A0A077Z139_TRITR Loading...

Epithelium specific ets factor 3, ese3

AlphaFold DB , UniProt , Accession A0A077Z139, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 256 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.5	Very low	47.2	Very low	241 Å²	241	162.7 Å²	162.7	100%	1.187	88%	0.88	S	S	*	*				0	123.2	0	-75.3	168	152.3	0	0	108.3
2	S	47.7	Very low	47	Very low	129 Å²	129	166.2 Å²	166.2	90%	0.902	88%	0.88	S	S	*	*			trans	52.6	102.8	170.3	-56.4	0	0	0	0	121.5
3	R	45.7	Very low	46.3	Very low	247 Å²	247	163.6 Å²	163.6	93%	0.932	88%	0.875	S	S	*	*			trans	-84	150.6	164.6	-76.1	173	139.7	148.7	-5.6	110.9
4	G	39.8	Very low	45.6	Very low	79 Å²	79	162.3 Å²	162.3	81%	0.814	87%	0.867	S	S	*	*			trans	-71	166.8	-177	0	0	0	0	0	116.1
5	T	57.6	Low	44.9	Very low	133 Å²	133	159.3 Å²	159.3	82%	0.816	86%	0.86	S	S	*	*			trans	-142.2	109.2	173.5	-51.2	0	0	0	0	109
6	L	47.9	Very low	44.4	Very low	182 Å²	182	159.6 Å²	159.6	95%	0.953	86%	0.861	S	S	*	*			trans	-78.2	114.8	165.9	-77.9	159.4	0	0	0	107.8
7	S	50.9	Low	44.3	Very low	108 Å²	108	155.7 Å²	155.7	76%	0.755	85%	0.849	S	S	*	*			trans	-101.2	108.5	178.6	49.5	0	0	0	0	112
8	S	46.1	Very low	44.4	Very low	106 Å²	106	153.9 Å²	153.9	74%	0.741	84%	0.843	S	S	*	*			trans	46.2	98.7	132.9	-157.8	0	0	0	0	118.6	R10	S8-R10 PolarHBondContact O-N 3.14Å; S8-R10 VanDerWaalsContact O-N 3.12Å
9	V	48.9	Very low	44.5	Very low	142 Å²	142	157.8 Å²	157.8	86%	0.861	84%	0.844	S	S	*	*			trans	-66.3	105.4	161.9	-174.2	0	0	0	0	108.2	F11	V9-F11 PolarHBondContact O-N 3.01Å
10	R	50.8	Low	45	Very low	232 Å²	232	154.4 Å²	154.4	88%	0.875	83%	0.825	S	S	*	*			trans	-78.5	115.3	-176.3	-155.5	178.1	-159.2	167.3	4.3	110	S8 K12	S8-R10 PolarHBondContact O-N 3.14Å; S8-R10 VanDerWaalsContact O-N 3.12Å; R10-K12 PolarHBondContact O-N 3.37Å
11	F	38.4	Very low	45.8	Very low	191 Å²	191	152 Å²	152	84%	0.838	81%	0.812	S	S	*	*			trans	-44	127.8	169.7	-66.8	-91.5	0	0	0	112	V9	V9-F11 PolarHBondContact O-N 3.01Å
12	K	44.6	Very low	46.8	Very low	204 Å²	204	143.7 Å²	143.7	89%	0.887	77%	0.773	S	S	*	*			trans	-101.5	101.8	157.9	-106.8	176.9	176.4	175.8	0	107.5	R10 L14	R10-K12 PolarHBondContact O-N 3.37Å; K12-L14 PolarHBondContact O-N 3.1Å
13	T	38.5	Very low	48	Very low	133 Å²	133	144 Å²	144	82%	0.816	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-70.3	116.1	167.1	35.2	0	0	0	0	108.7
14	L	35.9	Very low	49.5	Very low	145 Å²	145	134.1 Å²	134.1	76%	0.759	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-85.2	131.2	170.3	-72.4	167	0	0	0	109.2	K12	K12-L14 PolarHBondContact O-N 3.1Å
15	P	34.5	Very low	51.6	Low	118 Å²	118	130.4 Å²	130.4	77%	0.766	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	139.5	175.2	30.9	-30	0	0	0	109.7
16	N	37.8	Very low	52.8	Low	163 Å²	163	129.7 Å²	129.7	87%	0.872	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	78.1	38.7	-177.6	-64.5	-25.3	0	0	0	118	V18	N16-V18 PolarHBondContact O-N 2.77Å
17	S	41.7	Very low	54.5	Low	94 Å²	94	125.9 Å²	125.9	66%	0.657	66%	0.659	S	S	*	*			trans	-74.8	88	168.6	175.2	0	0	0	0	110.9	R19	S17-R19 VanDerWaalsContact C-N 3.33Å; S17-R19 PolarHBondContact O-N 3.29Å; S17-R19 VanDerWaalsContact O-N 3.08Å
18	V	47.4	Very low	56.1	Low	123 Å²	123	124.1 Å²	124.1	75%	0.745	64%	0.638	S	S	*	*			trans	-56.5	110.2	145.1	178.8	0	0	0	0	104	N16 L20	N16-V18 PolarHBondContact O-N 2.77Å; V18-L20 PolarHBondContact O-N 2.7Å
19	R	45.5	Very low	58	Low	228 Å²	228	125.7 Å²	125.7	86%	0.86	63%	0.632	S	S	*	*			trans	-54.3	103.3	175.8	-80.9	-179.7	162	135.1	-5	107.2	S17 D21	S17-R19 VanDerWaalsContact C-N 3.33Å; S17-R19 PolarHBondContact O-N 3.29Å; S17-R19 VanDerWaalsContact O-N 3.08Å; R19-D21 PolarHBondContact O-N 2.83Å; R19-D21 VanDerWaalsContact O-N 3.08Å
20	L	54.1	Low	59.8	Low	89 Å²	89	119.6 Å²	119.6	47%	0.466	60%	0.595	S	S	.	*			trans	-65	110.6	165.5	-98.6	89.1	0	0	0	105.6	V18 L22 D36	V18-L20 PolarHBondContact O-N 2.7Å; L20-L22 VanDerWaalsContact C-N 3.33Å; L20-L22 HydrophobicContact CB-CD2 4.11Å; L20-L22 HydrophobicContact CD2-CD2 4.38Å; L20-L22 PolarHBondContact O-N 2.85Å; L20-D36 HydrophobicContact CD2-CB 4.05Å
21	D	62.8	Low	61.3	Low	104 Å²	104	114.5 Å²	114.5	56%	0.556	58%	0.581	S	S	*	*			trans	-73.7	94.3	170.2	-179	-10.2	0	0	0	107.9	R19 E23 T24	R19-D21 PolarHBondContact O-N 2.83Å; R19-D21 VanDerWaalsContact O-N 3.08Å; D21-E23 PolarHBondContact O-N 3.17Å; D21-E23 VanDerWaalsContact O-N 3.16Å; D21-E23 PolarHBondContact OD1-N 3.07Å; D21-T24 WeakPolarHBondContact CB-OG1 3.5Å; D21-T24 PolarHBondContact O-N 3.06Å; D21-T24 PolarHBondContact O-OG1 2.87Å; D21-T24 PolarHBondContact OD1-N 2.91Å; D21-T24 PolarHBondContact OD1-OG1 2.93Å; D21-T24 PolarHBondContact OD2-OG1 2.86Å
22	L	66.5	Low	63.6	Low	67 Å²	67	110.8 Å²	110.8	35%	0.351	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.7	3.2	-177.9	-61.5	176.3	0	0	0	113.2	L20 F25 I43	L20-L22 VanDerWaalsContact C-N 3.33Å; L20-L22 HydrophobicContact CB-CD2 4.11Å; L20-L22 HydrophobicContact CD2-CD2 4.38Å; L20-L22 PolarHBondContact O-N 2.85Å; L22-F25 WeakPolarHBondContact O-CD1 3.39Å; L22-F25 WeakPolarHBondContact O-CE1 3.45Å; L22-I43 HydrophobicContact CD1-CD1 3.96Å; L22-I43 HydrophobicContact CD1-CG2 4.29Å; L22-I43 HydrophobicContact CD2-CD1 3.8Å
23	E	73.2	Confident	65.8	Low	135 Å²	135	101.4 Å²	101.4	63%	0.631	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	-15.8	177.7	-59.9	-165.9	153.9	0	0	113	D21 F25 R26	D21-E23 PolarHBondContact O-N 3.17Å; D21-E23 VanDerWaalsContact O-N 3.16Å; D21-E23 PolarHBondContact OD1-N 3.07Å; E23-F25 PolarHBondContact O-N 3.15Å; E23-R26 WeakPolarHBondContact O-CB 3.47Å; E23-R26 WeakPolarHBondContact O-CG 3.13Å; E23-R26 PolarHBondContact O-N 3.5Å
24	T	77.4	Confident	68.2	Low	41 Å²	41	98.2 Å²	98.2	25%	0.252	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-48.7	-38.3	179.2	-39.1	0	0	0	0	113	D21 R26 S27	D21-T24 WeakPolarHBondContact CB-OG1 3.5Å; D21-T24 PolarHBondContact O-N 3.06Å; D21-T24 PolarHBondContact O-OG1 2.87Å; D21-T24 PolarHBondContact OD1-N 2.91Å; D21-T24 PolarHBondContact OD1-OG1 2.93Å; D21-T24 PolarHBondContact OD2-OG1 2.86Å; T24-R26 PolarHBondContact O-N 3.19Å; T24-R26 VanDerWaalsContact O-N 3.1Å; T24-S27 PolarHBondContact O-N 2.82Å; T24-S27 PolarHBondContact O-OG 2.82Å
25	F	83.3	Confident	70.6	Confident	1 Å²	1	94 Å²	94	0%	0.004	49%	0.487	C	S	.	.	G	3₁₀ helix	trans	-56.6	-30	-177.8	80	-95.4	0	0	0	112.7	L22 E23 S27 K28 W33 D37 G40 F41 Y44 L95	L22-F25 WeakPolarHBondContact O-CD1 3.39Å; L22-F25 WeakPolarHBondContact O-CE1 3.45Å; E23-F25 PolarHBondContact O-N 3.15Å; F25-S27 VanDerWaalsContact C-N 3.27Å; F25-S27 PolarHBondContact O-N 2.89Å; F25-K28 PolarHBondContact O-N 2.85Å; F25-W33 HydrophobicContact CB-CD2 4.32Å; F25-W33 HydrophobicContact CB-CZ2 4.23Å; F25-W33 AromaticContact CD2-CH2 3.59Å; F25-W33 HydrophobicContact CD2-CH2 3.59Å; F25-W33 AromaticContact CD2-CZ2 3.48Å; F25-W33 HydrophobicContact CD2-CZ2 3.48Å; F25-W33 VanDerWaalsContact CD2-CZ2 3.48Å; F25-W33 HydrophobicContact CD2-CZ3 4.34Å; F25-W33 HydrophobicContact CE2-CH2 4.16Å; F25-W33 HydrophobicContact CE2-CZ2 4.33Å; F25-W33 HydrophobicContact CG-CZ2 4.33Å; F25-W33 PolarHBondContact O-NE1 2.71Å; F25-D37 HydrophobicContact CB-CB 3.72Å; F25-D37 WeakPolarHBondContact CB-O 3.37Å; F25-G40 VanDerWaalsContact CE1-C 3.44Å; F25-G40 WeakPolarHBondContact CE1-O 3.25Å; F25-F41 HydrophobicContact CD2-CB 4.02Å; F25-F41 HydrophobicContact CE2-CB 4.03Å; F25-F41 HydrophobicContact CE2-CD2 4.18Å; F25-F41 HydrophobicContact CG-CB 4.35Å; F25-F41 HydrophobicContact CZ-CB 4.36Å; F25-Y44 HydrophobicContact CE2-CD1 4.44Å; F25-Y44 AromaticContact CZ-CD1 3.93Å; F25-Y44 HydrophobicContact CZ-CD1 3.93Å; F25-Y44 AromaticContact CZ-CG 3.92Å; F25-Y44 HydrophobicContact CZ-CG 3.92Å; F25-L95 HydrophobicContact CE2-CD1 4.11Å
26	R	83.4	Confident	73.1	Confident	117 Å²	117	92.4 Å²	92.4	44%	0.442	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-68.2	-26.2	-179.3	-60.6	-178.9	-174.7	-80.3	1.3	113.4	E23 T24	E23-R26 WeakPolarHBondContact O-CB 3.47Å; E23-R26 WeakPolarHBondContact O-CG 3.13Å; E23-R26 PolarHBondContact O-N 3.5Å; T24-R26 PolarHBondContact O-N 3.19Å; T24-R26 VanDerWaalsContact O-N 3.1Å
27	S	83.1	Confident	75.6	Confident	102 Å²	102	85 Å²	85	71%	0.713	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-88.9	-8.3	-177.7	68.1	0	0	0	0	113.5	T24 F25	T24-S27 PolarHBondContact O-N 2.82Å; T24-S27 PolarHBondContact O-OG 2.82Å; F25-S27 VanDerWaalsContact C-N 3.27Å; F25-S27 PolarHBondContact O-N 2.89Å
28	K	84.4	Confident	77.9	Confident	72 Å²	72	80.5 Å²	80.5	31%	0.313	40%	0.401	S	S	.	.	S	Bend	trans	-105.8	147	-176.7	-66.1	172.1	179.7	163.4	0	110.4	F25 W33 D37	F25-K28 PolarHBondContact O-N 2.85Å; K28-W33 PolarHBondContact O-NE1 2.87Å; K28-D37 IonicContact NZ-OD1 2.85Å; K28-D37 PolarHBondContact NZ-OD1 3.07Å; K28-D37 IonicContact NZ-OD2 3.45Å; K28-D37 PolarHBondContact NZ-OD2 3.37Å
29	K	85.7	Confident	79.9	Confident	139 Å²	139	76.8 Å²	76.8	60%	0.604	38%	0.376	S	S	*	.			trans	-59	141.7	163.8	-68.7	-175.9	177.2	-177.9	0	108.9	E31 D32 W33	K29-E31 PolarHBondContact O-N 3.1Å; K29-E31 VanDerWaalsContact O-N 3.09Å; K29-D32 PolarHBondContact O-N 2.99Å; K29-W33 PolarHBondContact O-NE1 3.3Å
30	T	86.1	Confident	82.1	Confident	14 Å²	14	66 Å²	66	9%	0.086	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-57.1	-28.4	-178.9	51.8	0	0	0	0	112.2	D32 W33 G66 F92 L95 C96	T30-D32 VanDerWaalsContact C-N 3.27Å; T30-D32 PolarHBondContact O-N 2.76Å; T30-W33 HydrophobicContact CG2-CH2 4.13Å; T30-W33 HydrophobicContact CG2-CZ2 3.73Å; T30-W33 PolarHBondContact O-N 3.1Å; T30-G66 CarbonylContact O-C 3.59Å; T30-G66 WeakPolarHBondContact O-CA 3.36Å; T30-F92 HydrophobicContact CG2-CE2 4.05Å; T30-F92 HydrophobicContact CG2-CZ 4.3Å; T30-L95 HydrophobicContact CG2-CB 4.26Å; T30-C96 PolarHBondContact OG1-SG 2.87Å
31	E	83.8	Confident	83.9	Confident	125 Å²	125	61.7 Å²	61.7	58%	0.584	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-62.6	-30.8	175.3	-63.3	170.7	-156.9	0	0	113.4	K29 K67	K29-E31 PolarHBondContact O-N 3.1Å; K29-E31 VanDerWaalsContact O-N 3.09Å; E31-K67 WeakPolarHBondContact O-CB 3.34Å; E31-K67 PolarHBondContact O-N 2.87Å
32	D	86.3	Confident	85.3	Confident	112 Å²	112	56.9 Å²	56.9	60%	0.599	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-91.9	-1.9	-173.9	-64.1	-45.2	0	0	0	113.6	K29 T30 N34	K29-D32 PolarHBondContact O-N 2.99Å; T30-D32 VanDerWaalsContact C-N 3.27Å; T30-D32 PolarHBondContact O-N 2.76Å; D32-N34 PolarHBondContact O-N 3.36Å
33	W	90.3	Very high	86.5	Confident	7 Å²	7	56.4 Å²	56.4	3%	0.027	29%	0.285	C	S	.	.			trans	-67.1	133.8	-176.7	-68	6.1	0	0	0	112	F25 K28 K29 T30 D37 F41 A65 G66 F92 L95	F25-W33 HydrophobicContact CB-CD2 4.32Å; F25-W33 HydrophobicContact CB-CZ2 4.23Å; F25-W33 AromaticContact CD2-CH2 3.59Å; F25-W33 HydrophobicContact CD2-CH2 3.59Å; F25-W33 AromaticContact CD2-CZ2 3.48Å; F25-W33 HydrophobicContact CD2-CZ2 3.48Å; F25-W33 VanDerWaalsContact CD2-CZ2 3.48Å; F25-W33 HydrophobicContact CD2-CZ3 4.34Å; F25-W33 HydrophobicContact CE2-CH2 4.16Å; F25-W33 HydrophobicContact CE2-CZ2 4.33Å; F25-W33 HydrophobicContact CG-CZ2 4.33Å; F25-W33 PolarHBondContact O-NE1 2.71Å; K28-W33 PolarHBondContact O-NE1 2.87Å; K29-W33 PolarHBondContact O-NE1 3.3Å; T30-W33 HydrophobicContact CG2-CH2 4.13Å; T30-W33 HydrophobicContact CG2-CZ2 3.73Å; T30-W33 PolarHBondContact O-N 3.1Å; W33-D37 WeakPolarHBondContact CA-OD2 3.35Å; W33-D37 HydrophobicContact CB-CB 3.62Å; W33-D37 HydrophobicContact CD2-CB 4.27Å; W33-D37 HydrophobicContact CG-CB 3.78Å; W33-F41 HydrophobicContact CE3-CB 4.3Å; W33-F41 HydrophobicContact CH2-CB 3.87Å; W33-F41 AromaticContact CH2-CD2 3.82Å; W33-F41 HydrophobicContact CH2-CD2 3.82Å; W33-F41 AromaticContact CH2-CG 3.9Å; W33-F41 HydrophobicContact CH2-CG 3.9Å; W33-F41 HydrophobicContact CZ3-CB 3.46Å; W33-F41 VanDerWaalsContact CZ3-CB 3.46Å; W33-F41 HydrophobicContact CZ3-CD1 4.11Å; W33-F41 AromaticContact CZ3-CD2 3.96Å; W33-F41 HydrophobicContact CZ3-CD2 3.96Å; W33-F41 AromaticContact CZ3-CG 3.56Å; W33-F41 HydrophobicContact CZ3-CG 3.56Å; W33-A65 CarbonylContact O-C 3.56Å; W33-A65 WeakPolarHBondContact O-CA 3.42Å; W33-A65 VanDerWaalsContact O-CB 3.29Å; W33-A65 WeakPolarHBondContact O-CB 3.37Å; W33-G66 PolarHBondContact O-N 3.26Å; W33-F92 HydrophobicContact CE3-CE2 4.18Å; W33-F92 HydrophobicContact CH2-CD2 4.35Å; W33-F92 HydrophobicContact CH2-CE2 4.44Å; W33-F92 AromaticContact CZ3-CD2 3.92Å; W33-F92 HydrophobicContact CZ3-CD2 3.92Å; W33-F92 AromaticContact CZ3-CE2 3.9Å; W33-F92 HydrophobicContact CZ3-CE2 3.9Å; W33-L95 HydrophobicContact CH2-CD1 3.72Å; W33-L95 HydrophobicContact CZ2-CD1 4.26Å
34	N	88.6	Confident	87.4	Confident	67 Å²	67	53 Å²	53	36%	0.358	27%	0.267	S	S	.	.			trans	-87.7	-172	167.6	69.5	20.6	0	0	0	111	D32 D36 D37 L38	D32-N34 PolarHBondContact O-N 3.36Å; N34-D36 VanDerWaalsContact C-N 3.32Å; N34-D36 WeakPolarHBondContact OD1-CA 3.16Å; N34-D36 WeakPolarHBondContact OD1-CB 3.09Å; N34-D36 PolarHBondContact OD1-N 3.43Å; N34-D37 VanDerWaalsContact CG-OD2 3.27Å; N34-D37 PolarHBondContact N-OD2 2.88Å; N34-D37 PolarHBondContact O-N 3.17Å; N34-D37 VanDerWaalsContact OD1-CG 3.31Å; N34-D37 PolarHBondContact OD1-N 3.27Å; N34-D37 PolarHBondContact OD1-OD2 3.3Å; N34-D37 VanDerWaalsContact OD1-OD2 3.05Å; N34-L38 PolarHBondContact O-N 2.96Å; N34-L38 VanDerWaalsContact O-N 3.14Å
35	V	86.3	Confident	88.1	Confident	56 Å²	56	51.2 Å²	51.2	34%	0.339	26%	0.256	S	S	.	.	H	α-helix	trans	-67.5	-34.5	179.7	-178.8	0	0	0	0	111.6	L38 I39 S62	V35-L38 WeakPolarHBondContact O-CB 2.84Å; V35-L38 PolarHBondContact O-N 3.08Å; V35-I39 HydrophobicContact CG1-CD1 4.1Å; V35-I39 VanDerWaalsContact O-CG1 3.3Å; V35-I39 WeakPolarHBondContact O-CG1 3.45Å; V35-I39 PolarHBondContact O-N 3.49Å; V35-S62 VanDerWaalsContact CG2-O 3.3Å; V35-S62 WeakPolarHBondContact CG2-O 3.44Å
36	D	87.2	Confident	88.6	Confident	85 Å²	85	51.4 Å²	51.4	46%	0.455	26%	0.258	S	S	.	.	H	α-helix	trans	-67.9	-41.5	177.9	-55.2	-50.5	0	0	0	111.3	L20 N34 L38 I39 G40	L20-D36 HydrophobicContact CD2-CB 4.05Å; N34-D36 VanDerWaalsContact C-N 3.32Å; N34-D36 WeakPolarHBondContact OD1-CA 3.16Å; N34-D36 WeakPolarHBondContact OD1-CB 3.09Å; N34-D36 PolarHBondContact OD1-N 3.43Å; D36-L38 VanDerWaalsContact C-N 3.32Å; D36-L38 PolarHBondContact O-N 2.85Å; D36-I39 PolarHBondContact O-N 2.9Å; D36-G40 PolarHBondContact O-N 3.12Å
37	D	90.5	Very high	89	Confident	7 Å²	7	47.8 Å²	47.8	4%	0.037	26%	0.256	C	S	.	.	H	α-helix	trans	-60.8	-41.9	174.8	-66.3	-51.3	0	0	0	110.9	F25 K28 W33 N34 G40 F41	F25-D37 HydrophobicContact CB-CB 3.72Å; F25-D37 WeakPolarHBondContact CB-O 3.37Å; K28-D37 IonicContact NZ-OD1 2.85Å; K28-D37 PolarHBondContact NZ-OD1 3.07Å; K28-D37 IonicContact NZ-OD2 3.45Å; K28-D37 PolarHBondContact NZ-OD2 3.37Å; W33-D37 WeakPolarHBondContact CA-OD2 3.35Å; W33-D37 HydrophobicContact CB-CB 3.62Å; W33-D37 HydrophobicContact CD2-CB 4.27Å; W33-D37 HydrophobicContact CG-CB 3.78Å; N34-D37 VanDerWaalsContact CG-OD2 3.27Å; N34-D37 PolarHBondContact N-OD2 2.88Å; N34-D37 PolarHBondContact O-N 3.17Å; N34-D37 VanDerWaalsContact OD1-CG 3.31Å; N34-D37 PolarHBondContact OD1-N 3.27Å; N34-D37 PolarHBondContact OD1-OD2 3.3Å; N34-D37 VanDerWaalsContact OD1-OD2 3.05Å; D37-G40 PolarHBondContact O-N 3Å; D37-F41 PolarHBondContact O-N 2.73Å
38	L	90	Very high	89.5	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.4	-44.2	173.4	164.3	60.4	0	0	0	112	N34 V35 D36 G40 F41 M42 F61 C64 M69	N34-L38 PolarHBondContact O-N 2.96Å; N34-L38 VanDerWaalsContact O-N 3.14Å; V35-L38 WeakPolarHBondContact O-CB 2.84Å; V35-L38 PolarHBondContact O-N 3.08Å; D36-L38 VanDerWaalsContact C-N 3.32Å; D36-L38 PolarHBondContact O-N 2.85Å; L38-G40 VanDerWaalsContact C-N 3.31Å; L38-G40 PolarHBondContact O-N 3.2Å; L38-F41 HydrophobicContact CD1-CD1 4.14Å; L38-F41 WeakPolarHBondContact O-CB 3.34Å; L38-F41 PolarHBondContact O-N 3.45Å; L38-M42 HydrophobicContact CD1-CE 3.64Å; L38-M42 HydrophobicContact CD1-CG 4.15Å; L38-M42 HydrophobicContact CD1-SD 4.44Å; L38-M42 HydrophobicContact CD2-CE 4.05Å; L38-M42 HydrophobicContact CG-CE 3.62Å; L38-M42 PolarHBondContact O-N 3.03Å; L38-F61 HydrophobicContact CD2-CB 3.75Å; L38-F61 WeakPolarHBondContact CD2-O 3.45Å; L38-C64 HydrophobicContact CD2-CB 4.31Å; L38-C64 WeakPolarHBondContact CD2-O 3.3Å; L38-M69 HydrophobicContact CD1-CE 3.64Å; L38-M69 HydrophobicContact CD1-SD 3.22Å; L38-M69 WeakPolarHBondContact CD1-SD 3.3Å; L38-M69 HydrophobicContact CD2-SD 4.13Å; L38-M69 HydrophobicContact CG-SD 4.11Å
39	I	90.3	Very high	90	Very high	44 Å²	44	48.1 Å²	48.1	23%	0.226	24%	0.243	C	C	.	.	H	α-helix	trans	-61.7	-44	176.4	-69.4	165.7	0	0	0	109.7	V35 D36 F41 M42 I43 V58	V35-I39 HydrophobicContact CG1-CD1 4.1Å; V35-I39 VanDerWaalsContact O-CG1 3.3Å; V35-I39 WeakPolarHBondContact O-CG1 3.45Å; V35-I39 PolarHBondContact O-N 3.49Å; D36-I39 PolarHBondContact O-N 2.9Å; I39-F41 VanDerWaalsContact C-N 3.34Å; I39-F41 PolarHBondContact O-N 3.34Å; I39-M42 PolarHBondContact O-N 3.32Å; I39-I43 HydrophobicContact CG2-CD1 3.78Å; I39-I43 HydrophobicContact CG2-CG1 4.41Å; I39-I43 WeakPolarHBondContact O-CG1 3.44Å; I39-I43 PolarHBondContact O-N 3.44Å; I39-V58 HydrophobicContact CG1-CG1 4.13Å
40	G	90.4	Very high	90.3	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-55.6	-46.6	172.6	0	0	0	0	0	112.7	F25 D36 D37 L38 I43 Y44	F25-G40 VanDerWaalsContact CE1-C 3.44Å; F25-G40 WeakPolarHBondContact CE1-O 3.25Å; D36-G40 PolarHBondContact O-N 3.12Å; D37-G40 PolarHBondContact O-N 3Å; L38-G40 VanDerWaalsContact C-N 3.31Å; L38-G40 PolarHBondContact O-N 3.2Å; G40-I43 PolarHBondContact O-N 3.19Å; G40-Y44 WeakPolarHBondContact O-CB 3.4Å; G40-Y44 PolarHBondContact O-N 3.46Å
41	F	92.1	Very high	90.5	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-58.8	-47.6	174.2	164.6	-104.7	0	0	0	112.6	F25 W33 D37 L38 I39 I43 Y44 V45 M69 L88 E91 F92 L95	F25-F41 HydrophobicContact CD2-CB 4.02Å; F25-F41 HydrophobicContact CE2-CB 4.03Å; F25-F41 HydrophobicContact CE2-CD2 4.18Å; F25-F41 HydrophobicContact CG-CB 4.35Å; F25-F41 HydrophobicContact CZ-CB 4.36Å; W33-F41 HydrophobicContact CE3-CB 4.3Å; W33-F41 HydrophobicContact CH2-CB 3.87Å; W33-F41 AromaticContact CH2-CD2 3.82Å; W33-F41 HydrophobicContact CH2-CD2 3.82Å; W33-F41 AromaticContact CH2-CG 3.9Å; W33-F41 HydrophobicContact CH2-CG 3.9Å; W33-F41 HydrophobicContact CZ3-CB 3.46Å; W33-F41 VanDerWaalsContact CZ3-CB 3.46Å; W33-F41 HydrophobicContact CZ3-CD1 4.11Å; W33-F41 AromaticContact CZ3-CD2 3.96Å; W33-F41 HydrophobicContact CZ3-CD2 3.96Å; W33-F41 AromaticContact CZ3-CG 3.56Å; W33-F41 HydrophobicContact CZ3-CG 3.56Å; D37-F41 PolarHBondContact O-N 2.73Å; L38-F41 HydrophobicContact CD1-CD1 4.14Å; L38-F41 WeakPolarHBondContact O-CB 3.34Å; L38-F41 PolarHBondContact O-N 3.45Å; I39-F41 VanDerWaalsContact C-N 3.34Å; I39-F41 PolarHBondContact O-N 3.34Å; F41-I43 PolarHBondContact O-N 3.26Å; F41-Y44 WeakPolarHBondContact O-CB 3.17Å; F41-Y44 PolarHBondContact O-N 3.13Å; F41-V45 HydrophobicContact CD2-CG2 4.05Å; F41-V45 HydrophobicContact CE1-CG2 4.25Å; F41-V45 HydrophobicContact CE2-CG2 3.51Å; F41-V45 HydrophobicContact CZ-CG2 3.62Å; F41-V45 WeakPolarHBondContact O-CG2 3.29Å; F41-V45 PolarHBondContact O-N 3.44Å; F41-M69 HydrophobicContact CD1-CE 4.39Å; F41-M69 HydrophobicContact CE1-CE 4.17Å; F41-L88 HydrophobicContact CE1-CD2 4.2Å; F41-E91 HydrophobicContact CE2-CB 3.99Å; F41-E91 HydrophobicContact CZ-CB 4Å; F41-F92 HydrophobicContact CE1-CB 4.22Å; F41-F92 HydrophobicContact CE1-CD2 4.49Å; F41-F92 HydrophobicContact CE2-CB 4.44Å; F41-F92 HydrophobicContact CZ-CB 3.76Å; F41-L95 HydrophobicContact CD2-CD1 3.51Å; F41-L95 HydrophobicContact CE2-CD1 3.55Å
42	M	92.6	Very high	90.9	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-65.7	-38.4	179.5	-77.6	-167	-84.5	0	0	112.4	L38 I39 Y44 V45 A46 L56 V58 F61 L88	L38-M42 HydrophobicContact CD1-CE 3.64Å; L38-M42 HydrophobicContact CD1-CG 4.15Å; L38-M42 HydrophobicContact CD1-SD 4.44Å; L38-M42 HydrophobicContact CD2-CE 4.05Å; L38-M42 HydrophobicContact CG-CE 3.62Å; L38-M42 PolarHBondContact O-N 3.03Å; I39-M42 PolarHBondContact O-N 3.32Å; M42-Y44 VanDerWaalsContact C-N 3.33Å; M42-V45 PolarHBondContact O-N 3.07Å; M42-A46 WeakPolarHBondContact O-CB 3.38Å; M42-A46 PolarHBondContact O-N 2.96Å; M42-L56 HydrophobicContact CB-CD1 4.26Å; M42-V58 HydrophobicContact CE-CB 4.03Å; M42-V58 HydrophobicContact CE-CG1 3.6Å; M42-V58 HydrophobicContact CE-CG2 4.14Å; M42-V58 HydrophobicContact SD-CB 4.31Å; M42-V58 HydrophobicContact SD-CG1 4.47Å; M42-V58 HydrophobicContact SD-CG2 3.92Å; M42-F61 HydrophobicContact CE-CB 3.69Å; M42-F61 HydrophobicContact CE-CD2 4.28Å; M42-F61 HydrophobicContact CE-CG 4.19Å; M42-F61 HydrophobicContact SD-CB 4.32Å; M42-F61 HydrophobicContact SD-CD2 3.84Å; M42-F61 HydrophobicContact SD-CE2 4.41Å; M42-F61 HydrophobicContact SD-CG 4.17Å; M42-L88 HydrophobicContact CG-CD2 3.96Å
43	I	91	Very high	91	Very high	57 Å²	57	47.1 Å²	47.1	29%	0.292	23%	0.232	S	C	.	.	H	α-helix	trans	-63.5	-41.6	172.9	-69.1	169.8	0	0	0	110.5	L22 I39 G40 F41 A46 G47 F53	L22-I43 HydrophobicContact CD1-CD1 3.96Å; L22-I43 HydrophobicContact CD1-CG2 4.29Å; L22-I43 HydrophobicContact CD2-CD1 3.8Å; I39-I43 HydrophobicContact CG2-CD1 3.78Å; I39-I43 HydrophobicContact CG2-CG1 4.41Å; I39-I43 WeakPolarHBondContact O-CG1 3.44Å; I39-I43 PolarHBondContact O-N 3.44Å; G40-I43 PolarHBondContact O-N 3.19Å; F41-I43 PolarHBondContact O-N 3.26Å; I43-A46 WeakPolarHBondContact O-CB 3.4Å; I43-A46 PolarHBondContact O-N 3.33Å; I43-G47 PolarHBondContact O-N 3.05Å; I43-F53 HydrophobicContact CB-CE2 4.45Å; I43-F53 HydrophobicContact CD1-CE2 4.18Å; I43-F53 HydrophobicContact CD1-CZ 4.25Å; I43-F53 HydrophobicContact CG1-CD2 3.71Å; I43-F53 HydrophobicContact CG1-CE2 3.3Å; I43-F53 HydrophobicContact CG1-CZ 3.86Å
44	Y	92	Very high	90.9	Very high	65 Å²	65	54.5 Å²	54.5	26%	0.255	27%	0.267	S	S	.	.	H	α-helix	trans	-59.6	-48.9	174.8	163.4	-115.9	0	0	0	112	F25 G40 F41 M42 A46 G47 K48	F25-Y44 HydrophobicContact CE2-CD1 4.44Å; F25-Y44 AromaticContact CZ-CD1 3.93Å; F25-Y44 HydrophobicContact CZ-CD1 3.93Å; F25-Y44 AromaticContact CZ-CG 3.92Å; F25-Y44 HydrophobicContact CZ-CG 3.92Å; G40-Y44 WeakPolarHBondContact O-CB 3.4Å; G40-Y44 PolarHBondContact O-N 3.46Å; F41-Y44 WeakPolarHBondContact O-CB 3.17Å; F41-Y44 PolarHBondContact O-N 3.13Å; M42-Y44 VanDerWaalsContact C-N 3.33Å; Y44-A46 VanDerWaalsContact C-N 3.33Å; Y44-A46 PolarHBondContact O-N 3.46Å; Y44-G47 PolarHBondContact O-N 3.18Å; Y44-K48 HydrophobicContact CE1-CD 4.18Å; Y44-K48 HydrophobicContact CE2-CB 4.28Å; Y44-K48 HydrophobicContact CE2-CD 4.16Å; Y44-K48 VanDerWaalsContact O-CB 3.27Å; Y44-K48 WeakPolarHBondContact O-CB 3.41Å; Y44-K48 PolarHBondContact O-N 3.16Å; Y44-K48 WeakPolarHBondContact OH-CD 3.42Å
45	V	93.3	Very high	91	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.012	27%	0.268	C	S	.	.	H	α-helix	trans	-62.2	-43.1	178.4	175.8	0	0	0	0	110.6	F41 M42 G47 K48 Y49 L87 L88 E91	F41-V45 HydrophobicContact CD2-CG2 4.05Å; F41-V45 HydrophobicContact CE1-CG2 4.25Å; F41-V45 HydrophobicContact CE2-CG2 3.51Å; F41-V45 HydrophobicContact CZ-CG2 3.62Å; F41-V45 WeakPolarHBondContact O-CG2 3.29Å; F41-V45 PolarHBondContact O-N 3.44Å; M42-V45 PolarHBondContact O-N 3.07Å; V45-G47 PolarHBondContact O-N 3.46Å; V45-K48 PolarHBondContact O-N 3.46Å; V45-Y49 HydrophobicContact CG1-CD2 3.98Å; V45-Y49 HydrophobicContact CG1-CE2 4.5Å; V45-Y49 WeakPolarHBondContact O-CD2 3.42Å; V45-Y49 PolarHBondContact O-N 3.01Å; V45-L87 HydrophobicContact CG1-CD2 4.04Å; V45-L87 HydrophobicContact CG1-CG 3.99Å; V45-L88 HydrophobicContact CB-CD2 4.22Å; V45-L88 HydrophobicContact CG1-CD2 4.04Å; V45-L88 HydrophobicContact CG2-CD2 4.47Å; V45-E91 HydrophobicContact CG1-CG 4.23Å; V45-E91 HydrophobicContact CG2-CB 3.79Å; V45-E91 HydrophobicContact CG2-CG 4.02Å
46	A	93.2	Very high	91.3	Very high	6 Å²	6	53 Å²	53	5%	0.05	25%	0.254	C	S	.	.	H	α-helix	trans	-55.9	-50.3	175.7	0	0	0	0	0	111.6	M42 I43 Y44 R50 V51 F53 L56	M42-A46 WeakPolarHBondContact O-CB 3.38Å; M42-A46 PolarHBondContact O-N 2.96Å; I43-A46 WeakPolarHBondContact O-CB 3.4Å; I43-A46 PolarHBondContact O-N 3.33Å; Y44-A46 VanDerWaalsContact C-N 3.33Å; Y44-A46 PolarHBondContact O-N 3.46Å; A46-R50 CarbonylContact O-C 3.04Å; A46-R50 WeakPolarHBondContact O-CA 3.45Å; A46-R50 PolarHBondContact O-N 3.33Å; A46-V51 WeakPolarHBondContact CB-O 3.22Å; A46-V51 PolarHBondContact O-N 3.06Å; A46-F53 HydrophobicContact CB-CD2 4.37Å; A46-L56 HydrophobicContact CB-CD1 3.78Å
47	G	92.2	Very high	91.5	Very high	40 Å²	40	51 Å²	51	41%	0.412	24%	0.244	S	C	.	.	H	α-helix	trans	-63.9	-43.5	178.2	0	0	0	0	0	113.4	I43 Y44 V45 Y49 R50	I43-G47 PolarHBondContact O-N 3.05Å; Y44-G47 PolarHBondContact O-N 3.18Å; V45-G47 PolarHBondContact O-N 3.46Å; G47-Y49 PolarHBondContact O-N 3.13Å; G47-R50 PolarHBondContact O-N 3.31Å
48	K	92.3	Very high	91.5	Very high	96 Å²	96	51.9 Å²	51.9	42%	0.417	25%	0.249	S	C	.	.	H	α-helix	trans	-62.2	-40.2	-179.5	-179.7	175.2	177	-176.1	0	112.2	Y44 V45 E91	Y44-K48 HydrophobicContact CE1-CD 4.18Å; Y44-K48 HydrophobicContact CE2-CB 4.28Å; Y44-K48 HydrophobicContact CE2-CD 4.16Å; Y44-K48 VanDerWaalsContact O-CB 3.27Å; Y44-K48 WeakPolarHBondContact O-CB 3.41Å; Y44-K48 PolarHBondContact O-N 3.16Å; Y44-K48 WeakPolarHBondContact OH-CD 3.42Å; V45-K48 PolarHBondContact O-N 3.46Å; K48-E91 IonicContact NZ-OE2 3.59Å; K48-E91 PolarHBondContact NZ-OE2 2.71Å
49	Y	94.8	Very high	91.4	Very high	85 Å²	85	58 Å²	58	33%	0.333	28%	0.278	S	S	.	.	H	α-helix	trans	-104.1	9.3	-176.7	-68.7	-81.6	0	0	0	114	V45 G47 V51 L87 R90 E91	V45-Y49 HydrophobicContact CG1-CD2 3.98Å; V45-Y49 HydrophobicContact CG1-CE2 4.5Å; V45-Y49 WeakPolarHBondContact O-CD2 3.42Å; V45-Y49 PolarHBondContact O-N 3.01Å; G47-Y49 PolarHBondContact O-N 3.13Å; Y49-V51 PolarHBondContact O-N 3.19Å; Y49-L87 HydrophobicContact CD1-CD1 4.12Å; Y49-L87 HydrophobicContact CD2-CD1 3.84Å; Y49-L87 HydrophobicContact CD2-CD2 4.08Å; Y49-L87 HydrophobicContact CD2-CG 4.33Å; Y49-L87 HydrophobicContact CE1-CD1 4.09Å; Y49-L87 HydrophobicContact CE2-CD1 3.79Å; Y49-L87 HydrophobicContact CG-CD1 4.01Å; Y49-L87 HydrophobicContact CG-CD2 3.98Å; Y49-R90 PolarHBondContact OH-NH2 3.46Å; Y49-E91 HydrophobicContact CE2-CG 3.74Å; Y49-E91 VanDerWaalsContact OH-CD 3.31Å; Y49-E91 PolarHBondContact OH-OE1 3.19Å
50	R	92.3	Very high	91.2	Very high	218 Å²	218	60.2 Å²	60.2	82%	0.823	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	33.9	-178.3	-55.9	-63	-168.8	-149.4	3.9	113.1	A46 G47	A46-R50 CarbonylContact O-C 3.04Å; A46-R50 WeakPolarHBondContact O-CA 3.45Å; A46-R50 PolarHBondContact O-N 3.33Å; G47-R50 PolarHBondContact O-N 3.31Å
51	V	91.5	Very high	91.1	Very high	17 Å²	17	60.2 Å²	60.2	10%	0.103	29%	0.285	C	S	.	.			trans	-83.2	126.5	173.3	174.3	0	0	0	0	107.9	A46 Y49 F53 L56 Y84 L87	A46-V51 WeakPolarHBondContact CB-O 3.22Å; A46-V51 PolarHBondContact O-N 3.06Å; Y49-V51 PolarHBondContact O-N 3.19Å; V51-F53 PolarHBondContact O-N 2.97Å; V51-L56 HydrophobicContact CG1-CD2 3.96Å; V51-L56 HydrophobicContact CG1-CG 4.15Å; V51-Y84 HydrophobicContact CB-CE1 4.24Å; V51-Y84 HydrophobicContact CG1-CD1 4.14Å; V51-Y84 HydrophobicContact CG1-CD2 4.07Å; V51-Y84 HydrophobicContact CG1-CE1 3.68Å; V51-Y84 HydrophobicContact CG1-CE2 3.55Å; V51-Y84 HydrophobicContact CG1-CG 4.32Å; V51-Y84 HydrophobicContact CG2-CD1 3.94Å; V51-Y84 HydrophobicContact CG2-CE1 3.49Å; V51-Y84 VanDerWaalsContact CG2-CE1 3.49Å; V51-L87 HydrophobicContact CG2-CD2 4.35Å
52	P	90.9	Very high	90.5	Very high	58 Å²	58	63.5 Å²	63.5	38%	0.377	31%	0.308	S	S	.	.			trans	-58.5	127	172.1	-19.6	30.9	0	0	0	109.5	E54 E55	P52-E54 PolarHBondContact O-N 3.06Å; P52-E54 VanDerWaalsContact O-N 3.16Å; P52-E55 HydrophobicContact CB-CG 4.12Å; P52-E55 HydrophobicContact CG-CG 4.32Å; P52-E55 WeakPolarHBondContact O-CB 3.39Å; P52-E55 PolarHBondContact O-N 3.46Å
53	F	88.3	Confident	89.6	Confident	76 Å²	76	65.7 Å²	65.7	33%	0.333	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-60.6	-30.3	-172.8	177.3	-106.1	0	0	0	112.2	I43 A46 V51 E55 L56 V58	I43-F53 HydrophobicContact CB-CE2 4.45Å; I43-F53 HydrophobicContact CD1-CE2 4.18Å; I43-F53 HydrophobicContact CD1-CZ 4.25Å; I43-F53 HydrophobicContact CG1-CD2 3.71Å; I43-F53 HydrophobicContact CG1-CE2 3.3Å; I43-F53 HydrophobicContact CG1-CZ 3.86Å; A46-F53 HydrophobicContact CB-CD2 4.37Å; V51-F53 PolarHBondContact O-N 2.97Å; F53-E55 PolarHBondContact O-N 3.43Å; F53-L56 HydrophobicContact CD2-CD1 4.3Å; F53-L56 WeakPolarHBondContact O-CB 3.36Å; F53-L56 PolarHBondContact O-N 3.24Å; F53-L56 VanDerWaalsContact O-N 3.1Å; F53-V58 HydrophobicContact CD2-CG2 4.46Å; F53-V58 HydrophobicContact CE2-CG2 3.63Å; F53-V58 HydrophobicContact CZ-CG1 4.47Å; F53-V58 HydrophobicContact CZ-CG2 3.69Å
54	E	89.9	Confident	88.8	Confident	162 Å²	162	63.1 Å²	63.1	76%	0.757	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-65.8	-22.2	178.1	-54.9	74.7	-161.2	0	0	112.8	P52	P52-E54 PolarHBondContact O-N 3.06Å; P52-E54 VanDerWaalsContact O-N 3.16Å
55	E	90.7	Very high	88.2	Confident	83 Å²	83	61 Å²	61	39%	0.388	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-82.4	-15.2	175.7	-62.7	-172	-175.5	0	0	113	P52 F53 K83 Y84	P52-E55 HydrophobicContact CB-CG 4.12Å; P52-E55 HydrophobicContact CG-CG 4.32Å; P52-E55 WeakPolarHBondContact O-CB 3.39Å; P52-E55 PolarHBondContact O-N 3.46Å; F53-E55 PolarHBondContact O-N 3.43Å; E55-K83 IonicContact OE1-NZ 2.71Å; E55-K83 IonicContact OE2-NZ 3.51Å; E55-K83 PolarHBondContact OE2-NZ 3.39Å; E55-Y84 HydrophobicContact CB-CE2 3.81Å; E55-Y84 PolarHBondContact OE2-OH 3.22Å
56	L	91.9	Very high	87.6	Confident	10 Å²	10	60.9 Å²	60.9	5%	0.052	31%	0.313	C	S	.	.	S	Bend	trans	-77.2	132.3	174.7	-66.2	-176.7	0	0	0	110.4	M42 A46 V51 F53 V58 Y84	M42-L56 HydrophobicContact CB-CD1 4.26Å; A46-L56 HydrophobicContact CB-CD1 3.78Å; V51-L56 HydrophobicContact CG1-CD2 3.96Å; V51-L56 HydrophobicContact CG1-CG 4.15Å; F53-L56 HydrophobicContact CD2-CD1 4.3Å; F53-L56 WeakPolarHBondContact O-CB 3.36Å; F53-L56 PolarHBondContact O-N 3.24Å; F53-L56 VanDerWaalsContact O-N 3.1Å; L56-V58 HydrophobicContact CB-CG2 3.9Å; L56-V58 PolarHBondContact O-N 3.22Å; L56-Y84 HydrophobicContact CD2-CD2 3.58Å; L56-Y84 HydrophobicContact CD2-CE2 4.36Å; L56-Y84 HydrophobicContact CD2-CG 3.73Å
57	N	91.8	Very high	87.1	Confident	43 Å²	43	65.7 Å²	65.7	23%	0.23	33%	0.333	C	S	.	.			trans	-80.1	51.5	177.5	-67.8	-79.8	0	0	0	112.6	H59 K60 F61 D81	N57-H59 PolarHBondContact O-N 3Å; N57-H59 VanDerWaalsContact O-N 3.13Å; N57-K60 HydrophobicContact CB-CB 4.49Å; N57-K60 HydrophobicContact CB-CD 3.98Å; N57-K60 HydrophobicContact CB-CG 4.3Å; N57-K60 WeakPolarHBondContact O-CB 3.5Å; N57-K60 PolarHBondContact O-N 3.29Å; N57-F61 WeakPolarHBondContact O-CD2 3.46Å; N57-D81 HydrophobicContact CB-CB 4.31Å; N57-D81 WeakPolarHBondContact CB-OD2 3.2Å; N57-D81 PolarHBondContact N-OD2 3.02Å; N57-D81 VanDerWaalsContact ND2-CG 3.32Å; N57-D81 PolarHBondContact ND2-OD2 3.2Å
58	V	89.8	Confident	86.6	Confident	25 Å²	25	64.9 Å²	64.9	15%	0.152	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-51.1	-41.2	-175.3	176.9	0	0	0	0	112.2	I39 M42 F53 L56 K60 F61 S62	I39-V58 HydrophobicContact CG1-CG1 4.13Å; M42-V58 HydrophobicContact CE-CB 4.03Å; M42-V58 HydrophobicContact CE-CG1 3.6Å; M42-V58 HydrophobicContact CE-CG2 4.14Å; M42-V58 HydrophobicContact SD-CB 4.31Å; M42-V58 HydrophobicContact SD-CG1 4.47Å; M42-V58 HydrophobicContact SD-CG2 3.92Å; F53-V58 HydrophobicContact CD2-CG2 4.46Å; F53-V58 HydrophobicContact CE2-CG2 3.63Å; F53-V58 HydrophobicContact CZ-CG1 4.47Å; F53-V58 HydrophobicContact CZ-CG2 3.69Å; L56-V58 HydrophobicContact CB-CG2 3.9Å; L56-V58 PolarHBondContact O-N 3.22Å; V58-K60 PolarHBondContact O-N 3.19Å; V58-K60 VanDerWaalsContact O-N 3.17Å; V58-F61 WeakPolarHBondContact O-CA 3.36Å; V58-F61 PolarHBondContact O-N 3.19Å; V58-S62 PolarHBondContact O-N 3.34Å
59	H	87.7	Confident	86.3	Confident	129 Å²	129	60.3 Å²	60.3	60%	0.597	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-57.6	-30.7	179.3	65.2	-82	0	0	0	113.2	N57 F61 S62	N57-H59 PolarHBondContact O-N 3Å; N57-H59 VanDerWaalsContact O-N 3.13Å; H59-F61 VanDerWaalsContact C-N 3.27Å; H59-F61 PolarHBondContact O-N 3.04Å; H59-S62 WeakPolarHBondContact O-CB 3.26Å; H59-S62 PolarHBondContact O-N 3.49Å; H59-S62 PolarHBondContact O-OG 3.44Å
60	K	87	Confident	86	Confident	90 Å²	90	57.5 Å²	57.5	39%	0.391	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-76.7	-13.8	176.6	-63.2	-178.3	-177.7	177.1	0	113.5	N57 V58 R80	N57-K60 HydrophobicContact CB-CB 4.49Å; N57-K60 HydrophobicContact CB-CD 3.98Å; N57-K60 HydrophobicContact CB-CG 4.3Å; N57-K60 WeakPolarHBondContact O-CB 3.5Å; N57-K60 PolarHBondContact O-N 3.29Å; V58-K60 PolarHBondContact O-N 3.19Å; V58-K60 VanDerWaalsContact O-N 3.17Å; K60-R80 HydrophobicContact CB-CB 4.05Å; K60-R80 HydrophobicContact CB-CG 4.18Å; K60-R80 WeakPolarHBondContact CD-O 3.37Å; K60-R80 PolarHBondContact NZ-O 2.92Å
61	F	88.2	Confident	85.6	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-8.2	173.1	-62.9	-90.8	0	0	0	113.1	L38 M42 N57 V58 H59 G63 C64 M72 F77 R80 D81 L88	L38-F61 HydrophobicContact CD2-CB 3.75Å; L38-F61 WeakPolarHBondContact CD2-O 3.45Å; M42-F61 HydrophobicContact CE-CB 3.69Å; M42-F61 HydrophobicContact CE-CD2 4.28Å; M42-F61 HydrophobicContact CE-CG 4.19Å; M42-F61 HydrophobicContact SD-CB 4.32Å; M42-F61 HydrophobicContact SD-CD2 3.84Å; M42-F61 HydrophobicContact SD-CE2 4.41Å; M42-F61 HydrophobicContact SD-CG 4.17Å; N57-F61 WeakPolarHBondContact O-CD2 3.46Å; V58-F61 WeakPolarHBondContact O-CA 3.36Å; V58-F61 PolarHBondContact O-N 3.19Å; H59-F61 VanDerWaalsContact C-N 3.27Å; H59-F61 PolarHBondContact O-N 3.04Å; F61-G63 PolarHBondContact O-N 3.39Å; F61-C64 WeakPolarHBondContact O-CA 3.27Å; F61-C64 VanDerWaalsContact O-CB 3.28Å; F61-C64 WeakPolarHBondContact O-CB 3.5Å; F61-C64 PolarHBondContact O-N 3.43Å; F61-M72 HydrophobicContact CD1-CE 4.43Å; F61-M72 HydrophobicContact CE1-CE 4.36Å; F61-F77 AromaticContact CE1-CD1 3.72Å; F61-F77 HydrophobicContact CE1-CD1 3.72Å; F61-F77 HydrophobicContact CE1-CE1 4.1Å; F61-F77 HydrophobicContact CE1-CG 4.23Å; F61-F77 HydrophobicContact CZ-CD1 4.17Å; F61-R80 HydrophobicContact CD2-CB 4.42Å; F61-R80 HydrophobicContact CE1-CB 4.01Å; F61-R80 HydrophobicContact CE1-CG 4.46Å; F61-R80 HydrophobicContact CE2-CB 3.8Å; F61-R80 HydrophobicContact CZ-CB 3.56Å; F61-R80 HydrophobicContact CZ-CG 4.47Å; F61-D81 HydrophobicContact CE2-CB 4.04Å; F61-D81 HydrophobicContact CZ-CB 4.24Å; F61-L88 HydrophobicContact CE2-CD1 3.85Å; F61-L88 HydrophobicContact CZ-CD1 3.76Å
62	S	79.9	Confident	85.4	Confident	70 Å²	70	48.6 Å²	48.6	49%	0.49	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-24.6	-176	60.7	0	0	0	0	115.8	V35 V58 H59	V35-S62 VanDerWaalsContact CG2-O 3.3Å; V35-S62 WeakPolarHBondContact CG2-O 3.44Å; V58-S62 PolarHBondContact O-N 3.34Å; H59-S62 WeakPolarHBondContact O-CB 3.26Å; H59-S62 PolarHBondContact O-N 3.49Å; H59-S62 PolarHBondContact O-OG 3.44Å
63	G	73.6	Confident	85.4	Confident	48 Å²	48	46.9 Å²	46.9	50%	0.495	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-1.8	174.8	0	0	0	0	0	115.3	F61	F61-G63 PolarHBondContact O-N 3.39Å
64	C	73.4	Confident	85.6	Confident	2 Å²	2	46 Å²	46	1%	0.014	25%	0.247	C	C	.	.			trans	-104	90.6	-172.6	-50.4	0	0	0	0	109.8	L38 F61 F68 M69	L38-C64 HydrophobicContact CD2-CB 4.31Å; L38-C64 WeakPolarHBondContact CD2-O 3.3Å; F61-C64 WeakPolarHBondContact O-CA 3.27Å; F61-C64 VanDerWaalsContact O-CB 3.28Å; F61-C64 WeakPolarHBondContact O-CB 3.5Å; F61-C64 PolarHBondContact O-N 3.43Å; C64-F68 HydrophobicContact CB-CB 4.39Å; C64-M69 HydrophobicContact CB-CG 3.78Å
65	A	79.4	Confident	85.7	Confident	20 Å²	20	43.3 Å²	43.3	17%	0.165	23%	0.234	C	C	.	.			trans	-61.5	158.7	158.7	0	0	0	0	0	109.3	W33 K67 F68 M69	W33-A65 CarbonylContact O-C 3.56Å; W33-A65 WeakPolarHBondContact O-CA 3.42Å; W33-A65 VanDerWaalsContact O-CB 3.29Å; W33-A65 WeakPolarHBondContact O-CB 3.37Å; A65-K67 VanDerWaalsContact C-N 3.28Å; A65-K67 HydrophobicContact CB-CG 4.28Å; A65-K67 PolarHBondContact O-N 3.29Å; A65-F68 HydrophobicContact CB-CD2 3.8Å; A65-F68 HydrophobicContact CB-CE2 4.16Å; A65-F68 WeakPolarHBondContact O-CA 3.44Å; A65-F68 VanDerWaalsContact O-CB 3.3Å; A65-F68 WeakPolarHBondContact O-CB 3.03Å; A65-F68 PolarHBondContact O-N 3.29Å; A65-M69 PolarHBondContact O-N 3.37Å
66	G	81.7	Confident	85.6	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-64.8	-27.5	-169.9	0	0	0	0	0	114.7	T30 W33 F68 M69 A70	T30-G66 CarbonylContact O-C 3.59Å; T30-G66 WeakPolarHBondContact O-CA 3.36Å; W33-G66 PolarHBondContact O-N 3.26Å; G66-F68 PolarHBondContact O-N 2.75Å; G66-M69 PolarHBondContact O-N 2.97Å; G66-M69 VanDerWaalsContact O-N 3.07Å; G66-A70 PolarHBondContact O-N 2.95Å
67	K	81.5	Confident	85.7	Confident	108 Å²	108	40.8 Å²	40.8	47%	0.47	22%	0.224	S	C	.	.	H	α-helix	trans	-53.2	-37.7	164.7	60.5	-174.9	174.4	-171	0	113.9	E31 A65	E31-K67 WeakPolarHBondContact O-CB 3.34Å; E31-K67 PolarHBondContact O-N 2.87Å; A65-K67 VanDerWaalsContact C-N 3.28Å; A65-K67 HydrophobicContact CB-CG 4.28Å; A65-K67 PolarHBondContact O-N 3.29Å
68	F	81.6	Confident	85.8	Confident	22 Å²	22	42.6 Å²	42.6	10%	0.096	23%	0.229	C	C	.	.	H	α-helix	trans	-73.4	-40.2	176.9	-65.3	-79.7	0	0	0	110.5	C64 A65 G66 A70 L71 M72 Q205	C64-F68 HydrophobicContact CB-CB 4.39Å; A65-F68 HydrophobicContact CB-CD2 3.8Å; A65-F68 HydrophobicContact CB-CE2 4.16Å; A65-F68 WeakPolarHBondContact O-CA 3.44Å; A65-F68 VanDerWaalsContact O-CB 3.3Å; A65-F68 WeakPolarHBondContact O-CB 3.03Å; A65-F68 PolarHBondContact O-N 3.29Å; G66-F68 PolarHBondContact O-N 2.75Å; F68-A70 VanDerWaalsContact C-N 3.28Å; F68-A70 PolarHBondContact O-N 3.26Å; F68-L71 PolarHBondContact O-N 2.96Å; F68-L71 VanDerWaalsContact O-N 3.13Å; F68-M72 WeakPolarHBondContact O-CG 3.46Å; F68-M72 PolarHBondContact O-N 3.26Å; F68-Q205 HydrophobicContact CD1-CB 4.16Å; F68-Q205 HydrophobicContact CD1-CG 4.43Å; F68-Q205 HydrophobicContact CE1-CB 3.96Å; F68-Q205 HydrophobicContact CE1-CG 3.9Å
69	M	87.2	Confident	85.8	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-34.6	177.5	-65.1	-179.7	70.5	0	0	112.9	L38 F41 C64 A65 G66 L71 M72 F77 F92	L38-M69 HydrophobicContact CD1-CE 3.64Å; L38-M69 HydrophobicContact CD1-SD 3.22Å; L38-M69 WeakPolarHBondContact CD1-SD 3.3Å; L38-M69 HydrophobicContact CD2-SD 4.13Å; L38-M69 HydrophobicContact CG-SD 4.11Å; F41-M69 HydrophobicContact CD1-CE 4.39Å; F41-M69 HydrophobicContact CE1-CE 4.17Å; C64-M69 HydrophobicContact CB-CG 3.78Å; A65-M69 PolarHBondContact O-N 3.37Å; G66-M69 PolarHBondContact O-N 2.97Å; G66-M69 VanDerWaalsContact O-N 3.07Å; M69-L71 PolarHBondContact O-N 2.77Å; M69-M72 HydrophobicContact CB-CE 4.26Å; M69-M72 HydrophobicContact CG-CE 3.92Å; M69-M72 PolarHBondContact O-N 2.9Å; M69-M72 VanDerWaalsContact O-N 3.15Å; M69-F77 HydrophobicContact CB-CZ 4.26Å; M69-F77 HydrophobicContact CE-CE1 3.44Å; M69-F77 VanDerWaalsContact CE-CE1 3.44Å; M69-F77 HydrophobicContact CE-CZ 3.42Å; M69-F77 VanDerWaalsContact CE-CZ 3.42Å; M69-F92 VanDerWaalsContact C-CE1 3.48Å; M69-F92 HydrophobicContact CB-CD1 4.37Å; M69-F92 HydrophobicContact CB-CD2 4.31Å; M69-F92 HydrophobicContact CB-CE1 3.78Å; M69-F92 HydrophobicContact CB-CE2 3.7Å; M69-F92 HydrophobicContact CB-CZ 3.4Å; M69-F92 VanDerWaalsContact CB-CZ 3.4Å; M69-F92 HydrophobicContact CE-CD2 3.74Å; M69-F92 HydrophobicContact CE-CE2 4.12Å; M69-F92 HydrophobicContact CE-CG 4.13Å; M69-F92 HydrophobicContact SD-CD2 4.35Å; M69-F92 HydrophobicContact SD-CE2 4.15Å
70	A	87	Confident	85.9	Confident	26 Å²	26	41.9 Å²	41.9	22%	0.215	22%	0.223	C	C	.	.	H	α-helix	trans	-57.5	-30.4	173.8	0	0	0	0	0	113.3	G66 F68 F92 R93	G66-A70 PolarHBondContact O-N 2.95Å; F68-A70 VanDerWaalsContact C-N 3.28Å; F68-A70 PolarHBondContact O-N 3.26Å; A70-F92 HydrophobicContact CB-CE1 4.45Å; A70-F92 HydrophobicContact CB-CZ 4.46Å; A70-R93 PolarHBondContact O-NH1 3.18Å; A70-R93 PolarHBondContact O-NH2 3.13Å
71	L	85.7	Confident	86.2	Confident	47 Å²	47	37.6 Å²	37.6	25%	0.246	21%	0.205	C	C	.	.	H	α-helix	trans	-88.9	-14.9	179.1	-59.6	-174.3	0	0	0	114.7	F68 M69 K202 Q205	F68-L71 PolarHBondContact O-N 2.96Å; F68-L71 VanDerWaalsContact O-N 3.13Å; M69-L71 PolarHBondContact O-N 2.77Å; L71-K202 HydrophobicContact CD1-CB 4.22Å; L71-K202 HydrophobicContact CD1-CD 4.5Å; L71-K202 HydrophobicContact CD1-CG 3.92Å; L71-K202 HydrophobicContact CD2-CD 3.63Å; L71-K202 HydrophobicContact CD2-CG 3.91Å; L71-Q205 HydrophobicContact CD1-CB 4.08Å
72	M	86.9	Confident	86.5	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	24%	0.235	C	C	.	.			trans	-78.5	140.7	-176.9	-71.4	-171.2	-32.4	0	0	111.2	F61 F68 M69 N76 F77 F89 R93 L209	F61-M72 HydrophobicContact CD1-CE 4.43Å; F61-M72 HydrophobicContact CE1-CE 4.36Å; F68-M72 WeakPolarHBondContact O-CG 3.46Å; F68-M72 PolarHBondContact O-N 3.26Å; M69-M72 HydrophobicContact CB-CE 4.26Å; M69-M72 HydrophobicContact CG-CE 3.92Å; M69-M72 PolarHBondContact O-N 2.9Å; M69-M72 VanDerWaalsContact O-N 3.15Å; M72-N76 HydrophobicContact CB-CB 3.82Å; M72-N76 HydrophobicContact CG-CB 4.09Å; M72-N76 HydrophobicContact SD-CB 4.34Å; M72-F77 HydrophobicContact CB-CD2 4.06Å; M72-F77 HydrophobicContact CB-CE2 3.79Å; M72-F77 HydrophobicContact CE-CD2 3.65Å; M72-F77 HydrophobicContact CE-CE1 4.36Å; M72-F77 HydrophobicContact CE-CE2 3.3Å; M72-F77 HydrophobicContact CE-CG 4.33Å; M72-F77 HydrophobicContact CE-CZ 3.72Å; M72-F89 WeakPolarHBondContact O-CE2 3.21Å; M72-R93 PolarHBondContact O-NH2 3.35Å; M72-L209 HydrophobicContact CG-CD2 3.88Å; M72-L209 HydrophobicContact SD-CD1 4.37Å; M72-L209 HydrophobicContact SD-CD2 3.88Å
73	S	90.1	Very high	87.2	Confident	21 Å²	21	45.4 Å²	45.4	15%	0.147	24%	0.24	C	C	.	.			trans	-80.3	172.3	170	78.7	0	0	0	0	111.4	E75 N76 F77	S73-E75 WeakPolarHBondContact CB-OE2 3.39Å; S73-E75 PolarHBondContact O-N 3.2Å; S73-E75 PolarHBondContact OG-N 3.21Å; S73-E75 PolarHBondContact OG-OE2 3.41Å; S73-N76 PolarHBondContact N-OD1 3.35Å; S73-N76 WeakPolarHBondContact O-CB 3.44Å; S73-N76 PolarHBondContact O-N 3.04Å; S73-N76 VanDerWaalsContact O-N 3.15Å; S73-N76 PolarHBondContact OG-OD1 2.93Å; S73-F77 WeakPolarHBondContact O-CD2 3.48Å; S73-F77 PolarHBondContact O-N 3.43Å
74	E	92.8	Very high	88.3	Confident	57 Å²	57	44.7 Å²	44.7	27%	0.266	22%	0.223	S	C	.	.	H	α-helix	trans	-58.9	-38.3	174.9	-169.1	-179.5	138.7	0	0	111.6	N76 F77 K78 T86 F89	E74-N76 VanDerWaalsContact C-N 3.27Å; E74-N76 PolarHBondContact O-N 3.49Å; E74-F77 WeakPolarHBondContact O-CB 3.25Å; E74-F77 PolarHBondContact O-N 3.09Å; E74-F77 VanDerWaalsContact O-N 3.07Å; E74-K78 HydrophobicContact CG-CD 4.49Å; E74-K78 PolarHBondContact O-N 3.19Å; E74-K78 WeakPolarHBondContact OE1-CE 3.31Å; E74-K78 IonicContact OE1-NZ 3.17Å; E74-K78 PolarHBondContact OE1-NZ 2.66Å; E74-T86 WeakPolarHBondContact OE1-CG2 3.36Å; E74-F89 HydrophobicContact CB-CD1 3.56Å; E74-F89 HydrophobicContact CB-CD2 4.34Å; E74-F89 HydrophobicContact CB-CE1 3.69Å; E74-F89 HydrophobicContact CB-CE2 4.43Å; E74-F89 HydrophobicContact CB-CG 3.9Å; E74-F89 HydrophobicContact CB-CZ 4.13Å; E74-F89 HydrophobicContact CG-CB 4.15Å; E74-F89 HydrophobicContact CG-CD1 3.64Å; E74-F89 HydrophobicContact CG-CE1 4.24Å; E74-F89 HydrophobicContact CG-CG 3.98Å
75	E	91.1	Very high	89.3	Confident	106 Å²	106	44.6 Å²	44.6	50%	0.495	22%	0.222	S	C	.	.	H	α-helix	trans	-60.8	-37.6	177.5	-62.4	67.1	-142.5	0	0	111.3	S73 F77 K78 E79	S73-E75 WeakPolarHBondContact CB-OE2 3.39Å; S73-E75 PolarHBondContact O-N 3.2Å; S73-E75 PolarHBondContact OG-N 3.21Å; S73-E75 PolarHBondContact OG-OE2 3.41Å; E75-F77 VanDerWaalsContact C-N 3.29Å; E75-F77 PolarHBondContact O-N 3.47Å; E75-K78 PolarHBondContact O-N 2.89Å; E75-E79 WeakPolarHBondContact O-CB 3.47Å; E75-E79 PolarHBondContact O-N 3.34Å
76	N	89.8	Confident	90	Very high	40 Å²	40	46.7 Å²	46.7	21%	0.214	23%	0.233	C	C	.	.	H	α-helix	trans	-66.7	-32.6	176.6	-65.3	136.1	0	0	0	112.4	M72 S73 E74 R80	M72-N76 HydrophobicContact CB-CB 3.82Å; M72-N76 HydrophobicContact CG-CB 4.09Å; M72-N76 HydrophobicContact SD-CB 4.34Å; S73-N76 PolarHBondContact N-OD1 3.35Å; S73-N76 WeakPolarHBondContact O-CB 3.44Å; S73-N76 PolarHBondContact O-N 3.04Å; S73-N76 VanDerWaalsContact O-N 3.15Å; S73-N76 PolarHBondContact OG-OD1 2.93Å; E74-N76 VanDerWaalsContact C-N 3.27Å; E74-N76 PolarHBondContact O-N 3.49Å; N76-R80 PolarHBondContact O-N 3.48Å; N76-R80 PolarHBondContact O-NH1 3.36Å
77	F	93.4	Very high	90.7	Very high	1 Å²	1	48 Å²	48	0%	0.004	24%	0.24	C	C	.	.	H	α-helix	trans	-71.6	-42.9	172.4	-82	-110.2	0	0	0	110.9	F61 M69 M72 S73 E74 E75 E79 R80 D81 G85 L88 F89 F92	F61-F77 AromaticContact CE1-CD1 3.72Å; F61-F77 HydrophobicContact CE1-CD1 3.72Å; F61-F77 HydrophobicContact CE1-CE1 4.1Å; F61-F77 HydrophobicContact CE1-CG 4.23Å; F61-F77 HydrophobicContact CZ-CD1 4.17Å; M69-F77 HydrophobicContact CB-CZ 4.26Å; M69-F77 HydrophobicContact CE-CE1 3.44Å; M69-F77 VanDerWaalsContact CE-CE1 3.44Å; M69-F77 HydrophobicContact CE-CZ 3.42Å; M69-F77 VanDerWaalsContact CE-CZ 3.42Å; M72-F77 HydrophobicContact CB-CD2 4.06Å; M72-F77 HydrophobicContact CB-CE2 3.79Å; M72-F77 HydrophobicContact CE-CD2 3.65Å; M72-F77 HydrophobicContact CE-CE1 4.36Å; M72-F77 HydrophobicContact CE-CE2 3.3Å; M72-F77 HydrophobicContact CE-CG 4.33Å; M72-F77 HydrophobicContact CE-CZ 3.72Å; S73-F77 WeakPolarHBondContact O-CD2 3.48Å; S73-F77 PolarHBondContact O-N 3.43Å; E74-F77 WeakPolarHBondContact O-CB 3.25Å; E74-F77 PolarHBondContact O-N 3.09Å; E74-F77 VanDerWaalsContact O-N 3.07Å; E75-F77 VanDerWaalsContact C-N 3.29Å; E75-F77 PolarHBondContact O-N 3.47Å; F77-E79 PolarHBondContact O-N 3.02Å; F77-R80 PolarHBondContact O-N 3.4Å; F77-D81 PolarHBondContact O-N 3.49Å; F77-G85 VanDerWaalsContact CB-O 3.3Å; F77-G85 WeakPolarHBondContact CB-O 3.43Å; F77-G85 WeakPolarHBondContact O-CA 3.04Å; F77-L88 HydrophobicContact CD1-CB 3.68Å; F77-L88 HydrophobicContact CE1-CB 4.04Å; F77-F89 HydrophobicContact CB-CB 3.98Å; F77-F89 HydrophobicContact CD1-CB 4.04Å; F77-F89 HydrophobicContact CD2-CB 4.04Å; F77-F89 AromaticContact CD2-CD2 3.55Å; F77-F89 HydrophobicContact CD2-CD2 3.55Å; F77-F89 HydrophobicContact CD2-CE2 4.49Å; F77-F89 HydrophobicContact CD2-CG 4.26Å; F77-F89 HydrophobicContact CE1-CB 4.48Å; F77-F89 HydrophobicContact CE2-CB 4.48Å; F77-F89 AromaticContact CE2-CD2 3.63Å; F77-F89 HydrophobicContact CE2-CD2 3.63Å; F77-F89 HydrophobicContact CE2-CE2 4.44Å; F77-F89 HydrophobicContact CG-CB 3.78Å; F77-F89 HydrophobicContact CG-CD2 4.19Å; F77-F89 HydrophobicContact CG-CG 4.48Å; F77-F89 HydrophobicContact CZ-CD2 4.33Å; F77-F92 HydrophobicContact CE1-CB 4.46Å; F77-F92 HydrophobicContact CZ-CB 4.28Å; F77-F92 HydrophobicContact CZ-CD1 4.22Å; F77-F92 HydrophobicContact CZ-CG 4.23Å
78	K	94	Very high	91.4	Very high	80 Å²	80	43 Å²	43	35%	0.348	22%	0.218	S	C	.	.	H	α-helix	trans	-61.7	-37.8	175.1	-72.7	174.5	173.9	161.5	0	113.1	E74 E75 R80 D81 P82 T86	E74-K78 HydrophobicContact CG-CD 4.49Å; E74-K78 PolarHBondContact O-N 3.19Å; E74-K78 WeakPolarHBondContact OE1-CE 3.31Å; E74-K78 IonicContact OE1-NZ 3.17Å; E74-K78 PolarHBondContact OE1-NZ 2.66Å; E75-K78 PolarHBondContact O-N 2.89Å; K78-R80 VanDerWaalsContact C-N 3.28Å; K78-R80 PolarHBondContact O-N 3.42Å; K78-D81 CarbonylContact O-C 3.14Å; K78-P82 WeakPolarHBondContact O-CA 3.48Å; K78-P82 WeakPolarHBondContact O-CD 3.47Å; K78-T86 WeakPolarHBondContact CE-OG1 3.41Å
79	E	89.9	Confident	92	Very high	109 Å²	109	43.5 Å²	43.5	51%	0.509	22%	0.22	S	C	.	.	H	α-helix	trans	-63.9	-35.9	177.3	-173.2	-178.5	-169.3	0	0	111.6	E75 F77 H161	E75-E79 WeakPolarHBondContact O-CB 3.47Å; E75-E79 PolarHBondContact O-N 3.34Å; F77-E79 PolarHBondContact O-N 3.02Å; E79-H161 IonicContact OE1-CE1 2.86Å; E79-H161 PolarHBondContact OE1-CE1 2.74Å
80	R	90.9	Very high	92.3	Very high	30 Å²	30	49.1 Å²	49.1	11%	0.113	24%	0.241	C	C	.	.	H	α-helix	trans	-76.3	-52	175.8	-71.6	170.6	177.3	66.3	10	110.5	K60 F61 N76 F77 K78	K60-R80 HydrophobicContact CB-CB 4.05Å; K60-R80 HydrophobicContact CB-CG 4.18Å; K60-R80 WeakPolarHBondContact CD-O 3.37Å; K60-R80 PolarHBondContact NZ-O 2.92Å; F61-R80 HydrophobicContact CD2-CB 4.42Å; F61-R80 HydrophobicContact CE1-CB 4.01Å; F61-R80 HydrophobicContact CE1-CG 4.46Å; F61-R80 HydrophobicContact CE2-CB 3.8Å; F61-R80 HydrophobicContact CZ-CB 3.56Å; F61-R80 HydrophobicContact CZ-CG 4.47Å; N76-R80 PolarHBondContact O-N 3.48Å; N76-R80 PolarHBondContact O-NH1 3.36Å; F77-R80 PolarHBondContact O-N 3.4Å; K78-R80 VanDerWaalsContact C-N 3.28Å; K78-R80 PolarHBondContact O-N 3.42Å
81	D	92.9	Very high	92.7	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.232	C	C	.	.			trans	-124.2	94.9	178.7	-159.5	-47.9	0	0	0	110.7	N57 F61 F77 K78 K83 Y84 G85 L88	N57-D81 HydrophobicContact CB-CB 4.31Å; N57-D81 WeakPolarHBondContact CB-OD2 3.2Å; N57-D81 PolarHBondContact N-OD2 3.02Å; N57-D81 VanDerWaalsContact ND2-CG 3.32Å; N57-D81 PolarHBondContact ND2-OD2 3.2Å; F61-D81 HydrophobicContact CE2-CB 4.04Å; F61-D81 HydrophobicContact CZ-CB 4.24Å; F77-D81 PolarHBondContact O-N 3.49Å; K78-D81 CarbonylContact O-C 3.14Å; D81-K83 PolarHBondContact O-N 3.02Å; D81-K83 PolarHBondContact OD1-N 3.49Å; D81-K83 VanDerWaalsContact OD1-N 3.13Å; D81-Y84 PolarHBondContact OD1-N 3.13Å; D81-G85 WeakPolarHBondContact O-CA 3.48Å; D81-G85 PolarHBondContact O-N 3.38Å; D81-L88 HydrophobicContact CB-CD1 4.39Å
82	P	94.1	Very high	93	Very high	99 Å²	99	45.9 Å²	45.9	64%	0.643	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-25.9	-179.2	-27.3	35.9	0	0	0	113.9	K78	K78-P82 WeakPolarHBondContact O-CA 3.48Å; K78-P82 WeakPolarHBondContact O-CD 3.47Å
83	K	94.9	Very high	93.2	Very high	136 Å²	136	49.7 Å²	49.7	59%	0.591	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-44.4	-175.7	-170.9	174.2	178.8	-171.2	0	111.5	E55 D81	E55-K83 IonicContact OE1-NZ 2.71Å; E55-K83 IonicContact OE2-NZ 3.51Å; E55-K83 PolarHBondContact OE2-NZ 3.39Å; D81-K83 PolarHBondContact O-N 3.02Å; D81-K83 PolarHBondContact OD1-N 3.49Å; D81-K83 VanDerWaalsContact OD1-N 3.13Å
84	Y	96.1	Very high	93.2	Very high	32 Å²	32	52.2 Å²	52.2	13%	0.125	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.6	1.3	-171.9	-59.4	-67	0	0	0	114.2	V51 E55 L56 D81 T86 L87 L88	V51-Y84 HydrophobicContact CB-CE1 4.24Å; V51-Y84 HydrophobicContact CG1-CD1 4.14Å; V51-Y84 HydrophobicContact CG1-CD2 4.07Å; V51-Y84 HydrophobicContact CG1-CE1 3.68Å; V51-Y84 HydrophobicContact CG1-CE2 3.55Å; V51-Y84 HydrophobicContact CG1-CG 4.32Å; V51-Y84 HydrophobicContact CG2-CD1 3.94Å; V51-Y84 HydrophobicContact CG2-CE1 3.49Å; V51-Y84 VanDerWaalsContact CG2-CE1 3.49Å; E55-Y84 HydrophobicContact CB-CE2 3.81Å; E55-Y84 PolarHBondContact OE2-OH 3.22Å; L56-Y84 HydrophobicContact CD2-CD2 3.58Å; L56-Y84 HydrophobicContact CD2-CE2 4.36Å; L56-Y84 HydrophobicContact CD2-CG 3.73Å; D81-Y84 PolarHBondContact OD1-N 3.13Å; Y84-T86 PolarHBondContact O-N 3.2Å; Y84-L87 HydrophobicContact CD1-CD2 4.29Å; Y84-L87 WeakPolarHBondContact O-CB 3.13Å; Y84-L87 PolarHBondContact O-N 3.15Å; Y84-L88 WeakPolarHBondContact O-CG 3.49Å; Y84-L88 PolarHBondContact O-N 3.23Å
85	G	93.9	Very high	92.8	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-56.8	-45.4	-178	0	0	0	0	0	113.1	F77 D81 L87 L88 F89	F77-G85 VanDerWaalsContact CB-O 3.3Å; F77-G85 WeakPolarHBondContact CB-O 3.43Å; F77-G85 WeakPolarHBondContact O-CA 3.04Å; D81-G85 WeakPolarHBondContact O-CA 3.48Å; D81-G85 PolarHBondContact O-N 3.38Å; G85-L87 VanDerWaalsContact C-N 3.31Å; G85-L87 PolarHBondContact O-N 3.38Å; G85-L88 PolarHBondContact O-N 3.13Å; G85-F89 WeakPolarHBondContact O-CB 3.49Å; G85-F89 PolarHBondContact O-N 2.88Å
86	T	95.9	Very high	92.4	Very high	65 Å²	65	48.6 Å²	48.6	40%	0.399	24%	0.235	S	C	.	.	H	α-helix	trans	-57	-44.6	173.9	-50.1	0	0	0	0	112	E74 K78 Y84 R90	E74-T86 WeakPolarHBondContact OE1-CG2 3.36Å; K78-T86 WeakPolarHBondContact CE-OG1 3.41Å; Y84-T86 PolarHBondContact O-N 3.2Å; T86-R90 WeakPolarHBondContact O-CB 3.42Å; T86-R90 PolarHBondContact O-N 3.4Å
87	L	95.8	Very high	91.5	Very high	28 Å²	28	51.1 Å²	51.1	15%	0.147	26%	0.256	C	S	.	.	H	α-helix	trans	-65.4	-49.3	-179.2	176.3	63.9	0	0	0	110.8	V45 Y49 V51 Y84 G85 F89 R90 E91	V45-L87 HydrophobicContact CG1-CD2 4.04Å; V45-L87 HydrophobicContact CG1-CG 3.99Å; Y49-L87 HydrophobicContact CD1-CD1 4.12Å; Y49-L87 HydrophobicContact CD2-CD1 3.84Å; Y49-L87 HydrophobicContact CD2-CD2 4.08Å; Y49-L87 HydrophobicContact CD2-CG 4.33Å; Y49-L87 HydrophobicContact CE1-CD1 4.09Å; Y49-L87 HydrophobicContact CE2-CD1 3.79Å; Y49-L87 HydrophobicContact CG-CD1 4.01Å; Y49-L87 HydrophobicContact CG-CD2 3.98Å; V51-L87 HydrophobicContact CG2-CD2 4.35Å; Y84-L87 HydrophobicContact CD1-CD2 4.29Å; Y84-L87 WeakPolarHBondContact O-CB 3.13Å; Y84-L87 PolarHBondContact O-N 3.15Å; G85-L87 VanDerWaalsContact C-N 3.31Å; G85-L87 PolarHBondContact O-N 3.38Å; L87-F89 VanDerWaalsContact C-N 3.34Å; L87-F89 PolarHBondContact O-N 3.24Å; L87-R90 PolarHBondContact O-N 2.9Å; L87-E91 HydrophobicContact CD1-CG 4.28Å; L87-E91 WeakPolarHBondContact O-CG 3.45Å; L87-E91 PolarHBondContact O-N 3.24Å
88	L	94.9	Very high	90	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-59.6	-43.9	177.8	-70.9	172.6	0	0	0	111.5	F41 M42 V45 F61 F77 D81 Y84 G85 F92	F41-L88 HydrophobicContact CE1-CD2 4.2Å; M42-L88 HydrophobicContact CG-CD2 3.96Å; V45-L88 HydrophobicContact CB-CD2 4.22Å; V45-L88 HydrophobicContact CG1-CD2 4.04Å; V45-L88 HydrophobicContact CG2-CD2 4.47Å; F61-L88 HydrophobicContact CE2-CD1 3.85Å; F61-L88 HydrophobicContact CZ-CD1 3.76Å; F77-L88 HydrophobicContact CD1-CB 3.68Å; F77-L88 HydrophobicContact CE1-CB 4.04Å; D81-L88 HydrophobicContact CB-CD1 4.39Å; Y84-L88 WeakPolarHBondContact O-CG 3.49Å; Y84-L88 PolarHBondContact O-N 3.23Å; G85-L88 PolarHBondContact O-N 3.13Å; L88-F92 VanDerWaalsContact O-CB 3.24Å; L88-F92 WeakPolarHBondContact O-CB 3.49Å; L88-F92 PolarHBondContact O-N 3.49Å
89	F	94.9	Very high	88.1	Confident	33 Å²	33	56 Å²	56	15%	0.145	30%	0.295	C	S	.	.	H	α-helix	trans	-61.9	-48.5	177.1	179.6	-104.4	0	0	0	111.7	M72 E74 F77 G85 L87 E91 F92 R93	M72-F89 WeakPolarHBondContact O-CE2 3.21Å; E74-F89 HydrophobicContact CB-CD1 3.56Å; E74-F89 HydrophobicContact CB-CD2 4.34Å; E74-F89 HydrophobicContact CB-CE1 3.69Å; E74-F89 HydrophobicContact CB-CE2 4.43Å; E74-F89 HydrophobicContact CB-CG 3.9Å; E74-F89 HydrophobicContact CB-CZ 4.13Å; E74-F89 HydrophobicContact CG-CB 4.15Å; E74-F89 HydrophobicContact CG-CD1 3.64Å; E74-F89 HydrophobicContact CG-CE1 4.24Å; E74-F89 HydrophobicContact CG-CG 3.98Å; F77-F89 HydrophobicContact CB-CB 3.98Å; F77-F89 HydrophobicContact CD1-CB 4.04Å; F77-F89 HydrophobicContact CD2-CB 4.04Å; F77-F89 AromaticContact CD2-CD2 3.55Å; F77-F89 HydrophobicContact CD2-CD2 3.55Å; F77-F89 HydrophobicContact CD2-CE2 4.49Å; F77-F89 HydrophobicContact CD2-CG 4.26Å; F77-F89 HydrophobicContact CE1-CB 4.48Å; F77-F89 HydrophobicContact CE2-CB 4.48Å; F77-F89 AromaticContact CE2-CD2 3.63Å; F77-F89 HydrophobicContact CE2-CD2 3.63Å; F77-F89 HydrophobicContact CE2-CE2 4.44Å; F77-F89 HydrophobicContact CG-CB 3.78Å; F77-F89 HydrophobicContact CG-CD2 4.19Å; F77-F89 HydrophobicContact CG-CG 4.48Å; F77-F89 HydrophobicContact CZ-CD2 4.33Å; G85-F89 WeakPolarHBondContact O-CB 3.49Å; G85-F89 PolarHBondContact O-N 2.88Å; L87-F89 VanDerWaalsContact C-N 3.34Å; L87-F89 PolarHBondContact O-N 3.24Å; F89-E91 PolarHBondContact O-N 3.49Å; F89-F92 PolarHBondContact O-N 3.24Å; F89-R93 HydrophobicContact CD1-CG 4.2Å; F89-R93 HydrophobicContact CD2-CG 4.27Å; F89-R93 HydrophobicContact CE1-CG 3.85Å; F89-R93 HydrophobicContact CE2-CG 3.95Å; F89-R93 HydrophobicContact CG-CG 4.41Å; F89-R93 HydrophobicContact CZ-CG 3.73Å; F89-R93 VanDerWaalsContact CZ-NE 3.32Å; F89-R93 VanDerWaalsContact O-CG 3.31Å; F89-R93 WeakPolarHBondContact O-CG 3.43Å; F89-R93 PolarHBondContact O-N 3.14Å
90	R	94.6	Very high	85.7	Confident	118 Å²	118	57.5 Å²	57.5	45%	0.445	31%	0.306	S	S	.	.	H	α-helix	trans	-58.1	-50.1	179.1	-175.1	-175.4	71.5	-164.8	-0.9	111.7	Y49 T86 L87 F92 R93 N94	Y49-R90 PolarHBondContact OH-NH2 3.46Å; T86-R90 WeakPolarHBondContact O-CB 3.42Å; T86-R90 PolarHBondContact O-N 3.4Å; L87-R90 PolarHBondContact O-N 2.9Å; R90-F92 VanDerWaalsContact C-N 3.32Å; R90-F92 PolarHBondContact O-N 3.06Å; R90-R93 PolarHBondContact O-N 3.45Å; R90-N94 VanDerWaalsContact O-CG 3.25Å; R90-N94 PolarHBondContact O-N 3.27Å; R90-N94 PolarHBondContact O-ND2 2.9Å
91	E	93.9	Very high	83.4	Confident	6 Å²	6	62.1 Å²	62.1	3%	0.028	34%	0.34	C	S	.	.	H	α-helix	trans	-65.5	-37	-179.7	-66.1	-53.3	117	0	0	112.1	F41 V45 K48 Y49 L87 F89 N94 L95	F41-E91 HydrophobicContact CE2-CB 3.99Å; F41-E91 HydrophobicContact CZ-CB 4Å; V45-E91 HydrophobicContact CG1-CG 4.23Å; V45-E91 HydrophobicContact CG2-CB 3.79Å; V45-E91 HydrophobicContact CG2-CG 4.02Å; K48-E91 IonicContact NZ-OE2 3.59Å; K48-E91 PolarHBondContact NZ-OE2 2.71Å; Y49-E91 HydrophobicContact CE2-CG 3.74Å; Y49-E91 VanDerWaalsContact OH-CD 3.31Å; Y49-E91 PolarHBondContact OH-OE1 3.19Å; L87-E91 HydrophobicContact CD1-CG 4.28Å; L87-E91 WeakPolarHBondContact O-CG 3.45Å; L87-E91 PolarHBondContact O-N 3.24Å; F89-E91 PolarHBondContact O-N 3.49Å; E91-N94 PolarHBondContact O-N 3.28Å; E91-L95 WeakPolarHBondContact O-CG 3.44Å; E91-L95 PolarHBondContact O-N 2.78Å; E91-L95 VanDerWaalsContact O-N 3.14Å
92	F	92.6	Very high	80.8	Confident	0 Å²	0	73 Å²	73	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-64.2	-43.3	175.1	-178	-97.3	0	0	0	111.6	T30 W33 F41 M69 A70 F77 L88 F89 R90 L95 C96	T30-F92 HydrophobicContact CG2-CE2 4.05Å; T30-F92 HydrophobicContact CG2-CZ 4.3Å; W33-F92 HydrophobicContact CE3-CE2 4.18Å; W33-F92 HydrophobicContact CH2-CD2 4.35Å; W33-F92 HydrophobicContact CH2-CE2 4.44Å; W33-F92 AromaticContact CZ3-CD2 3.92Å; W33-F92 HydrophobicContact CZ3-CD2 3.92Å; W33-F92 AromaticContact CZ3-CE2 3.9Å; W33-F92 HydrophobicContact CZ3-CE2 3.9Å; F41-F92 HydrophobicContact CE1-CB 4.22Å; F41-F92 HydrophobicContact CE1-CD2 4.49Å; F41-F92 HydrophobicContact CE2-CB 4.44Å; F41-F92 HydrophobicContact CZ-CB 3.76Å; M69-F92 VanDerWaalsContact C-CE1 3.48Å; M69-F92 HydrophobicContact CB-CD1 4.37Å; M69-F92 HydrophobicContact CB-CD2 4.31Å; M69-F92 HydrophobicContact CB-CE1 3.78Å; M69-F92 HydrophobicContact CB-CE2 3.7Å; M69-F92 HydrophobicContact CB-CZ 3.4Å; M69-F92 VanDerWaalsContact CB-CZ 3.4Å; M69-F92 HydrophobicContact CE-CD2 3.74Å; M69-F92 HydrophobicContact CE-CE2 4.12Å; M69-F92 HydrophobicContact CE-CG 4.13Å; M69-F92 HydrophobicContact SD-CD2 4.35Å; M69-F92 HydrophobicContact SD-CE2 4.15Å; A70-F92 HydrophobicContact CB-CE1 4.45Å; A70-F92 HydrophobicContact CB-CZ 4.46Å; F77-F92 HydrophobicContact CE1-CB 4.46Å; F77-F92 HydrophobicContact CZ-CB 4.28Å; F77-F92 HydrophobicContact CZ-CD1 4.22Å; F77-F92 HydrophobicContact CZ-CG 4.23Å; L88-F92 VanDerWaalsContact O-CB 3.24Å; L88-F92 WeakPolarHBondContact O-CB 3.49Å; L88-F92 PolarHBondContact O-N 3.49Å; F89-F92 PolarHBondContact O-N 3.24Å; R90-F92 VanDerWaalsContact C-N 3.32Å; R90-F92 PolarHBondContact O-N 3.06Å; F92-L95 PolarHBondContact O-N 3.48Å; F92-C96 PolarHBondContact O-N 3.42Å; F92-C96 PolarHBondContact O-SG 3.06Å; F92-C96 VanDerWaalsContact O-SG 3.35Å
93	R	91.2	Very high	78.3	Confident	81 Å²	81	73.2 Å²	73.2	31%	0.306	39%	0.385	S	S	.	.	H	α-helix	trans	-66.2	-37.2	176.7	-67.4	-68.4	170.4	-169.2	-5.7	112.5	A70 M72 F89 R90 L95 C96 S97	A70-R93 PolarHBondContact O-NH1 3.18Å; A70-R93 PolarHBondContact O-NH2 3.13Å; M72-R93 PolarHBondContact O-NH2 3.35Å; F89-R93 HydrophobicContact CD1-CG 4.2Å; F89-R93 HydrophobicContact CD2-CG 4.27Å; F89-R93 HydrophobicContact CE1-CG 3.85Å; F89-R93 HydrophobicContact CE2-CG 3.95Å; F89-R93 HydrophobicContact CG-CG 4.41Å; F89-R93 HydrophobicContact CZ-CG 3.73Å; F89-R93 VanDerWaalsContact CZ-NE 3.32Å; F89-R93 VanDerWaalsContact O-CG 3.31Å; F89-R93 WeakPolarHBondContact O-CG 3.43Å; F89-R93 PolarHBondContact O-N 3.14Å; R90-R93 PolarHBondContact O-N 3.45Å; R93-L95 VanDerWaalsContact C-N 3.31Å; R93-L95 PolarHBondContact O-N 2.94Å; R93-C96 WeakPolarHBondContact O-CB 3.29Å; R93-C96 PolarHBondContact O-N 2.85Å; R93-S97 PolarHBondContact O-N 3.27Å; R93-S97 VanDerWaalsContact O-N 3.16Å; R93-S97 PolarHBondContact O-OG 3.27Å
94	N	89	Confident	75.8	Confident	74 Å²	74	71.2 Å²	71.2	40%	0.396	39%	0.394	S	S	.	.	H	α-helix	trans	-59	-43.5	173	-70.1	-16.4	0	0	0	111.4	R90 E91 C96 S97 D98	R90-N94 VanDerWaalsContact O-CG 3.25Å; R90-N94 PolarHBondContact O-N 3.27Å; R90-N94 PolarHBondContact O-ND2 2.9Å; E91-N94 PolarHBondContact O-N 3.28Å; N94-C96 PolarHBondContact O-N 3.26Å; N94-S97 PolarHBondContact O-N 3.42Å; N94-D98 PolarHBondContact O-N 3.24Å
95	L	86.2	Confident	73.4	Confident	43 Å²	43	76.7 Å²	76.7	23%	0.225	43%	0.426	C	S	.	.	H	α-helix	trans	-67.6	-33.1	177.1	-69.7	172.1	0	0	0	113.3	F25 T30 W33 F41 E91 F92 R93 S97	F25-L95 HydrophobicContact CE2-CD1 4.11Å; T30-L95 HydrophobicContact CG2-CB 4.26Å; W33-L95 HydrophobicContact CH2-CD1 3.72Å; W33-L95 HydrophobicContact CZ2-CD1 4.26Å; F41-L95 HydrophobicContact CD2-CD1 3.51Å; F41-L95 HydrophobicContact CE2-CD1 3.55Å; E91-L95 WeakPolarHBondContact O-CG 3.44Å; E91-L95 PolarHBondContact O-N 2.78Å; E91-L95 VanDerWaalsContact O-N 3.14Å; F92-L95 PolarHBondContact O-N 3.48Å; R93-L95 VanDerWaalsContact C-N 3.31Å; R93-L95 PolarHBondContact O-N 2.94Å; L95-S97 VanDerWaalsContact C-N 3.27Å; L95-S97 PolarHBondContact O-N 2.82Å
96	C	81.6	Confident	71.2	Confident	43 Å²	43	84 Å²	84	29%	0.291	46%	0.464	S	S	.	.	H	α-helix	trans	-63.7	-34.5	172.3	-66.6	0	0	0	0	112.2	T30 F92 R93 N94	T30-C96 PolarHBondContact OG1-SG 2.87Å; F92-C96 PolarHBondContact O-N 3.42Å; F92-C96 PolarHBondContact O-SG 3.06Å; F92-C96 VanDerWaalsContact O-SG 3.35Å; R93-C96 WeakPolarHBondContact O-CB 3.29Å; R93-C96 PolarHBondContact O-N 2.85Å; N94-C96 PolarHBondContact O-N 3.26Å
97	S	71.5	Confident	68.8	Low	94 Å²	94	88.5 Å²	88.5	66%	0.657	48%	0.481	S	S	*	.	H	α-helix	trans	-81.2	-32.3	-178.4	-60.7	0	0	0	0	113.4	R93 N94 L95 A99	R93-S97 PolarHBondContact O-N 3.27Å; R93-S97 VanDerWaalsContact O-N 3.16Å; R93-S97 PolarHBondContact O-OG 3.27Å; N94-S97 PolarHBondContact O-N 3.42Å; L95-S97 VanDerWaalsContact C-N 3.27Å; L95-S97 PolarHBondContact O-N 2.82Å; S97-A99 VanDerWaalsContact C-N 3.28Å; S97-A99 PolarHBondContact O-N 3.1Å
98	D	62	Low	66.3	Low	114 Å²	114	98.1 Å²	98.1	61%	0.61	52%	0.515	S	S	*	.	S	Bend	trans	-80.1	1.8	-175.7	-95.2	-28.4	0	0	0	114.7	N94 L100	N94-D98 PolarHBondContact O-N 3.24Å; D98-L100 PolarHBondContact O-N 3.32Å
99	A	53.3	Low	63.8	Low	68 Å²	68	106.4 Å²	106.4	56%	0.562	55%	0.554	S	S	*	*			trans	-74.5	20.2	-177.9	0	0	0	0	0	115.2	S97	S97-A99 VanDerWaalsContact C-N 3.28Å; S97-A99 PolarHBondContact O-N 3.1Å
100	L	39.4	Very low	61.5	Low	142 Å²	142	109.5 Å²	109.5	74%	0.743	59%	0.586	S	S	*	*	S	Bend	trans	-86	132.1	168.4	-69.7	179.4	0	0	0	110.1	D98 R102	D98-L100 PolarHBondContact O-N 3.32Å; L100-R102 PolarHBondContact O-N 3.46Å; L100-R102 VanDerWaalsContact O-N 3.07Å
101	P	42.2	Very low	59	Low	126 Å²	126	109.4 Å²	109.4	82%	0.818	60%	0.6	S	S	*	*			trans	-66.3	112.7	-177.6	25	-30.2	0	0	0	110.1	S103	P101-S103 PolarHBondContact O-N 2.94Å; P101-S103 VanDerWaalsContact O-N 3.1Å
102	R	39	Very low	56.6	Low	228 Å²	228	115.8 Å²	115.8	86%	0.86	64%	0.644	S	S	*	*			trans	-67.7	105.4	165.3	-75.5	-175.4	-178.8	-170.6	0.9	107.9	L100	L100-R102 PolarHBondContact O-N 3.46Å; L100-R102 VanDerWaalsContact O-N 3.07Å
103	S	41.9	Very low	54.4	Low	104 Å²	104	124.6 Å²	124.6	73%	0.727	69%	0.685	S	S	*	*			trans	-56.1	134	168.7	53.8	0	0	0	0	110	P101	P101-S103 PolarHBondContact O-N 2.94Å; P101-S103 VanDerWaalsContact O-N 3.1Å
104	A	42.4	Very low	52.3	Low	94 Å²	94	125.9 Å²	125.9	78%	0.777	71%	0.706	S	S	*	*			trans	-69.1	121.7	171.9	0	0	0	0	0	110.3
105	D	45.5	Very low	50.5	Low	148 Å²	148	127.3 Å²	127.3	79%	0.791	72%	0.723	S	S	*	*			trans	-160.6	99.5	159.8	-97.4	-50.5	0	0	0	107.7
106	D	46.5	Very low	48.8	Very low	152 Å²	152	130.7 Å²	130.7	81%	0.813	75%	0.75	S	S	*	*			trans	-162.9	88.3	143.5	-139.7	-90	0	0	0	110.1
107	Q	45.6	Very low	47.5	Very low	160 Å²	160	134.4 Å²	134.4	75%	0.748	77%	0.773	S	S	*	*			trans	20.6	120.9	140.9	-55.2	-179.6	-3.6	0	0	119.3
108	R	44.1	Very low	46.3	Very low	231 Å²	231	138.3 Å²	138.3	87%	0.872	78%	0.781	S	S	*	*				178.8	124.2	114.3	-94.8	171.5	-153.8	-164.7	5.7	113.5
109	E	41.6	Very low	46	Very low	176 Å²	176	137.6 Å²	137.6	82%	0.822	79%	0.785	S	S	*	*			trans	66.7	103.1	136.6	-60.6	-76.6	135.4	0	0	120.3
110	A	48.4	Very low	45.8	Very low	98 Å²	98	140.4 Å²	140.4	81%	0.81	80%	0.795	S	S	*	*				169.6	125	110.4	0	0	0	0	0	111.5
111	P	40.7	Very low	46.3	Very low	116 Å²	116	136.8 Å²	136.8	75%	0.753	79%	0.793	S	S	*	*			trans	-107.9	140.2	-176.4	35.7	-26.3	0	0	0	113.6
112	C	44	Very low	46.7	Very low	139 Å²	139	137 Å²	137	94%	0.939	79%	0.792	S	S	*	*			trans	-145.2	140	159.1	-75.2	0	0	0	0	110.8
113	Q	46.4	Very low	47.5	Very low	185 Å²	185	131 Å²	131	86%	0.864	79%	0.785	S	S	*	*			trans	-94.1	152.3	-157.6	-59.4	157.6	1.2	0	0	112.8
114	S	48.1	Very low	48.1	Very low	108 Å²	108	135.3 Å²	135.3	76%	0.755	79%	0.79	S	S	*	*				169.7	126.4	113.9	59.1	0	0	0	0	112.4
115	S	49.8	Very low	48.5	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	79%	0.788	S	S	*	*			trans	43.1	141.6	141.9	58.5	0	0	0	0	121
116	S	51.8	Low	49.1	Very low	114 Å²	114	135.5 Å²	135.5	80%	0.797	79%	0.787	S	S	*	*			cis	-177.5	161.3	-13	-98.3	0	0	0	0	105.5
117	P	52.7	Low	49.2	Very low	120 Å²	120	137.9 Å²	137.9	78%	0.779	79%	0.785	S	S	*	*			trans	-101.2	-179.6	-162	39.5	-32.2	0	0	0	113.3
118	E	46.8	Very low	49.4	Very low	176 Å²	176	136.7 Å²	136.7	82%	0.822	78%	0.783	S	S	*	*				169.8	136.3	125.6	-171.2	163.8	120.1	0	0	114.8
119	S	56	Low	49.6	Very low	99 Å²	99	131 Å²	131	69%	0.692	78%	0.778	S	S	*	*			trans	58.4	155.8	150	-74.5	0	0	0	0	123.5
120	T	48.6	Very low	50.2	Low	127 Å²	127	127.9 Å²	127.9	78%	0.779	77%	0.773	S	S	*	*			cis	-178.2	137.2	-20.3	-79.9	0	0	0	0	105.8
121	G	49.7	Very low	50.3	Low	67 Å²	67	130.7 Å²	130.7	69%	0.691	77%	0.767	S	S	*	*			trans	74.5	163.8	152.6	0	0	0	0	0	118.4
122	T	51.9	Low	50.8	Low	130 Å²	130	131.7 Å²	131.7	80%	0.798	76%	0.762	S	S	*	*			cis	-162.6	141.8	-15.5	-63.5	0	0	0	0	106.3
123	S	55.4	Low	51	Low	102 Å²	102	131.6 Å²	131.6	71%	0.713	75%	0.752	S	S	*	*			trans	13.3	139.6	157.1	-45.6	0	0	0	0	123
124	K	53.7	Low	51.3	Low	195 Å²	195	128.9 Å²	128.9	85%	0.848	74%	0.739	S	S	*	*				150.4	120.4	124	-82.5	168.9	-176.8	-179.8	0	109.7
125	T	51.9	Low	51.3	Low	118 Å²	118	133.4 Å²	133.4	72%	0.724	74%	0.74	S	S	*	*				106.8	125.9	64.6	-68.9	0	0	0	0	110.5
126	V	58.3	Low	51	Low	128 Å²	128	139.7 Å²	139.7	78%	0.776	75%	0.748	S	S	*	*			trans	73.2	142.3	151.3	163.3	0	0	0	0	116.7
127	R	47.3	Very low	50.6	Low	201 Å²	201	138.8 Å²	138.8	76%	0.758	74%	0.741	S	S	*	*			cis	175.4	161.7	-4.8	-169.2	-162.3	-176.2	-148.1	2.1	106
128	L	49.5	Very low	50.6	Low	136 Å²	136	138.5 Å²	138.5	71%	0.712	74%	0.742	S	S	*	*			trans	89.6	114.2	154.9	-54.5	171.2	0	0	0	120.4
129	S	48.8	Very low	50.6	Low	110 Å²	110	141.2 Å²	141.2	77%	0.769	75%	0.745	S	S	*	*			trans	-72.2	-159.6	160.5	-35.1	0	0	0	0	112.5
130	P	54.4	Low	50.2	Low	111 Å²	111	142.1 Å²	142.1	72%	0.721	75%	0.751	S	S	*	*				-128.7	-178.2	-59.2	29.5	-9.8	0	0	0	111.3
131	K	51.2	Low	50	Low	157 Å²	157	140.4 Å²	140.4	68%	0.683	75%	0.749	S	S	*	*			trans	157.8	141.5	130.1	-90.9	166.1	162.9	-115.7	0	115.4
132	E	50	Low	49.8	Very low	137 Å²	137	143.2 Å²	143.2	64%	0.64	75%	0.753	S	S	*	*			trans	70.5	138.3	138.6	-63.7	155.7	-171.7	0	0	116
133	D	49.5	Very low	49.6	Very low	138 Å²	138	149 Å²	149	74%	0.738	76%	0.76	S	S	*	*			cis	-174	160.8	34.9	-113.6	-33.2	0	0	0	112.7
134	E	52.4	Low	48.8	Very low	127 Å²	127	155.1 Å²	155.1	59%	0.593	77%	0.768	S	S	*	*			trans	64	113.9	137.6	-67.1	-101	105.6	0	0	125.9
135	R	47.7	Very low	48.4	Very low	203 Å²	203	151.7 Å²	151.7	77%	0.766	77%	0.769	S	S	*	*				78.2	137	118.2	-77.8	-166.9	-156.5	-112.2	-16	125.1
136	R	43.1	Very low	47.8	Very low	238 Å²	238	150.7 Å²	150.7	90%	0.898	77%	0.773	S	S	*	*			trans	92.2	150.3	135.5	-132.7	166.2	-171.1	-167.6	2.7	117
137	S	44.9	Very low	47.2	Very low	95 Å²	95	151.1 Å²	151.1	66%	0.664	78%	0.776	S	S	*	*			cis	176.4	126.9	-38.9	179.7	0	0	0	0	105.7
138	S	51.4	Low	46.8	Very low	114 Å²	114	151.4 Å²	151.4	80%	0.797	78%	0.777	S	S	*	*			trans	-176	97.4	161	46.6	0	0	0	0	108.9
139	R	46.1	Very low	46.6	Very low	233 Å²	233	151.6 Å²	151.6	88%	0.879	78%	0.784	S	S	*	*				52.7	111.4	81.1	-76.9	-169.7	177.1	-175.1	0.2	116
140	S	48.7	Very low	46.1	Very low	118 Å²	118	153.4 Å²	153.4	83%	0.825	78%	0.78	S	S	*	*				157.1	110.5	128.1	55.2	0	0	0	0	109.9
141	A	44.8	Very low	45.5	Very low	90 Å²	90	155.3 Å²	155.3	74%	0.744	78%	0.784	S	S	*	*				100.4	105.7	73.2	0	0	0	0	0	113
142	T	45.6	Very low	44.8	Very low	126 Å²	126	155.2 Å²	155.2	77%	0.773	79%	0.791	S	S	*	*			trans	55.4	114.4	133.8	-36.8	0	0	0	0	120.1
143	R	46.2	Very low	44	Very low	251 Å²	251	151.3 Å²	151.3	95%	0.947	79%	0.788	S	S	*	*				-165.7	135.9	120.2	-109.4	170.8	163.3	-173.5	-6	114.2
144	R	39.6	Very low	43.8	Very low	231 Å²	231	150.3 Å²	150.3	87%	0.872	79%	0.792	S	S	*	*			trans	-72.8	152.1	178.4	-58.5	167.7	178.8	168	-2.1	110.2
145	S	44.8	Very low	43.4	Very low	124 Å²	124	152.7 Å²	152.7	87%	0.867	80%	0.803	S	S	*	*				-178.8	133.5	126.1	-89.1	0	0	0	0	111.4
146	A	40.2	Very low	42.7	Very low	97 Å²	97	146.4 Å²	146.4	80%	0.802	80%	0.802	S	S	*	*			trans	-80.7	144.7	-179.7	0	0	0	0	0	111.7
147	T	45.9	Very low	42.8	Very low	137 Å²	137	144.4 Å²	144.4	84%	0.84	80%	0.799	S	S	*	*			trans	-141	119.1	152.7	39.1	0	0	0	0	109.3
148	R	38.9	Very low	42.9	Very low	207 Å²	207	151.6 Å²	151.6	78%	0.781	81%	0.812	S	S	*	*			trans	-63.5	136.6	163.8	-78.7	160.5	81.3	165.7	2.3	108.3	E150	R148-E150 IonicContact CZ-OE1 2.74Å; R148-E150 IonicContact NE-OE1 2.75Å; R148-E150 IonicContact NH2-OE1 2.8Å; R148-E150 PolarHBondContact NH2-OE1 3.33Å
149	T	45.2	Very low	42.4	Very low	140 Å²	140	149.4 Å²	149.4	86%	0.859	81%	0.807	S	S	*	*			trans	-140.1	104.7	147.5	11.8	0	0	0	0	108.4
150	E	37	Very low	42.2	Very low	148 Å²	148	144.9 Å²	144.9	69%	0.692	80%	0.796	S	S	*	*			trans	-63.2	128.1	161.4	-66.9	154.5	172.8	0	0	107.9	R148	R148-E150 IonicContact CZ-OE1 2.74Å; R148-E150 IonicContact NE-OE1 2.75Å; R148-E150 IonicContact NH2-OE1 2.8Å; R148-E150 PolarHBondContact NH2-OE1 3.33Å
151	N	42.4	Very low	42.2	Very low	151 Å²	151	143.2 Å²	143.2	81%	0.807	78%	0.775	S	S	*	*			trans	-157.9	85.2	159.9	-157.4	51.9	0	0	0	105.3
152	D	36.3	Very low	42.5	Very low	154 Å²	154	147.3 Å²	147.3	82%	0.824	78%	0.776	S	S	*	*				67.3	137.2	77.7	-162.9	40.2	0	0	0	113.2
153	G	32.2	Very low	42.7	Very low	56 Å²	56	144.9 Å²	144.9	58%	0.577	76%	0.764	S	S	*	*			trans	-72.1	157.8	-144.9	0	0	0	0	0	117.5
154	S	47	Very low	43.3	Very low	117 Å²	117	133.2 Å²	133.2	82%	0.818	72%	0.722	S	S	*	*			trans	-161.1	80.4	142	-0.7	0	0	0	0	110.5
155	E	42.4	Very low	45.3	Very low	176 Å²	176	126.5 Å²	126.5	82%	0.822	70%	0.703	S	S	*	*			trans	44.5	86.8	134.2	-59.1	-170.4	120.4	0	0	118.8	K157	E155-K157 PolarHBondContact O-N 3.48Å
156	G	33.7	Very low	47.6	Very low	72 Å²	72	126 Å²	126	74%	0.742	69%	0.686	S	S	*	*			trans	-65.3	94.2	155.5	0	0	0	0	0	111.5	R158	G156-R158 PolarHBondContact O-N 3.32Å
157	K	45.6	Very low	50.3	Low	195 Å²	195	121.7 Å²	121.7	85%	0.848	65%	0.649	S	S	*	*			trans	-70.5	85	160.8	-85.3	-179.3	176.8	172.3	0	109.4	E155 G159	E155-K157 PolarHBondContact O-N 3.48Å; K157-G159 VanDerWaalsContact C-N 3.25Å; K157-G159 PolarHBondContact O-N 3.19Å
158	R	46.6	Very low	52.7	Low	246 Å²	246	115.9 Å²	115.9	93%	0.928	61%	0.611	S	S	*	*			trans	-65	81.5	168.9	-66.6	176.1	178	167	0.8	109.5	G156 H160	G156-R158 PolarHBondContact O-N 3.32Å; R158-H160 PolarHBondContact O-N 3.05Å
159	G	40.8	Very low	55.4	Low	68 Å²	68	107.7 Å²	107.7	70%	0.701	58%	0.582	S	S	*	*			trans	-76.4	96.4	177	0	0	0	0	0	112.6	K157	K157-G159 VanDerWaalsContact C-N 3.25Å; K157-G159 PolarHBondContact O-N 3.19Å
160	H	43.2	Very low	57.8	Low	138 Å²	138	102 Å²	102	64%	0.639	55%	0.546	S	S	*	.			trans	60.2	58	138.2	-144.1	93.4	0	0	0	120.2	R158 K162	R158-H160 PolarHBondContact O-N 3.05Å; H160-K162 VanDerWaalsContact CE1-CD 3.48Å; H160-K162 WeakPolarHBondContact CE1-CD 3.3Å; H160-K162 WeakPolarHBondContact CE1-CE 3.39Å; H160-K162 WeakPolarHBondContact NE2-CD 3.41Å; H160-K162 WeakPolarHBondContact NE2-CE 3.38Å; H160-K162 WeakPolarHBondContact NE2-CG 3.45Å; H160-K162 PolarHBondContact O-N 2.75Å
161	H	46.8	Very low	60.6	Low	84 Å²	84	95 Å²	95	39%	0.389	51%	0.513	S	S	.	.			trans	-83	88.8	153.9	-89	-61	0	0	0	109.7	E79 S163 N165 K210	E79-H161 IonicContact OE1-CE1 2.86Å; E79-H161 PolarHBondContact OE1-CE1 2.74Å; H161-S163 VanDerWaalsContact C-N 3.32Å; H161-N165 PolarHBondContact O-ND2 2.75Å; H161-K210 PolarHBondContact ND1-NZ 3.25Å
162	K	52	Low	63.1	Low	176 Å²	176	88.8 Å²	88.8	77%	0.765	48%	0.478	S	S	*	.			trans	-83	5.2	177.6	-98	-161.8	-173.1	171	0	115.2	H160	H160-K162 VanDerWaalsContact CE1-CD 3.48Å; H160-K162 WeakPolarHBondContact CE1-CD 3.3Å; H160-K162 WeakPolarHBondContact CE1-CE 3.39Å; H160-K162 WeakPolarHBondContact NE2-CD 3.41Å; H160-K162 WeakPolarHBondContact NE2-CE 3.38Å; H160-K162 WeakPolarHBondContact NE2-CG 3.45Å; H160-K162 PolarHBondContact O-N 2.75Å
163	S	50	Low	65.8	Low	75 Å²	75	83.7 Å²	83.7	52%	0.524	45%	0.451	S	S	.	.	S	Bend	trans	-142.2	123.7	174.1	-170.1	0	0	0	0	111.7	H161 K210	H161-S163 VanDerWaalsContact C-N 3.32Å; S163-K210 PolarHBondContact O-NZ 3.47Å
164	G	59.4	Low	68.7	Low	6 Å²	6	81.5 Å²	81.5	6%	0.062	43%	0.426	C	S	.	.			trans	83.6	49.9	168.6	0	0	0	0	0	116.4	E169	G164-E169 WeakPolarHBondContact CA-OE2 3.22Å
165	N	79.8	Confident	71	Confident	89 Å²	89	76.2 Å²	76.2	48%	0.476	39%	0.389	S	S	.	.			trans	-80.9	-18.2	176.8	-80	-18	0	0	0	113	H161 E169	H161-N165 PolarHBondContact O-ND2 2.75Å; N165-E169 PolarHBondContact N-OE2 2.79Å; N165-E169 VanDerWaalsContact N-OE2 3.16Å
166	K	93.7	Very high	73.3	Confident	115 Å²	115	73.5 Å²	73.5	50%	0.5	37%	0.374	S	S	.	.	S	Bend	trans	-94.9	147.9	178.4	-58.3	173.5	-173.1	167.3	0	110.2	W168 E169 F170	K166-W168 VanDerWaalsContact C-N 3.3Å; K166-W168 PolarHBondContact O-N 2.8Å; K166-E169 HydrophobicContact CB-CG 4.09Å; K166-E169 WeakPolarHBondContact CB-OE2 3.44Å; K166-E169 PolarHBondContact N-OE2 2.92Å; K166-E169 WeakPolarHBondContact O-CB 3.47Å; K166-E169 PolarHBondContact O-N 3.05Å; K166-F170 PolarHBondContact O-N 3.44Å
167	L	96.6	Very high	76	Confident	5 Å²	5	73.2 Å²	73.2	3%	0.026	36%	0.356	C	S	.	.	H	α-helix	trans	-59.3	-40	-178.6	172.6	61.6	0	0	0	112.4	E169 F170 I171 W207 L221 A224 M225 Y228	L167-E169 VanDerWaalsContact C-N 3.34Å; L167-E169 PolarHBondContact O-N 2.85Å; L167-F170 HydrophobicContact CD1-CD1 4.11Å; L167-F170 WeakPolarHBondContact O-CB 3.37Å; L167-F170 PolarHBondContact O-N 3.18Å; L167-I171 HydrophobicContact CD1-CD1 4.08Å; L167-I171 HydrophobicContact CD1-CG1 4.21Å; L167-I171 HydrophobicContact CG-CD1 3.96Å; L167-I171 VanDerWaalsContact O-CG1 3.3Å; L167-I171 WeakPolarHBondContact O-CG1 3.43Å; L167-I171 PolarHBondContact O-N 3.23Å; L167-W207 HydrophobicContact CB-CH2 4.2Å; L167-W207 HydrophobicContact CB-CZ2 3.91Å; L167-W207 HydrophobicContact CD1-CD2 3.79Å; L167-W207 HydrophobicContact CD1-CE3 4.28Å; L167-W207 HydrophobicContact CD1-CG 3.92Å; L167-W207 HydrophobicContact CD1-CZ2 4.43Å; L167-L221 HydrophobicContact CD1-CD1 4.01Å; L167-L221 HydrophobicContact CD1-CD2 4.13Å; L167-L221 HydrophobicContact CD1-CG 3.81Å; L167-L221 HydrophobicContact CD2-CD2 4.13Å; L167-L221 HydrophobicContact CD2-CG 4.03Å; L167-A224 HydrophobicContact CD2-CB 3.6Å; L167-M225 HydrophobicContact CD2-CG 3.69Å; L167-M225 HydrophobicContact CG-CG 4.42Å; L167-Y228 HydrophobicContact CB-CE2 4.21Å
168	W	96.3	Very high	78.1	Confident	15 Å²	15	68.8 Å²	68.8	6%	0.057	35%	0.347	C	S	.	.	H	α-helix	trans	-67.2	-35.1	-180	73.7	-93.7	0	0	0	112.6	K166 I171 R172 Y228 I233 I234 A250 V251	K166-W168 VanDerWaalsContact C-N 3.3Å; K166-W168 PolarHBondContact O-N 2.8Å; W168-I171 PolarHBondContact O-N 2.95Å; W168-R172 WeakPolarHBondContact O-CB 3.43Å; W168-R172 PolarHBondContact O-N 3.1Å; W168-Y228 HydrophobicContact CB-CD2 4.35Å; W168-Y228 HydrophobicContact CB-CE2 3.94Å; W168-Y228 AromaticContact CD1-CE1 3.91Å; W168-Y228 AromaticContact CD1-CZ 3.68Å; W168-I233 HydrophobicContact CB-CG2 3.73Å; W168-I233 HydrophobicContact CD2-CG2 3.66Å; W168-I233 HydrophobicContact CE3-CG2 4.17Å; W168-I233 HydrophobicContact CG-CG2 3.45Å; W168-I233 VanDerWaalsContact CG-CG2 3.45Å; W168-I234 HydrophobicContact CB-CD1 4Å; W168-I234 HydrophobicContact CB-CG1 4.29Å; W168-A250 HydrophobicContact CE3-CB 4.34Å; W168-A250 HydrophobicContact CZ3-CB 4.41Å; W168-V251 HydrophobicContact CH2-CG2 3.79Å; W168-V251 HydrophobicContact CZ3-CG2 4.42Å
169	E	95.7	Very high	80	Confident	35 Å²	35	63.3 Å²	63.3	16%	0.164	33%	0.332	C	S	.	.	H	α-helix	trans	-66	-45.6	174.6	-61.9	167.4	161.8	0	0	109.4	G164 N165 K166 L167 I171 R172 D173	G164-E169 WeakPolarHBondContact CA-OE2 3.22Å; N165-E169 PolarHBondContact N-OE2 2.79Å; N165-E169 VanDerWaalsContact N-OE2 3.16Å; K166-E169 HydrophobicContact CB-CG 4.09Å; K166-E169 WeakPolarHBondContact CB-OE2 3.44Å; K166-E169 PolarHBondContact N-OE2 2.92Å; K166-E169 WeakPolarHBondContact O-CB 3.47Å; K166-E169 PolarHBondContact O-N 3.05Å; L167-E169 VanDerWaalsContact C-N 3.34Å; L167-E169 PolarHBondContact O-N 2.85Å; E169-I171 VanDerWaalsContact C-N 3.35Å; E169-I171 PolarHBondContact O-N 2.97Å; E169-R172 WeakPolarHBondContact O-CB 3.24Å; E169-R172 PolarHBondContact O-N 2.92Å; E169-D173 WeakPolarHBondContact O-CB 3.38Å; E169-D173 PolarHBondContact O-N 3.26Å
170	F	95.4	Very high	82.1	Confident	22 Å²	22	60.9 Å²	60.9	10%	0.096	30%	0.303	C	S	.	.	H	α-helix	trans	-56.4	-46	174.2	166.8	-100.2	0	0	0	112.4	K166 L167 R172 D173 T174 M203 L206 W207	K166-F170 PolarHBondContact O-N 3.44Å; L167-F170 HydrophobicContact CD1-CD1 4.11Å; L167-F170 WeakPolarHBondContact O-CB 3.37Å; L167-F170 PolarHBondContact O-N 3.18Å; F170-R172 PolarHBondContact O-N 3.29Å; F170-D173 PolarHBondContact O-N 2.98Å; F170-T174 WeakPolarHBondContact O-CB 3.44Å; F170-T174 PolarHBondContact O-N 2.85Å; F170-T174 PolarHBondContact O-OG1 3.15Å; F170-M203 HydrophobicContact CD1-CE 4.01Å; F170-M203 HydrophobicContact CE1-CE 3.52Å; F170-M203 HydrophobicContact CE1-SD 3.97Å; F170-M203 HydrophobicContact CZ-CE 4.33Å; F170-M203 HydrophobicContact CZ-SD 4.38Å; F170-L206 HydrophobicContact CE2-CB 4.29Å; F170-L206 HydrophobicContact CZ-CB 3.68Å; F170-W207 HydrophobicContact CB-CE3 3.7Å; F170-W207 HydrophobicContact CB-CZ3 3.6Å; F170-W207 HydrophobicContact CD1-CB 4.14Å; F170-W207 HydrophobicContact CD1-CD2 4.23Å; F170-W207 AromaticContact CD1-CE3 3.63Å; F170-W207 HydrophobicContact CD1-CE3 3.63Å; F170-W207 HydrophobicContact CD1-CG 4.46Å; F170-W207 HydrophobicContact CD1-CZ3 4.4Å; F170-W207 HydrophobicContact CD2-CE3 4.02Å; F170-W207 HydrophobicContact CD2-CZ3 4.5Å; F170-W207 HydrophobicContact CE1-CB 3.7Å; F170-W207 HydrophobicContact CE1-CE3 4.28Å; F170-W207 HydrophobicContact CE1-CG 4.48Å; F170-W207 HydrophobicContact CG-CD2 4.49Å; F170-W207 AromaticContact CG-CE3 3.48Å; F170-W207 HydrophobicContact CG-CE3 3.48Å; F170-W207 VanDerWaalsContact CG-CE3 3.48Å; F170-W207 AromaticContact CG-CZ3 3.92Å; F170-W207 HydrophobicContact CG-CZ3 3.92Å; F170-W207 HydrophobicContact CZ-CB 4.14Å
171	I	96.6	Very high	84.2	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.9	-46.4	177.2	-66.8	162.6	0	0	0	110.9	L167 W168 E169 D173 T174 L175 F195 M203 M225 I234 F246	L167-I171 HydrophobicContact CD1-CD1 4.08Å; L167-I171 HydrophobicContact CD1-CG1 4.21Å; L167-I171 HydrophobicContact CG-CD1 3.96Å; L167-I171 VanDerWaalsContact O-CG1 3.3Å; L167-I171 WeakPolarHBondContact O-CG1 3.43Å; L167-I171 PolarHBondContact O-N 3.23Å; W168-I171 PolarHBondContact O-N 2.95Å; E169-I171 VanDerWaalsContact C-N 3.35Å; E169-I171 PolarHBondContact O-N 2.97Å; I171-D173 PolarHBondContact O-N 3.03Å; I171-T174 PolarHBondContact O-N 3.36Å; I171-L175 HydrophobicContact CG2-CD1 4.15Å; I171-L175 PolarHBondContact O-N 3.05Å; I171-F195 HydrophobicContact CG2-CD2 4.12Å; I171-F195 HydrophobicContact CG2-CE2 3.56Å; I171-F195 HydrophobicContact CG2-CZ 3.77Å; I171-M203 HydrophobicContact CB-CE 4.04Å; I171-M203 HydrophobicContact CG1-CE 3.53Å; I171-M203 HydrophobicContact CG2-CE 4.24Å; I171-M225 HydrophobicContact CD1-CG 4.03Å; I171-M225 HydrophobicContact CD1-SD 3.59Å; I171-M225 VanDerWaalsContact CD1-SD 3.59Å; I171-I234 HydrophobicContact CD1-CD1 3.96Å; I171-F246 HydrophobicContact CG2-CZ 4.1Å
172	R	95.1	Very high	86.3	Confident	20 Å²	20	55.9 Å²	55.9	8%	0.075	29%	0.291	C	S	.	.	H	α-helix	trans	-59	-46.5	177.4	176.2	-164.7	69.1	-177	1.2	111.5	W168 E169 F170 T174 L175 K176 F246 V251 D252 W253	W168-R172 WeakPolarHBondContact O-CB 3.43Å; W168-R172 PolarHBondContact O-N 3.1Å; E169-R172 WeakPolarHBondContact O-CB 3.24Å; E169-R172 PolarHBondContact O-N 2.92Å; F170-R172 PolarHBondContact O-N 3.29Å; R172-T174 VanDerWaalsContact C-N 3.31Å; R172-T174 PolarHBondContact O-N 2.96Å; R172-L175 WeakPolarHBondContact O-CB 3.5Å; R172-L175 PolarHBondContact O-N 3.35Å; R172-K176 PolarHBondContact O-N 3.36Å; R172-F246 HydrophobicContact CB-CE1 4.25Å; R172-F246 HydrophobicContact CB-CZ 3.76Å; R172-V251 VanDerWaalsContact CD-O 3.25Å; R172-V251 WeakPolarHBondContact CD-O 3.18Å; R172-V251 PolarHBondContact NH1-O 3.41Å; R172-D252 IonicContact CZ-OD2 3.89Å; R172-D252 IonicContact NH1-OD2 2.83Å; R172-D252 PolarHBondContact NH1-OD2 3.07Å; R172-W253 HydrophobicContact CG-CB 3.92Å
173	D	93.1	Very high	88.2	Confident	48 Å²	48	50 Å²	50	26%	0.257	27%	0.272	S	S	.	.	H	α-helix	trans	-68.9	-35	-177.4	-60.7	-11.8	0	0	0	110.6	E169 F170 I171 L175 K176 N177	E169-D173 WeakPolarHBondContact O-CB 3.38Å; E169-D173 PolarHBondContact O-N 3.26Å; F170-D173 PolarHBondContact O-N 2.98Å; I171-D173 PolarHBondContact O-N 3.03Å; D173-L175 VanDerWaalsContact C-N 3.31Å; D173-L175 PolarHBondContact O-N 2.63Å; D173-K176 PolarHBondContact O-N 3.37Å; D173-K176 VanDerWaalsContact O-N 3.13Å; D173-N177 PolarHBondContact O-N 3.4Å
174	T	93.7	Very high	90.4	Very high	9 Å²	9	47 Å²	47	6%	0.055	25%	0.25	C	S	.	.	H	α-helix	trans	-64.8	-33.7	172.7	-49.9	0	0	0	0	112	F170 I171 R172 K176 N177 T180 V185 M203	F170-T174 WeakPolarHBondContact O-CB 3.44Å; F170-T174 PolarHBondContact O-N 2.85Å; F170-T174 PolarHBondContact O-OG1 3.15Å; I171-T174 PolarHBondContact O-N 3.36Å; R172-T174 VanDerWaalsContact C-N 3.31Å; R172-T174 PolarHBondContact O-N 2.96Å; T174-K176 VanDerWaalsContact C-N 3.28Å; T174-K176 PolarHBondContact O-N 2.97Å; T174-N177 PolarHBondContact O-N 3.44Å; T174-T180 HydrophobicContact CG2-CG2 4Å; T174-T180 VanDerWaalsContact CG2-OG1 3.3Å; T174-T180 WeakPolarHBondContact CG2-OG1 3.45Å; T174-T180 PolarHBondContact O-OG1 3.29Å; T174-V185 HydrophobicContact CG2-CG1 3.52Å; T174-M203 HydrophobicContact CG2-CE 4.31Å; T174-M203 HydrophobicContact CG2-SD 4.12Å
175	L	94.8	Very high	92.1	Very high	6 Å²	6	46.8 Å²	46.8	3%	0.031	25%	0.247	C	C	.	.	H	α-helix	trans	-72.7	-17.6	174.2	-83.2	162.5	0	0	0	114.1	I171 R172 D173 V185 W187 F195 F246	I171-L175 HydrophobicContact CG2-CD1 4.15Å; I171-L175 PolarHBondContact O-N 3.05Å; R172-L175 WeakPolarHBondContact O-CB 3.5Å; R172-L175 PolarHBondContact O-N 3.35Å; D173-L175 VanDerWaalsContact C-N 3.31Å; D173-L175 PolarHBondContact O-N 2.63Å; L175-V185 HydrophobicContact CD1-CG2 4.32Å; L175-V185 HydrophobicContact CD2-CB 4.33Å; L175-V185 HydrophobicContact CD2-CG1 3.94Å; L175-V185 HydrophobicContact CD2-CG2 3.72Å; L175-V185 HydrophobicContact CG-CB 4.48Å; L175-V185 HydrophobicContact CG-CG1 3.85Å; L175-V185 HydrophobicContact CG-CG2 3.83Å; L175-W187 HydrophobicContact CB-CH2 4.5Å; L175-W187 HydrophobicContact CB-CZ2 3.72Å; L175-W187 HydrophobicContact CD1-CH2 3.85Å; L175-W187 HydrophobicContact CD1-CZ2 3.88Å; L175-W187 HydrophobicContact CD1-CZ3 4.16Å; L175-W187 HydrophobicContact CD2-CD2 3.99Å; L175-W187 HydrophobicContact CD2-CG 4.2Å; L175-W187 HydrophobicContact CD2-CZ2 4.32Å; L175-W187 HydrophobicContact CG-CZ2 4.2Å; L175-W187 PolarHBondContact O-NE1 2.67Å; L175-F195 HydrophobicContact CD1-CB 3.65Å; L175-F195 HydrophobicContact CD1-CD1 4.11Å; L175-F195 HydrophobicContact CD1-CD2 4.18Å; L175-F195 HydrophobicContact CD1-CG 3.74Å; L175-F195 HydrophobicContact CD2-CB 4.01Å; L175-F195 HydrophobicContact CG-CB 4.46Å; L175-F246 HydrophobicContact CD1-CE2 3.65Å; L175-F246 HydrophobicContact CD1-CZ 4.08Å
176	K	91.2	Very high	92.9	Very high	119 Å²	119	47.4 Å²	47.4	52%	0.517	24%	0.243	S	C	.	.	H	α-helix	trans	-91	-20.7	175.3	-68.1	178.7	179.3	-176.5	0	112.7	R172 D173 T174 D252	R172-K176 PolarHBondContact O-N 3.36Å; D173-K176 PolarHBondContact O-N 3.37Å; D173-K176 VanDerWaalsContact O-N 3.13Å; T174-K176 VanDerWaalsContact C-N 3.28Å; T174-K176 PolarHBondContact O-N 2.97Å; K176-D252 WeakPolarHBondContact CE-O 3.45Å; K176-D252 PolarHBondContact NZ-O 3.45Å
177	N	89.5	Confident	93.1	Very high	67 Å²	67	44.5 Å²	44.5	36%	0.358	23%	0.229	S	C	.	.			trans	-82.5	121.3	-178.8	-178.4	-5.4	0	0	0	110.6	D173 T174 E179 T180 C181	D173-N177 PolarHBondContact O-N 3.4Å; T174-N177 PolarHBondContact O-N 3.44Å; N177-E179 VanDerWaalsContact C-N 3.26Å; N177-E179 PolarHBondContact O-N 3.35Å; N177-E179 WeakPolarHBondContact OD1-CB 3.44Å; N177-E179 PolarHBondContact OD1-N 2.71Å; N177-T180 WeakPolarHBondContact CB-OG1 3.39Å; N177-T180 PolarHBondContact O-N 3.48Å; N177-T180 PolarHBondContact O-OG1 3Å; N177-C181 WeakPolarHBondContact O-CB 3.35Å; N177-C181 PolarHBondContact O-N 3.33Å
178	P	90	Very high	93.1	Very high	102 Å²	102	47.1 Å²	47.1	66%	0.662	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-24.6	179.9	26.6	-35.6	0	0	0	114.1	T180	P178-T180 VanDerWaalsContact C-N 3.34Å
179	E	86.3	Confident	93.1	Very high	130 Å²	130	48.9 Å²	48.9	61%	0.607	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-32.8	178.8	-65.2	-61.8	133	0	0	112.3	N177 S183	N177-E179 VanDerWaalsContact C-N 3.26Å; N177-E179 PolarHBondContact O-N 3.35Å; N177-E179 WeakPolarHBondContact OD1-CB 3.44Å; N177-E179 PolarHBondContact OD1-N 2.71Å; E179-S183 PolarHBondContact O-OG 2.88Å
180	T	85	Confident	93	Very high	17 Å²	17	53.2 Å²	53.2	10%	0.104	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-20.3	-176.8	51	0	0	0	0	113.2	T174 N177 P178 S183 I184 V185 L206	T174-T180 HydrophobicContact CG2-CG2 4Å; T174-T180 VanDerWaalsContact CG2-OG1 3.3Å; T174-T180 WeakPolarHBondContact CG2-OG1 3.45Å; T174-T180 PolarHBondContact O-OG1 3.29Å; N177-T180 WeakPolarHBondContact CB-OG1 3.39Å; N177-T180 PolarHBondContact O-N 3.48Å; N177-T180 PolarHBondContact O-OG1 3Å; P178-T180 VanDerWaalsContact C-N 3.34Å; T180-S183 PolarHBondContact O-N 2.99Å; T180-S183 PolarHBondContact O-OG 3.46Å; T180-I184 HydrophobicContact CG2-CD1 4.15Å; T180-I184 PolarHBondContact O-N 2.87Å; T180-V185 PolarHBondContact O-N 3.28Å; T180-L206 HydrophobicContact CG2-CD1 4.16Å
181	C	87.4	Confident	93	Very high	31 Å²	31	60.1 Å²	60.1	21%	0.209	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	113.5	175.5	178.7	0	0	0	0	110.2	N177 V185	N177-C181 WeakPolarHBondContact O-CB 3.35Å; N177-C181 PolarHBondContact O-N 3.33Å; C181-V185 VanDerWaalsContact CA-O 3.22Å; C181-V185 WeakPolarHBondContact CA-O 3.36Å; C181-V185 WeakPolarHBondContact CB-O 3.3Å
182	P	91	Very high	93	Very high	87 Å²	87	64.4 Å²	64.4	57%	0.565	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	cis	-107	4.3	25.1	38.5	-36	0	0	0	115.7	R186	P182-R186 HydrophobicContact CB-CB 3.8Å
183	S	92.4	Very high	93.1	Very high	53 Å²	53	63.5 Å²	63.5	37%	0.371	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-45.6	-168.5	56.6	0	0	0	0	113.6	E179 T180 V198	E179-S183 PolarHBondContact O-OG 2.88Å; T180-S183 PolarHBondContact O-N 2.99Å; T180-S183 PolarHBondContact O-OG 3.46Å; S183-V198 WeakPolarHBondContact O-CB 3.09Å; S183-V198 WeakPolarHBondContact O-CG1 3.28Å
184	I	94.3	Very high	93.3	Very high	12 Å²	12	62 Å²	62	6%	0.062	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-42.6	-175.4	-62	176.4	0	0	0	111.1	T180 V198 E199 K202 M203 L206	T180-I184 HydrophobicContact CG2-CD1 4.15Å; T180-I184 PolarHBondContact O-N 2.87Å; I184-V198 PolarHBondContact O-N 2.85Å; I184-E199 PolarHBondContact O-N 3.19Å; I184-K202 HydrophobicContact CD1-CB 4.12Å; I184-K202 HydrophobicContact CD1-CD 4.5Å; I184-K202 HydrophobicContact CG1-CB 4.16Å; I184-K202 HydrophobicContact CG1-CD 4.33Å; I184-K202 HydrophobicContact CG2-CB 4.38Å; I184-M203 HydrophobicContact CG2-CB 3.8Å; I184-M203 HydrophobicContact CG2-CG 4.43Å; I184-M203 HydrophobicContact CG2-SD 3.8Å; I184-L206 HydrophobicContact CD1-CD1 3.47Å; I184-L206 VanDerWaalsContact CD1-CD1 3.47Å; I184-L206 HydrophobicContact CD1-CG 4.45Å; I184-L206 HydrophobicContact CG2-CD1 4.48Å
185	V	96.6	Very high	93.5	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	141.2	178.8	68.9	0	0	0	0	108.5	T174 L175 T180 C181 F195 R196 I197	T174-V185 HydrophobicContact CG2-CG1 3.52Å; L175-V185 HydrophobicContact CD1-CG2 4.32Å; L175-V185 HydrophobicContact CD2-CB 4.33Å; L175-V185 HydrophobicContact CD2-CG1 3.94Å; L175-V185 HydrophobicContact CD2-CG2 3.72Å; L175-V185 HydrophobicContact CG-CB 4.48Å; L175-V185 HydrophobicContact CG-CG1 3.85Å; L175-V185 HydrophobicContact CG-CG2 3.83Å; T180-V185 PolarHBondContact O-N 3.28Å; C181-V185 VanDerWaalsContact CA-O 3.22Å; C181-V185 WeakPolarHBondContact CA-O 3.36Å; C181-V185 WeakPolarHBondContact CB-O 3.3Å; V185-F195 HydrophobicContact CG2-CD2 4.09Å; V185-R196 CarbonylContact C-O 3.52Å; V185-R196 WeakPolarHBondContact CA-O 3.47Å; V185-R196 WeakPolarHBondContact CG2-O 3.38Å; V185-I197 HydrophobicContact CG2-CG1 4.36Å
186	R	96.7	Very high	93.7	Very high	103 Å²	103	64.1 Å²	64.1	39%	0.389	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	156.9	-179.2	72.4	-179.4	-169.2	-176.2	4.8	112.1	P182 E188 F195 R196 V198	P182-R186 HydrophobicContact CB-CB 3.8Å; R186-E188 IonicContact CZ-OE1 3.94Å; R186-E188 IonicContact NE-OE1 2.67Å; R186-E188 PolarHBondContact NE-OE1 2.78Å; R186-E188 IonicContact NH2-OE1 2.71Å; R186-E188 PolarHBondContact NH2-OE1 3.3Å; R186-F195 CarbonylContact O-C 3.58Å; R186-F195 VanDerWaalsContact O-CA 3.25Å; R186-F195 WeakPolarHBondContact O-CA 3.48Å; R186-F195 WeakPolarHBondContact O-CB 3.2Å; R186-R196 HydrophobicContact CG-CB 4.17Å; R186-R196 PolarHBondContact N-O 2.83Å; R186-R196 PolarHBondContact O-N 3.16Å; R186-V198 HydrophobicContact CB-CG2 4.36Å; R186-V198 HydrophobicContact CG-CG2 3.8Å
187	W	97.4	Very high	94	Very high	53 Å²	53	58.4 Å²	58.4	20%	0.201	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	133.6	166.3	-64.2	105.7	0	0	0	110.2	L175 R190 F195 F246 W253	L175-W187 HydrophobicContact CB-CH2 4.5Å; L175-W187 HydrophobicContact CB-CZ2 3.72Å; L175-W187 HydrophobicContact CD1-CH2 3.85Å; L175-W187 HydrophobicContact CD1-CZ2 3.88Å; L175-W187 HydrophobicContact CD1-CZ3 4.16Å; L175-W187 HydrophobicContact CD2-CD2 3.99Å; L175-W187 HydrophobicContact CD2-CG 4.2Å; L175-W187 HydrophobicContact CD2-CZ2 4.32Å; L175-W187 HydrophobicContact CG-CZ2 4.2Å; L175-W187 PolarHBondContact O-NE1 2.67Å; W187-R190 HydrophobicContact CB-CB 4.26Å; W187-R190 HydrophobicContact CD2-CB 4.27Å; W187-R190 HydrophobicContact CD2-CG 4.1Å; W187-R190 HydrophobicContact CG-CB 4.15Å; W187-R190 HydrophobicContact CG-CG 4.23Å; W187-F195 HydrophobicContact CE3-CB 4.16Å; W187-F195 HydrophobicContact CZ3-CB 4.32Å; W187-F246 AromaticContact CH2-CD2 3.84Å; W187-F246 HydrophobicContact CH2-CD2 3.84Å; W187-F246 AromaticContact CH2-CE2 3.65Å; W187-F246 HydrophobicContact CH2-CE2 3.65Å; W187-F246 HydrophobicContact CZ3-CD2 4.01Å; W187-F246 HydrophobicContact CZ3-CE2 4.08Å; W187-W253 HydrophobicContact CH2-CB 4.33Å; W187-W253 HydrophobicContact CH2-CE3 4.23Å; W187-W253 HydrophobicContact CZ3-CE3 4.45Å
188	E	96.9	Very high	94.4	Very high	60 Å²	60	58.2 Å²	58.2	28%	0.28	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-38.5	166	-72.8	-83.3	151.3	0	0	109.8	R186 I194 R196 R240	R186-E188 IonicContact CZ-OE1 3.94Å; R186-E188 IonicContact NE-OE1 2.67Å; R186-E188 PolarHBondContact NE-OE1 2.78Å; R186-E188 IonicContact NH2-OE1 2.71Å; R186-E188 PolarHBondContact NH2-OE1 3.3Å; E188-I194 HydrophobicContact CB-CB 4.39Å; E188-I194 HydrophobicContact CB-CG2 3.9Å; E188-I194 PolarHBondContact N-O 3.4Å; E188-R196 HydrophobicContact CG-CB 3.67Å; E188-R196 WeakPolarHBondContact OE1-CD 3.43Å; E188-R196 IonicContact OE1-CZ 3.72Å; E188-R196 IonicContact OE1-NE 2.77Å; E188-R196 PolarHBondContact OE1-NE 3.49Å; E188-R196 IonicContact OE1-NH2 3.79Å; E188-R240 IonicContact OE2-CZ 3.77Å; E188-R240 IonicContact OE2-NH2 2.7Å; E188-R240 PolarHBondContact OE2-NH2 3.08Å
189	N	96	Very high	94.7	Very high	52 Å²	52	56.7 Å²	56.7	28%	0.278	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	109.3	167.1	-177.4	-23	0	0	0	108.1	E191 E192 G193 I194	N189-E191 PolarHBondContact OD1-N 3.13Å; N189-E192 HydrophobicContact CB-CB 4.21Å; N189-E192 PolarHBondContact ND2-OE1 3.21Å; N189-E192 PolarHBondContact OD1-N 3.23Å; N189-E192 VanDerWaalsContact OD1-N 3.15Å; N189-G193 PolarHBondContact O-N 3.33Å; N189-G193 VanDerWaalsContact O-N 3.07Å; N189-I194 HydrophobicContact CB-CB 4.19Å; N189-I194 HydrophobicContact CB-CD1 4.34Å; N189-I194 HydrophobicContact CB-CG1 4.48Å; N189-I194 PolarHBondContact N-O 2.92Å; N189-I194 PolarHBondContact O-N 2.88Å
190	R	94.7	Very high	95.2	Very high	126 Å²	126	52 Å²	52	48%	0.475	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-33.5	-175.8	-171	173.7	176.4	-119.2	1.8	112.6	W187 G193 P255	W187-R190 HydrophobicContact CB-CB 4.26Å; W187-R190 HydrophobicContact CD2-CB 4.27Å; W187-R190 HydrophobicContact CD2-CG 4.1Å; W187-R190 HydrophobicContact CG-CB 4.15Å; W187-R190 HydrophobicContact CG-CG 4.23Å; R190-G193 PolarHBondContact O-N 3.46Å; R190-P255 HydrophobicContact CG-CG 4.04Å
191	E	94.7	Very high	95.8	Very high	167 Å²	167	55.8 Å²	55.8	78%	0.78	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-41.8	179.7	-59.8	-179	171.5	0	0	111.1	N189 G193	N189-E191 PolarHBondContact OD1-N 3.13Å; E191-G193 VanDerWaalsContact C-N 3.34Å
192	E	95.7	Very high	96.1	Very high	91 Å²	91	57.3 Å²	57.3	43%	0.425	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-9.7	176.5	-75.6	-162	-138.1	0	0	114.4	N189 I194 K245	N189-E192 HydrophobicContact CB-CB 4.21Å; N189-E192 PolarHBondContact ND2-OE1 3.21Å; N189-E192 PolarHBondContact OD1-N 3.23Å; N189-E192 VanDerWaalsContact OD1-N 3.15Å; E192-I194 VanDerWaalsContact C-N 3.33Å; E192-I194 HydrophobicContact CB-CD1 4.01Å; E192-I194 HydrophobicContact CB-CG1 3.87Å; E192-I194 WeakPolarHBondContact OE2-CD1 3.3Å; E192-K245 WeakPolarHBondContact O-CE 3.17Å; E192-K245 IonicContact OE2-NZ 2.95Å; E192-K245 PolarHBondContact OE2-NZ 3.03Å
193	G	96.8	Very high	96.3	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	24.4	-176.3	0	0	0	0	0	114.2	N189 R190 E191 K245 F246 W253	N189-G193 PolarHBondContact O-N 3.33Å; N189-G193 VanDerWaalsContact O-N 3.07Å; R190-G193 PolarHBondContact O-N 3.46Å; E191-G193 VanDerWaalsContact C-N 3.34Å; G193-K245 CarbonylContact O-C 3.59Å; G193-K245 WeakPolarHBondContact O-CA 3.46Å; G193-F246 PolarHBondContact O-N 3.27Å; G193-W253 VanDerWaalsContact CA-CH2 3.46Å
194	I	98	Very high	96.5	Very high	18 Å²	18	50.7 Å²	50.7	9%	0.092	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	124.8	177.2	-55.4	176.4	0	0	0	108.8	E188 N189 E192 V237 V243 Y244 K245	E188-I194 HydrophobicContact CB-CB 4.39Å; E188-I194 HydrophobicContact CB-CG2 3.9Å; E188-I194 PolarHBondContact N-O 3.4Å; N189-I194 HydrophobicContact CB-CB 4.19Å; N189-I194 HydrophobicContact CB-CD1 4.34Å; N189-I194 HydrophobicContact CB-CG1 4.48Å; N189-I194 PolarHBondContact N-O 2.92Å; N189-I194 PolarHBondContact O-N 2.88Å; E192-I194 VanDerWaalsContact C-N 3.33Å; E192-I194 HydrophobicContact CB-CD1 4.01Å; E192-I194 HydrophobicContact CB-CG1 3.87Å; E192-I194 WeakPolarHBondContact OE2-CD1 3.3Å; I194-V237 HydrophobicContact CG2-CG2 4.39Å; I194-V243 HydrophobicContact CG2-CG1 3.47Å; I194-V243 VanDerWaalsContact CG2-CG1 3.47Å; I194-Y244 WeakPolarHBondContact CA-O 3.45Å; I194-K245 HydrophobicContact CG1-CB 4.25Å; I194-K245 HydrophobicContact CG1-CD 3.97Å; I194-K245 HydrophobicContact CG1-CG 4.1Å
195	F	98.2	Very high	96.4	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	154.2	179	64	-89.1	0	0	0	111.6	I171 L175 V185 R186 W187 I234 V243 Y244 F246	I171-F195 HydrophobicContact CG2-CD2 4.12Å; I171-F195 HydrophobicContact CG2-CE2 3.56Å; I171-F195 HydrophobicContact CG2-CZ 3.77Å; L175-F195 HydrophobicContact CD1-CB 3.65Å; L175-F195 HydrophobicContact CD1-CD1 4.11Å; L175-F195 HydrophobicContact CD1-CD2 4.18Å; L175-F195 HydrophobicContact CD1-CG 3.74Å; L175-F195 HydrophobicContact CD2-CB 4.01Å; L175-F195 HydrophobicContact CG-CB 4.46Å; V185-F195 HydrophobicContact CG2-CD2 4.09Å; R186-F195 CarbonylContact O-C 3.58Å; R186-F195 VanDerWaalsContact O-CA 3.25Å; R186-F195 WeakPolarHBondContact O-CA 3.48Å; R186-F195 WeakPolarHBondContact O-CB 3.2Å; W187-F195 HydrophobicContact CE3-CB 4.16Å; W187-F195 HydrophobicContact CZ3-CB 4.32Å; F195-I234 HydrophobicContact CZ-CD1 4.5Å; F195-I234 HydrophobicContact CZ-CG2 4.49Å; F195-V243 WeakPolarHBondContact O-CA 3.46Å; F195-Y244 HydrophobicContact CE2-CD2 4.07Å; F195-Y244 HydrophobicContact CE2-CG 4.22Å; F195-Y244 VanDerWaalsContact CZ-CB 3.4Å; F195-Y244 HydrophobicContact CZ-CG 4.26Å; F195-Y244 PolarHBondContact N-O 3.16Å; F195-Y244 PolarHBondContact O-N 3.1Å; F195-F246 AromaticContact CD1-CD2 3.83Å; F195-F246 HydrophobicContact CD1-CD2 3.83Å; F195-F246 AromaticContact CD1-CE2 3.72Å; F195-F246 HydrophobicContact CD1-CE2 3.72Å; F195-F246 HydrophobicContact CD1-CG 4.48Å; F195-F246 HydrophobicContact CD1-CZ 4.29Å; F195-F246 HydrophobicContact CE1-CD1 4.25Å; F195-F246 AromaticContact CE1-CD2 3.86Å; F195-F246 HydrophobicContact CE1-CD2 3.86Å; F195-F246 HydrophobicContact CE1-CE1 4.17Å; F195-F246 AromaticContact CE1-CE2 3.76Å; F195-F246 HydrophobicContact CE1-CE2 3.76Å; F195-F246 HydrophobicContact CE1-CG 4.1Å; F195-F246 AromaticContact CE1-CZ 3.92Å; F195-F246 HydrophobicContact CE1-CZ 3.92Å; F195-F246 HydrophobicContact CZ-CZ 4.45Å
196	R	98.3	Very high	96.2	Very high	58 Å²	58	53.3 Å²	53.3	22%	0.219	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	134.6	174.5	174	180	-61.8	-78.4	1.7	109.8	V185 R186 E188 V198 R241 L242 V243	V185-R196 CarbonylContact C-O 3.52Å; V185-R196 WeakPolarHBondContact CA-O 3.47Å; V185-R196 WeakPolarHBondContact CG2-O 3.38Å; R186-R196 HydrophobicContact CG-CB 4.17Å; R186-R196 PolarHBondContact N-O 2.83Å; R186-R196 PolarHBondContact O-N 3.16Å; E188-R196 HydrophobicContact CG-CB 3.67Å; E188-R196 WeakPolarHBondContact OE1-CD 3.43Å; E188-R196 IonicContact OE1-CZ 3.72Å; E188-R196 IonicContact OE1-NE 2.77Å; E188-R196 PolarHBondContact OE1-NE 3.49Å; E188-R196 IonicContact OE1-NH2 3.79Å; R196-V198 HydrophobicContact CG-CG2 4.33Å; R196-R241 PolarHBondContact NH1-O 2.89Å; R196-L242 WeakPolarHBondContact CA-O 3.44Å; R196-V243 HydrophobicContact CB-CG2 4.32Å; R196-V243 HydrophobicContact CG-CG2 4.45Å
197	I	98.2	Very high	96.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	114.6	163.3	-59.7	175.6	0	0	0	107.2	V185 M203 Y218 M225 L242 Y244	V185-I197 HydrophobicContact CG2-CG1 4.36Å; I197-M203 HydrophobicContact CG2-CB 4Å; I197-M203 HydrophobicContact CG2-CG 4.27Å; I197-Y218 HydrophobicContact CD1-CE2 3.74Å; I197-Y218 HydrophobicContact CG2-CE2 4.33Å; I197-M225 HydrophobicContact CD1-CE 3.78Å; I197-M225 HydrophobicContact CD1-SD 4.09Å; I197-L242 HydrophobicContact CB-CB 4.44Å; I197-L242 PolarHBondContact N-O 2.86Å; I197-L242 WeakPolarHBondContact O-CB 3.32Å; I197-L242 WeakPolarHBondContact O-CD1 3.48Å; I197-Y244 HydrophobicContact CD1-CD2 4.24Å; I197-Y244 HydrophobicContact CD1-CE2 3.95Å
198	V	97.6	Very high	96	Very high	62 Å²	62	46.9 Å²	46.9	38%	0.376	22%	0.22	S	C	.	.	S	Bend	trans	-85.9	-53.2	-176.6	-179.6	0	0	0	0	109.4	S183 I184 R186 R196	S183-V198 WeakPolarHBondContact O-CB 3.09Å; S183-V198 WeakPolarHBondContact O-CG1 3.28Å; I184-V198 PolarHBondContact O-N 2.85Å; R186-V198 HydrophobicContact CB-CG2 4.36Å; R186-V198 HydrophobicContact CG-CG2 3.8Å; R196-V198 HydrophobicContact CG-CG2 4.33Å
199	E	96.3	Very high	95.5	Very high	71 Å²	71	45.1 Å²	45.1	33%	0.332	21%	0.212	S	C	.	.	S	Bend	trans	-110.4	86.9	177.1	-68.6	-159.3	-112.5	0	0	110.8	I184 E201 K202 M203	I184-E199 PolarHBondContact O-N 3.19Å; E199-E201 PolarHBondContact O-N 2.79Å; E199-K202 HydrophobicContact CB-CB 3.96Å; E199-K202 HydrophobicContact CB-CD 4.09Å; E199-K202 HydrophobicContact CB-CG 4.1Å; E199-K202 VanDerWaalsContact CD-CD 3.46Å; E199-K202 HydrophobicContact CG-CD 4.41Å; E199-K202 PolarHBondContact O-N 3.22Å; E199-K202 IonicContact OE1-NZ 2.68Å; E199-K202 PolarHBondContact OE1-NZ 2.94Å; E199-K202 WeakPolarHBondContact OE2-CD 3.49Å; E199-K202 WeakPolarHBondContact OE2-CE 3.17Å; E199-K202 IonicContact OE2-NZ 3.42Å; E199-K202 PolarHBondContact OE2-NZ 2.95Å; E199-M203 PolarHBondContact O-N 3.46Å
200	S	97.3	Very high	95.2	Very high	30 Å²	30	45.7 Å²	45.7	21%	0.21	21%	0.212	C	C	.	.	H	α-helix	trans	-58.4	-41.3	-174.1	62.1	0	0	0	0	114.2	M203 A204	S200-M203 PolarHBondContact O-N 3.38Å; S200-A204 PolarHBondContact O-N 3.14Å; S200-A204 VanDerWaalsContact O-N 3.08Å
201	E	96.5	Very high	94.9	Very high	97 Å²	97	44.5 Å²	44.5	45%	0.453	21%	0.21	S	C	.	.	H	α-helix	trans	-68	-43.9	177	-68.1	-54.7	131.1	0	0	112.1	E199 M203 A204 Q205	E199-E201 PolarHBondContact O-N 2.79Å; E201-M203 VanDerWaalsContact C-N 3.33Å; E201-M203 PolarHBondContact O-N 3.16Å; E201-A204 WeakPolarHBondContact O-CB 3.43Å; E201-A204 PolarHBondContact O-N 2.95Å; E201-Q205 VanDerWaalsContact O-CG 3.27Å; E201-Q205 WeakPolarHBondContact O-CG 3.21Å; E201-Q205 PolarHBondContact O-N 3.5Å
202	K	93.9	Very high	94.6	Very high	64 Å²	64	43.9 Å²	43.9	28%	0.278	21%	0.212	S	C	.	.	H	α-helix	trans	-62.2	-41.3	175.8	-67.8	-171.5	-178	159.4	0	111.7	L71 I184 E199 A204 Q205 L206	L71-K202 HydrophobicContact CD1-CB 4.22Å; L71-K202 HydrophobicContact CD1-CD 4.5Å; L71-K202 HydrophobicContact CD1-CG 3.92Å; L71-K202 HydrophobicContact CD2-CD 3.63Å; L71-K202 HydrophobicContact CD2-CG 3.91Å; I184-K202 HydrophobicContact CD1-CB 4.12Å; I184-K202 HydrophobicContact CD1-CD 4.5Å; I184-K202 HydrophobicContact CG1-CB 4.16Å; I184-K202 HydrophobicContact CG1-CD 4.33Å; I184-K202 HydrophobicContact CG2-CB 4.38Å; E199-K202 HydrophobicContact CB-CB 3.96Å; E199-K202 HydrophobicContact CB-CD 4.09Å; E199-K202 HydrophobicContact CB-CG 4.1Å; E199-K202 VanDerWaalsContact CD-CD 3.46Å; E199-K202 HydrophobicContact CG-CD 4.41Å; E199-K202 PolarHBondContact O-N 3.22Å; E199-K202 IonicContact OE1-NZ 2.68Å; E199-K202 PolarHBondContact OE1-NZ 2.94Å; E199-K202 WeakPolarHBondContact OE2-CD 3.49Å; E199-K202 WeakPolarHBondContact OE2-CE 3.17Å; E199-K202 IonicContact OE2-NZ 3.42Å; E199-K202 PolarHBondContact OE2-NZ 2.95Å; K202-A204 VanDerWaalsContact C-N 3.31Å; K202-A204 PolarHBondContact O-N 3.25Å; K202-Q205 PolarHBondContact O-N 2.91Å; K202-L206 WeakPolarHBondContact O-CG 3.12Å; K202-L206 PolarHBondContact O-N 3.34Å
203	M	95.9	Very high	94.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59	-43.5	175.4	-170	65.7	176	0	0	111.7	F170 I171 T174 I184 I197 E199 S200 E201 L206 W207 L221	F170-M203 HydrophobicContact CD1-CE 4.01Å; F170-M203 HydrophobicContact CE1-CE 3.52Å; F170-M203 HydrophobicContact CE1-SD 3.97Å; F170-M203 HydrophobicContact CZ-CE 4.33Å; F170-M203 HydrophobicContact CZ-SD 4.38Å; I171-M203 HydrophobicContact CB-CE 4.04Å; I171-M203 HydrophobicContact CG1-CE 3.53Å; I171-M203 HydrophobicContact CG2-CE 4.24Å; T174-M203 HydrophobicContact CG2-CE 4.31Å; T174-M203 HydrophobicContact CG2-SD 4.12Å; I184-M203 HydrophobicContact CG2-CB 3.8Å; I184-M203 HydrophobicContact CG2-CG 4.43Å; I184-M203 HydrophobicContact CG2-SD 3.8Å; I197-M203 HydrophobicContact CG2-CB 4Å; I197-M203 HydrophobicContact CG2-CG 4.27Å; E199-M203 PolarHBondContact O-N 3.46Å; S200-M203 PolarHBondContact O-N 3.38Å; E201-M203 VanDerWaalsContact C-N 3.33Å; E201-M203 PolarHBondContact O-N 3.16Å; M203-L206 PolarHBondContact O-N 3.3Å; M203-W207 PolarHBondContact O-N 3.01Å; M203-L221 HydrophobicContact CG-CD1 4.42Å
204	A	96.7	Very high	93.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.6	-39.9	176.3	0	0	0	0	0	112.5	S200 E201 K202 W207 G208 M216 Y218 L221	S200-A204 PolarHBondContact O-N 3.14Å; S200-A204 VanDerWaalsContact O-N 3.08Å; E201-A204 WeakPolarHBondContact O-CB 3.43Å; E201-A204 PolarHBondContact O-N 2.95Å; K202-A204 VanDerWaalsContact C-N 3.31Å; K202-A204 PolarHBondContact O-N 3.25Å; A204-W207 PolarHBondContact O-N 2.87Å; A204-G208 PolarHBondContact O-N 3.45Å; A204-M216 HydrophobicContact CB-CG 4.37Å; A204-M216 WeakPolarHBondContact O-CG 3.3Å; A204-Y218 VanDerWaalsContact CB-N 3.3Å; A204-L221 HydrophobicContact CB-CD1 4.31Å
205	Q	92.9	Very high	93.5	Very high	45 Å²	45	54.9 Å²	54.9	21%	0.21	27%	0.266	C	S	.	.	H	α-helix	trans	-64.9	-43.4	176.5	-70.3	173.9	39.5	0	0	111.7	F68 L71 E201 K202 G208 L209	F68-Q205 HydrophobicContact CD1-CB 4.16Å; F68-Q205 HydrophobicContact CD1-CG 4.43Å; F68-Q205 HydrophobicContact CE1-CB 3.96Å; F68-Q205 HydrophobicContact CE1-CG 3.9Å; L71-Q205 HydrophobicContact CD1-CB 4.08Å; E201-Q205 VanDerWaalsContact O-CG 3.27Å; E201-Q205 WeakPolarHBondContact O-CG 3.21Å; E201-Q205 PolarHBondContact O-N 3.5Å; K202-Q205 PolarHBondContact O-N 2.91Å; Q205-G208 CarbonylContact O-C 3.39Å; Q205-G208 PolarHBondContact O-N 2.88Å; Q205-L209 WeakPolarHBondContact O-CB 3.46Å; Q205-L209 PolarHBondContact O-N 3.49Å
206	L	92.6	Very high	93.3	Very high	22 Å²	22	56.3 Å²	56.3	12%	0.115	27%	0.273	C	S	.	.	H	α-helix	trans	-63.1	-41.9	175.3	-72.5	178.9	0	0	0	112.3	F170 T180 I184 K202 M203 L209 K210	F170-L206 HydrophobicContact CE2-CB 4.29Å; F170-L206 HydrophobicContact CZ-CB 3.68Å; T180-L206 HydrophobicContact CG2-CD1 4.16Å; I184-L206 HydrophobicContact CD1-CD1 3.47Å; I184-L206 VanDerWaalsContact CD1-CD1 3.47Å; I184-L206 HydrophobicContact CD1-CG 4.45Å; I184-L206 HydrophobicContact CG2-CD1 4.48Å; K202-L206 WeakPolarHBondContact O-CG 3.12Å; K202-L206 PolarHBondContact O-N 3.34Å; M203-L206 PolarHBondContact O-N 3.3Å; L206-L209 WeakPolarHBondContact O-CB 3.39Å; L206-L209 PolarHBondContact O-N 2.92Å; L206-K210 PolarHBondContact O-N 2.84Å
207	W	94.7	Very high	93.3	Very high	21 Å²	21	55.7 Å²	55.7	8%	0.08	28%	0.276	C	S	.	.	H	α-helix	trans	-65.1	-41.3	173.9	177.6	-123.9	0	0	0	111.9	L167 F170 M203 A204 L209 K210 K211 L221	L167-W207 HydrophobicContact CB-CH2 4.2Å; L167-W207 HydrophobicContact CB-CZ2 3.91Å; L167-W207 HydrophobicContact CD1-CD2 3.79Å; L167-W207 HydrophobicContact CD1-CE3 4.28Å; L167-W207 HydrophobicContact CD1-CG 3.92Å; L167-W207 HydrophobicContact CD1-CZ2 4.43Å; F170-W207 HydrophobicContact CB-CE3 3.7Å; F170-W207 HydrophobicContact CB-CZ3 3.6Å; F170-W207 HydrophobicContact CD1-CB 4.14Å; F170-W207 HydrophobicContact CD1-CD2 4.23Å; F170-W207 AromaticContact CD1-CE3 3.63Å; F170-W207 HydrophobicContact CD1-CE3 3.63Å; F170-W207 HydrophobicContact CD1-CG 4.46Å; F170-W207 HydrophobicContact CD1-CZ3 4.4Å; F170-W207 HydrophobicContact CD2-CE3 4.02Å; F170-W207 HydrophobicContact CD2-CZ3 4.5Å; F170-W207 HydrophobicContact CE1-CB 3.7Å; F170-W207 HydrophobicContact CE1-CE3 4.28Å; F170-W207 HydrophobicContact CE1-CG 4.48Å; F170-W207 HydrophobicContact CG-CD2 4.49Å; F170-W207 AromaticContact CG-CE3 3.48Å; F170-W207 HydrophobicContact CG-CE3 3.48Å; F170-W207 VanDerWaalsContact CG-CE3 3.48Å; F170-W207 AromaticContact CG-CZ3 3.92Å; F170-W207 HydrophobicContact CG-CZ3 3.92Å; F170-W207 HydrophobicContact CZ-CB 4.14Å; M203-W207 PolarHBondContact O-N 3.01Å; A204-W207 PolarHBondContact O-N 2.87Å; W207-L209 VanDerWaalsContact C-N 3.3Å; W207-L209 PolarHBondContact O-N 3.42Å; W207-K210 HydrophobicContact CE3-CB 4.24Å; W207-K210 HydrophobicContact CE3-CG 4.32Å; W207-K210 HydrophobicContact CZ3-CG 4.18Å; W207-K210 PolarHBondContact O-N 3.38Å; W207-K211 HydrophobicContact CD2-CG 3.99Å; W207-K211 HydrophobicContact CE3-CG 4.15Å; W207-K211 HydrophobicContact CH2-CD 3.63Å; W207-K211 HydrophobicContact CH2-CG 3.83Å; W207-K211 HydrophobicContact CZ2-CD 3.8Å; W207-K211 HydrophobicContact CZ2-CG 3.62Å; W207-K211 HydrophobicContact CZ3-CD 4.06Å; W207-K211 HydrophobicContact CZ3-CG 4.08Å; W207-K211 WeakPolarHBondContact O-CG 3.45Å; W207-K211 PolarHBondContact O-N 3.43Å; W207-K211 VanDerWaalsContact O-N 3.1Å; W207-L221 HydrophobicContact CB-CD1 3.69Å; W207-L221 HydrophobicContact CG-CD1 4Å
208	G	94.2	Very high	93.3	Very high	1 Å²	1	57 Å²	57	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-56.4	-45.7	172.2	0	0	0	0	0	111.5	A204 Q205 K211 N212 N213	A204-G208 PolarHBondContact O-N 3.45Å; Q205-G208 CarbonylContact O-C 3.39Å; Q205-G208 PolarHBondContact O-N 2.88Å; G208-K211 CarbonylContact O-C 3.37Å; G208-K211 PolarHBondContact O-N 3.38Å; G208-K211 VanDerWaalsContact O-N 3.13Å; G208-N212 CarbonylContact O-C 3.57Å; G208-N212 WeakPolarHBondContact O-CA 3.46Å; G208-N212 PolarHBondContact O-N 3.47Å; G208-N213 WeakPolarHBondContact CA-O 3.42Å; G208-N213 PolarHBondContact O-N 3.26Å
209	L	87.1	Confident	93.3	Very high	23 Å²	23	61.4 Å²	61.4	12%	0.12	30%	0.298	C	S	.	.	H	α-helix	trans	-59.3	-48.2	176.9	-172.9	66.8	0	0	0	111.7	M72 Q205 L206 W207 K211 N212	M72-L209 HydrophobicContact CG-CD2 3.88Å; M72-L209 HydrophobicContact SD-CD1 4.37Å; M72-L209 HydrophobicContact SD-CD2 3.88Å; Q205-L209 WeakPolarHBondContact O-CB 3.46Å; Q205-L209 PolarHBondContact O-N 3.49Å; L206-L209 WeakPolarHBondContact O-CB 3.39Å; L206-L209 PolarHBondContact O-N 2.92Å; W207-L209 VanDerWaalsContact C-N 3.3Å; W207-L209 PolarHBondContact O-N 3.42Å; L209-K211 PolarHBondContact O-N 3.41Å; L209-N212 PolarHBondContact O-N 2.81Å; L209-N212 PolarHBondContact O-OD1 3.21Å
210	K	88.6	Confident	93.4	Very high	64 Å²	64	63.4 Å²	63.4	28%	0.278	31%	0.305	S	S	.	.	H	α-helix	trans	-59.6	-29.7	176.6	-175.1	73.2	174.3	-171.8	0	112.6	H161 S163 L206 W207	H161-K210 PolarHBondContact ND1-NZ 3.25Å; S163-K210 PolarHBondContact O-NZ 3.47Å; L206-K210 PolarHBondContact O-N 2.84Å; W207-K210 HydrophobicContact CE3-CB 4.24Å; W207-K210 HydrophobicContact CE3-CG 4.32Å; W207-K210 HydrophobicContact CZ3-CG 4.18Å; W207-K210 PolarHBondContact O-N 3.38Å
211	K	89.3	Confident	93.4	Very high	101 Å²	101	62 Å²	62	44%	0.439	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	6.5	-178	-61.2	-58.8	-64.1	-175.2	0	113.8	W207 G208 L209 N213	W207-K211 HydrophobicContact CD2-CG 3.99Å; W207-K211 HydrophobicContact CE3-CG 4.15Å; W207-K211 HydrophobicContact CH2-CD 3.63Å; W207-K211 HydrophobicContact CH2-CG 3.83Å; W207-K211 HydrophobicContact CZ2-CD 3.8Å; W207-K211 HydrophobicContact CZ2-CG 3.62Å; W207-K211 HydrophobicContact CZ3-CD 4.06Å; W207-K211 HydrophobicContact CZ3-CG 4.08Å; W207-K211 WeakPolarHBondContact O-CG 3.45Å; W207-K211 PolarHBondContact O-N 3.43Å; W207-K211 VanDerWaalsContact O-N 3.1Å; G208-K211 CarbonylContact O-C 3.37Å; G208-K211 PolarHBondContact O-N 3.38Å; G208-K211 VanDerWaalsContact O-N 3.13Å; L209-K211 PolarHBondContact O-N 3.41Å; K211-N213 HydrophobicContact CB-CB 4.47Å; K211-N213 PolarHBondContact O-N 2.93Å
212	N	87.8	Confident	93.5	Very high	153 Å²	153	57.9 Å²	57.9	82%	0.818	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.6	44.4	-171	-66	20.6	0	0	0	112.8	G208 L209	G208-N212 CarbonylContact O-C 3.57Å; G208-N212 WeakPolarHBondContact O-CA 3.46Å; G208-N212 PolarHBondContact O-N 3.47Å; L209-N212 PolarHBondContact O-N 2.81Å; L209-N212 PolarHBondContact O-OD1 3.21Å
213	N	88.2	Confident	93.7	Very high	62 Å²	62	60.1 Å²	60.1	33%	0.332	28%	0.284	S	S	.	.			trans	-124.9	95.3	-179.7	-178.5	0.4	0	0	0	111	G208 K211 R215 M216	G208-N213 WeakPolarHBondContact CA-O 3.42Å; G208-N213 PolarHBondContact O-N 3.26Å; K211-N213 HydrophobicContact CB-CB 4.47Å; K211-N213 PolarHBondContact O-N 2.93Å; N213-R215 PolarHBondContact O-N 2.83Å; N213-R215 PolarHBondContact OD1-N 3.44Å; N213-M216 WeakPolarHBondContact O-CB 3.41Å; N213-M216 PolarHBondContact O-N 3.07Å
214	S	87	Confident	93.7	Very high	84 Å²	84	61.7 Å²	61.7	59%	0.587	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-14.6	179	59.4	0	0	0	0	114.4	M216	S214-M216 VanDerWaalsContact C-N 3.33Å
215	R	92.2	Very high	93.8	Very high	195 Å²	195	61.7 Å²	61.7	74%	0.736	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	13.2	177.2	-61.5	-176.5	177.3	179.2	-0.7	112.7	N213 K220	N213-R215 PolarHBondContact O-N 2.83Å; N213-R215 PolarHBondContact OD1-N 3.44Å; R215-K220 PolarHBondContact O-NZ 3.08Å
216	M	93.9	Very high	94	Very high	29 Å²	29	66.2 Å²	66.2	14%	0.143	31%	0.312	C	S	.	.			trans	-70	130.1	173.6	-174.3	57.4	65.4	0	0	109.9	A204 N213 S214 K220 L221	A204-M216 HydrophobicContact CB-CG 4.37Å; A204-M216 WeakPolarHBondContact O-CG 3.3Å; N213-M216 WeakPolarHBondContact O-CB 3.41Å; N213-M216 PolarHBondContact O-N 3.07Å; S214-M216 VanDerWaalsContact C-N 3.33Å; M216-K220 HydrophobicContact SD-CB 4.07Å; M216-L221 HydrophobicContact SD-CB 4.21Å
217	T	97.8	Very high	94.3	Very high	46 Å²	46	72.2 Å²	72.2	28%	0.282	33%	0.334	S	S	.	.			trans	-129.1	161.4	177.8	63.6	0	0	0	0	109.2	E219 K220 L221	T217-E219 PolarHBondContact O-N 3.48Å; T217-K220 PolarHBondContact O-N 3.39Å; T217-K220 PolarHBondContact OG1-N 2.85Å; T217-L221 WeakPolarHBondContact O-CB 3.5Å; T217-L221 PolarHBondContact O-N 3.03Å
218	Y	98.4	Very high	94.4	Very high	27 Å²	27	73.2 Å²	73.2	11%	0.106	34%	0.339	C	S	.	.	H	α-helix	trans	-61.9	-32.9	178	-177.8	-110.6	0	0	0	112.3	I197 A204 K220 L221 S222 M225 L242 Y244	I197-Y218 HydrophobicContact CD1-CE2 3.74Å; I197-Y218 HydrophobicContact CG2-CE2 4.33Å; A204-Y218 VanDerWaalsContact CB-N 3.3Å; Y218-K220 PolarHBondContact O-N 3.04Å; Y218-L221 HydrophobicContact CD2-CD2 4.4Å; Y218-L221 HydrophobicContact CE2-CD2 4.34Å; Y218-L221 PolarHBondContact O-N 2.81Å; Y218-S222 WeakPolarHBondContact O-CB 3.27Å; Y218-S222 PolarHBondContact O-N 3.32Å; Y218-S222 PolarHBondContact O-OG 3.25Å; Y218-S222 VanDerWaalsContact O-OG 3.1Å; Y218-M225 HydrophobicContact CE2-CE 3.98Å; Y218-L242 HydrophobicContact CD1-CD2 4.42Å; Y218-L242 HydrophobicContact CE1-CD2 3.41Å; Y218-L242 VanDerWaalsContact CE1-CD2 3.41Å; Y218-L242 HydrophobicContact CE2-CD2 4.46Å; Y218-L242 VanDerWaalsContact CZ-CD2 3.43Å; Y218-L242 WeakPolarHBondContact OH-CD2 3.39Å; Y218-Y244 PolarHBondContact OH-OH 3.29Å
219	E	98.1	Very high	94.6	Very high	155 Å²	155	75.8 Å²	75.8	72%	0.724	35%	0.348	S	S	*	.	H	α-helix	trans	-56.2	-50.3	173.8	-171.9	-177.3	-176.6	0	0	111.9	T217 S222 R223	T217-E219 PolarHBondContact O-N 3.48Å; E219-S222 PolarHBondContact O-N 3.38Å; E219-S222 PolarHBondContact O-OG 3.46Å; E219-R223 PolarHBondContact O-N 2.87Å
220	K	97.9	Very high	95.1	Very high	112 Å²	112	81.8 Å²	81.8	49%	0.487	38%	0.381	S	S	.	.	H	α-helix	trans	-67.5	-41.9	178.2	-66.1	174.6	-172.6	170.5	0	112.2	R215 M216 T217 Y218 R223 A224	R215-K220 PolarHBondContact O-NZ 3.08Å; M216-K220 HydrophobicContact SD-CB 4.07Å; T217-K220 PolarHBondContact O-N 3.39Å; T217-K220 PolarHBondContact OG1-N 2.85Å; Y218-K220 PolarHBondContact O-N 3.04Å; K220-R223 WeakPolarHBondContact O-CB 3.45Å; K220-R223 PolarHBondContact O-N 3.35Å; K220-A224 PolarHBondContact O-N 2.74Å; K220-A224 VanDerWaalsContact O-N 3.13Å
221	L	97.9	Very high	95.4	Very high	1 Å²	1	81 Å²	81	1%	0.005	38%	0.383	C	S	.	.	H	α-helix	trans	-62.1	-46.8	176.9	-173.8	157.9	0	0	0	110.6	L167 M203 A204 W207 M216 T217 Y218 R223 A224 M225	L167-L221 HydrophobicContact CD1-CD1 4.01Å; L167-L221 HydrophobicContact CD1-CD2 4.13Å; L167-L221 HydrophobicContact CD1-CG 3.81Å; L167-L221 HydrophobicContact CD2-CD2 4.13Å; L167-L221 HydrophobicContact CD2-CG 4.03Å; M203-L221 HydrophobicContact CG-CD1 4.42Å; A204-L221 HydrophobicContact CB-CD1 4.31Å; W207-L221 HydrophobicContact CB-CD1 3.69Å; W207-L221 HydrophobicContact CG-CD1 4Å; M216-L221 HydrophobicContact SD-CB 4.21Å; T217-L221 WeakPolarHBondContact O-CB 3.5Å; T217-L221 PolarHBondContact O-N 3.03Å; Y218-L221 HydrophobicContact CD2-CD2 4.4Å; Y218-L221 HydrophobicContact CE2-CD2 4.34Å; Y218-L221 PolarHBondContact O-N 2.81Å; L221-R223 VanDerWaalsContact C-N 3.28Å; L221-R223 PolarHBondContact O-N 3.39Å; L221-A224 WeakPolarHBondContact O-CA 3.12Å; L221-A224 WeakPolarHBondContact O-CB 3.4Å; L221-A224 PolarHBondContact O-N 2.91Å; L221-M225 HydrophobicContact CD2-CE 3.66Å; L221-M225 HydrophobicContact CD2-CG 3.98Å; L221-M225 HydrophobicContact CD2-SD 3.86Å; L221-M225 PolarHBondContact O-N 2.93Å
222	S	98.1	Very high	95.8	Very high	11 Å²	11	81 Å²	81	8%	0.077	38%	0.383	C	S	.	.	H	α-helix	trans	-64.3	-34.3	178.2	75.5	0	0	0	0	111.9	Y218 E219 A224 M225 R226	Y218-S222 WeakPolarHBondContact O-CB 3.27Å; Y218-S222 PolarHBondContact O-N 3.32Å; Y218-S222 PolarHBondContact O-OG 3.25Å; Y218-S222 VanDerWaalsContact O-OG 3.1Å; E219-S222 PolarHBondContact O-N 3.38Å; E219-S222 PolarHBondContact O-OG 3.46Å; S222-A224 VanDerWaalsContact C-N 3.3Å; S222-A224 PolarHBondContact O-N 3.17Å; S222-M225 PolarHBondContact O-N 2.72Å; S222-R226 WeakPolarHBondContact O-CG 2.87Å; S222-R226 PolarHBondContact O-N 3.39Å
223	R	98.1	Very high	96.3	Very high	111 Å²	111	75 Å²	75	42%	0.419	35%	0.351	S	S	.	.	H	α-helix	trans	-59.3	-41.9	171	-176.5	66.6	-169.6	89.7	-10.7	111.8	E219 K220 L221 R226 Y227	E219-R223 PolarHBondContact O-N 2.87Å; K220-R223 WeakPolarHBondContact O-CB 3.45Å; K220-R223 PolarHBondContact O-N 3.35Å; L221-R223 VanDerWaalsContact C-N 3.28Å; L221-R223 PolarHBondContact O-N 3.39Å; R223-R226 PolarHBondContact O-N 2.9Å; R223-Y227 HydrophobicContact CG-CE2 4.18Å; R223-Y227 VanDerWaalsContact NH1-CE2 3.32Å; R223-Y227 PolarHBondContact NH2-OH 3.22Å; R223-Y227 WeakPolarHBondContact O-CD2 3.38Å
224	A	97	Very high	96.7	Very high	33 Å²	33	72 Å²	72	27%	0.273	34%	0.335	S	S	.	.	H	α-helix	trans	-66.7	-41.4	175.5	0	0	0	0	0	112.3	L167 K220 L221 S222 R226 Y227	L167-A224 HydrophobicContact CD2-CB 3.6Å; K220-A224 PolarHBondContact O-N 2.74Å; K220-A224 VanDerWaalsContact O-N 3.13Å; L221-A224 WeakPolarHBondContact O-CA 3.12Å; L221-A224 WeakPolarHBondContact O-CB 3.4Å; L221-A224 PolarHBondContact O-N 2.91Å; S222-A224 VanDerWaalsContact C-N 3.3Å; S222-A224 PolarHBondContact O-N 3.17Å; A224-R226 VanDerWaalsContact C-N 3.31Å; A224-R226 PolarHBondContact O-N 3.13Å; A224-Y227 WeakPolarHBondContact O-CB 3.42Å; A224-Y227 PolarHBondContact O-N 2.9Å
225	M	98.1	Very high	97.3	Very high	0 Å²	0	70 Å²	70	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-59.9	-40.1	174.9	-67.8	-167.5	-67.1	0	0	112.6	L167 I171 I197 Y218 L221 S222 Y227 Y228 I234 Y244	L167-M225 HydrophobicContact CD2-CG 3.69Å; L167-M225 HydrophobicContact CG-CG 4.42Å; I171-M225 HydrophobicContact CD1-CG 4.03Å; I171-M225 HydrophobicContact CD1-SD 3.59Å; I171-M225 VanDerWaalsContact CD1-SD 3.59Å; I197-M225 HydrophobicContact CD1-CE 3.78Å; I197-M225 HydrophobicContact CD1-SD 4.09Å; Y218-M225 HydrophobicContact CE2-CE 3.98Å; L221-M225 HydrophobicContact CD2-CE 3.66Å; L221-M225 HydrophobicContact CD2-CG 3.98Å; L221-M225 HydrophobicContact CD2-SD 3.86Å; L221-M225 PolarHBondContact O-N 2.93Å; S222-M225 PolarHBondContact O-N 2.72Å; M225-Y227 PolarHBondContact O-N 3.36Å; M225-Y228 WeakPolarHBondContact O-CB 3.07Å; M225-Y228 PolarHBondContact O-N 2.89Å; M225-I234 HydrophobicContact CG-CD1 4.35Å; M225-Y244 HydrophobicContact CE-CD2 4.39Å; M225-Y244 HydrophobicContact CE-CE1 4.04Å; M225-Y244 HydrophobicContact CE-CE2 3.7Å; M225-Y244 VanDerWaalsContact CE-CZ 3.49Å; M225-Y244 HydrophobicContact SD-CE2 4.39Å
226	R	97.8	Very high	97.5	Very high	139 Å²	139	64 Å²	64	53%	0.525	30%	0.304	S	S	.	.	H	α-helix	trans	-61.7	-29.9	178.3	-70.7	175.6	-171.9	177.4	4.9	113.1	S222 R223 A224 Y228 Y229	S222-R226 WeakPolarHBondContact O-CG 2.87Å; S222-R226 PolarHBondContact O-N 3.39Å; R223-R226 PolarHBondContact O-N 2.9Å; A224-R226 VanDerWaalsContact C-N 3.31Å; A224-R226 PolarHBondContact O-N 3.13Å; R226-Y228 PolarHBondContact O-N 3.39Å; R226-Y229 HydrophobicContact CB-CD2 4.39Å; R226-Y229 HydrophobicContact CB-CE2 4.08Å; R226-Y229 HydrophobicContact CG-CE2 3.8Å; R226-Y229 WeakPolarHBondContact O-CB 3.39Å; R226-Y229 VanDerWaalsContact O-CG 3.25Å; R226-Y229 PolarHBondContact O-N 3.26Å
227	Y	97.8	Very high	97.7	Very high	148 Å²	148	64.2 Å²	64.2	58%	0.58	31%	0.306	S	S	*	.	H	α-helix	trans	-64.5	-20.4	175.7	-68.5	-56.9	0	0	0	113	R223 A224 M225 Y229	R223-Y227 HydrophobicContact CG-CE2 4.18Å; R223-Y227 VanDerWaalsContact NH1-CE2 3.32Å; R223-Y227 PolarHBondContact NH2-OH 3.22Å; R223-Y227 WeakPolarHBondContact O-CD2 3.38Å; A224-Y227 WeakPolarHBondContact O-CB 3.42Å; A224-Y227 PolarHBondContact O-N 2.9Å; M225-Y227 PolarHBondContact O-N 3.36Å; Y227-Y229 VanDerWaalsContact C-N 3.28Å; Y227-Y229 PolarHBondContact O-N 3.03Å
228	Y	98	Very high	97.6	Very high	43 Å²	43	67.4 Å²	67.4	17%	0.169	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-7	177.1	-66.4	-50.3	0	0	0	114.6	L167 W168 M225 R226 N230 S231 K232 I233 I234	L167-Y228 HydrophobicContact CB-CE2 4.21Å; W168-Y228 HydrophobicContact CB-CD2 4.35Å; W168-Y228 HydrophobicContact CB-CE2 3.94Å; W168-Y228 AromaticContact CD1-CE1 3.91Å; W168-Y228 AromaticContact CD1-CZ 3.68Å; M225-Y228 WeakPolarHBondContact O-CB 3.07Å; M225-Y228 PolarHBondContact O-N 2.89Å; R226-Y228 PolarHBondContact O-N 3.39Å; Y228-N230 PolarHBondContact O-N 3.45Å; Y228-S231 WeakPolarHBondContact CA-OG 3.34Å; Y228-S231 CarbonylContact O-C 3.57Å; Y228-S231 PolarHBondContact O-N 2.94Å; Y228-S231 PolarHBondContact O-OG 3.03Å; Y228-S231 VanDerWaalsContact O-OG 3.13Å; Y228-K232 PolarHBondContact O-N 2.84Å; Y228-I233 HydrophobicContact CD1-CB 4.16Å; Y228-I233 HydrophobicContact CD1-CD1 3.9Å; Y228-I233 HydrophobicContact CD1-CG2 4.5Å; Y228-I233 HydrophobicContact CE1-CD1 4.21Å; Y228-I233 HydrophobicContact CG-CB 4.25Å; Y228-I233 PolarHBondContact O-N 2.83Å; Y228-I234 HydrophobicContact CD2-CD1 3.89Å; Y228-I234 HydrophobicContact CD2-CG1 4.2Å; Y228-I234 HydrophobicContact CE2-CD1 4.49Å
229	Y	98	Very high	97.5	Very high	54 Å²	54	70.4 Å²	70.4	21%	0.212	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-40	-176.6	-66.1	-6	0	0	0	112	R226 Y227 K232 I234 P236	R226-Y229 HydrophobicContact CB-CD2 4.39Å; R226-Y229 HydrophobicContact CB-CE2 4.08Å; R226-Y229 HydrophobicContact CG-CE2 3.8Å; R226-Y229 WeakPolarHBondContact O-CB 3.39Å; R226-Y229 VanDerWaalsContact O-CG 3.25Å; R226-Y229 PolarHBondContact O-N 3.26Å; Y227-Y229 VanDerWaalsContact C-N 3.28Å; Y227-Y229 PolarHBondContact O-N 3.03Å; Y229-K232 WeakPolarHBondContact O-CD 3.17Å; Y229-K232 PolarHBondContact O-N 3.32Å; Y229-I234 VanDerWaalsContact CD1-O 3.29Å; Y229-I234 WeakPolarHBondContact CD1-O 3.48Å; Y229-I234 HydrophobicContact CE1-CG2 4.44Å; Y229-P236 HydrophobicContact CD2-CG 4.33Å; Y229-P236 HydrophobicContact CE1-CB 4.33Å; Y229-P236 HydrophobicContact CE1-CG 4.49Å; Y229-P236 HydrophobicContact CE2-CB 4.06Å; Y229-P236 HydrophobicContact CE2-CG 4.12Å
230	N	96.5	Very high	97.4	Very high	150 Å²	150	67.5 Å²	67.5	80%	0.802	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-41.1	176.3	-70.2	52.4	0	0	0	110.9	Y228 K232	Y228-N230 PolarHBondContact O-N 3.45Å; N230-K232 PolarHBondContact O-N 2.9Å
231	S	96.4	Very high	97.4	Very high	47 Å²	47	72.7 Å²	72.7	33%	0.329	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-2	178.9	72.5	0	0	0	0	113.7	Y228 I233 H249	Y228-S231 WeakPolarHBondContact CA-OG 3.34Å; Y228-S231 CarbonylContact O-C 3.57Å; Y228-S231 PolarHBondContact O-N 2.94Å; Y228-S231 PolarHBondContact O-OG 3.03Å; Y228-S231 VanDerWaalsContact O-OG 3.13Å; S231-I233 PolarHBondContact O-N 3.13Å; S231-I233 WeakPolarHBondContact OG-CD1 3.41Å; S231-I233 WeakPolarHBondContact OG-CG1 3.48Å; S231-H249 PolarHBondContact O-ND1 2.92Å
232	K	97.2	Very high	97.4	Very high	101 Å²	101	75 Å²	75	44%	0.439	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	34	179.2	-51.7	-65.3	175.9	-173.2	0	114	Y228 Y229 N230 L235 G247 P248 H249	Y228-K232 PolarHBondContact O-N 2.84Å; Y229-K232 WeakPolarHBondContact O-CD 3.17Å; Y229-K232 PolarHBondContact O-N 3.32Å; N230-K232 PolarHBondContact O-N 2.9Å; K232-L235 HydrophobicContact CB-CD2 4.49Å; K232-L235 HydrophobicContact CD-CD2 3.66Å; K232-G247 CarbonylContact O-C 3.54Å; K232-G247 VanDerWaalsContact O-CA 3.26Å; K232-G247 WeakPolarHBondContact O-CA 3.43Å; K232-P248 HydrophobicContact CB-CG 4.14Å; K232-P248 WeakPolarHBondContact O-CD 2.98Å; K232-H249 PolarHBondContact O-N 3.02Å
233	I	97.3	Very high	97.4	Very high	27 Å²	27	74.6 Å²	74.6	14%	0.138	38%	0.378	C	S	.	.	S	Bend	trans	-89.6	-43.1	174	-63.3	171.9	0	0	0	110.2	W168 Y228 S231 G247 H249 A250	W168-I233 HydrophobicContact CB-CG2 3.73Å; W168-I233 HydrophobicContact CD2-CG2 3.66Å; W168-I233 HydrophobicContact CE3-CG2 4.17Å; W168-I233 HydrophobicContact CG-CG2 3.45Å; W168-I233 VanDerWaalsContact CG-CG2 3.45Å; Y228-I233 HydrophobicContact CD1-CB 4.16Å; Y228-I233 HydrophobicContact CD1-CD1 3.9Å; Y228-I233 HydrophobicContact CD1-CG2 4.5Å; Y228-I233 HydrophobicContact CE1-CD1 4.21Å; Y228-I233 HydrophobicContact CG-CB 4.25Å; Y228-I233 PolarHBondContact O-N 2.83Å; S231-I233 PolarHBondContact O-N 3.13Å; S231-I233 WeakPolarHBondContact OG-CD1 3.41Å; S231-I233 WeakPolarHBondContact OG-CG1 3.48Å; I233-G247 PolarHBondContact O-N 2.99Å; I233-H249 HydrophobicContact CG1-CB 4.04Å; I233-A250 HydrophobicContact CG2-CB 4.09Å; I233-A250 WeakPolarHBondContact O-CB 3.46Å
234	I	98.1	Very high	97.4	Very high	0 Å²	0	70.3 Å²	70.3	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	141.1	170.3	-60.7	-178	0	0	0	106.7	W168 I171 F195 M225 Y228 Y229 Y244 K245	W168-I234 HydrophobicContact CB-CD1 4Å; W168-I234 HydrophobicContact CB-CG1 4.29Å; I171-I234 HydrophobicContact CD1-CD1 3.96Å; F195-I234 HydrophobicContact CZ-CD1 4.5Å; F195-I234 HydrophobicContact CZ-CG2 4.49Å; M225-I234 HydrophobicContact CG-CD1 4.35Å; Y228-I234 HydrophobicContact CD2-CD1 3.89Å; Y228-I234 HydrophobicContact CD2-CG1 4.2Å; Y228-I234 HydrophobicContact CE2-CD1 4.49Å; Y229-I234 VanDerWaalsContact CD1-O 3.29Å; Y229-I234 WeakPolarHBondContact CD1-O 3.48Å; Y229-I234 HydrophobicContact CE1-CG2 4.44Å; I234-Y244 HydrophobicContact CG2-CD1 4.1Å; I234-Y244 HydrophobicContact CG2-CG 4.37Å; I234-K245 CarbonylContact C-O 3.56Å; I234-K245 WeakPolarHBondContact CA-O 3.49Å
235	L	98.1	Very high	97.5	Very high	41 Å²	41	71.8 Å²	71.8	22%	0.215	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	144.2	178.4	-60.6	175.3	0	0	0	109.8	K232 K245	K232-L235 HydrophobicContact CB-CD2 4.49Å; K232-L235 HydrophobicContact CD-CD2 3.66Å; L235-K245 HydrophobicContact CB-CB 4.38Å; L235-K245 PolarHBondContact N-O 3.18Å; L235-K245 PolarHBondContact O-N 3.47Å
236	P	97.6	Very high	97.5	Very high	70 Å²	70	71.9 Å²	71.9	46%	0.455	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	148.7	172.2	30.6	-33.2	0	0	0	110.6	Y229	Y229-P236 HydrophobicContact CD2-CG 4.33Å; Y229-P236 HydrophobicContact CE1-CB 4.33Å; Y229-P236 HydrophobicContact CE1-CG 4.49Å; Y229-P236 HydrophobicContact CE2-CB 4.06Å; Y229-P236 HydrophobicContact CE2-CG 4.12Å
237	V	97.7	Very high	97.4	Very high	32 Å²	32	65.4 Å²	65.4	19%	0.194	34%	0.339	C	S	.	.			trans	-109.3	109.5	168.5	-176.8	0	0	0	0	108.3	I194 R240 V243 K245	I194-V237 HydrophobicContact CG2-CG2 4.39Å; V237-R240 HydrophobicContact CG1-CB 4.14Å; V237-R240 HydrophobicContact CG1-CG 4.15Å; V237-R240 PolarHBondContact O-N 3.47Å; V237-V243 HydrophobicContact CB-CB 4.31Å; V237-V243 HydrophobicContact CB-CG1 3.99Å; V237-V243 HydrophobicContact CG1-CG1 4.2Å; V237-V243 HydrophobicContact CG2-CG1 3.99Å; V237-K245 HydrophobicContact CG2-CB 3.95Å
238	S	95.4	Very high	97.3	Very high	114 Å²	114	63.3 Å²	63.3	80%	0.797	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	139	-174.2	-59.4	0	0	0	0	112.3	R240	S238-R240 PolarHBondContact O-N 3.23Å; S238-R240 VanDerWaalsContact O-N 3.1Å
239	G	96	Very high	97.2	Very high	89 Å²	89	67 Å²	67	92%	0.918	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	-3.7	177.9	0	0	0	0	0	115.6
240	R	97.1	Very high	97.1	Very high	95 Å²	95	64.8 Å²	64.8	36%	0.358	36%	0.355	S	S	.	.			trans	-116.9	102.6	-174.7	-59.1	-174.3	76.1	-157	0	111.1	E188 V237 S238 V243	E188-R240 IonicContact OE2-CZ 3.77Å; E188-R240 IonicContact OE2-NH2 2.7Å; E188-R240 PolarHBondContact OE2-NH2 3.08Å; V237-R240 HydrophobicContact CG1-CB 4.14Å; V237-R240 HydrophobicContact CG1-CG 4.15Å; V237-R240 PolarHBondContact O-N 3.47Å; S238-R240 PolarHBondContact O-N 3.23Å; S238-R240 VanDerWaalsContact O-N 3.1Å; R240-V243 HydrophobicContact CB-CB 3.72Å; R240-V243 HydrophobicContact CB-CG1 4.38Å; R240-V243 HydrophobicContact CB-CG2 3.77Å; R240-V243 PolarHBondContact O-N 3Å
241	R	97	Very high	96.9	Very high	220 Å²	220	61.4 Å²	61.4	83%	0.83	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	140.4	176.1	-64.5	-179.3	68.8	-163.9	1.1	110.9	R196 V243	R196-R241 PolarHBondContact NH1-O 2.89Å; R241-V243 PolarHBondContact O-N 3.2Å; R241-V243 VanDerWaalsContact O-N 3.14Å
242	L	97.9	Very high	96.6	Very high	50 Å²	50	64.3 Å²	64.3	26%	0.262	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	61	12.6	-179.7	-49.9	177.2	0	0	0	114.5	R196 I197 Y218	R196-L242 WeakPolarHBondContact CA-O 3.44Å; I197-L242 HydrophobicContact CB-CB 4.44Å; I197-L242 PolarHBondContact N-O 2.86Å; I197-L242 WeakPolarHBondContact O-CB 3.32Å; I197-L242 WeakPolarHBondContact O-CD1 3.48Å; Y218-L242 HydrophobicContact CD1-CD2 4.42Å; Y218-L242 HydrophobicContact CE1-CD2 3.41Å; Y218-L242 VanDerWaalsContact CE1-CD2 3.41Å; Y218-L242 HydrophobicContact CE2-CD2 4.46Å; Y218-L242 VanDerWaalsContact CZ-CD2 3.43Å; Y218-L242 WeakPolarHBondContact OH-CD2 3.39Å
243	V	98.3	Very high	96.3	Very high	3 Å²	3	60.3 Å²	60.3	2%	0.018	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	132.8	177.2	-174.2	0	0	0	0	109.4	I194 F195 R196 V237 R240 R241	I194-V243 HydrophobicContact CG2-CG1 3.47Å; I194-V243 VanDerWaalsContact CG2-CG1 3.47Å; F195-V243 WeakPolarHBondContact O-CA 3.46Å; R196-V243 HydrophobicContact CB-CG2 4.32Å; R196-V243 HydrophobicContact CG-CG2 4.45Å; V237-V243 HydrophobicContact CB-CB 4.31Å; V237-V243 HydrophobicContact CB-CG1 3.99Å; V237-V243 HydrophobicContact CG1-CG1 4.2Å; V237-V243 HydrophobicContact CG2-CG1 3.99Å; R240-V243 HydrophobicContact CB-CB 3.72Å; R240-V243 HydrophobicContact CB-CG1 4.38Å; R240-V243 HydrophobicContact CB-CG2 3.77Å; R240-V243 PolarHBondContact O-N 3Å; R241-V243 PolarHBondContact O-N 3.2Å; R241-V243 VanDerWaalsContact O-N 3.14Å
244	Y	98.6	Very high	95.8	Very high	21 Å²	21	66 Å²	66	8%	0.082	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	161.9	-177.2	-59.4	-86	0	0	0	109.3	I194 F195 I197 Y218 M225 I234	I194-Y244 WeakPolarHBondContact CA-O 3.45Å; F195-Y244 HydrophobicContact CE2-CD2 4.07Å; F195-Y244 HydrophobicContact CE2-CG 4.22Å; F195-Y244 VanDerWaalsContact CZ-CB 3.4Å; F195-Y244 HydrophobicContact CZ-CG 4.26Å; F195-Y244 PolarHBondContact N-O 3.16Å; F195-Y244 PolarHBondContact O-N 3.1Å; I197-Y244 HydrophobicContact CD1-CD2 4.24Å; I197-Y244 HydrophobicContact CD1-CE2 3.95Å; Y218-Y244 PolarHBondContact OH-OH 3.29Å; M225-Y244 HydrophobicContact CE-CD2 4.39Å; M225-Y244 HydrophobicContact CE-CE1 4.04Å; M225-Y244 HydrophobicContact CE-CE2 3.7Å; M225-Y244 VanDerWaalsContact CE-CZ 3.49Å; M225-Y244 HydrophobicContact SD-CE2 4.39Å; I234-Y244 HydrophobicContact CG2-CD1 4.1Å; I234-Y244 HydrophobicContact CG2-CG 4.37Å
245	K	98.1	Very high	94.7	Very high	63 Å²	63	68.1 Å²	68.1	27%	0.274	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	134.4	178.1	179.1	167.7	178.6	157.3	0	109.5	E192 G193 I194 I234 L235 V237 G247	E192-K245 WeakPolarHBondContact O-CE 3.17Å; E192-K245 IonicContact OE2-NZ 2.95Å; E192-K245 PolarHBondContact OE2-NZ 3.03Å; G193-K245 CarbonylContact O-C 3.59Å; G193-K245 WeakPolarHBondContact O-CA 3.46Å; I194-K245 HydrophobicContact CG1-CB 4.25Å; I194-K245 HydrophobicContact CG1-CD 3.97Å; I194-K245 HydrophobicContact CG1-CG 4.1Å; I234-K245 CarbonylContact C-O 3.56Å; I234-K245 WeakPolarHBondContact CA-O 3.49Å; L235-K245 HydrophobicContact CB-CB 4.38Å; L235-K245 PolarHBondContact N-O 3.18Å; L235-K245 PolarHBondContact O-N 3.47Å; V237-K245 HydrophobicContact CG2-CB 3.95Å; K245-G247 PolarHBondContact O-N 2.58Å
246	F	98.1	Very high	93.3	Very high	3 Å²	3	74.4 Å²	74.4	1%	0.013	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	130.2	167	-75.7	-65.1	0	0	0	109.5	I171 R172 L175 W187 G193 F195 A250 W253	I171-F246 HydrophobicContact CG2-CZ 4.1Å; R172-F246 HydrophobicContact CB-CE1 4.25Å; R172-F246 HydrophobicContact CB-CZ 3.76Å; L175-F246 HydrophobicContact CD1-CE2 3.65Å; L175-F246 HydrophobicContact CD1-CZ 4.08Å; W187-F246 AromaticContact CH2-CD2 3.84Å; W187-F246 HydrophobicContact CH2-CD2 3.84Å; W187-F246 AromaticContact CH2-CE2 3.65Å; W187-F246 HydrophobicContact CH2-CE2 3.65Å; W187-F246 HydrophobicContact CZ3-CD2 4.01Å; W187-F246 HydrophobicContact CZ3-CE2 4.08Å; G193-F246 PolarHBondContact O-N 3.27Å; F195-F246 AromaticContact CD1-CD2 3.83Å; F195-F246 HydrophobicContact CD1-CD2 3.83Å; F195-F246 AromaticContact CD1-CE2 3.72Å; F195-F246 HydrophobicContact CD1-CE2 3.72Å; F195-F246 HydrophobicContact CD1-CG 4.48Å; F195-F246 HydrophobicContact CD1-CZ 4.29Å; F195-F246 HydrophobicContact CE1-CD1 4.25Å; F195-F246 AromaticContact CE1-CD2 3.86Å; F195-F246 HydrophobicContact CE1-CD2 3.86Å; F195-F246 HydrophobicContact CE1-CE1 4.17Å; F195-F246 AromaticContact CE1-CE2 3.76Å; F195-F246 HydrophobicContact CE1-CE2 3.76Å; F195-F246 HydrophobicContact CE1-CG 4.1Å; F195-F246 AromaticContact CE1-CZ 3.92Å; F195-F246 HydrophobicContact CE1-CZ 3.92Å; F195-F246 HydrophobicContact CZ-CZ 4.45Å; F246-A250 HydrophobicContact CB-CB 4.07Å; F246-A250 HydrophobicContact CD1-CB 3.73Å; F246-A250 HydrophobicContact CG-CB 4.27Å; F246-W253 HydrophobicContact CB-CD2 3.67Å; F246-W253 VanDerWaalsContact CB-CE2 3.44Å; F246-W253 HydrophobicContact CB-CE3 4.41Å; F246-W253 HydrophobicContact CB-CG 3.82Å; F246-W253 HydrophobicContact CB-CZ2 3.97Å; F246-W253 HydrophobicContact CD1-CG 4.44Å; F246-W253 HydrophobicContact CD2-CB 3.77Å; F246-W253 AromaticContact CD2-CD2 3.89Å; F246-W253 HydrophobicContact CD2-CD2 3.89Å; F246-W253 HydrophobicContact CD2-CE3 4.27Å; F246-W253 AromaticContact CD2-CG 3.68Å; F246-W253 HydrophobicContact CD2-CG 3.68Å; F246-W253 HydrophobicContact CE2-CB 3.96Å; F246-W253 HydrophobicContact CE2-CG 4.36Å; F246-W253 HydrophobicContact CG-CB 4.18Å; F246-W253 AromaticContact CG-CD1 3.84Å; F246-W253 HydrophobicContact CG-CD2 4.01Å; F246-W253 AromaticContact CG-CG 3.73Å; F246-W253 HydrophobicContact CG-CG 3.73Å
247	G	97	Very high	93	Very high	3 Å²	3	74.7 Å²	74.7	3%	0.031	43%	0.427	C	S	.	.			trans	-86.1	177.8	179.1	0	0	0	0	0	112.7	K232 I233 K245 H249 A250	K232-G247 CarbonylContact O-C 3.54Å; K232-G247 VanDerWaalsContact O-CA 3.26Å; K232-G247 WeakPolarHBondContact O-CA 3.43Å; I233-G247 PolarHBondContact O-N 2.99Å; K245-G247 PolarHBondContact O-N 2.58Å; G247-H249 PolarHBondContact O-N 2.68Å; G247-A250 PolarHBondContact O-N 3Å; G247-A250 VanDerWaalsContact O-N 3.12Å
248	P	95.4	Very high	92.8	Very high	103 Å²	103	76.9 Å²	76.9	67%	0.669	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-22.9	-177.7	25.6	-35.7	0	0	0	114	K232	K232-P248 HydrophobicContact CB-CG 4.14Å; K232-P248 WeakPolarHBondContact O-CD 2.98Å
249	H	96.2	Very high	92.6	Very high	122 Å²	122	74.8 Å²	74.8	57%	0.565	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-1.8	179.8	-60.2	168.2	0	0	0	113.6	S231 K232 I233 G247	S231-H249 PolarHBondContact O-ND1 2.92Å; K232-H249 PolarHBondContact O-N 3.02Å; I233-H249 HydrophobicContact CG1-CB 4.04Å; G247-H249 PolarHBondContact O-N 2.68Å
250	A	94.8	Very high	92.5	Very high	7 Å²	7	74 Å²	74	6%	0.058	39%	0.391	C	S	.	.			trans	-85.3	134	170.7	0	0	0	0	0	109.9	W168 I233 F246 G247 W253	W168-A250 HydrophobicContact CE3-CB 4.34Å; W168-A250 HydrophobicContact CZ3-CB 4.41Å; I233-A250 HydrophobicContact CG2-CB 4.09Å; I233-A250 WeakPolarHBondContact O-CB 3.46Å; F246-A250 HydrophobicContact CB-CB 4.07Å; F246-A250 HydrophobicContact CD1-CB 3.73Å; F246-A250 HydrophobicContact CG-CB 4.27Å; G247-A250 PolarHBondContact O-N 3Å; G247-A250 VanDerWaalsContact O-N 3.12Å; A250-W253 VanDerWaalsContact O-CD1 3.27Å; A250-W253 PolarHBondContact O-NE1 2.8Å
251	V	92.5	Very high	92.2	Very high	79 Å²	79	72.7 Å²	72.7	48%	0.479	39%	0.393	S	S	.	.			trans	-111.7	159.7	-177.3	-62.5	0	0	0	0	112.3	W168 R172 W253	W168-V251 HydrophobicContact CH2-CG2 3.79Å; W168-V251 HydrophobicContact CZ3-CG2 4.42Å; R172-V251 VanDerWaalsContact CD-O 3.25Å; R172-V251 WeakPolarHBondContact CD-O 3.18Å; R172-V251 PolarHBondContact NH1-O 3.41Å; V251-W253 PolarHBondContact O-N 3.4Å; V251-W253 VanDerWaalsContact O-N 3.13Å
252	D	90.1	Very high	91.8	Very high	107 Å²	107	62.9 Å²	62.9	57%	0.572	36%	0.363	S	S	*	.	S	Bend	trans	58.2	18.1	175.6	-36.8	-48.3	0	0	0	116.6	R172 K176	R172-D252 IonicContact CZ-OD2 3.89Å; R172-D252 IonicContact NH1-OD2 2.83Å; R172-D252 PolarHBondContact NH1-OD2 3.07Å; K176-D252 WeakPolarHBondContact CE-O 3.45Å; K176-D252 PolarHBondContact NZ-O 3.45Å
253	W	90.7	Very high	91.4	Very high	18 Å²	18	63.8 Å²	63.8	7%	0.068	37%	0.371	C	S	.	.			trans	-94.9	-21.6	176.2	64.7	-96.4	0	0	0	113.1	R172 W187 G193 F246 A250 V251	R172-W253 HydrophobicContact CG-CB 3.92Å; W187-W253 HydrophobicContact CH2-CB 4.33Å; W187-W253 HydrophobicContact CH2-CE3 4.23Å; W187-W253 HydrophobicContact CZ3-CE3 4.45Å; G193-W253 VanDerWaalsContact CA-CH2 3.46Å; F246-W253 HydrophobicContact CB-CD2 3.67Å; F246-W253 VanDerWaalsContact CB-CE2 3.44Å; F246-W253 HydrophobicContact CB-CE3 4.41Å; F246-W253 HydrophobicContact CB-CG 3.82Å; F246-W253 HydrophobicContact CB-CZ2 3.97Å; F246-W253 HydrophobicContact CD1-CG 4.44Å; F246-W253 HydrophobicContact CD2-CB 3.77Å; F246-W253 AromaticContact CD2-CD2 3.89Å; F246-W253 HydrophobicContact CD2-CD2 3.89Å; F246-W253 HydrophobicContact CD2-CE3 4.27Å; F246-W253 AromaticContact CD2-CG 3.68Å; F246-W253 HydrophobicContact CD2-CG 3.68Å; F246-W253 HydrophobicContact CE2-CB 3.96Å; F246-W253 HydrophobicContact CE2-CG 4.36Å; F246-W253 HydrophobicContact CG-CB 4.18Å; F246-W253 AromaticContact CG-CD1 3.84Å; F246-W253 HydrophobicContact CG-CD2 4.01Å; F246-W253 AromaticContact CG-CG 3.73Å; F246-W253 HydrophobicContact CG-CG 3.73Å; A250-W253 VanDerWaalsContact O-CD1 3.27Å; A250-W253 PolarHBondContact O-NE1 2.8Å; V251-W253 PolarHBondContact O-N 3.4Å; V251-W253 VanDerWaalsContact O-N 3.13Å
254	K	86.3	Confident	90.9	Very high	145 Å²	145	68.5 Å²	68.5	63%	0.63	40%	0.398	S	S	*	.	S	Bend	trans	-65.4	150.9	-179.8	-67.9	-177.1	178.8	-177.6	0	110.8	A256	K254-A256 PolarHBondContact O-N 3.12Å
255	P	75.3	Confident	90.2	Very high	46 Å²	46	72.4 Å²	72.4	30%	0.299	42%	0.424	S	S	.	.			trans	-49.7	136.7	160.9	-18.3	28.7	0	0	0	110.3	R190	R190-P255 HydrophobicContact CG-CG 4.04Å
256	A	68.3	Low	89.5	Confident	173 Å²	173	73.3 Å²	73.3	100%	1.43	44%	0.438	S	S	*	.			trans	-61.6	0	160.1	0	0	0	0	0	109.5	K254	K254-A256 PolarHBondContact O-N 3.12Å

Retrieved 256 of 256 residues in 242.3 ms (Link to these results)

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