A0A060WZJ9_ONCMY Loading...

Regulator of G-protein signaling 8

AlphaFold DB , UniProt , Accession A0A060WZJ9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 174 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	41.2	Very low	41	Very low	235 Å²	235	162.9 Å²	162.9	100%	1.158	86%	0.855	S	S	*	*				0	140.2	0	-79.9	-174.5	179.4	0	0	109.4
2	K	38.8	Very low	40.6	Very low	189 Å²	189	158.1 Å²	158.1	82%	0.822	85%	0.845	S	S	*	*			trans	74.8	86.1	169.1	-59.5	173.5	179.9	176.6	0	116.1
3	T	51.1	Low	40	Very low	130 Å²	130	156.7 Å²	156.7	80%	0.798	84%	0.838	S	S	*	*				58	115.1	92.2	59.7	0	0	0	0	115.5
4	R	43.8	Very low	39.5	Very low	256 Å²	256	151.2 Å²	151.2	97%	0.966	82%	0.818	S	S	*	*			trans	-151.5	126.9	137	-75.7	-153.7	167.9	176.8	-4.9	111.8
5	L	45.4	Very low	39.5	Very low	178 Å²	178	153.8 Å²	153.8	93%	0.932	81%	0.813	S	S	*	*			trans	-90.6	133.5	170.4	-168.3	81.5	0	0	0	108.1
6	A	38	Very low	39.5	Very low	101 Å²	101	149.6 Å²	149.6	84%	0.835	80%	0.795	S	S	*	*			trans	161.9	140.9	159.3	0	0	0	0	0	107.8
7	C	39.5	Very low	39.7	Very low	118 Å²	118	147 Å²	147	80%	0.797	78%	0.782	S	S	*	*			cis	-155.2	137	9.6	179.6	0	0	0	0	106.1	S9	C7-S9 PolarHBondContact O-N 3.37Å; C7-S9 VanDerWaalsContact O-N 3.17Å
8	L	42.3	Very low	40.1	Very low	162 Å²	162	142.8 Å²	142.8	85%	0.848	76%	0.756	S	S	*	*			trans	-65.2	107.1	166	-75.8	156	0	0	0	108	N10	L8-N10 PolarHBondContact O-N 3.1Å
9	S	40.3	Very low	40.5	Very low	101 Å²	101	139.5 Å²	139.5	71%	0.706	74%	0.742	S	S	*	*			trans	-87.7	98.4	166.5	-161.3	0	0	0	0	108.3	C7 K11	C7-S9 PolarHBondContact O-N 3.37Å; C7-S9 VanDerWaalsContact O-N 3.17Å; S9-K11 PolarHBondContact O-N 3.28Å
10	N	37.3	Very low	40.8	Very low	148 Å²	148	140.7 Å²	140.7	79%	0.791	74%	0.743	S	S	*	*			trans	-56.6	103	158.8	-73.2	-16.8	0	0	0	108.1	L8 S12	L8-N10 PolarHBondContact O-N 3.1Å; N10-S12 PolarHBondContact O-N 2.9Å
11	K	33.6	Very low	41.2	Very low	174 Å²	174	138.9 Å²	138.9	76%	0.757	73%	0.729	S	S	*	*			trans	-87.1	97	157.9	-82.3	-178.5	176.1	173.1	0	106.6	S9 D13	S9-K11 PolarHBondContact O-N 3.28Å; K11-D13 PolarHBondContact O-N 3.45Å
12	S	35.7	Very low	41.6	Very low	105 Å²	105	130.4 Å²	130.4	73%	0.734	69%	0.688	S	S	*	*			trans	-66.3	103.6	161	50.4	0	0	0	0	107.5	N10 S14	N10-S12 PolarHBondContact O-N 2.9Å; S12-S14 PolarHBondContact O-N 2.83Å
13	D	32.4	Very low	41.7	Very low	140 Å²	140	126 Å²	126	75%	0.749	68%	0.679	S	S	*	*			trans	-70.1	84	167.6	-70	-31.9	0	0	0	108.3	K11 Y15	K11-D13 PolarHBondContact O-N 3.45Å; D13-Y15 PolarHBondContact O-N 3.4Å
14	S	34.2	Very low	41	Very low	80 Å²	80	125.4 Å²	125.4	56%	0.559	68%	0.677	S	S	*	*			trans	-75.1	80.5	171.1	-172.9	0	0	0	0	108.6	S12 T16	S12-S14 PolarHBondContact O-N 2.83Å; S14-T16 PolarHBondContact O-N 3.12Å; S14-T16 PolarHBondContact O-OG1 3.43Å; S14-T16 WeakPolarHBondContact OG-CG2 3.3Å; S14-T16 PolarHBondContact OG-OG1 3.38Å
15	Y	39.6	Very low	41	Very low	190 Å²	190	118.2 Å²	118.2	75%	0.745	67%	0.672	S	S	*	*			trans	-66.6	79.8	159.9	-96.6	-91.6	0	0	0	108.1	D13	D13-Y15 PolarHBondContact O-N 3.4Å
16	T	38.9	Very low	40.7	Very low	86 Å²	86	118.4 Å²	118.4	53%	0.528	67%	0.668	S	S	.	*			trans	-120.2	14.7	178.7	46.8	0	0	0	0	113.1	S14	S14-T16 PolarHBondContact O-N 3.12Å; S14-T16 PolarHBondContact O-OG1 3.43Å; S14-T16 WeakPolarHBondContact OG-CG2 3.3Å; S14-T16 PolarHBondContact OG-OG1 3.38Å
17	D	43.3	Very low	40.9	Very low	106 Å²	106	120.6 Å²	120.6	57%	0.567	67%	0.666	S	S	*	*			trans	-111.2	81.1	170.9	-157.8	-1.5	0	0	0	111.5	T19	D17-T19 PolarHBondContact O-N 3.39Å; D17-T19 WeakPolarHBondContact OD1-CB 3.46Å; D17-T19 PolarHBondContact OD1-N 3.22Å; D17-T19 PolarHBondContact OD1-OG1 3.08Å
18	F	45.4	Very low	40.9	Very low	72 Å²	72	125.5 Å²	125.5	32%	0.316	67%	0.668	S	S	.	*	G	3₁₀ helix	trans	-77.3	-0.9	174.4	-72.1	-82.7	0	0	0	112.7	E20 F21 I157	F18-E20 PolarHBondContact O-N 2.93Å; F18-F21 HydrophobicContact CD1-CD2 4.19Å; F18-F21 HydrophobicContact CD1-CE2 4.47Å; F18-F21 PolarHBondContact O-N 3.4Å; F18-I157 HydrophobicContact CE1-CD1 4.03Å; F18-I157 HydrophobicContact CE1-CG1 3.79Å; F18-I157 HydrophobicContact CZ-CG1 3.89Å
19	T	47.8	Very low	40.6	Very low	79 Å²	79	124.7 Å²	124.7	49%	0.485	67%	0.67	S	S	.	*	G	3₁₀ helix	trans	-67.3	-20.5	179.1	63.8	0	0	0	0	112.6	D17 F21 L22	D17-T19 PolarHBondContact O-N 3.39Å; D17-T19 WeakPolarHBondContact OD1-CB 3.46Å; D17-T19 PolarHBondContact OD1-N 3.22Å; D17-T19 PolarHBondContact OD1-OG1 3.08Å; T19-F21 VanDerWaalsContact C-N 3.29Å; T19-F21 PolarHBondContact O-N 3.25Å; T19-L22 PolarHBondContact O-N 3.09Å
20	E	48	Very low	40.5	Very low	163 Å²	163	124.8 Å²	124.8	76%	0.762	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-69.2	-23.9	177.8	-163.6	172.9	-168.6	0	0	113.4	F18	F18-E20 PolarHBondContact O-N 2.93Å
21	F	48.6	Very low	40.5	Very low	103 Å²	103	128.5 Å²	128.5	45%	0.452	67%	0.669	S	S	.	*	G	3₁₀ helix	trans	-90.2	-4.5	179	-59.2	-73	0	0	0	113.7	F18 T19	F18-F21 HydrophobicContact CD1-CD2 4.19Å; F18-F21 HydrophobicContact CD1-CE2 4.47Å; F18-F21 PolarHBondContact O-N 3.4Å; T19-F21 VanDerWaalsContact C-N 3.29Å; T19-F21 PolarHBondContact O-N 3.25Å
22	L	48.8	Very low	41.1	Very low	57 Å²	57	124.1 Å²	124.1	30%	0.298	66%	0.66	S	S	.	*	S	Bend	trans	-85.8	139.5	173.3	-65	172.2	0	0	0	109	T19 Y55	T19-L22 PolarHBondContact O-N 3.09Å; L22-Y55 HydrophobicContact CD2-CD1 4.07Å
23	P	41.2	Very low	41.8	Very low	97 Å²	97	124.8 Å²	124.8	63%	0.63	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-57.5	135.8	179.9	20.6	-30	0	0	0	110.6	A25	P23-A25 PolarHBondContact O-N 3Å
24	P	36.6	Very low	43.5	Very low	118 Å²	118	122 Å²	122	77%	0.766	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-61.1	137.2	179.4	24	-31.6	0	0	0	109.6	Q26	P24-Q26 PolarHBondContact O-N 3.44Å
25	A	43.5	Very low	45.8	Very low	104 Å²	104	119.1 Å²	119.1	86%	0.86	61%	0.614	S	S	*	*			trans	-57.8	103.6	-178.7	0	0	0	0	0	110.1	P23 D27	P23-A25 PolarHBondContact O-N 3Å; A25-D27 PolarHBondContact O-N 3.41Å
26	Q	40	Very low	48	Very low	182 Å²	182	113.1 Å²	113.1	85%	0.85	60%	0.597	S	S	*	*			trans	-76	119.5	168.2	-78.1	-175.2	-23.5	0	0	108.7	P24 R28	P24-Q26 PolarHBondContact O-N 3.44Å; Q26-R28 PolarHBondContact O-N 3.07Å
27	D	42.4	Very low	50.4	Low	148 Å²	148	114.9 Å²	114.9	79%	0.791	60%	0.597	S	S	*	*			trans	-65.1	108.8	177.9	-168.5	15.3	0	0	0	110.6	A25	A25-D27 PolarHBondContact O-N 3.41Å
28	R	39.4	Very low	52.6	Low	220 Å²	220	115.4 Å²	115.4	83%	0.83	60%	0.6	S	S	*	*	S	Bend	trans	174.5	119.8	140.6	-96.8	167.4	-174.6	-146.3	0.4	110.2	Q26	Q26-R28 PolarHBondContact O-N 3.07Å
29	T	34.7	Very low	54.7	Low	145 Å²	145	114.3 Å²	114.3	89%	0.89	60%	0.596	S	S	*	*			trans	62.2	55.7	171.9	35.2	0	0	0	0	115.2	R31	T29-R31 PolarHBondContact O-N 2.95Å; T29-R31 VanDerWaalsContact O-N 3.09Å
30	T	39	Very low	56.9	Low	104 Å²	104	110.6 Å²	110.6	64%	0.638	57%	0.573	S	S	*	*			trans	-76.6	91.7	-176.9	-44	0	0	0	0	111.8	C32	T30-C32 HydrophobicContact CG2-CB 4.14Å; T30-C32 PolarHBondContact O-N 2.92Å
31	R	37.5	Very low	59.1	Low	226 Å²	226	106.4 Å²	106.4	85%	0.853	56%	0.556	S	S	*	*			trans	-63.9	98.3	142.2	-72.2	-172.5	-153	-179.8	6.9	105.3	T29 L33	T29-R31 PolarHBondContact O-N 2.95Å; T29-R31 VanDerWaalsContact O-N 3.09Å; R31-L33 HydrophobicContact CB-CG 4.45Å; R31-L33 PolarHBondContact O-N 2.72Å
32	C	46	Very low	61.4	Low	82 Å²	82	107.9 Å²	107.9	55%	0.554	56%	0.558	S	S	*	*			trans	-65	82.8	169.1	-176.2	0	0	0	0	106.5	T30 K34	T30-C32 HydrophobicContact CG2-CB 4.14Å; T30-C32 PolarHBondContact O-N 2.92Å; C32-K34 PolarHBondContact O-N 3.46Å
33	L	49.4	Very low	63.7	Low	119 Å²	119	105.2 Å²	105.2	62%	0.623	54%	0.544	S	S	*	.			trans	-69.9	88.3	168	-67.8	173.4	0	0	0	105.2	R31 L35	R31-L33 HydrophobicContact CB-CG 4.45Å; R31-L33 PolarHBondContact O-N 2.72Å; L33-L35 PolarHBondContact O-N 3.48Å
34	K	69.6	Low	66.4	Low	80 Å²	80	102.8 Å²	102.8	35%	0.348	53%	0.532	S	S	.	.			trans	-54.7	122.7	170	-71.4	174.1	172	-179.8	0	106.5	C32 T36 Y166 H168	C32-K34 PolarHBondContact O-N 3.46Å; K34-T36 PolarHBondContact O-N 2.87Å; K34-Y166 WeakPolarHBondContact CD-O 3.4Å; K34-H168 WeakPolarHBondContact CE-O 3.48Å; K34-H168 PolarHBondContact NZ-O 2.96Å
35	L	81.8	Confident	69.3	Low	21 Å²	21	102.6 Å²	102.6	11%	0.11	52%	0.524	C	S	.	.			trans	-54.9	114.2	171.3	177.3	67.3	0	0	0	108.1	L33 E39 V40 W43 Y55 L161 Y166	L33-L35 PolarHBondContact O-N 3.48Å; L35-E39 HydrophobicContact CD1-CB 4.28Å; L35-V40 HydrophobicContact CD1-CG2 3.79Å; L35-V40 HydrophobicContact CD2-CG2 3.69Å; L35-V40 HydrophobicContact CG-CG2 3.63Å; L35-W43 HydrophobicContact CD1-CH2 4.19Å; L35-W43 HydrophobicContact CD1-CZ2 3.66Å; L35-W43 HydrophobicContact CD2-CH2 4.08Å; L35-W43 HydrophobicContact CD2-CZ2 4.39Å; L35-Y55 HydrophobicContact CB-CD2 4.31Å; L35-Y55 HydrophobicContact CB-CE2 4.49Å; L35-Y55 HydrophobicContact CD1-CD2 4Å; L35-Y55 HydrophobicContact CD1-CG 4.44Å; L35-L161 HydrophobicContact CD2-CD2 4.29Å; L35-Y166 HydrophobicContact CB-CD2 4.42Å; L35-Y166 HydrophobicContact CD2-CE2 4.38Å
36	T	86.6	Confident	71.9	Confident	64 Å²	64	99.5 Å²	99.5	39%	0.393	50%	0.497	S	S	.	.			trans	-85.1	152.4	179.8	63	0	0	0	0	110.4	K34 D38 E39 V40	K34-T36 PolarHBondContact O-N 2.87Å; T36-D38 PolarHBondContact O-N 2.9Å; T36-E39 PolarHBondContact N-OE2 3.18Å; T36-E39 PolarHBondContact O-N 3.34Å; T36-E39 WeakPolarHBondContact OG1-CB 3.28Å; T36-E39 VanDerWaalsContact OG1-CD 3.24Å; T36-E39 WeakPolarHBondContact OG1-CG 3.29Å; T36-E39 PolarHBondContact OG1-N 3.3Å; T36-E39 PolarHBondContact OG1-OE2 3.14Å; T36-V40 WeakPolarHBondContact O-CG2 3.42Å; T36-V40 PolarHBondContact O-N 3.13Å
37	K	87.9	Confident	74.6	Confident	122 Å²	122	90.8 Å²	90.8	53%	0.53	46%	0.456	S	S	.	.	H	α-helix	trans	-58.7	-38.4	175.4	-173.4	178.5	178	-179.1	0	111.5	E39 V40 I41 L162	K37-E39 VanDerWaalsContact C-N 3.34Å; K37-E39 PolarHBondContact O-N 3Å; K37-V40 PolarHBondContact O-N 3.49Å; K37-I41 HydrophobicContact CG-CD1 4.04Å; K37-I41 HydrophobicContact CG-CG1 4.46Å; K37-I41 WeakPolarHBondContact O-CG1 3.45Å; K37-I41 PolarHBondContact O-N 2.97Å; K37-L162 VanDerWaalsContact CE-O 3.28Å; K37-L162 WeakPolarHBondContact CE-O 3.25Å
38	D	89.8	Confident	77.3	Confident	117 Å²	117	88.4 Å²	88.4	63%	0.626	44%	0.443	S	S	*	.	H	α-helix	trans	-63.8	-39.1	178.9	-62	-20.2	0	0	0	111.7	T36 V40 I41 R42	T36-D38 PolarHBondContact O-N 2.9Å; D38-V40 VanDerWaalsContact C-N 3.35Å; D38-V40 PolarHBondContact O-N 2.71Å; D38-I41 PolarHBondContact O-N 2.9Å; D38-R42 WeakPolarHBondContact O-CG 3.31Å; D38-R42 PolarHBondContact O-N 3.26Å; D38-R42 VanDerWaalsContact O-N 3.07Å
39	E	91	Very high	80	Confident	49 Å²	49	80.3 Å²	80.3	23%	0.229	42%	0.418	C	S	.	.	H	α-helix	trans	-62.6	-40.7	173.1	-75	165.2	142.6	0	0	112.3	L35 T36 K37 R42 W43	L35-E39 HydrophobicContact CD1-CB 4.28Å; T36-E39 PolarHBondContact N-OE2 3.18Å; T36-E39 PolarHBondContact O-N 3.34Å; T36-E39 WeakPolarHBondContact OG1-CB 3.28Å; T36-E39 VanDerWaalsContact OG1-CD 3.24Å; T36-E39 WeakPolarHBondContact OG1-CG 3.29Å; T36-E39 PolarHBondContact OG1-N 3.3Å; T36-E39 PolarHBondContact OG1-OE2 3.14Å; K37-E39 VanDerWaalsContact C-N 3.34Å; K37-E39 PolarHBondContact O-N 3Å; E39-R42 PolarHBondContact O-N 3.1Å; E39-W43 PolarHBondContact O-N 2.68Å; E39-W43 PolarHBondContact O-NE1 3.01Å
40	V	93.7	Very high	83	Confident	1 Å²	1	73.4 Å²	73.4	1%	0.006	38%	0.376	C	S	.	.	H	α-helix	trans	-67.6	-38.8	177.4	-178.1	0	0	0	0	111.4	L35 T36 K37 D38 R42 W43 Y158 L161 L162	L35-V40 HydrophobicContact CD1-CG2 3.79Å; L35-V40 HydrophobicContact CD2-CG2 3.69Å; L35-V40 HydrophobicContact CG-CG2 3.63Å; T36-V40 WeakPolarHBondContact O-CG2 3.42Å; T36-V40 PolarHBondContact O-N 3.13Å; K37-V40 PolarHBondContact O-N 3.49Å; D38-V40 VanDerWaalsContact C-N 3.35Å; D38-V40 PolarHBondContact O-N 2.71Å; V40-R42 VanDerWaalsContact C-N 3.33Å; V40-R42 PolarHBondContact O-N 3.2Å; V40-W43 HydrophobicContact CG1-CE3 4.14Å; V40-W43 HydrophobicContact CG1-CZ3 4.21Å; V40-W43 HydrophobicContact CG2-CH2 4.22Å; V40-W43 HydrophobicContact CG2-CZ2 4.3Å; V40-W43 WeakPolarHBondContact O-CB 3.46Å; V40-W43 PolarHBondContact O-N 2.82Å; V40-Y158 HydrophobicContact CG1-CD2 4.17Å; V40-Y158 HydrophobicContact CG1-CE2 3.64Å; V40-Y158 WeakPolarHBondContact O-CE2 3.33Å; V40-Y158 PolarHBondContact O-OH 3.05Å; V40-L161 HydrophobicContact CG1-CB 4Å; V40-L162 HydrophobicContact CB-CD2 4.11Å; V40-L162 HydrophobicContact CG1-CD2 3.63Å; V40-L162 HydrophobicContact CG1-CG 3.97Å
41	I	94.4	Very high	85.8	Confident	76 Å²	76	68.8 Å²	68.8	39%	0.39	35%	0.347	S	S	.	.	H	α-helix	trans	-60.5	-45.3	175.8	-70.4	166.3	0	0	0	110.2	K37 D38 W43 A44 L162	K37-I41 HydrophobicContact CG-CD1 4.04Å; K37-I41 HydrophobicContact CG-CG1 4.46Å; K37-I41 WeakPolarHBondContact O-CG1 3.45Å; K37-I41 PolarHBondContact O-N 2.97Å; D38-I41 PolarHBondContact O-N 2.9Å; I41-W43 PolarHBondContact O-N 3.41Å; I41-W43 VanDerWaalsContact O-N 3.12Å; I41-A44 WeakPolarHBondContact O-CB 3.47Å; I41-A44 PolarHBondContact O-N 3.23Å; I41-L162 HydrophobicContact CG1-CD2 3.6Å
42	R	96.2	Very high	88.6	Confident	133 Å²	133	62.7 Å²	62.7	50%	0.502	34%	0.339	S	S	.	.	H	α-helix	trans	-61.9	-20.8	179.9	-72.2	-167.7	-60.6	-166.2	0.7	114.2	D38 E39 V40 A44 D45 V49	D38-R42 WeakPolarHBondContact O-CG 3.31Å; D38-R42 PolarHBondContact O-N 3.26Å; D38-R42 VanDerWaalsContact O-N 3.07Å; E39-R42 PolarHBondContact O-N 3.1Å; V40-R42 VanDerWaalsContact C-N 3.33Å; V40-R42 PolarHBondContact O-N 3.2Å; R42-A44 PolarHBondContact O-N 3.14Å; R42-A44 VanDerWaalsContact O-N 3.13Å; R42-D45 WeakPolarHBondContact CA-OD2 3.23Å; R42-D45 WeakPolarHBondContact CG-OD2 3.27Å; R42-D45 VanDerWaalsContact O-CB 3.25Å; R42-D45 WeakPolarHBondContact O-CB 3.37Å; R42-D45 PolarHBondContact O-N 2.95Å; R42-V49 HydrophobicContact CB-CG1 4.24Å; R42-V49 WeakPolarHBondContact O-CG1 3.28Å
43	W	97.1	Very high	90.9	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.008	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-18.7	173.4	-61.8	-8.1	0	0	0	113.3	L35 E39 V40 I41 L50 H53 G56 A59 Y149 F152 Y158 L161	L35-W43 HydrophobicContact CD1-CH2 4.19Å; L35-W43 HydrophobicContact CD1-CZ2 3.66Å; L35-W43 HydrophobicContact CD2-CH2 4.08Å; L35-W43 HydrophobicContact CD2-CZ2 4.39Å; E39-W43 PolarHBondContact O-N 2.68Å; E39-W43 PolarHBondContact O-NE1 3.01Å; V40-W43 HydrophobicContact CG1-CE3 4.14Å; V40-W43 HydrophobicContact CG1-CZ3 4.21Å; V40-W43 HydrophobicContact CG2-CH2 4.22Å; V40-W43 HydrophobicContact CG2-CZ2 4.3Å; V40-W43 WeakPolarHBondContact O-CB 3.46Å; V40-W43 PolarHBondContact O-N 2.82Å; I41-W43 PolarHBondContact O-N 3.41Å; I41-W43 VanDerWaalsContact O-N 3.12Å; W43-L50 HydrophobicContact CB-CB 4.19Å; W43-L50 HydrophobicContact CB-CD1 3.73Å; W43-L50 HydrophobicContact CD2-CD1 3.71Å; W43-L50 HydrophobicContact CE3-CD1 3.68Å; W43-L50 HydrophobicContact CG-CD1 3.74Å; W43-H53 AromaticContact CE2-ND1 3.57Å; W43-H53 AromaticContact CZ2-CE1 3.83Å; W43-H53 AromaticContact CZ2-ND1 3.38Å; W43-H53 WeakPolarHBondContact CZ2-ND1 3.5Å; W43-H53 AromaticContact NE1-CE1 3.92Å; W43-H53 AromaticContact NE1-CG 3.4Å; W43-H53 AromaticContact NE1-ND1 3.28Å; W43-H53 PolarHBondContact NE1-ND1 3.06Å; W43-G56 VanDerWaalsContact CZ2-CA 3.48Å; W43-G56 VanDerWaalsContact CZ2-N 3.26Å; W43-A59 HydrophobicContact CH2-CB 4.44Å; W43-A59 HydrophobicContact CZ3-CB 3.99Å; W43-Y149 PolarHBondContact O-OH 3.22Å; W43-F152 HydrophobicContact CE3-CE1 4.49Å; W43-F152 HydrophobicContact CE3-CZ 4.34Å; W43-Y158 HydrophobicContact CB-CE2 4.25Å; W43-Y158 HydrophobicContact CE3-CD2 4.13Å; W43-Y158 AromaticContact CE3-CE2 3.95Å; W43-Y158 HydrophobicContact CE3-CE2 3.95Å; W43-L161 HydrophobicContact CH2-CD1 4.28Å; W43-L161 HydrophobicContact CZ3-CD1 3.82Å
44	A	97.1	Very high	93	Very high	46 Å²	46	61.5 Å²	61.5	38%	0.38	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-13.8	173.9	0	0	0	0	0	113.3	I41 R42 Y149 L153	I41-A44 WeakPolarHBondContact O-CB 3.47Å; I41-A44 PolarHBondContact O-N 3.23Å; R42-A44 PolarHBondContact O-N 3.14Å; R42-A44 VanDerWaalsContact O-N 3.13Å; A44-Y149 VanDerWaalsContact C-OH 3.28Å; A44-Y149 WeakPolarHBondContact CA-OH 3.15Å; A44-Y149 PolarHBondContact O-OH 3.39Å; A44-L153 HydrophobicContact CB-CD1 4.09Å; A44-L153 HydrophobicContact CB-CD2 4.04Å
45	D	97.1	Very high	94.1	Very high	113 Å²	113	60.6 Å²	60.6	60%	0.604	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-42	-176.9	-64.7	-17.8	0	0	0	111.2	R42	R42-D45 WeakPolarHBondContact CA-OD2 3.23Å; R42-D45 WeakPolarHBondContact CG-OD2 3.27Å; R42-D45 VanDerWaalsContact O-CB 3.25Å; R42-D45 WeakPolarHBondContact O-CB 3.37Å; R42-D45 PolarHBondContact O-N 2.95Å
46	S	98.1	Very high	94.8	Very high	39 Å²	39	59.6 Å²	59.6	27%	0.273	31%	0.31	S	S	.	.			trans	-161.1	160.5	170.4	79.2	0	0	0	0	111.7	D48 V49 L50	S46-D48 VanDerWaalsContact C-N 3.27Å; S46-D48 PolarHBondContact O-N 3.45Å; S46-D48 PolarHBondContact OG-N 3.31Å; S46-V49 PolarHBondContact O-N 2.91Å; S46-V49 VanDerWaalsContact O-N 3.16Å; S46-V49 WeakPolarHBondContact OG-CG2 3.48Å; S46-V49 PolarHBondContact OG-N 3.06Å; S46-V49 VanDerWaalsContact OG-N 3.13Å; S46-L50 PolarHBondContact O-N 3.44Å; S46-L50 VanDerWaalsContact O-N 3.16Å
47	F	98.3	Very high	95.3	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63	-36.6	175.4	-170.7	-134.8	0	0	0	111.8	V49 L50 L51 F60 H141 M144 E145 Y149	F47-V49 VanDerWaalsContact C-N 3.32Å; F47-V49 PolarHBondContact O-N 2.71Å; F47-L50 HydrophobicContact CD2-CD2 3.96Å; F47-L50 HydrophobicContact CE2-CD2 4.05Å; F47-L50 WeakPolarHBondContact O-CB 3.49Å; F47-L50 PolarHBondContact O-N 3.18Å; F47-L51 HydrophobicContact CD1-CD1 4.13Å; F47-L51 HydrophobicContact CD1-CG 4.49Å; F47-L51 HydrophobicContact CD2-CD2 4.39Å; F47-L51 HydrophobicContact CD2-CG 4.18Å; F47-L51 HydrophobicContact CE1-CD1 3.66Å; F47-L51 HydrophobicContact CE1-CG 4.24Å; F47-L51 HydrophobicContact CE2-CD1 4.19Å; F47-L51 HydrophobicContact CE2-CD2 3.71Å; F47-L51 HydrophobicContact CE2-CG 3.9Å; F47-L51 HydrophobicContact CG-CG 4.46Å; F47-L51 HydrophobicContact CZ-CD1 3.69Å; F47-L51 HydrophobicContact CZ-CD2 3.85Å; F47-L51 HydrophobicContact CZ-CG 3.92Å; F47-L51 WeakPolarHBondContact O-CG 3.37Å; F47-L51 PolarHBondContact O-N 3.22Å; F47-F60 AromaticContact CE2-CD1 3.93Å; F47-F60 HydrophobicContact CE2-CD1 3.93Å; F47-F60 AromaticContact CE2-CE1 3.46Å; F47-F60 HydrophobicContact CE2-CE1 3.46Å; F47-F60 VanDerWaalsContact CE2-CE1 3.46Å; F47-F60 HydrophobicContact CE2-CE2 4.23Å; F47-F60 HydrophobicContact CE2-CG 4.48Å; F47-F60 AromaticContact CE2-CZ 3.63Å; F47-F60 HydrophobicContact CE2-CZ 3.63Å; F47-F60 HydrophobicContact CZ-CD1 4.25Å; F47-F60 AromaticContact CZ-CE1 3.53Å; F47-F60 HydrophobicContact CZ-CE1 3.53Å; F47-F60 AromaticContact CZ-CZ 3.91Å; F47-F60 HydrophobicContact CZ-CZ 3.91Å; F47-H141 AromaticContact CD1-CD2 3.75Å; F47-H141 AromaticContact CD1-CE1 3.46Å; F47-H141 VanDerWaalsContact CD1-CE1 3.46Å; F47-H141 WeakPolarHBondContact CD1-CE1 3.45Å; F47-H141 AromaticContact CD1-ND1 3.98Å; F47-H141 AromaticContact CD1-NE2 3.27Å; F47-H141 VanDerWaalsContact CD1-NE2 3.27Å; F47-H141 WeakPolarHBondContact CD1-NE2 3.36Å; F47-H141 AromaticContact CE1-CD2 3.64Å; F47-H141 AromaticContact CE1-NE2 3.66Å; F47-M144 HydrophobicContact CE1-CB 3.78Å; F47-M144 HydrophobicContact CE1-CE 4.2Å; F47-M144 HydrophobicContact CZ-CB 3.57Å; F47-M144 HydrophobicContact CZ-CE 4.08Å; F47-M144 HydrophobicContact CZ-SD 4.33Å; F47-E145 HydrophobicContact CB-CB 4.29Å; F47-E145 HydrophobicContact CB-CG 3.88Å; F47-E145 HydrophobicContact CD1-CB 3.62Å; F47-E145 HydrophobicContact CD1-CG 4.15Å; F47-E145 HydrophobicContact CE1-CB 4.21Å; F47-E145 HydrophobicContact CG-CB 4.13Å; F47-E145 HydrophobicContact CG-CG 4.27Å; F47-Y149 HydrophobicContact CB-CD1 4.01Å; F47-Y149 HydrophobicContact CB-CE1 4.08Å; F47-Y149 HydrophobicContact CB-CG 4.25Å; F47-Y149 HydrophobicContact CD2-CD1 4.25Å; F47-Y149 AromaticContact CD2-CD2 3.58Å; F47-Y149 HydrophobicContact CD2-CD2 3.58Å; F47-Y149 HydrophobicContact CD2-CE2 4.17Å; F47-Y149 AromaticContact CD2-CG 3.62Å; F47-Y149 HydrophobicContact CD2-CG 3.62Å; F47-Y149 HydrophobicContact CE2-CD2 4.26Å; F47-Y149 HydrophobicContact CE2-CG 4.32Å; F47-Y149 HydrophobicContact CG-CD1 4.39Å; F47-Y149 HydrophobicContact CG-CD2 4.45Å; F47-Y149 HydrophobicContact CG-CG 4.18Å
48	D	97.8	Very high	95.7	Very high	98 Å²	98	53.5 Å²	53.5	52%	0.524	28%	0.284	S	S	.	.	H	α-helix	trans	-59.5	-41	173.4	-64.4	-51.6	0	0	0	112.3	S46 L51 S52 H141	S46-D48 VanDerWaalsContact C-N 3.27Å; S46-D48 PolarHBondContact O-N 3.45Å; S46-D48 PolarHBondContact OG-N 3.31Å; D48-L51 PolarHBondContact O-N 3.24Å; D48-S52 VanDerWaalsContact O-CB 3.27Å; D48-S52 WeakPolarHBondContact O-CB 3.35Å; D48-S52 PolarHBondContact O-N 2.83Å; D48-S52 PolarHBondContact O-OG 2.95Å; D48-H141 IonicContact OD1-CE1 2.73Å; D48-H141 IonicContact OD1-NE2 3.24Å; D48-H141 PolarHBondContact OD1-NE2 3.25Å
49	V	97.6	Very high	96	Very high	49 Å²	49	48.5 Å²	48.5	30%	0.297	26%	0.259	S	S	.	.	H	α-helix	trans	-62.8	-45.1	177	173.8	0	0	0	0	110.3	R42 S46 F47 S52 H53	R42-V49 HydrophobicContact CB-CG1 4.24Å; R42-V49 WeakPolarHBondContact O-CG1 3.28Å; S46-V49 PolarHBondContact O-N 2.91Å; S46-V49 VanDerWaalsContact O-N 3.16Å; S46-V49 WeakPolarHBondContact OG-CG2 3.48Å; S46-V49 PolarHBondContact OG-N 3.06Å; S46-V49 VanDerWaalsContact OG-N 3.13Å; F47-V49 VanDerWaalsContact C-N 3.32Å; F47-V49 PolarHBondContact O-N 2.71Å; V49-S52 PolarHBondContact O-N 2.96Å; V49-S52 PolarHBondContact O-OG 3.44Å; V49-H53 PolarHBondContact O-N 2.77Å
50	L	97.8	Very high	96.3	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.3	-50.2	174.8	174.3	68.7	0	0	0	111.9	W43 S46 F47 H53 G56 L57 F60 Y149 F152	W43-L50 HydrophobicContact CB-CB 4.19Å; W43-L50 HydrophobicContact CB-CD1 3.73Å; W43-L50 HydrophobicContact CD2-CD1 3.71Å; W43-L50 HydrophobicContact CE3-CD1 3.68Å; W43-L50 HydrophobicContact CG-CD1 3.74Å; S46-L50 PolarHBondContact O-N 3.44Å; S46-L50 VanDerWaalsContact O-N 3.16Å; F47-L50 HydrophobicContact CD2-CD2 3.96Å; F47-L50 HydrophobicContact CE2-CD2 4.05Å; F47-L50 WeakPolarHBondContact O-CB 3.49Å; F47-L50 PolarHBondContact O-N 3.18Å; L50-H53 PolarHBondContact O-N 3.24Å; L50-G56 VanDerWaalsContact CD1-CA 3.46Å; L50-L57 PolarHBondContact O-N 3.31Å; L50-F60 HydrophobicContact CD2-CB 3.99Å; L50-F60 HydrophobicContact CD2-CD2 3.9Å; L50-F60 HydrophobicContact CD2-CG 3.91Å; L50-F60 HydrophobicContact CG-CB 4.46Å; L50-Y149 HydrophobicContact CB-CE2 4.33Å; L50-Y149 HydrophobicContact CD2-CD2 3.61Å; L50-Y149 HydrophobicContact CD2-CE2 3.72Å; L50-F152 HydrophobicContact CD1-CE1 3.7Å; L50-F152 HydrophobicContact CD1-CZ 4.16Å; L50-F152 HydrophobicContact CD2-CD1 3.91Å; L50-F152 HydrophobicContact CD2-CE1 3.84Å; L50-F152 HydrophobicContact CG-CE1 4.47Å
51	L	97.6	Very high	96.5	Very high	8 Å²	8	49.9 Å²	49.9	4%	0.042	26%	0.262	C	S	.	.	H	α-helix	trans	-71.6	-29.8	-175.5	-64.3	-166.6	0	0	0	113.3	F47 D48 H53 L57 F60 I73 W76	F47-L51 HydrophobicContact CD1-CD1 4.13Å; F47-L51 HydrophobicContact CD1-CG 4.49Å; F47-L51 HydrophobicContact CD2-CD2 4.39Å; F47-L51 HydrophobicContact CD2-CG 4.18Å; F47-L51 HydrophobicContact CE1-CD1 3.66Å; F47-L51 HydrophobicContact CE1-CG 4.24Å; F47-L51 HydrophobicContact CE2-CD1 4.19Å; F47-L51 HydrophobicContact CE2-CD2 3.71Å; F47-L51 HydrophobicContact CE2-CG 3.9Å; F47-L51 HydrophobicContact CG-CG 4.46Å; F47-L51 HydrophobicContact CZ-CD1 3.69Å; F47-L51 HydrophobicContact CZ-CD2 3.85Å; F47-L51 HydrophobicContact CZ-CG 3.92Å; F47-L51 WeakPolarHBondContact O-CG 3.37Å; F47-L51 PolarHBondContact O-N 3.22Å; D48-L51 PolarHBondContact O-N 3.24Å; L51-H53 PolarHBondContact O-N 2.73Å; L51-L57 HydrophobicContact CD2-CD1 3.91Å; L51-F60 HydrophobicContact CD2-CD1 4.1Å; L51-I73 HydrophobicContact CD1-CD1 4.4Å; L51-I73 HydrophobicContact CD2-CD1 3.71Å; L51-W76 HydrophobicContact CB-CH2 3.88Å; L51-W76 HydrophobicContact CB-CZ2 4.25Å; L51-W76 HydrophobicContact CB-CZ3 4.34Å; L51-W76 HydrophobicContact CD1-CD2 4.04Å; L51-W76 HydrophobicContact CD1-CE3 4.27Å; L51-W76 HydrophobicContact CD1-CH2 4Å; L51-W76 HydrophobicContact CD1-CZ2 3.73Å; L51-W76 HydrophobicContact CD1-CZ3 4.26Å
52	S	95.6	Very high	96.6	Very high	98 Å²	98	47 Å²	47	69%	0.685	25%	0.249	S	C	*	.	H	α-helix	trans	-67.6	-23.2	175.7	74.8	0	0	0	0	112.9	D48 V49	D48-S52 VanDerWaalsContact O-CB 3.27Å; D48-S52 WeakPolarHBondContact O-CB 3.35Å; D48-S52 PolarHBondContact O-N 2.83Å; D48-S52 PolarHBondContact O-OG 2.95Å; V49-S52 PolarHBondContact O-N 2.96Å; V49-S52 PolarHBondContact O-OG 3.44Å
53	H	94.8	Very high	96.7	Very high	41 Å²	41	41 Å²	41	19%	0.19	23%	0.227	C	C	.	.	S	Bend	trans	-95.1	121.1	-175.8	-166.3	-94.4	0	0	0	111.3	W43 V49 L50 L51 Y55 G56 L57	W43-H53 AromaticContact CE2-ND1 3.57Å; W43-H53 AromaticContact CZ2-CE1 3.83Å; W43-H53 AromaticContact CZ2-ND1 3.38Å; W43-H53 WeakPolarHBondContact CZ2-ND1 3.5Å; W43-H53 AromaticContact NE1-CE1 3.92Å; W43-H53 AromaticContact NE1-CG 3.4Å; W43-H53 AromaticContact NE1-ND1 3.28Å; W43-H53 PolarHBondContact NE1-ND1 3.06Å; V49-H53 PolarHBondContact O-N 2.77Å; L50-H53 PolarHBondContact O-N 3.24Å; L51-H53 PolarHBondContact O-N 2.73Å; H53-Y55 VanDerWaalsContact C-N 3.26Å; H53-Y55 AromaticContact CE1-CD2 3.67Å; H53-Y55 PolarHBondContact ND1-N 2.91Å; H53-Y55 PolarHBondContact O-N 3.44Å; H53-Y55 VanDerWaalsContact O-N 3.09Å; H53-G56 PolarHBondContact ND1-N 2.97Å; H53-G56 WeakPolarHBondContact O-CA 3.15Å; H53-G56 PolarHBondContact O-N 3.18Å; H53-L57 PolarHBondContact O-N 3.17Å
54	K	93.1	Very high	96.8	Very high	135 Å²	135	40.9 Å²	40.9	59%	0.587	23%	0.226	S	C	*	.	H	α-helix	trans	-52.4	-39.9	-174.7	69.9	179.5	-175	170.7	0	114.5	A58	K54-A58 PolarHBondContact O-N 2.79Å
55	Y	93.4	Very high	96.8	Very high	60 Å²	60	42.9 Å²	42.9	24%	0.235	23%	0.227	C	C	.	.	H	α-helix	trans	-80	-27.2	178.7	-62.6	-62.1	0	0	0	112	L22 L35 H53 A59	L22-Y55 HydrophobicContact CD2-CD1 4.07Å; L35-Y55 HydrophobicContact CB-CD2 4.31Å; L35-Y55 HydrophobicContact CB-CE2 4.49Å; L35-Y55 HydrophobicContact CD1-CD2 4Å; L35-Y55 HydrophobicContact CD1-CG 4.44Å; H53-Y55 VanDerWaalsContact C-N 3.26Å; H53-Y55 AromaticContact CE1-CD2 3.67Å; H53-Y55 PolarHBondContact ND1-N 2.91Å; H53-Y55 PolarHBondContact O-N 3.44Å; H53-Y55 VanDerWaalsContact O-N 3.09Å; Y55-A59 VanDerWaalsContact O-CB 3.32Å; Y55-A59 WeakPolarHBondContact O-CB 3.33Å; Y55-A59 PolarHBondContact O-N 3.28Å
56	G	95.6	Very high	96.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-68	-49.5	175.2	0	0	0	0	0	110.4	W43 L50 H53 A58 A59 F60	W43-G56 VanDerWaalsContact CZ2-CA 3.48Å; W43-G56 VanDerWaalsContact CZ2-N 3.26Å; L50-G56 VanDerWaalsContact CD1-CA 3.46Å; H53-G56 PolarHBondContact ND1-N 2.97Å; H53-G56 WeakPolarHBondContact O-CA 3.15Å; H53-G56 PolarHBondContact O-N 3.18Å; G56-A58 VanDerWaalsContact C-N 3.33Å; G56-A58 PolarHBondContact O-N 2.96Å; G56-A59 PolarHBondContact O-N 2.53Å; G56-F60 WeakPolarHBondContact O-CB 3.48Å; G56-F60 PolarHBondContact O-N 3.32Å
57	L	97	Very high	96.7	Very high	32 Å²	32	42.7 Å²	42.7	17%	0.168	22%	0.224	C	C	.	.	H	α-helix	trans	-54.4	-46.7	172.4	-176.8	64.7	0	0	0	112.3	L50 L51 H53 F60 R61 I73 W76 M77	L50-L57 PolarHBondContact O-N 3.31Å; L51-L57 HydrophobicContact CD2-CD1 3.91Å; H53-L57 PolarHBondContact O-N 3.17Å; L57-F60 PolarHBondContact O-N 3.33Å; L57-R61 WeakPolarHBondContact O-CB 3.39Å; L57-R61 PolarHBondContact O-N 3.38Å; L57-I73 HydrophobicContact CD1-CD1 3.61Å; L57-I73 HydrophobicContact CD1-CG1 3.73Å; L57-W76 HydrophobicContact CD1-CZ3 4.25Å; L57-M77 HydrophobicContact CD1-CG 4.24Å; L57-M77 HydrophobicContact CD1-SD 4.15Å; L57-M77 HydrophobicContact CD2-CG 4.21Å; L57-M77 HydrophobicContact CD2-SD 3.93Å; L57-M77 HydrophobicContact CG-SD 4.18Å
58	A	95.8	Very high	96.6	Very high	26 Å²	26	51.3 Å²	51.3	22%	0.215	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-44.5	178.5	0	0	0	0	0	112.6	K54 G56 R61 A62	K54-A58 PolarHBondContact O-N 2.79Å; G56-A58 VanDerWaalsContact C-N 3.33Å; G56-A58 PolarHBondContact O-N 2.96Å; A58-R61 PolarHBondContact O-N 3.3Å; A58-A62 WeakPolarHBondContact O-CB 3.12Å; A58-A62 PolarHBondContact O-N 3.47Å
59	A	96.3	Very high	96.6	Very high	12 Å²	12	47.4 Å²	47.4	10%	0.099	24%	0.242	C	C	.	.	H	α-helix	trans	-64.3	-42.1	177.4	0	0	0	0	0	111.8	W43 Y55 G56 A62 F63 F152 L161	W43-A59 HydrophobicContact CH2-CB 4.44Å; W43-A59 HydrophobicContact CZ3-CB 3.99Å; Y55-A59 VanDerWaalsContact O-CB 3.32Å; Y55-A59 WeakPolarHBondContact O-CB 3.33Å; Y55-A59 PolarHBondContact O-N 3.28Å; G56-A59 PolarHBondContact O-N 2.53Å; A59-A62 PolarHBondContact O-N 2.93Å; A59-F63 PolarHBondContact O-N 3.15Å; A59-F152 HydrophobicContact CB-CE2 4.09Å; A59-F152 HydrophobicContact CB-CZ 4.01Å; A59-L161 HydrophobicContact CB-CD1 3.79Å
60	F	98.3	Very high	96.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.6	-43.1	177.6	-170.9	-118	0	0	0	111.7	F47 L50 L51 G56 L57 A62 F63 L64 I73 M144 F152	F47-F60 AromaticContact CE2-CD1 3.93Å; F47-F60 HydrophobicContact CE2-CD1 3.93Å; F47-F60 AromaticContact CE2-CE1 3.46Å; F47-F60 HydrophobicContact CE2-CE1 3.46Å; F47-F60 VanDerWaalsContact CE2-CE1 3.46Å; F47-F60 HydrophobicContact CE2-CE2 4.23Å; F47-F60 HydrophobicContact CE2-CG 4.48Å; F47-F60 AromaticContact CE2-CZ 3.63Å; F47-F60 HydrophobicContact CE2-CZ 3.63Å; F47-F60 HydrophobicContact CZ-CD1 4.25Å; F47-F60 AromaticContact CZ-CE1 3.53Å; F47-F60 HydrophobicContact CZ-CE1 3.53Å; F47-F60 AromaticContact CZ-CZ 3.91Å; F47-F60 HydrophobicContact CZ-CZ 3.91Å; L50-F60 HydrophobicContact CD2-CB 3.99Å; L50-F60 HydrophobicContact CD2-CD2 3.9Å; L50-F60 HydrophobicContact CD2-CG 3.91Å; L50-F60 HydrophobicContact CG-CB 4.46Å; L51-F60 HydrophobicContact CD2-CD1 4.1Å; G56-F60 WeakPolarHBondContact O-CB 3.48Å; G56-F60 PolarHBondContact O-N 3.32Å; L57-F60 PolarHBondContact O-N 3.33Å; F60-A62 VanDerWaalsContact C-N 3.34Å; F60-A62 PolarHBondContact O-N 3.1Å; F60-F63 HydrophobicContact CD2-CD1 4.28Å; F60-F63 HydrophobicContact CE2-CD1 4.18Å; F60-F63 WeakPolarHBondContact O-CB 3.49Å; F60-F63 PolarHBondContact O-N 3.02Å; F60-L64 HydrophobicContact CD1-CD1 3.89Å; F60-L64 HydrophobicContact CD1-CG 4.37Å; F60-L64 HydrophobicContact CE1-CD1 3.52Å; F60-L64 HydrophobicContact CE1-CD2 4.36Å; F60-L64 HydrophobicContact CE1-CG 4.06Å; F60-L64 HydrophobicContact CE2-CD2 4.35Å; F60-L64 HydrophobicContact CE2-CG 4.42Å; F60-L64 HydrophobicContact CZ-CD1 3.99Å; F60-L64 HydrophobicContact CZ-CD2 3.97Å; F60-L64 HydrophobicContact CZ-CG 4.09Å; F60-L64 WeakPolarHBondContact O-CG 3.46Å; F60-L64 PolarHBondContact O-N 2.7Å; F60-I73 HydrophobicContact CD1-CD1 4.18Å; F60-I73 HydrophobicContact CD1-CG1 4.32Å; F60-I73 HydrophobicContact CE1-CD1 4.46Å; F60-M144 HydrophobicContact CE1-CB 4.27Å; F60-M144 HydrophobicContact CE1-CG 4.49Å; F60-M144 HydrophobicContact CE1-SD 3.87Å; F60-M144 HydrophobicContact CZ-CB 4.2Å; F60-F152 HydrophobicContact CD2-CB 3.76Å; F60-F152 HydrophobicContact CD2-CD1 4Å; F60-F152 AromaticContact CD2-CD2 3.98Å; F60-F152 HydrophobicContact CD2-CD2 3.98Å; F60-F152 AromaticContact CD2-CG 3.63Å; F60-F152 HydrophobicContact CD2-CG 3.63Å; F60-F152 HydrophobicContact CE2-CB 3.8Å; F60-F152 HydrophobicContact CE2-CG 4.19Å
61	R	98.2	Very high	96.6	Very high	80 Å²	80	48.2 Å²	48.2	30%	0.302	24%	0.244	S	C	.	.	H	α-helix	trans	-58.6	-44.8	172.7	-177.6	-173.6	179	164.9	11.9	111.9	L57 A58 F63 L64 K65 I73 E74	L57-R61 WeakPolarHBondContact O-CB 3.39Å; L57-R61 PolarHBondContact O-N 3.38Å; A58-R61 PolarHBondContact O-N 3.3Å; R61-F63 VanDerWaalsContact C-N 3.3Å; R61-F63 PolarHBondContact O-N 3.39Å; R61-L64 PolarHBondContact O-N 3.28Å; R61-K65 WeakPolarHBondContact O-CG 3.33Å; R61-K65 PolarHBondContact O-N 2.98Å; R61-K65 VanDerWaalsContact O-N 3.1Å; R61-I73 HydrophobicContact CB-CG2 4.07Å; R61-I73 HydrophobicContact CG-CG2 3.97Å; R61-E74 VanDerWaalsContact CD-OE1 3.24Å; R61-E74 WeakPolarHBondContact CD-OE1 3.49Å; R61-E74 IonicContact CZ-OE1 2.65Å; R61-E74 IonicContact CZ-OE2 2.71Å; R61-E74 IonicContact NE-OE1 3.8Å; R61-E74 PolarHBondContact NE-OE1 2.87Å; R61-E74 IonicContact NH1-OE1 3.6Å; R61-E74 PolarHBondContact NH1-OE1 2.95Å; R61-E74 IonicContact NH1-OE2 2.73Å; R61-E74 IonicContact NH2-OE1 2.73Å; R61-E74 PolarHBondContact NH2-OE1 3.41Å; R61-E74 IonicContact NH2-OE2 2.68Å; R61-E74 PolarHBondContact NH2-OE2 2.95Å
62	A	96.8	Very high	96.7	Very high	15 Å²	15	48.2 Å²	48.2	12%	0.124	24%	0.243	C	C	.	.	H	α-helix	trans	-61.2	-41.3	177	0	0	0	0	0	111.5	A58 A59 F60 K65 T66	A58-A62 WeakPolarHBondContact O-CB 3.12Å; A58-A62 PolarHBondContact O-N 3.47Å; A59-A62 PolarHBondContact O-N 2.93Å; F60-A62 VanDerWaalsContact C-N 3.34Å; F60-A62 PolarHBondContact O-N 3.1Å; A62-K65 PolarHBondContact O-N 2.86Å; A62-T66 PolarHBondContact O-N 3.45Å
63	F	98.2	Very high	96.8	Very high	7 Å²	7	43.5 Å²	43.5	3%	0.031	21%	0.211	C	C	.	.	H	α-helix	trans	-61.4	-49	173.9	168.8	-100	0	0	0	112.6	A59 F60 R61 K65 T66 E67 S148 R151 F152 I157	A59-F63 PolarHBondContact O-N 3.15Å; F60-F63 HydrophobicContact CD2-CD1 4.28Å; F60-F63 HydrophobicContact CE2-CD1 4.18Å; F60-F63 WeakPolarHBondContact O-CB 3.49Å; F60-F63 PolarHBondContact O-N 3.02Å; R61-F63 VanDerWaalsContact C-N 3.3Å; R61-F63 PolarHBondContact O-N 3.39Å; F63-K65 PolarHBondContact O-N 3.29Å; F63-T66 WeakPolarHBondContact O-CB 3.5Å; F63-T66 PolarHBondContact O-N 3.12Å; F63-T66 PolarHBondContact O-OG1 3.41Å; F63-E67 WeakPolarHBondContact CE1-OE2 3.38Å; F63-E67 HydrophobicContact CE2-CG 4.29Å; F63-E67 WeakPolarHBondContact CE2-OE1 3.43Å; F63-E67 HydrophobicContact CZ-CG 4.18Å; F63-E67 WeakPolarHBondContact CZ-OE1 3.48Å; F63-E67 WeakPolarHBondContact CZ-OE2 3.24Å; F63-E67 PolarHBondContact O-N 3.01Å; F63-S148 WeakPolarHBondContact CE1-O 3.47Å; F63-R151 HydrophobicContact CE1-CB 4.44Å; F63-R151 HydrophobicContact CZ-CB 3.76Å; F63-F152 HydrophobicContact CB-CD2 3.6Å; F63-F152 HydrophobicContact CB-CE2 4.2Å; F63-F152 HydrophobicContact CD1-CB 3.64Å; F63-F152 HydrophobicContact CD1-CD2 4.03Å; F63-F152 HydrophobicContact CD1-CG 4.3Å; F63-F152 HydrophobicContact CD2-CD2 4.31Å; F63-F152 HydrophobicContact CE1-CB 3.73Å; F63-F152 HydrophobicContact CG-CB 4.07Å; F63-F152 AromaticContact CG-CD2 3.71Å; F63-F152 HydrophobicContact CG-CD2 3.71Å; F63-F152 HydrophobicContact CG-CG 4.38Å; F63-F152 HydrophobicContact CZ-CB 4.21Å; F63-I157 HydrophobicContact CB-CD1 4Å; F63-I157 HydrophobicContact CD2-CD1 4.47Å
64	L	98.2	Very high	97	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.8	-32.1	179.4	-68.6	177.3	0	0	0	112.8	F60 R61 T66 E67 F68 S69 D70 I73 M144 S148	F60-L64 HydrophobicContact CD1-CD1 3.89Å; F60-L64 HydrophobicContact CD1-CG 4.37Å; F60-L64 HydrophobicContact CE1-CD1 3.52Å; F60-L64 HydrophobicContact CE1-CD2 4.36Å; F60-L64 HydrophobicContact CE1-CG 4.06Å; F60-L64 HydrophobicContact CE2-CD2 4.35Å; F60-L64 HydrophobicContact CE2-CG 4.42Å; F60-L64 HydrophobicContact CZ-CD1 3.99Å; F60-L64 HydrophobicContact CZ-CD2 3.97Å; F60-L64 HydrophobicContact CZ-CG 4.09Å; F60-L64 WeakPolarHBondContact O-CG 3.46Å; F60-L64 PolarHBondContact O-N 2.7Å; R61-L64 PolarHBondContact O-N 3.28Å; L64-T66 VanDerWaalsContact C-N 3.3Å; L64-T66 PolarHBondContact O-N 3.43Å; L64-E67 CarbonylContact O-C 3.53Å; L64-E67 PolarHBondContact O-N 2.79Å; L64-E67 VanDerWaalsContact O-N 3.1Å; L64-F68 PolarHBondContact O-N 3.16Å; L64-S69 WeakPolarHBondContact CD2-OG 3.38Å; L64-S69 PolarHBondContact O-N 3.09Å; L64-D70 HydrophobicContact CB-CB 3.95Å; L64-I73 HydrophobicContact CD1-CB 3.6Å; L64-I73 HydrophobicContact CD1-CG2 3.57Å; L64-M144 HydrophobicContact CD1-SD 4.06Å; L64-S148 WeakPolarHBondContact CD2-OG 3.44Å
65	K	97.3	Very high	97.2	Very high	88 Å²	88	36.6 Å²	36.6	38%	0.383	18%	0.18	S	C	.	.	H	α-helix	trans	-62.7	-35.8	172.9	-74.7	-179.8	176.8	-173.8	0	112.8	R61 A62 F63 E67 F68 D70	R61-K65 WeakPolarHBondContact O-CG 3.33Å; R61-K65 PolarHBondContact O-N 2.98Å; R61-K65 VanDerWaalsContact O-N 3.1Å; A62-K65 PolarHBondContact O-N 2.86Å; F63-K65 PolarHBondContact O-N 3.29Å; K65-E67 PolarHBondContact O-N 3.34Å; K65-F68 PolarHBondContact O-N 3Å; K65-D70 WeakPolarHBondContact CE-OD2 3.26Å; K65-D70 HydrophobicContact CG-CB 3.65Å; K65-D70 WeakPolarHBondContact CG-OD2 3.33Å
66	T	96.8	Very high	97.5	Very high	88 Å²	88	35.4 Å²	35.4	54%	0.54	18%	0.176	S	C	.	.	H	α-helix	trans	-68.2	-20.3	176.2	68.6	0	0	0	0	112.6	A62 F63 L64 I157	A62-T66 PolarHBondContact O-N 3.45Å; F63-T66 WeakPolarHBondContact O-CB 3.5Å; F63-T66 PolarHBondContact O-N 3.12Å; F63-T66 PolarHBondContact O-OG1 3.41Å; L64-T66 VanDerWaalsContact C-N 3.3Å; L64-T66 PolarHBondContact O-N 3.43Å; T66-I157 HydrophobicContact CG2-CD1 4.36Å
67	E	96.1	Very high	97.6	Very high	60 Å²	60	37.8 Å²	37.8	28%	0.28	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	12.2	-179.4	-57	-169.2	146	0	0	112.7	F63 L64 K65 S69 R151	F63-E67 WeakPolarHBondContact CE1-OE2 3.38Å; F63-E67 HydrophobicContact CE2-CG 4.29Å; F63-E67 WeakPolarHBondContact CE2-OE1 3.43Å; F63-E67 HydrophobicContact CZ-CG 4.18Å; F63-E67 WeakPolarHBondContact CZ-OE1 3.48Å; F63-E67 WeakPolarHBondContact CZ-OE2 3.24Å; F63-E67 PolarHBondContact O-N 3.01Å; L64-E67 CarbonylContact O-C 3.53Å; L64-E67 PolarHBondContact O-N 2.79Å; L64-E67 VanDerWaalsContact O-N 3.1Å; K65-E67 PolarHBondContact O-N 3.34Å; E67-S69 PolarHBondContact O-N 3.12Å; E67-R151 IonicContact OE1-CZ 2.71Å; E67-R151 IonicContact OE1-NH1 2.72Å; E67-R151 PolarHBondContact OE1-NH1 3.23Å; E67-R151 IonicContact OE2-CZ 3.14Å; E67-R151 IonicContact OE2-NH1 3.22Å; E67-R151 PolarHBondContact OE2-NH1 3.28Å; E67-R151 IonicContact OE2-NH2 3.92Å; E67-R151 PolarHBondContact OE2-NH2 3.08Å
68	F	95.9	Very high	97.7	Very high	181 Å²	181	36.8 Å²	36.8	79%	0.794	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	39.3	179.4	-52.9	-85.9	0	0	0	113.7	L64 K65	L64-F68 PolarHBondContact O-N 3.16Å; K65-F68 PolarHBondContact O-N 3Å
69	S	97.9	Very high	97.8	Very high	15 Å²	15	35.5 Å²	35.5	11%	0.105	17%	0.173	C	C	.	.			trans	-130.7	23	-178.4	54.2	0	0	0	0	112.8	L64 E67 E71 N72	L64-S69 WeakPolarHBondContact CD2-OG 3.38Å; L64-S69 PolarHBondContact O-N 3.09Å; E67-S69 PolarHBondContact O-N 3.12Å; S69-E71 VanDerWaalsContact C-N 3.28Å; S69-E71 WeakPolarHBondContact CA-OE2 3.26Å; S69-E71 PolarHBondContact O-N 3.17Å; S69-N72 PolarHBondContact O-N 3.21Å; S69-N72 PolarHBondContact O-ND2 3.49Å
70	D	98	Very high	97.9	Very high	34 Å²	34	37.5 Å²	37.5	18%	0.182	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-12.3	-175.7	80.9	-45.3	0	0	0	113.6	L64 K65 N72 I73 E74 R109	L64-D70 HydrophobicContact CB-CB 3.95Å; K65-D70 WeakPolarHBondContact CE-OD2 3.26Å; K65-D70 HydrophobicContact CG-CB 3.65Å; K65-D70 WeakPolarHBondContact CG-OD2 3.33Å; D70-N72 PolarHBondContact O-N 2.86Å; D70-I73 WeakPolarHBondContact O-CG2 3.41Å; D70-I73 PolarHBondContact O-N 3.35Å; D70-E74 VanDerWaalsContact O-CG 3.26Å; D70-E74 WeakPolarHBondContact O-CG 3.26Å; D70-E74 PolarHBondContact O-N 2.91Å; D70-E74 VanDerWaalsContact O-N 3.12Å; D70-R109 VanDerWaalsContact CG-NH2 3.28Å; D70-R109 PolarHBondContact O-NH2 3.11Å; D70-R109 IonicContact OD1-NH2 3.66Å; D70-R109 PolarHBondContact OD1-NH2 3.08Å; D70-R109 IonicContact OD2-NH2 3.75Å; D70-R109 PolarHBondContact OD2-NH2 3.09Å
71	E	98.4	Very high	97.8	Very high	33 Å²	33	42.3 Å²	42.3	15%	0.154	20%	0.203	C	C	.	.	H	α-helix	trans	-56.2	-34.8	170.2	72.6	-66.3	157.4	0	0	112.4	S69 E74 F75 R109 V111	S69-E71 VanDerWaalsContact C-N 3.28Å; S69-E71 WeakPolarHBondContact CA-OE2 3.26Å; S69-E71 PolarHBondContact O-N 3.17Å; E71-E74 PolarHBondContact O-N 3.39Å; E71-F75 VanDerWaalsContact O-CB 3.25Å; E71-F75 WeakPolarHBondContact O-CB 3.48Å; E71-F75 PolarHBondContact O-N 3.03Å; E71-R109 HydrophobicContact CB-CB 3.94Å; E71-V111 HydrophobicContact CG-CG1 4.31Å
72	N	98.4	Very high	97.8	Very high	7 Å²	7	38.5 Å²	38.5	4%	0.037	19%	0.189	C	C	.	.	H	α-helix	trans	-64.7	-44.8	-178.4	-61.1	-63.9	0	0	0	112.2	S69 D70 W76 V140 M144	S69-N72 PolarHBondContact O-N 3.21Å; S69-N72 PolarHBondContact O-ND2 3.49Å; D70-N72 PolarHBondContact O-N 2.86Å; N72-W76 WeakPolarHBondContact O-CB 3.3Å; N72-W76 PolarHBondContact O-N 3Å; N72-W76 VanDerWaalsContact O-N 3.07Å; N72-V140 HydrophobicContact CB-CG1 3.7Å; N72-V140 WeakPolarHBondContact O-CG1 3.46Å; N72-M144 VanDerWaalsContact C-SD 3.6Å; N72-M144 HydrophobicContact CB-CE 4.49Å; N72-M144 HydrophobicContact CB-CG 3.61Å; N72-M144 HydrophobicContact CB-SD 3.5Å; N72-M144 VanDerWaalsContact CB-SD 3.5Å
73	I	98.4	Very high	97.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-76.6	-33.7	179.9	-166	60	0	0	0	111.8	L51 L57 F60 R61 L64 D70 W76 M77 M144	L51-I73 HydrophobicContact CD1-CD1 4.4Å; L51-I73 HydrophobicContact CD2-CD1 3.71Å; L57-I73 HydrophobicContact CD1-CD1 3.61Å; L57-I73 HydrophobicContact CD1-CG1 3.73Å; F60-I73 HydrophobicContact CD1-CD1 4.18Å; F60-I73 HydrophobicContact CD1-CG1 4.32Å; F60-I73 HydrophobicContact CE1-CD1 4.46Å; R61-I73 HydrophobicContact CB-CG2 4.07Å; R61-I73 HydrophobicContact CG-CG2 3.97Å; L64-I73 HydrophobicContact CD1-CB 3.6Å; L64-I73 HydrophobicContact CD1-CG2 3.57Å; D70-I73 WeakPolarHBondContact O-CG2 3.41Å; D70-I73 PolarHBondContact O-N 3.35Å; I73-W76 HydrophobicContact CD1-CB 4.43Å; I73-W76 HydrophobicContact CD1-CD2 4.45Å; I73-W76 HydrophobicContact CD1-CE3 4.01Å; I73-W76 PolarHBondContact O-N 3.32Å; I73-M77 WeakPolarHBondContact O-CB 3.32Å; I73-M77 VanDerWaalsContact O-CG 3.3Å; I73-M77 WeakPolarHBondContact O-CG 3.45Å; I73-M77 PolarHBondContact O-N 3.29Å; I73-M144 HydrophobicContact CB-SD 3.94Å; I73-M144 HydrophobicContact CD1-CE 4.03Å; I73-M144 HydrophobicContact CD1-SD 4.13Å; I73-M144 PolarHBondContact N-SD 2.71Å
74	E	98.4	Very high	97.8	Very high	30 Å²	30	48.3 Å²	48.3	14%	0.14	23%	0.228	C	C	.	.	H	α-helix	trans	-65.9	-41.5	175.7	-69.1	-59.9	115.9	0	0	111.6	R61 D70 E71 M77 A78 F102 R109	R61-E74 VanDerWaalsContact CD-OE1 3.24Å; R61-E74 WeakPolarHBondContact CD-OE1 3.49Å; R61-E74 IonicContact CZ-OE1 2.65Å; R61-E74 IonicContact CZ-OE2 2.71Å; R61-E74 IonicContact NE-OE1 3.8Å; R61-E74 PolarHBondContact NE-OE1 2.87Å; R61-E74 IonicContact NH1-OE1 3.6Å; R61-E74 PolarHBondContact NH1-OE1 2.95Å; R61-E74 IonicContact NH1-OE2 2.73Å; R61-E74 IonicContact NH2-OE1 2.73Å; R61-E74 PolarHBondContact NH2-OE1 3.41Å; R61-E74 IonicContact NH2-OE2 2.68Å; R61-E74 PolarHBondContact NH2-OE2 2.95Å; D70-E74 VanDerWaalsContact O-CG 3.26Å; D70-E74 WeakPolarHBondContact O-CG 3.26Å; D70-E74 PolarHBondContact O-N 2.91Å; D70-E74 VanDerWaalsContact O-N 3.12Å; E71-E74 PolarHBondContact O-N 3.39Å; E74-M77 PolarHBondContact O-N 2.98Å; E74-A78 WeakPolarHBondContact O-CB 3.44Å; E74-A78 PolarHBondContact O-N 3.47Å; E74-F102 HydrophobicContact CB-CE1 4Å; E74-F102 HydrophobicContact CB-CZ 4.02Å; E74-R109 VanDerWaalsContact CB-NH1 3.27Å; E74-R109 VanDerWaalsContact CG-NH1 3.34Å
75	F	98.7	Very high	97.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.3	-50.3	171.3	171.4	-108.7	0	0	0	111.3	E71 M77 A78 C79 I98 F102 I103 V111 V136 Q137 V140	E71-F75 VanDerWaalsContact O-CB 3.25Å; E71-F75 WeakPolarHBondContact O-CB 3.48Å; E71-F75 PolarHBondContact O-N 3.03Å; F75-M77 VanDerWaalsContact C-N 3.31Å; F75-M77 PolarHBondContact O-N 3.1Å; F75-A78 WeakPolarHBondContact O-CB 3.42Å; F75-A78 PolarHBondContact O-N 3.1Å; F75-A78 VanDerWaalsContact O-N 3.1Å; F75-C79 VanDerWaalsContact CE2-SG 3.59Å; F75-C79 WeakPolarHBondContact CZ-SG 3.13Å; F75-C79 PolarHBondContact O-N 3.42Å; F75-C79 PolarHBondContact O-SG 3.43Å; F75-C79 VanDerWaalsContact O-SG 3.39Å; F75-I98 HydrophobicContact CD2-CG2 3.98Å; F75-I98 HydrophobicContact CE2-CG2 3.64Å; F75-F102 HydrophobicContact CB-CB 4.27Å; F75-F102 HydrophobicContact CB-CD1 3.74Å; F75-F102 HydrophobicContact CB-CD2 4.41Å; F75-F102 HydrophobicContact CB-CE1 4.14Å; F75-F102 HydrophobicContact CB-CG 3.89Å; F75-F102 HydrophobicContact CD2-CB 3.53Å; F75-F102 HydrophobicContact CD2-CD1 4.47Å; F75-F102 HydrophobicContact CD2-CD2 4.01Å; F75-F102 AromaticContact CD2-CG 3.77Å; F75-F102 HydrophobicContact CD2-CG 3.77Å; F75-F102 HydrophobicContact CE2-CB 4.26Å; F75-F102 HydrophobicContact CG-CB 4.2Å; F75-F102 HydrophobicContact CG-CG 4.28Å; F75-I103 HydrophobicContact CD2-CD1 4.36Å; F75-I103 HydrophobicContact CE2-CD1 3.55Å; F75-I103 HydrophobicContact CE2-CG1 4.2Å; F75-I103 HydrophobicContact CZ-CD1 3.75Å; F75-V111 HydrophobicContact CB-CG1 3.68Å; F75-V111 HydrophobicContact CD1-CG1 4.15Å; F75-V111 HydrophobicContact CG-CG1 3.9Å; F75-V136 HydrophobicContact CE1-CG2 4.15Å; F75-V136 HydrophobicContact CZ-CB 4.39Å; F75-V136 HydrophobicContact CZ-CG1 3.81Å; F75-V136 HydrophobicContact CZ-CG2 3.87Å; F75-Q137 HydrophobicContact CE1-CB 4.48Å; F75-V140 HydrophobicContact CD1-CB 3.91Å; F75-V140 HydrophobicContact CD1-CG1 3.97Å; F75-V140 HydrophobicContact CD1-CG2 3.71Å; F75-V140 HydrophobicContact CE1-CB 4.07Å; F75-V140 HydrophobicContact CE1-CG2 3.67Å
76	W	98.6	Very high	97.5	Very high	36 Å²	36	55.4 Å²	55.4	14%	0.136	26%	0.26	C	S	.	.	H	α-helix	trans	-58.1	-43.4	179.4	-179	93.8	0	0	0	112	L51 L57 N72 I73 C79 E80 Q137 H141 M144	L51-W76 HydrophobicContact CB-CH2 3.88Å; L51-W76 HydrophobicContact CB-CZ2 4.25Å; L51-W76 HydrophobicContact CB-CZ3 4.34Å; L51-W76 HydrophobicContact CD1-CD2 4.04Å; L51-W76 HydrophobicContact CD1-CE3 4.27Å; L51-W76 HydrophobicContact CD1-CH2 4Å; L51-W76 HydrophobicContact CD1-CZ2 3.73Å; L51-W76 HydrophobicContact CD1-CZ3 4.26Å; L57-W76 HydrophobicContact CD1-CZ3 4.25Å; N72-W76 WeakPolarHBondContact O-CB 3.3Å; N72-W76 PolarHBondContact O-N 3Å; N72-W76 VanDerWaalsContact O-N 3.07Å; I73-W76 HydrophobicContact CD1-CB 4.43Å; I73-W76 HydrophobicContact CD1-CD2 4.45Å; I73-W76 HydrophobicContact CD1-CE3 4.01Å; I73-W76 PolarHBondContact O-N 3.32Å; W76-C79 WeakPolarHBondContact O-CB 3.49Å; W76-C79 PolarHBondContact O-N 2.99Å; W76-E80 HydrophobicContact CD2-CG 4.2Å; W76-E80 HydrophobicContact CE3-CG 4.08Å; W76-E80 HydrophobicContact CH2-CG 3.71Å; W76-E80 HydrophobicContact CZ2-CG 3.82Å; W76-E80 HydrophobicContact CZ3-CG 3.84Å; W76-E80 PolarHBondContact O-N 2.96Å; W76-Q137 HydrophobicContact CG-CG 4.29Å; W76-Q137 PolarHBondContact O-NE2 3.32Å; W76-H141 AromaticContact NE1-CD2 3.56Å; W76-M144 HydrophobicContact CB-CE 3.98Å; W76-M144 HydrophobicContact CG-CE 4.29Å
77	M	98.3	Very high	97.5	Very high	50 Å²	50	54.4 Å²	54.4	25%	0.246	25%	0.254	C	S	.	.	H	α-helix	trans	-63.2	-42	175	-74.2	178	49.7	0	0	112.1	L57 I73 E74 F75 C79 E80 E81	L57-M77 HydrophobicContact CD1-CG 4.24Å; L57-M77 HydrophobicContact CD1-SD 4.15Å; L57-M77 HydrophobicContact CD2-CG 4.21Å; L57-M77 HydrophobicContact CD2-SD 3.93Å; L57-M77 HydrophobicContact CG-SD 4.18Å; I73-M77 WeakPolarHBondContact O-CB 3.32Å; I73-M77 VanDerWaalsContact O-CG 3.3Å; I73-M77 WeakPolarHBondContact O-CG 3.45Å; I73-M77 PolarHBondContact O-N 3.29Å; E74-M77 PolarHBondContact O-N 2.98Å; F75-M77 VanDerWaalsContact C-N 3.31Å; F75-M77 PolarHBondContact O-N 3.1Å; M77-C79 VanDerWaalsContact C-N 3.27Å; M77-C79 PolarHBondContact O-N 3.19Å; M77-E80 PolarHBondContact O-N 3.22Å; M77-E80 VanDerWaalsContact O-N 3.15Å; M77-E81 PolarHBondContact O-N 3.4Å
78	A	98.3	Very high	97.4	Very high	10 Å²	10	56.4 Å²	56.4	8%	0.083	27%	0.273	C	S	.	.	H	α-helix	trans	-62.1	-36.1	176.9	0	0	0	0	0	111.8	E74 F75 E81 Y82 I98 F102	E74-A78 WeakPolarHBondContact O-CB 3.44Å; E74-A78 PolarHBondContact O-N 3.47Å; F75-A78 WeakPolarHBondContact O-CB 3.42Å; F75-A78 PolarHBondContact O-N 3.1Å; F75-A78 VanDerWaalsContact O-N 3.1Å; A78-E81 PolarHBondContact O-N 3.47Å; A78-Y82 VanDerWaalsContact O-CB 3.3Å; A78-Y82 WeakPolarHBondContact O-CB 3.4Å; A78-Y82 PolarHBondContact O-N 3.28Å; A78-I98 HydrophobicContact CB-CD1 4.06Å; A78-I98 HydrophobicContact CB-CG1 4.02Å; A78-F102 HydrophobicContact CB-CE2 4.33Å
79	C	98.3	Very high	97.4	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.4	-42	172	-67.2	0	0	0	0	112.4	F75 W76 M77 E81 Y82 K83 Q137	F75-C79 VanDerWaalsContact CE2-SG 3.59Å; F75-C79 WeakPolarHBondContact CZ-SG 3.13Å; F75-C79 PolarHBondContact O-N 3.42Å; F75-C79 PolarHBondContact O-SG 3.43Å; F75-C79 VanDerWaalsContact O-SG 3.39Å; W76-C79 WeakPolarHBondContact O-CB 3.49Å; W76-C79 PolarHBondContact O-N 2.99Å; M77-C79 VanDerWaalsContact C-N 3.27Å; M77-C79 PolarHBondContact O-N 3.19Å; C79-E81 VanDerWaalsContact C-N 3.3Å; C79-E81 PolarHBondContact O-N 2.73Å; C79-Y82 WeakPolarHBondContact O-CB 3.33Å; C79-Y82 PolarHBondContact O-N 2.99Å; C79-Y82 VanDerWaalsContact O-N 3.16Å; C79-K83 WeakPolarHBondContact O-CG 3.49Å; C79-K83 PolarHBondContact O-N 2.97Å; C79-Q137 HydrophobicContact CB-CB 4.13Å; C79-Q137 HydrophobicContact CB-CG 3.75Å
80	E	97.9	Very high	97.3	Very high	53 Å²	53	57.5 Å²	57.5	25%	0.248	29%	0.289	C	S	.	.	H	α-helix	trans	-62.9	-35.6	175.9	-72.5	-55.7	107.3	0	0	112.9	W76 M77 K83 K84 Q137	W76-E80 HydrophobicContact CD2-CG 4.2Å; W76-E80 HydrophobicContact CE3-CG 4.08Å; W76-E80 HydrophobicContact CH2-CG 3.71Å; W76-E80 HydrophobicContact CZ2-CG 3.82Å; W76-E80 HydrophobicContact CZ3-CG 3.84Å; W76-E80 PolarHBondContact O-N 2.96Å; M77-E80 PolarHBondContact O-N 3.22Å; M77-E80 VanDerWaalsContact O-N 3.15Å; E80-K83 IonicContact OE1-NZ 3.88Å; E80-K83 PolarHBondContact OE1-NZ 3.42Å; E80-K84 WeakPolarHBondContact O-CD 3.15Å; E80-K84 VanDerWaalsContact O-CE 3.32Å; E80-K84 WeakPolarHBondContact O-CE 3.43Å; E80-K84 WeakPolarHBondContact O-CG 3.48Å; E80-Q137 PolarHBondContact OE1-NE2 3.06Å
81	E	97.3	Very high	97.3	Very high	102 Å²	102	56.4 Å²	56.4	48%	0.477	28%	0.283	S	S	.	.	H	α-helix	trans	-69.3	-42.3	171	-67	-176.8	145.8	0	0	112.1	M77 A78 C79 K83 K84 K94	M77-E81 PolarHBondContact O-N 3.4Å; A78-E81 PolarHBondContact O-N 3.47Å; C79-E81 VanDerWaalsContact C-N 3.3Å; C79-E81 PolarHBondContact O-N 2.73Å; E81-K83 VanDerWaalsContact C-N 3.34Å; E81-K83 PolarHBondContact O-N 2.95Å; E81-K84 WeakPolarHBondContact O-CB 3.41Å; E81-K84 PolarHBondContact O-N 3.42Å; E81-K84 VanDerWaalsContact O-N 3.12Å; E81-K94 IonicContact OE2-NZ 3.58Å; E81-K94 PolarHBondContact OE2-NZ 3.22Å
82	Y	98.1	Very high	97.2	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-58.2	-44.3	-179.7	173.9	-92.3	0	0	0	112	A78 C79 K84 I85 L91 K94 A95 I98 P128 T129 L133	A78-Y82 VanDerWaalsContact O-CB 3.3Å; A78-Y82 WeakPolarHBondContact O-CB 3.4Å; A78-Y82 PolarHBondContact O-N 3.28Å; C79-Y82 WeakPolarHBondContact O-CB 3.33Å; C79-Y82 PolarHBondContact O-N 2.99Å; C79-Y82 VanDerWaalsContact O-N 3.16Å; Y82-K84 PolarHBondContact O-N 3.31Å; Y82-K84 VanDerWaalsContact O-N 3.12Å; Y82-I85 HydrophobicContact CD2-CD1 4.48Å; Y82-I85 WeakPolarHBondContact O-CB 3.49Å; Y82-I85 WeakPolarHBondContact O-CG1 3.49Å; Y82-I85 PolarHBondContact O-N 3.39Å; Y82-I85 VanDerWaalsContact O-N 3.08Å; Y82-L91 HydrophobicContact CD1-CD1 4.4Å; Y82-L91 HydrophobicContact CD2-CD1 3.97Å; Y82-L91 HydrophobicContact CE1-CD1 3.92Å; Y82-L91 HydrophobicContact CE2-CD1 3.43Å; Y82-L91 VanDerWaalsContact CE2-CD1 3.43Å; Y82-L91 HydrophobicContact CE2-CG 3.81Å; Y82-L91 WeakPolarHBondContact CE2-O 3.35Å; Y82-L91 HydrophobicContact CG-CD1 4.42Å; Y82-L91 WeakPolarHBondContact OH-CG 3.35Å; Y82-K94 HydrophobicContact CD2-CB 4.06Å; Y82-K94 HydrophobicContact CD2-CG 3.86Å; Y82-A95 HydrophobicContact CE2-CB 3.81Å; Y82-I98 HydrophobicContact CD2-CD1 4.15Å; Y82-I98 HydrophobicContact CG-CD1 4.21Å; Y82-P128 WeakPolarHBondContact OH-CB 3.46Å; Y82-T129 WeakPolarHBondContact CE1-O 3.49Å; Y82-T129 VanDerWaalsContact CZ-O 3.31Å; Y82-T129 PolarHBondContact OH-O 3.33Å; Y82-L133 HydrophobicContact CD1-CD1 3.77Å; Y82-L133 HydrophobicContact CD1-CG 4.3Å; Y82-L133 HydrophobicContact CD2-CD1 4.2Å; Y82-L133 HydrophobicContact CE1-CD1 4.09Å; Y82-L133 HydrophobicContact CE1-CG 4.21Å; Y82-L133 HydrophobicContact CE2-CD1 4.5Å; Y82-L133 HydrophobicContact CG-CD1 3.84Å
83	K	97.3	Very high	97.2	Very high	76 Å²	76	62.2 Å²	62.2	33%	0.33	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-25.8	176.9	-71.7	172.3	-174.7	171.6	0	114.1	C79 E80 E81 I85 N134	C79-K83 WeakPolarHBondContact O-CG 3.49Å; C79-K83 PolarHBondContact O-N 2.97Å; E80-K83 IonicContact OE1-NZ 3.88Å; E80-K83 PolarHBondContact OE1-NZ 3.42Å; E81-K83 VanDerWaalsContact C-N 3.34Å; E81-K83 PolarHBondContact O-N 2.95Å; K83-I85 VanDerWaalsContact C-N 3.33Å; K83-N134 WeakPolarHBondContact CE-OD1 3.34Å
84	K	96.7	Very high	97.2	Very high	152 Å²	152	64.2 Å²	64.2	66%	0.661	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-9	-177.9	-62.9	168	-171.2	169.9	0	112.7	E80 E81 Y82	E80-K84 WeakPolarHBondContact O-CD 3.15Å; E80-K84 VanDerWaalsContact O-CE 3.32Å; E80-K84 WeakPolarHBondContact O-CE 3.43Å; E80-K84 WeakPolarHBondContact O-CG 3.48Å; E81-K84 WeakPolarHBondContact O-CB 3.41Å; E81-K84 PolarHBondContact O-N 3.42Å; E81-K84 VanDerWaalsContact O-N 3.12Å; Y82-K84 PolarHBondContact O-N 3.31Å; Y82-K84 VanDerWaalsContact O-N 3.12Å
85	I	96.9	Very high	97.1	Very high	33 Å²	33	62.8 Å²	62.8	17%	0.169	32%	0.323	C	S	.	.			trans	-75.2	126.6	-178.2	-61.5	174.4	0	0	0	110.2	Y82 K83 K90 L91 K94	Y82-I85 HydrophobicContact CD2-CD1 4.48Å; Y82-I85 WeakPolarHBondContact O-CB 3.49Å; Y82-I85 WeakPolarHBondContact O-CG1 3.49Å; Y82-I85 PolarHBondContact O-N 3.39Å; Y82-I85 VanDerWaalsContact O-N 3.08Å; K83-I85 VanDerWaalsContact C-N 3.33Å; I85-K90 HydrophobicContact CG2-CB 3.69Å; I85-L91 HydrophobicContact CB-CD1 3.95Å; I85-L91 HydrophobicContact CG2-CB 4.02Å; I85-L91 HydrophobicContact CG2-CD1 4.14Å; I85-K94 HydrophobicContact CD1-CB 3.55Å; I85-K94 HydrophobicContact CD1-CG 3.75Å
86	K	93.8	Very high	97.1	Very high	204 Å²	204	66.7 Å²	66.7	89%	0.887	34%	0.344	S	S	*	.			trans	-100.9	-18.1	-178.9	-59.2	-174.7	179.5	-176.6	0	114.4
87	T	96.1	Very high	97.1	Very high	67 Å²	67	70.8 Å²	70.8	41%	0.411	36%	0.363	S	S	.	.	S	Bend	trans	-102.1	128.2	-173.7	57.7	0	0	0	0	110.9	A89 K90 L91	T87-A89 VanDerWaalsContact C-N 3.34Å; T87-A89 PolarHBondContact O-N 3.46Å; T87-K90 PolarHBondContact O-N 3.44Å; T87-K90 VanDerWaalsContact OG1-CB 3.29Å; T87-K90 WeakPolarHBondContact OG1-CB 3.25Å; T87-K90 WeakPolarHBondContact OG1-CD 3.49Å; T87-K90 VanDerWaalsContact OG1-CG 3.28Å; T87-K90 WeakPolarHBondContact OG1-CG 3.38Å; T87-L91 PolarHBondContact O-N 3.44Å; T87-L91 VanDerWaalsContact O-N 3.08Å
88	P	94.3	Very high	97.1	Very high	102 Å²	102	68.5 Å²	68.5	66%	0.662	35%	0.351	S	S	*	.	H	α-helix	trans	-53.7	-43.9	-178.3	-29.3	35.5	0	0	0	114.3	K90 L91 V92	P88-K90 PolarHBondContact O-N 3.12Å; P88-L91 VanDerWaalsContact O-CB 3.31Å; P88-L91 WeakPolarHBondContact O-CB 3.25Å; P88-L91 PolarHBondContact O-N 3.34Å; P88-L91 VanDerWaalsContact O-N 3.09Å; P88-V92 WeakPolarHBondContact O-CG2 3.45Å; P88-V92 PolarHBondContact O-N 3.38Å
89	A	95.5	Very high	97	Very high	75 Å²	75	70.1 Å²	70.1	62%	0.62	36%	0.356	S	S	*	.	H	α-helix	trans	-60.9	-43.4	-179	0	0	0	0	0	113.5	T87 L91 T93	T87-A89 VanDerWaalsContact C-N 3.34Å; T87-A89 PolarHBondContact O-N 3.46Å; A89-L91 VanDerWaalsContact C-N 3.3Å; A89-T93 PolarHBondContact O-N 3.07Å; A89-T93 VanDerWaalsContact O-N 3.12Å; A89-T93 PolarHBondContact O-OG1 2.93Å
90	K	96.7	Very high	97	Very high	144 Å²	144	74.6 Å²	74.6	63%	0.626	38%	0.38	S	S	*	.	H	α-helix	trans	-69.2	-32.5	175.5	-66	-175.6	179.1	180	0	111.7	I85 T87 P88 T93 K94	I85-K90 HydrophobicContact CG2-CB 3.69Å; T87-K90 PolarHBondContact O-N 3.44Å; T87-K90 VanDerWaalsContact OG1-CB 3.29Å; T87-K90 WeakPolarHBondContact OG1-CB 3.25Å; T87-K90 WeakPolarHBondContact OG1-CD 3.49Å; T87-K90 VanDerWaalsContact OG1-CG 3.28Å; T87-K90 WeakPolarHBondContact OG1-CG 3.38Å; P88-K90 PolarHBondContact O-N 3.12Å; K90-T93 PolarHBondContact O-N 2.87Å; K90-K94 WeakPolarHBondContact O-CB 3.42Å; K90-K94 PolarHBondContact O-N 3.42Å
91	L	96.6	Very high	97	Very high	10 Å²	10	74.9 Å²	74.9	5%	0.052	38%	0.381	C	S	.	.	H	α-helix	trans	-64.6	-50.7	179.5	-166.2	72.6	0	0	0	109.9	Y82 I85 T87 P88 A89 T93 K94 A95 P128 P130	Y82-L91 HydrophobicContact CD1-CD1 4.4Å; Y82-L91 HydrophobicContact CD2-CD1 3.97Å; Y82-L91 HydrophobicContact CE1-CD1 3.92Å; Y82-L91 HydrophobicContact CE2-CD1 3.43Å; Y82-L91 VanDerWaalsContact CE2-CD1 3.43Å; Y82-L91 HydrophobicContact CE2-CG 3.81Å; Y82-L91 WeakPolarHBondContact CE2-O 3.35Å; Y82-L91 HydrophobicContact CG-CD1 4.42Å; Y82-L91 WeakPolarHBondContact OH-CG 3.35Å; I85-L91 HydrophobicContact CB-CD1 3.95Å; I85-L91 HydrophobicContact CG2-CB 4.02Å; I85-L91 HydrophobicContact CG2-CD1 4.14Å; T87-L91 PolarHBondContact O-N 3.44Å; T87-L91 VanDerWaalsContact O-N 3.08Å; P88-L91 VanDerWaalsContact O-CB 3.31Å; P88-L91 WeakPolarHBondContact O-CB 3.25Å; P88-L91 PolarHBondContact O-N 3.34Å; P88-L91 VanDerWaalsContact O-N 3.09Å; A89-L91 VanDerWaalsContact C-N 3.3Å; L91-T93 VanDerWaalsContact C-N 3.33Å; L91-T93 PolarHBondContact O-N 3.32Å; L91-K94 PolarHBondContact O-N 3.23Å; L91-A95 VanDerWaalsContact O-CB 3.28Å; L91-A95 WeakPolarHBondContact O-CB 3.2Å; L91-A95 PolarHBondContact O-N 3.45Å; L91-P128 HydrophobicContact CD2-CB 4.29Å; L91-P128 WeakPolarHBondContact CD2-O 3.3Å; L91-P128 HydrophobicContact CG-CB 4.19Å; L91-P130 HydrophobicContact CD2-CG 4.44Å
92	V	97.2	Very high	97.1	Very high	63 Å²	63	70.2 Å²	70.2	38%	0.382	36%	0.359	S	S	.	.	H	α-helix	trans	-57.5	-45.9	174.3	175.6	0	0	0	0	111.4	P88 K94 A95 N96 P128	P88-V92 WeakPolarHBondContact O-CG2 3.45Å; P88-V92 PolarHBondContact O-N 3.38Å; V92-K94 PolarHBondContact O-N 3.38Å; V92-A95 PolarHBondContact O-N 3.5Å; V92-N96 PolarHBondContact O-N 2.88Å; V92-N96 PolarHBondContact O-ND2 3.26Å; V92-P128 HydrophobicContact CG2-CG 4.08Å
93	T	97.6	Very high	97.1	Very high	99 Å²	99	70.2 Å²	70.2	61%	0.607	36%	0.359	S	S	*	.	H	α-helix	trans	-61.4	-45.4	179.5	-55.3	0	0	0	0	112	A89 K90 L91 K97	A89-T93 PolarHBondContact O-N 3.07Å; A89-T93 VanDerWaalsContact O-N 3.12Å; A89-T93 PolarHBondContact O-OG1 2.93Å; K90-T93 PolarHBondContact O-N 2.87Å; L91-T93 VanDerWaalsContact C-N 3.33Å; L91-T93 PolarHBondContact O-N 3.32Å; T93-K97 PolarHBondContact O-N 2.8Å; T93-K97 VanDerWaalsContact O-N 3.14Å
94	K	98.1	Very high	97	Very high	43 Å²	43	69.1 Å²	69.1	19%	0.187	36%	0.357	C	S	.	.	H	α-helix	trans	-71.3	-37.5	179.3	-174.5	73.5	168.6	-173.1	0	111.6	E81 Y82 I85 K90 L91 V92 K97 I98	E81-K94 IonicContact OE2-NZ 3.58Å; E81-K94 PolarHBondContact OE2-NZ 3.22Å; Y82-K94 HydrophobicContact CD2-CB 4.06Å; Y82-K94 HydrophobicContact CD2-CG 3.86Å; I85-K94 HydrophobicContact CD1-CB 3.55Å; I85-K94 HydrophobicContact CD1-CG 3.75Å; K90-K94 WeakPolarHBondContact O-CB 3.42Å; K90-K94 PolarHBondContact O-N 3.42Å; L91-K94 PolarHBondContact O-N 3.23Å; V92-K94 PolarHBondContact O-N 3.38Å; K94-K97 PolarHBondContact O-N 3.35Å; K94-I98 HydrophobicContact CD-CD1 4.39Å; K94-I98 HydrophobicContact CG-CD1 3.92Å; K94-I98 HydrophobicContact CG-CG1 4.42Å; K94-I98 WeakPolarHBondContact O-CG1 3.45Å; K94-I98 PolarHBondContact O-N 3.39Å
95	A	97.8	Very high	96.9	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-55.9	-53.4	173.3	0	0	0	0	0	111.3	Y82 L91 V92 K97 I98 Y99 L125 P128	Y82-A95 HydrophobicContact CE2-CB 3.81Å; L91-A95 VanDerWaalsContact O-CB 3.28Å; L91-A95 WeakPolarHBondContact O-CB 3.2Å; L91-A95 PolarHBondContact O-N 3.45Å; V92-A95 PolarHBondContact O-N 3.5Å; A95-K97 VanDerWaalsContact C-N 3.29Å; A95-K97 PolarHBondContact O-N 3.06Å; A95-I98 PolarHBondContact O-N 3.35Å; A95-Y99 WeakPolarHBondContact O-CB 3.32Å; A95-Y99 PolarHBondContact O-N 2.99Å; A95-L125 HydrophobicContact CB-CD2 3.81Å; A95-P128 HydrophobicContact CB-CB 3.97Å; A95-P128 HydrophobicContact CB-CG 3.86Å
96	N	97.4	Very high	96.7	Very high	82 Å²	82	73.6 Å²	73.6	44%	0.439	38%	0.382	S	S	.	.	H	α-helix	trans	-59.4	-40.9	178.1	-74.3	-28.2	0	0	0	112	V92 Y99 N100	V92-N96 PolarHBondContact O-N 2.88Å; V92-N96 PolarHBondContact O-ND2 3.26Å; N96-Y99 PolarHBondContact O-N 3.05Å; N96-N100 WeakPolarHBondContact O-CB 3.21Å; N96-N100 VanDerWaalsContact O-CG 3.27Å; N96-N100 PolarHBondContact O-N 2.97Å; N96-N100 VanDerWaalsContact O-N 3.07Å; N96-N100 PolarHBondContact O-ND2 2.76Å; N96-N100 VanDerWaalsContact O-ND2 3.1Å
97	K	98.2	Very high	96.9	Very high	121 Å²	121	64.4 Å²	64.4	53%	0.526	35%	0.345	S	S	.	.	H	α-helix	trans	-61.5	-49.6	175.5	-175.9	177	177.1	179.3	0	111.6	T93 K94 A95 Y99 N100 E101	T93-K97 PolarHBondContact O-N 2.8Å; T93-K97 VanDerWaalsContact O-N 3.14Å; K94-K97 PolarHBondContact O-N 3.35Å; A95-K97 VanDerWaalsContact C-N 3.29Å; A95-K97 PolarHBondContact O-N 3.06Å; K97-Y99 VanDerWaalsContact C-N 3.32Å; K97-Y99 PolarHBondContact O-N 3Å; K97-N100 PolarHBondContact O-N 3.36Å; K97-E101 VanDerWaalsContact CE-OE2 3.3Å; K97-E101 WeakPolarHBondContact CE-OE2 3.19Å; K97-E101 VanDerWaalsContact O-CB 3.23Å; K97-E101 WeakPolarHBondContact O-CB 3.45Å; K97-E101 PolarHBondContact O-N 2.97Å
98	I	98.4	Very high	96.9	Very high	2 Å²	2	66.6 Å²	66.6	1%	0.01	36%	0.36	C	S	.	.	H	α-helix	trans	-61.8	-43	-179.9	-70.1	170	0	0	0	110.6	F75 A78 Y82 K94 A95 E101 F102 L133	F75-I98 HydrophobicContact CD2-CG2 3.98Å; F75-I98 HydrophobicContact CE2-CG2 3.64Å; A78-I98 HydrophobicContact CB-CD1 4.06Å; A78-I98 HydrophobicContact CB-CG1 4.02Å; Y82-I98 HydrophobicContact CD2-CD1 4.15Å; Y82-I98 HydrophobicContact CG-CD1 4.21Å; K94-I98 HydrophobicContact CD-CD1 4.39Å; K94-I98 HydrophobicContact CG-CD1 3.92Å; K94-I98 HydrophobicContact CG-CG1 4.42Å; K94-I98 WeakPolarHBondContact O-CG1 3.45Å; K94-I98 PolarHBondContact O-N 3.39Å; A95-I98 PolarHBondContact O-N 3.35Å; I98-E101 PolarHBondContact O-N 3.37Å; I98-F102 HydrophobicContact CG2-CD2 4.34Å; I98-F102 PolarHBondContact O-N 2.99Å; I98-L133 HydrophobicContact CB-CD1 4.4Å; I98-L133 HydrophobicContact CD1-CD1 3.62Å; I98-L133 HydrophobicContact CG2-CD1 3.93Å; I98-L133 HydrophobicContact CG2-CD2 4.45Å
99	Y	97.9	Very high	97.1	Very high	45 Å²	45	64.6 Å²	64.6	18%	0.176	34%	0.339	C	S	.	.	I	π-helix	trans	-59.7	-51.1	179.5	-176.2	-91.7	0	0	0	111.8	A95 N96 K97 E101 I103 D104 R122 L125	A95-Y99 WeakPolarHBondContact O-CB 3.32Å; A95-Y99 PolarHBondContact O-N 2.99Å; N96-Y99 PolarHBondContact O-N 3.05Å; K97-Y99 VanDerWaalsContact C-N 3.32Å; K97-Y99 PolarHBondContact O-N 3Å; Y99-E101 VanDerWaalsContact C-N 3.32Å; Y99-E101 PolarHBondContact O-N 3.44Å; Y99-I103 HydrophobicContact CD2-CB 3.77Å; Y99-I103 HydrophobicContact CD2-CG1 4.48Å; Y99-I103 HydrophobicContact CD2-CG2 3.66Å; Y99-I103 HydrophobicContact CE2-CB 4.18Å; Y99-I103 HydrophobicContact CE2-CG2 3.66Å; Y99-I103 HydrophobicContact CG-CB 4.31Å; Y99-I103 WeakPolarHBondContact O-CA 3.2Å; Y99-I103 PolarHBondContact O-N 3.27Å; Y99-D104 HydrophobicContact CD1-CB 4.31Å; Y99-D104 HydrophobicContact CE1-CB 3.88Å; Y99-D104 PolarHBondContact O-N 2.74Å; Y99-R122 HydrophobicContact CE2-CB 3.96Å; Y99-R122 HydrophobicContact CE2-CG 3.96Å; Y99-L125 HydrophobicContact CD2-CD1 3.83Å; Y99-L125 HydrophobicContact CG-CD1 4.29Å
100	N	97.9	Very high	97.1	Very high	94 Å²	94	64.3 Å²	64.3	50%	0.503	33%	0.325	S	S	.	.	I	π-helix	trans	-70.1	-26.8	-178	-66.5	-29.6	0	0	0	113.4	N96 K97 A107 P108	N96-N100 WeakPolarHBondContact O-CB 3.21Å; N96-N100 VanDerWaalsContact O-CG 3.27Å; N96-N100 PolarHBondContact O-N 2.97Å; N96-N100 VanDerWaalsContact O-N 3.07Å; N96-N100 PolarHBondContact O-ND2 2.76Å; N96-N100 VanDerWaalsContact O-ND2 3.1Å; K97-N100 PolarHBondContact O-N 3.36Å; N100-A107 WeakPolarHBondContact O-CB 3.22Å; N100-P108 WeakPolarHBondContact O-CD 3.42Å
101	E	98.3	Very high	97.2	Very high	58 Å²	58	57.5 Å²	57.5	27%	0.271	30%	0.296	S	S	.	.	I	π-helix	trans	-86.7	-33.6	-178.1	-169.9	173.7	168.5	0	0	112.7	K97 I98 Y99 A107 R109	K97-E101 VanDerWaalsContact CE-OE2 3.3Å; K97-E101 WeakPolarHBondContact CE-OE2 3.19Å; K97-E101 VanDerWaalsContact O-CB 3.23Å; K97-E101 WeakPolarHBondContact O-CB 3.45Å; K97-E101 PolarHBondContact O-N 2.97Å; I98-E101 PolarHBondContact O-N 3.37Å; Y99-E101 VanDerWaalsContact C-N 3.32Å; Y99-E101 PolarHBondContact O-N 3.44Å; E101-A107 WeakPolarHBondContact O-CB 3.47Å; E101-R109 CarbonylContact O-C 3.59Å; E101-R109 WeakPolarHBondContact O-CA 3.45Å; E101-R109 WeakPolarHBondContact O-CB 3.45Å; E101-R109 PolarHBondContact O-N 2.68Å
102	F	98.4	Very high	97.1	Very high	4 Å²	4	63 Å²	63	2%	0.018	33%	0.325	C	S	.	.	I	π-helix	trans	-129.9	-24.1	-169.9	-58.8	-77.8	0	0	0	116.4	E74 F75 A78 I98 R109 E110 V111	E74-F102 HydrophobicContact CB-CE1 4Å; E74-F102 HydrophobicContact CB-CZ 4.02Å; F75-F102 HydrophobicContact CB-CB 4.27Å; F75-F102 HydrophobicContact CB-CD1 3.74Å; F75-F102 HydrophobicContact CB-CD2 4.41Å; F75-F102 HydrophobicContact CB-CE1 4.14Å; F75-F102 HydrophobicContact CB-CG 3.89Å; F75-F102 HydrophobicContact CD2-CB 3.53Å; F75-F102 HydrophobicContact CD2-CD1 4.47Å; F75-F102 HydrophobicContact CD2-CD2 4.01Å; F75-F102 AromaticContact CD2-CG 3.77Å; F75-F102 HydrophobicContact CD2-CG 3.77Å; F75-F102 HydrophobicContact CE2-CB 4.26Å; F75-F102 HydrophobicContact CG-CB 4.2Å; F75-F102 HydrophobicContact CG-CG 4.28Å; A78-F102 HydrophobicContact CB-CE2 4.33Å; I98-F102 HydrophobicContact CG2-CD2 4.34Å; I98-F102 PolarHBondContact O-N 2.99Å; F102-R109 HydrophobicContact CD1-CB 3.99Å; F102-R109 WeakPolarHBondContact CD1-O 3.29Å; F102-R109 HydrophobicContact CE1-CB 4.01Å; F102-E110 CarbonylContact O-C 3.36Å; F102-E110 WeakPolarHBondContact O-CA 3.43Å; F102-V111 HydrophobicContact CB-CG1 4.36Å; F102-V111 HydrophobicContact CD1-CG1 4.41Å; F102-V111 WeakPolarHBondContact O-CG2 3.38Å; F102-V111 PolarHBondContact O-N 3.18Å
103	I	97.8	Very high	97	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.005	31%	0.311	C	S	.	.	I	π-helix	trans	-105.4	-37.3	-168.8	-56.5	-59.3	0	0	0	113.3	F75 Y99 V111 I113 R118 T121 V136	F75-I103 HydrophobicContact CD2-CD1 4.36Å; F75-I103 HydrophobicContact CE2-CD1 3.55Å; F75-I103 HydrophobicContact CE2-CG1 4.2Å; F75-I103 HydrophobicContact CZ-CD1 3.75Å; Y99-I103 HydrophobicContact CD2-CB 3.77Å; Y99-I103 HydrophobicContact CD2-CG1 4.48Å; Y99-I103 HydrophobicContact CD2-CG2 3.66Å; Y99-I103 HydrophobicContact CE2-CB 4.18Å; Y99-I103 HydrophobicContact CE2-CG2 3.66Å; Y99-I103 HydrophobicContact CG-CB 4.31Å; Y99-I103 WeakPolarHBondContact O-CA 3.2Å; Y99-I103 PolarHBondContact O-N 3.27Å; I103-V111 HydrophobicContact CD1-CG2 4.07Å; I103-I113 HydrophobicContact CD1-CD1 4.13Å; I103-I113 HydrophobicContact CG2-CD1 4.44Å; I103-R118 HydrophobicContact CG2-CG 3.97Å; I103-R118 WeakPolarHBondContact O-CD 3.33Å; I103-T121 HydrophobicContact CD1-CG2 4.49Å; I103-T121 HydrophobicContact CG1-CG2 4.33Å; I103-T121 HydrophobicContact CG2-CG2 4.08Å; I103-V136 HydrophobicContact CD1-CG2 3.83Å
104	D	96.5	Very high	96.9	Very high	53 Å²	53	60.3 Å²	60.3	28%	0.283	31%	0.305	S	S	.	.	S	Bend	trans	-60.5	148.6	-178.6	-168.2	10.2	0	0	0	111.6	Y99 K106 A107	Y99-D104 HydrophobicContact CD1-CB 4.31Å; Y99-D104 HydrophobicContact CE1-CB 3.88Å; Y99-D104 PolarHBondContact O-N 2.74Å; D104-K106 PolarHBondContact O-N 3.3Å; D104-A107 HydrophobicContact CB-CB 4.18Å; D104-A107 WeakPolarHBondContact O-CB 3.41Å; D104-A107 PolarHBondContact O-N 3.27Å
105	V	93.1	Very high	96.7	Very high	92 Å²	92	66.2 Å²	66.2	56%	0.558	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-14.9	178.8	-171.1	0	0	0	0	113.1
106	K	93.3	Very high	96.6	Very high	186 Å²	186	75.7 Å²	75.7	81%	0.809	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.7	17.1	177.9	-61.1	-178.3	-178.5	176.5	0	111.8	D104	D104-K106 PolarHBondContact O-N 3.3Å
107	A	97	Very high	96.5	Very high	11 Å²	11	72 Å²	72	9%	0.091	35%	0.347	C	S	.	.			trans	-62.9	136.6	178.3	0	0	0	0	0	109.4	N100 E101 D104 R109 E110	N100-A107 WeakPolarHBondContact O-CB 3.22Å; E101-A107 WeakPolarHBondContact O-CB 3.47Å; D104-A107 HydrophobicContact CB-CB 4.18Å; D104-A107 WeakPolarHBondContact O-CB 3.41Å; D104-A107 PolarHBondContact O-N 3.27Å; A107-R109 PolarHBondContact O-N 2.75Å; A107-R109 VanDerWaalsContact O-N 3.1Å; A107-E110 HydrophobicContact CB-CB 4.13Å; A107-E110 PolarHBondContact O-N 2.85Å
108	P	97.1	Very high	96.4	Very high	113 Å²	113	67.9 Å²	67.9	73%	0.734	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-20.1	-177.5	26.9	-35.5	0	0	0	112.9	N100	N100-P108 WeakPolarHBondContact O-CD 3.42Å
109	R	97.6	Very high	96.3	Very high	61 Å²	61	70.5 Å²	70.5	23%	0.23	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.4	43.5	178.5	-55.5	-171.7	71.1	-152.1	3.1	110.6	D70 E71 E74 E101 F102 A107 V111	D70-R109 VanDerWaalsContact CG-NH2 3.28Å; D70-R109 PolarHBondContact O-NH2 3.11Å; D70-R109 IonicContact OD1-NH2 3.66Å; D70-R109 PolarHBondContact OD1-NH2 3.08Å; D70-R109 IonicContact OD2-NH2 3.75Å; D70-R109 PolarHBondContact OD2-NH2 3.09Å; E71-R109 HydrophobicContact CB-CB 3.94Å; E74-R109 VanDerWaalsContact CB-NH1 3.27Å; E74-R109 VanDerWaalsContact CG-NH1 3.34Å; E101-R109 CarbonylContact O-C 3.59Å; E101-R109 WeakPolarHBondContact O-CA 3.45Å; E101-R109 WeakPolarHBondContact O-CB 3.45Å; E101-R109 PolarHBondContact O-N 2.68Å; F102-R109 HydrophobicContact CD1-CB 3.99Å; F102-R109 WeakPolarHBondContact CD1-O 3.29Å; F102-R109 HydrophobicContact CE1-CB 4.01Å; A107-R109 PolarHBondContact O-N 2.75Å; A107-R109 VanDerWaalsContact O-N 3.1Å; R109-V111 PolarHBondContact O-N 3.33Å
110	E	97.3	Very high	96.2	Very high	69 Å²	69	70.9 Å²	70.9	32%	0.322	35%	0.347	S	S	.	.			trans	-51.9	125.8	179.9	-174.2	-177.9	174.5	0	0	111.8	F102 A107 R118	F102-E110 CarbonylContact O-C 3.36Å; F102-E110 WeakPolarHBondContact O-CA 3.43Å; A107-E110 HydrophobicContact CB-CB 4.13Å; A107-E110 PolarHBondContact O-N 2.85Å; E110-R118 IonicContact OE1-CZ 3.06Å; E110-R118 IonicContact OE1-NH1 3.57Å; E110-R118 PolarHBondContact OE1-NH1 3.37Å; E110-R118 IonicContact OE1-NH2 3.33Å; E110-R118 PolarHBondContact OE1-NH2 3.05Å
111	V	97.6	Very high	96.1	Very high	1 Å²	1	66.6 Å²	66.6	1%	0.006	32%	0.324	C	S	.	.			trans	-80.8	146	173.6	-65.7	0	0	0	0	111.1	E71 F75 F102 I103 R109 I113 V140	E71-V111 HydrophobicContact CG-CG1 4.31Å; F75-V111 HydrophobicContact CB-CG1 3.68Å; F75-V111 HydrophobicContact CD1-CG1 4.15Å; F75-V111 HydrophobicContact CG-CG1 3.9Å; F102-V111 HydrophobicContact CB-CG1 4.36Å; F102-V111 HydrophobicContact CD1-CG1 4.41Å; F102-V111 WeakPolarHBondContact O-CG2 3.38Å; F102-V111 PolarHBondContact O-N 3.18Å; I103-V111 HydrophobicContact CD1-CG2 4.07Å; R109-V111 PolarHBondContact O-N 3.33Å; V111-I113 HydrophobicContact CG2-CD1 4.28Å; V111-I113 HydrophobicContact CG2-CG1 4.36Å; V111-I113 HydrophobicContact CG2-CG2 3.98Å; V111-I113 PolarHBondContact O-N 3.41Å; V111-V140 HydrophobicContact CB-CG2 3.99Å; V111-V140 HydrophobicContact CG1-CG2 4.37Å; V111-V140 HydrophobicContact CG2-CG2 3.89Å
112	N	95.4	Very high	96	Very high	126 Å²	126	67.9 Å²	67.9	67%	0.674	33%	0.327	S	S	*	.			trans	-74.8	87.8	-178	-174.7	12.9	0	0	0	112.2	L143	N112-L143 HydrophobicContact CB-CD2 4.12Å
113	I	95	Very high	95.9	Very high	14 Å²	14	72.4 Å²	72.4	7%	0.072	35%	0.348	C	S	.	.			trans	-127.6	148.1	177.8	62.4	176.1	0	0	0	111.8	I103 V111 T117 R118 V136 V140	I103-I113 HydrophobicContact CD1-CD1 4.13Å; I103-I113 HydrophobicContact CG2-CD1 4.44Å; V111-I113 HydrophobicContact CG2-CD1 4.28Å; V111-I113 HydrophobicContact CG2-CG1 4.36Å; V111-I113 HydrophobicContact CG2-CG2 3.98Å; V111-I113 PolarHBondContact O-N 3.41Å; I113-T117 HydrophobicContact CB-CG2 4.34Å; I113-T117 HydrophobicContact CD1-CG2 4.35Å; I113-R118 HydrophobicContact CD1-CB 4.07Å; I113-R118 HydrophobicContact CD1-CG 4.47Å; I113-R118 HydrophobicContact CG1-CB 4.42Å; I113-R118 PolarHBondContact O-NH2 2.94Å; I113-V136 HydrophobicContact CD1-CG2 3.68Å; I113-V136 HydrophobicContact CG2-CG2 4.2Å; I113-V140 HydrophobicContact CG2-CG2 3.94Å
114	D	94.4	Very high	95.7	Very high	91 Å²	91	74 Å²	74	49%	0.487	36%	0.359	S	S	.	.			trans	-68.2	161	178.7	68.8	32	0	0	0	112.8	R116 T117 R118	D114-R116 VanDerWaalsContact C-N 3.25Å; D114-R116 PolarHBondContact O-N 3.45Å; D114-R116 PolarHBondContact OD1-N 3.47Å; D114-T117 PolarHBondContact O-N 2.63Å; D114-T117 WeakPolarHBondContact OD1-CB 3.32Å; D114-T117 PolarHBondContact OD1-N 2.97Å; D114-T117 PolarHBondContact OD1-OG1 3.2Å; D114-R118 PolarHBondContact O-N 3.27Å; D114-R118 VanDerWaalsContact O-N 3.11Å
115	F	94.4	Very high	95.6	Very high	167 Å²	167	72.1 Å²	72.1	73%	0.732	35%	0.349	S	S	*	.	H	α-helix	trans	-55.6	-40.7	-178.6	175	-97.2	0	0	0	112.5	R118 E119	F115-R118 PolarHBondContact O-N 2.9Å; F115-E119 WeakPolarHBondContact O-CB 3.36Å; F115-E119 PolarHBondContact O-N 2.91Å
116	R	95.1	Very high	95.6	Very high	198 Å²	198	73.9 Å²	73.9	75%	0.747	35%	0.351	S	S	*	.	H	α-helix	trans	-65.8	-47.1	-177.5	-177.9	177	178.1	-176.6	-0.5	111.5	D114 R118 E119 V120	D114-R116 VanDerWaalsContact C-N 3.25Å; D114-R116 PolarHBondContact O-N 3.45Å; D114-R116 PolarHBondContact OD1-N 3.47Å; R116-R118 VanDerWaalsContact C-N 3.27Å; R116-R118 PolarHBondContact O-N 3.05Å; R116-E119 PolarHBondContact O-N 3.32Å; R116-V120 WeakPolarHBondContact O-CG2 3.39Å; R116-V120 PolarHBondContact O-N 3.49Å
117	T	95.2	Very high	95.7	Very high	5 Å²	5	73 Å²	73	3%	0.031	35%	0.35	C	S	.	.	H	α-helix	trans	-59.8	-42.4	178.1	-57.9	0	0	0	0	110.5	I113 D114 T121 V136 R139	I113-T117 HydrophobicContact CB-CG2 4.34Å; I113-T117 HydrophobicContact CD1-CG2 4.35Å; D114-T117 PolarHBondContact O-N 2.63Å; D114-T117 WeakPolarHBondContact OD1-CB 3.32Å; D114-T117 PolarHBondContact OD1-N 2.97Å; D114-T117 PolarHBondContact OD1-OG1 3.2Å; T117-T121 WeakPolarHBondContact O-CB 3.39Å; T117-T121 PolarHBondContact O-N 3.49Å; T117-T121 PolarHBondContact O-OG1 2.84Å; T117-V136 HydrophobicContact CG2-CB 4.08Å; T117-V136 HydrophobicContact CG2-CG2 4.09Å; T117-R139 HydrophobicContact CG2-CG 3.89Å
118	R	96.7	Very high	95.6	Very high	35 Å²	35	73.6 Å²	73.6	13%	0.132	35%	0.353	C	S	.	.	H	α-helix	trans	-63.1	-46.4	177.8	-170.3	-175.7	-44.7	-148.6	-5.9	112.2	I103 E110 I113 D114 F115 R116 T121 R122	I103-R118 HydrophobicContact CG2-CG 3.97Å; I103-R118 WeakPolarHBondContact O-CD 3.33Å; E110-R118 IonicContact OE1-CZ 3.06Å; E110-R118 IonicContact OE1-NH1 3.57Å; E110-R118 PolarHBondContact OE1-NH1 3.37Å; E110-R118 IonicContact OE1-NH2 3.33Å; E110-R118 PolarHBondContact OE1-NH2 3.05Å; I113-R118 HydrophobicContact CD1-CB 4.07Å; I113-R118 HydrophobicContact CD1-CG 4.47Å; I113-R118 HydrophobicContact CG1-CB 4.42Å; I113-R118 PolarHBondContact O-NH2 2.94Å; D114-R118 PolarHBondContact O-N 3.27Å; D114-R118 VanDerWaalsContact O-N 3.11Å; F115-R118 PolarHBondContact O-N 2.9Å; R116-R118 VanDerWaalsContact C-N 3.27Å; R116-R118 PolarHBondContact O-N 3.05Å; R118-T121 WeakPolarHBondContact O-CB 3.42Å; R118-T121 PolarHBondContact O-N 3.29Å; R118-R122 PolarHBondContact O-N 3Å
119	E	95.9	Very high	95.6	Very high	56 Å²	56	71 Å²	71	26%	0.262	34%	0.335	S	S	.	.	H	α-helix	trans	-65.7	-41.3	-179.8	-176.4	53.6	-152.6	0	0	111.8	F115 R116 T121 R122 Q123	F115-E119 WeakPolarHBondContact O-CB 3.36Å; F115-E119 PolarHBondContact O-N 2.91Å; R116-E119 PolarHBondContact O-N 3.32Å; E119-T121 VanDerWaalsContact C-N 3.3Å; E119-T121 PolarHBondContact O-N 3.13Å; E119-R122 WeakPolarHBondContact O-CB 3.43Å; E119-R122 PolarHBondContact O-N 3.47Å; E119-R122 IonicContact OE1-CZ 3.27Å; E119-R122 IonicContact OE1-NE 3.7Å; E119-R122 PolarHBondContact OE1-NE 3.46Å; E119-R122 VanDerWaalsContact OE1-NE 3.14Å; E119-R122 IonicContact OE1-NH2 3.19Å; E119-R122 PolarHBondContact OE1-NH2 3.19Å; E119-R122 IonicContact OE2-NE 2.74Å; E119-R122 PolarHBondContact OE2-NE 3.45Å; E119-Q123 WeakPolarHBondContact O-CG 3.1Å; E119-Q123 PolarHBondContact O-N 3.48Å; E119-Q123 PolarHBondContact OE1-NE2 3.05Å
120	V	95.4	Very high	95.5	Very high	53 Å²	53	71.1 Å²	71.1	32%	0.321	34%	0.344	S	S	.	.	H	α-helix	trans	-60.2	-41.8	172.6	170.8	0	0	0	0	111.1	R116 Q123 S124	R116-V120 WeakPolarHBondContact O-CG2 3.39Å; R116-V120 PolarHBondContact O-N 3.49Å; V120-Q123 PolarHBondContact O-N 3.09Å; V120-S124 WeakPolarHBondContact O-CB 3.23Å; V120-S124 PolarHBondContact O-N 3.39Å
121	T	96.3	Very high	95.4	Very high	4 Å²	4	71 Å²	71	3%	0.025	35%	0.35	C	S	.	.	H	α-helix	trans	-65.7	-41.1	176.8	-55.5	0	0	0	0	111.5	I103 T117 R118 E119 Q123 S124 L125 L133 V136	I103-T121 HydrophobicContact CD1-CG2 4.49Å; I103-T121 HydrophobicContact CG1-CG2 4.33Å; I103-T121 HydrophobicContact CG2-CG2 4.08Å; T117-T121 WeakPolarHBondContact O-CB 3.39Å; T117-T121 PolarHBondContact O-N 3.49Å; T117-T121 PolarHBondContact O-OG1 2.84Å; R118-T121 WeakPolarHBondContact O-CB 3.42Å; R118-T121 PolarHBondContact O-N 3.29Å; E119-T121 VanDerWaalsContact C-N 3.3Å; E119-T121 PolarHBondContact O-N 3.13Å; T121-Q123 VanDerWaalsContact C-N 3.33Å; T121-Q123 PolarHBondContact O-N 2.9Å; T121-S124 PolarHBondContact O-N 2.85Å; T121-S124 PolarHBondContact O-OG 2.95Å; T121-L125 HydrophobicContact CG2-CD1 4.13Å; T121-L125 HydrophobicContact CG2-CG 4.46Å; T121-L125 VanDerWaalsContact O-CG 3.26Å; T121-L125 WeakPolarHBondContact O-CG 3.48Å; T121-L125 PolarHBondContact O-N 3.25Å; T121-L133 HydrophobicContact CG2-CD2 3.93Å; T121-V136 HydrophobicContact CG2-CB 4.39Å; T121-V136 HydrophobicContact CG2-CG1 3.78Å; T121-V136 WeakPolarHBondContact OG1-CB 3.22Å
122	R	96.3	Very high	95.4	Very high	85 Å²	85	71.7 Å²	71.7	32%	0.321	36%	0.355	S	S	.	.	H	α-helix	trans	-58.9	-46.9	177.4	-170.7	-163.9	67	65.9	3.2	110.7	Y99 R118 E119 L125 E126	Y99-R122 HydrophobicContact CE2-CB 3.96Å; Y99-R122 HydrophobicContact CE2-CG 3.96Å; R118-R122 PolarHBondContact O-N 3Å; E119-R122 WeakPolarHBondContact O-CB 3.43Å; E119-R122 PolarHBondContact O-N 3.47Å; E119-R122 IonicContact OE1-CZ 3.27Å; E119-R122 IonicContact OE1-NE 3.7Å; E119-R122 PolarHBondContact OE1-NE 3.46Å; E119-R122 VanDerWaalsContact OE1-NE 3.14Å; E119-R122 IonicContact OE1-NH2 3.19Å; E119-R122 PolarHBondContact OE1-NH2 3.19Å; E119-R122 IonicContact OE2-NE 2.74Å; E119-R122 PolarHBondContact OE2-NE 3.45Å; R122-L125 PolarHBondContact O-N 3.44Å; R122-E126 IonicContact CZ-OE1 2.71Å; R122-E126 IonicContact NH1-OE1 2.72Å; R122-E126 PolarHBondContact NH1-OE1 2.86Å; R122-E126 IonicContact NH2-OE1 3.07Å; R122-E126 PolarHBondContact O-N 2.88Å
123	Q	95.8	Very high	95.5	Very high	100 Å²	100	65.7 Å²	65.7	47%	0.467	32%	0.323	S	S	.	.	H	α-helix	trans	-65.1	-41.8	178	-67.6	172.2	10.2	0	0	111.9	E119 V120 T121 L125 E126	E119-Q123 WeakPolarHBondContact O-CG 3.1Å; E119-Q123 PolarHBondContact O-N 3.48Å; E119-Q123 PolarHBondContact OE1-NE2 3.05Å; V120-Q123 PolarHBondContact O-N 3.09Å; T121-Q123 VanDerWaalsContact C-N 3.33Å; T121-Q123 PolarHBondContact O-N 2.9Å; Q123-L125 PolarHBondContact O-N 3.36Å; Q123-L125 VanDerWaalsContact O-N 3.17Å; Q123-E126 WeakPolarHBondContact O-CB 3.33Å; Q123-E126 PolarHBondContact O-N 3.49Å; Q123-E126 VanDerWaalsContact O-N 3.13Å
124	S	94.7	Very high	95.6	Very high	33 Å²	33	68.4 Å²	68.4	23%	0.231	34%	0.338	C	S	.	.	H	α-helix	trans	-66.4	-17.5	179.3	78.6	0	0	0	0	113.9	V120 T121 S132	V120-S124 WeakPolarHBondContact O-CB 3.23Å; V120-S124 PolarHBondContact O-N 3.39Å; T121-S124 PolarHBondContact O-N 2.85Å; T121-S124 PolarHBondContact O-OG 2.95Å; S124-S132 VanDerWaalsContact O-CB 3.26Å; S124-S132 WeakPolarHBondContact O-CB 3.3Å; S124-S132 PolarHBondContact O-OG 2.85Å; S124-S132 PolarHBondContact OG-O 3.31Å
125	L	94.6	Very high	95.7	Very high	15 Å²	15	68.4 Å²	68.4	8%	0.079	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-1.6	177.5	-66.2	-177.6	0	0	0	113.7	A95 Y99 T121 R122 Q123 E127 P128 L133	A95-L125 HydrophobicContact CB-CD2 3.81Å; Y99-L125 HydrophobicContact CD2-CD1 3.83Å; Y99-L125 HydrophobicContact CG-CD1 4.29Å; T121-L125 HydrophobicContact CG2-CD1 4.13Å; T121-L125 HydrophobicContact CG2-CG 4.46Å; T121-L125 VanDerWaalsContact O-CG 3.26Å; T121-L125 WeakPolarHBondContact O-CG 3.48Å; T121-L125 PolarHBondContact O-N 3.25Å; R122-L125 PolarHBondContact O-N 3.44Å; Q123-L125 PolarHBondContact O-N 3.36Å; Q123-L125 VanDerWaalsContact O-N 3.17Å; L125-E127 VanDerWaalsContact C-N 3.32Å; L125-P128 WeakPolarHBondContact O-CD 3.44Å; L125-P128 VanDerWaalsContact O-CG 3.27Å; L125-P128 WeakPolarHBondContact O-CG 3.09Å; L125-L133 HydrophobicContact CD1-CD2 4.03Å; L125-L133 HydrophobicContact CD2-CD2 3.95Å; L125-L133 HydrophobicContact CD2-CG 4.23Å; L125-L133 HydrophobicContact CG-CD2 4.32Å
126	E	93.6	Very high	95.8	Very high	128 Å²	128	60.4 Å²	60.4	60%	0.598	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-39.3	169.4	-67.1	179.5	-176.4	0	0	110.6	R122 Q123	R122-E126 IonicContact CZ-OE1 2.71Å; R122-E126 IonicContact NH1-OE1 2.72Å; R122-E126 PolarHBondContact NH1-OE1 2.86Å; R122-E126 IonicContact NH2-OE1 3.07Å; R122-E126 PolarHBondContact O-N 2.88Å; Q123-E126 WeakPolarHBondContact O-CB 3.33Å; Q123-E126 PolarHBondContact O-N 3.49Å; Q123-E126 VanDerWaalsContact O-N 3.13Å
127	E	93.9	Very high	96	Very high	169 Å²	169	51.3 Å²	51.3	79%	0.79	27%	0.265	S	S	*	.	S	Bend	trans	-123.4	83.2	169.7	-66	-171.8	169.4	0	0	110.2	L125 T129	L125-E127 VanDerWaalsContact C-N 3.32Å; E127-T129 PolarHBondContact O-N 3.36Å
128	P	95.3	Very high	96.1	Very high	23 Å²	23	53.6 Å²	53.6	15%	0.149	29%	0.285	C	S	.	.			trans	-60.7	129.2	-173.5	-26.6	36.3	0	0	0	113.2	Y82 L91 V92 A95 L125	Y82-P128 WeakPolarHBondContact OH-CB 3.46Å; L91-P128 HydrophobicContact CD2-CB 4.29Å; L91-P128 WeakPolarHBondContact CD2-O 3.3Å; L91-P128 HydrophobicContact CG-CB 4.19Å; V92-P128 HydrophobicContact CG2-CG 4.08Å; A95-P128 HydrophobicContact CB-CB 3.97Å; A95-P128 HydrophobicContact CB-CG 3.86Å; L125-P128 WeakPolarHBondContact O-CD 3.44Å; L125-P128 VanDerWaalsContact O-CG 3.27Å; L125-P128 WeakPolarHBondContact O-CG 3.09Å
129	T	96.3	Very high	96.1	Very high	59 Å²	59	58.2 Å²	58.2	36%	0.362	30%	0.302	S	S	.	.			trans	-120.7	160.1	169.6	67.8	0	0	0	0	109.3	Y82 E127 S131 S132	Y82-T129 WeakPolarHBondContact CE1-O 3.49Å; Y82-T129 VanDerWaalsContact CZ-O 3.31Å; Y82-T129 PolarHBondContact OH-O 3.33Å; E127-T129 PolarHBondContact O-N 3.36Å; T129-S131 PolarHBondContact O-N 3.15Å; T129-S131 PolarHBondContact OG1-N 3Å; T129-S131 PolarHBondContact OG1-OG 2.76Å; T129-S131 VanDerWaalsContact OG1-OG 3.09Å; T129-S132 PolarHBondContact N-OG 2.65Å; T129-S132 WeakPolarHBondContact O-CB 3.3Å; T129-S132 PolarHBondContact O-N 3.31Å; T129-S132 PolarHBondContact O-OG 2.73Å; T129-S132 PolarHBondContact OG1-N 2.78Å; T129-S132 PolarHBondContact OG1-OG 2.96Å
130	P	95.9	Very high	96.2	Very high	63 Å²	63	55.5 Å²	55.5	41%	0.409	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-21.7	176.1	-27.4	36.6	0	0	0	114.2	L91	L91-P130 HydrophobicContact CD2-CG 4.44Å
131	S	96.3	Very high	96.4	Very high	66 Å²	66	54 Å²	54	46%	0.462	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-5.7	178.4	46.9	0	0	0	0	115.1	T129 L133 N134	T129-S131 PolarHBondContact O-N 3.15Å; T129-S131 PolarHBondContact OG1-N 3Å; T129-S131 PolarHBondContact OG1-OG 2.76Å; T129-S131 VanDerWaalsContact OG1-OG 3.09Å; S131-L133 PolarHBondContact O-N 3.08Å; S131-N134 WeakPolarHBondContact CB-ND2 3.26Å; S131-N134 WeakPolarHBondContact O-CB 3.42Å; S131-N134 VanDerWaalsContact O-CG 3.31Å; S131-N134 PolarHBondContact O-N 2.73Å
132	S	96.8	Very high	96.5	Very high	15 Å²	15	56 Å²	56	11%	0.105	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-26.3	-172.3	-68.5	0	0	0	0	114.2	S124 T129	S124-S132 VanDerWaalsContact O-CB 3.26Å; S124-S132 WeakPolarHBondContact O-CB 3.3Å; S124-S132 PolarHBondContact O-OG 2.85Å; S124-S132 PolarHBondContact OG-O 3.31Å; T129-S132 PolarHBondContact N-OG 2.65Å; T129-S132 WeakPolarHBondContact O-CB 3.3Å; T129-S132 PolarHBondContact O-N 3.31Å; T129-S132 PolarHBondContact O-OG 2.73Å; T129-S132 PolarHBondContact OG1-N 2.78Å; T129-S132 PolarHBondContact OG1-OG 2.96Å
133	L	97.4	Very high	96.5	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.005	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-0.1	-179.8	-65	175.1	0	0	0	114	Y82 I98 T121 L125 S131 E135 V136 Q137	Y82-L133 HydrophobicContact CD1-CD1 3.77Å; Y82-L133 HydrophobicContact CD1-CG 4.3Å; Y82-L133 HydrophobicContact CD2-CD1 4.2Å; Y82-L133 HydrophobicContact CE1-CD1 4.09Å; Y82-L133 HydrophobicContact CE1-CG 4.21Å; Y82-L133 HydrophobicContact CE2-CD1 4.5Å; Y82-L133 HydrophobicContact CG-CD1 3.84Å; I98-L133 HydrophobicContact CB-CD1 4.4Å; I98-L133 HydrophobicContact CD1-CD1 3.62Å; I98-L133 HydrophobicContact CG2-CD1 3.93Å; I98-L133 HydrophobicContact CG2-CD2 4.45Å; T121-L133 HydrophobicContact CG2-CD2 3.93Å; L125-L133 HydrophobicContact CD1-CD2 4.03Å; L125-L133 HydrophobicContact CD2-CD2 3.95Å; L125-L133 HydrophobicContact CD2-CG 4.23Å; L125-L133 HydrophobicContact CG-CD2 4.32Å; S131-L133 PolarHBondContact O-N 3.08Å; L133-E135 PolarHBondContact O-N 3.42Å; L133-V136 HydrophobicContact CB-CG1 4.3Å; L133-V136 HydrophobicContact CD2-CG1 4.02Å; L133-V136 VanDerWaalsContact O-CG1 3.25Å; L133-V136 WeakPolarHBondContact O-CG1 3.5Å; L133-V136 PolarHBondContact O-N 3.11Å; L133-Q137 WeakPolarHBondContact O-CB 3.38Å; L133-Q137 PolarHBondContact O-N 3.4Å
134	N	97.1	Very high	96.6	Very high	70 Å²	70	49.9 Å²	49.9	37%	0.374	27%	0.27	S	S	.	.	H	α-helix	trans	-60.3	-43.3	-171.7	-75.8	-1.8	0	0	0	112.8	K83 S131 A138	K83-N134 WeakPolarHBondContact CE-OD1 3.34Å; S131-N134 WeakPolarHBondContact CB-ND2 3.26Å; S131-N134 WeakPolarHBondContact O-CB 3.42Å; S131-N134 VanDerWaalsContact O-CG 3.31Å; S131-N134 PolarHBondContact O-N 2.73Å; N134-A138 WeakPolarHBondContact O-CB 3.33Å; N134-A138 PolarHBondContact O-N 3.46Å
135	E	96.1	Very high	96.8	Very high	91 Å²	91	51.6 Å²	51.6	43%	0.425	27%	0.274	S	S	.	.	H	α-helix	trans	-65.5	-52.5	-177.6	-176.8	174.9	173.8	0	0	111.3	L133 Q137 A138 R139	L133-E135 PolarHBondContact O-N 3.42Å; E135-Q137 VanDerWaalsContact C-N 3.32Å; E135-Q137 PolarHBondContact O-N 3.47Å; E135-A138 WeakPolarHBondContact O-CB 3.21Å; E135-A138 PolarHBondContact O-N 3.36Å; E135-A138 VanDerWaalsContact O-N 3.13Å; E135-R139 WeakPolarHBondContact O-CG 3.44Å; E135-R139 PolarHBondContact O-N 3.25Å; E135-R139 IonicContact OE1-NH2 3.39Å
136	V	97.6	Very high	97	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64.7	-36.9	-179.7	58.3	0	0	0	0	112.1	F75 I103 I113 T117 T121 L133 A138 R139 V140	F75-V136 HydrophobicContact CE1-CG2 4.15Å; F75-V136 HydrophobicContact CZ-CB 4.39Å; F75-V136 HydrophobicContact CZ-CG1 3.81Å; F75-V136 HydrophobicContact CZ-CG2 3.87Å; I103-V136 HydrophobicContact CD1-CG2 3.83Å; I113-V136 HydrophobicContact CD1-CG2 3.68Å; I113-V136 HydrophobicContact CG2-CG2 4.2Å; T117-V136 HydrophobicContact CG2-CB 4.08Å; T117-V136 HydrophobicContact CG2-CG2 4.09Å; T121-V136 HydrophobicContact CG2-CB 4.39Å; T121-V136 HydrophobicContact CG2-CG1 3.78Å; T121-V136 WeakPolarHBondContact OG1-CB 3.22Å; L133-V136 HydrophobicContact CB-CG1 4.3Å; L133-V136 HydrophobicContact CD2-CG1 4.02Å; L133-V136 VanDerWaalsContact O-CG1 3.25Å; L133-V136 WeakPolarHBondContact O-CG1 3.5Å; L133-V136 PolarHBondContact O-N 3.11Å; V136-A138 VanDerWaalsContact C-N 3.33Å; V136-A138 PolarHBondContact O-N 3.08Å; V136-R139 WeakPolarHBondContact O-CB 3.25Å; V136-R139 PolarHBondContact O-N 3.32Å; V136-V140 PolarHBondContact O-N 2.94Å
137	Q	98.4	Very high	97.2	Very high	6 Å²	6	56.6 Å²	56.6	3%	0.028	30%	0.297	C	S	.	.	H	α-helix	trans	-61.7	-41.6	173.3	-171.3	-171.7	11.8	0	0	111.5	F75 W76 C79 E80 L133 E135 R139 V140 H141	F75-Q137 HydrophobicContact CE1-CB 4.48Å; W76-Q137 HydrophobicContact CG-CG 4.29Å; W76-Q137 PolarHBondContact O-NE2 3.32Å; C79-Q137 HydrophobicContact CB-CB 4.13Å; C79-Q137 HydrophobicContact CB-CG 3.75Å; E80-Q137 PolarHBondContact OE1-NE2 3.06Å; L133-Q137 WeakPolarHBondContact O-CB 3.38Å; L133-Q137 PolarHBondContact O-N 3.4Å; E135-Q137 VanDerWaalsContact C-N 3.32Å; E135-Q137 PolarHBondContact O-N 3.47Å; Q137-R139 VanDerWaalsContact C-N 3.31Å; Q137-R139 PolarHBondContact O-N 3.25Å; Q137-V140 PolarHBondContact O-N 3.14Å; Q137-H141 VanDerWaalsContact O-CB 3.29Å; Q137-H141 WeakPolarHBondContact O-CB 3.35Å; Q137-H141 PolarHBondContact O-N 2.82Å
138	A	97.6	Very high	97.4	Very high	53 Å²	53	48.7 Å²	48.7	44%	0.438	26%	0.261	S	S	.	.	H	α-helix	trans	-63.7	-36.6	175.9	0	0	0	0	0	112	N134 E135 V136 H141 S142	N134-A138 WeakPolarHBondContact O-CB 3.33Å; N134-A138 PolarHBondContact O-N 3.46Å; E135-A138 WeakPolarHBondContact O-CB 3.21Å; E135-A138 PolarHBondContact O-N 3.36Å; E135-A138 VanDerWaalsContact O-N 3.13Å; V136-A138 VanDerWaalsContact C-N 3.33Å; V136-A138 PolarHBondContact O-N 3.08Å; A138-H141 PolarHBondContact O-N 2.88Å; A138-S142 PolarHBondContact O-N 3.34Å; A138-S142 PolarHBondContact O-OG 2.96Å
139	R	97.7	Very high	97.5	Very high	132 Å²	132	48.6 Å²	48.6	50%	0.498	26%	0.257	S	S	.	.	H	α-helix	trans	-61.7	-49.8	174.1	-60.9	-55.8	-177.4	159	-0	111.9	T117 E135 V136 Q137 H141 S142 L143	T117-R139 HydrophobicContact CG2-CG 3.89Å; E135-R139 WeakPolarHBondContact O-CG 3.44Å; E135-R139 PolarHBondContact O-N 3.25Å; E135-R139 IonicContact OE1-NH2 3.39Å; V136-R139 WeakPolarHBondContact O-CB 3.25Å; V136-R139 PolarHBondContact O-N 3.32Å; Q137-R139 VanDerWaalsContact C-N 3.31Å; Q137-R139 PolarHBondContact O-N 3.25Å; R139-H141 VanDerWaalsContact C-N 3.33Å; R139-H141 PolarHBondContact O-N 3.44Å; R139-S142 PolarHBondContact O-N 2.83Å; R139-L143 PolarHBondContact O-N 2.65Å
140	V	98.1	Very high	97.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-67.4	-35.7	179.6	179.3	0	0	0	0	111.4	N72 F75 V111 I113 V136 Q137 L143 M144	N72-V140 HydrophobicContact CB-CG1 3.7Å; N72-V140 WeakPolarHBondContact O-CG1 3.46Å; F75-V140 HydrophobicContact CD1-CB 3.91Å; F75-V140 HydrophobicContact CD1-CG1 3.97Å; F75-V140 HydrophobicContact CD1-CG2 3.71Å; F75-V140 HydrophobicContact CE1-CB 4.07Å; F75-V140 HydrophobicContact CE1-CG2 3.67Å; V111-V140 HydrophobicContact CB-CG2 3.99Å; V111-V140 HydrophobicContact CG1-CG2 4.37Å; V111-V140 HydrophobicContact CG2-CG2 3.89Å; I113-V140 HydrophobicContact CG2-CG2 3.94Å; V136-V140 PolarHBondContact O-N 2.94Å; Q137-V140 PolarHBondContact O-N 3.14Å; V140-L143 WeakPolarHBondContact O-CB 3.36Å; V140-L143 PolarHBondContact O-N 2.8Å; V140-M144 HydrophobicContact CG1-CE 4.25Å; V140-M144 PolarHBondContact O-N 3.16Å
141	H	98.4	Very high	97.8	Very high	22 Å²	22	48.8 Å²	48.8	10%	0.102	25%	0.25	C	C	.	.	H	α-helix	trans	-58.3	-52.5	171.7	-175.7	-89.9	0	0	0	111.4	F47 D48 W76 Q137 A138 R139 L143 M144 E145	F47-H141 AromaticContact CD1-CD2 3.75Å; F47-H141 AromaticContact CD1-CE1 3.46Å; F47-H141 VanDerWaalsContact CD1-CE1 3.46Å; F47-H141 WeakPolarHBondContact CD1-CE1 3.45Å; F47-H141 AromaticContact CD1-ND1 3.98Å; F47-H141 AromaticContact CD1-NE2 3.27Å; F47-H141 VanDerWaalsContact CD1-NE2 3.27Å; F47-H141 WeakPolarHBondContact CD1-NE2 3.36Å; F47-H141 AromaticContact CE1-CD2 3.64Å; F47-H141 AromaticContact CE1-NE2 3.66Å; D48-H141 IonicContact OD1-CE1 2.73Å; D48-H141 IonicContact OD1-NE2 3.24Å; D48-H141 PolarHBondContact OD1-NE2 3.25Å; W76-H141 AromaticContact NE1-CD2 3.56Å; Q137-H141 VanDerWaalsContact O-CB 3.29Å; Q137-H141 WeakPolarHBondContact O-CB 3.35Å; Q137-H141 PolarHBondContact O-N 2.82Å; A138-H141 PolarHBondContact O-N 2.88Å; R139-H141 VanDerWaalsContact C-N 3.33Å; R139-H141 PolarHBondContact O-N 3.44Å; H141-L143 VanDerWaalsContact C-N 3.27Å; H141-L143 PolarHBondContact O-N 3.33Å; H141-M144 PolarHBondContact O-N 2.95Å; H141-E145 IonicContact CE1-OE2 3.33Å; H141-E145 IonicContact ND1-OE2 3.77Å; H141-E145 WeakPolarHBondContact O-CB 3.41Å; H141-E145 PolarHBondContact O-N 3.4Å
142	S	98.1	Very high	97.9	Very high	45 Å²	45	45.7 Å²	45.7	32%	0.315	23%	0.228	S	C	.	.	H	α-helix	trans	-62.3	-32.2	177	-72	0	0	0	0	113.4	A138 R139 K146	A138-S142 PolarHBondContact O-N 3.34Å; A138-S142 PolarHBondContact O-OG 2.96Å; R139-S142 PolarHBondContact O-N 2.83Å; S142-K146 WeakPolarHBondContact O-CB 3.27Å; S142-K146 VanDerWaalsContact O-CG 3.25Å; S142-K146 WeakPolarHBondContact O-CG 3.33Å; S142-K146 PolarHBondContact O-N 3.07Å
143	L	97.6	Very high	97.9	Very high	56 Å²	56	46.6 Å²	46.6	29%	0.293	23%	0.231	S	C	.	.	H	α-helix	trans	-61.3	-53.7	173.8	175.2	66.8	0	0	0	110.4	N112 R139 V140 H141 E145 K146 D147	N112-L143 HydrophobicContact CB-CD2 4.12Å; R139-L143 PolarHBondContact O-N 2.65Å; V140-L143 WeakPolarHBondContact O-CB 3.36Å; V140-L143 PolarHBondContact O-N 2.8Å; H141-L143 VanDerWaalsContact C-N 3.27Å; H141-L143 PolarHBondContact O-N 3.33Å; L143-E145 PolarHBondContact O-N 2.72Å; L143-K146 PolarHBondContact O-N 3.21Å; L143-D147 WeakPolarHBondContact O-CB 3.46Å; L143-D147 PolarHBondContact O-N 3.07Å; L143-D147 VanDerWaalsContact O-N 3.08Å
144	M	98.4	Very high	97.9	Very high	1 Å²	1	55 Å²	55	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-63	-41.8	178.6	-68.4	-173.5	-68.2	0	0	112.1	F47 F60 L64 N72 I73 W76 V140 H141 K146 S148 Y149	F47-M144 HydrophobicContact CE1-CB 3.78Å; F47-M144 HydrophobicContact CE1-CE 4.2Å; F47-M144 HydrophobicContact CZ-CB 3.57Å; F47-M144 HydrophobicContact CZ-CE 4.08Å; F47-M144 HydrophobicContact CZ-SD 4.33Å; F60-M144 HydrophobicContact CE1-CB 4.27Å; F60-M144 HydrophobicContact CE1-CG 4.49Å; F60-M144 HydrophobicContact CE1-SD 3.87Å; F60-M144 HydrophobicContact CZ-CB 4.2Å; L64-M144 HydrophobicContact CD1-SD 4.06Å; N72-M144 VanDerWaalsContact C-SD 3.6Å; N72-M144 HydrophobicContact CB-CE 4.49Å; N72-M144 HydrophobicContact CB-CG 3.61Å; N72-M144 HydrophobicContact CB-SD 3.5Å; N72-M144 VanDerWaalsContact CB-SD 3.5Å; I73-M144 HydrophobicContact CB-SD 3.94Å; I73-M144 HydrophobicContact CD1-CE 4.03Å; I73-M144 HydrophobicContact CD1-SD 4.13Å; I73-M144 PolarHBondContact N-SD 2.71Å; W76-M144 HydrophobicContact CB-CE 3.98Å; W76-M144 HydrophobicContact CG-CE 4.29Å; V140-M144 HydrophobicContact CG1-CE 4.25Å; V140-M144 PolarHBondContact O-N 3.16Å; H141-M144 PolarHBondContact O-N 2.95Å; M144-K146 VanDerWaalsContact C-N 3.33Å; M144-K146 PolarHBondContact O-N 3.47Å; M144-S148 PolarHBondContact O-N 3.46Å; M144-S148 VanDerWaalsContact O-N 3.11Å; M144-Y149 WeakPolarHBondContact O-CB 3.38Å; M144-Y149 PolarHBondContact O-N 3.23Å
145	E	98.5	Very high	97.9	Very high	69 Å²	69	52.5 Å²	52.5	32%	0.322	25%	0.251	S	S	.	.	H	α-helix	trans	-61.6	-39.4	179.9	-176.2	174.5	-159.5	0	0	112.6	F47 H141 L143 P150	F47-E145 HydrophobicContact CB-CB 4.29Å; F47-E145 HydrophobicContact CB-CG 3.88Å; F47-E145 HydrophobicContact CD1-CB 3.62Å; F47-E145 HydrophobicContact CD1-CG 4.15Å; F47-E145 HydrophobicContact CE1-CB 4.21Å; F47-E145 HydrophobicContact CG-CB 4.13Å; F47-E145 HydrophobicContact CG-CG 4.27Å; H141-E145 IonicContact CE1-OE2 3.33Å; H141-E145 IonicContact ND1-OE2 3.77Å; H141-E145 WeakPolarHBondContact O-CB 3.41Å; H141-E145 PolarHBondContact O-N 3.4Å; L143-E145 PolarHBondContact O-N 2.72Å; E145-P150 VanDerWaalsContact O-CD 3.25Å; E145-P150 WeakPolarHBondContact O-CD 3.37Å
146	K	98	Very high	97.8	Very high	167 Å²	167	54.6 Å²	54.6	73%	0.726	26%	0.259	S	S	*	.	H	α-helix	trans	-86.1	-26.4	-176	-69.6	176.3	-177.3	178.8	0	113.5	S142 L143 M144	S142-K146 WeakPolarHBondContact O-CB 3.27Å; S142-K146 VanDerWaalsContact O-CG 3.25Å; S142-K146 WeakPolarHBondContact O-CG 3.33Å; S142-K146 PolarHBondContact O-N 3.07Å; L143-K146 PolarHBondContact O-N 3.21Å; M144-K146 VanDerWaalsContact C-N 3.33Å; M144-K146 PolarHBondContact O-N 3.47Å
147	D	97.6	Very high	97.6	Very high	80 Å²	80	55.5 Å²	55.5	43%	0.428	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-69.1	-174.7	-177.7	52.1	0	0	0	113	L143 P150 R151	L143-D147 WeakPolarHBondContact O-CB 3.46Å; L143-D147 PolarHBondContact O-N 3.07Å; L143-D147 VanDerWaalsContact O-N 3.08Å; D147-P150 WeakPolarHBondContact O-CD 3.5Å; D147-R151 PolarHBondContact O-NE 3.44Å; D147-R151 IonicContact OD1-NE 3.56Å; D147-R151 IonicContact OD1-NH2 4Å; D147-R151 IonicContact OD2-CZ 3.18Å; D147-R151 IonicContact OD2-NE 2.77Å; D147-R151 IonicContact OD2-NH2 2.96Å; D147-R151 PolarHBondContact OD2-NH2 3.49Å
148	S	98.1	Very high	97.4	Very high	4 Å²	4	55.7 Å²	55.7	3%	0.028	26%	0.264	C	S	.	.	H	α-helix	trans	-73.7	-35.5	-171.9	-50.8	0	0	0	0	113.3	F63 L64 M144 R151 F152	F63-S148 WeakPolarHBondContact CE1-O 3.47Å; L64-S148 WeakPolarHBondContact CD2-OG 3.44Å; M144-S148 PolarHBondContact O-N 3.46Å; M144-S148 VanDerWaalsContact O-N 3.11Å; S148-R151 CarbonylContact O-C 3.59Å; S148-R151 PolarHBondContact O-N 2.94Å; S148-F152 WeakPolarHBondContact O-CB 3.27Å; S148-F152 PolarHBondContact O-N 3.17Å
149	Y	98.6	Very high	97.3	Very high	20 Å²	20	56.6 Å²	56.6	8%	0.078	26%	0.259	C	S	.	.	H	α-helix	trans	-63.3	-47.1	-176.8	170	-117.8	0	0	0	113.5	W43 A44 F47 L50 M144 R151 F152 L153	W43-Y149 PolarHBondContact O-OH 3.22Å; A44-Y149 VanDerWaalsContact C-OH 3.28Å; A44-Y149 WeakPolarHBondContact CA-OH 3.15Å; A44-Y149 PolarHBondContact O-OH 3.39Å; F47-Y149 HydrophobicContact CB-CD1 4.01Å; F47-Y149 HydrophobicContact CB-CE1 4.08Å; F47-Y149 HydrophobicContact CB-CG 4.25Å; F47-Y149 HydrophobicContact CD2-CD1 4.25Å; F47-Y149 AromaticContact CD2-CD2 3.58Å; F47-Y149 HydrophobicContact CD2-CD2 3.58Å; F47-Y149 HydrophobicContact CD2-CE2 4.17Å; F47-Y149 AromaticContact CD2-CG 3.62Å; F47-Y149 HydrophobicContact CD2-CG 3.62Å; F47-Y149 HydrophobicContact CE2-CD2 4.26Å; F47-Y149 HydrophobicContact CE2-CG 4.32Å; F47-Y149 HydrophobicContact CG-CD1 4.39Å; F47-Y149 HydrophobicContact CG-CD2 4.45Å; F47-Y149 HydrophobicContact CG-CG 4.18Å; L50-Y149 HydrophobicContact CB-CE2 4.33Å; L50-Y149 HydrophobicContact CD2-CD2 3.61Å; L50-Y149 HydrophobicContact CD2-CE2 3.72Å; M144-Y149 WeakPolarHBondContact O-CB 3.38Å; M144-Y149 PolarHBondContact O-N 3.23Å; Y149-R151 PolarHBondContact O-N 3.2Å; Y149-F152 HydrophobicContact CD2-CD1 4.42Å; Y149-F152 WeakPolarHBondContact O-CB 3.17Å; Y149-F152 PolarHBondContact O-N 3.2Å; Y149-F152 VanDerWaalsContact O-N 3.16Å; Y149-L153 HydrophobicContact CD2-CD1 4.49Å; Y149-L153 HydrophobicContact CD2-CG 4.27Å; Y149-L153 HydrophobicContact CE1-CD1 4.12Å; Y149-L153 HydrophobicContact CE2-CD1 3.88Å; Y149-L153 HydrophobicContact CE2-CD2 3.9Å; Y149-L153 HydrophobicContact CE2-CG 3.88Å; Y149-L153 PolarHBondContact O-N 3.13Å; Y149-L153 VanDerWaalsContact O-N 3.07Å
150	P	98.4	Very high	97	Very high	49 Å²	49	52.5 Å²	52.5	32%	0.318	25%	0.247	S	C	.	.	H	α-helix	trans	-61.8	-28.5	173.1	-25	34.1	0	0	0	113.5	E145 D147 R154	E145-P150 VanDerWaalsContact O-CD 3.25Å; E145-P150 WeakPolarHBondContact O-CD 3.37Å; D147-P150 WeakPolarHBondContact O-CD 3.5Å; P150-R154 PolarHBondContact O-NE 3.16Å; P150-R154 PolarHBondContact O-NH2 3.36Å
151	R	98.4	Very high	96.6	Very high	78 Å²	78	53.9 Å²	53.9	29%	0.294	25%	0.254	S	S	.	.	H	α-helix	trans	-76.1	-40.2	174.7	-66.6	-172.6	-71.3	127.2	-0.8	111.2	F63 E67 D147 S148 Y149 L153 R154 S155	F63-R151 HydrophobicContact CE1-CB 4.44Å; F63-R151 HydrophobicContact CZ-CB 3.76Å; E67-R151 IonicContact OE1-CZ 2.71Å; E67-R151 IonicContact OE1-NH1 2.72Å; E67-R151 PolarHBondContact OE1-NH1 3.23Å; E67-R151 IonicContact OE2-CZ 3.14Å; E67-R151 IonicContact OE2-NH1 3.22Å; E67-R151 PolarHBondContact OE2-NH1 3.28Å; E67-R151 IonicContact OE2-NH2 3.92Å; E67-R151 PolarHBondContact OE2-NH2 3.08Å; D147-R151 PolarHBondContact O-NE 3.44Å; D147-R151 IonicContact OD1-NE 3.56Å; D147-R151 IonicContact OD1-NH2 4Å; D147-R151 IonicContact OD2-CZ 3.18Å; D147-R151 IonicContact OD2-NE 2.77Å; D147-R151 IonicContact OD2-NH2 2.96Å; D147-R151 PolarHBondContact OD2-NH2 3.49Å; S148-R151 CarbonylContact O-C 3.59Å; S148-R151 PolarHBondContact O-N 2.94Å; Y149-R151 PolarHBondContact O-N 3.2Å; R151-L153 PolarHBondContact O-N 3.39Å; R151-R154 CarbonylContact O-C 3.44Å; R151-R154 PolarHBondContact O-N 3.16Å; R151-R154 VanDerWaalsContact O-N 3.08Å; R151-S155 PolarHBondContact O-N 3.25Å
152	F	98.4	Very high	96.2	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-55.5	-47.9	173.2	168.7	-106.6	0	0	0	112	W43 L50 A59 F60 F63 S148 Y149 R154 S155 I157 Y158	W43-F152 HydrophobicContact CE3-CE1 4.49Å; W43-F152 HydrophobicContact CE3-CZ 4.34Å; L50-F152 HydrophobicContact CD1-CE1 3.7Å; L50-F152 HydrophobicContact CD1-CZ 4.16Å; L50-F152 HydrophobicContact CD2-CD1 3.91Å; L50-F152 HydrophobicContact CD2-CE1 3.84Å; L50-F152 HydrophobicContact CG-CE1 4.47Å; A59-F152 HydrophobicContact CB-CE2 4.09Å; A59-F152 HydrophobicContact CB-CZ 4.01Å; F60-F152 HydrophobicContact CD2-CB 3.76Å; F60-F152 HydrophobicContact CD2-CD1 4Å; F60-F152 AromaticContact CD2-CD2 3.98Å; F60-F152 HydrophobicContact CD2-CD2 3.98Å; F60-F152 AromaticContact CD2-CG 3.63Å; F60-F152 HydrophobicContact CD2-CG 3.63Å; F60-F152 HydrophobicContact CE2-CB 3.8Å; F60-F152 HydrophobicContact CE2-CG 4.19Å; F63-F152 HydrophobicContact CB-CD2 3.6Å; F63-F152 HydrophobicContact CB-CE2 4.2Å; F63-F152 HydrophobicContact CD1-CB 3.64Å; F63-F152 HydrophobicContact CD1-CD2 4.03Å; F63-F152 HydrophobicContact CD1-CG 4.3Å; F63-F152 HydrophobicContact CD2-CD2 4.31Å; F63-F152 HydrophobicContact CE1-CB 3.73Å; F63-F152 HydrophobicContact CG-CB 4.07Å; F63-F152 AromaticContact CG-CD2 3.71Å; F63-F152 HydrophobicContact CG-CD2 3.71Å; F63-F152 HydrophobicContact CG-CG 4.38Å; F63-F152 HydrophobicContact CZ-CB 4.21Å; S148-F152 WeakPolarHBondContact O-CB 3.27Å; S148-F152 PolarHBondContact O-N 3.17Å; Y149-F152 HydrophobicContact CD2-CD1 4.42Å; Y149-F152 WeakPolarHBondContact O-CB 3.17Å; Y149-F152 PolarHBondContact O-N 3.2Å; Y149-F152 VanDerWaalsContact O-N 3.16Å; F152-R154 PolarHBondContact O-N 3.16Å; F152-R154 VanDerWaalsContact O-N 3.14Å; F152-S155 WeakPolarHBondContact O-CB 3.18Å; F152-S155 PolarHBondContact O-N 2.84Å; F152-S155 PolarHBondContact O-OG 3.44Å; F152-I157 HydrophobicContact CE2-CG2 4.39Å; F152-Y158 AromaticContact CE1-CD2 3.7Å; F152-Y158 HydrophobicContact CE1-CD2 3.7Å; F152-Y158 HydrophobicContact CE1-CE2 4.4Å; F152-Y158 HydrophobicContact CE1-CG 4.23Å; F152-Y158 AromaticContact CZ-CD2 3.83Å; F152-Y158 HydrophobicContact CZ-CD2 3.83Å; F152-Y158 HydrophobicContact CZ-CG 4.36Å; F152-Y158 WeakPolarHBondContact O-CB 3.44Å
153	L	97.9	Very high	95.6	Very high	34 Å²	34	59.1 Å²	59.1	18%	0.178	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-20.2	179.6	-63.9	179.9	0	0	0	113.7	A44 Y149 R151 Y158 Q159	A44-L153 HydrophobicContact CB-CD1 4.09Å; A44-L153 HydrophobicContact CB-CD2 4.04Å; Y149-L153 HydrophobicContact CD2-CD1 4.49Å; Y149-L153 HydrophobicContact CD2-CG 4.27Å; Y149-L153 HydrophobicContact CE1-CD1 4.12Å; Y149-L153 HydrophobicContact CE2-CD1 3.88Å; Y149-L153 HydrophobicContact CE2-CD2 3.9Å; Y149-L153 HydrophobicContact CE2-CG 3.88Å; Y149-L153 PolarHBondContact O-N 3.13Å; Y149-L153 VanDerWaalsContact O-N 3.07Å; R151-L153 PolarHBondContact O-N 3.39Å; L153-Y158 HydrophobicContact CB-CD1 4.42Å; L153-Y158 HydrophobicContact CB-CE1 4.5Å; L153-Y158 HydrophobicContact CD2-CD1 4.19Å; L153-Y158 HydrophobicContact CD2-CD2 4.31Å; L153-Y158 HydrophobicContact CD2-CE1 3.87Å; L153-Y158 HydrophobicContact CD2-CE2 4.05Å; L153-Y158 HydrophobicContact CD2-CG 4.39Å; L153-Y158 WeakPolarHBondContact O-CD1 3.33Å; L153-Q159 PolarHBondContact O-NE2 3.48Å
154	R	97.4	Very high	94.3	Very high	178 Å²	178	59.3 Å²	59.3	67%	0.672	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-9	174	-68.5	177.2	-70.6	-173.1	2.7	113	P150 R151 F152	P150-R154 PolarHBondContact O-NE 3.16Å; P150-R154 PolarHBondContact O-NH2 3.36Å; R151-R154 CarbonylContact O-C 3.44Å; R151-R154 PolarHBondContact O-N 3.16Å; R151-R154 VanDerWaalsContact O-N 3.08Å; F152-R154 PolarHBondContact O-N 3.16Å; F152-R154 VanDerWaalsContact O-N 3.14Å
155	S	97.1	Very high	92.2	Very high	17 Å²	17	66.7 Å²	66.7	12%	0.119	31%	0.31	C	S	.	.	S	Bend	trans	-69.9	153	-175.5	76.8	0	0	0	0	111.8	R151 F152 I157 Y158 Q159	R151-S155 PolarHBondContact O-N 3.25Å; F152-S155 WeakPolarHBondContact O-CB 3.18Å; F152-S155 PolarHBondContact O-N 2.84Å; F152-S155 PolarHBondContact O-OG 3.44Å; S155-I157 PolarHBondContact O-N 3.24Å; S155-Y158 PolarHBondContact O-N 2.81Å; S155-Y158 PolarHBondContact OG-N 3.33Å; S155-Q159 VanDerWaalsContact O-CG 3.26Å; S155-Q159 WeakPolarHBondContact O-CG 3.25Å; S155-Q159 PolarHBondContact O-N 2.87Å
156	K	94.3	Very high	89.9	Confident	135 Å²	135	67.5 Å²	67.5	59%	0.587	31%	0.311	S	S	*	.	H	α-helix	trans	-56.8	-36	173.7	-174.2	177.2	177.8	-170	0	112	Y158 Q159 D160	K156-Y158 PolarHBondContact O-N 3.2Å; K156-Q159 PolarHBondContact O-N 2.91Å; K156-D160 VanDerWaalsContact CE-OD2 3.23Å; K156-D160 WeakPolarHBondContact CE-OD2 3.3Å; K156-D160 VanDerWaalsContact CG-OD2 3.3Å; K156-D160 WeakPolarHBondContact CG-OD2 3.28Å; K156-D160 VanDerWaalsContact O-CB 3.3Å; K156-D160 WeakPolarHBondContact O-CB 3.49Å; K156-D160 PolarHBondContact O-N 3.41Å
157	I	93	Very high	87.1	Confident	19 Å²	19	64.4 Å²	64.4	10%	0.097	31%	0.306	C	S	.	.	H	α-helix	trans	-56.1	-52.7	178.1	-63.9	174.3	0	0	0	110.5	F18 F63 T66 F152 S155 L161	F18-I157 HydrophobicContact CE1-CD1 4.03Å; F18-I157 HydrophobicContact CE1-CG1 3.79Å; F18-I157 HydrophobicContact CZ-CG1 3.89Å; F63-I157 HydrophobicContact CB-CD1 4Å; F63-I157 HydrophobicContact CD2-CD1 4.47Å; T66-I157 HydrophobicContact CG2-CD1 4.36Å; F152-I157 HydrophobicContact CE2-CG2 4.39Å; S155-I157 PolarHBondContact O-N 3.24Å; I157-L161 HydrophobicContact CG2-CD1 4.44Å; I157-L161 WeakPolarHBondContact O-CG 3.33Å; I157-L161 PolarHBondContact O-N 3.31Å
158	Y	94.7	Very high	84.3	Confident	11 Å²	11	66.5 Å²	66.5	4%	0.043	31%	0.313	C	S	.	.	H	α-helix	trans	-68.2	-41.6	179.7	-177.8	-107.5	0	0	0	112.3	V40 W43 F152 L153 S155 K156 D160 L161 L162	V40-Y158 HydrophobicContact CG1-CD2 4.17Å; V40-Y158 HydrophobicContact CG1-CE2 3.64Å; V40-Y158 WeakPolarHBondContact O-CE2 3.33Å; V40-Y158 PolarHBondContact O-OH 3.05Å; W43-Y158 HydrophobicContact CB-CE2 4.25Å; W43-Y158 HydrophobicContact CE3-CD2 4.13Å; W43-Y158 AromaticContact CE3-CE2 3.95Å; W43-Y158 HydrophobicContact CE3-CE2 3.95Å; F152-Y158 AromaticContact CE1-CD2 3.7Å; F152-Y158 HydrophobicContact CE1-CD2 3.7Å; F152-Y158 HydrophobicContact CE1-CE2 4.4Å; F152-Y158 HydrophobicContact CE1-CG 4.23Å; F152-Y158 AromaticContact CZ-CD2 3.83Å; F152-Y158 HydrophobicContact CZ-CD2 3.83Å; F152-Y158 HydrophobicContact CZ-CG 4.36Å; F152-Y158 WeakPolarHBondContact O-CB 3.44Å; L153-Y158 HydrophobicContact CB-CD1 4.42Å; L153-Y158 HydrophobicContact CB-CE1 4.5Å; L153-Y158 HydrophobicContact CD2-CD1 4.19Å; L153-Y158 HydrophobicContact CD2-CD2 4.31Å; L153-Y158 HydrophobicContact CD2-CE1 3.87Å; L153-Y158 HydrophobicContact CD2-CE2 4.05Å; L153-Y158 HydrophobicContact CD2-CG 4.39Å; L153-Y158 WeakPolarHBondContact O-CD1 3.33Å; S155-Y158 PolarHBondContact O-N 2.81Å; S155-Y158 PolarHBondContact OG-N 3.33Å; K156-Y158 PolarHBondContact O-N 3.2Å; Y158-D160 VanDerWaalsContact C-N 3.33Å; Y158-D160 PolarHBondContact O-N 3.24Å; Y158-L161 PolarHBondContact O-N 3.42Å; Y158-L162 HydrophobicContact CD1-CD1 3.93Å; Y158-L162 HydrophobicContact CD1-CG 4.44Å; Y158-L162 HydrophobicContact CE1-CD1 3.48Å; Y158-L162 VanDerWaalsContact CE1-CD1 3.48Å; Y158-L162 HydrophobicContact CE1-CG 4.06Å; Y158-L162 PolarHBondContact O-N 2.81Å
159	Q	94.3	Very high	81.5	Confident	72 Å²	72	71.2 Å²	71.2	34%	0.336	35%	0.345	S	S	.	.	H	α-helix	trans	-64.1	-35.8	179.6	-65	-60.9	-39.9	0	0	112.9	L153 S155 K156 L162 K163	L153-Q159 PolarHBondContact O-NE2 3.48Å; S155-Q159 VanDerWaalsContact O-CG 3.26Å; S155-Q159 WeakPolarHBondContact O-CG 3.25Å; S155-Q159 PolarHBondContact O-N 2.87Å; K156-Q159 PolarHBondContact O-N 2.91Å; Q159-L162 PolarHBondContact O-N 3.16Å; Q159-K163 WeakPolarHBondContact O-CD 3.39Å; Q159-K163 VanDerWaalsContact O-CG 3.3Å; Q159-K163 WeakPolarHBondContact O-CG 3.46Å; Q159-K163 PolarHBondContact O-N 2.84Å
160	D	91.3	Very high	78.6	Confident	45 Å²	45	77.3 Å²	77.3	24%	0.241	37%	0.374	C	S	.	.	H	α-helix	trans	-72.5	-35.1	176.7	-70.5	-10.7	0	0	0	111.3	K156 Y158 L162 K163 T164	K156-D160 VanDerWaalsContact CE-OD2 3.23Å; K156-D160 WeakPolarHBondContact CE-OD2 3.3Å; K156-D160 VanDerWaalsContact CG-OD2 3.3Å; K156-D160 WeakPolarHBondContact CG-OD2 3.28Å; K156-D160 VanDerWaalsContact O-CB 3.3Å; K156-D160 WeakPolarHBondContact O-CB 3.49Å; K156-D160 PolarHBondContact O-N 3.41Å; Y158-D160 VanDerWaalsContact C-N 3.33Å; Y158-D160 PolarHBondContact O-N 3.24Å; D160-L162 VanDerWaalsContact C-N 3.34Å; D160-L162 PolarHBondContact O-N 3.17Å; D160-K163 PolarHBondContact O-N 3.01Å; D160-K163 IonicContact OD1-NZ 3.84Å; D160-T164 WeakPolarHBondContact O-CB 3.4Å; D160-T164 PolarHBondContact O-N 3.07Å; D160-T164 PolarHBondContact O-OG1 3.01Å
161	L	90.6	Very high	75.8	Confident	29 Å²	29	86.5 Å²	86.5	15%	0.152	40%	0.402	C	S	.	.	H	α-helix	trans	-63.5	-37.7	172.2	-70.6	170.3	0	0	0	112.4	L35 V40 W43 A59 I157 Y158 K163 T164 Y166	L35-L161 HydrophobicContact CD2-CD2 4.29Å; V40-L161 HydrophobicContact CG1-CB 4Å; W43-L161 HydrophobicContact CH2-CD1 4.28Å; W43-L161 HydrophobicContact CZ3-CD1 3.82Å; A59-L161 HydrophobicContact CB-CD1 3.79Å; I157-L161 HydrophobicContact CG2-CD1 4.44Å; I157-L161 WeakPolarHBondContact O-CG 3.33Å; I157-L161 PolarHBondContact O-N 3.31Å; Y158-L161 PolarHBondContact O-N 3.42Å; L161-K163 VanDerWaalsContact C-N 3.28Å; L161-K163 PolarHBondContact O-N 3.49Å; L161-T164 PolarHBondContact O-N 3.07Å; L161-Y166 HydrophobicContact CD2-CE2 4.38Å
162	L	89.1	Confident	72.8	Confident	31 Å²	31	89.3 Å²	89.3	16%	0.162	42%	0.424	C	S	.	.	H	α-helix	trans	-66.8	-28.3	175.2	-74.4	175.1	0	0	0	113.6	K37 V40 I41 Y158 Q159 D160	K37-L162 VanDerWaalsContact CE-O 3.28Å; K37-L162 WeakPolarHBondContact CE-O 3.25Å; V40-L162 HydrophobicContact CB-CD2 4.11Å; V40-L162 HydrophobicContact CG1-CD2 3.63Å; V40-L162 HydrophobicContact CG1-CG 3.97Å; I41-L162 HydrophobicContact CG1-CD2 3.6Å; Y158-L162 HydrophobicContact CD1-CD1 3.93Å; Y158-L162 HydrophobicContact CD1-CG 4.44Å; Y158-L162 HydrophobicContact CE1-CD1 3.48Å; Y158-L162 VanDerWaalsContact CE1-CD1 3.48Å; Y158-L162 HydrophobicContact CE1-CG 4.06Å; Y158-L162 PolarHBondContact O-N 2.81Å; Q159-L162 PolarHBondContact O-N 3.16Å; D160-L162 VanDerWaalsContact C-N 3.34Å; D160-L162 PolarHBondContact O-N 3.17Å
163	K	85.2	Confident	70.1	Confident	147 Å²	147	94.6 Å²	94.6	64%	0.639	46%	0.46	S	S	*	.	H	α-helix	trans	-86.1	-27.5	179.2	-68.2	167.9	-169.1	168.2	0	112.4	Q159 D160 L161 Q165	Q159-K163 WeakPolarHBondContact O-CD 3.39Å; Q159-K163 VanDerWaalsContact O-CG 3.3Å; Q159-K163 WeakPolarHBondContact O-CG 3.46Å; Q159-K163 PolarHBondContact O-N 2.84Å; D160-K163 PolarHBondContact O-N 3.01Å; D160-K163 IonicContact OD1-NZ 3.84Å; L161-K163 VanDerWaalsContact C-N 3.28Å; L161-K163 PolarHBondContact O-N 3.49Å; K163-Q165 PolarHBondContact O-N 3.12Å; K163-Q165 VanDerWaalsContact O-N 3.16Å
164	T	71	Confident	67.4	Low	60 Å²	60	103.2 Å²	103.2	37%	0.368	51%	0.514	S	S	.	.			trans	-75.4	104.8	-176.6	-56.5	0	0	0	0	110.2	D160 L161 Y166	D160-T164 WeakPolarHBondContact O-CB 3.4Å; D160-T164 PolarHBondContact O-N 3.07Å; D160-T164 PolarHBondContact O-OG1 3.01Å; L161-T164 PolarHBondContact O-N 3.07Å; T164-Y166 HydrophobicContact CG2-CD1 4.44Å; T164-Y166 HydrophobicContact CG2-CD2 3.74Å; T164-Y166 HydrophobicContact CG2-CE1 4.45Å; T164-Y166 HydrophobicContact CG2-CE2 3.74Å; T164-Y166 HydrophobicContact CG2-CG 4.1Å; T164-Y166 PolarHBondContact O-N 3.41Å
165	Q	54.3	Low	65.9	Low	156 Å²	156	99.5 Å²	99.5	73%	0.729	51%	0.506	S	S	*	.			trans	-72	104.4	156.6	-66.8	-177.6	5.2	0	0	106.8	K163 T167	K163-Q165 PolarHBondContact O-N 3.12Å; K163-Q165 VanDerWaalsContact O-N 3.16Å; Q165-T167 PolarHBondContact O-N 3.37Å
166	Y	51	Low	64.3	Low	86 Å²	86	103.8 Å²	103.8	34%	0.337	53%	0.526	S	S	.	.			trans	-69.6	70.6	168.6	-84.4	-82.2	0	0	0	110	K34 L35 L161 T164 H168	K34-Y166 WeakPolarHBondContact CD-O 3.4Å; L35-Y166 HydrophobicContact CB-CD2 4.42Å; L35-Y166 HydrophobicContact CD2-CE2 4.38Å; L161-Y166 HydrophobicContact CD2-CE2 4.38Å; T164-Y166 HydrophobicContact CG2-CD1 4.44Å; T164-Y166 HydrophobicContact CG2-CD2 3.74Å; T164-Y166 HydrophobicContact CG2-CE1 4.45Å; T164-Y166 HydrophobicContact CG2-CE2 3.74Å; T164-Y166 HydrophobicContact CG2-CG 4.1Å; T164-Y166 PolarHBondContact O-N 3.41Å; Y166-H168 VanDerWaalsContact C-N 3.25Å; Y166-H168 PolarHBondContact O-N 3.25Å; Y166-H168 VanDerWaalsContact O-N 3.15Å
167	T	38.7	Very low	62.6	Low	101 Å²	101	102.1 Å²	102.1	62%	0.62	52%	0.523	S	S	*	.			trans	-83.1	71.2	164.7	41.4	0	0	0	0	109.1	Q165 C169	Q165-T167 PolarHBondContact O-N 3.37Å; T167-C169 PolarHBondContact O-N 2.91Å
168	H	38.8	Very low	60.8	Low	125 Å²	125	106.9 Å²	106.9	58%	0.579	55%	0.548	S	S	*	.			trans	-75.9	84.8	159.5	-163.9	74.2	0	0	0	108.2	K34 Y166	K34-H168 WeakPolarHBondContact CE-O 3.48Å; K34-H168 PolarHBondContact NZ-O 2.96Å; Y166-H168 VanDerWaalsContact C-N 3.25Å; Y166-H168 PolarHBondContact O-N 3.25Å; Y166-H168 VanDerWaalsContact O-N 3.15Å
169	C	38.2	Very low	58.7	Low	103 Å²	103	112.9 Å²	112.9	70%	0.696	58%	0.579	S	S	*	*			trans	-99.2	117.3	159.9	-75.1	0	0	0	0	106.6	T167 R171	T167-C169 PolarHBondContact O-N 2.91Å; C169-R171 PolarHBondContact O-N 3.13Å
170	Q	38.3	Very low	56.3	Low	148 Å²	148	115.7 Å²	115.7	69%	0.692	60%	0.596	S	S	*	*			trans	-53.1	130.3	176.7	-68	174.6	-5.3	0	0	109.3	N172	Q170-N172 VanDerWaalsContact C-N 3.27Å; Q170-N172 PolarHBondContact O-N 3.47Å
171	R	39.3	Very low	53.8	Low	241 Å²	241	120.7 Å²	120.7	91%	0.909	62%	0.621	S	S	*	*			trans	-64.7	95.9	158.8	-87.4	-177.5	174.4	131.6	-2.5	106.6	C169 S173	C169-R171 PolarHBondContact O-N 3.13Å; R171-S173 VanDerWaalsContact C-N 3.35Å; R171-S173 PolarHBondContact O-N 3.46Å; R171-S173 VanDerWaalsContact O-N 3.08Å
172	N	36	Very low	51	Low	138 Å²	138	127.8 Å²	127.8	74%	0.738	66%	0.657	S	S	*	*			trans	-69.8	101.9	159.9	-75.2	-5.6	0	0	0	106.5	Q170	Q170-N172 VanDerWaalsContact C-N 3.27Å; Q170-N172 PolarHBondContact O-N 3.47Å
173	S	40.9	Very low	47.8	Very low	111 Å²	111	135.8 Å²	135.8	78%	0.776	70%	0.698	S	S	*	*			trans	-78	117.6	161.8	-54.3	0	0	0	0	106.4	R171	R171-S173 VanDerWaalsContact C-N 3.35Å; R171-S173 PolarHBondContact O-N 3.46Å; R171-S173 VanDerWaalsContact O-N 3.08Å
174	V	42.6	Very low	44.5	Very low	214 Å²	214	134.8 Å²	134.8	100%	1.297	70%	0.704	S	S	*	*			trans	-113.8	0	151	-175.5	0	0	0	0	105.7

Retrieved 174 of 174 residues in 359.3 ms (Link to these results)

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