Low	59.8	Low	149 Å²	149	98.2 Å²	98.2	65%	0.648	52%	0.518	S	S	*	.	H	α-helix	trans	-60	-35.8	174.2	-78.7	-174.7	177.8	-172.9	0	112.7	A7 L15	A7-K11 VanDerWaalsContact O-CB 3.27Å; A7-K11 WeakPolarHBondContact O-CB 3.15Å; A7-K11 VanDerWaalsContact O-CG 3.29Å; A7-K11 WeakPolarHBondContact O-CG 3.35Å; A7-K11 PolarHBondContact O-N 3.08Å; K11-L15 WeakPolarHBondContact O-CA 3.47Å; K11-L15 WeakPolarHBondContact O-CB 3.25Å; K11-L15 PolarHBondContact O-N 3.48Å
12	K	53.8	Low	61.5	Low	164 Å²	164	90.1 Å²	90.1	71%	0.713	48%	0.479	S	S	*	.	H	α-helix	trans	-70.7	-41.6	178.5	-172.6	178.6	-179.5	-175.9	0	111.3	M8 G9 G10 N16	M8-K12 WeakPolarHBondContact O-CB 3.35Å; M8-K12 PolarHBondContact O-N 3.06Å; G9-K12 PolarHBondContact O-N 3.3Å; G10-K12 VanDerWaalsContact C-N 3.28Å; G10-K12 PolarHBondContact O-N 2.66Å; K12-N16 WeakPolarHBondContact O-CB 3.18Å; K12-N16 PolarHBondContact O-N 3.43Å
13	A	56.7	Low	62.9	Low	57 Å²	57	83.4 Å²	83.4	47%	0.471	45%	0.448	S	S	.	.	H	α-helix	trans	-65.6	-47.4	174.8	0	0	0	0	0	111.3	G9 G10 N16 I17	G9-A13 WeakPolarHBondContact O-CB 3.45Å; G9-A13 PolarHBondContact O-N 3.47Å; G10-A13 PolarHBondContact O-N 2.93Å; A13-N16 WeakPolarHBondContact O-CB 3.38Å; A13-N16 PolarHBondContact O-N 2.93Å; A13-N16 VanDerWaalsContact O-N 3.16Å; A13-I17 WeakPolarHBondContact O-CG1 3.47Å; A13-I17 PolarHBondContact O-N 3.37Å
14	E	52.3	Low	64.2	Low	134 Å²	134	76.7 Å²	76.7	63%	0.626	41%	0.412	S	S	*	.	H	α-helix	trans	-62.2	-43.6	176.8	-171	-178	-178.1	0	0	111.7	G10 N16 I17 R18	G10-E14 VanDerWaalsContact O-CB 3.24Å; G10-E14 WeakPolarHBondContact O-CB 3.35Å; G10-E14 PolarHBondContact O-N 2.89Å; E14-N16 VanDerWaalsContact C-N 3.29Å; E14-N16 PolarHBondContact O-N 3.04Å; E14-I17 PolarHBondContact O-N 3.22Å; E14-R18 VanDerWaalsContact O-CB 3.31Å; E14-R18 WeakPolarHBondContact O-CB 3.46Å; E14-R18 PolarHBondContact O-N 3.32Å
15	L	54.5	Low	66.1	Low	85 Å²	85	71.9 Å²	71.9	45%	0.445	39%	0.388	S	S	.	.	H	α-helix	trans	-62.1	-38.2	174.7	-175	70.1	0	0	0	111.1	K11 T19	K11-L15 WeakPolarHBondContact O-CA 3.47Å; K11-L15 WeakPolarHBondContact O-CB 3.25Å; K11-L15 PolarHBondContact O-N 3.48Å; L15-T19 VanDerWaalsContact O-CB 3.29Å; L15-T19 WeakPolarHBondContact O-CB 3.38Å; L15-T19 PolarHBondContact O-N 2.83Å; L15-T19 PolarHBondContact O-OG1 3Å
16	N	67.8	Low	67.6	Low	94 Å²	94	69 Å²	69	50%	0.503	37%	0.374	S	S	.	.	H	α-helix	trans	-66.4	-46.7	178.9	-153.4	10.4	0	0	0	110.8	K12 A13 E14 T19 V20	K12-N16 WeakPolarHBondContact O-CB 3.18Å; K12-N16 PolarHBondContact O-N 3.43Å; A13-N16 WeakPolarHBondContact O-CB 3.38Å; A13-N16 PolarHBondContact O-N 2.93Å; A13-N16 VanDerWaalsContact O-N 3.16Å; E14-N16 VanDerWaalsContact C-N 3.29Å; E14-N16 PolarHBondContact O-N 3.04Å; N16-T19 PolarHBondContact O-N 2.98Å; N16-V20 WeakPolarHBondContact O-CB 3.2Å; N16-V20 VanDerWaalsContact O-CG2 3.22Å; N16-V20 WeakPolarHBondContact O-CG2 3.19Å; N16-V20 PolarHBondContact O-N 3.35Å; N16-V20 VanDerWaalsContact O-N 3.07Å
17	I	69.9	Low	68.9	Low	92 Å²	92	66.3 Å²	66.3	47%	0.472	35%	0.353	S	S	.	.	H	α-helix	trans	-60.8	-49.1	175.8	-65	167.7	0	0	0	110.5	A13 E14 T19 V20 I21	A13-I17 WeakPolarHBondContact O-CG1 3.47Å; A13-I17 PolarHBondContact O-N 3.37Å; E14-I17 PolarHBondContact O-N 3.22Å; I17-T19 VanDerWaalsContact C-N 3.34Å; I17-T19 PolarHBondContact O-N 2.94Å; I17-V20 WeakPolarHBondContact O-CB 3.45Å; I17-V20 PolarHBondContact O-N 3.49Å; I17-V20 VanDerWaalsContact O-N 3.14Å; I17-I21 HydrophobicContact CG2-CD1 3.77Å; I17-I21 HydrophobicContact CG2-CG1 4.39Å; I17-I21 WeakPolarHBondContact O-CG1 3.47Å; I17-I21 PolarHBondContact O-N 3.15Å
18	R	77.3	Confident	70.5	Confident	148 Å²	148	63.8 Å²	63.8	56%	0.558	33%	0.332	S	S	*	.	H	α-helix	trans	-61.5	-40.3	179.2	-170.5	178	-178	-65.4	-8.8	112.5	E14 V20 I21 D22	E14-R18 VanDerWaalsContact O-CB 3.31Å; E14-R18 WeakPolarHBondContact O-CB 3.46Å; E14-R18 PolarHBondContact O-N 3.32Å; R18-V20 VanDerWaalsContact C-N 3.27Å; R18-V20 PolarHBondContact O-N 3.44Å; R18-I21 PolarHBondContact O-N 3.19Å; R18-D22 IonicContact CZ-OD1 3.8Å; R18-D22 IonicContact CZ-OD2 2.69Å; R18-D22 IonicContact NH1-OD1 2.89Å; R18-D22 IonicContact NH1-OD2 3.55Å; R18-D22 PolarHBondContact NH1-OD2 2.92Å; R18-D22 WeakPolarHBondContact O-CB 3.38Å; R18-D22 PolarHBondContact O-N 3.29Å
19	T	79.2	Confident	72.6	Confident	7 Å²	7	61.3 Å²	61.3	4%	0.043	32%	0.321	C	S	.	.	H	α-helix	trans	-63.1	-40	177.5	-54	0	0	0	0	110.6	L15 N16 I17 D22 L23 L152 Q156	L15-T19 VanDerWaalsContact O-CB 3.29Å; L15-T19 WeakPolarHBondContact O-CB 3.38Å; L15-T19 PolarHBondContact O-N 2.83Å; L15-T19 PolarHBondContact O-OG1 3Å; N16-T19 PolarHBondContact O-N 2.98Å; I17-T19 VanDerWaalsContact C-N 3.34Å; I17-T19 PolarHBondContact O-N 2.94Å; T19-D22 PolarHBondContact O-N 3.45Å; T19-L23 WeakPolarHBondContact O-CG 3.33Å; T19-L23 PolarHBondContact O-N 3.22Å; T19-L152 HydrophobicContact CG2-CD2 3.34Å; T19-Q156 PolarHBondContact OG1-NE2 3.06Å
20	V	77.4	Confident	74.4	Confident	26 Å²	26	66.7 Å²	66.7	16%	0.158	33%	0.333	C	S	.	.	H	α-helix	trans	-68.7	-40.7	178.4	170.8	0	0	0	0	112	N16 I17 R18 L23 T24 L56	N16-V20 WeakPolarHBondContact O-CB 3.2Å; N16-V20 VanDerWaalsContact O-CG2 3.22Å; N16-V20 WeakPolarHBondContact O-CG2 3.19Å; N16-V20 PolarHBondContact O-N 3.35Å; N16-V20 VanDerWaalsContact O-N 3.07Å; I17-V20 WeakPolarHBondContact O-CB 3.45Å; I17-V20 PolarHBondContact O-N 3.49Å; I17-V20 VanDerWaalsContact O-N 3.14Å; R18-V20 VanDerWaalsContact C-N 3.27Å; R18-V20 PolarHBondContact O-N 3.44Å; V20-L23 PolarHBondContact O-N 3Å; V20-T24 PolarHBondContact O-N 2.69Å; V20-T24 PolarHBondContact O-OG1 3.1Å; V20-L56 HydrophobicContact CB-CD2 4.43Å; V20-L56 HydrophobicContact CG1-CD2 2.94Å; V20-L56 HydrophobicContact CG1-CG 4.43Å
21	I	83.3	Confident	76	Confident	11 Å²	11	65.6 Å²	65.6	6%	0.056	32%	0.319	C	S	.	.	H	α-helix	trans	-58.6	-51.3	171.1	-67.6	163.5	0	0	0	109.9	I17 R18 L23 T24 V25 V42	I17-I21 HydrophobicContact CG2-CD1 3.77Å; I17-I21 HydrophobicContact CG2-CG1 4.39Å; I17-I21 WeakPolarHBondContact O-CG1 3.47Å; I17-I21 PolarHBondContact O-N 3.15Å; R18-I21 PolarHBondContact O-N 3.19Å; I21-L23 PolarHBondContact O-N 3.35Å; I21-T24 WeakPolarHBondContact O-CB 3.38Å; I21-T24 PolarHBondContact O-N 3.23Å; I21-V25 HydrophobicContact CG2-CG2 4.39Å; I21-V25 WeakPolarHBondContact O-CG2 3.27Å; I21-V25 PolarHBondContact O-N 3.01Å; I21-V42 HydrophobicContact CB-CG1 4.26Å; I21-V42 HydrophobicContact CG1-CG1 4.04Å; I21-V42 HydrophobicContact CG2-CB 4.03Å; I21-V42 HydrophobicContact CG2-CG1 3.84Å
22	D	85.6	Confident	77.4	Confident	31 Å²	31	58.8 Å²	58.8	17%	0.166	29%	0.29	C	S	.	.	H	α-helix	trans	-62.8	-27.8	-178.8	-67.5	-12.5	0	0	0	112.4	R18 T19 D26 R155	R18-D22 IonicContact CZ-OD1 3.8Å; R18-D22 IonicContact CZ-OD2 2.69Å; R18-D22 IonicContact NH1-OD1 2.89Å; R18-D22 IonicContact NH1-OD2 3.55Å; R18-D22 PolarHBondContact NH1-OD2 2.92Å; R18-D22 WeakPolarHBondContact O-CB 3.38Å; R18-D22 PolarHBondContact O-N 3.29Å; T19-D22 PolarHBondContact O-N 3.45Å; D22-D26 VanDerWaalsContact O-CB 3.25Å; D22-D26 WeakPolarHBondContact O-CB 3.43Å; D22-D26 PolarHBondContact O-N 3.17Å; D22-D26 VanDerWaalsContact O-N 3.08Å; D22-R155 VanDerWaalsContact CB-CZ 3.43Å; D22-R155 PolarHBondContact O-NH1 3.27Å; D22-R155 IonicContact OD2-CZ 3.59Å; D22-R155 IonicContact OD2-NH2 3.74Å; D22-R155 PolarHBondContact OD2-NH2 2.88Å
23	L	85.3	Confident	78.6	Confident	18 Å²	18	54.8 Å²	54.8	9%	0.094	28%	0.281	C	S	.	.	H	α-helix	trans	-73.6	-35.9	172.9	-76.4	-176.7	0	0	0	112.6	T19 V20 I21 Y27 L148 V151 L152	T19-L23 WeakPolarHBondContact O-CG 3.33Å; T19-L23 PolarHBondContact O-N 3.22Å; V20-L23 PolarHBondContact O-N 3Å; I21-L23 PolarHBondContact O-N 3.35Å; L23-Y27 WeakPolarHBondContact O-CB 3.31Å; L23-Y27 PolarHBondContact O-N 2.97Å; L23-L148 HydrophobicContact CD1-CG 4.48Å; L23-V151 HydrophobicContact CD1-CG1 4.37Å; L23-V151 HydrophobicContact CD2-CG1 3.48Å; L23-V151 VanDerWaalsContact CD2-CG1 3.48Å; L23-L152 HydrophobicContact CD1-CD2 3.32Å; L23-L152 HydrophobicContact CD1-CG 3.65Å; L23-L152 HydrophobicContact CG-CD2 4.25Å
24	T	85.8	Confident	79.8	Confident	1 Å²	1	61 Å²	61	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-67	-45.2	176.8	-54.8	0	0	0	0	109.9	V20 I21 Y27 F28 L37 F83	V20-T24 PolarHBondContact O-N 2.69Å; V20-T24 PolarHBondContact O-OG1 3.1Å; I21-T24 WeakPolarHBondContact O-CB 3.38Å; I21-T24 PolarHBondContact O-N 3.23Å; T24-Y27 WeakPolarHBondContact O-CB 3.45Å; T24-Y27 PolarHBondContact O-N 3.15Å; T24-F28 HydrophobicContact CG2-CD2 4.3Å; T24-F28 HydrophobicContact CG2-CE2 4.33Å; T24-F28 WeakPolarHBondContact O-CD2 3.34Å; T24-F28 PolarHBondContact O-N 3.41Å; T24-F28 VanDerWaalsContact O-N 3.07Å; T24-L37 HydrophobicContact CG2-CD2 3.79Å; T24-F83 HydrophobicContact CG2-CD2 3.69Å; T24-F83 HydrophobicContact CG2-CE2 3.31Å; T24-F83 HydrophobicContact CG2-CZ 3.86Å
25	V	88.2	Confident	81.3	Confident	20 Å²	20	58.4 Å²	58.4	12%	0.121	28%	0.284	C	S	.	.	H	α-helix	trans	-60.3	-48.6	174.7	176.6	0	0	0	0	110.6	I21 Y27 F28 D29 L37 A39 V42	I21-V25 HydrophobicContact CG2-CG2 4.39Å; I21-V25 WeakPolarHBondContact O-CG2 3.27Å; I21-V25 PolarHBondContact O-N 3.01Å; V25-Y27 VanDerWaalsContact C-N 3.27Å; V25-Y27 PolarHBondContact O-N 3.12Å; V25-F28 PolarHBondContact O-N 3.36Å; V25-F28 VanDerWaalsContact O-N 3.09Å; V25-D29 PolarHBondContact O-N 3.21Å; V25-L37 HydrophobicContact CG2-CD2 4.34Å; V25-A39 HydrophobicContact CG2-CB 4.03Å; V25-V42 HydrophobicContact CG2-CG2 4.4Å
26	D	88.5	Confident	82.8	Confident	54 Å²	54	60 Å²	60	29%	0.289	29%	0.289	S	S	.	.	H	α-helix	trans	-61.1	-32.8	176.4	179.2	52	0	0	0	113	D22 K30	D22-D26 VanDerWaalsContact O-CB 3.25Å; D22-D26 WeakPolarHBondContact O-CB 3.43Å; D22-D26 PolarHBondContact O-N 3.17Å; D22-D26 VanDerWaalsContact O-N 3.08Å; D26-K30 WeakPolarHBondContact O-CB 3.45Å; D26-K30 WeakPolarHBondContact O-CD 3.45Å; D26-K30 VanDerWaalsContact O-CG 3.29Å; D26-K30 WeakPolarHBondContact O-CG 3.35Å; D26-K30 PolarHBondContact O-N 3.48Å; D26-K30 VanDerWaalsContact O-N 3.16Å; D26-K30 WeakPolarHBondContact OD1-CE 3.44Å; D26-K30 IonicContact OD1-NZ 2.84Å; D26-K30 PolarHBondContact OD1-NZ 2.95Å; D26-K30 IonicContact OD2-NZ 3.82Å; D26-K30 PolarHBondContact OD2-NZ 3.35Å
27	Y	87.9	Confident	83.7	Confident	48 Å²	48	55.8 Å²	55.8	19%	0.188	27%	0.266	C	S	.	.	H	α-helix	trans	-64	-47.2	172.8	173.1	-92.7	0	0	0	111.4	L23 T24 V25 K30 T31 L60 L63 Y74	L23-Y27 WeakPolarHBondContact O-CB 3.31Å; L23-Y27 PolarHBondContact O-N 2.97Å; T24-Y27 WeakPolarHBondContact O-CB 3.45Å; T24-Y27 PolarHBondContact O-N 3.15Å; V25-Y27 VanDerWaalsContact C-N 3.27Å; V25-Y27 PolarHBondContact O-N 3.12Å; Y27-K30 PolarHBondContact O-N 3.16Å; Y27-T31 HydrophobicContact CD2-CG2 4.3Å; Y27-T31 HydrophobicContact CE1-CG2 4.33Å; Y27-T31 HydrophobicContact CE2-CG2 3.94Å; Y27-T31 WeakPolarHBondContact O-CB 3.2Å; Y27-T31 VanDerWaalsContact O-CG2 3.28Å; Y27-T31 WeakPolarHBondContact O-CG2 3.28Å; Y27-T31 PolarHBondContact O-N 3.37Å; Y27-T31 VanDerWaalsContact O-N 3.1Å; Y27-T31 PolarHBondContact O-OG1 3.41Å; Y27-L60 HydrophobicContact CD1-CD2 4.02Å; Y27-L60 HydrophobicContact CE1-CD2 4.43Å; Y27-L60 HydrophobicContact CG-CD2 4.17Å; Y27-L63 HydrophobicContact CE1-CB 4.14Å; Y27-L63 HydrophobicContact CE1-CD1 4.29Å; Y27-Y74 VanDerWaalsContact CE1-OH 3.29Å; Y27-Y74 WeakPolarHBondContact CE1-OH 3.3Å
28	F	88.2	Confident	84.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-68.5	-41.2	177.8	-85.1	-87.4	0	0	0	112.1	T24 V25 K30 T31 S32 L37 L63 P79 L82 F83	T24-F28 HydrophobicContact CG2-CD2 4.3Å; T24-F28 HydrophobicContact CG2-CE2 4.33Å; T24-F28 WeakPolarHBondContact O-CD2 3.34Å; T24-F28 PolarHBondContact O-N 3.41Å; T24-F28 VanDerWaalsContact O-N 3.07Å; V25-F28 PolarHBondContact O-N 3.36Å; V25-F28 VanDerWaalsContact O-N 3.09Å; F28-K30 PolarHBondContact O-N 3.44Å; F28-K30 VanDerWaalsContact O-N 3.16Å; F28-T31 WeakPolarHBondContact CA-OG1 3.4Å; F28-T31 PolarHBondContact O-N 3Å; F28-S32 WeakPolarHBondContact O-CB 3.13Å; F28-S32 PolarHBondContact O-N 2.92Å; F28-L37 HydrophobicContact CB-CB 3.78Å; F28-L37 HydrophobicContact CB-CD2 4.35Å; F28-L37 HydrophobicContact CD2-CB 4.37Å; F28-L37 HydrophobicContact CD2-CD2 3.54Å; F28-L37 HydrophobicContact CD2-CG 4.43Å; F28-L37 HydrophobicContact CE2-CD2 4.01Å; F28-L37 HydrophobicContact CG-CB 4.06Å; F28-L37 HydrophobicContact CG-CD2 4.09Å; F28-L63 HydrophobicContact CE2-CD1 3.62Å; F28-L63 HydrophobicContact CZ-CD1 3.51Å; F28-L63 HydrophobicContact CZ-CD2 3.97Å; F28-L63 HydrophobicContact CZ-CG 4.38Å; F28-P79 HydrophobicContact CD1-CB 3.68Å; F28-P79 HydrophobicContact CD1-CG 4.42Å; F28-P79 HydrophobicContact CE1-CB 3.99Å; F28-P79 HydrophobicContact CG-CB 4.38Å; F28-L82 HydrophobicContact CE1-CD2 4.21Å; F28-F83 HydrophobicContact CE2-CB 3.96Å; F28-F83 AromaticContact CE2-CD2 3.92Å; F28-F83 HydrophobicContact CE2-CD2 3.92Å; F28-F83 HydrophobicContact CE2-CG 4.3Å; F28-F83 HydrophobicContact CZ-CB 3.85Å; F28-F83 HydrophobicContact CZ-CD2 4.48Å
29	D	87.9	Confident	84.9	Confident	70 Å²	70	49.4 Å²	49.4	37%	0.374	25%	0.25	S	C	.	.	H	α-helix	trans	-58.2	-32.3	175.7	-72.1	-20.1	0	0	0	112.7	V25 H36	V25-D29 PolarHBondContact O-N 3.21Å; D29-H36 IonicContact OD1-CE1 2.97Å; D29-H36 IonicContact OD1-CG 3.96Å; D29-H36 IonicContact OD1-ND1 3.75Å; D29-H36 PolarHBondContact OD1-ND1 2.97Å
30	K	87.5	Confident	85.3	Confident	152 Å²	152	54.3 Å²	54.3	66%	0.661	28%	0.275	S	S	*	.	H	α-helix	trans	-83.3	-24	176.5	-74.6	170.3	179.3	157.4	0	114.1	D26 Y27 F28	D26-K30 WeakPolarHBondContact O-CB 3.45Å; D26-K30 WeakPolarHBondContact O-CD 3.45Å; D26-K30 VanDerWaalsContact O-CG 3.29Å; D26-K30 WeakPolarHBondContact O-CG 3.35Å; D26-K30 PolarHBondContact O-N 3.48Å; D26-K30 VanDerWaalsContact O-N 3.16Å; D26-K30 WeakPolarHBondContact OD1-CE 3.44Å; D26-K30 IonicContact OD1-NZ 2.84Å; D26-K30 PolarHBondContact OD1-NZ 2.95Å; D26-K30 IonicContact OD2-NZ 3.82Å; D26-K30 PolarHBondContact OD2-NZ 3.35Å; Y27-K30 PolarHBondContact O-N 3.16Å; F28-K30 PolarHBondContact O-N 3.44Å; F28-K30 VanDerWaalsContact O-N 3.16Å
31	T	85.6	Confident	85.7	Confident	17 Å²	17	53.7 Å²	53.7	10%	0.104	27%	0.271	C	S	.	.	H	α-helix	trans	-109.3	-21.7	-170.2	55.5	0	0	0	0	114	Y27 F28 Y74	Y27-T31 HydrophobicContact CD2-CG2 4.3Å; Y27-T31 HydrophobicContact CE1-CG2 4.33Å; Y27-T31 HydrophobicContact CE2-CG2 3.94Å; Y27-T31 WeakPolarHBondContact O-CB 3.2Å; Y27-T31 VanDerWaalsContact O-CG2 3.28Å; Y27-T31 WeakPolarHBondContact O-CG2 3.28Å; Y27-T31 PolarHBondContact O-N 3.37Å; Y27-T31 VanDerWaalsContact O-N 3.1Å; Y27-T31 PolarHBondContact O-OG1 3.41Å; F28-T31 WeakPolarHBondContact CA-OG1 3.4Å; F28-T31 PolarHBondContact O-N 3Å; T31-Y74 PolarHBondContact OG1-OH 3.47Å
32	S	83.9	Confident	85.8	Confident	6 Å²	6	53.3 Å²	53.3	4%	0.042	27%	0.269	C	S	.	.			trans	-112.3	100.4	179.6	-65.2	0	0	0	0	109.1	F28 Y34 D35	F28-S32 WeakPolarHBondContact O-CB 3.13Å; F28-S32 PolarHBondContact O-N 2.92Å; S32-Y34 VanDerWaalsContact C-N 3.31Å; S32-Y34 PolarHBondContact O-N 3.25Å; S32-D35 VanDerWaalsContact CB-O 3.31Å; S32-D35 WeakPolarHBondContact CB-O 3.25Å
33	P	77.9	Confident	85.8	Confident	79 Å²	79	54.5 Å²	54.5	51%	0.513	28%	0.28	S	S	.	.	S	Bend	trans	-76.4	-16.9	-175.7	28.1	-33.3	0	0	0	114	E75	P33-E75 WeakPolarHBondContact CD-OE1 3.24Å
34	Y	81.6	Confident	85.7	Confident	188 Å²	188	59.6 Å²	59.6	74%	0.737	30%	0.298	S	S	*	.	S	Bend	trans	-108.4	-14.4	-170.2	-56.8	-61.1	0	0	0	114.4	S32 E75	S32-Y34 VanDerWaalsContact C-N 3.31Å; S32-Y34 PolarHBondContact O-N 3.25Å; Y34-E75 HydrophobicContact CD2-CB 4.41Å
35	D	84.9	Confident	85.6	Confident	80 Å²	80	59.6 Å²	59.6	43%	0.428	30%	0.298	S	S	.	.			trans	-153.8	153	-175.4	-160.1	7.2	0	0	0	110.2	S32 P79	S32-D35 VanDerWaalsContact CB-O 3.31Å; S32-D35 WeakPolarHBondContact CB-O 3.25Å; D35-P79 HydrophobicContact CB-CG 3.78Å; D35-P79 WeakPolarHBondContact OD2-CD 3.18Å
36	H	85.4	Confident	85.2	Confident	118 Å²	118	59.8 Å²	59.8	55%	0.546	30%	0.3	S	S	.	.			trans	-116.6	145.6	-175.1	-65.1	-69.8	0	0	0	110.6	D29	D29-H36 IonicContact OD1-CE1 2.97Å; D29-H36 IonicContact OD1-CG 3.96Å; D29-H36 IonicContact OD1-ND1 3.75Å; D29-H36 PolarHBondContact OD1-ND1 2.97Å
37	L	86.9	Confident	84.6	Confident	6 Å²	6	60.9 Å²	60.9	3%	0.031	32%	0.316	C	S	.	.			trans	-79.5	124	175.4	-175.8	72.6	0	0	0	109.6	T24 V25 F28 A39 V42 P79 D80 F83	T24-L37 HydrophobicContact CG2-CD2 3.79Å; V25-L37 HydrophobicContact CG2-CD2 4.34Å; F28-L37 HydrophobicContact CB-CB 3.78Å; F28-L37 HydrophobicContact CB-CD2 4.35Å; F28-L37 HydrophobicContact CD2-CB 4.37Å; F28-L37 HydrophobicContact CD2-CD2 3.54Å; F28-L37 HydrophobicContact CD2-CG 4.43Å; F28-L37 HydrophobicContact CE2-CD2 4.01Å; F28-L37 HydrophobicContact CG-CB 4.06Å; F28-L37 HydrophobicContact CG-CD2 4.09Å; L37-A39 PolarHBondContact O-N 3.27Å; L37-V42 HydrophobicContact CD1-CG2 3.99Å; L37-V42 HydrophobicContact CD2-CG2 3.26Å; L37-V42 HydrophobicContact CG-CG2 3.45Å; L37-V42 VanDerWaalsContact CG-CG2 3.45Å; L37-P79 HydrophobicContact CB-CB 4.07Å; L37-P79 HydrophobicContact CD1-CB 4.04Å; L37-D80 WeakPolarHBondContact CD1-OD1 3.37Å; L37-F83 HydrophobicContact CD1-CB 3.82Å; L37-F83 HydrophobicContact CD1-CD1 4.43Å; L37-F83 HydrophobicContact CD1-CG 4.26Å; L37-F83 HydrophobicContact CD2-CG 4.35Å
38	D	86.6	Confident	83.8	Confident	64 Å²	64	63.8 Å²	63.8	34%	0.342	33%	0.331	S	S	.	.			trans	-69.6	116.5	178.4	176.2	21.8	0	0	0	110.5	N40 F41 V42 D80	D38-N40 PolarHBondContact O-N 3.5Å; D38-N40 VanDerWaalsContact O-N 3.16Å; D38-N40 PolarHBondContact OD1-N 3.07Å; D38-N40 PolarHBondContact OD1-ND2 2.7Å; D38-F41 HydrophobicContact CB-CB 3.9Å; D38-F41 WeakPolarHBondContact O-CB 3.38Å; D38-F41 PolarHBondContact O-N 3.08Å; D38-F41 PolarHBondContact OD2-N 2.93Å; D38-V42 WeakPolarHBondContact O-CG2 3.41Å; D38-V42 PolarHBondContact O-N 3.3Å; D38-D80 PolarHBondContact N-OD1 3.4Å
39	A	86.4	Confident	82.9	Confident	41 Å²	41	65.2 Å²	65.2	34%	0.339	35%	0.347	S	S	.	.	H	α-helix	trans	-57.2	-32.1	177.8	0	0	0	0	0	112.6	V25 L37 S43	V25-A39 HydrophobicContact CG2-CB 4.03Å; L37-A39 PolarHBondContact O-N 3.27Å; A39-S43 WeakPolarHBondContact O-CB 3.3Å; A39-S43 PolarHBondContact O-N 3.47Å
40	N	86.6	Confident	81.7	Confident	110 Å²	110	66.1 Å²	66.1	59%	0.588	36%	0.363	S	S	*	.	H	α-helix	trans	-72.6	-34.9	177	-59	-62	0	0	0	111.9	D38 R44	D38-N40 PolarHBondContact O-N 3.5Å; D38-N40 VanDerWaalsContact O-N 3.16Å; D38-N40 PolarHBondContact OD1-N 3.07Å; D38-N40 PolarHBondContact OD1-ND2 2.7Å; N40-R44 WeakPolarHBondContact O-CB 3.35Å; N40-R44 VanDerWaalsContact O-CG 3.31Å; N40-R44 WeakPolarHBondContact O-CG 3.35Å; N40-R44 PolarHBondContact O-N 2.98Å; N40-R44 PolarHBondContact O-NE 3.26Å
41	F	86.2	Confident	81	Confident	14 Å²	14	60.2 Å²	60.2	6%	0.061	34%	0.34	C	S	.	.	H	α-helix	trans	-61.9	-50	172.1	177.6	-102.9	0	0	0	110.8	D38 S43 R44 L45 D80 F83 A84 C112	D38-F41 HydrophobicContact CB-CB 3.9Å; D38-F41 WeakPolarHBondContact O-CB 3.38Å; D38-F41 PolarHBondContact O-N 3.08Å; D38-F41 PolarHBondContact OD2-N 2.93Å; F41-S43 PolarHBondContact O-N 3.5Å; F41-R44 PolarHBondContact O-N 3.35Å; F41-L45 HydrophobicContact CE1-CD2 4.02Å; F41-L45 HydrophobicContact CZ-CD2 4.07Å; F41-L45 WeakPolarHBondContact O-CB 3.42Å; F41-L45 PolarHBondContact O-N 2.94Å; F41-D80 HydrophobicContact CD1-CB 3.85Å; F41-D80 HydrophobicContact CE1-CB 3.8Å; F41-D80 VanDerWaalsContact CE1-O 3.3Å; F41-D80 WeakPolarHBondContact CE1-O 3.32Å; F41-D80 HydrophobicContact CG-CB 4.37Å; F41-D80 HydrophobicContact CZ-CB 4.28Å; F41-F83 HydrophobicContact CE1-CD1 4.43Å; F41-A84 HydrophobicContact CE1-CB 4.26Å; F41-A84 HydrophobicContact CZ-CB 4Å; F41-C112 HydrophobicContact CE2-CB 4.39Å; F41-C112 HydrophobicContact CZ-CB 4.44Å
42	V	86	Confident	80.8	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.012	35%	0.345	C	S	.	.	H	α-helix	trans	-61.1	-44	177.9	-175.7	0	0	0	0	111.5	I21 V25 L37 D38 R44 L45 S46 F83	I21-V42 HydrophobicContact CB-CG1 4.26Å; I21-V42 HydrophobicContact CG1-CG1 4.04Å; I21-V42 HydrophobicContact CG2-CB 4.03Å; I21-V42 HydrophobicContact CG2-CG1 3.84Å; V25-V42 HydrophobicContact CG2-CG2 4.4Å; L37-V42 HydrophobicContact CD1-CG2 3.99Å; L37-V42 HydrophobicContact CD2-CG2 3.26Å; L37-V42 HydrophobicContact CG-CG2 3.45Å; L37-V42 VanDerWaalsContact CG-CG2 3.45Å; D38-V42 WeakPolarHBondContact O-CG2 3.41Å; D38-V42 PolarHBondContact O-N 3.3Å; V42-R44 PolarHBondContact O-N 3.32Å; V42-L45 PolarHBondContact O-N 3.02Å; V42-S46 WeakPolarHBondContact O-CB 3.2Å; V42-S46 PolarHBondContact O-N 3.48Å; V42-F83 HydrophobicContact CB-CE1 4.29Å; V42-F83 HydrophobicContact CG1-CE1 3.76Å; V42-F83 HydrophobicContact CG1-CZ 3.95Å; V42-F83 HydrophobicContact CG2-CD1 4.16Å; V42-F83 HydrophobicContact CG2-CE1 4.08Å
43	S	83.8	Confident	80.7	Confident	56 Å²	56	64.9 Å²	64.9	39%	0.392	37%	0.371	S	S	.	.	H	α-helix	trans	-63.1	-42.7	179.6	-173.2	0	0	0	0	112.3	A39 F41 A47	A39-S43 WeakPolarHBondContact O-CB 3.3Å; A39-S43 PolarHBondContact O-N 3.47Å; F41-S43 PolarHBondContact O-N 3.5Å; S43-A47 VanDerWaalsContact O-CB 3.24Å; S43-A47 WeakPolarHBondContact O-CB 3.06Å; S43-A47 PolarHBondContact O-N 3.11Å
44	R	84.6	Confident	81.2	Confident	125 Å²	125	63.7 Å²	63.7	47%	0.472	36%	0.364	S	S	.	.	H	α-helix	trans	-64.8	-49.7	176.1	-75.6	-178	-67.5	167	-0.8	110.8	N40 F41 V42 S46 A47 E48	N40-R44 WeakPolarHBondContact O-CB 3.35Å; N40-R44 VanDerWaalsContact O-CG 3.31Å; N40-R44 WeakPolarHBondContact O-CG 3.35Å; N40-R44 PolarHBondContact O-N 2.98Å; N40-R44 PolarHBondContact O-NE 3.26Å; F41-R44 PolarHBondContact O-N 3.35Å; V42-R44 PolarHBondContact O-N 3.32Å; R44-S46 VanDerWaalsContact C-N 3.32Å; R44-S46 PolarHBondContact O-N 3.38Å; R44-A47 PolarHBondContact O-N 2.97Å; R44-A47 VanDerWaalsContact O-N 3.17Å; R44-E48 WeakPolarHBondContact O-CB 3.3Å; R44-E48 WeakPolarHBondContact O-CG 3.41Å; R44-E48 PolarHBondContact O-N 2.97Å
45	L	83.7	Confident	81.5	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-62.6	-40.1	-178.6	-169.1	61	0	0	0	112.3	F41 V42 G49 F83 A84 L87 W108	F41-L45 HydrophobicContact CE1-CD2 4.02Å; F41-L45 HydrophobicContact CZ-CD2 4.07Å; F41-L45 WeakPolarHBondContact O-CB 3.42Å; F41-L45 PolarHBondContact O-N 2.94Å; V42-L45 PolarHBondContact O-N 3.02Å; L45-G49 PolarHBondContact O-N 3.4Å; L45-F83 HydrophobicContact CD2-CD1 4.14Å; L45-F83 HydrophobicContact CD2-CE1 4.08Å; L45-A84 HydrophobicContact CD2-CB 3.94Å; L45-L87 HydrophobicContact CD2-CD2 3.99Å; L45-L87 HydrophobicContact CG-CD2 4.12Å; L45-W108 HydrophobicContact CD1-CE3 3.84Å; L45-W108 HydrophobicContact CD1-CZ3 3.54Å; L45-W108 HydrophobicContact CD2-CZ3 4.13Å; L45-W108 HydrophobicContact CG-CZ3 3.89Å
46	S	78.2	Confident	81.7	Confident	24 Å²	24	51.6 Å²	51.6	17%	0.168	31%	0.313	C	S	.	.	H	α-helix	trans	-68.1	-34.9	176.8	-173.2	0	0	0	0	112.7	V42 R44 V51	V42-S46 WeakPolarHBondContact O-CB 3.2Å; V42-S46 PolarHBondContact O-N 3.48Å; R44-S46 VanDerWaalsContact C-N 3.32Å; R44-S46 PolarHBondContact O-N 3.38Å; S46-V51 PolarHBondContact O-N 3.2Å
47	A	76.6	Confident	82	Confident	76 Å²	76	46.3 Å²	46.3	63%	0.628	29%	0.288	S	S	*	.	H	α-helix	trans	-76.6	-44.7	179	0	0	0	0	0	111.9	S43 R44	S43-A47 VanDerWaalsContact O-CB 3.24Å; S43-A47 WeakPolarHBondContact O-CB 3.06Å; S43-A47 PolarHBondContact O-N 3.11Å; R44-A47 PolarHBondContact O-N 2.97Å; R44-A47 VanDerWaalsContact O-N 3.17Å
48	E	72.1	Confident	82.3	Confident	109 Å²	109	46.3 Å²	46.3	51%	0.509	29%	0.288	S	S	.	.	H	α-helix	trans	-72.2	-39.2	-179.3	-69.3	177.4	-161.9	0	0	112.2	R44 A50 S111	R44-E48 WeakPolarHBondContact O-CB 3.3Å; R44-E48 WeakPolarHBondContact O-CG 3.41Å; R44-E48 PolarHBondContact O-N 2.97Å; E48-A50 VanDerWaalsContact C-N 3.27Å; E48-A50 PolarHBondContact O-N 3.32Å; E48-S111 WeakPolarHBondContact OE2-CA 3.37Å; E48-S111 WeakPolarHBondContact OE2-CB 3.38Å; E48-S111 PolarHBondContact OE2-OG 3.16Å
49	G	68	Low	82.6	Confident	31 Å²	31	43.3 Å²	43.3	32%	0.32	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	3.3	179.2	0	0	0	0	0	115	L45 V51	L45-G49 PolarHBondContact O-N 3.4Å; G49-V51 PolarHBondContact O-N 3.49Å; G49-V51 VanDerWaalsContact O-N 3.07Å
50	A	63.1	Low	82.9	Confident	88 Å²	88	42.7 Å²	42.7	73%	0.727	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.6	45.4	-174.9	0	0	0	0	0	112.9	E48 S52	E48-A50 VanDerWaalsContact C-N 3.27Å; E48-A50 PolarHBondContact O-N 3.32Å; A50-S52 PolarHBondContact O-N 2.87Å
51	V	72.7	Confident	83.3	Confident	28 Å²	28	38.3 Å²	38.3	17%	0.17	24%	0.239	C	C	.	.			trans	-67.2	118.4	-164.1	174	0	0	0	0	110.5	S46 G49 V55 L56 L87	S46-V51 PolarHBondContact O-N 3.2Å; G49-V51 PolarHBondContact O-N 3.49Å; G49-V51 VanDerWaalsContact O-N 3.07Å; V51-V55 HydrophobicContact CG1-CB 4.29Å; V51-V55 HydrophobicContact CG1-CG1 4.28Å; V51-L56 HydrophobicContact CG1-CB 4.45Å; V51-L87 HydrophobicContact CG1-CD1 3.73Å; V51-L87 HydrophobicContact CG1-CD2 4.3Å; V51-L87 HydrophobicContact CG1-CG 4.36Å; V51-L87 HydrophobicContact CG2-CD1 4.49Å; V51-L87 HydrophobicContact CG2-CD2 3.66Å; V51-L87 HydrophobicContact CG2-CG 4.24Å
52	S	80.8	Confident	83.7	Confident	31 Å²	31	37.6 Å²	37.6	22%	0.217	24%	0.236	C	C	.	.			trans	-70.6	149.3	174.5	79.3	0	0	0	0	111.1	A50 C54 V55 L56	A50-S52 PolarHBondContact O-N 2.87Å; S52-C54 PolarHBondContact O-N 3.27Å; S52-C54 VanDerWaalsContact O-N 3.12Å; S52-V55 PolarHBondContact O-N 3.33Å; S52-V55 VanDerWaalsContact O-N 3.11Å; S52-V55 WeakPolarHBondContact OG-CG2 3.26Å; S52-V55 PolarHBondContact OG-N 2.88Å; S52-L56 PolarHBondContact O-N 3.5Å
53	P	83.1	Confident	84.1	Confident	90 Å²	90	37.5 Å²	37.5	58%	0.584	24%	0.236	S	C	*	.	H	α-helix	trans	-55.7	-31.2	175.7	-26.2	34.6	0	0	0	113.3	L56 I57	P53-L56 PolarHBondContact O-N 2.64Å; P53-I57 WeakPolarHBondContact O-CG1 3.41Å; P53-I57 PolarHBondContact O-N 3.22Å; P53-I57 VanDerWaalsContact O-N 3.1Å
54	C	86.9	Confident	84.6	Confident	55 Å²	55	38 Å²	38	37%	0.372	23%	0.232	S	C	.	.	H	α-helix	trans	-65.7	-45.1	177.7	-62	0	0	0	0	112.1	S52 L56 I57 I58 L94 F141	S52-C54 PolarHBondContact O-N 3.27Å; S52-C54 VanDerWaalsContact O-N 3.12Å; C54-L56 VanDerWaalsContact C-N 3.27Å; C54-L56 PolarHBondContact O-N 3.4Å; C54-I57 PolarHBondContact O-N 2.99Å; C54-I58 WeakPolarHBondContact O-CG1 3.46Å; C54-I58 PolarHBondContact O-N 3.36Å; C54-I58 VanDerWaalsContact O-N 3.11Å; C54-L94 HydrophobicContact CB-CD2 3.98Å; C54-F141 HydrophobicContact CB-CE2 4.34Å; C54-F141 HydrophobicContact CB-CZ 4.21Å
55	V	88.8	Confident	85.1	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.012	22%	0.222	C	C	.	.	H	α-helix	trans	-59.7	-42	176.7	172.5	0	0	0	0	110.3	V51 S52 I58 A59 L87 A90 L94 F95	V51-V55 HydrophobicContact CG1-CB 4.29Å; V51-V55 HydrophobicContact CG1-CG1 4.28Å; S52-V55 PolarHBondContact O-N 3.33Å; S52-V55 VanDerWaalsContact O-N 3.11Å; S52-V55 WeakPolarHBondContact OG-CG2 3.26Å; S52-V55 PolarHBondContact OG-N 2.88Å; V55-I58 PolarHBondContact O-N 3.4Å; V55-A59 WeakPolarHBondContact O-CB 3.43Å; V55-A59 PolarHBondContact O-N 2.96Å; V55-L87 HydrophobicContact CG1-CD1 3.78Å; V55-L87 HydrophobicContact CG1-CG 4.34Å; V55-A90 HydrophobicContact CG1-CB 3.83Å; V55-A90 WeakPolarHBondContact O-CB 3.38Å; V55-L94 HydrophobicContact CG2-CB 4.35Å; V55-L94 HydrophobicContact CG2-CD2 3.67Å; V55-F95 HydrophobicContact CG2-CD2 4.29Å; V55-F95 HydrophobicContact CG2-CE2 3.49Å; V55-F95 VanDerWaalsContact CG2-CE2 3.49Å; V55-F95 HydrophobicContact CG2-CZ 4.07Å
56	L	89.1	Confident	85.6	Confident	12 Å²	12	35.4 Å²	35.4	6%	0.063	22%	0.222	C	C	.	.	H	α-helix	trans	-64	-43.6	178.3	-178.2	67.9	0	0	0	112.7	V20 V51 S52 P53 C54 I58 A59 L60 F83 L87	V20-L56 HydrophobicContact CB-CD2 4.43Å; V20-L56 HydrophobicContact CG1-CD2 2.94Å; V20-L56 HydrophobicContact CG1-CG 4.43Å; V51-L56 HydrophobicContact CG1-CB 4.45Å; S52-L56 PolarHBondContact O-N 3.5Å; P53-L56 PolarHBondContact O-N 2.64Å; C54-L56 VanDerWaalsContact C-N 3.27Å; C54-L56 PolarHBondContact O-N 3.4Å; L56-I58 VanDerWaalsContact C-N 3.26Å; L56-I58 PolarHBondContact O-N 3.34Å; L56-A59 WeakPolarHBondContact O-CB 3.25Å; L56-A59 PolarHBondContact O-N 3.24Å; L56-L60 HydrophobicContact CD1-CG 4.42Å; L56-L60 HydrophobicContact CG-CD1 4.23Å; L56-L60 HydrophobicContact CG-CG 4.41Å; L56-L60 WeakPolarHBondContact O-CG 3.34Å; L56-L60 PolarHBondContact O-N 3.44Å; L56-F83 HydrophobicContact CD1-CE2 3.69Å; L56-F83 HydrophobicContact CD1-CZ 3.99Å; L56-L87 HydrophobicContact CD1-CD1 4.36Å
57	I	91.4	Very high	86.3	Confident	7 Å²	7	38.5 Å²	38.5	4%	0.036	23%	0.23	C	C	.	.	H	α-helix	trans	-59.7	-41.8	177.7	-69.1	165	0	0	0	110.4	P53 C54 L60 L61 F141 A144 L145 L148	P53-I57 WeakPolarHBondContact O-CG1 3.41Å; P53-I57 PolarHBondContact O-N 3.22Å; P53-I57 VanDerWaalsContact O-N 3.1Å; C54-I57 PolarHBondContact O-N 2.99Å; I57-L60 PolarHBondContact O-N 3.37Å; I57-L61 HydrophobicContact CG2-CD1 4.21Å; I57-L61 WeakPolarHBondContact O-CG 3.27Å; I57-L61 PolarHBondContact O-N 3.27Å; I57-F141 HydrophobicContact CB-CD2 4.41Å; I57-F141 HydrophobicContact CB-CE2 3.9Å; I57-F141 HydrophobicContact CD1-CE2 4.26Å; I57-F141 HydrophobicContact CD1-CZ 4.21Å; I57-F141 HydrophobicContact CG2-CD2 3.76Å; I57-F141 HydrophobicContact CG2-CE2 3.72Å; I57-A144 HydrophobicContact CG2-CB 3.9Å; I57-L145 HydrophobicContact CD1-CB 4.2Å; I57-L145 HydrophobicContact CD1-CD1 3.51Å; I57-L145 HydrophobicContact CD1-CG 4.43Å; I57-L148 HydrophobicContact CG1-CD1 4.41Å
58	I	93.2	Very high	87.1	Confident	6 Å²	6	41.9 Å²	41.9	3%	0.031	23%	0.23	C	C	.	.	H	α-helix	trans	-65.1	-42.9	177	-66.4	167.4	0	0	0	110.7	C54 V55 L56 L60 L61 Y62 A90 F93 L94 V136 F141	C54-I58 WeakPolarHBondContact O-CG1 3.46Å; C54-I58 PolarHBondContact O-N 3.36Å; C54-I58 VanDerWaalsContact O-N 3.11Å; V55-I58 PolarHBondContact O-N 3.4Å; L56-I58 VanDerWaalsContact C-N 3.26Å; L56-I58 PolarHBondContact O-N 3.34Å; I58-L60 PolarHBondContact O-N 3.39Å; I58-L61 WeakPolarHBondContact O-CB 3.15Å; I58-L61 PolarHBondContact O-N 3Å; I58-Y62 HydrophobicContact CG2-CD2 4.29Å; I58-Y62 HydrophobicContact CG2-CE1 4.01Å; I58-Y62 HydrophobicContact CG2-CE2 3.63Å; I58-Y62 VanDerWaalsContact CG2-CZ 3.44Å; I58-Y62 WeakPolarHBondContact CG2-OH 3.42Å; I58-Y62 PolarHBondContact O-N 2.93Å; I58-A90 HydrophobicContact CB-CB 3.99Å; I58-A90 HydrophobicContact CG2-CB 3.65Å; I58-F93 HydrophobicContact CD1-CD1 3.97Å; I58-F93 HydrophobicContact CD1-CE1 4.08Å; I58-F93 HydrophobicContact CG2-CD1 4.11Å; I58-L94 HydrophobicContact CD1-CD1 4.46Å; I58-V136 HydrophobicContact CG2-CG2 4.08Å; I58-F141 HydrophobicContact CG1-CD2 4.05Å; I58-F141 HydrophobicContact CG1-CE2 4.2Å
59	A	93.3	Very high	88.2	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60	-46.3	175.6	0	0	0	0	0	111.7	V55 L56 L61 Y62 L63 A86 L87 A90	V55-A59 WeakPolarHBondContact O-CB 3.43Å; V55-A59 PolarHBondContact O-N 2.96Å; L56-A59 WeakPolarHBondContact O-CB 3.25Å; L56-A59 PolarHBondContact O-N 3.24Å; A59-L61 VanDerWaalsContact C-N 3.29Å; A59-L61 PolarHBondContact O-N 3.07Å; A59-Y62 PolarHBondContact O-N 3.01Å; A59-Y62 VanDerWaalsContact O-N 3.16Å; A59-L63 VanDerWaalsContact O-CG 3.31Å; A59-L63 WeakPolarHBondContact O-CG 3.41Å; A59-L63 PolarHBondContact O-N 3.17Å; A59-A86 HydrophobicContact CB-CB 4.14Å; A59-L87 HydrophobicContact CB-CD1 3.97Å; A59-A90 HydrophobicContact CB-CB 3.98Å
60	L	92.7	Very high	89.3	Confident	28 Å²	28	41.7 Å²	41.7	15%	0.147	22%	0.221	C	C	.	.	H	α-helix	trans	-61	-37.2	175.4	-69.4	174.2	0	0	0	112	Y27 L56 I57 I58 L63 E64 L148	Y27-L60 HydrophobicContact CD1-CD2 4.02Å; Y27-L60 HydrophobicContact CE1-CD2 4.43Å; Y27-L60 HydrophobicContact CG-CD2 4.17Å; L56-L60 HydrophobicContact CD1-CG 4.42Å; L56-L60 HydrophobicContact CG-CD1 4.23Å; L56-L60 HydrophobicContact CG-CG 4.41Å; L56-L60 WeakPolarHBondContact O-CG 3.34Å; L56-L60 PolarHBondContact O-N 3.44Å; I57-L60 PolarHBondContact O-N 3.37Å; I58-L60 PolarHBondContact O-N 3.39Å; L60-L63 HydrophobicContact CD2-CD1 4.27Å; L60-L63 PolarHBondContact O-N 3.36Å; L60-E64 WeakPolarHBondContact O-CB 3.44Å; L60-E64 PolarHBondContact O-N 3.29Å; L60-L148 HydrophobicContact CD1-CD1 4.17Å
61	L	94.7	Very high	90.7	Very high	18 Å²	18	43.4 Å²	43.4	9%	0.094	21%	0.212	C	C	.	.	H	α-helix	trans	-66.4	-39.3	174.5	-77.5	169	0	0	0	112.5	I57 I58 A59 E64 R65 V136 A144	I57-L61 HydrophobicContact CG2-CD1 4.21Å; I57-L61 WeakPolarHBondContact O-CG 3.27Å; I57-L61 PolarHBondContact O-N 3.27Å; I58-L61 WeakPolarHBondContact O-CB 3.15Å; I58-L61 PolarHBondContact O-N 3Å; A59-L61 VanDerWaalsContact C-N 3.29Å; A59-L61 PolarHBondContact O-N 3.07Å; L61-E64 PolarHBondContact O-N 3.3Å; L61-R65 WeakPolarHBondContact O-CB 3.4Å; L61-R65 VanDerWaalsContact O-CG 3.26Å; L61-R65 WeakPolarHBondContact O-CG 3.46Å; L61-R65 PolarHBondContact O-N 2.92Å; L61-V136 HydrophobicContact CD1-CG1 3.75Å; L61-A144 HydrophobicContact CD1-CB 3.94Å; L61-A144 HydrophobicContact CD2-CB 3.91Å; L61-A144 HydrophobicContact CG-CB 4.03Å
62	Y	95.7	Very high	91.6	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64	-44.3	173.3	-65.2	-20.2	0	0	0	111.8	I58 A59 E64 R65 I66 C89 A90 F93 F126 L130 V134 V136	I58-Y62 HydrophobicContact CG2-CD2 4.29Å; I58-Y62 HydrophobicContact CG2-CE1 4.01Å; I58-Y62 HydrophobicContact CG2-CE2 3.63Å; I58-Y62 VanDerWaalsContact CG2-CZ 3.44Å; I58-Y62 WeakPolarHBondContact CG2-OH 3.42Å; I58-Y62 PolarHBondContact O-N 2.93Å; A59-Y62 PolarHBondContact O-N 3.01Å; A59-Y62 VanDerWaalsContact O-N 3.16Å; Y62-E64 VanDerWaalsContact C-N 3.31Å; Y62-E64 PolarHBondContact O-N 3.38Å; Y62-R65 PolarHBondContact O-N 2.98Å; Y62-I66 WeakPolarHBondContact O-CG1 3.49Å; Y62-I66 PolarHBondContact O-N 3.01Å; Y62-C89 HydrophobicContact CD2-CB 4.31Å; Y62-C89 HydrophobicContact CE2-CB 4.19Å; Y62-A90 HydrophobicContact CD2-CB 4.4Å; Y62-A90 HydrophobicContact CE2-CB 4.08Å; Y62-F93 WeakPolarHBondContact OH-CG 3.22Å; Y62-F126 HydrophobicContact CD2-CE1 4.24Å; Y62-F126 HydrophobicContact CG-CE1 4.48Å; Y62-L130 HydrophobicContact CD1-CD1 4.35Å; Y62-L130 HydrophobicContact CD2-CD1 4.48Å; Y62-L130 HydrophobicContact CG-CD1 4.13Å; Y62-V134 HydrophobicContact CE1-CG1 4.5Å; Y62-V134 VanDerWaalsContact CE1-O 3.27Å; Y62-V134 WeakPolarHBondContact CE1-O 2.9Å; Y62-V134 HydrophobicContact CE2-CG1 4.4Å; Y62-V134 WeakPolarHBondContact OH-CG1 3.46Å; Y62-V134 PolarHBondContact OH-O 3.49Å; Y62-V136 HydrophobicContact CD1-CG2 4.44Å; Y62-V136 HydrophobicContact CE1-CG2 3.62Å
63	L	94.4	Very high	92.1	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-58.4	-44.3	174.7	-68.7	171.4	0	0	0	111.4	Y27 F28 A59 L60 I66 R67 Y74 L82 F83 A86 F126	Y27-L63 HydrophobicContact CE1-CB 4.14Å; Y27-L63 HydrophobicContact CE1-CD1 4.29Å; F28-L63 HydrophobicContact CE2-CD1 3.62Å; F28-L63 HydrophobicContact CZ-CD1 3.51Å; F28-L63 HydrophobicContact CZ-CD2 3.97Å; F28-L63 HydrophobicContact CZ-CG 4.38Å; A59-L63 VanDerWaalsContact O-CG 3.31Å; A59-L63 WeakPolarHBondContact O-CG 3.41Å; A59-L63 PolarHBondContact O-N 3.17Å; L60-L63 HydrophobicContact CD2-CD1 4.27Å; L60-L63 PolarHBondContact O-N 3.36Å; L63-I66 PolarHBondContact O-N 3.44Å; L63-R67 VanDerWaalsContact O-CB 3.26Å; L63-R67 WeakPolarHBondContact O-CB 3.16Å; L63-R67 PolarHBondContact O-N 2.95Å; L63-Y74 HydrophobicContact CB-CE2 4.3Å; L63-Y74 HydrophobicContact CD2-CE2 4.23Å; L63-L82 HydrophobicContact CD2-CB 4.47Å; L63-L82 HydrophobicContact CD2-CD1 4.33Å; L63-L82 HydrophobicContact CD2-CD2 3.67Å; L63-L82 HydrophobicContact CD2-CG 3.48Å; L63-L82 VanDerWaalsContact CD2-CG 3.48Å; L63-F83 HydrophobicContact CD1-CD2 4.49Å; L63-A86 HydrophobicContact CD1-CB 4.26Å; L63-A86 HydrophobicContact CD2-CB 3.82Å; L63-A86 HydrophobicContact CG-CB 3.78Å; L63-F126 HydrophobicContact CD2-CE2 4.48Å
64	E	93.7	Very high	92.6	Very high	65 Å²	65	45.7 Å²	45.7	30%	0.304	21%	0.209	S	C	.	.	H	α-helix	trans	-65.2	-39.8	177.9	-167.8	-176.4	179.1	0	0	112.2	L60 L61 Y62 K68	L60-E64 WeakPolarHBondContact O-CB 3.44Å; L60-E64 PolarHBondContact O-N 3.29Å; L61-E64 PolarHBondContact O-N 3.3Å; Y62-E64 VanDerWaalsContact C-N 3.31Å; Y62-E64 PolarHBondContact O-N 3.38Å; E64-K68 HydrophobicContact CG-CD 4.36Å; E64-K68 WeakPolarHBondContact O-CG 3.45Å; E64-K68 PolarHBondContact O-N 3.25Å; E64-K68 VanDerWaalsContact O-N 3.08Å; E64-K68 WeakPolarHBondContact OE1-CE 3.37Å; E64-K68 IonicContact OE1-NZ 3.92Å; E64-K68 PolarHBondContact OE1-NZ 2.99Å
65	R	95.2	Very high	92.7	Very high	72 Å²	72	45.5 Å²	45.5	27%	0.272	20%	0.203	S	C	.	.	H	α-helix	trans	-61.2	-47.8	175.7	-75.5	172	-178.5	-169.8	0.4	111.4	L61 Y62 K68 K69 L130 R133 L135 D140	L61-R65 WeakPolarHBondContact O-CB 3.4Å; L61-R65 VanDerWaalsContact O-CG 3.26Å; L61-R65 WeakPolarHBondContact O-CG 3.46Å; L61-R65 PolarHBondContact O-N 2.92Å; Y62-R65 PolarHBondContact O-N 2.98Å; R65-K68 PolarHBondContact O-N 3.33Å; R65-K69 WeakPolarHBondContact O-CB 3.49Å; R65-K69 PolarHBondContact O-N 3.39Å; R65-K69 VanDerWaalsContact O-N 3.09Å; R65-L130 HydrophobicContact CB-CD2 4Å; R65-R133 PolarHBondContact NH1-O 3.41Å; R65-L135 PolarHBondContact NH1-O 2.86Å; R65-L135 PolarHBondContact NH2-O 3.17Å; R65-D140 IonicContact NH2-OD2 2.68Å
66	I	94.6	Very high	92.7	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-64.8	-48	178.3	-68.2	175	0	0	0	110.4	Y62 L63 K68 K69 N70 Y73 Y74 F126 E129 L130	Y62-I66 WeakPolarHBondContact O-CG1 3.49Å; Y62-I66 PolarHBondContact O-N 3.01Å; L63-I66 PolarHBondContact O-N 3.44Å; I66-K68 VanDerWaalsContact C-N 3.25Å; I66-K68 PolarHBondContact O-N 3.34Å; I66-K69 PolarHBondContact O-N 3.11Å; I66-N70 CarbonylContact O-C 3.43Å; I66-N70 PolarHBondContact O-N 2.81Å; I66-Y73 HydrophobicContact CG2-CD1 3.66Å; I66-Y73 HydrophobicContact CG2-CE1 4.14Å; I66-Y74 HydrophobicContact CG2-CD2 4.42Å; I66-F126 HydrophobicContact CD1-CD1 4.28Å; I66-F126 HydrophobicContact CD1-CD2 3.38Å; I66-F126 HydrophobicContact CD1-CE1 4.07Å; I66-F126 HydrophobicContact CD1-CE2 3.12Å; I66-F126 HydrophobicContact CD1-CG 3.96Å; I66-F126 HydrophobicContact CD1-CZ 3.49Å; I66-F126 VanDerWaalsContact CD1-CZ 3.49Å; I66-E129 HydrophobicContact CD1-CB 4.5Å; I66-E129 HydrophobicContact CG1-CB 4.48Å; I66-L130 HydrophobicContact CD1-CD2 4.16Å; I66-L130 HydrophobicContact CD1-CG 3.97Å; I66-L130 HydrophobicContact CG1-CD2 3.67Å; I66-L130 HydrophobicContact CG1-CG 3.93Å
67	R	92.7	Very high	92.8	Very high	90 Å²	90	50.8 Å²	50.8	34%	0.34	24%	0.243	S	C	.	.	H	α-helix	trans	-55.2	-40.3	179.3	-171.4	-179	68.7	104.5	0.3	112.7	L63 Y74	L63-R67 VanDerWaalsContact O-CB 3.26Å; L63-R67 WeakPolarHBondContact O-CB 3.16Å; L63-R67 PolarHBondContact O-N 2.95Å; R67-Y74 HydrophobicContact CB-CD1 4.39Å; R67-Y74 HydrophobicContact CB-CD2 3.67Å; R67-Y74 HydrophobicContact CB-CE2 3.92Å; R67-Y74 HydrophobicContact CB-CG 3.94Å; R67-Y74 HydrophobicContact CG-CD1 4.01Å; R67-Y74 HydrophobicContact CG-CD2 4.2Å; R67-Y74 HydrophobicContact CG-CE1 4.19Å; R67-Y74 HydrophobicContact CG-CE2 4.36Å; R67-Y74 HydrophobicContact CG-CG 4.03Å
68	K	93.3	Very high	92.8	Very high	146 Å²	146	52.4 Å²	52.4	64%	0.635	26%	0.255	S	S	*	.	H	α-helix	trans	-73.4	-32.7	177.5	-74.1	177.6	-176.2	168.4	0	113.1	E64 R65 I66	E64-K68 HydrophobicContact CG-CD 4.36Å; E64-K68 WeakPolarHBondContact O-CG 3.45Å; E64-K68 PolarHBondContact O-N 3.25Å; E64-K68 VanDerWaalsContact O-N 3.08Å; E64-K68 WeakPolarHBondContact OE1-CE 3.37Å; E64-K68 IonicContact OE1-NZ 3.92Å; E64-K68 PolarHBondContact OE1-NZ 2.99Å; R65-K68 PolarHBondContact O-N 3.33Å; I66-K68 VanDerWaalsContact C-N 3.25Å; I66-K68 PolarHBondContact O-N 3.34Å
69	K	94	Very high	92.8	Very high	93 Å²	93	52.2 Å²	52.2	40%	0.404	25%	0.254	S	S	.	.	H	α-helix	trans	-83.5	-52.4	-177	-177.9	-173.7	165.6	-171.4	0	112.2	R65 I66 E129 D131	R65-K69 WeakPolarHBondContact O-CB 3.49Å; R65-K69 PolarHBondContact O-N 3.39Å; R65-K69 VanDerWaalsContact O-N 3.09Å; I66-K69 PolarHBondContact O-N 3.11Å; K69-E129 VanDerWaalsContact CD-O 3.25Å; K69-E129 WeakPolarHBondContact CD-O 3.47Å; K69-E129 WeakPolarHBondContact CE-O 3.45Å; K69-E129 PolarHBondContact NZ-O 3.42Å; K69-D131 WeakPolarHBondContact CE-OD2 3.36Å; K69-D131 IonicContact NZ-OD1 3.35Å; K69-D131 PolarHBondContact NZ-OD1 2.82Å; K69-D131 IonicContact NZ-OD2 2.81Å; K69-D131 PolarHBondContact NZ-OD2 3.44Å
70	N	92.8	Very high	92.7	Very high	44 Å²	44	54.3 Å²	54.3	24%	0.235	27%	0.265	C	S	.	.			trans	-135.7	87.6	-174.4	-171.2	-8.9	0	0	0	109.9	I66 E72 Y73 Y74 E129	I66-N70 CarbonylContact O-C 3.43Å; I66-N70 PolarHBondContact O-N 2.81Å; N70-E72 VanDerWaalsContact C-N 3.28Å; N70-E72 PolarHBondContact O-N 3.43Å; N70-E72 PolarHBondContact OD1-N 2.83Å; N70-Y73 VanDerWaalsContact CG-CB 3.49Å; N70-Y73 WeakPolarHBondContact ND2-CB 3.35Å; N70-Y73 PolarHBondContact O-N 3.37Å; N70-Y73 PolarHBondContact OD1-N 3.42Å; N70-Y74 PolarHBondContact O-N 2.99Å; N70-Y74 VanDerWaalsContact O-N 3.15Å; N70-E129 WeakPolarHBondContact CB-OE2 3.39Å; N70-E129 PolarHBondContact ND2-OE2 2.97Å
71	K	91.8	Very high	92.6	Very high	123 Å²	123	54 Å²	54	54%	0.535	26%	0.264	S	S	.	.	H	α-helix	trans	-63.9	-35.3	179	-172.4	-179.7	172.8	-168.6	0	111.9	Y74 E75	K71-Y74 PolarHBondContact O-N 2.87Å; K71-E75 WeakPolarHBondContact CE-OE1 3.27Å; K71-E75 VanDerWaalsContact CE-OE2 3.26Å; K71-E75 WeakPolarHBondContact CE-OE2 3.4Å; K71-E75 HydrophobicContact CG-CG 4.25Å; K71-E75 IonicContact NZ-OE1 2.74Å; K71-E75 PolarHBondContact NZ-OE1 3.3Å; K71-E75 IonicContact NZ-OE2 3.5Å; K71-E75 WeakPolarHBondContact O-CB 3.36Å; K71-E75 WeakPolarHBondContact O-CG 3.24Å; K71-E75 PolarHBondContact O-N 2.99Å
72	E	91.5	Very high	92.6	Very high	168 Å²	168	53.3 Å²	53.3	79%	0.785	26%	0.26	S	S	*	.	H	α-helix	trans	-65.4	-42.7	-180	-63.6	178.4	-175.9	0	0	111.7	N70 G76	N70-E72 VanDerWaalsContact C-N 3.28Å; N70-E72 PolarHBondContact O-N 3.43Å; N70-E72 PolarHBondContact OD1-N 2.83Å; E72-G76 WeakPolarHBondContact O-CA 3.04Å; E72-G76 PolarHBondContact O-N 3.46Å
73	Y	92.4	Very high	92.4	Very high	29 Å²	29	53.5 Å²	53.5	11%	0.114	26%	0.261	C	S	.	.	H	α-helix	trans	-64.1	-44.1	172.9	176.7	-90.6	0	0	0	111.7	I66 N70 G76 K77 L82 E125 E129	I66-Y73 HydrophobicContact CG2-CD1 3.66Å; I66-Y73 HydrophobicContact CG2-CE1 4.14Å; N70-Y73 VanDerWaalsContact CG-CB 3.49Å; N70-Y73 WeakPolarHBondContact ND2-CB 3.35Å; N70-Y73 PolarHBondContact O-N 3.37Å; N70-Y73 PolarHBondContact OD1-N 3.42Å; Y73-G76 PolarHBondContact O-N 2.93Å; Y73-K77 HydrophobicContact CD2-CG 4.36Å; Y73-K77 HydrophobicContact CE1-CG 4.33Å; Y73-K77 HydrophobicContact CE2-CD 4.41Å; Y73-K77 HydrophobicContact CE2-CG 4.08Å; Y73-K77 VanDerWaalsContact O-CG 3.31Å; Y73-K77 WeakPolarHBondContact O-CG 3.15Å; Y73-K77 PolarHBondContact O-N 3.48Å; Y73-L82 HydrophobicContact CE1-CD1 3.9Å; Y73-E125 HydrophobicContact CE2-CB 4.34Å; Y73-E129 HydrophobicContact CD1-CB 4.38Å; Y73-E129 HydrophobicContact CD1-CG 3.85Å; Y73-E129 HydrophobicContact CD2-CG 3.73Å; Y73-E129 HydrophobicContact CE1-CB 4.35Å; Y73-E129 HydrophobicContact CE1-CG 3.94Å; Y73-E129 HydrophobicContact CE2-CG 3.83Å; Y73-E129 HydrophobicContact CG-CG 3.74Å
74	Y	91.9	Very high	92.3	Very high	1 Å²	1	53.5 Å²	53.5	0%	0.004	26%	0.261	C	S	.	.	H	α-helix	trans	-60.4	-46.7	-179.8	-174.4	-87.4	0	0	0	112.2	Y27 T31 L63 I66 R67 N70 K71 L82	Y27-Y74 VanDerWaalsContact CE1-OH 3.29Å; Y27-Y74 WeakPolarHBondContact CE1-OH 3.3Å; T31-Y74 PolarHBondContact OG1-OH 3.47Å; L63-Y74 HydrophobicContact CB-CE2 4.3Å; L63-Y74 HydrophobicContact CD2-CE2 4.23Å; I66-Y74 HydrophobicContact CG2-CD2 4.42Å; R67-Y74 HydrophobicContact CB-CD1 4.39Å; R67-Y74 HydrophobicContact CB-CD2 3.67Å; R67-Y74 HydrophobicContact CB-CE2 3.92Å; R67-Y74 HydrophobicContact CB-CG 3.94Å; R67-Y74 HydrophobicContact CG-CD1 4.01Å; R67-Y74 HydrophobicContact CG-CD2 4.2Å; R67-Y74 HydrophobicContact CG-CE1 4.19Å; R67-Y74 HydrophobicContact CG-CE2 4.36Å; R67-Y74 HydrophobicContact CG-CG 4.03Å; N70-Y74 PolarHBondContact O-N 2.99Å; N70-Y74 VanDerWaalsContact O-N 3.15Å; K71-Y74 PolarHBondContact O-N 2.87Å; Y74-L82 HydrophobicContact CD2-CD2 3.43Å; Y74-L82 VanDerWaalsContact CD2-CD2 3.43Å; Y74-L82 HydrophobicContact CE2-CD2 3.44Å; Y74-L82 VanDerWaalsContact CE2-CD2 3.44Å; Y74-L82 HydrophobicContact CG-CD2 4.08Å
75	E	90	Very high	92.2	Very high	51 Å²	51	50.6 Å²	50.6	24%	0.238	25%	0.248	C	C	.	.	H	α-helix	trans	-82.4	-22.3	-177.9	-66.9	-178	159.3	0	0	113.4	P33 Y34 K71	P33-E75 WeakPolarHBondContact CD-OE1 3.24Å; Y34-E75 HydrophobicContact CD2-CB 4.41Å; K71-E75 WeakPolarHBondContact CE-OE1 3.27Å; K71-E75 VanDerWaalsContact CE-OE2 3.26Å; K71-E75 WeakPolarHBondContact CE-OE2 3.4Å; K71-E75 HydrophobicContact CG-CG 4.25Å; K71-E75 IonicContact NZ-OE1 2.74Å; K71-E75 PolarHBondContact NZ-OE1 3.3Å; K71-E75 IonicContact NZ-OE2 3.5Å; K71-E75 WeakPolarHBondContact O-CB 3.36Å; K71-E75 WeakPolarHBondContact O-CG 3.24Å; K71-E75 PolarHBondContact O-N 2.99Å
76	G	89.5	Confident	92.2	Very high	65 Å²	65	47.1 Å²	47.1	67%	0.67	24%	0.235	S	C	*	.	H	α-helix	trans	-82.6	-10.9	179.2	0	0	0	0	0	114.6	E72 Y73	E72-G76 WeakPolarHBondContact O-CA 3.04Å; E72-G76 PolarHBondContact O-N 3.46Å; Y73-G76 PolarHBondContact O-N 2.93Å
77	K	90.7	Very high	92	Very high	59 Å²	59	47.1 Å²	47.1	26%	0.257	24%	0.235	S	C	.	.	S	Bend	trans	-101	149	176.9	-67.1	-66	-170.7	172.7	0	110.5	Y73 E125	Y73-K77 HydrophobicContact CD2-CG 4.36Å; Y73-K77 HydrophobicContact CE1-CG 4.33Å; Y73-K77 HydrophobicContact CE2-CD 4.41Å; Y73-K77 HydrophobicContact CE2-CG 4.08Å; Y73-K77 VanDerWaalsContact O-CG 3.31Å; Y73-K77 WeakPolarHBondContact O-CG 3.15Å; Y73-K77 PolarHBondContact O-N 3.48Å; K77-E125 IonicContact NZ-OE2 2.68Å; K77-E125 PolarHBondContact NZ-OE2 2.97Å
78	S	90.9	Very high	91.9	Very high	41 Å²	41	42.9 Å²	42.9	29%	0.287	22%	0.219	S	C	.	.			trans	-61.9	134.1	172.3	40.9	0	0	0	0	110.3	D80 D81 L82	S78-D80 PolarHBondContact O-N 2.88Å; S78-D81 PolarHBondContact O-N 3.39Å; S78-D81 VanDerWaalsContact OG-CB 3.26Å; S78-D81 WeakPolarHBondContact OG-CB 3.35Å; S78-D81 PolarHBondContact OG-OD1 3.23Å; S78-L82 WeakPolarHBondContact O-CB 3.43Å; S78-L82 PolarHBondContact O-N 3.21Å
79	P	92.2	Very high	91.9	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.013	19%	0.19	C	C	.	.	H	α-helix	trans	-53.2	-40.8	176.4	-29.5	37.3	0	0	0	113.1	F28 D35 L37 D81 L82 F83	F28-P79 HydrophobicContact CD1-CB 3.68Å; F28-P79 HydrophobicContact CD1-CG 4.42Å; F28-P79 HydrophobicContact CE1-CB 3.99Å; F28-P79 HydrophobicContact CG-CB 4.38Å; D35-P79 HydrophobicContact CB-CG 3.78Å; D35-P79 WeakPolarHBondContact OD2-CD 3.18Å; L37-P79 HydrophobicContact CB-CB 4.07Å; L37-P79 HydrophobicContact CD1-CB 4.04Å; P79-D81 PolarHBondContact O-N 2.85Å; P79-L82 PolarHBondContact O-N 2.94Å; P79-F83 VanDerWaalsContact O-CB 3.23Å; P79-F83 WeakPolarHBondContact O-CB 3.24Å; P79-F83 PolarHBondContact O-N 3.39Å
80	D	91.1	Very high	91.7	Very high	44 Å²	44	31.8 Å²	31.8	24%	0.235	17%	0.171	C	C	.	.	H	α-helix	trans	-59.3	-47.3	178.5	-69.3	-3.8	0	0	0	111.9	L37 D38 F41 S78 A84	L37-D80 WeakPolarHBondContact CD1-OD1 3.37Å; D38-D80 PolarHBondContact N-OD1 3.4Å; F41-D80 HydrophobicContact CD1-CB 3.85Å; F41-D80 HydrophobicContact CE1-CB 3.8Å; F41-D80 VanDerWaalsContact CE1-O 3.3Å; F41-D80 WeakPolarHBondContact CE1-O 3.32Å; F41-D80 HydrophobicContact CG-CB 4.37Å; F41-D80 HydrophobicContact CZ-CB 4.28Å; S78-D80 PolarHBondContact O-N 2.88Å; D80-A84 VanDerWaalsContact O-CB 3.25Å; D80-A84 WeakPolarHBondContact O-CB 3.33Å; D80-A84 PolarHBondContact O-N 3.31Å
81	D	92.3	Very high	91.5	Very high	21 Å²	21	30.1 Å²	30.1	11%	0.112	16%	0.163	C	C	.	.	H	α-helix	trans	-67.7	-42.7	179.6	-66.7	50.3	0	0	0	110.5	S78 P79 A84 I85 K114 L122	S78-D81 PolarHBondContact O-N 3.39Å; S78-D81 VanDerWaalsContact OG-CB 3.26Å; S78-D81 WeakPolarHBondContact OG-CB 3.35Å; S78-D81 PolarHBondContact OG-OD1 3.23Å; P79-D81 PolarHBondContact O-N 2.85Å; D81-A84 PolarHBondContact O-N 2.97Å; D81-I85 WeakPolarHBondContact O-CB 3.15Å; D81-I85 WeakPolarHBondContact O-CG1 3.42Å; D81-I85 PolarHBondContact O-N 2.91Å; D81-K114 WeakPolarHBondContact OD1-CE 3.31Å; D81-K114 IonicContact OD1-NZ 2.57Å; D81-K114 PolarHBondContact OD1-NZ 3.48Å; D81-K114 IonicContact OD2-NZ 2.84Å; D81-K114 PolarHBondContact OD2-NZ 2.9Å; D81-L122 HydrophobicContact CB-CD1 3.93Å; D81-L122 WeakPolarHBondContact OD2-CD1 3.38Å
82	L	93.4	Very high	91.4	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-66.1	-43.1	-179.3	-167.4	68.7	0	0	0	111.3	F28 L63 Y73 Y74 S78 P79 A86 F126	F28-L82 HydrophobicContact CE1-CD2 4.21Å; L63-L82 HydrophobicContact CD2-CB 4.47Å; L63-L82 HydrophobicContact CD2-CD1 4.33Å; L63-L82 HydrophobicContact CD2-CD2 3.67Å; L63-L82 HydrophobicContact CD2-CG 3.48Å; L63-L82 VanDerWaalsContact CD2-CG 3.48Å; Y73-L82 HydrophobicContact CE1-CD1 3.9Å; Y74-L82 HydrophobicContact CD2-CD2 3.43Å; Y74-L82 VanDerWaalsContact CD2-CD2 3.43Å; Y74-L82 HydrophobicContact CE2-CD2 3.44Å; Y74-L82 VanDerWaalsContact CE2-CD2 3.44Å; Y74-L82 HydrophobicContact CG-CD2 4.08Å; S78-L82 WeakPolarHBondContact O-CB 3.43Å; S78-L82 PolarHBondContact O-N 3.21Å; P79-L82 PolarHBondContact O-N 2.94Å; L82-A86 VanDerWaalsContact O-CB 3.24Å; L82-A86 WeakPolarHBondContact O-CB 3.22Å; L82-A86 PolarHBondContact O-N 3.48Å; L82-F126 HydrophobicContact CD1-CD2 3.91Å; L82-F126 HydrophobicContact CD1-CE2 3.89Å
83	F	92	Very high	91.2	Very high	4 Å²	4	22.6 Å²	22.6	2%	0.018	13%	0.128	C	C	.	.	H	α-helix	trans	-63.6	-48.2	175.5	178.8	-111.5	0	0	0	111.6	T24 F28 L37 F41 V42 L45 L56 L63 P79 I85 A86 L87	T24-F83 HydrophobicContact CG2-CD2 3.69Å; T24-F83 HydrophobicContact CG2-CE2 3.31Å; T24-F83 HydrophobicContact CG2-CZ 3.86Å; F28-F83 HydrophobicContact CE2-CB 3.96Å; F28-F83 AromaticContact CE2-CD2 3.92Å; F28-F83 HydrophobicContact CE2-CD2 3.92Å; F28-F83 HydrophobicContact CE2-CG 4.3Å; F28-F83 HydrophobicContact CZ-CB 3.85Å; F28-F83 HydrophobicContact CZ-CD2 4.48Å; L37-F83 HydrophobicContact CD1-CB 3.82Å; L37-F83 HydrophobicContact CD1-CD1 4.43Å; L37-F83 HydrophobicContact CD1-CG 4.26Å; L37-F83 HydrophobicContact CD2-CG 4.35Å; F41-F83 HydrophobicContact CE1-CD1 4.43Å; V42-F83 HydrophobicContact CB-CE1 4.29Å; V42-F83 HydrophobicContact CG1-CE1 3.76Å; V42-F83 HydrophobicContact CG1-CZ 3.95Å; V42-F83 HydrophobicContact CG2-CD1 4.16Å; V42-F83 HydrophobicContact CG2-CE1 4.08Å; L45-F83 HydrophobicContact CD2-CD1 4.14Å; L45-F83 HydrophobicContact CD2-CE1 4.08Å; L56-F83 HydrophobicContact CD1-CE2 3.69Å; L56-F83 HydrophobicContact CD1-CZ 3.99Å; L63-F83 HydrophobicContact CD1-CD2 4.49Å; P79-F83 VanDerWaalsContact O-CB 3.23Å; P79-F83 WeakPolarHBondContact O-CB 3.24Å; P79-F83 PolarHBondContact O-N 3.39Å; F83-I85 VanDerWaalsContact C-N 3.34Å; F83-I85 PolarHBondContact O-N 3.27Å; F83-A86 PolarHBondContact O-N 3.05Å; F83-L87 HydrophobicContact CE1-CD2 4.13Å; F83-L87 HydrophobicContact CZ-CD2 4.07Å; F83-L87 WeakPolarHBondContact O-CB 3.36Å; F83-L87 PolarHBondContact O-N 3.33Å
84	A	91.4	Very high	90.8	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.008	14%	0.139	C	C	.	.	H	α-helix	trans	-59.5	-43.9	-179.7	0	0	0	0	0	112.7	F41 L45 D80 D81 L87 L88	F41-A84 HydrophobicContact CE1-CB 4.26Å; F41-A84 HydrophobicContact CZ-CB 4Å; L45-A84 HydrophobicContact CD2-CB 3.94Å; D80-A84 VanDerWaalsContact O-CB 3.25Å; D80-A84 WeakPolarHBondContact O-CB 3.33Å; D80-A84 PolarHBondContact O-N 3.31Å; D81-A84 PolarHBondContact O-N 2.97Å; A84-L87 PolarHBondContact O-N 3.47Å; A84-L88 WeakPolarHBondContact O-CB 3.29Å; A84-L88 PolarHBondContact O-N 3.08Å
85	I	93.4	Very high	90.3	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.015	16%	0.159	C	C	.	.	H	α-helix	trans	-74	-37.3	-178.8	-63.1	-69.5	0	0	0	111.6	D81 F83 L87 L88 C89 I119 L122 F126	D81-I85 WeakPolarHBondContact O-CB 3.15Å; D81-I85 WeakPolarHBondContact O-CG1 3.42Å; D81-I85 PolarHBondContact O-N 2.91Å; F83-I85 VanDerWaalsContact C-N 3.34Å; F83-I85 PolarHBondContact O-N 3.27Å; I85-L87 PolarHBondContact O-N 2.93Å; I85-L88 PolarHBondContact O-N 3.18Å; I85-C89 WeakPolarHBondContact O-CB 3.34Å; I85-C89 PolarHBondContact O-N 3.44Å; I85-C89 PolarHBondContact O-SG 3.38Å; I85-I119 HydrophobicContact CD1-CD1 3.99Å; I85-I119 HydrophobicContact CD1-CG2 4.02Å; I85-L122 HydrophobicContact CD1-CB 3.74Å; I85-L122 HydrophobicContact CD1-CD1 4.45Å; I85-L122 HydrophobicContact CG1-CB 3.67Å; I85-L122 HydrophobicContact CG1-CD1 4.16Å; I85-F126 HydrophobicContact CG2-CB 3.52Å; I85-F126 HydrophobicContact CG2-CD1 4.07Å; I85-F126 HydrophobicContact CG2-CD2 4.02Å; I85-F126 HydrophobicContact CG2-CG 3.64Å
86	A	93.6	Very high	89.3	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59.2	-40.9	172	0	0	0	0	0	111.3	A59 L63 L82 F83 A90 F126	A59-A86 HydrophobicContact CB-CB 4.14Å; L63-A86 HydrophobicContact CD1-CB 4.26Å; L63-A86 HydrophobicContact CD2-CB 3.82Å; L63-A86 HydrophobicContact CG-CB 3.78Å; L82-A86 VanDerWaalsContact O-CB 3.24Å; L82-A86 WeakPolarHBondContact O-CB 3.22Å; L82-A86 PolarHBondContact O-N 3.48Å; F83-A86 PolarHBondContact O-N 3.05Å; A86-A90 VanDerWaalsContact O-CB 3.24Å; A86-A90 WeakPolarHBondContact O-CB 3.27Å; A86-A90 PolarHBondContact O-N 2.82Å; A86-F126 VanDerWaalsContact CA-CZ 3.49Å; A86-F126 HydrophobicContact CB-CE1 4.43Å; A86-F126 HydrophobicContact CB-CE2 3.92Å; A86-F126 HydrophobicContact CB-CZ 3.55Å
87	L	91.8	Very high	88.1	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-69.5	-41.3	179.1	-158.9	66	0	0	0	112.7	L45 V51 V55 L56 A59 F83 A84 I85 A90 S91 W108	L45-L87 HydrophobicContact CD2-CD2 3.99Å; L45-L87 HydrophobicContact CG-CD2 4.12Å; V51-L87 HydrophobicContact CG1-CD1 3.73Å; V51-L87 HydrophobicContact CG1-CD2 4.3Å; V51-L87 HydrophobicContact CG1-CG 4.36Å; V51-L87 HydrophobicContact CG2-CD1 4.49Å; V51-L87 HydrophobicContact CG2-CD2 3.66Å; V51-L87 HydrophobicContact CG2-CG 4.24Å; V55-L87 HydrophobicContact CG1-CD1 3.78Å; V55-L87 HydrophobicContact CG1-CG 4.34Å; L56-L87 HydrophobicContact CD1-CD1 4.36Å; A59-L87 HydrophobicContact CB-CD1 3.97Å; F83-L87 HydrophobicContact CE1-CD2 4.13Å; F83-L87 HydrophobicContact CZ-CD2 4.07Å; F83-L87 WeakPolarHBondContact O-CB 3.36Å; F83-L87 PolarHBondContact O-N 3.33Å; A84-L87 PolarHBondContact O-N 3.47Å; I85-L87 PolarHBondContact O-N 2.93Å; L87-A90 PolarHBondContact O-N 2.91Å; L87-S91 WeakPolarHBondContact O-CB 3.49Å; L87-S91 PolarHBondContact O-N 3.37Å; L87-S91 PolarHBondContact O-OG 3.09Å; L87-W108 HydrophobicContact CB-CH2 4.24Å; L87-W108 HydrophobicContact CB-CZ3 4.32Å; L87-W108 HydrophobicContact CD2-CH2 3.8Å; L87-W108 HydrophobicContact CD2-CZ3 3.98Å; L87-W108 HydrophobicContact CG-CH2 3.82Å; L87-W108 HydrophobicContact CG-CZ3 4.27Å
88	L	90.8	Very high	86.6	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-62.1	-45.7	173.6	-179.4	153.1	0	0	0	112	A84 I85 A90 S91 K92 W108 I119 E123	A84-L88 WeakPolarHBondContact O-CB 3.29Å; A84-L88 PolarHBondContact O-N 3.08Å; I85-L88 PolarHBondContact O-N 3.18Å; L88-A90 VanDerWaalsContact C-N 3.29Å; L88-A90 PolarHBondContact O-N 2.94Å; L88-S91 PolarHBondContact O-N 2.61Å; L88-S91 PolarHBondContact O-OG 3.45Å; L88-K92 HydrophobicContact CD2-CD 4.1Å; L88-K92 WeakPolarHBondContact O-CG 3.27Å; L88-K92 PolarHBondContact O-N 3.43Å; L88-K92 VanDerWaalsContact O-N 3.08Å; L88-W108 HydrophobicContact CB-CD2 4.19Å; L88-W108 HydrophobicContact CB-CE3 4.4Å; L88-W108 HydrophobicContact CB-CG 4.49Å; L88-W108 HydrophobicContact CD1-CB 3.64Å; L88-W108 HydrophobicContact CD1-CD2 4.16Å; L88-W108 HydrophobicContact CD1-CG 3.63Å; L88-W108 HydrophobicContact CG-CD2 4.37Å; L88-W108 HydrophobicContact CG-CG 4.17Å; L88-I119 HydrophobicContact CD1-CG2 3.71Å; L88-E123 HydrophobicContact CD2-CG 4.16Å
89	C	91.8	Very high	84.9	Confident	5 Å²	5	38.9 Å²	38.9	3%	0.034	21%	0.212	C	C	.	.	H	α-helix	trans	-66	-35.8	177.4	-65.7	0	0	0	0	111.5	Y62 I85 F93 F126	Y62-C89 HydrophobicContact CD2-CB 4.31Å; Y62-C89 HydrophobicContact CE2-CB 4.19Å; I85-C89 WeakPolarHBondContact O-CB 3.34Å; I85-C89 PolarHBondContact O-N 3.44Å; I85-C89 PolarHBondContact O-SG 3.38Å; C89-F93 WeakPolarHBondContact O-CB 3.31Å; C89-F93 PolarHBondContact O-N 3.45Å; C89-F126 HydrophobicContact CB-CD1 4.34Å; C89-F126 HydrophobicContact CB-CE1 4.13Å
90	A	91.5	Very high	83.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-70.4	-38.3	177.4	0	0	0	0	0	112.7	V55 I58 A59 Y62 A86 L87 L88 F93 L94	V55-A90 HydrophobicContact CG1-CB 3.83Å; V55-A90 WeakPolarHBondContact O-CB 3.38Å; I58-A90 HydrophobicContact CB-CB 3.99Å; I58-A90 HydrophobicContact CG2-CB 3.65Å; A59-A90 HydrophobicContact CB-CB 3.98Å; Y62-A90 HydrophobicContact CD2-CB 4.4Å; Y62-A90 HydrophobicContact CE2-CB 4.08Å; A86-A90 VanDerWaalsContact O-CB 3.24Å; A86-A90 WeakPolarHBondContact O-CB 3.27Å; A86-A90 PolarHBondContact O-N 2.82Å; L87-A90 PolarHBondContact O-N 2.91Å; L88-A90 VanDerWaalsContact C-N 3.29Å; L88-A90 PolarHBondContact O-N 2.94Å; A90-F93 PolarHBondContact O-N 3.29Å; A90-L94 PolarHBondContact O-N 2.94Å; A90-L94 VanDerWaalsContact O-N 3.13Å
91	S	88.2	Confident	81.5	Confident	9 Å²	9	51.3 Å²	51.3	6%	0.063	28%	0.278	C	S	.	.	H	α-helix	trans	-67.4	-44.2	177	63.2	0	0	0	0	111.1	L87 L88 F93 L94 F95	L87-S91 WeakPolarHBondContact O-CB 3.49Å; L87-S91 PolarHBondContact O-N 3.37Å; L87-S91 PolarHBondContact O-OG 3.09Å; L88-S91 PolarHBondContact O-N 2.61Å; L88-S91 PolarHBondContact O-OG 3.45Å; S91-F93 PolarHBondContact O-N 3.49Å; S91-L94 PolarHBondContact O-N 2.96Å; S91-F95 WeakPolarHBondContact O-CB 3.36Å; S91-F95 WeakPolarHBondContact O-CD2 3.16Å; S91-F95 PolarHBondContact O-N 3.49Å
92	K	88.2	Confident	80.1	Confident	60 Å²	60	51.7 Å²	51.7	26%	0.261	28%	0.282	S	S	.	.	H	α-helix	trans	-57.5	-48.4	170.8	-71.2	-175.5	-179.9	-177.7	0	111.3	L88 L94 F95 D96 N105 E123	L88-K92 HydrophobicContact CD2-CD 4.1Å; L88-K92 WeakPolarHBondContact O-CG 3.27Å; L88-K92 PolarHBondContact O-N 3.43Å; L88-K92 VanDerWaalsContact O-N 3.08Å; K92-L94 PolarHBondContact O-N 3.09Å; K92-L94 VanDerWaalsContact O-N 3.16Å; K92-F95 PolarHBondContact O-N 3.07Å; K92-D96 WeakPolarHBondContact O-CB 3.38Å; K92-D96 PolarHBondContact O-N 3.06Å; K92-N105 WeakPolarHBondContact CE-OD1 3.29Å; K92-N105 PolarHBondContact NZ-OD1 2.67Å; K92-E123 IonicContact NZ-OE1 3.92Å; K92-E123 PolarHBondContact NZ-OE1 3.44Å; K92-E123 IonicContact NZ-OE2 3.68Å; K92-E123 PolarHBondContact NZ-OE2 3.01Å
93	F	87.8	Confident	78.8	Confident	74 Å²	74	54.2 Å²	54.2	33%	0.325	30%	0.298	S	S	.	.	H	α-helix	trans	-57.5	-35	179.1	172.3	-103.4	0	0	0	114.1	I58 Y62 C89 A90 S91 V134 L135 V136	I58-F93 HydrophobicContact CD1-CD1 3.97Å; I58-F93 HydrophobicContact CD1-CE1 4.08Å; I58-F93 HydrophobicContact CG2-CD1 4.11Å; Y62-F93 WeakPolarHBondContact OH-CG 3.22Å; C89-F93 WeakPolarHBondContact O-CB 3.31Å; C89-F93 PolarHBondContact O-N 3.45Å; A90-F93 PolarHBondContact O-N 3.29Å; S91-F93 PolarHBondContact O-N 3.49Å; F93-V134 HydrophobicContact CB-CG1 3.89Å; F93-V134 HydrophobicContact CD2-CG1 3.7Å; F93-V134 HydrophobicContact CG-CG1 4Å; F93-L135 HydrophobicContact CE2-CD1 4.19Å; F93-L135 HydrophobicContact CZ-CD1 4.26Å; F93-V136 HydrophobicContact CE1-CB 4.42Å
94	L	84.7	Confident	78.1	Confident	66 Å²	66	62 Å²	62	35%	0.346	33%	0.328	S	S	.	.	H	α-helix	trans	-89.2	-29.5	-176.3	-168	64.2	0	0	0	113.9	C54 V55 I58 A90 S91 K92	C54-L94 HydrophobicContact CB-CD2 3.98Å; V55-L94 HydrophobicContact CG2-CB 4.35Å; V55-L94 HydrophobicContact CG2-CD2 3.67Å; I58-L94 HydrophobicContact CD1-CD1 4.46Å; A90-L94 PolarHBondContact O-N 2.94Å; A90-L94 VanDerWaalsContact O-N 3.13Å; S91-L94 PolarHBondContact O-N 2.96Å; K92-L94 PolarHBondContact O-N 3.09Å; K92-L94 VanDerWaalsContact O-N 3.16Å
95	F	80.1	Confident	77.7	Confident	96 Å²	96	63.1 Å²	63.1	42%	0.421	33%	0.334	S	S	.	.	H	α-helix	trans	-122.5	5.2	-169	-55.3	-58.8	0	0	0	114.5	V55 S91 K92 D97	V55-F95 HydrophobicContact CG2-CD2 4.29Å; V55-F95 HydrophobicContact CG2-CE2 3.49Å; V55-F95 VanDerWaalsContact CG2-CE2 3.49Å; V55-F95 HydrophobicContact CG2-CZ 4.07Å; S91-F95 WeakPolarHBondContact O-CB 3.36Å; S91-F95 WeakPolarHBondContact O-CD2 3.16Å; S91-F95 PolarHBondContact O-N 3.49Å; K92-F95 PolarHBondContact O-N 3.07Å; F95-D97 PolarHBondContact O-N 3.23Å
96	D	70.7	Confident	77.3	Confident	120 Å²	120	64.5 Å²	64.5	64%	0.642	35%	0.349	S	S	*	.			trans	-75.8	57.3	176.7	-169.9	30.1	0	0	0	112.1	K92 G98	K92-D96 WeakPolarHBondContact O-CB 3.38Å; K92-D96 PolarHBondContact O-N 3.06Å; D96-G98 VanDerWaalsContact C-N 3.31Å
97	D	63.4	Low	76.8	Confident	133 Å²	133	69.5 Å²	69.5	71%	0.711	37%	0.373	S	S	*	.	S	Bend	trans	-90.6	3.6	170.2	-75.3	-18.1	0	0	0	111.7	F95 I99	F95-D97 PolarHBondContact O-N 3.23Å; D97-I99 HydrophobicContact CB-CD1 4.14Å; D97-I99 HydrophobicContact CB-CG1 4.32Å; D97-I99 PolarHBondContact O-N 2.72Å
98	G	60.3	Low	76.5	Confident	63 Å²	63	69.9 Å²	69.9	65%	0.649	37%	0.374	S	S	*	.	S	Bend	trans	69.8	15.4	-179.3	0	0	0	0	0	115	D96	D96-G98 VanDerWaalsContact C-N 3.31Å
99	I	53.8	Low	76.3	Confident	110 Å²	110	70 Å²	70	56%	0.564	38%	0.375	S	S	*	.	S	Bend	trans	-92.6	166.8	178.4	-58	170.9	0	0	0	109.7	D97 D101 S102	D97-I99 HydrophobicContact CB-CD1 4.14Å; D97-I99 HydrophobicContact CB-CG1 4.32Å; D97-I99 PolarHBondContact O-N 2.72Å; I99-D101 PolarHBondContact O-N 2.8Å; I99-S102 WeakPolarHBondContact O-CB 3.39Å; I99-S102 PolarHBondContact O-N 2.8Å; I99-S102 PolarHBondContact O-OG 3.07Å
100	D	55.3	Low	76.1	Confident	167 Å²	167	75 Å²	75	89%	0.893	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.4	-20.8	-175.1	-65.1	-35.5	0	0	0	116.3	S102	D100-S102 PolarHBondContact O-N 3.43Å
101	D	57.3	Low	75.8	Confident	140 Å²	140	76.7 Å²	76.7	75%	0.749	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	7.8	176.4	-64.5	-31.1	0	0	0	113.7	I99 V103	I99-D101 PolarHBondContact O-N 2.8Å; D101-V103 PolarHBondContact O-N 3.1Å; D101-V103 VanDerWaalsContact O-N 3.16Å
102	S	61.7	Low	75.6	Confident	29 Å²	29	76.6 Å²	76.6	20%	0.203	42%	0.417	C	S	.	.			trans	-66.9	108.8	178.2	-63.6	0	0	0	0	111.3	I99 D100 Y104	I99-S102 WeakPolarHBondContact O-CB 3.39Å; I99-S102 PolarHBondContact O-N 2.8Å; I99-S102 PolarHBondContact O-OG 3.07Å; D100-S102 PolarHBondContact O-N 3.43Å; S102-Y104 PolarHBondContact O-N 3.34Å
103	V	66	Low	75.6	Confident	57 Å²	57	78.5 Å²	78.5	35%	0.345	44%	0.437	S	S	.	.			trans	-79.6	116.5	-178.3	-163	0	0	0	0	111.1	D101 E107 W108	D101-V103 PolarHBondContact O-N 3.1Å; D101-V103 VanDerWaalsContact O-N 3.16Å; V103-E107 HydrophobicContact CG1-CB 4.22Å; V103-W108 HydrophobicContact CG1-CG 4.29Å
104	Y	78.2	Confident	75.7	Confident	166 Å²	166	77.1 Å²	77.1	65%	0.651	43%	0.431	S	S	*	.			trans	-75.5	149.1	178	-63.5	-81.2	0	0	0	112	S102 G106 E107 W108	S102-Y104 PolarHBondContact O-N 3.34Å; Y104-G106 PolarHBondContact O-N 2.92Å; Y104-G106 VanDerWaalsContact O-N 3.08Å; Y104-E107 PolarHBondContact O-N 3.4Å; Y104-W108 PolarHBondContact O-N 2.85Å
105	N	83.4	Confident	76.1	Confident	26 Å²	26	77.3 Å²	77.3	14%	0.139	44%	0.438	C	S	.	.	H	α-helix	trans	-58.1	-26.7	176.2	-71.5	3.3	0	0	0	113.3	K92 A109 L116 I119 N120 E123	K92-N105 WeakPolarHBondContact CE-OD1 3.29Å; K92-N105 PolarHBondContact NZ-OD1 2.67Å; N105-A109 WeakPolarHBondContact O-CB 3.27Å; N105-A109 PolarHBondContact O-N 3.43Å; N105-L116 HydrophobicContact CB-CD1 3.6Å; N105-I119 HydrophobicContact CB-CG2 4.42Å; N105-N120 PolarHBondContact ND2-OD1 3.36Å; N105-E123 PolarHBondContact ND2-OE2 3.17Å
106	G	83.8	Confident	76.6	Confident	32 Å²	32	76.6 Å²	76.6	33%	0.33	44%	0.438	S	S	.	.	H	α-helix	trans	-66.5	-36.3	176.6	0	0	0	0	0	113.3	Y104 T110	Y104-G106 PolarHBondContact O-N 2.92Å; Y104-G106 VanDerWaalsContact O-N 3.08Å; G106-T110 PolarHBondContact O-N 3.48Å; G106-T110 VanDerWaalsContact O-N 3.15Å; G106-T110 PolarHBondContact O-OG1 3.2Å
107	E	83.9	Confident	77.8	Confident	105 Å²	105	81.1 Å²	81.1	49%	0.491	45%	0.447	S	S	.	.	H	α-helix	trans	-71	-47.5	176.2	-66	173.1	-163.6	0	0	110	V103 Y104 A109 T110 S111	V103-E107 HydrophobicContact CG1-CB 4.22Å; Y104-E107 PolarHBondContact O-N 3.4Å; E107-A109 VanDerWaalsContact C-N 3.3Å; E107-A109 PolarHBondContact O-N 3.09Å; E107-T110 WeakPolarHBondContact O-CA 3.46Å; E107-T110 WeakPolarHBondContact O-CB 3.33Å; E107-T110 PolarHBondContact O-N 3.29Å; E107-S111 PolarHBondContact O-N 2.71Å
108	W	84.5	Confident	79.2	Confident	8 Å²	8	77.8 Å²	77.8	3%	0.03	43%	0.428	C	S	.	.	H	α-helix	trans	-59.2	-38.3	174.1	-83.2	98.5	0	0	0	113.3	L45 L87 L88 V103 Y104 T110 S111 C112	L45-W108 HydrophobicContact CD1-CE3 3.84Å; L45-W108 HydrophobicContact CD1-CZ3 3.54Å; L45-W108 HydrophobicContact CD2-CZ3 4.13Å; L45-W108 HydrophobicContact CG-CZ3 3.89Å; L87-W108 HydrophobicContact CB-CH2 4.24Å; L87-W108 HydrophobicContact CB-CZ3 4.32Å; L87-W108 HydrophobicContact CD2-CH2 3.8Å; L87-W108 HydrophobicContact CD2-CZ3 3.98Å; L87-W108 HydrophobicContact CG-CH2 3.82Å; L87-W108 HydrophobicContact CG-CZ3 4.27Å; L88-W108 HydrophobicContact CB-CD2 4.19Å; L88-W108 HydrophobicContact CB-CE3 4.4Å; L88-W108 HydrophobicContact CB-CG 4.49Å; L88-W108 HydrophobicContact CD1-CB 3.64Å; L88-W108 HydrophobicContact CD1-CD2 4.16Å; L88-W108 HydrophobicContact CD1-CG 3.63Å; L88-W108 HydrophobicContact CG-CD2 4.37Å; L88-W108 HydrophobicContact CG-CG 4.17Å; V103-W108 HydrophobicContact CG1-CG 4.29Å; Y104-W108 PolarHBondContact O-N 2.85Å; W108-T110 VanDerWaalsContact C-N 3.29Å; W108-T110 PolarHBondContact O-N 2.87Å; W108-S111 PolarHBondContact O-N 2.76Å; W108-C112 VanDerWaalsContact O-CB 3.29Å; W108-C112 WeakPolarHBondContact O-CB 3.4Å; W108-C112 PolarHBondContact O-N 3.42Å; W108-C112 PolarHBondContact O-SG 3.16Å
109	A	87.6	Confident	80.7	Confident	4 Å²	4	74.9 Å²	74.9	3%	0.033	40%	0.398	C	S	.	.	H	α-helix	trans	-61.5	-40.9	174.7	0	0	0	0	0	111.2	N105 E107 S113 K114 L116 I119	N105-A109 WeakPolarHBondContact O-CB 3.27Å; N105-A109 PolarHBondContact O-N 3.43Å; E107-A109 VanDerWaalsContact C-N 3.3Å; E107-A109 PolarHBondContact O-N 3.09Å; A109-S113 PolarHBondContact O-N 2.99Å; A109-S113 VanDerWaalsContact O-N 3.13Å; A109-K114 CarbonylContact C-O 3.59Å; A109-K114 WeakPolarHBondContact CB-O 3.32Å; A109-K114 PolarHBondContact O-N 2.89Å; A109-L116 HydrophobicContact CB-CB 4.29Å; A109-I119 HydrophobicContact CB-CG1 3.94Å
110	T	87.5	Confident	82.7	Confident	111 Å²	111	72.3 Å²	72.3	68%	0.681	39%	0.385	S	S	*	.	H	α-helix	trans	-66.2	-48.2	176.8	-54.8	0	0	0	0	111.1	G106 E107 W108 C112 S113	G106-T110 PolarHBondContact O-N 3.48Å; G106-T110 VanDerWaalsContact O-N 3.15Å; G106-T110 PolarHBondContact O-OG1 3.2Å; E107-T110 WeakPolarHBondContact O-CA 3.46Å; E107-T110 WeakPolarHBondContact O-CB 3.33Å; E107-T110 PolarHBondContact O-N 3.29Å; W108-T110 VanDerWaalsContact C-N 3.29Å; W108-T110 PolarHBondContact O-N 2.87Å; T110-C112 PolarHBondContact O-N 3.15Å; T110-S113 PolarHBondContact O-N 2.52Å
111	S	85.1	Confident	84.6	Confident	35 Å²	35	70.2 Å²	70.2	25%	0.245	37%	0.368	C	S	.	.	H	α-helix	trans	-63.3	-37.7	177.7	-74.6	0	0	0	0	113.6	E48 E107 W108 S113	E48-S111 WeakPolarHBondContact OE2-CA 3.37Å; E48-S111 WeakPolarHBondContact OE2-CB 3.38Å; E48-S111 PolarHBondContact OE2-OG 3.16Å; E107-S111 PolarHBondContact O-N 2.71Å; W108-S111 PolarHBondContact O-N 2.76Å; S111-S113 PolarHBondContact O-N 2.84Å
112	C	85.3	Confident	86.4	Confident	7 Å²	7	64.1 Å²	64.1	5%	0.047	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-5.6	175.2	-61.8	0	0	0	0	113.4	F41 W108 T110 K114 I119	F41-C112 HydrophobicContact CE2-CB 4.39Å; F41-C112 HydrophobicContact CZ-CB 4.44Å; W108-C112 VanDerWaalsContact O-CB 3.29Å; W108-C112 WeakPolarHBondContact O-CB 3.4Å; W108-C112 PolarHBondContact O-N 3.42Å; W108-C112 PolarHBondContact O-SG 3.16Å; T110-C112 PolarHBondContact O-N 3.15Å; C112-K114 HydrophobicContact CB-CB 4.16Å; C112-K114 HydrophobicContact CB-CD 3.99Å; C112-K114 HydrophobicContact CB-CG 4.08Å; C112-K114 PolarHBondContact O-N 3.32Å; C112-I119 HydrophobicContact CB-CD1 4.5Å
113	S	87.5	Confident	87.9	Confident	99 Å²	99	63.9 Å²	63.9	69%	0.692	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	37.8	-168.7	-58.2	0	0	0	0	113	A109 T110 S111	A109-S113 PolarHBondContact O-N 2.99Å; A109-S113 VanDerWaalsContact O-N 3.13Å; T110-S113 PolarHBondContact O-N 2.52Å; S111-S113 PolarHBondContact O-N 2.84Å
114	K	89.3	Confident	89.4	Confident	45 Å²	45	65.1 Å²	65.1	20%	0.196	34%	0.335	C	S	.	.			trans	-118.6	154.9	-178.2	-73.9	176.3	-172.9	-73.3	0	110.5	D81 A109 C112 L118 I119	D81-K114 WeakPolarHBondContact OD1-CE 3.31Å; D81-K114 IonicContact OD1-NZ 2.57Å; D81-K114 PolarHBondContact OD1-NZ 3.48Å; D81-K114 IonicContact OD2-NZ 2.84Å; D81-K114 PolarHBondContact OD2-NZ 2.9Å; A109-K114 CarbonylContact C-O 3.59Å; A109-K114 WeakPolarHBondContact CB-O 3.32Å; A109-K114 PolarHBondContact O-N 2.89Å; C112-K114 HydrophobicContact CB-CB 4.16Å; C112-K114 HydrophobicContact CB-CD 3.99Å; C112-K114 HydrophobicContact CB-CG 4.08Å; C112-K114 PolarHBondContact O-N 3.32Å; K114-L118 HydrophobicContact CB-CD2 4.42Å; K114-L118 HydrophobicContact CD-CD2 4.34Å; K114-L118 HydrophobicContact CG-CD2 4.33Å; K114-I119 HydrophobicContact CB-CD1 3.95Å; K114-I119 HydrophobicContact CB-CG1 4.1Å; K114-I119 HydrophobicContact CD-CD1 3.88Å
115	S	92.7	Very high	90.2	Very high	70 Å²	70	59.4 Å²	59.4	49%	0.49	31%	0.314	S	S	.	.			trans	-69.3	142	174.8	73.6	0	0	0	0	111.3	R117 L118 I119	S115-R117 PolarHBondContact O-N 3.26Å; S115-L118 WeakPolarHBondContact O-CB 3.36Å; S115-L118 PolarHBondContact O-N 2.8Å; S115-L118 VanDerWaalsContact OG-CB 3.27Å; S115-L118 WeakPolarHBondContact OG-CB 3.47Å; S115-L118 PolarHBondContact OG-N 3.31Å; S115-I119 PolarHBondContact O-N 2.8Å
116	L	92.4	Very high	90.8	Very high	81 Å²	81	58.1 Å²	58.1	42%	0.424	31%	0.308	S	S	.	.	H	α-helix	trans	-54.9	-37.8	175.3	177.3	59.2	0	0	0	112.1	N105 A109 L118 I119 N120	N105-L116 HydrophobicContact CB-CD1 3.6Å; A109-L116 HydrophobicContact CB-CB 4.29Å; L116-L118 VanDerWaalsContact C-N 3.31Å; L116-L118 PolarHBondContact O-N 3.25Å; L116-I119 PolarHBondContact O-N 2.9Å; L116-N120 WeakPolarHBondContact O-CB 3.47Å; L116-N120 VanDerWaalsContact O-CG 3.22Å; L116-N120 PolarHBondContact O-N 3.47Å
117	R	94.1	Very high	91.4	Very high	216 Å²	216	57.6 Å²	57.6	82%	0.815	30%	0.297	S	S	*	.	H	α-helix	trans	-62	-39	176.8	-174	177.6	-179.8	176	0.7	112.2	S115 K121	S115-R117 PolarHBondContact O-N 3.26Å; R117-K121 WeakPolarHBondContact O-CB 3.48Å; R117-K121 PolarHBondContact O-N 2.7Å; R117-K121 VanDerWaalsContact O-N 3.11Å
118	L	93.3	Very high	92	Very high	62 Å²	62	57.7 Å²	57.7	33%	0.325	30%	0.297	S	S	.	.	H	α-helix	trans	-68.6	-47.4	176.9	178.5	63.6	0	0	0	110.9	K114 S115 L116 N120 K121 L122	K114-L118 HydrophobicContact CB-CD2 4.42Å; K114-L118 HydrophobicContact CD-CD2 4.34Å; K114-L118 HydrophobicContact CG-CD2 4.33Å; S115-L118 WeakPolarHBondContact O-CB 3.36Å; S115-L118 PolarHBondContact O-N 2.8Å; S115-L118 VanDerWaalsContact OG-CB 3.27Å; S115-L118 WeakPolarHBondContact OG-CB 3.47Å; S115-L118 PolarHBondContact OG-N 3.31Å; L116-L118 VanDerWaalsContact C-N 3.31Å; L116-L118 PolarHBondContact O-N 3.25Å; L118-N120 PolarHBondContact O-N 2.87Å; L118-K121 PolarHBondContact O-N 3.42Å; L118-L122 HydrophobicContact CD1-CD1 3.96Å; L118-L122 HydrophobicContact CD1-CG 4.04Å; L118-L122 HydrophobicContact CG-CD1 3.87Å; L118-L122 HydrophobicContact CG-CG 4.35Å; L118-L122 WeakPolarHBondContact O-CG 3.41Å; L118-L122 PolarHBondContact O-N 3.39Å
119	I	93.1	Very high	92.5	Very high	2 Å²	2	59.5 Å²	59.5	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-57.8	-49.2	177.9	-66.1	-60.9	0	0	0	111	I85 L88 N105 A109 C112 K114 S115 L116 K121 L122 E123	I85-I119 HydrophobicContact CD1-CD1 3.99Å; I85-I119 HydrophobicContact CD1-CG2 4.02Å; L88-I119 HydrophobicContact CD1-CG2 3.71Å; N105-I119 HydrophobicContact CB-CG2 4.42Å; A109-I119 HydrophobicContact CB-CG1 3.94Å; C112-I119 HydrophobicContact CB-CD1 4.5Å; K114-I119 HydrophobicContact CB-CD1 3.95Å; K114-I119 HydrophobicContact CB-CG1 4.1Å; K114-I119 HydrophobicContact CD-CD1 3.88Å; S115-I119 PolarHBondContact O-N 2.8Å; L116-I119 PolarHBondContact O-N 2.9Å; I119-K121 VanDerWaalsContact C-N 3.31Å; I119-K121 PolarHBondContact O-N 3.28Å; I119-L122 PolarHBondContact O-N 2.97Å; I119-E123 WeakPolarHBondContact O-CB 3.47Å; I119-E123 PolarHBondContact O-N 3.04Å
120	N	94	Very high	92.9	Very high	57 Å²	57	59.7 Å²	59.7	31%	0.305	31%	0.307	S	S	.	.	H	α-helix	trans	-61.1	-39.9	178.4	-69	-9.6	0	0	0	112.2	N105 L116 L118 I124	N105-N120 PolarHBondContact ND2-OD1 3.36Å; L116-N120 WeakPolarHBondContact O-CB 3.47Å; L116-N120 VanDerWaalsContact O-CG 3.22Å; L116-N120 PolarHBondContact O-N 3.47Å; L118-N120 PolarHBondContact O-N 2.87Å; N120-I124 WeakPolarHBondContact O-CD1 3.37Å; N120-I124 VanDerWaalsContact O-CG1 3.29Å; N120-I124 WeakPolarHBondContact O-CG1 3.48Å; N120-I124 PolarHBondContact O-N 2.9Å
121	K	96.1	Very high	93.2	Very high	123 Å²	123	58 Å²	58	54%	0.535	29%	0.293	S	S	.	.	H	α-helix	trans	-63.5	-48.6	176.5	177.3	179.2	170.6	-179.6	0	111.1	R117 L118 I119 I124 E125	R117-K121 WeakPolarHBondContact O-CB 3.48Å; R117-K121 PolarHBondContact O-N 2.7Å; R117-K121 VanDerWaalsContact O-N 3.11Å; L118-K121 PolarHBondContact O-N 3.42Å; I119-K121 VanDerWaalsContact C-N 3.31Å; I119-K121 PolarHBondContact O-N 3.28Å; K121-I124 PolarHBondContact O-N 2.94Å; K121-E125 WeakPolarHBondContact CE-OE1 3.45Å; K121-E125 IonicContact NZ-OE1 3.78Å; K121-E125 WeakPolarHBondContact O-CG 3.01Å; K121-E125 PolarHBondContact O-N 3.24Å
122	L	95.1	Very high	93.7	Very high	11 Å²	11	64.1 Å²	64.1	6%	0.058	31%	0.311	C	S	.	.	H	α-helix	trans	-67.7	-36	-178.9	-67.1	170.2	0	0	0	112.2	D81 I85 L118 I119 E125 F126	D81-L122 HydrophobicContact CB-CD1 3.93Å; D81-L122 WeakPolarHBondContact OD2-CD1 3.38Å; I85-L122 HydrophobicContact CD1-CB 3.74Å; I85-L122 HydrophobicContact CD1-CD1 4.45Å; I85-L122 HydrophobicContact CG1-CB 3.67Å; I85-L122 HydrophobicContact CG1-CD1 4.16Å; L118-L122 HydrophobicContact CD1-CD1 3.96Å; L118-L122 HydrophobicContact CD1-CG 4.04Å; L118-L122 HydrophobicContact CG-CD1 3.87Å; L118-L122 HydrophobicContact CG-CG 4.35Å; L118-L122 WeakPolarHBondContact O-CG 3.41Å; L118-L122 PolarHBondContact O-N 3.39Å; I119-L122 PolarHBondContact O-N 2.97Å; L122-E125 PolarHBondContact O-N 3.4Å; L122-F126 WeakPolarHBondContact O-CB 3.48Å; L122-F126 PolarHBondContact O-N 3.39Å
123	E	94.2	Very high	94	Very high	24 Å²	24	71.3 Å²	71.3	11%	0.112	34%	0.337	C	S	.	.	H	α-helix	trans	-59	-48.6	174.2	179	179.1	-161.4	0	0	110.9	L88 K92 N105 I119 F126 L127	L88-E123 HydrophobicContact CD2-CG 4.16Å; K92-E123 IonicContact NZ-OE1 3.92Å; K92-E123 PolarHBondContact NZ-OE1 3.44Å; K92-E123 IonicContact NZ-OE2 3.68Å; K92-E123 PolarHBondContact NZ-OE2 3.01Å; N105-E123 PolarHBondContact ND2-OE2 3.17Å; I119-E123 WeakPolarHBondContact O-CB 3.47Å; I119-E123 PolarHBondContact O-N 3.04Å; E123-F126 PolarHBondContact O-N 2.89Å; E123-L127 HydrophobicContact CG-CD1 3.94Å; E123-L127 WeakPolarHBondContact O-CB 3.31Å; E123-L127 VanDerWaalsContact O-CG 3.3Å; E123-L127 WeakPolarHBondContact O-CG 3.24Å; E123-L127 PolarHBondContact O-N 3.07Å
124	I	96	Very high	94.2	Very high	84 Å²	84	68 Å²	68	43%	0.431	31%	0.313	S	S	.	.	H	α-helix	trans	-62.4	-47	178.2	-66	165.6	0	0	0	110.7	N120 K121 F126 L127 Q128	N120-I124 WeakPolarHBondContact O-CD1 3.37Å; N120-I124 VanDerWaalsContact O-CG1 3.29Å; N120-I124 WeakPolarHBondContact O-CG1 3.48Å; N120-I124 PolarHBondContact O-N 2.9Å; K121-I124 PolarHBondContact O-N 2.94Å; I124-F126 VanDerWaalsContact C-N 3.34Å; I124-F126 PolarHBondContact O-N 3.26Å; I124-L127 PolarHBondContact O-N 3.36Å; I124-Q128 HydrophobicContact CG2-CG 4.41Å; I124-Q128 WeakPolarHBondContact O-CB 3.37Å; I124-Q128 WeakPolarHBondContact O-CG 3.36Å; I124-Q128 PolarHBondContact O-N 3.39Å
125	E	96.1	Very high	94.4	Very high	45 Å²	45	72 Å²	72	21%	0.21	34%	0.336	C	S	.	.	H	α-helix	trans	-59.4	-44.6	177.2	-73.3	176.9	-174.3	0	0	111.3	Y73 K77 K121 L122 Q128 E129	Y73-E125 HydrophobicContact CE2-CB 4.34Å; K77-E125 IonicContact NZ-OE2 2.68Å; K77-E125 PolarHBondContact NZ-OE2 2.97Å; K121-E125 WeakPolarHBondContact CE-OE1 3.45Å; K121-E125 IonicContact NZ-OE1 3.78Å; K121-E125 WeakPolarHBondContact O-CG 3.01Å; K121-E125 PolarHBondContact O-N 3.24Å; L122-E125 PolarHBondContact O-N 3.4Å; E125-Q128 WeakPolarHBondContact O-CB 3.4Å; E125-Q128 PolarHBondContact O-N 2.89Å; E125-E129 WeakPolarHBondContact O-CG 3.29Å; E125-E129 PolarHBondContact O-N 3.18Å
126	F	95.7	Very high	94.4	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64.1	-43.1	179.4	-173.7	-91.7	0	0	0	112.5	Y62 L63 I66 L82 I85 A86 C89 L122 E123 I124 E129 L130	Y62-F126 HydrophobicContact CD2-CE1 4.24Å; Y62-F126 HydrophobicContact CG-CE1 4.48Å; L63-F126 HydrophobicContact CD2-CE2 4.48Å; I66-F126 HydrophobicContact CD1-CD1 4.28Å; I66-F126 HydrophobicContact CD1-CD2 3.38Å; I66-F126 HydrophobicContact CD1-CE1 4.07Å; I66-F126 HydrophobicContact CD1-CE2 3.12Å; I66-F126 HydrophobicContact CD1-CG 3.96Å; I66-F126 HydrophobicContact CD1-CZ 3.49Å; I66-F126 VanDerWaalsContact CD1-CZ 3.49Å; L82-F126 HydrophobicContact CD1-CD2 3.91Å; L82-F126 HydrophobicContact CD1-CE2 3.89Å; I85-F126 HydrophobicContact CG2-CB 3.52Å; I85-F126 HydrophobicContact CG2-CD1 4.07Å; I85-F126 HydrophobicContact CG2-CD2 4.02Å; I85-F126 HydrophobicContact CG2-CG 3.64Å; A86-F126 VanDerWaalsContact CA-CZ 3.49Å; A86-F126 HydrophobicContact CB-CE1 4.43Å; A86-F126 HydrophobicContact CB-CE2 3.92Å; A86-F126 HydrophobicContact CB-CZ 3.55Å; C89-F126 HydrophobicContact CB-CD1 4.34Å; C89-F126 HydrophobicContact CB-CE1 4.13Å; L122-F126 WeakPolarHBondContact O-CB 3.48Å; L122-F126 PolarHBondContact O-N 3.39Å; E123-F126 PolarHBondContact O-N 2.89Å; I124-F126 VanDerWaalsContact C-N 3.34Å; I124-F126 PolarHBondContact O-N 3.26Å; F126-E129 PolarHBondContact O-N 3.09Å; F126-L130 HydrophobicContact CD1-CD1 3.71Å; F126-L130 HydrophobicContact CD1-CG 4.48Å; F126-L130 HydrophobicContact CE1-CD1 3.37Å; F126-L130 HydrophobicContact CE1-CG 4.31Å; F126-L130 HydrophobicContact CZ-CD1 4.2Å; F126-L130 WeakPolarHBondContact O-CG 3.35Å; F126-L130 PolarHBondContact O-N 3.49Å
127	L	96.1	Very high	94.5	Very high	20 Å²	20	73.9 Å²	73.9	11%	0.105	33%	0.328	C	S	.	.	H	α-helix	trans	-68.1	-35.3	176.6	-69.7	173	0	0	0	112.2	E123 I124 L130 D131 W132 V134	E123-L127 HydrophobicContact CG-CD1 3.94Å; E123-L127 WeakPolarHBondContact O-CB 3.31Å; E123-L127 VanDerWaalsContact O-CG 3.3Å; E123-L127 WeakPolarHBondContact O-CG 3.24Å; E123-L127 PolarHBondContact O-N 3.07Å; I124-L127 PolarHBondContact O-N 3.36Å; L127-L130 CarbonylContact O-C 3.54Å; L127-L130 PolarHBondContact O-N 3.48Å; L127-D131 PolarHBondContact O-N 2.81Å; L127-W132 HydrophobicContact CB-CD2 4.22Å; L127-W132 HydrophobicContact CB-CE3 4.13Å; L127-W132 HydrophobicContact CB-CH2 4.2Å; L127-W132 HydrophobicContact CB-CZ2 4.27Å; L127-W132 HydrophobicContact CB-CZ3 4.14Å; L127-W132 HydrophobicContact CD1-CE3 4.21Å; L127-W132 HydrophobicContact CD1-CH2 4Å; L127-W132 HydrophobicContact CD1-CZ3 3.64Å; L127-W132 HydrophobicContact CG-CZ3 4.43Å; L127-W132 PolarHBondContact O-N 2.85Å; L127-V134 HydrophobicContact CD2-CG2 3.74Å
128	Q	96.6	Very high	94.4	Very high	107 Å²	107	65.7 Å²	65.7	50%	0.5	31%	0.311	S	S	.	.	H	α-helix	trans	-63	-45.4	171.5	-74.9	172.4	-9.4	0	0	111.4	I124 E125 L130 D131	I124-Q128 HydrophobicContact CG2-CG 4.41Å; I124-Q128 WeakPolarHBondContact O-CB 3.37Å; I124-Q128 WeakPolarHBondContact O-CG 3.36Å; I124-Q128 PolarHBondContact O-N 3.39Å; E125-Q128 WeakPolarHBondContact O-CB 3.4Å; E125-Q128 PolarHBondContact O-N 2.89Å; Q128-L130 PolarHBondContact O-N 3.1Å; Q128-D131 PolarHBondContact O-N 2.79Å
129	E	95.7	Very high	94.4	Very high	47 Å²	47	66.1 Å²	66.1	22%	0.22	32%	0.319	C	S	.	.	H	α-helix	trans	-64	-27.7	175.4	-69.7	-60.8	147.6	0	0	112.4	I66 K69 N70 Y73 E125 F126 D131	I66-E129 HydrophobicContact CD1-CB 4.5Å; I66-E129 HydrophobicContact CG1-CB 4.48Å; K69-E129 VanDerWaalsContact CD-O 3.25Å; K69-E129 WeakPolarHBondContact CD-O 3.47Å; K69-E129 WeakPolarHBondContact CE-O 3.45Å; K69-E129 PolarHBondContact NZ-O 3.42Å; N70-E129 WeakPolarHBondContact CB-OE2 3.39Å; N70-E129 PolarHBondContact ND2-OE2 2.97Å; Y73-E129 HydrophobicContact CD1-CB 4.38Å; Y73-E129 HydrophobicContact CD1-CG 3.85Å; Y73-E129 HydrophobicContact CD2-CG 3.73Å; Y73-E129 HydrophobicContact CE1-CB 4.35Å; Y73-E129 HydrophobicContact CE1-CG 3.94Å; Y73-E129 HydrophobicContact CE2-CG 3.83Å; Y73-E129 HydrophobicContact CG-CG 3.74Å; E125-E129 WeakPolarHBondContact O-CG 3.29Å; E125-E129 PolarHBondContact O-N 3.18Å; F126-E129 PolarHBondContact O-N 3.09Å; E129-D131 VanDerWaalsContact C-N 3.31Å; E129-D131 PolarHBondContact O-N 3.16Å
130	L	94.7	Very high	94.4	Very high	8 Å²	8	69 Å²	69	4%	0.042	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-4.3	171	-74.9	172.3	0	0	0	114.6	Y62 R65 I66 F126 L127 Q128 W132 R133	Y62-L130 HydrophobicContact CD1-CD1 4.35Å; Y62-L130 HydrophobicContact CD2-CD1 4.48Å; Y62-L130 HydrophobicContact CG-CD1 4.13Å; R65-L130 HydrophobicContact CB-CD2 4Å; I66-L130 HydrophobicContact CD1-CD2 4.16Å; I66-L130 HydrophobicContact CD1-CG 3.97Å; I66-L130 HydrophobicContact CG1-CD2 3.67Å; I66-L130 HydrophobicContact CG1-CG 3.93Å; F126-L130 HydrophobicContact CD1-CD1 3.71Å; F126-L130 HydrophobicContact CD1-CG 4.48Å; F126-L130 HydrophobicContact CE1-CD1 3.37Å; F126-L130 HydrophobicContact CE1-CG 4.31Å; F126-L130 HydrophobicContact CZ-CD1 4.2Å; F126-L130 WeakPolarHBondContact O-CG 3.35Å; F126-L130 PolarHBondContact O-N 3.49Å; L127-L130 CarbonylContact O-C 3.54Å; L127-L130 PolarHBondContact O-N 3.48Å; Q128-L130 PolarHBondContact O-N 3.1Å; L130-W132 PolarHBondContact O-N 3.08Å; L130-R133 WeakPolarHBondContact O-CB 3.22Å; L130-R133 PolarHBondContact O-N 3.36Å
131	D	95	Very high	94.4	Very high	75 Å²	75	68.1 Å²	68.1	40%	0.401	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	31.1	-166.7	-50	-56	0	0	0	113.1	K69 L127 Q128 E129 R133	K69-D131 WeakPolarHBondContact CE-OD2 3.36Å; K69-D131 IonicContact NZ-OD1 3.35Å; K69-D131 PolarHBondContact NZ-OD1 2.82Å; K69-D131 IonicContact NZ-OD2 2.81Å; K69-D131 PolarHBondContact NZ-OD2 3.44Å; L127-D131 PolarHBondContact O-N 2.81Å; Q128-D131 PolarHBondContact O-N 2.79Å; E129-D131 VanDerWaalsContact C-N 3.31Å; E129-D131 PolarHBondContact O-N 3.16Å; D131-R133 HydrophobicContact CB-CG 4.29Å; D131-R133 PolarHBondContact O-N 3.24Å; D131-R133 IonicContact OD2-CZ 2.65Å; D131-R133 IonicContact OD2-NE 2.98Å; D131-R133 IonicContact OD2-NH2 2.68Å; D131-R133 PolarHBondContact OD2-NH2 2.95Å
132	W	94.3	Very high	94.2	Very high	164 Å²	164	68.7 Å²	68.7	62%	0.621	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	17.5	-173.3	-55.3	83.6	0	0	0	113.9	L127 L130 V134	L127-W132 HydrophobicContact CB-CD2 4.22Å; L127-W132 HydrophobicContact CB-CE3 4.13Å; L127-W132 HydrophobicContact CB-CH2 4.2Å; L127-W132 HydrophobicContact CB-CZ2 4.27Å; L127-W132 HydrophobicContact CB-CZ3 4.14Å; L127-W132 HydrophobicContact CD1-CE3 4.21Å; L127-W132 HydrophobicContact CD1-CH2 4Å; L127-W132 HydrophobicContact CD1-CZ3 3.64Å; L127-W132 HydrophobicContact CG-CZ3 4.43Å; L127-W132 PolarHBondContact O-N 2.85Å; L130-W132 PolarHBondContact O-N 3.08Å; W132-V134 PolarHBondContact O-N 3.39Å
133	R	93.2	Very high	94.1	Very high	157 Å²	157	72 Å²	72	59%	0.592	36%	0.355	S	S	*	.			trans	-81.6	62.4	175	-65.4	-176.9	-73.4	172.5	-8.6	110.6	R65 L130 D131 L135	R65-R133 PolarHBondContact NH1-O 3.41Å; L130-R133 WeakPolarHBondContact O-CB 3.22Å; L130-R133 PolarHBondContact O-N 3.36Å; D131-R133 HydrophobicContact CB-CG 4.29Å; D131-R133 PolarHBondContact O-N 3.24Å; D131-R133 IonicContact OD2-CZ 2.65Å; D131-R133 IonicContact OD2-NE 2.98Å; D131-R133 IonicContact OD2-NH2 2.68Å; D131-R133 PolarHBondContact OD2-NH2 2.95Å; R133-L135 VanDerWaalsContact C-N 3.35Å
134	V	91.6	Very high	94	Very high	31 Å²	31	72 Å²	72	19%	0.188	36%	0.359	C	S	.	.			trans	-73.2	-29.1	-177.5	-175.2	0	0	0	0	111.1	Y62 F93 L127 W132 V136	Y62-V134 HydrophobicContact CE1-CG1 4.5Å; Y62-V134 VanDerWaalsContact CE1-O 3.27Å; Y62-V134 WeakPolarHBondContact CE1-O 2.9Å; Y62-V134 HydrophobicContact CE2-CG1 4.4Å; Y62-V134 WeakPolarHBondContact OH-CG1 3.46Å; Y62-V134 PolarHBondContact OH-O 3.49Å; F93-V134 HydrophobicContact CB-CG1 3.89Å; F93-V134 HydrophobicContact CD2-CG1 3.7Å; F93-V134 HydrophobicContact CG-CG1 4Å; L127-V134 HydrophobicContact CD2-CG2 3.74Å; W132-V134 PolarHBondContact O-N 3.39Å; V134-V136 PolarHBondContact O-N 2.97Å; V134-V136 VanDerWaalsContact O-N 3.13Å
135	L	93.5	Very high	93.7	Very high	127 Å²	127	70 Å²	70	67%	0.665	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-56.8	121.5	-178.7	-174.3	66.7	0	0	0	112.4	R65 F93 R133	R65-L135 PolarHBondContact NH1-O 2.86Å; R65-L135 PolarHBondContact NH2-O 3.17Å; F93-L135 HydrophobicContact CE2-CD1 4.19Å; F93-L135 HydrophobicContact CZ-CD1 4.26Å; R133-L135 VanDerWaalsContact C-N 3.35Å
136	V	92.7	Very high	93.4	Very high	16 Å²	16	69.4 Å²	69.4	10%	0.097	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-100.7	121.6	169.1	-178.6	0	0	0	0	108.6	I58 L61 Y62 F93 V134 D140 F141	I58-V136 HydrophobicContact CG2-CG2 4.08Å; L61-V136 HydrophobicContact CD1-CG1 3.75Å; Y62-V136 HydrophobicContact CD1-CG2 4.44Å; Y62-V136 HydrophobicContact CE1-CG2 3.62Å; F93-V136 HydrophobicContact CE1-CB 4.42Å; V134-V136 PolarHBondContact O-N 2.97Å; V134-V136 VanDerWaalsContact O-N 3.13Å; V136-D140 HydrophobicContact CG1-CB 4.41Å; V136-F141 HydrophobicContact CG1-CB 4.07Å
137	R	93.3	Very high	93.2	Very high	176 Å²	176	74.8 Å²	74.8	66%	0.664	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-70.5	144.9	176.2	-64.2	177	176.7	-178.2	-0.9	109.2	S139 D140 F141	R137-S139 PolarHBondContact O-N 2.94Å; R137-D140 PolarHBondContact O-N 3.41Å; R137-F141 PolarHBondContact O-N 3.36Å
138	G	92.7	Very high	92.8	Very high	44 Å²	44	75.3 Å²	75.3	45%	0.454	38%	0.381	S	S	.	.	H	α-helix	trans	-54	-37.6	175.7	0	0	0	0	0	112.8	D140 F141 F142	G138-D140 PolarHBondContact O-N 3.39Å; G138-F141 PolarHBondContact O-N 3.4Å; G138-F142 WeakPolarHBondContact O-CD2 3.36Å; G138-F142 PolarHBondContact O-N 3.1Å
139	S	93.8	Very high	92.4	Very high	71 Å²	71	73 Å²	73	50%	0.497	37%	0.37	S	S	.	.	H	α-helix	trans	-59.6	-43.2	175.6	56	0	0	0	0	113.3	R137 S143	R137-S139 PolarHBondContact O-N 2.94Å; S139-S143 VanDerWaalsContact O-CB 3.31Å; S139-S143 WeakPolarHBondContact O-CB 3.15Å; S139-S143 PolarHBondContact O-N 3.28Å; S139-S143 PolarHBondContact O-OG 2.94Å
140	D	92.7	Very high	92.1	Very high	63 Å²	63	72.3 Å²	72.3	34%	0.337	37%	0.367	S	S	.	.	H	α-helix	trans	-71.2	-41.4	-177.5	-56.5	-13.3	0	0	0	109.3	R65 V136 R137 G138 S143 A144	R65-D140 IonicContact NH2-OD2 2.68Å; V136-D140 HydrophobicContact CG1-CB 4.41Å; R137-D140 PolarHBondContact O-N 3.41Å; G138-D140 PolarHBondContact O-N 3.39Å; D140-S143 PolarHBondContact O-N 2.88Å; D140-A144 WeakPolarHBondContact O-CB 3.41Å; D140-A144 PolarHBondContact O-N 3.01Å
141	F	93.4	Very high	91.8	Very high	37 Å²	37	74.7 Å²	74.7	16%	0.162	38%	0.382	C	S	.	.	H	α-helix	trans	-59.1	-52.3	173.9	178.8	-93.9	0	0	0	112	C54 I57 I58 V136 R137 G138 S143 A144 L145	C54-F141 HydrophobicContact CB-CE2 4.34Å; C54-F141 HydrophobicContact CB-CZ 4.21Å; I57-F141 HydrophobicContact CB-CD2 4.41Å; I57-F141 HydrophobicContact CB-CE2 3.9Å; I57-F141 HydrophobicContact CD1-CE2 4.26Å; I57-F141 HydrophobicContact CD1-CZ 4.21Å; I57-F141 HydrophobicContact CG2-CD2 3.76Å; I57-F141 HydrophobicContact CG2-CE2 3.72Å; I58-F141 HydrophobicContact CG1-CD2 4.05Å; I58-F141 HydrophobicContact CG1-CE2 4.2Å; V136-F141 HydrophobicContact CG1-CB 4.07Å; R137-F141 PolarHBondContact O-N 3.36Å; G138-F141 PolarHBondContact O-N 3.4Å; F141-S143 VanDerWaalsContact C-N 3.3Å; F141-S143 PolarHBondContact O-N 3.3Å; F141-A144 PolarHBondContact O-N 3.36Å; F141-L145 HydrophobicContact CE1-CD2 4.29Å; F141-L145 WeakPolarHBondContact O-CB 3.47Å; F141-L145 PolarHBondContact O-N 2.77Å
142	F	92.6	Very high	91.4	Very high	136 Å²	136	72.5 Å²	72.5	60%	0.596	37%	0.37	S	S	*	.	H	α-helix	trans	-66.7	-31.6	-179.9	-75.2	-62	0	0	0	112.8	G138 L145 S146	G138-F142 WeakPolarHBondContact O-CD2 3.36Å; G138-F142 PolarHBondContact O-N 3.1Å; F142-L145 HydrophobicContact CD1-CD2 4.12Å; F142-L145 HydrophobicContact CE1-CD2 4.47Å; F142-S146 WeakPolarHBondContact O-CB 3.34Å; F142-S146 PolarHBondContact O-N 3.12Å
143	S	92.6	Very high	91.1	Very high	80 Å²	80	65 Å²	65	56%	0.559	34%	0.343	S	S	*	.	H	α-helix	trans	-66	-44.8	173.5	-59.8	0	0	0	0	111.2	S139 D140 F141 S146 L147	S139-S143 VanDerWaalsContact O-CB 3.31Å; S139-S143 WeakPolarHBondContact O-CB 3.15Å; S139-S143 PolarHBondContact O-N 3.28Å; S139-S143 PolarHBondContact O-OG 2.94Å; D140-S143 PolarHBondContact O-N 2.88Å; F141-S143 VanDerWaalsContact C-N 3.3Å; F141-S143 PolarHBondContact O-N 3.3Å; S143-S146 PolarHBondContact O-N 3.4Å; S143-L147 PolarHBondContact O-N 2.86Å
144	A	90.9	Very high	90.8	Very high	24 Å²	24	65.2 Å²	65.2	20%	0.198	34%	0.344	C	S	.	.	H	α-helix	trans	-65.1	-43.2	175.9	0	0	0	0	0	111.9	I57 L61 D140 F141 S146 L147 L148	I57-A144 HydrophobicContact CG2-CB 3.9Å; L61-A144 HydrophobicContact CD1-CB 3.94Å; L61-A144 HydrophobicContact CD2-CB 3.91Å; L61-A144 HydrophobicContact CG-CB 4.03Å; D140-A144 WeakPolarHBondContact O-CB 3.41Å; D140-A144 PolarHBondContact O-N 3.01Å; F141-A144 PolarHBondContact O-N 3.36Å; A144-S146 PolarHBondContact O-N 3Å; A144-L147 PolarHBondContact O-N 3.34Å; A144-L148 WeakPolarHBondContact O-CB 3.35Å; A144-L148 PolarHBondContact O-N 3.07Å
145	L	90.9	Very high	90.6	Very high	42 Å²	42	67.9 Å²	67.9	22%	0.22	35%	0.35	C	S	.	.	H	α-helix	trans	-58.1	-47.7	174.3	177.5	63.6	0	0	0	110.7	I57 F141 F142 L147 L148 E149	I57-L145 HydrophobicContact CD1-CB 4.2Å; I57-L145 HydrophobicContact CD1-CD1 3.51Å; I57-L145 HydrophobicContact CD1-CG 4.43Å; F141-L145 HydrophobicContact CE1-CD2 4.29Å; F141-L145 WeakPolarHBondContact O-CB 3.47Å; F141-L145 PolarHBondContact O-N 2.77Å; F142-L145 HydrophobicContact CD1-CD2 4.12Å; F142-L145 HydrophobicContact CE1-CD2 4.47Å; L145-L147 VanDerWaalsContact C-N 3.3Å; L145-L147 PolarHBondContact O-N 2.84Å; L145-L148 PolarHBondContact O-N 3.36Å; L145-L148 VanDerWaalsContact O-N 3.16Å; L145-E149 HydrophobicContact CD1-CG 4.13Å; L145-E149 HydrophobicContact CG-CG 4.31Å; L145-E149 WeakPolarHBondContact O-CB 3.49Å; L145-E149 VanDerWaalsContact O-CG 3.31Å; L145-E149 WeakPolarHBondContact O-CG 3.07Å; L145-E149 PolarHBondContact O-N 2.61Å
146	S	90.3	Very high	90.2	Very high	33 Å²	33	63.4 Å²	63.4	23%	0.231	33%	0.326	C	S	.	.	H	α-helix	trans	-62.1	-37.4	179	-176.1	0	0	0	0	112.7	F142 S143 A144 Q150	F142-S146 WeakPolarHBondContact O-CB 3.34Å; F142-S146 PolarHBondContact O-N 3.12Å; S143-S146 PolarHBondContact O-N 3.4Å; A144-S146 PolarHBondContact O-N 3Å; S146-Q150 VanDerWaalsContact O-CG 3.27Å; S146-Q150 WeakPolarHBondContact O-CG 3.27Å; S146-Q150 PolarHBondContact O-N 3.41Å; S146-Q150 VanDerWaalsContact O-N 3.09Å; S146-Q150 PolarHBondContact O-NE2 3Å; S146-Q150 VanDerWaalsContact O-NE2 3.1Å; S146-Q150 PolarHBondContact OG-NE2 3.16Å
147	L	89.9	Confident	89.9	Confident	112 Å²	112	64.6 Å²	64.6	59%	0.586	33%	0.331	S	S	*	.	H	α-helix	trans	-65	-47.9	173.9	-173.1	160	0	0	0	110.5	S143 A144 L145 E149 Q150 V151	S143-L147 PolarHBondContact O-N 2.86Å; A144-L147 PolarHBondContact O-N 3.34Å; L145-L147 VanDerWaalsContact C-N 3.3Å; L145-L147 PolarHBondContact O-N 2.84Å; L147-E149 PolarHBondContact O-N 2.8Å; L147-Q150 WeakPolarHBondContact O-CB 3.11Å; L147-Q150 PolarHBondContact O-N 3.16Å; L147-V151 HydrophobicContact CD2-CG2 3.92Å; L147-V151 WeakPolarHBondContact O-CG2 3.26Å; L147-V151 PolarHBondContact O-N 3.05Å
148	L	88.8	Confident	89.6	Confident	31 Å²	31	61.1 Å²	61.1	16%	0.162	33%	0.334	C	S	.	.	H	α-helix	trans	-62.2	-43.6	180	-174.3	128.4	0	0	0	111.7	L23 I57 L60 A144 L145 Q150 V151 L152	L23-L148 HydrophobicContact CD1-CG 4.48Å; I57-L148 HydrophobicContact CG1-CD1 4.41Å; L60-L148 HydrophobicContact CD1-CD1 4.17Å; A144-L148 WeakPolarHBondContact O-CB 3.35Å; A144-L148 PolarHBondContact O-N 3.07Å; L145-L148 PolarHBondContact O-N 3.36Å; L145-L148 VanDerWaalsContact O-N 3.16Å; L148-Q150 VanDerWaalsContact C-N 3.33Å; L148-Q150 PolarHBondContact O-N 3.24Å; L148-V151 PolarHBondContact O-N 3.48Å; L148-L152 HydrophobicContact CD2-CD1 3.55Å; L148-L152 HydrophobicContact CD2-CG 4.33Å; L148-L152 HydrophobicContact CG-CD1 4.27Å; L148-L152 WeakPolarHBondContact O-CB 3.42Å; L148-L152 WeakPolarHBondContact O-CG 3.44Å; L148-L152 PolarHBondContact O-N 3.18Å
149	E	88.3	Confident	89.3	Confident	60 Å²	60	63.7 Å²	63.7	28%	0.28	35%	0.345	S	S	.	.	H	α-helix	trans	-57.7	-43.1	172.8	-74	-180	159.5	0	0	111.7	L145 L147 L152 A153 V170 R173	L145-E149 HydrophobicContact CD1-CG 4.13Å; L145-E149 HydrophobicContact CG-CG 4.31Å; L145-E149 WeakPolarHBondContact O-CB 3.49Å; L145-E149 VanDerWaalsContact O-CG 3.31Å; L145-E149 WeakPolarHBondContact O-CG 3.07Å; L145-E149 PolarHBondContact O-N 2.61Å; L147-E149 PolarHBondContact O-N 2.8Å; E149-L152 PolarHBondContact O-N 3.13Å; E149-A153 VanDerWaalsContact O-CB 3.24Å; E149-A153 WeakPolarHBondContact O-CB 3.37Å; E149-A153 PolarHBondContact O-N 2.98Å; E149-V170 HydrophobicContact CB-CG1 3.75Å; E149-V170 HydrophobicContact CB-CG2 4.43Å; E149-R173 IonicContact OE2-NH1 2.8Å; E149-R173 PolarHBondContact OE2-NH1 3.4Å
150	Q	89.3	Confident	88.8	Confident	31 Å²	31	65 Å²	65	15%	0.145	34%	0.339	C	S	.	.	H	α-helix	trans	-64.8	-41.5	177.2	-76.4	170.6	67.3	0	0	112.1	S146 L147 L148 R154 V170 N174	S146-Q150 VanDerWaalsContact O-CG 3.27Å; S146-Q150 WeakPolarHBondContact O-CG 3.27Å; S146-Q150 PolarHBondContact O-N 3.41Å; S146-Q150 VanDerWaalsContact O-N 3.09Å; S146-Q150 PolarHBondContact O-NE2 3Å; S146-Q150 VanDerWaalsContact O-NE2 3.1Å; S146-Q150 PolarHBondContact OG-NE2 3.16Å; L147-Q150 WeakPolarHBondContact O-CB 3.11Å; L147-Q150 PolarHBondContact O-N 3.16Å; L148-Q150 VanDerWaalsContact C-N 3.33Å; L148-Q150 PolarHBondContact O-N 3.24Å; Q150-R154 WeakPolarHBondContact O-CG 3.41Å; Q150-R154 PolarHBondContact O-N 3.13Å; Q150-R154 VanDerWaalsContact O-N 3.08Å; Q150-V170 HydrophobicContact CB-CG1 4.44Å; Q150-V170 HydrophobicContact CG-CG1 3.83Å; Q150-N174 PolarHBondContact OE1-ND2 2.91Å
151	V	88	Confident	88.5	Confident	59 Å²	59	65.3 Å²	65.3	36%	0.358	36%	0.357	S	S	.	.	H	α-helix	trans	-66.1	-45.1	177.2	174.5	0	0	0	0	110.5	L23 L147 L148 R154 R155	L23-V151 HydrophobicContact CD1-CG1 4.37Å; L23-V151 HydrophobicContact CD2-CG1 3.48Å; L23-V151 VanDerWaalsContact CD2-CG1 3.48Å; L147-V151 HydrophobicContact CD2-CG2 3.92Å; L147-V151 WeakPolarHBondContact O-CG2 3.26Å; L147-V151 PolarHBondContact O-N 3.05Å; L148-V151 PolarHBondContact O-N 3.48Å; V151-R154 PolarHBondContact O-N 3.18Å; V151-R155 WeakPolarHBondContact O-CB 3.36Å; V151-R155 PolarHBondContact O-N 3.39Å
152	L	86.8	Confident	88.2	Confident	29 Å²	29	69 Å²	69	15%	0.152	37%	0.374	C	S	.	.	H	α-helix	trans	-60	-47.3	175.5	-76.5	175.1	0	0	0	111.7	T19 L23 L148 E149 R154 R155 Q156	T19-L152 HydrophobicContact CG2-CD2 3.34Å; L23-L152 HydrophobicContact CD1-CD2 3.32Å; L23-L152 HydrophobicContact CD1-CG 3.65Å; L23-L152 HydrophobicContact CG-CD2 4.25Å; L148-L152 HydrophobicContact CD2-CD1 3.55Å; L148-L152 HydrophobicContact CD2-CG 4.33Å; L148-L152 HydrophobicContact CG-CD1 4.27Å; L148-L152 WeakPolarHBondContact O-CB 3.42Å; L148-L152 WeakPolarHBondContact O-CG 3.44Å; L148-L152 PolarHBondContact O-N 3.18Å; E149-L152 PolarHBondContact O-N 3.13Å; L152-R154 VanDerWaalsContact C-N 3.32Å; L152-R154 PolarHBondContact O-N 3.4Å; L152-R155 PolarHBondContact O-N 3.37Å; L152-R155 VanDerWaalsContact O-N 3.17Å; L152-Q156 WeakPolarHBondContact O-CB 3.44Å; L152-Q156 WeakPolarHBondContact O-CG 3.31Å; L152-Q156 PolarHBondContact O-N 3.3Å
153	A	87.7	Confident	87.9	Confident	7 Å²	7	65.5 Å²	65.5	6%	0.058	37%	0.365	C	S	.	.	H	α-helix	trans	-58.1	-45.4	178.7	0	0	0	0	0	111.3	E149 R155 Q156 I157 E167 V170 L171	E149-A153 VanDerWaalsContact O-CB 3.24Å; E149-A153 WeakPolarHBondContact O-CB 3.37Å; E149-A153 PolarHBondContact O-N 2.98Å; A153-R155 PolarHBondContact O-N 3.11Å; A153-Q156 PolarHBondContact O-N 3.27Å; A153-I157 WeakPolarHBondContact O-CD1 3.24Å; A153-I157 WeakPolarHBondContact O-CG1 3.25Å; A153-I157 PolarHBondContact O-N 3.1Å; A153-E167 HydrophobicContact CB-CB 4.01Å; A153-E167 HydrophobicContact CB-CG 3.95Å; A153-V170 HydrophobicContact CB-CG1 4.36Å; A153-L171 HydrophobicContact CB-CD2 4.41Å; A153-L171 HydrophobicContact CB-CG 4.25Å
154	R	87.9	Confident	87.7	Confident	161 Å²	161	63.8 Å²	63.8	61%	0.608	35%	0.351	S	S	*	.	H	α-helix	trans	-61.7	-44.6	175.8	-72.2	178.6	-177.9	-159.5	1.3	112.1	Q150 V151 L152 I157 S158 L171	Q150-R154 WeakPolarHBondContact O-CG 3.41Å; Q150-R154 PolarHBondContact O-N 3.13Å; Q150-R154 VanDerWaalsContact O-N 3.08Å; V151-R154 PolarHBondContact O-N 3.18Å; L152-R154 VanDerWaalsContact C-N 3.32Å; L152-R154 PolarHBondContact O-N 3.4Å; R154-I157 PolarHBondContact O-N 3.28Å; R154-S158 WeakPolarHBondContact O-CB 3.4Å; R154-S158 PolarHBondContact O-N 3.01Å; R154-S158 PolarHBondContact O-OG 2.94Å; R154-S158 VanDerWaalsContact O-OG 3.1Å; R154-L171 HydrophobicContact CG-CD2 3.89Å
155	R	86.5	Confident	87.5	Confident	86 Å²	86	71.2 Å²	71.2	33%	0.325	38%	0.376	S	S	.	.	H	α-helix	trans	-63.8	-42.1	-180	-170.2	170.1	-179.5	149.8	6.6	111.6	D22 V151 L152 A153 S158 S159	D22-R155 VanDerWaalsContact CB-CZ 3.43Å; D22-R155 PolarHBondContact O-NH1 3.27Å; D22-R155 IonicContact OD2-CZ 3.59Å; D22-R155 IonicContact OD2-NH2 3.74Å; D22-R155 PolarHBondContact OD2-NH2 2.88Å; V151-R155 WeakPolarHBondContact O-CB 3.36Å; V151-R155 PolarHBondContact O-N 3.39Å; L152-R155 PolarHBondContact O-N 3.37Å; L152-R155 VanDerWaalsContact O-N 3.17Å; A153-R155 PolarHBondContact O-N 3.11Å; R155-S158 PolarHBondContact O-N 2.83Å; R155-S159 WeakPolarHBondContact O-CB 3.39Å; R155-S159 PolarHBondContact O-N 3.42Å
156	Q	84.2	Confident	87.2	Confident	34 Å²	34	73.6 Å²	73.6	16%	0.159	39%	0.392	C	S	.	.	H	α-helix	trans	-66	-42.5	177	-71.3	-61.9	-29.9	0	0	111.9	T19 L152 A153 S159 R160	T19-Q156 PolarHBondContact OG1-NE2 3.06Å; L152-Q156 WeakPolarHBondContact O-CB 3.44Å; L152-Q156 WeakPolarHBondContact O-CG 3.31Å; L152-Q156 PolarHBondContact O-N 3.3Å; A153-Q156 PolarHBondContact O-N 3.27Å; Q156-S159 PolarHBondContact O-N 3.11Å; Q156-R160 VanDerWaalsContact O-CB 3.27Å; Q156-R160 WeakPolarHBondContact O-CB 3.45Å; Q156-R160 VanDerWaalsContact O-CG 3.29Å; Q156-R160 WeakPolarHBondContact O-CG 3.46Å; Q156-R160 PolarHBondContact O-N 3.33Å
157	I	88	Confident	87.2	Confident	40 Å²	40	73 Å²	73	21%	0.205	39%	0.386	C	S	.	.	H	α-helix	trans	-61.1	-46.7	174.5	-67.8	162.4	0	0	0	110.6	A153 R154 S159 R160 G161 C163 E167 L171	A153-I157 WeakPolarHBondContact O-CD1 3.24Å; A153-I157 WeakPolarHBondContact O-CG1 3.25Å; A153-I157 PolarHBondContact O-N 3.1Å; R154-I157 PolarHBondContact O-N 3.28Å; I157-S159 VanDerWaalsContact C-N 3.3Å; I157-S159 PolarHBondContact O-N 2.96Å; I157-R160 PolarHBondContact O-N 3.43Å; I157-G161 WeakPolarHBondContact O-CA 3.49Å; I157-G161 PolarHBondContact O-N 3.44Å; I157-C163 HydrophobicContact CD1-CB 4.14Å; I157-C163 HydrophobicContact CG1-CB 4.13Å; I157-E167 HydrophobicContact CD1-CB 4Å; I157-E167 HydrophobicContact CG1-CB 4.19Å; I157-E167 HydrophobicContact CG1-CG 4.42Å; I157-L171 HydrophobicContact CD1-CD1 3.41Å; I157-L171 VanDerWaalsContact CD1-CD1 3.41Å
158	S	87.4	Confident	87	Confident	104 Å²	104	71.7 Å²	71.7	73%	0.727	38%	0.379	S	S	*	.	H	α-helix	trans	-62.8	-37.1	178.6	-64.9	0	0	0	0	112.4	R154 R155	R154-S158 WeakPolarHBondContact O-CB 3.4Å; R154-S158 PolarHBondContact O-N 3.01Å; R154-S158 PolarHBondContact O-OG 2.94Å; R154-S158 VanDerWaalsContact O-OG 3.1Å; R155-S158 PolarHBondContact O-N 2.83Å
159	S	84.6	Confident	86.9	Confident	98 Å²	98	73.7 Å²	73.7	69%	0.685	39%	0.387	S	S	*	.	H	α-helix	trans	-75.5	-33.8	178.7	-173.9	0	0	0	0	113.3	R155 Q156 I157	R155-S159 WeakPolarHBondContact O-CB 3.39Å; R155-S159 PolarHBondContact O-N 3.42Å; Q156-S159 PolarHBondContact O-N 3.11Å; I157-S159 VanDerWaalsContact C-N 3.3Å; I157-S159 PolarHBondContact O-N 2.96Å
160	R	84.3	Confident	86.9	Confident	97 Å²	97	71.3 Å²	71.3	37%	0.366	38%	0.377	S	S	.	.	H	α-helix	trans	-94.6	-26.7	-174.8	-67.3	168.3	63.4	-169.2	4.8	113.2	Q156 I157 F162 E167	Q156-R160 VanDerWaalsContact O-CB 3.27Å; Q156-R160 WeakPolarHBondContact O-CB 3.45Å; Q156-R160 VanDerWaalsContact O-CG 3.29Å; Q156-R160 WeakPolarHBondContact O-CG 3.46Å; Q156-R160 PolarHBondContact O-N 3.33Å; I157-R160 PolarHBondContact O-N 3.43Å; R160-F162 VanDerWaalsContact C-N 3.3Å; R160-F162 HydrophobicContact CB-CD1 3.98Å; R160-F162 HydrophobicContact CB-CE1 3.91Å; R160-F162 WeakPolarHBondContact O-CD1 3.34Å; R160-E167 IonicContact NH1-OE1 3.33Å; R160-E167 PolarHBondContact NH1-OE1 2.9Å; R160-E167 IonicContact NH1-OE2 2.76Å
161	G	86.8	Confident	86.8	Confident	70 Å²	70	71.3 Å²	71.3	72%	0.722	38%	0.377	S	S	*	.	S	Bend	trans	81.1	-0.6	-174.8	0	0	0	0	0	115.1	I157	I157-G161 WeakPolarHBondContact O-CA 3.49Å; I157-G161 PolarHBondContact O-N 3.44Å
162	F	86.6	Confident	86.7	Confident	116 Å²	116	70.4 Å²	70.4	51%	0.509	37%	0.374	S	S	.	.	S	Bend	trans	-140	159	178.2	65.7	-87.2	0	0	0	112.1	R160 T164	R160-F162 VanDerWaalsContact C-N 3.3Å; R160-F162 HydrophobicContact CB-CD1 3.98Å; R160-F162 HydrophobicContact CB-CE1 3.91Å; R160-F162 WeakPolarHBondContact O-CD1 3.34Å; F162-T164 HydrophobicContact CD2-CG2 4.45Å; F162-T164 HydrophobicContact CE2-CG2 4.16Å
163	C	85.7	Confident	86.5	Confident	62 Å²	62	75.8 Å²	75.8	42%	0.419	39%	0.392	S	S	.	.			trans	-110.1	124.8	-177.1	-173.1	0	0	0	0	110.5	I157 L168	I157-C163 HydrophobicContact CD1-CB 4.14Å; I157-C163 HydrophobicContact CG1-CB 4.13Å; C163-L168 PolarHBondContact SG-N 3.14Å
164	T	88.4	Confident	85.9	Confident	43 Å²	43	81.1 Å²	81.1	26%	0.264	42%	0.42	S	S	.	.			trans	-87.3	167.3	171.7	70.2	0	0	0	0	111.2	F162 T166 E167 L168	F162-T164 HydrophobicContact CD2-CG2 4.45Å; F162-T164 HydrophobicContact CE2-CG2 4.16Å; T164-T166 VanDerWaalsContact C-N 3.27Å; T164-T166 PolarHBondContact O-N 2.94Å; T164-E167 WeakPolarHBondContact CA-OE2 3.46Å; T164-E167 WeakPolarHBondContact CB-OE2 3.24Å; T164-E167 WeakPolarHBondContact CG2-OE2 3.35Å; T164-E167 PolarHBondContact N-OE2 3.41Å; T164-E167 PolarHBondContact O-N 3.18Å; T164-E167 PolarHBondContact OG1-OE2 3.37Å; T164-L168 WeakPolarHBondContact O-CB 3.38Å; T164-L168 PolarHBondContact O-N 3.42Å
165	Y	86.6	Confident	85.2	Confident	180 Å²	180	76.2 Å²	76.2	71%	0.706	41%	0.405	S	S	*	.	H	α-helix	trans	-55.8	-41.2	179.5	-175.8	-99.4	0	0	0	112.7	L168 E169	Y165-L168 PolarHBondContact O-N 2.84Å; Y165-E169 WeakPolarHBondContact O-CB 3.36Å; Y165-E169 PolarHBondContact O-N 2.89Å
166	T	86.1	Confident	84.5	Confident	92 Å²	92	74.3 Å²	74.3	56%	0.564	41%	0.412	S	S	*	.	H	α-helix	trans	-64.3	-44.6	178.8	-52.2	0	0	0	0	112	T164 E169 V170	T164-T166 VanDerWaalsContact C-N 3.27Å; T164-T166 PolarHBondContact O-N 2.94Å; T166-E169 PolarHBondContact O-N 2.84Å; T166-V170 WeakPolarHBondContact O-CG2 3.17Å; T166-V170 PolarHBondContact O-N 3.39Å; T166-V170 VanDerWaalsContact O-N 3.07Å
167	E	88.7	Confident	83.7	Confident	21 Å²	21	80.3 Å²	80.3	10%	0.098	44%	0.438	C	S	.	.	H	α-helix	trans	-67.2	-39.2	177.9	-67.7	127	179.8	0	0	111	A153 I157 R160 T164 L171	A153-E167 HydrophobicContact CB-CB 4.01Å; A153-E167 HydrophobicContact CB-CG 3.95Å; I157-E167 HydrophobicContact CD1-CB 4Å; I157-E167 HydrophobicContact CG1-CB 4.19Å; I157-E167 HydrophobicContact CG1-CG 4.42Å; R160-E167 IonicContact NH1-OE1 3.33Å; R160-E167 PolarHBondContact NH1-OE1 2.9Å; R160-E167 IonicContact NH1-OE2 2.76Å; T164-E167 WeakPolarHBondContact CA-OE2 3.46Å; T164-E167 WeakPolarHBondContact CB-OE2 3.24Å; T164-E167 WeakPolarHBondContact CG2-OE2 3.35Å; T164-E167 PolarHBondContact N-OE2 3.41Å; T164-E167 PolarHBondContact O-N 3.18Å; T164-E167 PolarHBondContact OG1-OE2 3.37Å; E167-L171 WeakPolarHBondContact O-CB 3.38Å; E167-L171 WeakPolarHBondContact O-CG 3.5Å; E167-L171 PolarHBondContact O-N 2.96Å
168	L	87.1	Confident	83	Confident	84 Å²	84	86.2 Å²	86.2	44%	0.44	47%	0.465	S	S	.	.	H	α-helix	trans	-63.5	-43.2	175.5	-176.7	61.3	0	0	0	111.7	C163 T164 Y165 L171 S172	C163-L168 PolarHBondContact SG-N 3.14Å; T164-L168 WeakPolarHBondContact O-CB 3.38Å; T164-L168 PolarHBondContact O-N 3.42Å; Y165-L168 PolarHBondContact O-N 2.84Å; L168-L171 PolarHBondContact O-N 3.39Å; L168-S172 WeakPolarHBondContact O-CB 3.26Å; L168-S172 PolarHBondContact O-N 3.16Å; L168-S172 PolarHBondContact O-OG 2.92Å
169	E	86.9	Confident	82.6	Confident	73 Å²	73	88.5 Å²	88.5	34%	0.341	46%	0.461	S	S	.	.	H	α-helix	trans	-59.8	-53.8	178.1	-169.4	-160.9	143.3	0	0	110.5	Y165 T166 L171 S172 R173	Y165-E169 WeakPolarHBondContact O-CB 3.36Å; Y165-E169 PolarHBondContact O-N 2.89Å; T166-E169 PolarHBondContact O-N 2.84Å; E169-L171 VanDerWaalsContact C-N 3.31Å; E169-L171 PolarHBondContact O-N 2.72Å; E169-S172 WeakPolarHBondContact CA-OG 3.28Å; E169-S172 PolarHBondContact O-N 3.07Å; E169-S172 VanDerWaalsContact O-N 3.1Å; E169-S172 PolarHBondContact O-OG 2.65Å; E169-R173 WeakPolarHBondContact O-CG 3.37Å; E169-R173 PolarHBondContact O-N 2.91Å; E169-R173 VanDerWaalsContact O-N 3.09Å; E169-R173 IonicContact OE1-CZ 2.67Å; E169-R173 IonicContact OE1-NE 3.43Å; E169-R173 IonicContact OE1-NH2 3.62Å; E169-R173 PolarHBondContact OE1-NH2 2.68Å
170	V	87.7	Confident	82.3	Confident	10 Å²	10	86.3 Å²	86.3	6%	0.061	44%	0.442	C	S	.	.	H	α-helix	trans	-57.3	-44.3	179.2	169.8	0	0	0	0	111.4	E149 Q150 A153 T166	E149-V170 HydrophobicContact CB-CG1 3.75Å; E149-V170 HydrophobicContact CB-CG2 4.43Å; Q150-V170 HydrophobicContact CB-CG1 4.44Å; Q150-V170 HydrophobicContact CG-CG1 3.83Å; A153-V170 HydrophobicContact CB-CG1 4.36Å; T166-V170 WeakPolarHBondContact O-CG2 3.17Å; T166-V170 PolarHBondContact O-N 3.39Å; T166-V170 VanDerWaalsContact O-N 3.07Å
171	L	87.2	Confident	82	Confident	31 Å²	31	85.5 Å²	85.5	16%	0.162	44%	0.442	C	S	.	.	H	α-helix	trans	-69.6	-35	178.3	-68.3	175	0	0	0	112.2	A153 R154 I157 E167 L168 E169 R173 I175	A153-L171 HydrophobicContact CB-CD2 4.41Å; A153-L171 HydrophobicContact CB-CG 4.25Å; R154-L171 HydrophobicContact CG-CD2 3.89Å; I157-L171 HydrophobicContact CD1-CD1 3.41Å; I157-L171 VanDerWaalsContact CD1-CD1 3.41Å; E167-L171 WeakPolarHBondContact O-CB 3.38Å; E167-L171 WeakPolarHBondContact O-CG 3.5Å; E167-L171 PolarHBondContact O-N 2.96Å; L168-L171 PolarHBondContact O-N 3.39Å; E169-L171 VanDerWaalsContact C-N 3.31Å; E169-L171 PolarHBondContact O-N 2.72Å; L171-R173 VanDerWaalsContact C-N 3.35Å; L171-R173 PolarHBondContact O-N 2.95Å; L171-I175 VanDerWaalsContact O-CD1 3.3Å; L171-I175 WeakPolarHBondContact O-CD1 3.45Å; L171-I175 VanDerWaalsContact O-CG1 3.24Å; L171-I175 WeakPolarHBondContact O-CG1 3.43Å
172	S	85.5	Confident	81.7	Confident	41 Å²	41	87.2 Å²	87.2	29%	0.287	43%	0.431	S	S	.	.	H	α-helix	trans	-69.4	-29.5	-179.9	73.8	0	0	0	0	113.3	L168 E169 N174 I175	L168-S172 WeakPolarHBondContact O-CB 3.26Å; L168-S172 PolarHBondContact O-N 3.16Å; L168-S172 PolarHBondContact O-OG 2.92Å; E169-S172 WeakPolarHBondContact CA-OG 3.28Å; E169-S172 PolarHBondContact O-N 3.07Å; E169-S172 VanDerWaalsContact O-N 3.1Å; E169-S172 PolarHBondContact O-OG 2.65Å; S172-N174 PolarHBondContact O-N 3.3Å; S172-N174 VanDerWaalsContact O-N 3.07Å; S172-I175 PolarHBondContact O-N 3.38Å
173	R	83.5	Confident	81.4	Confident	142 Å²	142	87.8 Å²	87.8	54%	0.536	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-32.5	-178.9	-73.5	178.2	-163.4	166.7	5.6	113.3	E149 E169 L171	E149-R173 IonicContact OE2-NH1 2.8Å; E149-R173 PolarHBondContact OE2-NH1 3.4Å; E169-R173 WeakPolarHBondContact O-CG 3.37Å; E169-R173 PolarHBondContact O-N 2.91Å; E169-R173 VanDerWaalsContact O-N 3.09Å; E169-R173 IonicContact OE1-CZ 2.67Å; E169-R173 IonicContact OE1-NE 3.43Å; E169-R173 IonicContact OE1-NH2 3.62Å; E169-R173 PolarHBondContact OE1-NH2 2.68Å; L171-R173 VanDerWaalsContact C-N 3.35Å; L171-R173 PolarHBondContact O-N 2.95Å
174	N	73.5	Confident	81.3	Confident	118 Å²	118	87.9 Å²	87.9	63%	0.631	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-5	-178.1	-153	4.4	0	0	0	113.4	Q150 S172 G176	Q150-N174 PolarHBondContact OE1-ND2 2.91Å; S172-N174 PolarHBondContact O-N 3.3Å; S172-N174 VanDerWaalsContact O-N 3.07Å; N174-G176 PolarHBondContact O-N 2.98Å; N174-G176 VanDerWaalsContact O-N 3.15Å
175	I	73.5	Confident	81.1	Confident	59 Å²	59	89.5 Å²	89.5	30%	0.303	44%	0.441	S	S	.	.	S	Bend	trans	-80.5	99.3	173.7	-66.7	166.6	0	0	0	106.3	L171 S172 F177 K179 L180	L171-I175 VanDerWaalsContact O-CD1 3.3Å; L171-I175 WeakPolarHBondContact O-CD1 3.45Å; L171-I175 VanDerWaalsContact O-CG1 3.24Å; L171-I175 WeakPolarHBondContact O-CG1 3.43Å; S172-I175 PolarHBondContact O-N 3.38Å; I175-F177 PolarHBondContact O-N 3.16Å; I175-K179 HydrophobicContact CG2-CB 3.55Å; I175-L180 HydrophobicContact CG2-CB 3.94Å
176	G	71.5	Confident	81.2	Confident	45 Å²	45	85.5 Å²	85.5	46%	0.464	43%	0.427	S	S	.	.			trans	-49.1	142.7	172.8	0	0	0	0	0	110.8	N174 Q178 K179 L180	N174-G176 PolarHBondContact O-N 2.98Å; N174-G176 VanDerWaalsContact O-N 3.15Å; G176-Q178 PolarHBondContact O-N 3.18Å; G176-K179 PolarHBondContact O-N 3.49Å; G176-L180 PolarHBondContact O-N 2.87Å
177	F	68	Low	81.4	Confident	161 Å²	161	84.2 Å²	84.2	71%	0.706	42%	0.42	S	S	*	.	H	α-helix	trans	-46.6	-34.5	-173.3	-175.8	-99.6	0	0	0	113.7	I175 L180 H181	I175-F177 PolarHBondContact O-N 3.16Å; F177-L180 PolarHBondContact O-N 2.95Å; F177-H181 WeakPolarHBondContact O-CB 3.49Å; F177-H181 PolarHBondContact O-N 3.38Å
178	Q	74	Confident	81.6	Confident	164 Å²	164	87.4 Å²	87.4	77%	0.766	44%	0.438	S	S	*	.	H	α-helix	trans	-61.3	-45.1	176	-64.7	-176.3	-19.5	0	0	113.4	G176 H181 E182	G176-Q178 PolarHBondContact O-N 3.18Å; Q178-H181 PolarHBondContact O-N 3.41Å; Q178-E182 WeakPolarHBondContact O-CG 3.47Å; Q178-E182 PolarHBondContact O-N 2.94Å; Q178-E182 VanDerWaalsContact O-N 3.09Å
179	K	78.5	Confident	81.8	Confident	152 Å²	152	86.3 Å²	86.3	66%	0.661	44%	0.441	S	S	*	.	H	α-helix	trans	-69.2	-36.9	177.8	-75.1	-177.7	-179	177	0	111.4	I175 G176 H181 E182 L183	I175-K179 HydrophobicContact CG2-CB 3.55Å; G176-K179 PolarHBondContact O-N 3.49Å; K179-H181 VanDerWaalsContact C-N 3.34Å; K179-E182 PolarHBondContact O-N 3.28Å; K179-L183 WeakPolarHBondContact O-CB 3.48Å; K179-L183 PolarHBondContact O-N 2.89Å
180	L	79	Confident	82.1	Confident	51 Å²	51	87.9 Å²	87.9	27%	0.267	45%	0.451	S	S	.	.	H	α-helix	trans	-63	-43.8	176	-173.2	148.6	0	0	0	110.9	I175 G176 F177 L183 I184 L185	I175-L180 HydrophobicContact CG2-CB 3.94Å; G176-L180 PolarHBondContact O-N 2.87Å; F177-L180 PolarHBondContact O-N 2.95Å; L180-L183 PolarHBondContact O-N 2.99Å; L180-I184 HydrophobicContact CG-CD1 4.33Å; L180-I184 WeakPolarHBondContact O-CB 3.29Å; L180-I184 PolarHBondContact O-N 2.87Å; L180-L185 HydrophobicContact CD2-CD1 4.17Å; L180-L185 HydrophobicContact CD2-CG 4.21Å; L180-L185 PolarHBondContact O-N 3.44Å
181	H	76.2	Confident	82.5	Confident	80 Å²	80	91.4 Å²	91.4	37%	0.37	47%	0.472	S	S	.	.	I	π-helix	trans	-61.1	-47.5	176.7	177.7	-96.3	0	0	0	112.4	F177 Q178 K179 L185 K186	F177-H181 WeakPolarHBondContact O-CB 3.49Å; F177-H181 PolarHBondContact O-N 3.38Å; Q178-H181 PolarHBondContact O-N 3.41Å; K179-H181 VanDerWaalsContact C-N 3.34Å; H181-L185 HydrophobicContact CB-CD1 4.34Å; H181-L185 PolarHBondContact O-N 3.33Å; H181-K186 PolarHBondContact O-N 2.94Å
182	E	82.4	Confident	82.9	Confident	106 Å²	106	95 Å²	95	50%	0.495	49%	0.491	S	S	.	.	I	π-helix	trans	-63.8	-43.5	178	-72.6	-68	150.2	0	0	113	Q178 K179 K186	Q178-E182 WeakPolarHBondContact O-CG 3.47Å; Q178-E182 PolarHBondContact O-N 2.94Å; Q178-E182 VanDerWaalsContact O-N 3.09Å; K179-E182 PolarHBondContact O-N 3.28Å; E182-K186 VanDerWaalsContact CD-CE 3.44Å; E182-K186 WeakPolarHBondContact OE1-CE 3.29Å; E182-K186 IonicContact OE1-NZ 3.52Å; E182-K186 PolarHBondContact OE1-NZ 3.22Å; E182-K186 WeakPolarHBondContact OE2-CD 3.24Å; E182-K186 VanDerWaalsContact OE2-CE 3.27Å; E182-K186 WeakPolarHBondContact OE2-CE 3.23Å; E182-K186 IonicContact OE2-NZ 2.61Å; E182-K186 PolarHBondContact OE2-NZ 3.2Å
183	L	80.1	Confident	83.3	Confident	129 Å²	129	94.7 Å²	94.7	68%	0.675	49%	0.494	S	S	*	.	I	π-helix	trans	-87	-29.7	-169.1	-158.8	74	0	0	0	113.5	K179 L180 P187	K179-L183 WeakPolarHBondContact O-CB 3.48Å; K179-L183 PolarHBondContact O-N 2.89Å; L180-L183 PolarHBondContact O-N 2.99Å; L183-P187 WeakPolarHBondContact O-CG 3.14Å
184	I	83.1	Confident	83.9	Confident	63 Å²	63	93 Å²	93	32%	0.323	49%	0.494	S	S	.	.	I	π-helix	trans	-117.3	-55.2	-172	-58	-179.3	0	0	0	111.3	L180 K186 P187 I188	L180-I184 HydrophobicContact CG-CD1 4.33Å; L180-I184 WeakPolarHBondContact O-CB 3.29Å; L180-I184 PolarHBondContact O-N 2.87Å; I184-K186 PolarHBondContact O-N 2.99Å; I184-P187 WeakPolarHBondContact O-CD 3.3Å; I184-I188 HydrophobicContact CG2-CD1 3.58Å; I184-I188 WeakPolarHBondContact O-CB 3.44Å; I184-I188 VanDerWaalsContact O-CG1 3.25Å; I184-I188 WeakPolarHBondContact O-CG1 3.46Å; I184-I188 PolarHBondContact O-N 2.97Å
185	L	84.7	Confident	84.9	Confident	78 Å²	78	90.3 Å²	90.3	41%	0.408	48%	0.482	S	S	.	.	I	π-helix	trans	-67.7	-40.3	-172.6	-66.8	175.2	0	0	0	112.1	L180 H181 A189	L180-L185 HydrophobicContact CD2-CD1 4.17Å; L180-L185 HydrophobicContact CD2-CG 4.21Å; L180-L185 PolarHBondContact O-N 3.44Å; H181-L185 HydrophobicContact CB-CD1 4.34Å; H181-L185 PolarHBondContact O-N 3.33Å; L185-A189 WeakPolarHBondContact O-CB 3.25Å; L185-A189 PolarHBondContact O-N 3.08Å
186	K	88.8	Confident	85.9	Confident	95 Å²	95	90.3 Å²	90.3	41%	0.413	49%	0.487	S	S	.	.	H	α-helix	trans	-61.7	-52.5	177.7	-78.4	-171.7	-176.9	-177.9	0	113.3	H181 E182 I184 I188 A189 L190	H181-K186 PolarHBondContact O-N 2.94Å; E182-K186 VanDerWaalsContact CD-CE 3.44Å; E182-K186 WeakPolarHBondContact OE1-CE 3.29Å; E182-K186 IonicContact OE1-NZ 3.52Å; E182-K186 PolarHBondContact OE1-NZ 3.22Å; E182-K186 WeakPolarHBondContact OE2-CD 3.24Å; E182-K186 VanDerWaalsContact OE2-CE 3.27Å; E182-K186 WeakPolarHBondContact OE2-CE 3.23Å; E182-K186 IonicContact OE2-NZ 2.61Å; E182-K186 PolarHBondContact OE2-NZ 3.2Å; I184-K186 PolarHBondContact O-N 2.99Å; K186-I188 VanDerWaalsContact C-N 3.35Å; K186-I188 PolarHBondContact O-N 3.08Å; K186-A189 PolarHBondContact O-N 2.87Å; K186-L190 WeakPolarHBondContact O-CB 3.3Å; K186-L190 PolarHBondContact O-N 3.33Å
187	P	89.7	Confident	87.1	Confident	65 Å²	65	93 Å²	93	42%	0.422	49%	0.49	S	S	.	.	H	α-helix	trans	-60.8	-41.4	177	-26.6	35.1	0	0	0	113.3	L183 I184 L190 V191	L183-P187 WeakPolarHBondContact O-CG 3.14Å; I184-P187 WeakPolarHBondContact O-CD 3.3Å; P187-L190 PolarHBondContact O-N 3.41Å; P187-V191 WeakPolarHBondContact O-CG2 3.42Å; P187-V191 PolarHBondContact O-N 2.93Å
188	I	92.4	Very high	88.3	Confident	89 Å²	89	88.2 Å²	88.2	46%	0.456	48%	0.477	S	S	.	.	H	α-helix	trans	-64.9	-45.5	179.2	-67.7	173.9	0	0	0	110.6	I184 K186 L190 V191 I192	I184-I188 HydrophobicContact CG2-CD1 3.58Å; I184-I188 WeakPolarHBondContact O-CB 3.44Å; I184-I188 VanDerWaalsContact O-CG1 3.25Å; I184-I188 WeakPolarHBondContact O-CG1 3.46Å; I184-I188 PolarHBondContact O-N 2.97Å; K186-I188 VanDerWaalsContact C-N 3.35Å; K186-I188 PolarHBondContact O-N 3.08Å; I188-L190 VanDerWaalsContact C-N 3.28Å; I188-L190 PolarHBondContact O-N 2.88Å; I188-V191 PolarHBondContact O-N 2.95Å; I188-I192 HydrophobicContact CG2-CD1 3.7Å; I188-I192 HydrophobicContact CG2-CG1 4.34Å; I188-I192 VanDerWaalsContact O-CG1 3.3Å; I188-I192 WeakPolarHBondContact O-CG1 3.4Å; I188-I192 PolarHBondContact O-N 3.17Å
189	A	91.8	Very high	89.3	Confident	61 Å²	61	87.9 Å²	87.9	50%	0.504	47%	0.469	S	S	.	.	H	α-helix	trans	-60.7	-39.2	176.6	0	0	0	0	0	111.8	L185 K186 I192 G193	L185-A189 WeakPolarHBondContact O-CB 3.25Å; L185-A189 PolarHBondContact O-N 3.08Å; K186-A189 PolarHBondContact O-N 2.87Å; A189-I192 PolarHBondContact O-N 3.06Å; A189-G193 PolarHBondContact O-N 2.91Å
190	L	93.9	Very high	90.1	Very high	106 Å²	106	86 Å²	86	56%	0.555	47%	0.466	S	S	*	.	H	α-helix	trans	-62.8	-46.2	175	-173.3	159.3	0	0	0	111.1	K186 P187 I188 G193 I194	K186-L190 WeakPolarHBondContact O-CB 3.3Å; K186-L190 PolarHBondContact O-N 3.33Å; P187-L190 PolarHBondContact O-N 3.41Å; I188-L190 VanDerWaalsContact C-N 3.28Å; I188-L190 PolarHBondContact O-N 2.88Å; L190-G193 PolarHBondContact O-N 3.49Å; L190-I194 HydrophobicContact CD2-CD1 3.42Å; L190-I194 VanDerWaalsContact CD2-CD1 3.42Å; L190-I194 HydrophobicContact CD2-CG1 4.16Å; L190-I194 WeakPolarHBondContact O-CG1 3.21Å; L190-I194 PolarHBondContact O-N 2.93Å
191	V	95	Very high	90.7	Very high	84 Å²	84	89.2 Å²	89.2	51%	0.509	48%	0.483	S	S	.	.	H	α-helix	trans	-62.4	-45.8	177.6	172	0	0	0	0	111.2	P187 I188 G193 I194 V195	P187-V191 WeakPolarHBondContact O-CG2 3.42Å; P187-V191 PolarHBondContact O-N 2.93Å; I188-V191 PolarHBondContact O-N 2.95Å; V191-G193 VanDerWaalsContact C-N 3.28Å; V191-G193 PolarHBondContact O-N 3.03Å; V191-I194 PolarHBondContact O-N 3.43Å; V191-V195 HydrophobicContact CG1-CG2 4.3Å; V191-V195 WeakPolarHBondContact O-CB 3.38Å; V191-V195 VanDerWaalsContact O-CG2 3.26Å; V191-V195 WeakPolarHBondContact O-CG2 3.49Å; V191-V195 PolarHBondContact O-N 2.74Å
192	I	94.9	Very high	91.5	Very high	107 Å²	107	88.1 Å²	88.1	55%	0.549	49%	0.488	S	S	.	.	H	α-helix	trans	-60.6	-41	175.9	-66.5	167.9	0	0	0	110.4	I188 A189 V195 S196	I188-I192 HydrophobicContact CG2-CD1 3.7Å; I188-I192 HydrophobicContact CG2-CG1 4.34Å; I188-I192 VanDerWaalsContact O-CG1 3.3Å; I188-I192 WeakPolarHBondContact O-CG1 3.4Å; I188-I192 PolarHBondContact O-N 3.17Å; A189-I192 PolarHBondContact O-N 3.06Å; I192-V195 PolarHBondContact O-N 2.82Å; I192-S196 VanDerWaalsContact O-CB 3.3Å; I192-S196 WeakPolarHBondContact O-CB 3.34Å; I192-S196 PolarHBondContact O-N 3.38Å; I192-S196 PolarHBondContact O-OG 3.42Å; I192-S196 VanDerWaalsContact O-OG 3.11Å
193	G	94.8	Very high	92	Very high	34 Å²	34	88.5 Å²	88.5	35%	0.351	49%	0.493	S	S	.	.	H	α-helix	trans	-57.8	-51.1	174.9	0	0	0	0	0	112.2	A189 L190 V191 V195 S196 L197	A189-G193 PolarHBondContact O-N 2.91Å; L190-G193 PolarHBondContact O-N 3.49Å; V191-G193 VanDerWaalsContact C-N 3.28Å; V191-G193 PolarHBondContact O-N 3.03Å; G193-V195 PolarHBondContact O-N 3.32Å; G193-S196 PolarHBondContact O-N 3.49Å; G193-S196 PolarHBondContact O-OG 3.27Å; G193-L197 WeakPolarHBondContact O-CB 3.34Å; G193-L197 PolarHBondContact O-N 3.43Å
194	I	95.3	Very high	92.4	Very high	105 Å²	105	83.9 Å²	83.9	54%	0.538	48%	0.477	S	S	.	.	H	α-helix	trans	-61.7	-44.6	178.1	-67	175.9	0	0	0	111.4	L190 V191 L197 S198	L190-I194 HydrophobicContact CD2-CD1 3.42Å; L190-I194 VanDerWaalsContact CD2-CD1 3.42Å; L190-I194 HydrophobicContact CD2-CG1 4.16Å; L190-I194 WeakPolarHBondContact O-CG1 3.21Å; L190-I194 PolarHBondContact O-N 2.93Å; V191-I194 PolarHBondContact O-N 3.43Å; I194-L197 PolarHBondContact O-N 2.96Å; I194-S198 PolarHBondContact O-N 3.36Å; I194-S198 PolarHBondContact O-OG 2.84Å
195	V	96.1	Very high	92.6	Very high	62 Å²	62	84.1 Å²	84.1	38%	0.376	48%	0.483	S	S	.	.	H	α-helix	trans	-65.5	-44.5	-179.6	170.4	0	0	0	0	110.8	V191 I192 G193 L197 S198 Y199	V191-V195 HydrophobicContact CG1-CG2 4.3Å; V191-V195 WeakPolarHBondContact O-CB 3.38Å; V191-V195 VanDerWaalsContact O-CG2 3.26Å; V191-V195 WeakPolarHBondContact O-CG2 3.49Å; V191-V195 PolarHBondContact O-N 2.74Å; I192-V195 PolarHBondContact O-N 2.82Å; G193-V195 PolarHBondContact O-N 3.32Å; V195-L197 VanDerWaalsContact C-N 3.33Å; V195-L197 PolarHBondContact O-N 3.47Å; V195-S198 PolarHBondContact O-N 3Å; V195-S198 PolarHBondContact O-OG 3.02Å; V195-Y199 HydrophobicContact CG1-CD2 3.6Å; V195-Y199 HydrophobicContact CG1-CE2 3.31Å; V195-Y199 WeakPolarHBondContact O-CD2 3.29Å; V195-Y199 PolarHBondContact O-N 2.76Å
196	S	94.6	Very high	92.6	Very high	60 Å²	60	85.7 Å²	85.7	42%	0.42	49%	0.492	S	S	.	.	H	α-helix	trans	-62.3	-40	176.2	68	0	0	0	0	112.2	I192 G193 Y199 L200	I192-S196 VanDerWaalsContact O-CB 3.3Å; I192-S196 WeakPolarHBondContact O-CB 3.34Å; I192-S196 PolarHBondContact O-N 3.38Å; I192-S196 PolarHBondContact O-OG 3.42Å; I192-S196 VanDerWaalsContact O-OG 3.11Å; G193-S196 PolarHBondContact O-N 3.49Å; G193-S196 PolarHBondContact O-OG 3.27Å; S196-Y199 PolarHBondContact O-N 2.94Å; S196-L200 WeakPolarHBondContact O-CG 3.43Å; S196-L200 PolarHBondContact O-N 3.22Å
197	L	95.5	Very high	92.5	Very high	100 Å²	100	88.3 Å²	88.3	52%	0.524	50%	0.5	S	S	.	.	H	α-helix	trans	-64.9	-42.8	175.9	-179.1	62.1	0	0	0	111.7	G193 I194 V195 Y199 L200 L201	G193-L197 WeakPolarHBondContact O-CB 3.34Å; G193-L197 PolarHBondContact O-N 3.43Å; I194-L197 PolarHBondContact O-N 2.96Å; V195-L197 VanDerWaalsContact C-N 3.33Å; V195-L197 PolarHBondContact O-N 3.47Å; L197-Y199 VanDerWaalsContact C-N 3.33Å; L197-Y199 PolarHBondContact O-N 3.08Å; L197-L200 PolarHBondContact O-N 2.89Å; L197-L201 HydrophobicContact CD1-CG 4.46Å; L197-L201 HydrophobicContact CG-CD1 4.25Å; L197-L201 VanDerWaalsContact O-CG 3.32Å; L197-L201 WeakPolarHBondContact O-CG 3.36Å; L197-L201 PolarHBondContact O-N 3.22Å
198	S	93.8	Very high	92.1	Very high	61 Å²	61	90.1 Å²	90.1	43%	0.427	51%	0.506	S	S	.	.	H	α-helix	trans	-65.4	-37.3	177.5	69.3	0	0	0	0	111.9	I194 V195 L201 A202	I194-S198 PolarHBondContact O-N 3.36Å; I194-S198 PolarHBondContact O-OG 2.84Å; V195-S198 PolarHBondContact O-N 3Å; V195-S198 PolarHBondContact O-OG 3.02Å; S198-L201 PolarHBondContact O-N 3.42Å; S198-A202 WeakPolarHBondContact O-CB 3.31Å; S198-A202 PolarHBondContact O-N 2.89Å
199	Y	94.9	Very high	91.4	Very high	157 Å²	157	90.5 Å²	90.5	62%	0.616	51%	0.513	S	S	*	.	H	α-helix	trans	-62.7	-43.2	171.5	-81.1	-64.8	0	0	0	112.6	V195 S196 L197 A202 L203	V195-Y199 HydrophobicContact CG1-CD2 3.6Å; V195-Y199 HydrophobicContact CG1-CE2 3.31Å; V195-Y199 WeakPolarHBondContact O-CD2 3.29Å; V195-Y199 PolarHBondContact O-N 2.76Å; S196-Y199 PolarHBondContact O-N 2.94Å; L197-Y199 VanDerWaalsContact C-N 3.33Å; L197-Y199 PolarHBondContact O-N 3.08Å; Y199-A202 PolarHBondContact O-N 3.22Å; Y199-L203 WeakPolarHBondContact O-CG 3.46Å; Y199-L203 PolarHBondContact O-N 3.27Å
200	L	94.2	Very high	90.5	Very high	114 Å²	114	91.1 Å²	91.1	60%	0.597	51%	0.507	S	S	*	.	H	α-helix	trans	-64.5	-40.8	177.2	-71.4	174.4	0	0	0	112.3	S196 L197 L203 G204	S196-L200 WeakPolarHBondContact O-CG 3.43Å; S196-L200 PolarHBondContact O-N 3.22Å; L197-L200 PolarHBondContact O-N 2.89Å; L200-L203 PolarHBondContact O-N 2.78Å; L200-G204 PolarHBondContact O-N 2.69Å
201	L	93.2	Very high	89.5	Confident	117 Å²	117	89.2 Å²	89.2	61%	0.613	50%	0.5	S	S	*	.	H	α-helix	trans	-64.9	-39.6	176	-70	172.9	0	0	0	111.9	L197 S198 G204 S205	L197-L201 HydrophobicContact CD1-CG 4.46Å; L197-L201 HydrophobicContact CG-CD1 4.25Å; L197-L201 VanDerWaalsContact O-CG 3.32Å; L197-L201 WeakPolarHBondContact O-CG 3.36Å; L197-L201 PolarHBondContact O-N 3.22Å; S198-L201 PolarHBondContact O-N 3.42Å; L201-G204 PolarHBondContact O-N 3.1Å; L201-S205 PolarHBondContact O-N 3.4Å
202	A	92.6	Very high	88.4	Confident	57 Å²	57	88.7 Å²	88.7	47%	0.471	50%	0.499	S	S	.	.	H	α-helix	trans	-64.9	-37.8	175.2	0	0	0	0	0	112.4	S198 Y199 S205 L206	S198-A202 WeakPolarHBondContact O-CB 3.31Å; S198-A202 PolarHBondContact O-N 2.89Å; Y199-A202 PolarHBondContact O-N 3.22Å; A202-S205 PolarHBondContact O-OG 2.91Å; A202-L206 PolarHBondContact O-N 3.16Å
203	L	91.9	Very high	87.3	Confident	114 Å²	114	86.1 Å²	86.1	60%	0.597	49%	0.493	S	S	*	.	H	α-helix	trans	-68.6	-38.5	173.5	-70.1	172.1	0	0	0	112	Y199 L200 L206 Y207	Y199-L203 WeakPolarHBondContact O-CG 3.46Å; Y199-L203 PolarHBondContact O-N 3.27Å; L200-L203 PolarHBondContact O-N 2.78Å; L203-L206 PolarHBondContact O-N 3.16Å; L203-Y207 PolarHBondContact O-N 2.82Å; L203-Y207 VanDerWaalsContact O-N 3.17Å
204	G	88.8	Confident	86.2	Confident	33 Å²	33	91.1 Å²	91.1	34%	0.34	50%	0.501	S	S	.	.	H	α-helix	trans	-65.2	-39	177.3	0	0	0	0	0	113.5	L200 L201 Y207 N208	L200-G204 PolarHBondContact O-N 2.69Å; L201-G204 PolarHBondContact O-N 3.1Å; G204-Y207 PolarHBondContact O-N 3.09Å; G204-N208 PolarHBondContact O-N 3.01Å; G204-N208 VanDerWaalsContact O-N 3.07Å; G204-N208 PolarHBondContact O-ND2 3.36Å
205	S	86.9	Confident	85.3	Confident	67 Å²	67	88.4 Å²	88.4	47%	0.469	50%	0.495	S	S	.	.	H	α-helix	trans	-65.4	-39.3	175.9	68	0	0	0	0	111.8	L201 A202 Y207 N208 V209	L201-S205 PolarHBondContact O-N 3.4Å; A202-S205 PolarHBondContact O-OG 2.91Å; S205-Y207 VanDerWaalsContact C-N 3.33Å; S205-Y207 PolarHBondContact O-N 3.07Å; S205-N208 PolarHBondContact O-N 3.21Å; S205-V209 WeakPolarHBondContact O-CG2 3.12Å; S205-V209 PolarHBondContact O-N 2.99Å
206	L	85.9	Confident	84.5	Confident	111 Å²	111	89.3 Å²	89.3	58%	0.581	50%	0.5	S	S	*	.	H	α-helix	trans	-62.4	-39.4	175.6	-172.6	66.7	0	0	0	112.1	A202 L203 N210	A202-L206 PolarHBondContact O-N 3.16Å; L203-L206 PolarHBondContact O-N 3.16Å; L206-N210 PolarHBondContact O-ND2 2.81Å
207	Y	85.7	Confident	83.7	Confident	150 Å²	150	91.1 Å²	91.1	59%	0.588	51%	0.505	S	S	*	.	H	α-helix	trans	-66.9	-41.9	176.7	-162.6	-93.8	0	0	0	111.9	L203 G204 S205 N210	L203-Y207 PolarHBondContact O-N 2.82Å; L203-Y207 VanDerWaalsContact O-N 3.17Å; G204-Y207 PolarHBondContact O-N 3.09Å; S205-Y207 VanDerWaalsContact C-N 3.33Å; S205-Y207 PolarHBondContact O-N 3.07Å; Y207-N210 PolarHBondContact O-N 2.9Å
208	N	81.2	Confident	83	Confident	103 Å²	103	92.9 Å²	92.9	55%	0.551	51%	0.511	S	S	*	.	H	α-helix	trans	-67.1	-36	178.9	-78.4	-33.4	0	0	0	113.1	G204 S205 N210 T211 P212	G204-N208 PolarHBondContact O-N 3.01Å; G204-N208 VanDerWaalsContact O-N 3.07Å; G204-N208 PolarHBondContact O-ND2 3.36Å; S205-N208 PolarHBondContact O-N 3.21Å; N208-N210 PolarHBondContact O-N 3.37Å; N208-T211 WeakPolarHBondContact O-CB 3.39Å; N208-T211 PolarHBondContact O-N 3.33Å; N208-T211 PolarHBondContact O-OG1 3.37Å; N208-P212 WeakPolarHBondContact O-CD 3.09Å
209	V	78.4	Confident	82.3	Confident	98 Å²	98	94.4 Å²	94.4	59%	0.594	52%	0.517	S	S	*	.	H	α-helix	trans	-62	-29.6	177.2	169.2	0	0	0	0	112.5	S205 T211 P212	S205-V209 WeakPolarHBondContact O-CG2 3.12Å; S205-V209 PolarHBondContact O-N 2.99Å; V209-T211 PolarHBondContact O-N 2.72Å; V209-P212 VanDerWaalsContact O-CD 3.25Å; V209-P212 WeakPolarHBondContact O-CD 3.41Å; V209-P212 WeakPolarHBondContact O-CG 3.25Å
210	N	72.7	Confident	81.5	Confident	73 Å²	73	91.9 Å²	91.9	39%	0.39	51%	0.514	S	S	.	.	H	α-helix	trans	-73.5	-15.7	175.7	-66.5	-37.2	0	0	0	113.1	L206 Y207 N208 R214	L206-N210 PolarHBondContact O-ND2 2.81Å; Y207-N210 PolarHBondContact O-N 2.9Å; N208-N210 PolarHBondContact O-N 3.37Å; N210-R214 WeakPolarHBondContact O-CB 3.22Å; N210-R214 WeakPolarHBondContact O-CG 3.47Å; N210-R214 PolarHBondContact O-N 3.39Å
211	T	74	Confident	80.9	Confident	66 Å²	66	91.1 Å²	91.1	41%	0.405	51%	0.51	S	S	.	.	H	α-helix	trans	-72.2	-48.1	-178.2	67.9	0	0	0	0	114	N208 V209 A213 R214 A215	N208-T211 WeakPolarHBondContact O-CB 3.39Å; N208-T211 PolarHBondContact O-N 3.33Å; N208-T211 PolarHBondContact O-OG1 3.37Å; V209-T211 PolarHBondContact O-N 2.72Å; T211-A213 VanDerWaalsContact C-N 3.29Å; T211-A213 PolarHBondContact O-N 2.68Å; T211-R214 PolarHBondContact O-N 2.72Å; T211-A215 WeakPolarHBondContact O-CB 3.42Å; T211-A215 PolarHBondContact O-N 3.02Å
212	P	71.7	Confident	80.3	Confident	74 Å²	74	88 Å²	88	48%	0.481	50%	0.501	S	S	.	.	H	α-helix	trans	-63.8	-36.7	174.6	26	-35.6	0	0	0	111.4	N208 V209 R214 A215 V216	N208-P212 WeakPolarHBondContact O-CD 3.09Å; V209-P212 VanDerWaalsContact O-CD 3.25Å; V209-P212 WeakPolarHBondContact O-CD 3.41Å; V209-P212 WeakPolarHBondContact O-CG 3.25Å; P212-R214 PolarHBondContact O-N 2.96Å; P212-A215 PolarHBondContact O-N 3.46Å; P212-V216 VanDerWaalsContact O-CG2 3.28Å; P212-V216 WeakPolarHBondContact O-CG2 3.45Å; P212-V216 PolarHBondContact O-N 2.96Å
213	A	71	Confident	79.5	Confident	52 Å²	52	90 Å²	90	43%	0.43	50%	0.497	S	S	.	.	H	α-helix	trans	-62.8	-42.4	175.5	0	0	0	0	0	112	T211 N217	T211-A213 VanDerWaalsContact C-N 3.29Å; T211-A213 PolarHBondContact O-N 2.68Å; A213-N217 WeakPolarHBondContact O-CB 3.38Å; A213-N217 PolarHBondContact O-N 3.19Å
214	R	72.2	Confident	79.1	Confident	139 Å²	139	92 Å²	92	53%	0.525	50%	0.497	S	S	.	.	H	α-helix	trans	-64.3	-42.2	173.2	-77.2	174.1	-179.8	179	1.4	112.1	N210 T211 P212 N217 Q218	N210-R214 WeakPolarHBondContact O-CB 3.22Å; N210-R214 WeakPolarHBondContact O-CG 3.47Å; N210-R214 PolarHBondContact O-N 3.39Å; T211-R214 PolarHBondContact O-N 2.72Å; P212-R214 PolarHBondContact O-N 2.96Å; R214-N217 PolarHBondContact O-N 3.4Å; R214-Q218 WeakPolarHBondContact O-CG 3.35Å; R214-Q218 PolarHBondContact O-N 3.05Å
215	A	76.7	Confident	78.6	Confident	48 Å²	48	95.2 Å²	95.2	40%	0.397	51%	0.506	S	S	.	.	H	α-helix	trans	-62.9	-44.7	178.2	0	0	0	0	0	111.6	T211 P212 Q218 T219	T211-A215 WeakPolarHBondContact O-CB 3.42Å; T211-A215 PolarHBondContact O-N 3.02Å; P212-A215 PolarHBondContact O-N 3.46Å; A215-Q218 PolarHBondContact O-N 3.01Å; A215-T219 WeakPolarHBondContact O-CG2 3.31Å; A215-T219 PolarHBondContact O-N 2.81Å; A215-T219 PolarHBondContact O-OG1 3.48Å
216	V	78.9	Confident	78.2	Confident	81 Å²	81	97 Å²	97	49%	0.491	51%	0.511	S	S	.	.	H	α-helix	trans	-64.4	-40.8	175.6	173.8	0	0	0	0	111.4	P212 Q218 T219 L220	P212-V216 VanDerWaalsContact O-CG2 3.28Å; P212-V216 WeakPolarHBondContact O-CG2 3.45Å; P212-V216 PolarHBondContact O-N 2.96Å; V216-Q218 VanDerWaalsContact C-N 3.34Å; V216-Q218 PolarHBondContact O-N 3.16Å; V216-T219 PolarHBondContact O-N 2.88Å; V216-T219 PolarHBondContact O-OG1 2.88Å; V216-L220 HydrophobicContact CG1-CD1 4.01Å; V216-L220 HydrophobicContact CG1-CG 4.4Å; V216-L220 WeakPolarHBondContact O-CB 3.15Å; V216-L220 VanDerWaalsContact O-CG 3.31Å; V216-L220 WeakPolarHBondContact O-CG 3.49Å; V216-L220 PolarHBondContact O-N 3.44Å
217	N	78.2	Confident	77.6	Confident	98 Å²	98	94.4 Å²	94.4	52%	0.524	50%	0.499	S	S	.	.	H	α-helix	trans	-64.5	-38.8	176.2	-80.1	-18.8	0	0	0	112.3	A213 R214 L220 L221	A213-N217 WeakPolarHBondContact O-CB 3.38Å; A213-N217 PolarHBondContact O-N 3.19Å; R214-N217 PolarHBondContact O-N 3.4Å; N217-L220 PolarHBondContact O-N 3.13Å; N217-L221 WeakPolarHBondContact O-CB 3.46Å; N217-L221 VanDerWaalsContact O-CG 3.27Å; N217-L221 WeakPolarHBondContact O-CG 3.29Å; N217-L221 PolarHBondContact O-N 3.32Å
218	Q	81.1	Confident	77	Confident	138 Å²	138	90.8 Å²	90.8	65%	0.645	49%	0.49	S	S	*	.	H	α-helix	trans	-66.3	-42.2	176.5	-76.4	177.2	-15.8	0	0	112.1	R214 A215 V216 L221 A222	R214-Q218 WeakPolarHBondContact O-CG 3.35Å; R214-Q218 PolarHBondContact O-N 3.05Å; A215-Q218 PolarHBondContact O-N 3.01Å; V216-Q218 VanDerWaalsContact C-N 3.34Å; V216-Q218 PolarHBondContact O-N 3.16Å; Q218-L221 PolarHBondContact O-N 3.25Å; Q218-A222 WeakPolarHBondContact O-CB 3.36Å; Q218-A222 PolarHBondContact O-N 3.2Å
219	T	77.9	Confident	76.7	Confident	92 Å²	92	91.1 Å²	91.1	56%	0.564	49%	0.489	S	S	*	.	H	α-helix	trans	-66.9	-38	177.3	56.3	0	0	0	0	112	A215 V216 A222 Y223	A215-T219 WeakPolarHBondContact O-CG2 3.31Å; A215-T219 PolarHBondContact O-N 2.81Å; A215-T219 PolarHBondContact O-OG1 3.48Å; V216-T219 PolarHBondContact O-N 2.88Å; V216-T219 PolarHBondContact O-OG1 2.88Å; T219-A222 PolarHBondContact O-N 3.08Å; T219-Y223 WeakPolarHBondContact O-CB 3.19Å; T219-Y223 PolarHBondContact O-N 3.3Å
220	L	78.9	Confident	76.1	Confident	104 Å²	104	88.8 Å²	88.8	55%	0.545	48%	0.479	S	S	.	.	H	α-helix	trans	-65.5	-39.3	174.5	-73.2	174.4	0	0	0	112.6	V216 N217 Y223 R224	V216-L220 HydrophobicContact CG1-CD1 4.01Å; V216-L220 HydrophobicContact CG1-CG 4.4Å; V216-L220 WeakPolarHBondContact O-CB 3.15Å; V216-L220 VanDerWaalsContact O-CG 3.31Å; V216-L220 WeakPolarHBondContact O-CG 3.49Å; V216-L220 PolarHBondContact O-N 3.44Å; N217-L220 PolarHBondContact O-N 3.13Å; L220-Y223 PolarHBondContact O-N 3.04Å; L220-R224 WeakPolarHBondContact O-CB 3.26Å; L220-R224 PolarHBondContact O-N 3.02Å
221	L	81.2	Confident	75.3	Confident	98 Å²	98	90.2 Å²	90.2	51%	0.513	49%	0.485	S	S	.	.	H	α-helix	trans	-68.5	-39.5	175.8	-73	171.9	0	0	0	112.2	N217 Q218 R224 N225	N217-L221 WeakPolarHBondContact O-CB 3.46Å; N217-L221 VanDerWaalsContact O-CG 3.27Å; N217-L221 WeakPolarHBondContact O-CG 3.29Å; N217-L221 PolarHBondContact O-N 3.32Å; Q218-L221 PolarHBondContact O-N 3.25Å; L221-R224 PolarHBondContact O-N 3Å; L221-N225 WeakPolarHBondContact O-CB 3.43Å; L221-N225 VanDerWaalsContact O-CG 3.24Å; L221-N225 PolarHBondContact O-N 2.88Å
222	A	79.9	Confident	74.9	Confident	51 Å²	51	89.7 Å²	89.7	42%	0.421	49%	0.493	S	S	.	.	H	α-helix	trans	-61.1	-47.6	173.8	0	0	0	0	0	110.9	Q218 T219 R224 N225 D226	Q218-A222 WeakPolarHBondContact O-CB 3.36Å; Q218-A222 PolarHBondContact O-N 3.2Å; T219-A222 PolarHBondContact O-N 3.08Å; A222-R224 VanDerWaalsContact C-N 3.34Å; A222-R224 PolarHBondContact O-N 2.9Å; A222-N225 PolarHBondContact O-N 3.42Å; A222-D226 PolarHBondContact O-N 2.85Å
223	Y	76.4	Confident	74.6	Confident	99 Å²	99	93.3 Å²	93.3	39%	0.388	50%	0.501	S	S	.	.	H	α-helix	trans	-59.9	-43.3	175.9	-175.3	-92.5	0	0	0	112.1	T219 L220 D226 T227 P275	T219-Y223 WeakPolarHBondContact O-CB 3.19Å; T219-Y223 PolarHBondContact O-N 3.3Å; L220-Y223 PolarHBondContact O-N 3.04Å; Y223-D226 PolarHBondContact O-N 3.35Å; Y223-T227 HydrophobicContact CD1-CG2 4.15Å; Y223-T227 HydrophobicContact CE1-CG2 3.7Å; Y223-T227 WeakPolarHBondContact O-CG2 2.72Å; Y223-T227 PolarHBondContact O-N 3.09Å; Y223-T227 PolarHBondContact O-OG1 3.32Å; Y223-P275 HydrophobicContact CE2-CG 4.39Å; Y223-P275 WeakPolarHBondContact OH-CD 3.42Å; Y223-P275 WeakPolarHBondContact OH-CG 3.27Å
224	R	82.7	Confident	73.7	Confident	157 Å²	157	97.3 Å²	97.3	59%	0.592	52%	0.515	S	S	*	.	H	α-helix	trans	-61.5	-46.8	177.4	-176.4	177.5	-176.9	166	4	112.2	L220 L221 A222 D226 T227 D228	L220-R224 WeakPolarHBondContact O-CB 3.26Å; L220-R224 PolarHBondContact O-N 3.02Å; L221-R224 PolarHBondContact O-N 3Å; A222-R224 VanDerWaalsContact C-N 3.34Å; A222-R224 PolarHBondContact O-N 2.9Å; R224-D226 VanDerWaalsContact C-N 3.35Å; R224-D226 PolarHBondContact O-N 3.02Å; R224-T227 WeakPolarHBondContact CA-OG1 3.4Å; R224-T227 PolarHBondContact O-N 2.69Å; R224-T227 PolarHBondContact O-OG1 3.15Å; R224-D228 PolarHBondContact O-N 3.3Å
225	N	79.4	Confident	72.3	Confident	100 Å²	100	95.2 Å²	95.2	54%	0.535	51%	0.513	S	S	.	.	H	α-helix	trans	-64	-41.3	179.8	-70.3	-11.3	0	0	0	111.6	L221 A222 T227 D228 E229	L221-N225 WeakPolarHBondContact O-CB 3.43Å; L221-N225 VanDerWaalsContact O-CG 3.24Å; L221-N225 PolarHBondContact O-N 2.88Å; A222-N225 PolarHBondContact O-N 3.42Å; N225-T227 VanDerWaalsContact C-N 3.31Å; N225-T227 PolarHBondContact O-N 2.74Å; N225-D228 PolarHBondContact O-N 2.83Å; N225-E229 PolarHBondContact O-N 3.45Å
226	D	79	Confident	70.8	Confident	106 Å²	106	98.6 Å²	98.6	57%	0.567	53%	0.531	S	S	*	.	H	α-helix	trans	-62.6	-39.3	175.3	-73.7	-14	0	0	0	111.4	A222 Y223 R224 A230	A222-D226 PolarHBondContact O-N 2.85Å; Y223-D226 PolarHBondContact O-N 3.35Å; R224-D226 VanDerWaalsContact C-N 3.35Å; R224-D226 PolarHBondContact O-N 3.02Å; D226-A230 VanDerWaalsContact O-CB 3.25Å; D226-A230 WeakPolarHBondContact O-CB 3.37Å; D226-A230 PolarHBondContact O-N 3Å
227	T	72.2	Confident	68.9	Low	55 Å²	55	101 Å²	101	34%	0.337	53%	0.532	S	S	.	.	H	α-helix	trans	-67.3	-40.1	175.3	53.9	0	0	0	0	112.8	Y223 R224 N225 A230 M231	Y223-T227 HydrophobicContact CD1-CG2 4.15Å; Y223-T227 HydrophobicContact CE1-CG2 3.7Å; Y223-T227 WeakPolarHBondContact O-CG2 2.72Å; Y223-T227 PolarHBondContact O-N 3.09Å; Y223-T227 PolarHBondContact O-OG1 3.32Å; R224-T227 WeakPolarHBondContact CA-OG1 3.4Å; R224-T227 PolarHBondContact O-N 2.69Å; R224-T227 PolarHBondContact O-OG1 3.15Å; N225-T227 VanDerWaalsContact C-N 3.31Å; N225-T227 PolarHBondContact O-N 2.74Å; T227-A230 PolarHBondContact O-N 3.34Å; T227-M231 WeakPolarHBondContact O-CB 3.26Å; T227-M231 PolarHBondContact O-N 2.92Å
228	D	72.3	Confident	66.8	Low	75 Å²	75	105.5 Å²	105.5	40%	0.401	55%	0.547	S	S	.	.	H	α-helix	trans	-67.6	-39.6	178.1	-73.3	-24.9	0	0	0	111	R224 N225 M231 G232	R224-D228 PolarHBondContact O-N 3.3Å; N225-D228 PolarHBondContact O-N 2.83Å; D228-M231 PolarHBondContact O-N 2.79Å; D228-G232 PolarHBondContact O-N 3.47Å
229	E	74.9	Confident	64.8	Low	110 Å²	110	104.9 Å²	104.9	51%	0.514	55%	0.547	S	S	.	.	H	α-helix	trans	-67.2	-42.4	174.7	-167.2	-176	158.6	0	0	111.9	N225 G232 K233	N225-E229 PolarHBondContact O-N 3.45Å; E229-G232 PolarHBondContact O-N 3.15Å; E229-K233 WeakPolarHBondContact O-CG 3.46Å; E229-K233 PolarHBondContact O-N 3.31Å; E229-K233 VanDerWaalsContact O-N 3.08Å; E229-K233 WeakPolarHBondContact OE1-CE 3.31Å; E229-K233 IonicContact OE1-NZ 2.66Å; E229-K233 PolarHBondContact OE1-NZ 2.76Å
230	A	67.7	Low	62.5	Low	48 Å²	48	107 Å²	107	40%	0.397	55%	0.552	S	S	.	*	H	α-helix	trans	-64.1	-41.9	175.6	0	0	0	0	0	111.8	D226 T227 K233 L234	D226-A230 VanDerWaalsContact O-CB 3.25Å; D226-A230 WeakPolarHBondContact O-CB 3.37Å; D226-A230 PolarHBondContact O-N 3Å; T227-A230 PolarHBondContact O-N 3.34Å; A230-K233 PolarHBondContact O-N 2.93Å; A230-L234 WeakPolarHBondContact O-CB 3.49Å; A230-L234 WeakPolarHBondContact O-CG 3.49Å; A230-L234 PolarHBondContact O-N 3.39Å
231	M	55.4	Low	60.3	Low	103 Å²	103	109.3 Å²	109.3	51%	0.507	57%	0.565	S	S	.	*	H	α-helix	trans	-66.7	-40.7	177.7	-173.7	163.5	61.2	0	0	111.6	T227 D228 K233 L234 L235	T227-M231 WeakPolarHBondContact O-CB 3.26Å; T227-M231 PolarHBondContact O-N 2.92Å; D228-M231 PolarHBondContact O-N 2.79Å; M231-K233 VanDerWaalsContact C-N 3.33Å; M231-K233 PolarHBondContact O-N 3.44Å; M231-L234 PolarHBondContact O-N 2.92Å; M231-L235 HydrophobicContact CG-CD1 3.74Å; M231-L235 HydrophobicContact CG-CG 4.46Å; M231-L235 WeakPolarHBondContact O-CB 3.46Å; M231-L235 PolarHBondContact O-N 3.46Å
232	G	64.6	Low	58.2	Low	56 Å²	56	113.6 Å²	113.6	58%	0.577	57%	0.574	S	S	*	*	H	α-helix	trans	-62.6	-35.3	173.9	0	0	0	0	0	113.6	D228 E229	D228-G232 PolarHBondContact O-N 3.47Å; E229-G232 PolarHBondContact O-N 3.15Å
233	K	66.9	Low	56.8	Low	149 Å²	149	117.5 Å²	117.5	65%	0.648	60%	0.595	S	S	*	*	H	α-helix	trans	-74.7	-32.5	174.9	-73.1	176	-173	165.3	0	113.3	E229 A230 M231	E229-K233 WeakPolarHBondContact O-CG 3.46Å; E229-K233 PolarHBondContact O-N 3.31Å; E229-K233 VanDerWaalsContact O-N 3.08Å; E229-K233 WeakPolarHBondContact OE1-CE 3.31Å; E229-K233 IonicContact OE1-NZ 2.66Å; E229-K233 PolarHBondContact OE1-NZ 2.76Å; A230-K233 PolarHBondContact O-N 2.93Å; M231-K233 VanDerWaalsContact C-N 3.33Å; M231-K233 PolarHBondContact O-N 3.44Å
234	L	51.8	Low	55.3	Low	137 Å²	137	116.7 Å²	116.7	72%	0.717	60%	0.598	S	S	*	*	H	α-helix	trans	-81.7	-23.6	-179.7	-74.9	167.1	0	0	0	113.3	A230 M231 P236	A230-L234 WeakPolarHBondContact O-CB 3.49Å; A230-L234 WeakPolarHBondContact O-CG 3.49Å; A230-L234 PolarHBondContact O-N 3.39Å; M231-L234 PolarHBondContact O-N 2.92Å; L234-P236 WeakPolarHBondContact O-CD 2.8Å
235	L	42.1	Very low	53.4	Low	94 Å²	94	113.1 Å²	113.1	49%	0.492	59%	0.59	S	S	.	*			trans	-110.1	60.2	-179.9	-62.6	175	0	0	0	113.5	M231 Y237	M231-L235 HydrophobicContact CG-CD1 3.74Å; M231-L235 HydrophobicContact CG-CG 4.46Å; M231-L235 WeakPolarHBondContact O-CB 3.46Å; M231-L235 PolarHBondContact O-N 3.46Å; L235-Y237 PolarHBondContact O-N 3.33Å
236	P	45.4	Very low	51.9	Low	119 Å²	119	111.3 Å²	111.3	77%	0.773	59%	0.585	S	S	*	*			trans	-70.1	-3	163.3	31.6	-30.8	0	0	0	112	L234 K238	L234-P236 WeakPolarHBondContact O-CD 2.8Å; P236-K238 PolarHBondContact O-N 2.81Å
237	Y	38.3	Very low	50.4	Low	133 Å²	133	110.1 Å²	110.1	52%	0.522	58%	0.582	S	S	.	*	S	Bend	trans	-83	104	172	159.5	-100.1	0	0	0	109.6	L235 I239 M240	L235-Y237 PolarHBondContact O-N 3.33Å; Y237-I239 PolarHBondContact O-N 3.4Å; Y237-M240 HydrophobicContact CE2-CG 3.89Å; Y237-M240 WeakPolarHBondContact OH-CB 3.41Å; Y237-M240 WeakPolarHBondContact OH-CG 3.06Å; Y237-M240 PolarHBondContact OH-N 3.19Å
238	K	34	Very low	49.1	Very low	191 Å²	191	111.2 Å²	111.2	83%	0.83	59%	0.585	S	S	*	*			trans	-42.8	112.1	160.8	-174.7	177	-175	179	0	108.2	P236 M240	P236-K238 PolarHBondContact O-N 2.81Å; K238-M240 PolarHBondContact O-N 3.03Å
239	I	39.1	Very low	47.9	Very low	125 Å²	125	111.7 Å²	111.7	64%	0.641	60%	0.595	S	S	*	*			trans	-46.7	108.7	173.3	-61.9	168.9	0	0	0	106.2	Y237 D241	Y237-I239 PolarHBondContact O-N 3.4Å; I239-D241 PolarHBondContact O-N 3.38Å; I239-D241 VanDerWaalsContact O-N 3.1Å
240	M	29.6	Very low	46.4	Very low	138 Å²	138	112 Å²	112	68%	0.68	60%	0.595	S	S	*	*			trans	-62.8	114.7	165.5	-72.7	-166	175.6	0	0	105.4	Y237 K238 R242	Y237-M240 HydrophobicContact CE2-CG 3.89Å; Y237-M240 WeakPolarHBondContact OH-CB 3.41Å; Y237-M240 WeakPolarHBondContact OH-CG 3.06Å; Y237-M240 PolarHBondContact OH-N 3.19Å; K238-M240 PolarHBondContact O-N 3.03Å; M240-R242 VanDerWaalsContact C-N 3.26Å; M240-R242 PolarHBondContact O-N 3.35Å
241	D	33.8	Very low	45.3	Very low	152 Å²	152	115.1 Å²	115.1	81%	0.813	61%	0.609	S	S	*	*			trans	-53.6	95.4	167.5	-77.9	-40.8	0	0	0	108.3	I239 P243	I239-D241 PolarHBondContact O-N 3.38Å; I239-D241 VanDerWaalsContact O-N 3.1Å; D241-P243 WeakPolarHBondContact O-CD 3.36Å
242	R	37.9	Very low	44.4	Very low	188 Å²	188	114 Å²	114	71%	0.709	62%	0.616	S	S	*	*			trans	-94	99.4	157.6	-91.5	-90	-169.1	159.9	1.9	104.5	M240 D244	M240-R242 VanDerWaalsContact C-N 3.26Å; M240-R242 PolarHBondContact O-N 3.35Å; R242-D244 WeakPolarHBondContact CD-OD1 3.45Å; R242-D244 PolarHBondContact O-N 2.99Å
243	P	49.7	Very low	43.8	Very low	133 Å²	133	115.2 Å²	115.2	86%	0.864	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	5.5	-171.2	28	-35	0	0	0	113.9	D241	D241-P243 WeakPolarHBondContact O-CD 3.36Å
244	D	44.9	Very low	43	Very low	81 Å²	81	112.1 Å²	112.1	43%	0.433	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.9	1.3	-177.5	61.8	-46.7	0	0	0	115	R242	R242-D244 WeakPolarHBondContact CD-OD1 3.45Å; R242-D244 PolarHBondContact O-N 2.99Å
245	L	43	Very low	42.3	Very low	82 Å²	82	112.2 Å²	112.2	43%	0.429	62%	0.616	S	S	.	*			trans	-137.7	111.6	-179.8	-144.9	81	0	0	0	112.3	V247 Q262	L245-V247 HydrophobicContact CD2-CG2 4.32Å; L245-Q262 HydrophobicContact CD1-CB 3.79Å; L245-Q262 HydrophobicContact CD1-CG 3.85Å
246	S	48.3	Very low	42.6	Very low	62 Å²	62	110.6 Å²	110.6	43%	0.434	61%	0.607	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.2	132.8	166.1	60.4	0	0	0	0	109.8	Y261	S246-Y261 PolarHBondContact O-N 3.37Å
247	V	46.8	Very low	42.4	Very low	82 Å²	82	105.7 Å²	105.7	50%	0.497	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.3	114.8	178.9	-178.6	0	0	0	0	107.7	L245 T260	L245-V247 HydrophobicContact CD2-CG2 4.32Å; V247-T260 HydrophobicContact CG1-CG2 4.17Å; V247-T260 HydrophobicContact CG2-CG2 3.88Å
248	D	44.2	Very low	42.8	Very low	77 Å²	77	102.7 Å²	102.7	41%	0.412	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.5	135.7	176.9	-68.9	-35.3	0	0	0	109.8	F250 V259 Y261	D248-F250 HydrophobicContact CB-CE2 3.75Å; D248-F250 HydrophobicContact CB-CZ 4.22Å; D248-V259 PolarHBondContact N-O 3.49Å; D248-V259 PolarHBondContact O-N 3.28Å; D248-V259 VanDerWaalsContact O-N 3.12Å; D248-Y261 HydrophobicContact CB-CE2 4.32Å
249	S	47.4	Very low	43.3	Very low	86 Å²	86	93.8 Å²	93.8	60%	0.601	53%	0.531	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.7	130.6	176.7	65.3	0	0	0	0	110.7
250	F	42.9	Very low	43.6	Very low	117 Å²	117	88.6 Å²	88.6	51%	0.513	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	135.9	174.7	-63.2	-87.5	0	0	0	110.7	D248 S257	D248-F250 HydrophobicContact CB-CE2 3.75Å; D248-F250 HydrophobicContact CB-CZ 4.22Å; F250-S257 PolarHBondContact N-O 3.24Å; F250-S257 VanDerWaalsContact N-O 3.15Å; F250-S257 PolarHBondContact O-N 3.36Å
251	T	44.4	Very low	44.3	Very low	113 Å²	113	86 Å²	86	69%	0.693	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.3	121.9	176	29.7	0	0	0	0	109.9	I256	T251-I256 HydrophobicContact CG2-CG1 3.89Å
252	A	37.6	Very low	44.9	Very low	80 Å²	80	83.3 Å²	83.3	66%	0.661	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126	97.1	172.3	0	0	0	0	0	108.9	R255	A252-R255 PolarHBondContact N-O 2.83Å; A252-R255 PolarHBondContact O-N 2.81Å
253	G	52.6	Low	45.6	Very low	81 Å²	81	84 Å²	84	84%	0.835	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	-132.2	-175.9	0	0	0	0	0	112.6	R255	G253-R255 PolarHBondContact O-N 3.19Å
254	S	49.2	Very low	45.7	Very low	84 Å²	84	85.9 Å²	85.9	59%	0.587	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	15.8	-179	57	0	0	0	0	114.6	A274	S254-A274 WeakPolarHBondContact O-CB 3.39Å; S254-A274 PolarHBondContact O-N 3.31Å
255	R	37.6	Very low	45.5	Very low	138 Å²	138	88.7 Å²	88.7	52%	0.521	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	131	-178.8	-67.2	-177.3	178.4	-177.8	-0	111	A252 G253 F272	A252-R255 PolarHBondContact N-O 2.83Å; A252-R255 PolarHBondContact O-N 2.81Å; G253-R255 PolarHBondContact O-N 3.19Å; R255-F272 WeakPolarHBondContact CA-O 3.34Å
256	I	47.2	Very low	45.7	Very low	60 Å²	60	89.5 Å²	89.5	31%	0.308	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.6	172.2	-57	172.8	0	0	0	107.7	T251 F272	T251-I256 HydrophobicContact CG2-CG1 3.89Å; I256-F272 PolarHBondContact N-O 3.25Å; I256-F272 PolarHBondContact O-N 3.05Å
257	S	43.1	Very low	45.6	Very low	17 Å²	17	89.3 Å²	89.3	12%	0.119	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.4	173.9	-61.5	0	0	0	0	109.5	F250	F250-S257 PolarHBondContact N-O 3.24Å; F250-S257 VanDerWaalsContact N-O 3.15Å; F250-S257 PolarHBondContact O-N 3.36Å
258	L	44.6	Very low	45.4	Very low	69 Å²	69	92.3 Å²	92.3	36%	0.361	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	121.7	170	-69.5	169.5	0	0	0	108.8	L269 F272	L258-L269 PolarHBondContact O-N 2.94Å; L258-F272 HydrophobicContact CD1-CE2 4.5Å
259	V	44.6	Very low	45.6	Very low	5 Å²	5	92.4 Å²	92.4	3%	0.03	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	129.3	176.4	-177.3	0	0	0	0	108.4	D248 Y261 I266 W268	D248-V259 PolarHBondContact N-O 3.49Å; D248-V259 PolarHBondContact O-N 3.28Å; D248-V259 VanDerWaalsContact O-N 3.12Å; V259-Y261 HydrophobicContact CG1-CD2 4.49Å; V259-Y261 HydrophobicContact CG1-CE1 4.38Å; V259-Y261 HydrophobicContact CG1-CE2 3.96Å; V259-I266 HydrophobicContact CG1-CG2 3.81Å; V259-W268 HydrophobicContact CG2-CE3 4.05Å; V259-W268 HydrophobicContact CG2-CH2 4.19Å; V259-W268 HydrophobicContact CG2-CZ3 3.82Å
260	T	46.5	Very low	45.3	Very low	16 Å²	16	95.7 Å²	95.7	10%	0.098	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	138.3	170.1	73	0	0	0	0	109.2	V247 I267 L269	V247-T260 HydrophobicContact CG1-CG2 4.17Å; V247-T260 HydrophobicContact CG2-CG2 3.88Å; T260-I267 PolarHBondContact O-N 3.42Å; T260-L269 HydrophobicContact CG2-CD1 3.38Å; T260-L269 HydrophobicContact CG2-CG 4.2Å
261	Y	43.9	Very low	45.4	Very low	82 Å²	82	96.7 Å²	96.7	32%	0.322	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.3	175.2	-60.9	-89.5	0	0	0	109.4	S246 D248 V259 I266	S246-Y261 PolarHBondContact O-N 3.37Å; D248-Y261 HydrophobicContact CB-CE2 4.32Å; V259-Y261 HydrophobicContact CG1-CD2 4.49Å; V259-Y261 HydrophobicContact CG1-CE1 4.38Å; V259-Y261 HydrophobicContact CG1-CE2 3.96Å; Y261-I266 HydrophobicContact CD1-CG1 4.35Å; Y261-I266 HydrophobicContact CE1-CG1 4.07Å
262	Q	46.1	Very low	45.5	Very low	97 Å²	97	94.2 Å²	94.2	45%	0.453	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	114	167	-161.2	-177.8	13.4	0	0	109.1	L245 D264 Q265	L245-Q262 HydrophobicContact CD1-CB 3.79Å; L245-Q262 HydrophobicContact CD1-CG 3.85Å; Q262-D264 PolarHBondContact O-N 3.06Å; Q262-Q265 PolarHBondContact N-O 3.02Å; Q262-Q265 PolarHBondContact O-N 3.29Å
263	K	53.1	Low	45.6	Very low	201 Å²	201	96.4 Å²	96.4	87%	0.874	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	37.9	64.7	177.6	-70.1	-176.4	176.7	177.5	0	113.6	Q265	K263-Q265 VanDerWaalsContact C-N 3.26Å; K263-Q265 PolarHBondContact O-N 2.86Å
264	D	52	Low	45.4	Very low	173 Å²	173	94.2 Å²	94.2	93%	0.925	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	11.5	177	-70.6	-17.1	0	0	0	117.4	Q262	Q262-D264 PolarHBondContact O-N 3.06Å
265	Q	39.8	Very low	45.4	Very low	140 Å²	140	92.7 Å²	92.7	65%	0.654	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	128.5	165.9	-65.8	-158.2	-13.8	0	0	112	Q262 K263	Q262-Q265 PolarHBondContact N-O 3.02Å; Q262-Q265 PolarHBondContact O-N 3.29Å; K263-Q265 VanDerWaalsContact C-N 3.26Å; K263-Q265 PolarHBondContact O-N 2.86Å
266	I	48.3	Very low	45.8	Very low	100 Å²	100	93 Å²	93	51%	0.513	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	108.9	173.1	-58.8	176.4	0	0	0	107.8	V259 Y261	V259-I266 HydrophobicContact CG1-CG2 3.81Å; Y261-I266 HydrophobicContact CD1-CG1 4.35Å; Y261-I266 HydrophobicContact CE1-CG1 4.07Å
267	I	45.2	Very low	45.4	Very low	58 Å²	58	96.3 Å²	96.3	30%	0.297	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	113	176.1	-56.5	175.2	0	0	0	108.3	T260 L269	T260-I267 PolarHBondContact O-N 3.42Å; I267-L269 HydrophobicContact CG2-CD2 4.27Å; I267-L269 PolarHBondContact O-N 3.13Å
268	W	43.3	Very low	45.2	Very low	144 Å²	144	103.6 Å²	103.6	55%	0.545	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	107.2	175	-69.8	91.2	0	0	0	109.8	V259 R270 Y271	V259-W268 HydrophobicContact CG2-CE3 4.05Å; V259-W268 HydrophobicContact CG2-CH2 4.19Å; V259-W268 HydrophobicContact CG2-CZ3 3.82Å; W268-R270 PolarHBondContact O-N 3.35Å; W268-Y271 HydrophobicContact CE3-CE1 4.49Å; W268-Y271 HydrophobicContact CZ3-CE1 4.47Å
269	L	47.8	Very low	45	Very low	79 Å²	79	104.5 Å²	104.5	41%	0.414	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	1.3	-175.2	-77.3	179.9	0	0	0	115.1	L258 T260 I267	L258-L269 PolarHBondContact O-N 2.94Å; T260-L269 HydrophobicContact CG2-CD1 3.38Å; T260-L269 HydrophobicContact CG2-CG 4.2Å; I267-L269 HydrophobicContact CG2-CD2 4.27Å; I267-L269 PolarHBondContact O-N 3.13Å
270	R	42.2	Very low	44.6	Very low	156 Å²	156	113.9 Å²	113.9	59%	0.589	56%	0.56	S	S	*	*	E	Extended strand (participates in β ladder)	trans	114.6	148.3	172.7	-165.2	176.3	-165.4	-152.4	1	113.9	W268	W268-R270 PolarHBondContact O-N 3.35Å
271	Y	44.1	Very low	44.3	Very low	137 Å²	137	117.2 Å²	117.2	54%	0.537	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81	131	177	-56.2	-82.6	0	0	0	111.1	W268	W268-Y271 HydrophobicContact CE3-CE1 4.49Å; W268-Y271 HydrophobicContact CZ3-CE1 4.47Å
272	F	47.1	Very low	44.1	Very low	61 Å²	61	117.8 Å²	117.8	27%	0.268	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.8	133.1	168.3	-65.9	-86.3	0	0	0	110.1	R255 I256 L258 I286	R255-F272 WeakPolarHBondContact CA-O 3.34Å; I256-F272 PolarHBondContact N-O 3.25Å; I256-F272 PolarHBondContact O-N 3.05Å; L258-F272 HydrophobicContact CD1-CE2 4.5Å; F272-I286 HydrophobicContact CE1-CD1 4.01Å; F272-I286 HydrophobicContact CZ-CD1 4.3Å
273	L	39.9	Very low	43.8	Very low	126 Å²	126	119.5 Å²	119.5	66%	0.66	60%	0.596	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.3	131.5	161.2	-78.7	155.4	0	0	0	107.3
274	A	47	Very low	43.2	Very low	36 Å²	36	117.2 Å²	117.2	30%	0.298	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-52.8	125.4	173.1	0	0	0	0	0	109.2	S254 T276	S254-A274 WeakPolarHBondContact O-CB 3.39Å; S254-A274 PolarHBondContact O-N 3.31Å; A274-T276 PolarHBondContact O-N 2.92Å; A274-T276 VanDerWaalsContact O-N 3.11Å
275	P	49.2	Very low	42.3	Very low	51 Å²	51	119 Å²	119	33%	0.331	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-62.1	117.4	-177	23.2	-31.4	0	0	0	109.4	Y223 N277	Y223-P275 HydrophobicContact CE2-CG 4.39Å; Y223-P275 WeakPolarHBondContact OH-CD 3.42Å; Y223-P275 WeakPolarHBondContact OH-CG 3.27Å; P275-N277 VanDerWaalsContact C-N 3.27Å; P275-N277 PolarHBondContact O-N 3.28Å
276	T	47.7	Very low	42.3	Very low	144 Å²	144	114.6 Å²	114.6	88%	0.883	57%	0.568	S	S	*	*	S	Bend	trans	-83.3	-2.2	-178.7	49.6	0	0	0	0	113.1	A274	A274-T276 PolarHBondContact O-N 2.92Å; A274-T276 VanDerWaalsContact O-N 3.11Å
277	N	38	Very low	41.6	Very low	131 Å²	131	114.7 Å²	114.7	70%	0.701	57%	0.574	S	S	*	*	S	Bend	trans	-161.2	154.5	176.3	-134.5	-20.7	0	0	0	110.6	P275 S279	P275-N277 VanDerWaalsContact C-N 3.27Å; P275-N277 PolarHBondContact O-N 3.28Å; N277-S279 PolarHBondContact O-N 3.48Å; N277-S279 PolarHBondContact O-OG 3.35Å
278	N	39.6	Very low	41.3	Very low	169 Å²	169	118 Å²	118	90%	0.904	59%	0.592	S	S	*	*	S	Bend	trans	-53.7	24.2	-167.9	-90.9	-15.7	0	0	0	119.7	K280	N278-K280 PolarHBondContact O-N 2.68Å; N278-K280 VanDerWaalsContact O-N 3.16Å
279	S	39.2	Very low	40.7	Very low	88 Å²	88	120 Å²	120	62%	0.615	60%	0.604	S	S	*	*			trans	-73.1	105.1	167	58.1	0	0	0	0	109.7	N277 I281	N277-S279 PolarHBondContact O-N 3.48Å; N277-S279 PolarHBondContact O-OG 3.35Å; S279-I281 PolarHBondContact O-N 2.89Å; S279-I281 VanDerWaalsContact O-N 3.08Å
280	K	36.6	Very low	40.1	Very low	202 Å²	202	124.2 Å²	124.2	88%	0.878	62%	0.619	S	S	*	*			trans	-46.6	116.1	158.3	-90.8	179.7	173.1	179.5	0	108.4	N278 D282	N278-K280 PolarHBondContact O-N 2.68Å; N278-K280 VanDerWaalsContact O-N 3.16Å; K280-D282 PolarHBondContact O-N 2.9Å; K280-D282 VanDerWaalsContact O-N 3.15Å
281	I	41.3	Very low	39.5	Very low	86 Å²	86	123.6 Å²	123.6	44%	0.441	63%	0.626	S	S	.	*			trans	-69.4	109.9	168.5	-63.4	173.6	0	0	0	105.9	S279 I283 I286	S279-I281 PolarHBondContact O-N 2.89Å; S279-I281 VanDerWaalsContact O-N 3.08Å; I281-I283 PolarHBondContact O-N 3.2Å; I281-I283 VanDerWaalsContact O-N 3.1Å; I281-I286 HydrophobicContact CG2-CD1 3.79Å
282	D	38	Very low	38.8	Very low	95 Å²	95	122.3 Å²	122.3	51%	0.508	64%	0.637	S	S	.	*			trans	-73.6	95.9	174.2	-160.8	9.5	0	0	0	108	K280 D284 R285	K280-D282 PolarHBondContact O-N 2.9Å; K280-D282 VanDerWaalsContact O-N 3.15Å; D282-D284 PolarHBondContact O-N 3.46Å; D282-R285 PolarHBondContact O-N 3.11Å
283	I	40.7	Very low	38.1	Very low	132 Å²	132	132 Å²	132	68%	0.677	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-59.6	-28.6	-174.2	-61.4	173.2	0	0	0	110.6	I281 R285 I286	I281-I283 PolarHBondContact O-N 3.2Å; I281-I283 VanDerWaalsContact O-N 3.1Å; I283-R285 PolarHBondContact O-N 2.84Å; I283-I286 PolarHBondContact O-N 2.57Å
284	D	39.1	Very low	38	Very low	153 Å²	153	132.3 Å²	132.3	82%	0.818	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-68	-18.2	-178.8	-72.1	-9.1	0	0	0	113.9	D282	D282-D284 PolarHBondContact O-N 3.46Å
285	R	34.8	Very low	37.5	Very low	211 Å²	211	137.3 Å²	137.3	80%	0.796	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-102.2	8.2	-179.6	-75.3	-170.4	174.2	-158.8	0.3	114.6	D282 I283 P287	D282-R285 PolarHBondContact O-N 3.11Å; I283-R285 PolarHBondContact O-N 2.84Å; R285-P287 WeakPolarHBondContact O-CD 3.42Å
286	I	38.4	Very low	36.9	Very low	48 Å²	48	142.1 Å²	142.1	25%	0.246	72%	0.721	C	S	.	*			trans	-90.6	109.5	177.5	-53.2	176.1	0	0	0	108.7	F272 I281 I283 I288	F272-I286 HydrophobicContact CE1-CD1 4.01Å; F272-I286 HydrophobicContact CZ-CD1 4.3Å; I281-I286 HydrophobicContact CG2-CD1 3.79Å; I283-I286 PolarHBondContact O-N 2.57Å; I286-I288 PolarHBondContact O-N 3.21Å
287	P	34.1	Very low	36.3	Very low	101 Å²	101	142 Å²	142	66%	0.656	71%	0.712	S	S	*	*			trans	-64	114.1	172.3	25.5	-31.7	0	0	0	108.7	R285 K289	R285-P287 WeakPolarHBondContact O-CD 3.42Å; P287-K289 PolarHBondContact O-N 2.65Å
288	I	40.3	Very low	36.2	Very low	129 Å²	129	142.7 Å²	142.7	66%	0.662	71%	0.712	S	S	*	*			trans	-67.6	96.6	172.6	-57.5	171	0	0	0	106.8	I286 F290	I286-I288 PolarHBondContact O-N 3.21Å; I288-F290 HydrophobicContact CG2-CD2 4.16Å; I288-F290 HydrophobicContact CG2-CE2 3.76Å; I288-F290 HydrophobicContact CG2-CZ 3.96Å
289	K	30.2	Very low	35.9	Very low	186 Å²	186	140.9 Å²	140.9	81%	0.809	70%	0.699	S	S	*	*			trans	-87.9	105.7	166.6	-91.7	-170.9	174	-175.6	0	108.3	P287 I291	P287-K289 PolarHBondContact O-N 2.65Å; K289-I291 PolarHBondContact O-N 3.19Å
290	F	35.4	Very low	35.7	Very low	167 Å²	167	144.7 Å²	144.7	73%	0.732	71%	0.705	S	S	*	*			trans	-62	113	160.2	-64.4	-86.2	0	0	0	107.6	I288 S292	I288-F290 HydrophobicContact CG2-CD2 4.16Å; I288-F290 HydrophobicContact CG2-CE2 3.76Å; I288-F290 HydrophobicContact CG2-CZ 3.96Å; F290-S292 PolarHBondContact O-N 2.98Å
291	I	29.8	Very low	35.6	Very low	143 Å²	143	140.3 Å²	140.3	73%	0.733	69%	0.692	S	S	*	*			trans	-89.2	99.9	166.2	-59.9	174.6	0	0	0	104.9	K289 F293	K289-I291 PolarHBondContact O-N 3.19Å; I291-F293 HydrophobicContact CG2-CE2 4.41Å
292	S	28.2	Very low	35.1	Very low	109 Å²	109	144.8 Å²	144.8	76%	0.762	71%	0.713	S	S	*	*			trans	-73.4	124	164.1	64.7	0	0	0	0	107.8	F290	F290-S292 PolarHBondContact O-N 2.98Å
293	F	32.7	Very low	34.9	Very low	264 Å²	264	149.4 Å²	149.4	100%	1.158	73%	0.732	S	S	*	*			trans	-80.9	0	150.9	-79.9	-82.1	0	0	0	108.7	I291	I291-F293 HydrophobicContact CG2-CE2 4.41Å

Retrieved 293 of 293 residues in 204 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).