A0A077Z4T0_TRITR Loading...

MFS 1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z4T0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 661 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.3	Very low	31.8	Very low	240 Å²	240	165.5 Å²	165.5	100%	1.182	87%	0.872	S	S	*	*				0	135.3	0	-92.3	180	170.3	0	0	108.4
2	P	49.4	Very low	31.5	Very low	116 Å²	116	170.8 Å²	170.8	75%	0.753	87%	0.871	S	S	*	*				-123.8	134.3	-115.7	32.7	-18.4	0	0	0	112.9
3	L	32.6	Very low	31.1	Very low	177 Å²	177	169.2 Å²	169.2	93%	0.927	86%	0.864	S	S	*	*	P	Polyproline II helix	trans	-85.7	127	165	-77.4	159	0	0	0	108.5
4	T	33.3	Very low	31	Very low	134 Å²	134	161.9 Å²	161.9	82%	0.822	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-59.1	133.2	-171	36.5	0	0	0	0	113.1	E6	T4-E6 PolarHBondContact O-N 3.09Å
5	R	29.8	Very low	30.5	Very low	243 Å²	243	163.6 Å²	163.6	92%	0.917	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-62.7	120.4	176.9	-74.6	172.9	168.2	173.2	-5.6	111.2
6	E	31	Very low	30.6	Very low	188 Å²	188	164.3 Å²	164.3	88%	0.879	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-83.3	122.3	154.7	-77.2	-178.8	158.8	0	0	108.5	T4 V8	T4-E6 PolarHBondContact O-N 3.09Å; E6-V8 PolarHBondContact O-N 2.84Å
7	T	30.2	Very low	30.5	Very low	138 Å²	138	165.2 Å²	165.2	85%	0.847	85%	0.852	S	S	*	*			trans	-69.5	110.8	179.1	40.8	0	0	0	0	110.6
8	V	29.8	Very low	30.6	Very low	130 Å²	130	162.8 Å²	162.8	79%	0.788	85%	0.849	S	S	*	*			trans	-76.1	114.5	164.8	177	0	0	0	0	107.9	E6 E10	E6-V8 PolarHBondContact O-N 2.84Å; V8-E10 PolarHBondContact O-N 2.77Å
9	A	29	Very low	30.6	Very low	98 Å²	98	164.5 Å²	164.5	81%	0.81	85%	0.852	S	S	*	*			trans	-79.3	105	171	0	0	0	0	0	108.9	E11	A9-E11 PolarHBondContact O-N 3.11Å
10	E	28.8	Very low	30.3	Very low	163 Å²	163	165.6 Å²	165.6	76%	0.762	86%	0.855	S	S	*	*			trans	-76.4	109.9	170	-73.6	178.1	154.8	0	0	109.8	V8 R12	V8-E10 PolarHBondContact O-N 2.77Å; E10-R12 PolarHBondContact O-N 3.33Å
11	E	28.2	Very low	30.4	Very low	194 Å²	194	163.5 Å²	163.5	91%	0.907	86%	0.855	S	S	*	*			trans	-67.6	104.8	164.3	-91.4	-179.7	145.7	0	0	109.5	A9 I13	A9-E11 PolarHBondContact O-N 3.11Å; E11-I13 PolarHBondContact O-N 3.03Å
12	R	28.1	Very low	30.5	Very low	229 Å²	229	156.3 Å²	156.3	86%	0.864	83%	0.834	S	S	*	*			trans	-75.6	116.1	167.9	-81.6	-176.9	-150.6	-145.8	0.8	110	E10 G14	E10-R12 PolarHBondContact O-N 3.33Å; R12-G14 PolarHBondContact O-N 3.29Å; R12-G14 VanDerWaalsContact O-N 3.11Å
13	I	26.2	Very low	29.9	Very low	150 Å²	150	156.9 Å²	156.9	77%	0.769	84%	0.838	S	S	*	*			trans	-66.3	100.9	166.8	-59.4	171	0	0	0	107.9	E11 F15	E11-I13 PolarHBondContact O-N 3.03Å; I13-F15 HydrophobicContact CG2-CD2 4.29Å; I13-F15 HydrophobicContact CG2-CE2 4.15Å; I13-F15 PolarHBondContact O-N 3.02Å
14	G	28.9	Very low	29.9	Very low	67 Å²	67	158.3 Å²	158.3	69%	0.691	84%	0.837	S	S	*	*			trans	-82.3	107.3	173	0	0	0	0	0	110.7	R12 L16	R12-G14 PolarHBondContact O-N 3.29Å; R12-G14 VanDerWaalsContact O-N 3.11Å; G14-L16 PolarHBondContact O-N 3.19Å
15	F	24.5	Very low	29.8	Very low	187 Å²	187	158.3 Å²	158.3	82%	0.82	84%	0.837	S	S	*	*			trans	-71.2	115.3	163.2	-83	-98.8	0	0	0	108.6	I13	I13-F15 HydrophobicContact CG2-CD2 4.29Å; I13-F15 HydrophobicContact CG2-CE2 4.15Å; I13-F15 PolarHBondContact O-N 3.02Å
16	L	31.7	Very low	29.9	Very low	174 Å²	174	152.3 Å²	152.3	91%	0.911	83%	0.829	S	S	*	*			trans	-113.4	108.1	167.2	-75.3	169.5	0	0	0	107.9	G14	G14-L16 PolarHBondContact O-N 3.19Å
17	E	29.2	Very low	29.9	Very low	180 Å²	180	149.2 Å²	149.2	84%	0.841	83%	0.826	S	S	*	*			trans	-70.2	152.6	174.7	-74.4	-179.7	157.6	0	0	111.5
18	P	32	Very low	29.9	Very low	122 Å²	122	148 Å²	148	79%	0.792	82%	0.823	S	S	*	*			trans	-85.1	120.1	-164.8	32.1	-32.1	0	0	0	112.7	M20	P18-M20 PolarHBondContact O-N 2.73Å
19	E	30.7	Very low	29.7	Very low	195 Å²	195	151.3 Å²	151.3	91%	0.911	83%	0.827	S	S	*	*			trans	-78	104.7	167.9	-78.7	-171.7	153.3	0	0	110.9
20	M	24.3	Very low	29.8	Very low	186 Å²	186	154.1 Å²	154.1	92%	0.916	83%	0.828	S	S	*	*			trans	-76.4	117.5	161.2	-80.6	170.1	48.8	0	0	109.7	P18	P18-M20 PolarHBondContact O-N 2.73Å
21	S	31.6	Very low	29.7	Very low	122 Å²	122	155.3 Å²	155.3	85%	0.853	83%	0.834	S	S	*	*			trans	-137.1	141	158.8	68.2	0	0	0	0	111.7
22	A	31.9	Very low	29.7	Very low	89 Å²	89	155.4 Å²	155.4	74%	0.736	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-80.2	167.1	-156.2	0	0	0	0	0	114.6
23	P	35.8	Very low	29.6	Very low	129 Å²	129	154.1 Å²	154.1	84%	0.838	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-82.4	134.9	-155.6	32.8	-32.1	0	0	0	112.8
24	K	33	Very low	29.6	Very low	207 Å²	207	155.3 Å²	155.3	90%	0.9	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-98.5	133.7	169.5	-72.6	-177.3	178.9	177.1	0	110.4
25	T	31.3	Very low	29.4	Very low	133 Å²	133	161.7 Å²	161.7	82%	0.816	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-61.5	154.5	-174.6	30.6	0	0	0	0	114.4
26	P	32.2	Very low	29.4	Very low	118 Å²	118	158.5 Å²	158.5	77%	0.766	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-79.9	143.2	-161.9	31.5	-34.1	0	0	0	112.9
27	P	31.5	Very low	29	Very low	123 Å²	123	159.4 Å²	159.4	80%	0.799	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-81.4	150.5	179.8	32.4	-31.8	0	0	0	112.6
28	S	29.3	Very low	28.8	Very low	112 Å²	112	160 Å²	160	78%	0.783	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-65.1	142.2	-176.9	46	0	0	0	0	114.1	D30	S28-D30 PolarHBondContact O-N 3.14Å
29	F	25.8	Very low	28.5	Very low	200 Å²	200	163 Å²	163	88%	0.877	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-63	117.1	174.4	-83.1	-107.8	0	0	0	111.4
30	D	30.3	Very low	28.3	Very low	157 Å²	157	162.1 Å²	162.1	84%	0.84	84%	0.837	S	S	*	*			trans	-118.8	113.3	157.6	-98.3	-31.3	0	0	0	108	S28 K32	S28-D30 PolarHBondContact O-N 3.14Å; D30-K32 PolarHBondContact O-N 3.02Å
31	E	28.5	Very low	28.5	Very low	188 Å²	188	159.1 Å²	159.1	88%	0.879	83%	0.832	S	S	*	*			trans	-63.4	108.1	178.5	-70.9	173.6	149.2	0	0	110.2
32	K	26.7	Very low	28.3	Very low	196 Å²	196	156.6 Å²	156.6	85%	0.852	83%	0.825	S	S	*	*			trans	-124.1	106.6	156.8	-76.6	-174.1	178.5	175.7	0	108.2	D30 E34	D30-K32 PolarHBondContact O-N 3.02Å; K32-E34 VanDerWaalsContact C-N 3.3Å; K32-E34 PolarHBondContact O-N 3.47Å
33	E	25.7	Very low	28	Very low	202 Å²	202	161.5 Å²	161.5	94%	0.944	83%	0.83	S	S	*	*			trans	-58.4	87	171.7	-68.3	-178.9	142.8	0	0	110.3
34	E	26.6	Very low	27.7	Very low	174 Å²	174	160.6 Å²	160.6	81%	0.813	82%	0.824	S	S	*	*			trans	-95.6	110.1	166.3	-158.2	164.8	-161.3	0	0	108.2	K32 V36	K32-E34 VanDerWaalsContact C-N 3.3Å; K32-E34 PolarHBondContact O-N 3.47Å; E34-V36 PolarHBondContact O-N 3.01Å
35	K	24.6	Very low	27.5	Very low	202 Å²	202	158.3 Å²	158.3	88%	0.878	82%	0.822	S	S	*	*			trans	-57.5	95.6	178.5	-75.2	178	176.6	177.1	0	109.9	K37	K35-K37 PolarHBondContact O-N 2.96Å
36	V	25.8	Very low	27.3	Very low	119 Å²	119	159.4 Å²	159.4	72%	0.721	82%	0.818	S	S	*	*			trans	-64.7	96.8	168.4	-178.9	0	0	0	0	107.7	E34 F38	E34-V36 PolarHBondContact O-N 3.01Å; V36-F38 PolarHBondContact O-N 2.66Å
37	K	22.9	Very low	27.2	Very low	194 Å²	194	158.5 Å²	158.5	84%	0.843	81%	0.814	S	S	*	*			trans	-64.5	111.7	160.1	-85.7	180	174.3	178.5	0	106.5	K35 E39	K35-K37 PolarHBondContact O-N 2.96Å; K37-E39 PolarHBondContact O-N 2.87Å
38	F	24.5	Very low	27.1	Very low	191 Å²	191	160 Å²	160	84%	0.838	81%	0.81	S	S	*	*			trans	-59.9	99.4	164.5	-82.5	-97.8	0	0	0	108	V36 E40	V36-F38 PolarHBondContact O-N 2.66Å; F38-E40 PolarHBondContact O-N 2.94Å
39	E	25.6	Very low	27.3	Very low	186 Å²	186	158.3 Å²	158.3	87%	0.869	80%	0.798	S	S	*	*			trans	-68.8	107.5	156	-89.5	-179.3	148.7	0	0	106.5	K37	K37-E39 PolarHBondContact O-N 2.87Å
40	E	26.5	Very low	27.7	Very low	176 Å²	176	154.7 Å²	154.7	82%	0.822	79%	0.788	S	S	*	*			trans	-53.7	133.8	165.1	-73.4	-178.8	159.8	0	0	108.3	F38 G42	F38-E40 PolarHBondContact O-N 2.94Å; E40-G42 PolarHBondContact O-N 2.94Å
41	P	28.7	Very low	27.9	Very low	123 Å²	123	152 Å²	152	80%	0.799	77%	0.773	S	S	*	*			trans	-59.2	112	-178.6	24	-31.3	0	0	0	108.1	K43	P41-K43 PolarHBondContact O-N 3.45Å
42	G	27.6	Very low	28.5	Very low	69 Å²	69	148 Å²	148	71%	0.711	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-51	118.4	177.2	0	0	0	0	0	108.7	E40 P44	E40-G42 PolarHBondContact O-N 2.94Å; G42-P44 VanDerWaalsContact O-N 3.15Å
43	K	25.4	Very low	29.3	Very low	192 Å²	192	143.9 Å²	143.9	84%	0.835	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-46.2	124.2	167.7	-89.4	178.1	172	176.5	0	106.9	P41 D45	P41-K43 PolarHBondContact O-N 3.45Å; K43-D45 PolarHBondContact O-N 3.4Å; K43-D45 VanDerWaalsContact O-N 3.09Å
44	P	29.4	Very low	30.6	Very low	111 Å²	111	136 Å²	136	72%	0.721	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-55.7	126.1	175.1	24.4	-30.7	0	0	0	106.1	G42 E46	G42-P44 VanDerWaalsContact O-N 3.15Å; P44-E46 VanDerWaalsContact C-N 3.29Å; P44-E46 PolarHBondContact O-N 2.94Å
45	D	27.9	Very low	32.3	Very low	159 Å²	159	129.6 Å²	129.6	85%	0.85	69%	0.692	S	S	*	*			trans	-52	101.9	173.7	-79.8	-42.5	0	0	0	106.7	K43 S47	K43-D45 PolarHBondContact O-N 3.4Å; K43-D45 VanDerWaalsContact O-N 3.09Å; D45-S47 PolarHBondContact O-N 3.24Å
46	E	28.6	Very low	34.7	Very low	156 Å²	156	125.6 Å²	125.6	73%	0.729	68%	0.679	S	S	*	*			trans	-68.6	64.7	165.7	-72.4	-177.1	173.8	0	0	106.7	P44 H48	P44-E46 VanDerWaalsContact C-N 3.29Å; P44-E46 PolarHBondContact O-N 2.94Å; E46-H48 PolarHBondContact O-N 3.3Å
47	S	29.2	Very low	37.5	Very low	99 Å²	99	121 Å²	121	69%	0.692	65%	0.652	S	S	*	*			trans	-61.9	93.7	150	65.1	0	0	0	0	104	D45 S49	D45-S47 PolarHBondContact O-N 3.24Å; S47-S49 PolarHBondContact O-N 3.4Å
48	H	30	Very low	40.5	Very low	154 Å²	154	115 Å²	115	71%	0.713	63%	0.632	S	S	*	*			trans	-49.3	94.7	162.8	-67.9	-73	0	0	0	106.7	E46 N50	E46-H48 PolarHBondContact O-N 3.3Å; H48-N50 PolarHBondContact O-N 3.28Å
49	S	33.2	Very low	43.7	Very low	77 Å²	77	107.3 Å²	107.3	54%	0.538	60%	0.6	S	S	.	*			trans	-61	114.3	164.5	54	0	0	0	0	103.5	S47 D51	S47-S49 PolarHBondContact O-N 3.4Å; S49-D51 VanDerWaalsContact CB-OD1 3.26Å; S49-D51 WeakPolarHBondContact CB-OD1 3.25Å; S49-D51 PolarHBondContact O-N 3.17Å; S49-D51 PolarHBondContact OG-OD1 3.12Å
50	N	34.4	Very low	46.8	Very low	124 Å²	124	99 Å²	99	66%	0.663	56%	0.564	S	S	*	*			trans	-65.4	81.3	174.5	-80.7	-31	0	0	0	106.9	H48 N52	H48-N50 PolarHBondContact O-N 3.28Å; N50-N52 PolarHBondContact O-N 3.28Å
51	D	34.7	Very low	49.9	Very low	99 Å²	99	93.6 Å²	93.6	53%	0.529	56%	0.556	S	S	.	*			trans	-74.1	40.6	-178.5	-71.2	-6.3	0	0	0	111.5	S49 R255	S49-D51 VanDerWaalsContact CB-OD1 3.26Å; S49-D51 WeakPolarHBondContact CB-OD1 3.25Å; S49-D51 PolarHBondContact O-N 3.17Å; S49-D51 PolarHBondContact OG-OD1 3.12Å; D51-R255 PolarHBondContact O-NH2 2.89Å
52	N	39.4	Very low	53	Low	106 Å²	106	92.2 Å²	92.2	57%	0.567	54%	0.535	S	S	*	.			trans	-100	11.6	168.7	-95.5	8	0	0	0	111.8	N50 G54 R255	N50-N52 PolarHBondContact O-N 3.28Å; N52-G54 PolarHBondContact O-N 3.42Å; N52-R255 PolarHBondContact OD1-NH1 3.19Å; N52-R255 PolarHBondContact OD1-NH2 2.66Å
53	D	44.7	Very low	56.2	Low	108 Å²	108	89 Å²	89	58%	0.578	50%	0.502	S	S	*	.			trans	-64.3	101.3	-177.5	-83.7	-6	0	0	0	109.9	S248	D53-S248 WeakPolarHBondContact O-CB 3.3Å; D53-S248 PolarHBondContact O-OG 3.48Å
54	G	52.3	Low	59.7	Low	36 Å²	36	84.8 Å²	84.8	37%	0.371	48%	0.481	S	S	.	.			trans	-54.9	-173.2	152.7	0	0	0	0	0	110.7	N52 I56	N52-G54 PolarHBondContact O-N 3.42Å; G54-I56 PolarHBondContact O-N 3.31Å
55	P	62	Low	62.9	Low	40 Å²	40	81.9 Å²	81.9	26%	0.26	46%	0.461	S	S	.	.	S	Bend	trans	-53.5	117.7	177.3	17	-25.3	0	0	0	110.4	P57 L242 Q244	P55-P57 WeakPolarHBondContact O-CD 3.45Å; P55-L242 HydrophobicContact CB-CB 4.4Å; P55-L242 HydrophobicContact CG-CB 4.34Å; P55-Q244 HydrophobicContact CG-CG 4.23Å
56	I	75.4	Confident	66.2	Low	118 Å²	118	74.3 Å²	74.3	61%	0.605	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-60.1	123	177.6	-58.5	168.3	0	0	0	107.5	G54	G54-I56 PolarHBondContact O-N 3.31Å
57	P	85.8	Confident	69.5	Low	23 Å²	23	67.1 Å²	67.1	15%	0.149	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-59.2	130.7	179.6	-26	36.6	0	0	0	110.6	P55 D59 E184	P55-P57 WeakPolarHBondContact O-CD 3.45Å; P57-D59 PolarHBondContact O-N 2.89Å; P57-E184 HydrophobicContact CB-CB 4.21Å; P57-E184 HydrophobicContact CG-CB 4.14Å
58	P	86	Confident	72.8	Confident	67 Å²	67	67.8 Å²	67.8	44%	0.435	38%	0.377	S	S	.	.			trans	-70.4	-16.7	-175.9	26.5	-35.5	0	0	0	114.1	G60 Y182 L242	P58-G60 PolarHBondContact O-N 3.48Å; P58-Y182 VanDerWaalsContact CD-O 3.29Å; P58-Y182 WeakPolarHBondContact CD-O 3.35Å; P58-Y182 HydrophobicContact CG-CD1 3.69Å; P58-Y182 HydrophobicContact CG-CE1 4.36Å; P58-L242 HydrophobicContact CG-CD2 4.27Å
59	D	90.1	Very high	76	Confident	30 Å²	30	60.5 Å²	60.5	16%	0.16	34%	0.344	C	S	.	.	S	Bend	trans	52.1	28.1	-176.4	-84.4	-48.7	0	0	0	113.6	P57 Y182 F183 E184 K185 K186	P57-D59 PolarHBondContact O-N 2.89Å; D59-Y182 PolarHBondContact N-O 2.95Å; D59-Y182 VanDerWaalsContact N-O 3.08Å; D59-F183 WeakPolarHBondContact OD1-CA 3.3Å; D59-E184 PolarHBondContact OD1-N 2.84Å; D59-K185 PolarHBondContact OD1-N 2.69Å; D59-K185 WeakPolarHBondContact OD2-CB 3.34Å; D59-K185 WeakPolarHBondContact OD2-CG 3.24Å; D59-K185 PolarHBondContact OD2-N 3.31Å; D59-K186 PolarHBondContact OD1-N 2.89Å
60	G	91.5	Very high	79.1	Confident	11 Å²	11	56.8 Å²	56.8	11%	0.113	32%	0.318	C	S	.	.	S	Bend	trans	164.6	-155.3	-175.7	0	0	0	0	0	113.3	P58 Y62 G63	P58-G60 PolarHBondContact O-N 3.48Å; G60-Y62 PolarHBondContact O-N 3.38Å; G60-G63 WeakPolarHBondContact O-CA 3.42Å; G60-G63 PolarHBondContact O-N 2.85Å
61	G	92.3	Very high	82.1	Confident	63 Å²	63	52.8 Å²	52.8	65%	0.649	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	-125.9	179.5	0	0	0	0	0	112.4	G63 W64	G61-G63 PolarHBondContact O-N 3.18Å; G61-G63 VanDerWaalsContact O-N 3.12Å; G61-W64 PolarHBondContact O-N 2.9Å
62	Y	94	Very high	85.2	Confident	95 Å²	95	50.4 Å²	50.4	37%	0.373	28%	0.281	S	S	.	.	H	α-helix	trans	-60.5	-20.6	176.9	-159.8	-94.4	0	0	0	113.1	G60 W64 V65 I66 Y182 L238 W240	G60-Y62 PolarHBondContact O-N 3.38Å; Y62-W64 PolarHBondContact O-N 3.13Å; Y62-V65 HydrophobicContact CD1-CB 4.47Å; Y62-V65 HydrophobicContact CD2-CB 4.23Å; Y62-V65 HydrophobicContact CD2-CG2 4.08Å; Y62-V65 HydrophobicContact CE1-CB 4.46Å; Y62-V65 HydrophobicContact CE2-CB 4.23Å; Y62-V65 HydrophobicContact CE2-CG1 4.16Å; Y62-V65 HydrophobicContact CE2-CG2 4.3Å; Y62-V65 HydrophobicContact CG-CB 4.37Å; Y62-V65 HydrophobicContact CG-CG2 4.5Å; Y62-V65 WeakPolarHBondContact O-CA 3.47Å; Y62-V65 WeakPolarHBondContact O-CB 3.48Å; Y62-V65 PolarHBondContact O-N 3.34Å; Y62-I66 HydrophobicContact CD1-CD1 4.05Å; Y62-I66 HydrophobicContact CD1-CG1 4.03Å; Y62-I66 HydrophobicContact CE1-CD1 3.76Å; Y62-I66 HydrophobicContact CE1-CG1 4.22Å; Y62-I66 PolarHBondContact O-N 3.41Å; Y62-I66 VanDerWaalsContact O-N 3.12Å; Y62-Y182 HydrophobicContact CD1-CE1 4.14Å; Y62-L238 WeakPolarHBondContact CE1-O 3.31Å; Y62-L238 PolarHBondContact OH-O 3.33Å; Y62-L238 VanDerWaalsContact OH-O 3.1Å; Y62-W240 HydrophobicContact CD1-CB 4.48Å; Y62-W240 HydrophobicContact CE1-CB 3.59Å
63	G	94.7	Very high	88	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-54.8	-33.6	171.9	0	0	0	0	0	112.8	G60 G61 V65 I66 V67 Y182 F183	G60-G63 WeakPolarHBondContact O-CA 3.42Å; G60-G63 PolarHBondContact O-N 2.85Å; G61-G63 PolarHBondContact O-N 3.18Å; G61-G63 VanDerWaalsContact O-N 3.12Å; G63-V65 VanDerWaalsContact C-N 3.35Å; G63-I66 WeakPolarHBondContact O-CB 3.47Å; G63-I66 PolarHBondContact O-N 3.13Å; G63-V67 WeakPolarHBondContact O-CG2 3.43Å; G63-V67 PolarHBondContact O-N 3.14Å; G63-Y182 VanDerWaalsContact CA-CD1 3.42Å; G63-F183 WeakPolarHBondContact O-CE2 3.39Å
64	W	97.4	Very high	90.5	Very high	105 Å²	105	40.3 Å²	40.3	40%	0.398	23%	0.228	S	C	.	.	H	α-helix	trans	-72	-27.2	175.4	-69	115.7	0	0	0	113.6	G61 Y62 V67 F68 F183 I193	G61-W64 PolarHBondContact O-N 2.9Å; Y62-W64 PolarHBondContact O-N 3.13Å; W64-V67 HydrophobicContact CE3-CB 4.13Å; W64-V67 HydrophobicContact CE3-CG1 4.15Å; W64-V67 HydrophobicContact CE3-CG2 4.13Å; W64-V67 HydrophobicContact CZ3-CG1 4.29Å; W64-V67 HydrophobicContact CZ3-CG2 4.41Å; W64-V67 PolarHBondContact O-N 3.49Å; W64-F68 PolarHBondContact O-N 3.35Å; W64-F183 HydrophobicContact CD2-CZ 4.07Å; W64-F183 HydrophobicContact CE3-CZ 4.35Å; W64-F183 HydrophobicContact CG-CZ 4.46Å; W64-F183 HydrophobicContact CZ2-CE1 4.11Å; W64-F183 HydrophobicContact CZ2-CZ 4.39Å; W64-I193 HydrophobicContact CH2-CD1 4.13Å; W64-I193 HydrophobicContact CZ3-CD1 3.8Å
65	V	97.5	Very high	92.7	Very high	50 Å²	50	38.9 Å²	38.9	30%	0.303	21%	0.212	S	C	.	.	H	α-helix	trans	-68.2	-40.9	170.8	-177.7	0	0	0	0	110	Y62 G63 V67 F68 A69 L238	Y62-V65 HydrophobicContact CD1-CB 4.47Å; Y62-V65 HydrophobicContact CD2-CB 4.23Å; Y62-V65 HydrophobicContact CD2-CG2 4.08Å; Y62-V65 HydrophobicContact CE1-CB 4.46Å; Y62-V65 HydrophobicContact CE2-CB 4.23Å; Y62-V65 HydrophobicContact CE2-CG1 4.16Å; Y62-V65 HydrophobicContact CE2-CG2 4.3Å; Y62-V65 HydrophobicContact CG-CB 4.37Å; Y62-V65 HydrophobicContact CG-CG2 4.5Å; Y62-V65 WeakPolarHBondContact O-CA 3.47Å; Y62-V65 WeakPolarHBondContact O-CB 3.48Å; Y62-V65 PolarHBondContact O-N 3.34Å; G63-V65 VanDerWaalsContact C-N 3.35Å; V65-V67 VanDerWaalsContact C-N 3.34Å; V65-F68 PolarHBondContact O-N 3.17Å; V65-A69 WeakPolarHBondContact O-CB 3.4Å; V65-A69 PolarHBondContact O-N 3.49Å; V65-L238 HydrophobicContact CG1-CB 4.32Å; V65-L238 HydrophobicContact CG1-CD1 4.37Å; V65-L238 HydrophobicContact CG1-CD2 4.47Å
66	I	96.1	Very high	94.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61.5	-43.7	173.8	-56.8	-65.7	0	0	0	110.7	Y62 G63 A69 S70 V179 Y182 L238 L239	Y62-I66 HydrophobicContact CD1-CD1 4.05Å; Y62-I66 HydrophobicContact CD1-CG1 4.03Å; Y62-I66 HydrophobicContact CE1-CD1 3.76Å; Y62-I66 HydrophobicContact CE1-CG1 4.22Å; Y62-I66 PolarHBondContact O-N 3.41Å; Y62-I66 VanDerWaalsContact O-N 3.12Å; G63-I66 WeakPolarHBondContact O-CB 3.47Å; G63-I66 PolarHBondContact O-N 3.13Å; I66-A69 PolarHBondContact O-N 2.88Å; I66-S70 VanDerWaalsContact O-CB 3.23Å; I66-S70 WeakPolarHBondContact O-CB 3.48Å; I66-S70 PolarHBondContact O-N 3.33Å; I66-S70 PolarHBondContact O-OG 3.43Å; I66-V179 HydrophobicContact CG2-CG2 4.06Å; I66-Y182 HydrophobicContact CB-CD2 4.43Å; I66-Y182 HydrophobicContact CD1-CE2 3.95Å; I66-Y182 HydrophobicContact CG1-CD1 4.3Å; I66-Y182 HydrophobicContact CG1-CD2 3.82Å; I66-Y182 HydrophobicContact CG1-CE1 4.12Å; I66-Y182 HydrophobicContact CG1-CE2 3.62Å; I66-Y182 HydrophobicContact CG1-CG 4.15Å; I66-Y182 HydrophobicContact CG2-CD2 4.36Å; I66-L238 WeakPolarHBondContact CD1-O 3.44Å; I66-L239 HydrophobicContact CD1-CD2 4.28Å; I66-L239 HydrophobicContact CG2-CD2 4.15Å
67	V	98.2	Very high	95.5	Very high	5 Å²	5	31.9 Å²	31.9	3%	0.03	17%	0.173	C	C	.	.	H	α-helix	trans	-60	-46.8	175.7	170	0	0	0	0	111	G63 W64 V65 S70 F71 V179 F183 A190 I193 A194	G63-V67 WeakPolarHBondContact O-CG2 3.43Å; G63-V67 PolarHBondContact O-N 3.14Å; W64-V67 HydrophobicContact CE3-CB 4.13Å; W64-V67 HydrophobicContact CE3-CG1 4.15Å; W64-V67 HydrophobicContact CE3-CG2 4.13Å; W64-V67 HydrophobicContact CZ3-CG1 4.29Å; W64-V67 HydrophobicContact CZ3-CG2 4.41Å; W64-V67 PolarHBondContact O-N 3.49Å; V65-V67 VanDerWaalsContact C-N 3.34Å; V67-S70 PolarHBondContact O-N 3.34Å; V67-F71 WeakPolarHBondContact O-CB 3.35Å; V67-F71 PolarHBondContact O-N 2.9Å; V67-V179 HydrophobicContact CG2-CG1 3.8Å; V67-F183 HydrophobicContact CG2-CE2 3.69Å; V67-F183 HydrophobicContact CG2-CZ 4.15Å; V67-A190 HydrophobicContact CG2-CB 4Å; V67-I193 HydrophobicContact CG1-CB 3.96Å; V67-I193 HydrophobicContact CG1-CG2 3.53Å; V67-A194 HydrophobicContact CG1-CB 4.19Å
68	F	98.2	Very high	96	Very high	112 Å²	112	30.8 Å²	30.8	49%	0.491	17%	0.166	S	C	.	.	H	α-helix	trans	-63	-47.3	177.9	173	-102.3	0	0	0	112.6	W64 V65 S70 F71 M72	W64-F68 PolarHBondContact O-N 3.35Å; V65-F68 PolarHBondContact O-N 3.17Å; F68-S70 VanDerWaalsContact C-N 3.28Å; F68-S70 PolarHBondContact O-N 3.46Å; F68-F71 WeakPolarHBondContact O-CB 3.36Å; F68-F71 PolarHBondContact O-N 3.46Å; F68-M72 HydrophobicContact CD2-CG 4.33Å; F68-M72 HydrophobicContact CE1-CG 4.19Å; F68-M72 HydrophobicContact CE2-CG 3.83Å; F68-M72 HydrophobicContact CE2-SD 4.22Å; F68-M72 HydrophobicContact CZ-CG 3.75Å; F68-M72 HydrophobicContact CZ-SD 4.41Å; F68-M72 WeakPolarHBondContact O-CG 3.39Å; F68-M72 PolarHBondContact O-N 2.98Å
69	A	98.3	Very high	96.6	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.008	15%	0.146	C	C	.	.	H	α-helix	trans	-59.2	-43.3	177.4	0	0	0	0	0	111.4	V65 I66 M72 A73 F235 L238 L239	V65-A69 WeakPolarHBondContact O-CB 3.4Å; V65-A69 PolarHBondContact O-N 3.49Å; I66-A69 PolarHBondContact O-N 2.88Å; A69-M72 PolarHBondContact O-N 3.44Å; A69-A73 WeakPolarHBondContact O-CB 3.39Å; A69-A73 PolarHBondContact O-N 3.01Å; A69-F235 HydrophobicContact CB-CB 4.25Å; A69-L238 HydrophobicContact CB-CB 3.92Å; A69-L238 HydrophobicContact CB-CD1 4.08Å; A69-L239 HydrophobicContact CB-CD2 4.22Å
70	S	97.9	Very high	96.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-67.7	-39.6	178.2	-56.4	0	0	0	0	112.1	I66 V67 F68 A73 N74 A175 V179	I66-S70 VanDerWaalsContact O-CB 3.23Å; I66-S70 WeakPolarHBondContact O-CB 3.48Å; I66-S70 PolarHBondContact O-N 3.33Å; I66-S70 PolarHBondContact O-OG 3.43Å; V67-S70 PolarHBondContact O-N 3.34Å; F68-S70 VanDerWaalsContact C-N 3.28Å; F68-S70 PolarHBondContact O-N 3.46Å; S70-A73 PolarHBondContact O-N 2.95Å; S70-N74 VanDerWaalsContact O-CB 3.3Å; S70-N74 WeakPolarHBondContact O-CB 3.21Å; S70-N74 VanDerWaalsContact O-CG 3.26Å; S70-N74 PolarHBondContact O-N 3.45Å; S70-N74 PolarHBondContact O-ND2 3.16Å; S70-N74 VanDerWaalsContact O-ND2 3.08Å; S70-A175 WeakPolarHBondContact CB-O 3.33Å; S70-A175 PolarHBondContact OG-O 3.44Å; S70-V179 WeakPolarHBondContact OG-CG2 3.28Å
71	F	98.5	Very high	97	Very high	40 Å²	40	26 Å²	26	18%	0.175	14%	0.135	C	C	.	.	H	α-helix	trans	-56.4	-50.1	172.2	178.9	-81.1	0	0	0	111.3	V67 F68 N74 T75 I193 A194 A196 G197 F200	V67-F71 WeakPolarHBondContact O-CB 3.35Å; V67-F71 PolarHBondContact O-N 2.9Å; F68-F71 WeakPolarHBondContact O-CB 3.36Å; F68-F71 PolarHBondContact O-N 3.46Å; F71-N74 PolarHBondContact O-N 2.98Å; F71-T75 WeakPolarHBondContact O-CB 3.34Å; F71-T75 PolarHBondContact O-N 3.23Å; F71-T75 PolarHBondContact O-OG1 3.42Å; F71-I193 VanDerWaalsContact CD2-O 3.31Å; F71-I193 WeakPolarHBondContact CD2-O 3.44Å; F71-A194 WeakPolarHBondContact CA-O 3.4Å; F71-A194 PolarHBondContact N-O 2.91Å; F71-A196 HydrophobicContact CD2-CB 4.46Å; F71-A196 HydrophobicContact CE2-CB 4.17Å; F71-G197 VanDerWaalsContact CD2-N 3.27Å; F71-G197 VanDerWaalsContact CE2-N 3.34Å; F71-G197 WeakPolarHBondContact O-CA 3.33Å; F71-F200 HydrophobicContact CE1-CB 4.34Å; F71-F200 AromaticContact CE1-CD1 3.73Å; F71-F200 HydrophobicContact CE1-CD1 3.73Å; F71-F200 HydrophobicContact CE1-CE1 4.31Å; F71-F200 HydrophobicContact CE1-CG 4.13Å; F71-F200 HydrophobicContact CE2-CB 4.33Å; F71-F200 HydrophobicContact CZ-CB 3.62Å; F71-F200 AromaticContact CZ-CD1 3.8Å; F71-F200 HydrophobicContact CZ-CD1 3.8Å; F71-F200 HydrophobicContact CZ-CD2 4.43Å; F71-F200 AromaticContact CZ-CG 3.69Å; F71-F200 HydrophobicContact CZ-CG 3.69Å
72	M	98.4	Very high	97.1	Very high	49 Å²	49	23.1 Å²	23.1	24%	0.241	11%	0.105	C	C	.	.	H	α-helix	trans	-69	-39.7	-178.2	-67.6	-58.3	-62.3	0	0	112.4	F68 A69 T75 V76 F235	F68-M72 HydrophobicContact CD2-CG 4.33Å; F68-M72 HydrophobicContact CE1-CG 4.19Å; F68-M72 HydrophobicContact CE2-CG 3.83Å; F68-M72 HydrophobicContact CE2-SD 4.22Å; F68-M72 HydrophobicContact CZ-CG 3.75Å; F68-M72 HydrophobicContact CZ-SD 4.41Å; F68-M72 WeakPolarHBondContact O-CG 3.39Å; F68-M72 PolarHBondContact O-N 2.98Å; A69-M72 PolarHBondContact O-N 3.44Å; M72-T75 WeakPolarHBondContact O-CB 3.45Å; M72-T75 PolarHBondContact O-N 2.83Å; M72-V76 PolarHBondContact O-N 3.45Å; M72-F235 HydrophobicContact CB-CD1 3.8Å; M72-F235 HydrophobicContact CB-CD2 3.61Å; M72-F235 HydrophobicContact CB-CE1 3.64Å; M72-F235 HydrophobicContact CB-CE2 3.48Å; M72-F235 VanDerWaalsContact CB-CE2 3.48Å; M72-F235 HydrophobicContact CB-CG 3.81Å; M72-F235 HydrophobicContact CB-CZ 3.5Å; M72-F235 HydrophobicContact CE-CE2 4.34Å; M72-F235 HydrophobicContact CE-CZ 3.83Å; M72-F235 HydrophobicContact CG-CD1 4.31Å; M72-F235 HydrophobicContact CG-CE1 3.85Å; M72-F235 HydrophobicContact CG-CE2 4.4Å; M72-F235 HydrophobicContact CG-CZ 3.93Å
73	A	98.4	Very high	97.1	Very high	2 Å²	2	18.7 Å²	18.7	2%	0.017	9%	0.088	C	C	.	.	H	α-helix	trans	-60.7	-49	174	0	0	0	0	0	111.6	A69 S70 T75 V76 V77 I171 A175	A69-A73 WeakPolarHBondContact O-CB 3.39Å; A69-A73 PolarHBondContact O-N 3.01Å; S70-A73 PolarHBondContact O-N 2.95Å; A73-T75 VanDerWaalsContact C-N 3.3Å; A73-T75 PolarHBondContact O-N 3.28Å; A73-V76 PolarHBondContact O-N 3.3Å; A73-V77 WeakPolarHBondContact O-CG2 3.22Å; A73-V77 PolarHBondContact O-N 3.28Å; A73-I171 HydrophobicContact CB-CG2 3.8Å; A73-A175 HydrophobicContact CB-CB 3.91Å
74	N	97.9	Very high	97	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-63.6	-35.4	176.5	-72.7	-35.1	0	0	0	112.2	S70 F71 V76 D78 Y172 A194	S70-N74 VanDerWaalsContact O-CB 3.3Å; S70-N74 WeakPolarHBondContact O-CB 3.21Å; S70-N74 VanDerWaalsContact O-CG 3.26Å; S70-N74 PolarHBondContact O-N 3.45Å; S70-N74 PolarHBondContact O-ND2 3.16Å; S70-N74 VanDerWaalsContact O-ND2 3.08Å; F71-N74 PolarHBondContact O-N 2.98Å; N74-V76 VanDerWaalsContact C-N 3.33Å; N74-V76 PolarHBondContact O-N 2.83Å; N74-D78 WeakPolarHBondContact O-CB 3.49Å; N74-D78 PolarHBondContact O-N 3.04Å; N74-Y172 WeakPolarHBondContact OD1-CD2 3.31Å; N74-A194 PolarHBondContact ND2-O 3.34Å
75	T	98.4	Very high	96.7	Very high	6 Å²	6	14.1 Å²	14.1	4%	0.037	7%	0.072	C	C	.	.	H	α-helix	trans	-56.5	-47	175	-62.8	0	0	0	0	111.5	F71 M72 A73 G79 G197 F200 G201 F205	F71-T75 WeakPolarHBondContact O-CB 3.34Å; F71-T75 PolarHBondContact O-N 3.23Å; F71-T75 PolarHBondContact O-OG1 3.42Å; M72-T75 WeakPolarHBondContact O-CB 3.45Å; M72-T75 PolarHBondContact O-N 2.83Å; A73-T75 VanDerWaalsContact C-N 3.3Å; A73-T75 PolarHBondContact O-N 3.28Å; T75-G79 VanDerWaalsContact O-CA 3.27Å; T75-G79 WeakPolarHBondContact O-CA 3.37Å; T75-G79 PolarHBondContact O-N 3.07Å; T75-G197 WeakPolarHBondContact CA-O 3.41Å; T75-G197 VanDerWaalsContact OG1-CA 3.29Å; T75-G197 WeakPolarHBondContact OG1-CA 3.09Å; T75-G197 PolarHBondContact OG1-O 3.19Å; T75-G197 VanDerWaalsContact OG1-O 3.11Å; T75-F200 HydrophobicContact CG2-CD1 3.65Å; T75-F200 HydrophobicContact CG2-CE1 4.16Å; T75-G201 WeakPolarHBondContact O-CA 3.49Å; T75-F205 HydrophobicContact CG2-CE2 4.23Å
76	V	98.3	Very high	96.4	Very high	10 Å²	10	12.9 Å²	12.9	6%	0.061	6%	0.063	C	C	.	.	H	α-helix	trans	-72.8	-50.5	-179.8	177.4	0	0	0	0	111	M72 A73 N74 I80 F205 M228 V229	M72-V76 PolarHBondContact O-N 3.45Å; A73-V76 PolarHBondContact O-N 3.3Å; N74-V76 VanDerWaalsContact C-N 3.33Å; N74-V76 PolarHBondContact O-N 2.83Å; V76-I80 HydrophobicContact CG1-CD1 3.83Å; V76-I80 WeakPolarHBondContact O-CB 3.39Å; V76-I80 WeakPolarHBondContact O-CD1 3.32Å; V76-I80 VanDerWaalsContact O-CG1 3.22Å; V76-I80 WeakPolarHBondContact O-CG1 3.3Å; V76-I80 PolarHBondContact O-N 3.42Å; V76-I80 VanDerWaalsContact O-N 3.09Å; V76-F205 HydrophobicContact CB-CZ 4.47Å; V76-F205 HydrophobicContact CG1-CZ 4.47Å; V76-F205 HydrophobicContact CG2-CZ 4.35Å; V76-M228 HydrophobicContact CG1-CB 4.26Å; V76-V229 HydrophobicContact CG1-CG2 4.09Å
77	V	98.1	Very high	96.2	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-60.1	-57.4	-175.8	172	0	0	0	0	111.1	A73 A81 L168 I171	A73-V77 WeakPolarHBondContact O-CG2 3.22Å; A73-V77 PolarHBondContact O-N 3.28Å; V77-A81 WeakPolarHBondContact O-CB 3.44Å; V77-A81 PolarHBondContact O-N 3.24Å; V77-A81 VanDerWaalsContact O-N 3.11Å; V77-L168 HydrophobicContact CG1-CB 4.02Å; V77-L168 HydrophobicContact CG1-CD1 4.38Å; V77-L168 HydrophobicContact CG2-CB 4.41Å; V77-L168 HydrophobicContact CG2-CD2 4.08Å; V77-I171 HydrophobicContact CG2-CB 3.97Å; V77-I171 HydrophobicContact CG2-CG2 3.62Å
78	D	96.4	Very high	95.9	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-77.1	-30.1	-175.7	-82.8	9.9	0	0	0	111.6	N74 I80 A81 Y82 S198	N74-D78 WeakPolarHBondContact O-CB 3.49Å; N74-D78 PolarHBondContact O-N 3.04Å; D78-I80 VanDerWaalsContact C-N 3.34Å; D78-I80 PolarHBondContact O-N 2.74Å; D78-A81 PolarHBondContact O-N 3.39Å; D78-Y82 HydrophobicContact CB-CD2 3.91Å; D78-Y82 HydrophobicContact CB-CE2 3.54Å; D78-Y82 WeakPolarHBondContact O-CB 3.2Å; D78-Y82 WeakPolarHBondContact O-CD2 3.36Å; D78-Y82 PolarHBondContact O-N 2.74Å; D78-Y82 WeakPolarHBondContact OD2-CE2 3.29Å; D78-Y82 PolarHBondContact OD2-OH 3.04Å; D78-S198 VanDerWaalsContact CB-CB 3.43Å; D78-S198 VanDerWaalsContact CG-OG 3.3Å; D78-S198 WeakPolarHBondContact OD2-CB 3.38Å; D78-S198 PolarHBondContact OD2-OG 2.94Å
79	G	96.9	Very high	95.5	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-59.6	-44.7	174.4	0	0	0	0	0	112.1	T75 S83 G201 F205	T75-G79 VanDerWaalsContact O-CA 3.27Å; T75-G79 WeakPolarHBondContact O-CA 3.37Å; T75-G79 PolarHBondContact O-N 3.07Å; G79-S83 WeakPolarHBondContact O-CB 3.42Å; G79-S83 PolarHBondContact O-N 3.32Å; G79-S83 PolarHBondContact O-OG 3.49Å; G79-G201 VanDerWaalsContact CA-C 3.48Å; G79-F205 WeakPolarHBondContact O-CB 3.2Å
80	I	96.4	Very high	95.1	Very high	2 Å²	2	15.8 Å²	15.8	1%	0.01	8%	0.084	C	C	.	.	H	α-helix	trans	-65.4	-48.6	173.8	-67.9	170.3	0	0	0	110.9	V76 D78 S83 F84 L109 F144 F205 L225 V229	V76-I80 HydrophobicContact CG1-CD1 3.83Å; V76-I80 WeakPolarHBondContact O-CB 3.39Å; V76-I80 WeakPolarHBondContact O-CD1 3.32Å; V76-I80 VanDerWaalsContact O-CG1 3.22Å; V76-I80 WeakPolarHBondContact O-CG1 3.3Å; V76-I80 PolarHBondContact O-N 3.42Å; V76-I80 VanDerWaalsContact O-N 3.09Å; D78-I80 VanDerWaalsContact C-N 3.34Å; D78-I80 PolarHBondContact O-N 2.74Å; I80-S83 PolarHBondContact O-N 3.35Å; I80-F84 PolarHBondContact O-N 3.12Å; I80-L109 HydrophobicContact CG2-CD2 4.29Å; I80-F144 HydrophobicContact CD1-CE1 4.04Å; I80-F144 HydrophobicContact CD1-CZ 4.42Å; I80-F144 HydrophobicContact CG2-CE1 3.74Å; I80-F144 HydrophobicContact CG2-CZ 3.71Å; I80-F205 HydrophobicContact CD1-CE1 4.22Å; I80-F205 HydrophobicContact CG1-CD1 3.81Å; I80-F205 HydrophobicContact CG1-CE1 3.53Å; I80-F205 HydrophobicContact CG1-CZ 4.45Å; I80-L225 HydrophobicContact CD1-CB 4.33Å; I80-L225 HydrophobicContact CD1-CD2 4.42Å; I80-L225 HydrophobicContact CG1-CD1 4.44Å; I80-L225 HydrophobicContact CG1-CD2 4.09Å; I80-L225 HydrophobicContact CG2-CD1 4.49Å; I80-V229 HydrophobicContact CD1-CG2 3.51Å
81	A	95.1	Very high	94.9	Very high	5 Å²	5	16 Å²	16	4%	0.041	9%	0.085	C	C	.	.	H	α-helix	trans	-60.9	-47.4	-176.2	0	0	0	0	0	112.7	V77 D78 V110 Y113	V77-A81 WeakPolarHBondContact O-CB 3.44Å; V77-A81 PolarHBondContact O-N 3.24Å; V77-A81 VanDerWaalsContact O-N 3.11Å; D78-A81 PolarHBondContact O-N 3.39Å; A81-V110 HydrophobicContact CB-CG2 3.95Å; A81-Y113 HydrophobicContact CB-CE1 4.19Å
82	Y	94.3	Very high	94.5	Very high	3 Å²	3	17.5 Å²	17.5	1%	0.012	9%	0.093	C	C	.	.	H	α-helix	trans	-81.4	-17.4	-175.3	-59.7	-27.9	0	0	0	113.4	D78 T202 F482 Y483 F486	D78-Y82 HydrophobicContact CB-CD2 3.91Å; D78-Y82 HydrophobicContact CB-CE2 3.54Å; D78-Y82 WeakPolarHBondContact O-CB 3.2Å; D78-Y82 WeakPolarHBondContact O-CD2 3.36Å; D78-Y82 PolarHBondContact O-N 2.74Å; D78-Y82 WeakPolarHBondContact OD2-CE2 3.29Å; D78-Y82 PolarHBondContact OD2-OH 3.04Å; Y82-T202 WeakPolarHBondContact CD2-OG1 3.46Å; Y82-F482 AromaticContact CE1-CE1 3.64Å; Y82-F482 HydrophobicContact CE1-CE1 3.64Å; Y82-F482 HydrophobicContact CE1-CZ 4.15Å; Y82-F482 AromaticContact CZ-CE1 3.87Å; Y82-F482 AromaticContact CZ-CZ 3.93Å; Y82-Y483 HydrophobicContact CD1-CD1 4.23Å; Y82-Y483 AromaticContact CD1-CE1 3.76Å; Y82-Y483 HydrophobicContact CD1-CE1 3.76Å; Y82-Y483 HydrophobicContact CE1-CD1 4.22Å; Y82-Y483 AromaticContact CE1-CE1 3.4Å; Y82-Y483 HydrophobicContact CE1-CE1 3.4Å; Y82-Y483 VanDerWaalsContact CE1-CE1 3.4Å; Y82-F486 HydrophobicContact CD1-CD1 4.38Å; Y82-F486 HydrophobicContact CD1-CD2 4.45Å; Y82-F486 HydrophobicContact CD1-CG 4.26Å; Y82-F486 HydrophobicContact CD2-CD1 4.41Å; Y82-F486 HydrophobicContact CD2-CE1 4.13Å; Y82-F486 AromaticContact CG-CD1 3.92Å; Y82-F486 HydrophobicContact CG-CD1 3.92Å; Y82-F486 HydrophobicContact CG-CE1 4.1Å; Y82-F486 HydrophobicContact CG-CG 4.25Å
83	S	92.9	Very high	94.2	Very high	2 Å²	2	19 Å²	19	1%	0.014	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-0.1	175.9	-50.9	0	0	0	0	113.6	G79 I80 G85 I86 F205 A206	G79-S83 WeakPolarHBondContact O-CB 3.42Å; G79-S83 PolarHBondContact O-N 3.32Å; G79-S83 PolarHBondContact O-OG 3.49Å; I80-S83 PolarHBondContact O-N 3.35Å; S83-G85 PolarHBondContact O-N 3.1Å; S83-G85 VanDerWaalsContact O-N 3.17Å; S83-I86 WeakPolarHBondContact O-CB 3.26Å; S83-I86 WeakPolarHBondContact O-CG1 3.37Å; S83-I86 PolarHBondContact O-N 3.47Å; S83-I86 VanDerWaalsContact O-N 3.07Å; S83-F205 WeakPolarHBondContact OG-CB 3.23Å; S83-A206 PolarHBondContact OG-N 2.93Å
84	F	92.5	Very high	94	Very high	5 Å²	5	24.5 Å²	24.5	2%	0.022	13%	0.129	C	C	.	.	H	α-helix	trans	-56.4	-34	-179	-179.7	-92.1	0	0	0	113.3	I80 I86 M87 L88 L91 V105 G106 Y160	I80-F84 PolarHBondContact O-N 3.12Å; F84-I86 PolarHBondContact O-N 3.23Å; F84-M87 HydrophobicContact CD2-CE 3.52Å; F84-M87 HydrophobicContact CE2-CE 3.93Å; F84-M87 HydrophobicContact CG-CE 4.46Å; F84-M87 PolarHBondContact O-N 2.78Å; F84-L88 PolarHBondContact O-N 3.22Å; F84-L91 HydrophobicContact CE2-CD1 3.97Å; F84-L91 HydrophobicContact CZ-CD1 3.79Å; F84-V105 HydrophobicContact CE2-CB 4.11Å; F84-V105 HydrophobicContact CE2-CG1 3.7Å; F84-V105 HydrophobicContact CZ-CB 3.65Å; F84-V105 HydrophobicContact CZ-CG1 3.76Å; F84-G106 VanDerWaalsContact CZ-N 3.29Å; F84-Y160 AromaticContact CD2-CE1 3.76Å; F84-Y160 HydrophobicContact CD2-CE1 3.76Å; F84-Y160 AromaticContact CD2-CZ 3.99Å; F84-Y160 AromaticContact CE2-CE1 3.81Å; F84-Y160 HydrophobicContact CE2-CE1 3.81Å
85	G	91.4	Very high	93.8	Very high	4 Å²	4	26.2 Å²	26.2	4%	0.041	14%	0.137	C	C	.	.	H	α-helix	trans	-54.5	-24.5	178	0	0	0	0	0	113.8	S83 L88	S83-G85 PolarHBondContact O-N 3.1Å; S83-G85 VanDerWaalsContact O-N 3.17Å; G85-L88 WeakPolarHBondContact O-CB 3.35Å; G85-L88 PolarHBondContact O-N 3.1Å
86	I	92.6	Very high	93.5	Very high	24 Å²	24	34.8 Å²	34.8	12%	0.123	17%	0.174	C	C	.	.	H	α-helix	trans	-72.7	-33.2	176.5	-56.6	178.4	0	0	0	111.8	S83 F84 L88 P89 A206 T209 T210 L213 L507	S83-I86 WeakPolarHBondContact O-CB 3.26Å; S83-I86 WeakPolarHBondContact O-CG1 3.37Å; S83-I86 PolarHBondContact O-N 3.47Å; S83-I86 VanDerWaalsContact O-N 3.07Å; F84-I86 PolarHBondContact O-N 3.23Å; I86-L88 VanDerWaalsContact C-N 3.3Å; I86-P89 WeakPolarHBondContact O-CD 3.44Å; I86-A206 VanDerWaalsContact CD1-CA 3.48Å; I86-A206 HydrophobicContact CD1-CB 3.83Å; I86-A206 VanDerWaalsContact CD1-O 3.25Å; I86-A206 WeakPolarHBondContact CD1-O 3.31Å; I86-T209 HydrophobicContact CB-CG2 4.26Å; I86-T209 HydrophobicContact CG2-CG2 4.21Å; I86-T210 WeakPolarHBondContact CG2-OG1 3.13Å; I86-L213 HydrophobicContact CG2-CD1 3.89Å; I86-L507 HydrophobicContact CD1-CD2 4.21Å; I86-L507 HydrophobicContact CG1-CD2 4.42Å
87	M	91.8	Very high	93.1	Very high	6 Å²	6	35.2 Å²	35.2	3%	0.03	18%	0.18	C	C	.	.	H	α-helix	trans	-78.9	-15	176.3	-64.4	-168.4	-70.4	0	0	112.7	F84 E90 L91 T209 L213 T221 L222	F84-M87 HydrophobicContact CD2-CE 3.52Å; F84-M87 HydrophobicContact CE2-CE 3.93Å; F84-M87 HydrophobicContact CG-CE 4.46Å; F84-M87 PolarHBondContact O-N 2.78Å; M87-E90 PolarHBondContact O-N 3.2Å; M87-L91 HydrophobicContact CB-CD1 4.19Å; M87-L91 WeakPolarHBondContact O-CG 3.31Å; M87-L91 PolarHBondContact O-N 2.99Å; M87-T209 HydrophobicContact CG-CG2 3.81Å; M87-T209 HydrophobicContact SD-CG2 4.47Å; M87-L213 HydrophobicContact CG-CD1 3.95Å; M87-L213 HydrophobicContact CG-CD2 4.13Å; M87-L213 HydrophobicContact CG-CG 4.4Å; M87-T221 HydrophobicContact SD-CG2 4.27Å; M87-L222 HydrophobicContact SD-CD2 4.47Å
88	L	90.1	Very high	92.7	Very high	15 Å²	15	37.6 Å²	37.6	8%	0.079	20%	0.196	C	C	.	.	H	α-helix	trans	-59.1	-47.4	-172.2	-166	155.9	0	0	0	112.9	F84 G85 I86 E90 L91 H92 V99 V102 A103 V487	F84-L88 PolarHBondContact O-N 3.22Å; G85-L88 WeakPolarHBondContact O-CB 3.35Å; G85-L88 PolarHBondContact O-N 3.1Å; I86-L88 VanDerWaalsContact C-N 3.3Å; L88-E90 VanDerWaalsContact C-N 3.34Å; L88-E90 PolarHBondContact O-N 3.22Å; L88-L91 PolarHBondContact O-N 3.19Å; L88-H92 VanDerWaalsContact O-CB 3.22Å; L88-H92 WeakPolarHBondContact O-CB 3.48Å; L88-H92 PolarHBondContact O-N 2.67Å; L88-V99 HydrophobicContact CD2-CG1 4.23Å; L88-V102 HydrophobicContact CG-CG1 4.1Å; L88-A103 HydrophobicContact CD1-CB 4.18Å; L88-V487 HydrophobicContact CD1-CG1 4.05Å
89	P	89.9	Confident	92.3	Very high	70 Å²	70	38.5 Å²	38.5	46%	0.455	20%	0.202	S	C	.	.	H	α-helix	trans	-62.9	-38.5	178.4	-22.5	34.8	0	0	0	113.3	I86 H92 S93	I86-P89 WeakPolarHBondContact O-CD 3.44Å; P89-H92 PolarHBondContact O-N 2.99Å; P89-S93 WeakPolarHBondContact O-CB 3.29Å; P89-S93 PolarHBondContact O-N 3.35Å
90	E	90.6	Very high	91.9	Very high	88 Å²	88	41.7 Å²	41.7	41%	0.411	22%	0.217	S	C	.	.	H	α-helix	trans	-67.4	-45.5	-179.6	-170.2	63	-157.4	0	0	111.2	M87 L88 S93 Y94 L213 W218	M87-E90 PolarHBondContact O-N 3.2Å; L88-E90 VanDerWaalsContact C-N 3.34Å; L88-E90 PolarHBondContact O-N 3.22Å; E90-S93 PolarHBondContact O-N 3.31Å; E90-Y94 WeakPolarHBondContact O-CB 3.4Å; E90-Y94 PolarHBondContact O-N 2.85Å; E90-L213 HydrophobicContact CG-CD2 4.41Å; E90-W218 HydrophobicContact CG-CB 4.23Å
91	L	93.9	Very high	91.7	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-67.1	-38	176.4	-67.3	174.1	0	0	0	111.8	F84 M87 L88 Y94 F95 V102 L156 W218	F84-L91 HydrophobicContact CE2-CD1 3.97Å; F84-L91 HydrophobicContact CZ-CD1 3.79Å; M87-L91 HydrophobicContact CB-CD1 4.19Å; M87-L91 WeakPolarHBondContact O-CG 3.31Å; M87-L91 PolarHBondContact O-N 2.99Å; L88-L91 PolarHBondContact O-N 3.19Å; L91-Y94 PolarHBondContact O-N 3.48Å; L91-F95 HydrophobicContact CB-CD2 4.49Å; L91-F95 HydrophobicContact CD2-CD2 4.3Å; L91-F95 HydrophobicContact CD2-CE2 3.92Å; L91-F95 WeakPolarHBondContact O-CB 3.32Å; L91-F95 WeakPolarHBondContact O-CD2 3.39Å; L91-F95 PolarHBondContact O-N 3.01Å; L91-V102 HydrophobicContact CB-CG1 3.64Å; L91-V102 HydrophobicContact CD1-CG1 4.48Å; L91-L156 HydrophobicContact CD1-CD2 4.28Å; L91-L156 HydrophobicContact CD2-CD2 3.9Å; L91-W218 HydrophobicContact CD2-CB 4.25Å; L91-W218 HydrophobicContact CD2-CD2 3.75Å; L91-W218 HydrophobicContact CD2-CE3 3.96Å; L91-W218 HydrophobicContact CD2-CG 3.9Å
92	H	89.9	Confident	91.6	Very high	73 Å²	73	44 Å²	44	34%	0.338	23%	0.23	S	C	.	.	H	α-helix	trans	-60.4	-47.3	174.2	177.1	70.9	0	0	0	111.6	L88 P89 K96 G97 V102	L88-H92 VanDerWaalsContact O-CB 3.22Å; L88-H92 WeakPolarHBondContact O-CB 3.48Å; L88-H92 PolarHBondContact O-N 2.67Å; P89-H92 PolarHBondContact O-N 2.99Å; H92-K96 VanDerWaalsContact O-CA 3.25Å; H92-K96 WeakPolarHBondContact O-CA 3.43Å; H92-K96 PolarHBondContact O-N 3.4Å; H92-G97 PolarHBondContact CE1-O 2.82Å; H92-G97 PolarHBondContact ND1-O 2.96Å; H92-V102 HydrophobicContact CB-CG2 4.14Å
93	S	91.7	Very high	91.5	Very high	81 Å²	81	43.9 Å²	43.9	57%	0.566	23%	0.231	S	C	*	.	H	α-helix	trans	-62.1	-46.4	176.3	-174.8	0	0	0	0	112.2	P89 E90	P89-S93 WeakPolarHBondContact O-CB 3.29Å; P89-S93 PolarHBondContact O-N 3.35Å; E90-S93 PolarHBondContact O-N 3.31Å
94	Y	94.5	Very high	91.6	Very high	116 Å²	116	47.6 Å²	47.6	46%	0.455	24%	0.244	S	C	.	.	H	α-helix	trans	-66.5	-48.3	-177.5	-175.8	-94.2	0	0	0	113	E90 L91 W218	E90-Y94 WeakPolarHBondContact O-CB 3.4Å; E90-Y94 PolarHBondContact O-N 2.85Å; L91-Y94 PolarHBondContact O-N 3.48Å; Y94-W218 AromaticContact CD1-CZ2 3.99Å; Y94-W218 HydrophobicContact CD1-CZ2 3.99Å; Y94-W218 AromaticContact CD1-NE1 3.9Å; Y94-W218 AromaticContact CD2-NE1 3.76Å; Y94-W218 AromaticContact CE1-CZ2 3.76Å; Y94-W218 HydrophobicContact CE1-CZ2 3.76Å; Y94-W218 AromaticContact CG-NE1 3.63Å
95	F	94.9	Very high	91.7	Very high	36 Å²	36	47.4 Å²	47.4	16%	0.158	24%	0.244	C	C	.	.	H	α-helix	trans	-89.9	-11.1	-176	-71	-72.1	0	0	0	114	L91 G97 L153 L156 W218	L91-F95 HydrophobicContact CB-CD2 4.49Å; L91-F95 HydrophobicContact CD2-CD2 4.3Å; L91-F95 HydrophobicContact CD2-CE2 3.92Å; L91-F95 WeakPolarHBondContact O-CB 3.32Å; L91-F95 WeakPolarHBondContact O-CD2 3.39Å; L91-F95 PolarHBondContact O-N 3.01Å; F95-G97 PolarHBondContact O-N 2.9Å; F95-G97 VanDerWaalsContact O-N 3.09Å; F95-L153 HydrophobicContact CB-CD1 3.98Å; F95-L153 HydrophobicContact CB-CD2 3.82Å; F95-L153 HydrophobicContact CB-CG 3.69Å; F95-L153 HydrophobicContact CD1-CD2 4.36Å; F95-L153 HydrophobicContact CD1-CG 4.14Å; F95-L153 HydrophobicContact CD2-CD2 3.42Å; F95-L153 VanDerWaalsContact CD2-CD2 3.42Å; F95-L153 HydrophobicContact CD2-CG 4.07Å; F95-L153 HydrophobicContact CE2-CD2 4.06Å; F95-L153 HydrophobicContact CG-CD2 3.6Å; F95-L153 HydrophobicContact CG-CG 3.7Å; F95-L156 HydrophobicContact CE2-CD2 3.96Å; F95-L156 HydrophobicContact CZ-CD2 4.46Å; F95-W218 HydrophobicContact CE2-CH2 4.36Å; F95-W218 HydrophobicContact CE2-CZ2 4.11Å; F95-W218 HydrophobicContact CZ-CH2 4.14Å; F95-W218 HydrophobicContact CZ-CZ2 4.03Å
96	K	91.7	Very high	91.8	Very high	187 Å²	187	47.5 Å²	47.5	81%	0.813	24%	0.244	S	C	*	.			trans	52.4	27.2	-177.8	-55.9	-177.5	179.6	-179.3	0	114.2	H92	H92-K96 VanDerWaalsContact O-CA 3.25Å; H92-K96 WeakPolarHBondContact O-CA 3.43Å; H92-K96 PolarHBondContact O-N 3.4Å
97	G	88.7	Confident	91.9	Very high	18 Å²	18	46.5 Å²	46.5	19%	0.186	24%	0.239	C	C	.	.			trans	-89.4	165.5	176.9	0	0	0	0	0	112.1	H92 F95	H92-G97 PolarHBondContact CE1-O 2.82Å; H92-G97 PolarHBondContact ND1-O 2.96Å; F95-G97 PolarHBondContact O-N 2.9Å; F95-G97 VanDerWaalsContact O-N 3.09Å
98	S	90.9	Very high	92.1	Very high	50 Å²	50	47 Å²	47	35%	0.35	24%	0.242	S	C	.	.			trans	-62.8	158	176.7	69.6	0	0	0	0	112.7	Q100 T101 V102	S98-Q100 VanDerWaalsContact C-N 3.26Å; S98-Q100 PolarHBondContact O-N 2.88Å; S98-T101 PolarHBondContact O-N 3.31Å; S98-T101 WeakPolarHBondContact OG-CB 3.21Å; S98-T101 PolarHBondContact OG-N 2.8Å; S98-T101 VanDerWaalsContact OG-N 3.14Å; S98-T101 PolarHBondContact OG-OG1 3.41Å; S98-V102 WeakPolarHBondContact O-CG2 3.48Å; S98-V102 PolarHBondContact O-N 3.02Å
99	V	88	Confident	92.4	Very high	19 Å²	19	46.2 Å²	46.2	12%	0.115	24%	0.239	C	C	.	.	H	α-helix	trans	-55.8	-43.7	176.1	174	0	0	0	0	110.5	L88 T101 V102 A103 Y488	L88-V99 HydrophobicContact CD2-CG1 4.23Å; V99-T101 PolarHBondContact O-N 3.42Å; V99-V102 PolarHBondContact O-N 3.14Å; V99-A103 VanDerWaalsContact O-CB 3.3Å; V99-A103 WeakPolarHBondContact O-CB 3.31Å; V99-A103 PolarHBondContact O-N 2.74Å; V99-Y488 HydrophobicContact CG1-CE1 4.46Å
100	Q	88.3	Confident	92.7	Very high	68 Å²	68	43.1 Å²	43.1	32%	0.318	22%	0.218	S	C	.	.	H	α-helix	trans	-57.5	-46.5	173.2	-173.9	-174.6	33.1	0	0	112.5	S98 V102 A103 W104 P610 D617	S98-Q100 VanDerWaalsContact C-N 3.26Å; S98-Q100 PolarHBondContact O-N 2.88Å; Q100-V102 PolarHBondContact O-N 3.08Å; Q100-A103 PolarHBondContact O-N 3.24Å; Q100-W104 PolarHBondContact O-N 3.34Å; Q100-P610 HydrophobicContact CG-CB 4.31Å; Q100-P610 PolarHBondContact NE2-O 2.98Å; Q100-D617 WeakPolarHBondContact CB-OD2 3.34Å
101	T	92	Very high	92.9	Very high	54 Å²	54	38.9 Å²	38.9	33%	0.331	20%	0.199	S	C	.	.	H	α-helix	trans	-65.1	-39.1	-177.4	-52.7	0	0	0	0	111.7	S98 V99 W104 L153	S98-T101 PolarHBondContact O-N 3.31Å; S98-T101 WeakPolarHBondContact OG-CB 3.21Å; S98-T101 PolarHBondContact OG-N 2.8Å; S98-T101 VanDerWaalsContact OG-N 3.14Å; S98-T101 PolarHBondContact OG-OG1 3.41Å; V99-T101 PolarHBondContact O-N 3.42Å; T101-W104 WeakPolarHBondContact O-CB 3.47Å; T101-W104 PolarHBondContact O-N 3.41Å; T101-L153 HydrophobicContact CG2-CD1 3.76Å
102	V	93.4	Very high	93	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-72.1	-37.5	177.8	180	0	0	0	0	111.2	L88 L91 H92 S98 V99 Q100 W104 V105 L153	L88-V102 HydrophobicContact CG-CG1 4.1Å; L91-V102 HydrophobicContact CB-CG1 3.64Å; L91-V102 HydrophobicContact CD1-CG1 4.48Å; H92-V102 HydrophobicContact CB-CG2 4.14Å; S98-V102 WeakPolarHBondContact O-CG2 3.48Å; S98-V102 PolarHBondContact O-N 3.02Å; V99-V102 PolarHBondContact O-N 3.14Å; Q100-V102 PolarHBondContact O-N 3.08Å; V102-W104 PolarHBondContact O-N 2.85Å; V102-V105 WeakPolarHBondContact O-CB 3.33Å; V102-V105 PolarHBondContact O-N 3.38Å; V102-L153 HydrophobicContact CG2-CD1 4.13Å; V102-L153 HydrophobicContact CG2-CD2 4.31Å
103	A	92.5	Very high	93.2	Very high	2 Å²	2	36.1 Å²	36.1	2%	0.017	19%	0.187	C	C	.	.	H	α-helix	trans	-60.7	-24.4	177.3	0	0	0	0	0	113.2	L88 V99 Q100 V105 S107	L88-A103 HydrophobicContact CD1-CB 4.18Å; V99-A103 VanDerWaalsContact O-CB 3.3Å; V99-A103 WeakPolarHBondContact O-CB 3.31Å; V99-A103 PolarHBondContact O-N 2.74Å; Q100-A103 PolarHBondContact O-N 3.24Å; A103-V105 PolarHBondContact O-N 3.18Å; A103-S107 WeakPolarHBondContact O-CB 3.44Å; A103-S107 PolarHBondContact O-N 3.12Å; A103-S107 VanDerWaalsContact O-N 3.12Å; A103-S107 PolarHBondContact O-OG 3.45Å
104	W	94.3	Very high	93.4	Very high	80 Å²	80	32.2 Å²	32.2	30%	0.303	16%	0.16	S	C	.	.	H	α-helix	trans	-61.1	-29.4	171.8	-79.9	103.7	0	0	0	113.1	Q100 T101 V102 G106 S107 V108 M157 M606 P610	Q100-W104 PolarHBondContact O-N 3.34Å; T101-W104 WeakPolarHBondContact O-CB 3.47Å; T101-W104 PolarHBondContact O-N 3.41Å; V102-W104 PolarHBondContact O-N 2.85Å; W104-G106 PolarHBondContact O-N 3.48Å; W104-S107 PolarHBondContact O-N 3.36Å; W104-V108 HydrophobicContact CE3-CG2 3.98Å; W104-V108 VanDerWaalsContact O-CB 3.3Å; W104-V108 WeakPolarHBondContact O-CB 3.33Å; W104-V108 WeakPolarHBondContact O-CG2 3.46Å; W104-V108 PolarHBondContact O-N 3.3Å; W104-M157 HydrophobicContact CB-SD 3.7Å; W104-M606 HydrophobicContact CZ3-CG 4.02Å; W104-M606 WeakPolarHBondContact CZ3-O 3.31Å; W104-P610 HydrophobicContact CD2-CB 4.15Å; W104-P610 HydrophobicContact CD2-CG 3.58Å; W104-P610 HydrophobicContact CE3-CG 3.89Å; W104-P610 HydrophobicContact CG-CG 4.04Å; W104-P610 HydrophobicContact CH2-CB 4.41Å; W104-P610 HydrophobicContact CH2-CG 4.14Å; W104-P610 HydrophobicContact CZ2-CB 3.74Å; W104-P610 HydrophobicContact CZ2-CG 3.84Å; W104-P610 HydrophobicContact CZ3-CG 4.17Å
105	V	94.8	Very high	93.3	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	15%	0.152	C	C	.	.	H	α-helix	trans	-60.1	-51.6	-178.7	174.7	0	0	0	0	111.3	F84 V102 A103 L109 L153 L156 M157 Y160	F84-V105 HydrophobicContact CE2-CB 4.11Å; F84-V105 HydrophobicContact CE2-CG1 3.7Å; F84-V105 HydrophobicContact CZ-CB 3.65Å; F84-V105 HydrophobicContact CZ-CG1 3.76Å; V102-V105 WeakPolarHBondContact O-CB 3.33Å; V102-V105 PolarHBondContact O-N 3.38Å; A103-V105 PolarHBondContact O-N 3.18Å; V105-L109 PolarHBondContact O-N 3.12Å; V105-L153 HydrophobicContact CG2-CD2 4.09Å; V105-L156 HydrophobicContact CG1-CD2 3.82Å; V105-L156 HydrophobicContact CG1-CG 3.76Å; V105-L156 HydrophobicContact CG2-CD2 4.09Å; V105-L156 HydrophobicContact CG2-CG 4.32Å; V105-M157 HydrophobicContact CG2-CG 3.9Å; V105-Y160 HydrophobicContact CG1-CD1 3.57Å; V105-Y160 HydrophobicContact CG1-CE1 4.07Å; V105-Y160 HydrophobicContact CG1-CG 4.39Å
106	G	93.4	Very high	93.2	Very high	5 Å²	5	28 Å²	28	5%	0.052	15%	0.147	C	C	.	.	H	α-helix	trans	-71.2	-35.7	175.2	0	0	0	0	0	113	F84 W104 L109 V110	F84-G106 VanDerWaalsContact CZ-N 3.29Å; W104-G106 PolarHBondContact O-N 3.48Å; G106-L109 WeakPolarHBondContact O-CB 3.47Å; G106-L109 PolarHBondContact O-N 2.84Å; G106-V110 VanDerWaalsContact O-CG2 3.3Å; G106-V110 WeakPolarHBondContact O-CG2 3.38Å; G106-V110 PolarHBondContact O-N 3.44Å
107	S	94.5	Very high	93.2	Very high	3 Å²	3	19.1 Å²	19.1	2%	0.021	11%	0.108	C	C	.	.	H	α-helix	trans	-70.8	-35.2	-177.9	-52.3	0	0	0	0	112.6	A103 W104 V110 G111 S609 P610	A103-S107 WeakPolarHBondContact O-CB 3.44Å; A103-S107 PolarHBondContact O-N 3.12Å; A103-S107 VanDerWaalsContact O-N 3.12Å; A103-S107 PolarHBondContact O-OG 3.45Å; W104-S107 PolarHBondContact O-N 3.36Å; S107-V110 PolarHBondContact O-N 3.28Å; S107-G111 PolarHBondContact O-N 2.79Å; S107-S609 VanDerWaalsContact OG-CB 3.22Å; S107-S609 WeakPolarHBondContact OG-CB 3.32Å; S107-S609 PolarHBondContact OG-OG 2.8Å; S107-P610 WeakPolarHBondContact OG-CD 3.48Å
108	V	96	Very high	93.4	Very high	16 Å²	16	19.1 Å²	19.1	10%	0.097	11%	0.105	C	C	.	.	H	α-helix	trans	-65.8	-42.8	171.7	174.5	0	0	0	0	110.2	W104 V110 G111 V112 V162 M606	W104-V108 HydrophobicContact CE3-CG2 3.98Å; W104-V108 VanDerWaalsContact O-CB 3.3Å; W104-V108 WeakPolarHBondContact O-CB 3.33Å; W104-V108 WeakPolarHBondContact O-CG2 3.46Å; W104-V108 PolarHBondContact O-N 3.3Å; V108-V110 VanDerWaalsContact C-N 3.29Å; V108-V110 PolarHBondContact O-N 3.48Å; V108-G111 PolarHBondContact O-N 3.41Å; V108-V112 HydrophobicContact CG1-CG2 3.8Å; V108-V112 WeakPolarHBondContact O-CB 3.44Å; V108-V112 WeakPolarHBondContact O-CG2 3.44Å; V108-V112 PolarHBondContact O-N 2.91Å; V108-V162 HydrophobicContact CG1-CG2 3.71Å; V108-M606 HydrophobicContact CG2-CG 4.45Å
109	L	96.8	Very high	93.4	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-52.8	-53.1	174.1	178	79.8	0	0	0	110.5	I80 V105 G106 Y113 F144 Y160 G161 G165 L168	I80-L109 HydrophobicContact CG2-CD2 4.29Å; V105-L109 PolarHBondContact O-N 3.12Å; G106-L109 WeakPolarHBondContact O-CB 3.47Å; G106-L109 PolarHBondContact O-N 2.84Å; L109-Y113 VanDerWaalsContact O-CD1 3.27Å; L109-Y113 WeakPolarHBondContact O-CD1 3.2Å; L109-Y113 PolarHBondContact O-N 2.94Å; L109-Y113 VanDerWaalsContact O-N 3.08Å; L109-F144 HydrophobicContact CD1-CE2 3.96Å; L109-F144 HydrophobicContact CD1-CZ 4.24Å; L109-F144 HydrophobicContact CD2-CZ 4.49Å; L109-Y160 HydrophobicContact CB-CD1 4.26Å; L109-Y160 HydrophobicContact CB-CE1 4Å; L109-Y160 HydrophobicContact CD1-CE1 4.42Å; L109-Y160 WeakPolarHBondContact CD1-O 3.49Å; L109-Y160 HydrophobicContact CD2-CE1 3.76Å; L109-Y160 HydrophobicContact CG-CE1 4.28Å; L109-G161 WeakPolarHBondContact CA-O 3.48Å; L109-G165 WeakPolarHBondContact O-CA 3.37Å; L109-L168 HydrophobicContact CD1-CD1 3.85Å; L109-L168 HydrophobicContact CD2-CD1 4.06Å; L109-L168 HydrophobicContact CG-CD1 4.14Å
110	V	94.9	Very high	93.6	Very high	4 Å²	4	19.8 Å²	19.8	2%	0.024	10%	0.103	C	C	.	.	H	α-helix	trans	-65.7	-48.9	-175.6	173.1	0	0	0	0	112.5	A81 G106 S107 V108 Y113 S114 Y483 A605	A81-V110 HydrophobicContact CB-CG2 3.95Å; G106-V110 VanDerWaalsContact O-CG2 3.3Å; G106-V110 WeakPolarHBondContact O-CG2 3.38Å; G106-V110 PolarHBondContact O-N 3.44Å; S107-V110 PolarHBondContact O-N 3.28Å; V108-V110 VanDerWaalsContact C-N 3.29Å; V108-V110 PolarHBondContact O-N 3.48Å; V110-Y113 HydrophobicContact CB-CD1 4.41Å; V110-Y113 HydrophobicContact CB-CE1 3.93Å; V110-Y113 HydrophobicContact CG1-CE1 3.84Å; V110-Y113 HydrophobicContact CG2-CE1 3.99Å; V110-Y113 VanDerWaalsContact O-CD1 3.29Å; V110-Y113 WeakPolarHBondContact O-CD1 3.44Å; V110-Y113 WeakPolarHBondContact O-CE1 3.22Å; V110-S114 PolarHBondContact O-N 2.88Å; V110-S114 PolarHBondContact O-OG 3.18Å; V110-Y483 HydrophobicContact CB-CE1 4.23Å; V110-Y483 HydrophobicContact CG1-CD1 4.1Å; V110-Y483 HydrophobicContact CG1-CD2 4.27Å; V110-Y483 HydrophobicContact CG1-CE1 3.29Å; V110-Y483 HydrophobicContact CG1-CE2 3.57Å; V110-Y483 WeakPolarHBondContact CG1-OH 3.47Å; V110-Y483 HydrophobicContact CG2-CD1 4.46Å; V110-Y483 HydrophobicContact CG2-CE1 3.93Å; V110-A605 HydrophobicContact CG1-CB 3.73Å
111	G	95.2	Very high	93.6	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-60.2	-50.2	179.4	0	0	0	0	0	110.9	S107 V108 Y113 S114 L115 G602	S107-G111 PolarHBondContact O-N 2.79Å; V108-G111 PolarHBondContact O-N 3.41Å; G111-Y113 PolarHBondContact O-N 3.44Å; G111-S114 CarbonylContact O-C 3.52Å; G111-S114 WeakPolarHBondContact O-CB 3.35Å; G111-S114 PolarHBondContact O-N 2.76Å; G111-S114 VanDerWaalsContact O-N 3.16Å; G111-L115 VanDerWaalsContact O-CG 3.25Å; G111-L115 WeakPolarHBondContact O-CG 3.3Å; G111-L115 PolarHBondContact O-N 3.26Å; G111-G602 WeakPolarHBondContact CA-O 3.33Å
112	V	96	Very high	93.3	Very high	18 Å²	18	14 Å²	14	11%	0.109	7%	0.073	C	C	.	.	H	α-helix	trans	-64.9	-42	-176.8	174.9	0	0	0	0	111.8	V108 S114 L115 T116 V162 I166	V108-V112 HydrophobicContact CG1-CG2 3.8Å; V108-V112 WeakPolarHBondContact O-CB 3.44Å; V108-V112 WeakPolarHBondContact O-CG2 3.44Å; V108-V112 PolarHBondContact O-N 2.91Å; V112-S114 PolarHBondContact O-N 3.42Å; V112-L115 PolarHBondContact O-N 3.48Å; V112-L115 VanDerWaalsContact O-N 3.1Å; V112-T116 WeakPolarHBondContact O-CG2 3.48Å; V112-T116 PolarHBondContact O-N 3.28Å; V112-T116 VanDerWaalsContact O-N 3.14Å; V112-V162 HydrophobicContact CG1-CG1 4.33Å; V112-V162 WeakPolarHBondContact CG1-O 3.17Å; V112-V162 HydrophobicContact CG2-CG2 4.25Å; V112-I166 HydrophobicContact CG1-CG1 3.7Å
113	Y	95.7	Very high	92.9	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-60.6	-35.6	177.4	85	-121.5	0	0	0	111.8	A81 L109 V110 G111 T116 G165 G169 Y172 Y483	A81-Y113 HydrophobicContact CB-CE1 4.19Å; L109-Y113 VanDerWaalsContact O-CD1 3.27Å; L109-Y113 WeakPolarHBondContact O-CD1 3.2Å; L109-Y113 PolarHBondContact O-N 2.94Å; L109-Y113 VanDerWaalsContact O-N 3.08Å; V110-Y113 HydrophobicContact CB-CD1 4.41Å; V110-Y113 HydrophobicContact CB-CE1 3.93Å; V110-Y113 HydrophobicContact CG1-CE1 3.84Å; V110-Y113 HydrophobicContact CG2-CE1 3.99Å; V110-Y113 VanDerWaalsContact O-CD1 3.29Å; V110-Y113 WeakPolarHBondContact O-CD1 3.44Å; V110-Y113 WeakPolarHBondContact O-CE1 3.22Å; G111-Y113 PolarHBondContact O-N 3.44Å; Y113-T116 PolarHBondContact O-OG1 3.41Å; Y113-G165 WeakPolarHBondContact CA-O 3.36Å; Y113-G165 WeakPolarHBondContact CB-O 3.13Å; Y113-G169 WeakPolarHBondContact O-CA 3.3Å; Y113-Y172 HydrophobicContact CE2-CD1 4.39Å; Y113-Y483 PolarHBondContact OH-OH 3.41Å
114	S	94	Very high	92.7	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-74.8	-35.9	176.2	-65.1	0	0	0	0	112.3	V110 G111 V112 T116 G117 V598 L599	V110-S114 PolarHBondContact O-N 2.88Å; V110-S114 PolarHBondContact O-OG 3.18Å; G111-S114 CarbonylContact O-C 3.52Å; G111-S114 WeakPolarHBondContact O-CB 3.35Å; G111-S114 PolarHBondContact O-N 2.76Å; G111-S114 VanDerWaalsContact O-N 3.16Å; V112-S114 PolarHBondContact O-N 3.42Å; S114-T116 PolarHBondContact O-N 3.36Å; S114-G117 PolarHBondContact O-N 2.95Å; S114-G117 VanDerWaalsContact O-N 3.08Å; S114-V598 WeakPolarHBondContact CB-O 3.39Å; S114-V598 CarbonylContact O-C 3.6Å; S114-V598 WeakPolarHBondContact O-CG1 3.15Å; S114-L599 PolarHBondContact O-N 3.32Å
115	L	93.6	Very high	92.2	Very high	55 Å²	55	16.9 Å²	16.9	29%	0.288	9%	0.092	S	C	.	.	H	α-helix	trans	-63.1	-23.2	175.5	-70.4	173.5	0	0	0	113	G111 V112 G117 L599 V603 M606	G111-L115 VanDerWaalsContact O-CG 3.25Å; G111-L115 WeakPolarHBondContact O-CG 3.3Å; G111-L115 PolarHBondContact O-N 3.26Å; V112-L115 PolarHBondContact O-N 3.48Å; V112-L115 VanDerWaalsContact O-N 3.1Å; L115-G117 PolarHBondContact O-N 2.85Å; L115-L599 HydrophobicContact CD2-CD1 3.73Å; L115-V603 HydrophobicContact CD2-CG2 3.69Å; L115-M606 HydrophobicContact CD1-SD 4.49Å
116	T	93.3	Very high	91.5	Very high	9 Å²	9	19.4 Å²	19.4	6%	0.055	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-11.6	174.6	69.9	0	0	0	0	114.3	V112 Y113 S114 I119 A120 I166 G169 F170	V112-T116 WeakPolarHBondContact O-CG2 3.48Å; V112-T116 PolarHBondContact O-N 3.28Å; V112-T116 VanDerWaalsContact O-N 3.14Å; Y113-T116 PolarHBondContact O-OG1 3.41Å; S114-T116 PolarHBondContact O-N 3.36Å; T116-I119 PolarHBondContact O-N 3.03Å; T116-A120 WeakPolarHBondContact O-CB 3.43Å; T116-A120 PolarHBondContact O-N 3.12Å; T116-I166 HydrophobicContact CG2-CB 4.25Å; T116-I166 HydrophobicContact CG2-CG1 4.13Å; T116-I166 HydrophobicContact CG2-CG2 4.3Å; T116-G169 WeakPolarHBondContact OG1-CA 3.35Å; T116-F170 HydrophobicContact CG2-CD1 4.47Å; T116-F170 HydrophobicContact CG2-CE1 4.3Å
117	G	91.8	Very high	91	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-40.6	-57	-171.9	0	0	0	0	0	115.4	S114 L115 I119 A120 S121 G595	S114-G117 PolarHBondContact O-N 2.95Å; S114-G117 VanDerWaalsContact O-N 3.08Å; L115-G117 PolarHBondContact O-N 2.85Å; G117-I119 PolarHBondContact O-N 2.89Å; G117-A120 PolarHBondContact O-N 3.2Å; G117-S121 VanDerWaalsContact O-CB 3.24Å; G117-S121 WeakPolarHBondContact O-CB 3.28Å; G117-S121 PolarHBondContact O-N 2.89Å; G117-S121 PolarHBondContact O-OG 3.28Å; G117-S121 VanDerWaalsContact O-OG 3.13Å; G117-G595 VanDerWaalsContact C-CA 3.47Å; G117-G595 WeakPolarHBondContact O-CA 3.48Å
118	P	91.6	Very high	90.7	Very high	17 Å²	17	23.8 Å²	23.8	11%	0.11	13%	0.125	C	C	.	.	H	α-helix	trans	-67.4	-34.6	-178.6	-20.3	32.7	0	0	0	113.6	S121 G122 V458 G595 L599	P118-S121 VanDerWaalsContact CA-OG 3.26Å; P118-S121 WeakPolarHBondContact CA-OG 3.25Å; P118-S121 PolarHBondContact O-OG 3.27Å; P118-G122 PolarHBondContact O-N 3.39Å; P118-V458 HydrophobicContact CB-CG1 4.03Å; P118-V458 HydrophobicContact CB-CG2 3.86Å; P118-V458 VanDerWaalsContact O-CG2 3.27Å; P118-V458 WeakPolarHBondContact O-CG2 3.44Å; P118-G595 WeakPolarHBondContact CD-O 3.23Å; P118-L599 HydrophobicContact CG-CB 3.93Å; P118-L599 HydrophobicContact CG-CD1 4.25Å; P118-L599 HydrophobicContact CG-CD2 3.9Å; P118-L599 HydrophobicContact CG-CG 4.24Å
119	I	91.2	Very high	90.5	Very high	83 Å²	83	23 Å²	23	43%	0.426	12%	0.12	S	C	.	.	H	α-helix	trans	-71	-48.8	179.7	-58.5	173.2	0	0	0	108.7	T116 G117 S121 G122 M123 F170	T116-I119 PolarHBondContact O-N 3.03Å; G117-I119 PolarHBondContact O-N 2.89Å; I119-S121 PolarHBondContact O-N 2.67Å; I119-G122 PolarHBondContact O-N 2.98Å; I119-M123 HydrophobicContact CG2-SD 4.12Å; I119-M123 WeakPolarHBondContact O-CB 3.34Å; I119-M123 VanDerWaalsContact O-CG 3.26Å; I119-M123 WeakPolarHBondContact O-CG 3.09Å; I119-M123 PolarHBondContact O-N 3.3Å; I119-F170 HydrophobicContact CB-CE1 4.48Å; I119-F170 HydrophobicContact CG2-CE1 4.16Å; I119-F170 HydrophobicContact CG2-CZ 3.92Å
120	A	92	Very high	90.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.8	-46.9	176.3	0	0	0	0	0	111.1	T116 G117 G122 M123 I124 F170 I173	T116-A120 WeakPolarHBondContact O-CB 3.43Å; T116-A120 PolarHBondContact O-N 3.12Å; G117-A120 PolarHBondContact O-N 3.2Å; A120-G122 PolarHBondContact O-N 3.49Å; A120-M123 PolarHBondContact O-N 3.14Å; A120-I124 VanDerWaalsContact O-CG1 3.22Å; A120-I124 WeakPolarHBondContact O-CG1 3.04Å; A120-I124 PolarHBondContact O-N 2.93Å; A120-F170 HydrophobicContact CB-CD1 3.67Å; A120-F170 HydrophobicContact CB-CE1 3.85Å; A120-I173 HydrophobicContact CB-CB 3.93Å; A120-I173 HydrophobicContact CB-CG1 3.83Å; A120-I173 HydrophobicContact CB-CG2 4.14Å
121	S	89	Confident	90.3	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.3	-44.5	178.7	67.8	0	0	0	0	111.8	G117 P118 I119 I124 N125 T591	G117-S121 VanDerWaalsContact O-CB 3.24Å; G117-S121 WeakPolarHBondContact O-CB 3.28Å; G117-S121 PolarHBondContact O-N 2.89Å; G117-S121 PolarHBondContact O-OG 3.28Å; G117-S121 VanDerWaalsContact O-OG 3.13Å; P118-S121 VanDerWaalsContact CA-OG 3.26Å; P118-S121 WeakPolarHBondContact CA-OG 3.25Å; P118-S121 PolarHBondContact O-OG 3.27Å; I119-S121 PolarHBondContact O-N 2.67Å; S121-I124 PolarHBondContact O-N 2.91Å; S121-N125 VanDerWaalsContact O-CG 3.29Å; S121-N125 PolarHBondContact O-N 3.4Å; S121-N125 PolarHBondContact O-ND2 3.01Å; S121-T591 WeakPolarHBondContact CB-O 3.25Å; S121-T591 WeakPolarHBondContact O-CG2 3.17Å
122	G	84.9	Confident	90.3	Very high	2 Å²	2	30.1 Å²	30.1	2%	0.021	16%	0.156	C	C	.	.	H	α-helix	trans	-57.5	-52.4	173.1	0	0	0	0	0	110.8	P118 I119 A120 I124 N125 K126 M457	P118-G122 PolarHBondContact O-N 3.39Å; I119-G122 PolarHBondContact O-N 2.98Å; A120-G122 PolarHBondContact O-N 3.49Å; G122-I124 VanDerWaalsContact C-N 3.29Å; G122-I124 PolarHBondContact O-N 3.29Å; G122-N125 WeakPolarHBondContact O-CB 3.44Å; G122-N125 PolarHBondContact O-N 3Å; G122-N125 VanDerWaalsContact O-N 3.08Å; G122-K126 PolarHBondContact O-N 3.48Å; G122-M457 WeakPolarHBondContact O-CE 3.35Å
123	M	86.5	Confident	90.3	Very high	47 Å²	47	29.3 Å²	29.3	23%	0.232	15%	0.151	C	C	.	.	H	α-helix	trans	-59.8	-37.1	-178.7	-70.9	179.3	69.8	0	0	112.9	I119 A120 N125 K126 F127 V132 F170	I119-M123 HydrophobicContact CG2-SD 4.12Å; I119-M123 WeakPolarHBondContact O-CB 3.34Å; I119-M123 VanDerWaalsContact O-CG 3.26Å; I119-M123 WeakPolarHBondContact O-CG 3.09Å; I119-M123 PolarHBondContact O-N 3.3Å; A120-M123 PolarHBondContact O-N 3.14Å; M123-N125 VanDerWaalsContact C-N 3.33Å; M123-N125 PolarHBondContact O-N 3.07Å; M123-K126 PolarHBondContact O-N 2.71Å; M123-F127 HydrophobicContact CB-CD2 4.1Å; M123-F127 HydrophobicContact CE-CD2 4.38Å; M123-F127 HydrophobicContact CE-CE2 4.45Å; M123-F127 HydrophobicContact CG-CD2 4.29Å; M123-F127 HydrophobicContact CG-CE2 4.31Å; M123-F127 PolarHBondContact O-N 3.17Å; M123-V132 HydrophobicContact CB-CG2 3.55Å; M123-V132 HydrophobicContact CE-CG2 4.47Å; M123-F170 HydrophobicContact CE-CE2 4.1Å; M123-F170 HydrophobicContact SD-CE1 4.32Å; M123-F170 HydrophobicContact SD-CE2 3.67Å; M123-F170 HydrophobicContact SD-CZ 3.51Å; M123-F170 VanDerWaalsContact SD-CZ 3.51Å
124	I	87.1	Confident	90.4	Very high	10 Å²	10	32.2 Å²	32.2	5%	0.051	17%	0.166	C	C	.	.	H	α-helix	trans	-60	-46.4	175.1	-70.1	163.2	0	0	0	110.2	A120 S121 G122 K126 S128 A129 V132 I173 P174 V177 T591	A120-I124 VanDerWaalsContact O-CG1 3.22Å; A120-I124 WeakPolarHBondContact O-CG1 3.04Å; A120-I124 PolarHBondContact O-N 2.93Å; S121-I124 PolarHBondContact O-N 2.91Å; G122-I124 VanDerWaalsContact C-N 3.29Å; G122-I124 PolarHBondContact O-N 3.29Å; I124-K126 PolarHBondContact O-N 3.11Å; I124-S128 WeakPolarHBondContact O-CA 3.2Å; I124-S128 PolarHBondContact O-N 3.3Å; I124-S128 VanDerWaalsContact O-N 3.12Å; I124-A129 HydrophobicContact CG2-CB 4.2Å; I124-V132 HydrophobicContact CG1-CB 4.26Å; I124-V132 HydrophobicContact CG1-CG1 4.33Å; I124-V132 HydrophobicContact CG1-CG2 4.13Å; I124-I173 HydrophobicContact CD1-CB 4.38Å; I124-I173 HydrophobicContact CD1-CG2 3.68Å; I124-P174 HydrophobicContact CD1-CB 3.88Å; I124-P174 HydrophobicContact CD1-CG 4.41Å; I124-P174 HydrophobicContact CG1-CB 4.28Å; I124-V177 HydrophobicContact CD1-CG2 4.36Å; I124-T591 HydrophobicContact CB-CG2 4.15Å; I124-T591 HydrophobicContact CD1-CG2 4.39Å; I124-T591 HydrophobicContact CG2-CG2 4.12Å
125	N	84	Confident	90.6	Very high	84 Å²	84	34 Å²	34	45%	0.449	18%	0.181	S	C	.	.	H	α-helix	trans	-64.4	-25	-179.6	-65.1	-23.6	0	0	0	113	S121 G122 M123 T591 N592	S121-N125 VanDerWaalsContact O-CG 3.29Å; S121-N125 PolarHBondContact O-N 3.4Å; S121-N125 PolarHBondContact O-ND2 3.01Å; G122-N125 WeakPolarHBondContact O-CB 3.44Å; G122-N125 PolarHBondContact O-N 3Å; G122-N125 VanDerWaalsContact O-N 3.08Å; M123-N125 VanDerWaalsContact C-N 3.33Å; M123-N125 PolarHBondContact O-N 3.07Å; N125-T591 WeakPolarHBondContact OD1-CG2 3.31Å; N125-N592 PolarHBondContact ND2-OD1 3.23Å; N125-N592 VanDerWaalsContact ND2-OD1 3.11Å
126	K	81.2	Confident	90.8	Very high	54 Å²	54	31.4 Å²	31.4	24%	0.235	17%	0.167	C	C	.	.	H	α-helix	trans	-101.2	-39.7	-177.6	-177.8	163.2	-171.5	165.5	0	115.1	G122 M123 I124 F386 V453 M457	G122-K126 PolarHBondContact O-N 3.48Å; M123-K126 PolarHBondContact O-N 2.71Å; I124-K126 PolarHBondContact O-N 3.11Å; K126-F386 PolarHBondContact NZ-O 2.99Å; K126-V453 HydrophobicContact CD-CG1 4.34Å; K126-M457 HydrophobicContact CB-CE 3.29Å; K126-M457 HydrophobicContact CB-SD 4.28Å; K126-M457 HydrophobicContact CD-CE 3.68Å; K126-M457 HydrophobicContact CD-SD 3.67Å; K126-M457 HydrophobicContact CG-CE 4.08Å
127	F	82.9	Confident	91.1	Very high	68 Å²	68	31 Å²	31	30%	0.298	17%	0.165	S	C	.	.	H	α-helix	trans	-111.3	-13.5	-171	-59.9	-70.5	0	0	0	114.5	M123 S131 F392	M123-F127 HydrophobicContact CB-CD2 4.1Å; M123-F127 HydrophobicContact CE-CD2 4.38Å; M123-F127 HydrophobicContact CE-CE2 4.45Å; M123-F127 HydrophobicContact CG-CD2 4.29Å; M123-F127 HydrophobicContact CG-CE2 4.31Å; M123-F127 PolarHBondContact O-N 3.17Å; F127-S131 PolarHBondContact O-OG 2.85Å; F127-F392 AromaticContact CD1-CD2 3.75Å; F127-F392 HydrophobicContact CD1-CD2 3.75Å; F127-F392 HydrophobicContact CD1-CE1 4.32Å; F127-F392 AromaticContact CD1-CE2 3.52Å; F127-F392 HydrophobicContact CD1-CE2 3.52Å; F127-F392 HydrophobicContact CD1-CG 4.28Å; F127-F392 AromaticContact CD1-CZ 3.85Å; F127-F392 HydrophobicContact CD1-CZ 3.85Å; F127-F392 HydrophobicContact CE1-CD2 4Å; F127-F392 HydrophobicContact CE1-CE1 4.35Å; F127-F392 AromaticContact CE1-CE2 3.29Å; F127-F392 HydrophobicContact CE1-CE2 3.29Å; F127-F392 AromaticContact CE1-CZ 3.51Å; F127-F392 HydrophobicContact CE1-CZ 3.51Å; F127-F392 HydrophobicContact CZ-CE2 4.44Å
128	S	87.4	Confident	91.4	Very high	32 Å²	32	34.4 Å²	34.4	22%	0.224	19%	0.186	C	C	.	.			trans	91.3	149	-167.3	82.8	0	0	0	0	115.9	I124 R130 S131 V132	I124-S128 WeakPolarHBondContact O-CA 3.2Å; I124-S128 PolarHBondContact O-N 3.3Å; I124-S128 VanDerWaalsContact O-N 3.12Å; S128-R130 VanDerWaalsContact C-N 3.29Å; S128-R130 PolarHBondContact O-N 3.18Å; S128-S131 PolarHBondContact O-N 3.45Å; S128-S131 PolarHBondContact OG-OG 3.42Å; S128-V132 WeakPolarHBondContact O-CG2 3.39Å; S128-V132 PolarHBondContact O-N 3.37Å
129	A	90.6	Very high	91.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58.3	-37.1	176.2	0	0	0	0	0	113.4	I124 V132 C133 P174 Y178 L239	I124-A129 HydrophobicContact CG2-CB 4.2Å; A129-V132 PolarHBondContact O-N 3.11Å; A129-C133 WeakPolarHBondContact O-CB 3.45Å; A129-C133 PolarHBondContact O-N 3.03Å; A129-P174 HydrophobicContact CB-CB 3.75Å; A129-Y178 HydrophobicContact CB-CD1 4.14Å; A129-Y178 HydrophobicContact CB-CD2 3.7Å; A129-Y178 HydrophobicContact CB-CE1 4.05Å; A129-Y178 HydrophobicContact CB-CE2 3.64Å; A129-Y178 HydrophobicContact CB-CG 3.96Å; A129-L239 HydrophobicContact CB-CB 4.49Å
130	R	94.6	Very high	92.1	Very high	91 Å²	91	31.9 Å²	31.9	34%	0.343	17%	0.172	S	C	.	.	H	α-helix	trans	-58.5	-53.3	177.7	170.7	170.6	176.4	-172.8	0.6	112	S128 V132 C133 I134 G236 W240	S128-R130 VanDerWaalsContact C-N 3.29Å; S128-R130 PolarHBondContact O-N 3.18Å; R130-V132 VanDerWaalsContact C-N 3.32Å; R130-V132 PolarHBondContact O-N 3.5Å; R130-C133 PolarHBondContact O-N 3.38Å; R130-I134 HydrophobicContact CG-CD1 3.84Å; R130-I134 WeakPolarHBondContact O-CG1 3.37Å; R130-I134 PolarHBondContact O-N 3.16Å; R130-I134 VanDerWaalsContact O-N 3.07Å; R130-G236 WeakPolarHBondContact CA-O 3.2Å; R130-G236 WeakPolarHBondContact CG-O 3.36Å; R130-W240 VanDerWaalsContact NH1-CZ3 3.31Å
131	S	93.5	Very high	92.4	Very high	61 Å²	61	34.8 Å²	34.8	43%	0.427	19%	0.186	S	C	.	.	H	α-helix	trans	-63.4	-40.4	-176.8	-58	0	0	0	0	111.7	F127 S128 A135	F127-S131 PolarHBondContact O-OG 2.85Å; S128-S131 PolarHBondContact O-N 3.45Å; S128-S131 PolarHBondContact OG-OG 3.42Å; S131-A135 WeakPolarHBondContact O-CB 3.22Å; S131-A135 PolarHBondContact O-N 3.33Å
132	V	95.1	Very high	92.8	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-64.2	-44.8	178.3	179.2	0	0	0	0	111.2	M123 I124 S128 A129 R130 A135 G136 F170	M123-V132 HydrophobicContact CB-CG2 3.55Å; M123-V132 HydrophobicContact CE-CG2 4.47Å; I124-V132 HydrophobicContact CG1-CB 4.26Å; I124-V132 HydrophobicContact CG1-CG1 4.33Å; I124-V132 HydrophobicContact CG1-CG2 4.13Å; S128-V132 WeakPolarHBondContact O-CG2 3.39Å; S128-V132 PolarHBondContact O-N 3.37Å; A129-V132 PolarHBondContact O-N 3.11Å; R130-V132 VanDerWaalsContact C-N 3.32Å; R130-V132 PolarHBondContact O-N 3.5Å; V132-A135 PolarHBondContact O-N 3Å; V132-G136 PolarHBondContact O-N 3.37Å; V132-F170 HydrophobicContact CG1-CB 4Å; V132-F170 HydrophobicContact CG1-CD1 4.46Å; V132-F170 HydrophobicContact CG1-CD2 4.41Å; V132-F170 HydrophobicContact CG1-CG 4.06Å
133	C	97.2	Very high	93.4	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.007	21%	0.208	C	C	.	.	H	α-helix	trans	-65	-42.9	179.5	-171.1	0	0	0	0	112.5	A129 R130 A135 G136 A137 F170 P174 G236 L239	A129-C133 WeakPolarHBondContact O-CB 3.45Å; A129-C133 PolarHBondContact O-N 3.03Å; R130-C133 PolarHBondContact O-N 3.38Å; C133-A135 PolarHBondContact O-N 2.93Å; C133-G136 PolarHBondContact O-N 3.37Å; C133-A137 PolarHBondContact O-N 3.24Å; C133-F170 WeakPolarHBondContact CA-O 3.49Å; C133-P174 HydrophobicContact CB-CG 3.91Å; C133-G236 WeakPolarHBondContact SG-CA 3.35Å; C133-L239 HydrophobicContact CB-CD1 4.07Å
134	I	97.9	Very high	94	Very high	61 Å²	61	36.9 Å²	36.9	31%	0.313	20%	0.197	S	C	.	.	H	α-helix	trans	-61.5	-46	176.5	-66.7	167.6	0	0	0	110.8	R130 G136 A137 T138 A237	R130-I134 HydrophobicContact CG-CD1 3.84Å; R130-I134 WeakPolarHBondContact O-CG1 3.37Å; R130-I134 PolarHBondContact O-N 3.16Å; R130-I134 VanDerWaalsContact O-N 3.07Å; I134-G136 VanDerWaalsContact C-N 3.32Å; I134-G136 PolarHBondContact O-N 3.36Å; I134-A137 PolarHBondContact O-N 3.25Å; I134-T138 PolarHBondContact O-N 3.34Å; I134-T138 VanDerWaalsContact O-N 3.14Å; I134-T138 PolarHBondContact O-OG1 3.23Å; I134-A237 HydrophobicContact CD1-CB 4.3Å
135	A	97.2	Very high	94.5	Very high	37 Å²	37	37.8 Å²	37.8	31%	0.306	20%	0.203	S	C	.	.	H	α-helix	trans	-61	-42.4	176	0	0	0	0	0	111.7	S131 V132 C133 A137 T138 I139	S131-A135 WeakPolarHBondContact O-CB 3.22Å; S131-A135 PolarHBondContact O-N 3.33Å; V132-A135 PolarHBondContact O-N 3Å; C133-A135 PolarHBondContact O-N 2.93Å; A135-A137 PolarHBondContact O-N 3.17Å; A135-T138 PolarHBondContact O-N 3.12Å; A135-I139 VanDerWaalsContact O-CG1 3.26Å; A135-I139 WeakPolarHBondContact O-CG1 3.5Å; A135-I139 PolarHBondContact O-N 3.14Å
136	G	98.4	Very high	95.1	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-57.9	-45.1	175.2	0	0	0	0	0	113.1	V132 C133 I134 T138 I139 G140 G167 F170	V132-G136 PolarHBondContact O-N 3.37Å; C133-G136 PolarHBondContact O-N 3.37Å; I134-G136 VanDerWaalsContact C-N 3.32Å; I134-G136 PolarHBondContact O-N 3.36Å; G136-T138 PolarHBondContact O-N 2.97Å; G136-I139 PolarHBondContact O-N 2.88Å; G136-G140 PolarHBondContact O-N 3.11Å; G136-G167 CarbonylContact C-O 3.56Å; G136-G167 VanDerWaalsContact CA-O 3.29Å; G136-G167 WeakPolarHBondContact CA-O 3.05Å; G136-G167 CarbonylContact O-C 3.5Å; G136-G167 WeakPolarHBondContact O-CA 2.95Å; G136-F170 VanDerWaalsContact CA-CB 3.49Å
137	A	98.6	Very high	95.9	Very high	2 Å²	2	32.5 Å²	32.5	2%	0.017	18%	0.179	C	C	.	.	H	α-helix	trans	-62	-41.9	176.9	0	0	0	0	0	112.8	C133 I134 A135 M141 I171 C232	C133-A137 PolarHBondContact O-N 3.24Å; I134-A137 PolarHBondContact O-N 3.25Å; A135-A137 PolarHBondContact O-N 3.17Å; A137-M141 VanDerWaalsContact O-CB 3.31Å; A137-M141 WeakPolarHBondContact O-CB 3.31Å; A137-M141 PolarHBondContact O-N 2.87Å; A137-I171 HydrophobicContact CB-CD1 4.16Å; A137-I171 HydrophobicContact CB-CG1 4.39Å; A137-C232 HydrophobicContact CB-CB 4.14Å
138	T	98.4	Very high	96.6	Very high	71 Å²	71	29.7 Å²	29.7	44%	0.436	17%	0.168	S	C	.	.	H	α-helix	trans	-65	-46.3	175.7	-52	0	0	0	0	111.7	I134 A135 G136 M141 L142	I134-T138 PolarHBondContact O-N 3.34Å; I134-T138 VanDerWaalsContact O-N 3.14Å; I134-T138 PolarHBondContact O-OG1 3.23Å; A135-T138 PolarHBondContact O-N 3.12Å; G136-T138 PolarHBondContact O-N 2.97Å; T138-M141 PolarHBondContact O-N 3.38Å; T138-L142 HydrophobicContact CG2-CD1 4.35Å; T138-L142 WeakPolarHBondContact O-CG 3.35Å; T138-L142 PolarHBondContact O-N 2.8Å; T138-L142 VanDerWaalsContact O-N 3.08Å
139	I	98.4	Very high	97	Very high	47 Å²	47	35.8 Å²	35.8	24%	0.241	19%	0.186	C	C	.	.	H	α-helix	trans	-62.8	-45.4	179	-67.4	166	0	0	0	110.8	A135 G136 L142 G143 L163 I166 F170	A135-I139 VanDerWaalsContact O-CG1 3.26Å; A135-I139 WeakPolarHBondContact O-CG1 3.5Å; A135-I139 PolarHBondContact O-N 3.14Å; G136-I139 PolarHBondContact O-N 2.88Å; I139-L142 PolarHBondContact O-N 2.92Å; I139-G143 PolarHBondContact O-N 3.47Å; I139-L163 HydrophobicContact CG2-CD1 3.64Å; I139-L163 HydrophobicContact CG2-CG 4.34Å; I139-I166 HydrophobicContact CG2-CB 4.44Å; I139-I166 HydrophobicContact CG2-CG2 4.22Å; I139-F170 HydrophobicContact CD1-CD2 4.33Å; I139-F170 HydrophobicContact CD1-CE2 4.5Å
140	G	98.4	Very high	97.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63.4	-43.9	-179.9	0	0	0	0	0	112.2	G136 L142 G143 F144	G136-G140 PolarHBondContact O-N 3.11Å; G140-L142 PolarHBondContact O-N 3.25Å; G140-G143 PolarHBondContact O-N 3.42Å; G140-F144 VanDerWaalsContact O-CD2 3.29Å; G140-F144 WeakPolarHBondContact O-CD2 3.22Å; G140-F144 PolarHBondContact O-N 3.42Å
141	M	98.4	Very high	97	Very high	60 Å²	60	37.3 Å²	37.3	30%	0.296	21%	0.206	S	C	.	.	H	α-helix	trans	-56.7	-48.8	173.1	179.3	-167.5	70.1	0	0	111.1	A137 T138 G143 F144 V145 A230	A137-M141 VanDerWaalsContact O-CB 3.31Å; A137-M141 WeakPolarHBondContact O-CB 3.31Å; A137-M141 PolarHBondContact O-N 2.87Å; T138-M141 PolarHBondContact O-N 3.38Å; M141-G143 VanDerWaalsContact C-N 3.33Å; M141-G143 PolarHBondContact O-N 3.38Å; M141-F144 PolarHBondContact O-N 2.75Å; M141-V145 HydrophobicContact CG-CG2 4.38Å; M141-V145 WeakPolarHBondContact O-CB 3.17Å; M141-V145 WeakPolarHBondContact O-CG2 3.32Å; M141-V145 PolarHBondContact O-N 3.15Å; M141-A230 HydrophobicContact CB-CB 4.23Å; M141-A230 HydrophobicContact CG-CB 4.06Å; M141-A230 HydrophobicContact SD-CB 3.68Å
142	L	98.2	Very high	97.1	Very high	94 Å²	94	36.8 Å²	36.8	49%	0.492	20%	0.202	S	C	.	.	H	α-helix	trans	-62.5	-38.4	178.1	-68.5	172.9	0	0	0	112.3	T138 I139 G140 S146	T138-L142 HydrophobicContact CG2-CD1 4.35Å; T138-L142 WeakPolarHBondContact O-CG 3.35Å; T138-L142 PolarHBondContact O-N 2.8Å; T138-L142 VanDerWaalsContact O-N 3.08Å; I139-L142 PolarHBondContact O-N 2.92Å; G140-L142 PolarHBondContact O-N 3.25Å; L142-S146 WeakPolarHBondContact O-CB 3.49Å; L142-S146 PolarHBondContact O-N 3.29Å; L142-S146 PolarHBondContact O-OG 3.31Å
143	G	98.2	Very high	97.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.5	-43.9	173.7	0	0	0	0	0	113.1	I139 G140 M141 S146 S147 T159	I139-G143 PolarHBondContact O-N 3.47Å; G140-G143 PolarHBondContact O-N 3.42Å; M141-G143 VanDerWaalsContact C-N 3.33Å; M141-G143 PolarHBondContact O-N 3.38Å; G143-S146 WeakPolarHBondContact CA-OG 3.33Å; G143-S146 PolarHBondContact O-OG 3.34Å; G143-S147 PolarHBondContact O-N 3.2Å; G143-S147 PolarHBondContact O-OG 2.86Å; G143-T159 CarbonylContact O-C 3.25Å
144	F	98.2	Very high	97	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-73.9	-42.8	-179.1	-82.1	-129.4	0	0	0	111.8	I80 L109 G140 M141 S147 Y160 L168 L222 L225 V229	I80-F144 HydrophobicContact CD1-CE1 4.04Å; I80-F144 HydrophobicContact CD1-CZ 4.42Å; I80-F144 HydrophobicContact CG2-CE1 3.74Å; I80-F144 HydrophobicContact CG2-CZ 3.71Å; L109-F144 HydrophobicContact CD1-CE2 3.96Å; L109-F144 HydrophobicContact CD1-CZ 4.24Å; L109-F144 HydrophobicContact CD2-CZ 4.49Å; G140-F144 VanDerWaalsContact O-CD2 3.29Å; G140-F144 WeakPolarHBondContact O-CD2 3.22Å; G140-F144 PolarHBondContact O-N 3.42Å; M141-F144 PolarHBondContact O-N 2.75Å; F144-S147 VanDerWaalsContact O-CB 3.31Å; F144-S147 WeakPolarHBondContact O-CB 3.26Å; F144-S147 PolarHBondContact O-N 3.48Å; F144-Y160 HydrophobicContact CD1-CD2 4.27Å; F144-Y160 HydrophobicContact CD1-CE2 4.05Å; F144-Y160 HydrophobicContact CD2-CD2 4.21Å; F144-Y160 HydrophobicContact CD2-CE2 4.49Å; F144-Y160 HydrophobicContact CE1-CD2 4.04Å; F144-Y160 AromaticContact CE1-CE2 3.44Å; F144-Y160 HydrophobicContact CE1-CE2 3.44Å; F144-Y160 VanDerWaalsContact CE1-CE2 3.44Å; F144-Y160 AromaticContact CE2-CD2 3.96Å; F144-Y160 HydrophobicContact CE2-CD2 3.96Å; F144-Y160 AromaticContact CE2-CE2 3.95Å; F144-Y160 HydrophobicContact CE2-CE2 3.95Å; F144-Y160 HydrophobicContact CG-CD2 4.34Å; F144-Y160 AromaticContact CZ-CD2 3.87Å; F144-Y160 HydrophobicContact CZ-CD2 3.87Å; F144-Y160 AromaticContact CZ-CE2 3.37Å; F144-Y160 HydrophobicContact CZ-CE2 3.37Å; F144-L168 HydrophobicContact CZ-CD1 4.44Å; F144-L222 HydrophobicContact CD1-CD2 4.3Å; F144-L225 HydrophobicContact CD1-CB 3.93Å; F144-L225 HydrophobicContact CE1-CB 4.08Å; F144-L225 HydrophobicContact CE1-CD1 4.49Å; F144-V229 HydrophobicContact CE1-CG2 4.48Å
145	V	98	Very high	96.9	Very high	28 Å²	28	43.7 Å²	43.7	17%	0.17	24%	0.235	C	C	.	.	H	α-helix	trans	-62	-47.5	176.2	172.1	0	0	0	0	110.6	M141 S147 T148 W149 W223 S226	M141-V145 HydrophobicContact CG-CG2 4.38Å; M141-V145 WeakPolarHBondContact O-CB 3.17Å; M141-V145 WeakPolarHBondContact O-CG2 3.32Å; M141-V145 PolarHBondContact O-N 3.15Å; V145-S147 PolarHBondContact O-N 3.16Å; V145-T148 WeakPolarHBondContact O-CB 3.47Å; V145-T148 WeakPolarHBondContact O-CG2 3.39Å; V145-T148 PolarHBondContact O-N 3.07Å; V145-T148 VanDerWaalsContact O-N 3.12Å; V145-T148 PolarHBondContact O-OG1 3.17Å; V145-W149 HydrophobicContact CG1-CH2 3.69Å; V145-W149 HydrophobicContact CG1-CZ3 3.7Å; V145-W149 WeakPolarHBondContact O-CZ3 3.48Å; V145-W223 HydrophobicContact CG1-CH2 3.86Å; V145-W223 HydrophobicContact CG1-CZ2 4.23Å; V145-W223 HydrophobicContact CG1-CZ3 4.18Å; V145-W223 HydrophobicContact CG2-CE3 4.43Å; V145-W223 HydrophobicContact CG2-CZ3 4.26Å; V145-S226 WeakPolarHBondContact CG2-OG 3.41Å
146	S	97.2	Very high	96.9	Very high	27 Å²	27	42 Å²	42	19%	0.189	22%	0.221	C	C	.	.	H	α-helix	trans	-59.2	-29.6	178.8	56.4	0	0	0	0	113.6	L142 G143 T148 W149 F155 T159	L142-S146 WeakPolarHBondContact O-CB 3.49Å; L142-S146 PolarHBondContact O-N 3.29Å; L142-S146 PolarHBondContact O-OG 3.31Å; G143-S146 WeakPolarHBondContact CA-OG 3.33Å; G143-S146 PolarHBondContact O-OG 3.34Å; S146-T148 PolarHBondContact O-N 3.02Å; S146-W149 PolarHBondContact O-N 3.28Å; S146-F155 WeakPolarHBondContact O-CE1 3.39Å; S146-T159 WeakPolarHBondContact OG-CB 3.33Å
147	S	97.7	Very high	96.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-66.4	-19.1	178.7	-61.3	0	0	0	0	114.8	G143 F144 V145 W149 A150 T159 Y160	G143-S147 PolarHBondContact O-N 3.2Å; G143-S147 PolarHBondContact O-OG 2.86Å; F144-S147 VanDerWaalsContact O-CB 3.31Å; F144-S147 WeakPolarHBondContact O-CB 3.26Å; F144-S147 PolarHBondContact O-N 3.48Å; V145-S147 PolarHBondContact O-N 3.16Å; S147-W149 PolarHBondContact O-N 3.47Å; S147-A150 WeakPolarHBondContact O-CB 3.36Å; S147-A150 PolarHBondContact O-N 3.28Å; S147-A150 VanDerWaalsContact O-N 3.07Å; S147-T159 VanDerWaalsContact CA-OG1 3.29Å; S147-T159 WeakPolarHBondContact CA-OG1 3.21Å; S147-T159 WeakPolarHBondContact CB-OG1 3.46Å; S147-T159 VanDerWaalsContact OG-CB 3.26Å; S147-T159 WeakPolarHBondContact OG-CB 3.49Å; S147-T159 PolarHBondContact OG-OG1 3.03Å; S147-Y160 VanDerWaalsContact OG-CA 3.22Å; S147-Y160 WeakPolarHBondContact OG-CA 3.36Å; S147-Y160 VanDerWaalsContact OG-CB 3.25Å; S147-Y160 WeakPolarHBondContact OG-CB 3.25Å; S147-Y160 PolarHBondContact OG-N 3.47Å
148	T	96.2	Very high	96.8	Very high	9 Å²	9	48.2 Å²	48.2	6%	0.055	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-71.3	-22.6	-178.2	66.8	0	0	0	0	112.3	V145 S146 A150 K219 L222 W223	V145-T148 WeakPolarHBondContact O-CB 3.47Å; V145-T148 WeakPolarHBondContact O-CG2 3.39Å; V145-T148 PolarHBondContact O-N 3.07Å; V145-T148 VanDerWaalsContact O-N 3.12Å; V145-T148 PolarHBondContact O-OG1 3.17Å; S146-T148 PolarHBondContact O-N 3.02Å; T148-A150 VanDerWaalsContact C-N 3.3Å; T148-K219 WeakPolarHBondContact O-CD 3.38Å; T148-K219 VanDerWaalsContact O-CE 3.31Å; T148-K219 WeakPolarHBondContact O-CE 3.27Å; T148-K219 PolarHBondContact O-NZ 3.42Å; T148-L222 HydrophobicContact CG2-CB 4.11Å; T148-W223 VanDerWaalsContact CG2-CD1 3.45Å; T148-W223 HydrophobicContact CG2-CG 4.11Å
149	W	96.1	Very high	96.8	Very high	161 Å²	161	45.6 Å²	45.6	61%	0.61	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-86.8	6.4	172.2	-61.5	-77.9	0	0	0	113.5	V145 S146 S147 T151 W223	V145-W149 HydrophobicContact CG1-CH2 3.69Å; V145-W149 HydrophobicContact CG1-CZ3 3.7Å; V145-W149 WeakPolarHBondContact O-CZ3 3.48Å; S146-W149 PolarHBondContact O-N 3.28Å; S147-W149 PolarHBondContact O-N 3.47Å; W149-T151 PolarHBondContact O-N 3.16Å; W149-W223 HydrophobicContact CH2-CZ2 4.37Å; W149-W223 HydrophobicContact CZ2-CZ2 4.44Å
150	A	94.1	Very high	96.8	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.225	C	C	.	.			trans	-63.1	125.2	-179.5	0	0	0	0	0	112.3	S147 T148 F155 L156 W218	S147-A150 WeakPolarHBondContact O-CB 3.36Å; S147-A150 PolarHBondContact O-N 3.28Å; S147-A150 VanDerWaalsContact O-N 3.07Å; T148-A150 VanDerWaalsContact C-N 3.3Å; A150-F155 HydrophobicContact CB-CD1 3.48Å; A150-F155 VanDerWaalsContact CB-CD1 3.48Å; A150-F155 HydrophobicContact CB-CE1 4.1Å; A150-F155 HydrophobicContact CB-CG 4.41Å; A150-L156 HydrophobicContact CB-CB 3.98Å; A150-L156 HydrophobicContact CB-CD1 4.11Å; A150-W218 HydrophobicContact CB-CH2 4.21Å
151	T	92.7	Very high	96.7	Very high	123 Å²	123	43.4 Å²	43.4	76%	0.755	23%	0.225	S	C	*	.			trans	-108.3	-6.8	173.3	55.8	0	0	0	0	112.7	W149	W149-T151 PolarHBondContact O-N 3.16Å
152	S	94.7	Very high	96.7	Very high	50 Å²	50	43 Å²	43	35%	0.35	23%	0.226	S	C	.	.	S	Bend	trans	-142.7	157.2	176.2	66.1	0	0	0	0	111.2	L154 F155 L156	S152-L154 VanDerWaalsContact C-N 3.27Å; S152-L154 PolarHBondContact O-N 3.23Å; S152-F155 PolarHBondContact O-N 3.02Å; S152-F155 WeakPolarHBondContact OG-CB 3.28Å; S152-F155 PolarHBondContact OG-N 3.48Å; S152-L156 PolarHBondContact O-N 3.47Å; S152-L156 VanDerWaalsContact O-N 3.12Å
153	L	94.3	Very high	96.7	Very high	20 Å²	20	41.6 Å²	41.6	11%	0.105	22%	0.219	C	C	.	.	H	α-helix	trans	-61.7	-35.9	174.8	-72.4	172.1	0	0	0	112	F95 T101 V102 V105 L156 M157	F95-L153 HydrophobicContact CB-CD1 3.98Å; F95-L153 HydrophobicContact CB-CD2 3.82Å; F95-L153 HydrophobicContact CB-CG 3.69Å; F95-L153 HydrophobicContact CD1-CD2 4.36Å; F95-L153 HydrophobicContact CD1-CG 4.14Å; F95-L153 HydrophobicContact CD2-CD2 3.42Å; F95-L153 VanDerWaalsContact CD2-CD2 3.42Å; F95-L153 HydrophobicContact CD2-CG 4.07Å; F95-L153 HydrophobicContact CE2-CD2 4.06Å; F95-L153 HydrophobicContact CG-CD2 3.6Å; F95-L153 HydrophobicContact CG-CG 3.7Å; T101-L153 HydrophobicContact CG2-CD1 3.76Å; V102-L153 HydrophobicContact CG2-CD1 4.13Å; V102-L153 HydrophobicContact CG2-CD2 4.31Å; V105-L153 HydrophobicContact CG2-CD2 4.09Å; L153-L156 PolarHBondContact O-N 2.83Å; L153-M157 HydrophobicContact CB-CE 3.87Å; L153-M157 WeakPolarHBondContact O-CE 2.93Å; L153-M157 VanDerWaalsContact O-CG 3.32Å; L153-M157 WeakPolarHBondContact O-CG 3.42Å; L153-M157 PolarHBondContact O-N 3.42Å
154	L	95.5	Very high	96.7	Very high	110 Å²	110	41.6 Å²	41.6	58%	0.576	22%	0.219	S	C	*	.	H	α-helix	trans	-62.7	-45.6	177.2	178.5	61.7	0	0	0	111.4	S152 L156 M157 L158	S152-L154 VanDerWaalsContact C-N 3.27Å; S152-L154 PolarHBondContact O-N 3.23Å; L154-L156 VanDerWaalsContact C-N 3.29Å; L154-L156 PolarHBondContact O-N 3.29Å; L154-M157 PolarHBondContact O-N 3.44Å; L154-L158 HydrophobicContact CD1-CD1 4.45Å; L154-L158 HydrophobicContact CD1-CG 4.4Å; L154-L158 HydrophobicContact CG-CD1 4.31Å; L154-L158 WeakPolarHBondContact O-CG 3.2Å; L154-L158 PolarHBondContact O-N 2.94Å
155	F	97.1	Very high	96.7	Very high	78 Å²	78	41.6 Å²	41.6	34%	0.342	22%	0.219	S	C	.	.	H	α-helix	trans	-60.1	-44	176.2	-175.2	-82.1	0	0	0	110.8	S146 A150 S152 M157 L158 T159	S146-F155 WeakPolarHBondContact O-CE1 3.39Å; A150-F155 HydrophobicContact CB-CD1 3.48Å; A150-F155 VanDerWaalsContact CB-CD1 3.48Å; A150-F155 HydrophobicContact CB-CE1 4.1Å; A150-F155 HydrophobicContact CB-CG 4.41Å; S152-F155 PolarHBondContact O-N 3.02Å; S152-F155 WeakPolarHBondContact OG-CB 3.28Å; S152-F155 PolarHBondContact OG-N 3.48Å; F155-M157 PolarHBondContact O-N 2.65Å; F155-L158 PolarHBondContact O-N 3.27Å; F155-L158 VanDerWaalsContact O-N 3.16Å; F155-T159 HydrophobicContact CD1-CG2 4.01Å; F155-T159 HydrophobicContact CE1-CG2 3.58Å; F155-T159 HydrophobicContact CE2-CG2 4.41Å; F155-T159 HydrophobicContact CZ-CG2 3.81Å; F155-T159 PolarHBondContact O-N 3.24Å; F155-T159 PolarHBondContact O-OG1 2.78Å
156	L	97	Very high	96.7	Very high	3 Å²	3	42.9 Å²	42.9	2%	0.016	22%	0.224	C	C	.	.	H	α-helix	trans	-62.5	-40.5	176.9	-170.1	60.4	0	0	0	112.1	L91 F95 V105 A150 S152 L153 L154 L158 Y160 G161 W218 L222	L91-L156 HydrophobicContact CD1-CD2 4.28Å; L91-L156 HydrophobicContact CD2-CD2 3.9Å; F95-L156 HydrophobicContact CE2-CD2 3.96Å; F95-L156 HydrophobicContact CZ-CD2 4.46Å; V105-L156 HydrophobicContact CG1-CD2 3.82Å; V105-L156 HydrophobicContact CG1-CG 3.76Å; V105-L156 HydrophobicContact CG2-CD2 4.09Å; V105-L156 HydrophobicContact CG2-CG 4.32Å; A150-L156 HydrophobicContact CB-CB 3.98Å; A150-L156 HydrophobicContact CB-CD1 4.11Å; S152-L156 PolarHBondContact O-N 3.47Å; S152-L156 VanDerWaalsContact O-N 3.12Å; L153-L156 PolarHBondContact O-N 2.83Å; L154-L156 VanDerWaalsContact C-N 3.29Å; L154-L156 PolarHBondContact O-N 3.29Å; L156-L158 VanDerWaalsContact C-N 3.32Å; L156-L158 PolarHBondContact O-N 3.25Å; L156-Y160 WeakPolarHBondContact O-CA 3.46Å; L156-Y160 WeakPolarHBondContact O-CB 3.49Å; L156-Y160 PolarHBondContact O-N 3.4Å; L156-G161 PolarHBondContact O-N 3.13Å; L156-W218 HydrophobicContact CD1-CZ3 4.24Å; L156-L222 HydrophobicContact CD1-CD1 4.29Å
157	M	96.7	Very high	96.7	Very high	33 Å²	33	41.6 Å²	41.6	16%	0.163	22%	0.215	C	C	.	.	I	π-helix	trans	-62.4	-37.6	173.8	-74.4	-178.3	-109.3	0	0	112.3	W104 V105 L153 L154 F155 G161 V162	W104-M157 HydrophobicContact CB-SD 3.7Å; V105-M157 HydrophobicContact CG2-CG 3.9Å; L153-M157 HydrophobicContact CB-CE 3.87Å; L153-M157 WeakPolarHBondContact O-CE 2.93Å; L153-M157 VanDerWaalsContact O-CG 3.32Å; L153-M157 WeakPolarHBondContact O-CG 3.42Å; L153-M157 PolarHBondContact O-N 3.42Å; L154-M157 PolarHBondContact O-N 3.44Å; F155-M157 PolarHBondContact O-N 2.65Å; M157-G161 CarbonylContact O-C 3.41Å; M157-G161 WeakPolarHBondContact O-CA 3.25Å; M157-G161 PolarHBondContact O-N 3.32Å; M157-V162 PolarHBondContact O-N 3.08Å
158	L	97.9	Very high	96.8	Very high	99 Å²	99	41.6 Å²	41.6	52%	0.518	22%	0.215	S	C	.	.	I	π-helix	trans	-73.2	-41.7	178.7	-67.9	174.1	0	0	0	112.3	L154 F155 L156 V162 L163	L154-L158 HydrophobicContact CD1-CD1 4.45Å; L154-L158 HydrophobicContact CD1-CG 4.4Å; L154-L158 HydrophobicContact CG-CD1 4.31Å; L154-L158 WeakPolarHBondContact O-CG 3.2Å; L154-L158 PolarHBondContact O-N 2.94Å; F155-L158 PolarHBondContact O-N 3.27Å; F155-L158 VanDerWaalsContact O-N 3.16Å; L156-L158 VanDerWaalsContact C-N 3.32Å; L156-L158 PolarHBondContact O-N 3.25Å; L158-V162 HydrophobicContact CD2-CG2 4.37Å; L158-V162 WeakPolarHBondContact O-CB 3.29Å; L158-V162 PolarHBondContact O-N 3.14Å; L158-L163 PolarHBondContact O-N 3.33Å
159	T	98	Very high	96.8	Very high	15 Å²	15	41.1 Å²	41.1	9%	0.092	21%	0.212	C	C	.	.	I	π-helix	trans	-83.9	-58.6	-178.3	56.1	0	0	0	0	112.2	G143 S146 S147 F155 L163 G164	G143-T159 CarbonylContact O-C 3.25Å; S146-T159 WeakPolarHBondContact OG-CB 3.33Å; S147-T159 VanDerWaalsContact CA-OG1 3.29Å; S147-T159 WeakPolarHBondContact CA-OG1 3.21Å; S147-T159 WeakPolarHBondContact CB-OG1 3.46Å; S147-T159 VanDerWaalsContact OG-CB 3.26Å; S147-T159 WeakPolarHBondContact OG-CB 3.49Å; S147-T159 PolarHBondContact OG-OG1 3.03Å; F155-T159 HydrophobicContact CD1-CG2 4.01Å; F155-T159 HydrophobicContact CE1-CG2 3.58Å; F155-T159 HydrophobicContact CE2-CG2 4.41Å; F155-T159 HydrophobicContact CZ-CG2 3.81Å; F155-T159 PolarHBondContact O-N 3.24Å; F155-T159 PolarHBondContact O-OG1 2.78Å; T159-L163 WeakPolarHBondContact O-CB 3.3Å; T159-L163 PolarHBondContact O-N 2.92Å; T159-G164 PolarHBondContact O-N 3.41Å
160	Y	97.4	Very high	96.9	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.008	19%	0.187	C	C	.	.	I	π-helix	trans	-71.7	-49.3	-177.6	177.3	-96.3	0	0	0	109.3	F84 V105 L109 F144 S147 L156 G164 L222	F84-Y160 AromaticContact CD2-CE1 3.76Å; F84-Y160 HydrophobicContact CD2-CE1 3.76Å; F84-Y160 AromaticContact CD2-CZ 3.99Å; F84-Y160 AromaticContact CE2-CE1 3.81Å; F84-Y160 HydrophobicContact CE2-CE1 3.81Å; V105-Y160 HydrophobicContact CG1-CD1 3.57Å; V105-Y160 HydrophobicContact CG1-CE1 4.07Å; V105-Y160 HydrophobicContact CG1-CG 4.39Å; L109-Y160 HydrophobicContact CB-CD1 4.26Å; L109-Y160 HydrophobicContact CB-CE1 4Å; L109-Y160 HydrophobicContact CD1-CE1 4.42Å; L109-Y160 WeakPolarHBondContact CD1-O 3.49Å; L109-Y160 HydrophobicContact CD2-CE1 3.76Å; L109-Y160 HydrophobicContact CG-CE1 4.28Å; F144-Y160 HydrophobicContact CD1-CD2 4.27Å; F144-Y160 HydrophobicContact CD1-CE2 4.05Å; F144-Y160 HydrophobicContact CD2-CD2 4.21Å; F144-Y160 HydrophobicContact CD2-CE2 4.49Å; F144-Y160 HydrophobicContact CE1-CD2 4.04Å; F144-Y160 AromaticContact CE1-CE2 3.44Å; F144-Y160 HydrophobicContact CE1-CE2 3.44Å; F144-Y160 VanDerWaalsContact CE1-CE2 3.44Å; F144-Y160 AromaticContact CE2-CD2 3.96Å; F144-Y160 HydrophobicContact CE2-CD2 3.96Å; F144-Y160 AromaticContact CE2-CE2 3.95Å; F144-Y160 HydrophobicContact CE2-CE2 3.95Å; F144-Y160 HydrophobicContact CG-CD2 4.34Å; F144-Y160 AromaticContact CZ-CD2 3.87Å; F144-Y160 HydrophobicContact CZ-CD2 3.87Å; F144-Y160 AromaticContact CZ-CE2 3.37Å; F144-Y160 HydrophobicContact CZ-CE2 3.37Å; S147-Y160 VanDerWaalsContact OG-CA 3.22Å; S147-Y160 WeakPolarHBondContact OG-CA 3.36Å; S147-Y160 VanDerWaalsContact OG-CB 3.25Å; S147-Y160 WeakPolarHBondContact OG-CB 3.25Å; S147-Y160 PolarHBondContact OG-N 3.47Å; L156-Y160 WeakPolarHBondContact O-CA 3.46Å; L156-Y160 WeakPolarHBondContact O-CB 3.49Å; L156-Y160 PolarHBondContact O-N 3.4Å; Y160-G164 VanDerWaalsContact O-CA 3.28Å; Y160-G164 WeakPolarHBondContact O-CA 3.45Å; Y160-G164 PolarHBondContact O-N 2.9Å; Y160-L222 HydrophobicContact CD2-CD2 3.64Å; Y160-L222 HydrophobicContact CE2-CD2 3.47Å; Y160-L222 VanDerWaalsContact CE2-CD2 3.47Å
161	G	97.2	Very high	97.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.187	C	C	.	.	I	π-helix	trans	-68	-68.1	-179.1	0	0	0	0	0	112.6	L109 L156 M157 G165	L109-G161 WeakPolarHBondContact CA-O 3.48Å; L156-G161 PolarHBondContact O-N 3.13Å; M157-G161 CarbonylContact O-C 3.41Å; M157-G161 WeakPolarHBondContact O-CA 3.25Å; M157-G161 PolarHBondContact O-N 3.32Å; G161-G165 VanDerWaalsContact O-CA 3.25Å; G161-G165 WeakPolarHBondContact O-CA 3.49Å; G161-G165 PolarHBondContact O-N 3.29Å
162	V	97.9	Very high	97.4	Very high	52 Å²	52	28.5 Å²	28.5	32%	0.315	15%	0.151	S	C	.	.	I	π-helix	trans	-73.5	-57.7	-171.6	-177.6	0	0	0	0	111.8	V108 V112 M157 L158 G165 I166	V108-V162 HydrophobicContact CG1-CG2 3.71Å; V112-V162 HydrophobicContact CG1-CG1 4.33Å; V112-V162 WeakPolarHBondContact CG1-O 3.17Å; V112-V162 HydrophobicContact CG2-CG2 4.25Å; M157-V162 PolarHBondContact O-N 3.08Å; L158-V162 HydrophobicContact CD2-CG2 4.37Å; L158-V162 WeakPolarHBondContact O-CB 3.29Å; L158-V162 PolarHBondContact O-N 3.14Å; V162-G165 PolarHBondContact O-N 2.84Å; V162-I166 HydrophobicContact CG1-CD1 4.1Å; V162-I166 VanDerWaalsContact O-CG1 3.31Å; V162-I166 WeakPolarHBondContact O-CG1 3.43Å; V162-I166 PolarHBondContact O-N 2.94Å
163	L	98.1	Very high	97.4	Very high	63 Å²	63	26.1 Å²	26.1	33%	0.33	14%	0.135	S	C	.	.	I	π-helix	trans	-67.9	-44.3	-176.1	-175.3	62	0	0	0	111.7	I139 L158 T159 G165 I166 G167	I139-L163 HydrophobicContact CG2-CD1 3.64Å; I139-L163 HydrophobicContact CG2-CG 4.34Å; L158-L163 PolarHBondContact O-N 3.33Å; T159-L163 WeakPolarHBondContact O-CB 3.3Å; T159-L163 PolarHBondContact O-N 2.92Å; L163-G165 VanDerWaalsContact C-N 3.35Å; L163-I166 PolarHBondContact O-N 3.48Å; L163-G167 PolarHBondContact O-N 2.94Å
164	G	98.3	Very high	97.4	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.5	-44.4	172.3	0	0	0	0	0	112	T159 Y160 I166 G167 L168	T159-G164 PolarHBondContact O-N 3.41Å; Y160-G164 VanDerWaalsContact O-CA 3.28Å; Y160-G164 WeakPolarHBondContact O-CA 3.45Å; Y160-G164 PolarHBondContact O-N 2.9Å; G164-I166 PolarHBondContact O-N 3.43Å; G164-G167 PolarHBondContact O-N 2.99Å; G164-L168 WeakPolarHBondContact O-CG 3.47Å; G164-L168 PolarHBondContact O-N 3.43Å
165	G	98.2	Very high	97.4	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-60.4	-46.5	178.4	0	0	0	0	0	112	L109 Y113 G161 V162 L163 G167 L168 G169	L109-G165 WeakPolarHBondContact O-CA 3.37Å; Y113-G165 WeakPolarHBondContact CA-O 3.36Å; Y113-G165 WeakPolarHBondContact CB-O 3.13Å; G161-G165 VanDerWaalsContact O-CA 3.25Å; G161-G165 WeakPolarHBondContact O-CA 3.49Å; G161-G165 PolarHBondContact O-N 3.29Å; V162-G165 PolarHBondContact O-N 2.84Å; L163-G165 VanDerWaalsContact C-N 3.35Å; G165-G167 VanDerWaalsContact C-N 3.28Å; G165-G167 PolarHBondContact O-N 3.19Å; G165-L168 PolarHBondContact O-N 3.21Å; G165-G169 PolarHBondContact O-N 3.21Å
166	I	98.2	Very high	97.2	Very high	55 Å²	55	16.5 Å²	16.5	28%	0.282	9%	0.088	S	C	.	.	H	α-helix	trans	-56.5	-45.9	176.7	-68	165.4	0	0	0	110.9	V112 T116 I139 V162 L163 G164 G169 F170	V112-I166 HydrophobicContact CG1-CG1 3.7Å; T116-I166 HydrophobicContact CG2-CB 4.25Å; T116-I166 HydrophobicContact CG2-CG1 4.13Å; T116-I166 HydrophobicContact CG2-CG2 4.3Å; I139-I166 HydrophobicContact CG2-CB 4.44Å; I139-I166 HydrophobicContact CG2-CG2 4.22Å; V162-I166 HydrophobicContact CG1-CD1 4.1Å; V162-I166 VanDerWaalsContact O-CG1 3.31Å; V162-I166 WeakPolarHBondContact O-CG1 3.43Å; V162-I166 PolarHBondContact O-N 2.94Å; L163-I166 PolarHBondContact O-N 3.48Å; G164-I166 PolarHBondContact O-N 3.43Å; I166-G169 PolarHBondContact O-N 2.89Å; I166-F170 PolarHBondContact O-N 2.92Å; I166-F170 VanDerWaalsContact O-N 3.17Å
167	G	98.4	Very high	97	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-61.2	-49.8	178.4	0	0	0	0	0	113.2	G136 L163 G164 G165 G169 F170 I171	G136-G167 CarbonylContact C-O 3.56Å; G136-G167 VanDerWaalsContact CA-O 3.29Å; G136-G167 WeakPolarHBondContact CA-O 3.05Å; G136-G167 CarbonylContact O-C 3.5Å; G136-G167 WeakPolarHBondContact O-CA 2.95Å; L163-G167 PolarHBondContact O-N 2.94Å; G164-G167 PolarHBondContact O-N 2.99Å; G165-G167 VanDerWaalsContact C-N 3.28Å; G165-G167 PolarHBondContact O-N 3.19Å; G167-G169 VanDerWaalsContact C-N 3.25Å; G167-G169 PolarHBondContact O-N 3.31Å; G167-F170 PolarHBondContact O-N 3.37Å; G167-I171 WeakPolarHBondContact O-CG1 3.43Å; G167-I171 PolarHBondContact O-N 3.25Å
168	L	98.5	Very high	96.8	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-62.2	-33.4	177.7	-64.2	-170.3	0	0	0	112.2	V77 L109 F144 G164 G165 I171 Y172 V229	V77-L168 HydrophobicContact CG1-CB 4.02Å; V77-L168 HydrophobicContact CG1-CD1 4.38Å; V77-L168 HydrophobicContact CG2-CB 4.41Å; V77-L168 HydrophobicContact CG2-CD2 4.08Å; L109-L168 HydrophobicContact CD1-CD1 3.85Å; L109-L168 HydrophobicContact CD2-CD1 4.06Å; L109-L168 HydrophobicContact CG-CD1 4.14Å; F144-L168 HydrophobicContact CZ-CD1 4.44Å; G164-L168 WeakPolarHBondContact O-CG 3.47Å; G164-L168 PolarHBondContact O-N 3.43Å; G165-L168 PolarHBondContact O-N 3.21Å; L168-I171 HydrophobicContact CD2-CD1 4.27Å; L168-I171 PolarHBondContact O-N 3.24Å; L168-Y172 VanDerWaalsContact O-CB 3.31Å; L168-Y172 WeakPolarHBondContact O-CB 3.41Å; L168-Y172 PolarHBondContact O-N 3.46Å; L168-V229 HydrophobicContact CD2-CG1 4.04Å; L168-V229 HydrophobicContact CD2-CG2 3.95Å
169	G	97.6	Very high	96.6	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-66.8	-41.8	179.2	0	0	0	0	0	111.9	Y113 T116 G165 I166 G167 I171 Y172 I173	Y113-G169 WeakPolarHBondContact O-CA 3.3Å; T116-G169 WeakPolarHBondContact OG1-CA 3.35Å; G165-G169 PolarHBondContact O-N 3.21Å; I166-G169 PolarHBondContact O-N 2.89Å; G167-G169 VanDerWaalsContact C-N 3.25Å; G167-G169 PolarHBondContact O-N 3.31Å; G169-I171 PolarHBondContact O-N 3.29Å; G169-Y172 PolarHBondContact O-N 3.5Å; G169-I173 VanDerWaalsContact O-CG1 3.3Å; G169-I173 WeakPolarHBondContact O-CG1 3.39Å; G169-I173 PolarHBondContact O-N 3.28Å; G169-I173 VanDerWaalsContact O-N 3.08Å
170	F	97.9	Very high	96.3	Very high	17 Å²	17	10.8 Å²	10.8	8%	0.075	6%	0.056	C	C	.	.	H	α-helix	trans	-70.1	-17.7	175.6	-77	9.5	0	0	0	113.4	T116 I119 A120 M123 V132 C133 G136 I139 I166 G167 P174	T116-F170 HydrophobicContact CG2-CD1 4.47Å; T116-F170 HydrophobicContact CG2-CE1 4.3Å; I119-F170 HydrophobicContact CB-CE1 4.48Å; I119-F170 HydrophobicContact CG2-CE1 4.16Å; I119-F170 HydrophobicContact CG2-CZ 3.92Å; A120-F170 HydrophobicContact CB-CD1 3.67Å; A120-F170 HydrophobicContact CB-CE1 3.85Å; M123-F170 HydrophobicContact CE-CE2 4.1Å; M123-F170 HydrophobicContact SD-CE1 4.32Å; M123-F170 HydrophobicContact SD-CE2 3.67Å; M123-F170 HydrophobicContact SD-CZ 3.51Å; M123-F170 VanDerWaalsContact SD-CZ 3.51Å; V132-F170 HydrophobicContact CG1-CB 4Å; V132-F170 HydrophobicContact CG1-CD1 4.46Å; V132-F170 HydrophobicContact CG1-CD2 4.41Å; V132-F170 HydrophobicContact CG1-CG 4.06Å; C133-F170 WeakPolarHBondContact CA-O 3.49Å; G136-F170 VanDerWaalsContact CA-CB 3.49Å; I139-F170 HydrophobicContact CD1-CD2 4.33Å; I139-F170 HydrophobicContact CD1-CE2 4.5Å; I166-F170 PolarHBondContact O-N 2.92Å; I166-F170 VanDerWaalsContact O-N 3.17Å; G167-F170 PolarHBondContact O-N 3.37Å; F170-P174 WeakPolarHBondContact O-CD 3.39Å; F170-P174 WeakPolarHBondContact O-CG 3.2Å
171	I	98.4	Very high	96	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-83.2	-47.9	168.7	-65	159.6	0	0	0	110.7	A73 V77 A137 G167 L168 G169 P174 A175 V229 C232	A73-I171 HydrophobicContact CB-CG2 3.8Å; V77-I171 HydrophobicContact CG2-CB 3.97Å; V77-I171 HydrophobicContact CG2-CG2 3.62Å; A137-I171 HydrophobicContact CB-CD1 4.16Å; A137-I171 HydrophobicContact CB-CG1 4.39Å; G167-I171 WeakPolarHBondContact O-CG1 3.43Å; G167-I171 PolarHBondContact O-N 3.25Å; L168-I171 HydrophobicContact CD2-CD1 4.27Å; L168-I171 PolarHBondContact O-N 3.24Å; G169-I171 PolarHBondContact O-N 3.29Å; I171-P174 WeakPolarHBondContact O-CD 3.26Å; I171-P174 WeakPolarHBondContact O-CG 3.37Å; I171-A175 WeakPolarHBondContact O-CB 3.33Å; I171-A175 PolarHBondContact O-N 3.15Å; I171-V229 HydrophobicContact CD1-CG1 4.16Å; I171-C232 HydrophobicContact CD1-CB 3.72Å; I171-C232 HydrophobicContact CG1-CB 4.1Å; I171-C232 HydrophobicContact CG2-CB 3.94Å
172	Y	97.5	Very high	95.8	Very high	2 Å²	2	13.8 Å²	13.8	1%	0.008	7%	0.068	C	C	.	.	H	α-helix	trans	-63.9	-52.1	-172	175.9	-106	0	0	0	113.1	N74 Y113 L168 G169 A175 C176 F594 V598	N74-Y172 WeakPolarHBondContact OD1-CD2 3.31Å; Y113-Y172 HydrophobicContact CE2-CD1 4.39Å; L168-Y172 VanDerWaalsContact O-CB 3.31Å; L168-Y172 WeakPolarHBondContact O-CB 3.41Å; L168-Y172 PolarHBondContact O-N 3.46Å; G169-Y172 PolarHBondContact O-N 3.5Å; Y172-A175 PolarHBondContact O-N 3.11Å; Y172-C176 WeakPolarHBondContact CE2-SG 3.29Å; Y172-C176 PolarHBondContact O-N 3.01Å; Y172-F594 HydrophobicContact CE1-CE1 4.03Å; Y172-F594 HydrophobicContact CE1-CZ 4.06Å; Y172-V598 HydrophobicContact CE1-CG2 4.43Å
173	I	94.9	Very high	95.6	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-57.2	-53.5	-174.8	-58.4	-67.2	0	0	0	111.8	A120 I124 G169 A175 C176 V177 F594 V598	A120-I173 HydrophobicContact CB-CB 3.93Å; A120-I173 HydrophobicContact CB-CG1 3.83Å; A120-I173 HydrophobicContact CB-CG2 4.14Å; I124-I173 HydrophobicContact CD1-CB 4.38Å; I124-I173 HydrophobicContact CD1-CG2 3.68Å; G169-I173 VanDerWaalsContact O-CG1 3.3Å; G169-I173 WeakPolarHBondContact O-CG1 3.39Å; G169-I173 PolarHBondContact O-N 3.28Å; G169-I173 VanDerWaalsContact O-N 3.08Å; I173-A175 PolarHBondContact O-N 3.06Å; I173-C176 PolarHBondContact O-N 2.95Å; I173-V177 WeakPolarHBondContact O-CG2 3.34Å; I173-V177 PolarHBondContact O-N 3.42Å; I173-V177 VanDerWaalsContact O-N 3.09Å; I173-F594 HydrophobicContact CD1-CD1 3.95Å; I173-F594 HydrophobicContact CD1-CE1 3.76Å; I173-F594 HydrophobicContact CG2-CD1 4.31Å; I173-V598 HydrophobicContact CD1-CB 4.05Å; I173-V598 HydrophobicContact CD1-CG1 3.76Å; I173-V598 HydrophobicContact CD1-CG2 4.15Å
174	P	95.1	Very high	95.2	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-63.3	-39.7	178.1	23.3	-30.6	0	0	0	112.4	I124 A129 C133 F170 I171 C176 V177 Y178 L239	I124-P174 HydrophobicContact CD1-CB 3.88Å; I124-P174 HydrophobicContact CD1-CG 4.41Å; I124-P174 HydrophobicContact CG1-CB 4.28Å; A129-P174 HydrophobicContact CB-CB 3.75Å; C133-P174 HydrophobicContact CB-CG 3.91Å; F170-P174 WeakPolarHBondContact O-CD 3.39Å; F170-P174 WeakPolarHBondContact O-CG 3.2Å; I171-P174 WeakPolarHBondContact O-CD 3.26Å; I171-P174 WeakPolarHBondContact O-CG 3.37Å; P174-C176 VanDerWaalsContact C-N 3.28Å; P174-C176 PolarHBondContact O-N 2.91Å; P174-V177 PolarHBondContact O-N 3.26Å; P174-Y178 VanDerWaalsContact O-CB 3.3Å; P174-Y178 WeakPolarHBondContact O-CB 3.45Å; P174-Y178 PolarHBondContact O-N 3.18Å; P174-Y178 VanDerWaalsContact O-N 3.14Å; P174-L239 HydrophobicContact CB-CD1 4.06Å
175	A	95.6	Very high	95	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.008	10%	0.098	C	C	.	.	H	α-helix	trans	-59.7	-37.3	177.1	0	0	0	0	0	112.6	S70 A73 I171 Y172 I173	S70-A175 WeakPolarHBondContact CB-O 3.33Å; S70-A175 PolarHBondContact OG-O 3.44Å; A73-A175 HydrophobicContact CB-CB 3.91Å; I171-A175 WeakPolarHBondContact O-CB 3.33Å; I171-A175 PolarHBondContact O-N 3.15Å; Y172-A175 PolarHBondContact O-N 3.11Å; I173-A175 PolarHBondContact O-N 3.06Å
176	C	92.6	Very high	94.7	Very high	4 Å²	4	26.8 Å²	26.8	3%	0.027	12%	0.119	C	C	.	.	H	α-helix	trans	-75.9	-47	178.4	-75.7	0	0	0	0	113.5	Y172 I173 P174 F594	Y172-C176 WeakPolarHBondContact CE2-SG 3.29Å; Y172-C176 PolarHBondContact O-N 3.01Å; I173-C176 PolarHBondContact O-N 2.95Å; P174-C176 VanDerWaalsContact C-N 3.28Å; P174-C176 PolarHBondContact O-N 2.91Å; C176-F594 HydrophobicContact CB-CE1 3.84Å; C176-F594 HydrophobicContact CB-CE2 4.26Å; C176-F594 HydrophobicContact CB-CZ 3.5Å
177	V	92.3	Very high	94.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-78.9	-34.8	-169.9	-58	0	0	0	0	112.8	I124 I173 P174 V179 S180 Y181 L590 F594	I124-V177 HydrophobicContact CD1-CG2 4.36Å; I173-V177 WeakPolarHBondContact O-CG2 3.34Å; I173-V177 PolarHBondContact O-N 3.42Å; I173-V177 VanDerWaalsContact O-N 3.09Å; P174-V177 PolarHBondContact O-N 3.26Å; V177-V179 VanDerWaalsContact C-N 3.28Å; V177-V179 PolarHBondContact O-N 3.08Å; V177-S180 WeakPolarHBondContact O-CB 3.45Å; V177-S180 PolarHBondContact O-N 2.83Å; V177-S180 VanDerWaalsContact O-N 3.11Å; V177-Y181 WeakPolarHBondContact O-CD2 3.48Å; V177-L590 HydrophobicContact CB-CD2 4.41Å; V177-F594 HydrophobicContact CG1-CB 3.77Å; V177-F594 HydrophobicContact CG1-CD1 3.52Å; V177-F594 HydrophobicContact CG1-CD2 4.22Å; V177-F594 HydrophobicContact CG1-CE1 4.12Å; V177-F594 HydrophobicContact CG1-CG 3.58Å
178	Y	92	Very high	94.6	Very high	30 Å²	30	26 Å²	26	12%	0.118	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-26.1	-166.8	-131.3	-127.4	0	0	0	113.8	A129 P174 S180 Y181 Y182 L239 W240 P241	A129-Y178 HydrophobicContact CB-CD1 4.14Å; A129-Y178 HydrophobicContact CB-CD2 3.7Å; A129-Y178 HydrophobicContact CB-CE1 4.05Å; A129-Y178 HydrophobicContact CB-CE2 3.64Å; A129-Y178 HydrophobicContact CB-CG 3.96Å; P174-Y178 VanDerWaalsContact O-CB 3.3Å; P174-Y178 WeakPolarHBondContact O-CB 3.45Å; P174-Y178 PolarHBondContact O-N 3.18Å; P174-Y178 VanDerWaalsContact O-N 3.14Å; Y178-S180 PolarHBondContact O-N 3.48Å; Y178-Y181 HydrophobicContact CD2-CD2 4.19Å; Y178-Y181 PolarHBondContact O-N 3Å; Y178-Y182 HydrophobicContact CD1-CE2 4.31Å; Y178-Y182 HydrophobicContact CE1-CE2 4.46Å; Y178-L239 HydrophobicContact CD1-CB 4.48Å; Y178-W240 WeakPolarHBondContact CE1-O 3.48Å; Y178-P241 VanDerWaalsContact OH-CA 3.3Å; Y178-P241 WeakPolarHBondContact OH-CA 3.15Å; Y178-P241 WeakPolarHBondContact OH-CB 3.48Å
179	V	94.6	Very high	94.5	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.006	12%	0.122	C	C	.	.	H	α-helix	trans	-58.3	-39.1	174.1	179.6	0	0	0	0	111	I66 V67 S70 V177 Y181 Y182 F183 A190 A194	I66-V179 HydrophobicContact CG2-CG2 4.06Å; V67-V179 HydrophobicContact CG2-CG1 3.8Å; S70-V179 WeakPolarHBondContact OG-CG2 3.28Å; V177-V179 VanDerWaalsContact C-N 3.28Å; V177-V179 PolarHBondContact O-N 3.08Å; V179-Y181 PolarHBondContact O-N 3.33Å; V179-Y182 PolarHBondContact O-N 3.14Å; V179-Y182 VanDerWaalsContact O-N 3.11Å; V179-F183 HydrophobicContact CG1-CD2 4.21Å; V179-F183 WeakPolarHBondContact O-CD2 3.33Å; V179-F183 PolarHBondContact O-N 2.64Å; V179-A190 HydrophobicContact CG1-CB 3.9Å; V179-A194 HydrophobicContact CB-CB 4.44Å; V179-A194 HydrophobicContact CG1-CB 4.27Å; V179-A194 HydrophobicContact CG2-CB 3.58Å
180	S	92.4	Very high	94.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-67.8	-19.9	-177.8	-68.7	0	0	0	0	114	V177 Y178 R187 L590	V177-S180 WeakPolarHBondContact O-CB 3.45Å; V177-S180 PolarHBondContact O-N 2.83Å; V177-S180 VanDerWaalsContact O-N 3.11Å; Y178-S180 PolarHBondContact O-N 3.48Å; S180-R187 PolarHBondContact O-NE 3.45Å; S180-L590 VanDerWaalsContact CB-CD2 3.43Å
181	Y	90.8	Very high	94.5	Very high	53 Å²	53	26.9 Å²	26.9	21%	0.208	12%	0.118	C	C	.	.	H	α-helix	trans	-79.3	-24.7	175.2	-69.8	-87.6	0	0	0	112.5	V177 Y178 V179 L242 L587 L590 T591	V177-Y181 WeakPolarHBondContact O-CD2 3.48Å; Y178-Y181 HydrophobicContact CD2-CD2 4.19Å; Y178-Y181 PolarHBondContact O-N 3Å; V179-Y181 PolarHBondContact O-N 3.33Å; Y181-L242 VanDerWaalsContact C-CD1 3.45Å; Y181-L242 WeakPolarHBondContact O-CD1 3.4Å; Y181-L587 HydrophobicContact CD1-CD1 4.12Å; Y181-L587 HydrophobicContact CD1-CD2 4.24Å; Y181-L587 HydrophobicContact CD1-CG 4.08Å; Y181-L587 HydrophobicContact CE1-CD1 4.15Å; Y181-L587 HydrophobicContact CE1-CG 4.02Å; Y181-L587 HydrophobicContact CG-CD1 4.36Å; Y181-L587 PolarHBondContact OH-O 2.71Å; Y181-L590 HydrophobicContact CE2-CD2 4.16Å; Y181-T591 PolarHBondContact OH-OG1 2.92Å
182	Y	92.3	Very high	94.4	Very high	11 Å²	11	26.9 Å²	26.9	4%	0.043	12%	0.118	C	C	.	.	H	α-helix	trans	-88.6	-14.5	-178.9	-86.9	-95.7	0	0	0	114.1	P58 D59 Y62 G63 I66 Y178 V179 W240 L242	P58-Y182 VanDerWaalsContact CD-O 3.29Å; P58-Y182 WeakPolarHBondContact CD-O 3.35Å; P58-Y182 HydrophobicContact CG-CD1 3.69Å; P58-Y182 HydrophobicContact CG-CE1 4.36Å; D59-Y182 PolarHBondContact N-O 2.95Å; D59-Y182 VanDerWaalsContact N-O 3.08Å; Y62-Y182 HydrophobicContact CD1-CE1 4.14Å; G63-Y182 VanDerWaalsContact CA-CD1 3.42Å; I66-Y182 HydrophobicContact CB-CD2 4.43Å; I66-Y182 HydrophobicContact CD1-CE2 3.95Å; I66-Y182 HydrophobicContact CG1-CD1 4.3Å; I66-Y182 HydrophobicContact CG1-CD2 3.82Å; I66-Y182 HydrophobicContact CG1-CE1 4.12Å; I66-Y182 HydrophobicContact CG1-CE2 3.62Å; I66-Y182 HydrophobicContact CG1-CG 4.15Å; I66-Y182 HydrophobicContact CG2-CD2 4.36Å; Y178-Y182 HydrophobicContact CD1-CE2 4.31Å; Y178-Y182 HydrophobicContact CE1-CE2 4.46Å; V179-Y182 PolarHBondContact O-N 3.14Å; V179-Y182 VanDerWaalsContact O-N 3.11Å; Y182-W240 PolarHBondContact OH-O 3.21Å; Y182-L242 HydrophobicContact CD1-CD1 4.12Å; Y182-L242 HydrophobicContact CD1-CD2 3.97Å; Y182-L242 HydrophobicContact CD1-CG 4.1Å; Y182-L242 HydrophobicContact CD2-CD1 3.34Å; Y182-L242 HydrophobicContact CD2-CG 3.92Å; Y182-L242 HydrophobicContact CE1-CD1 4.21Å; Y182-L242 HydrophobicContact CE1-CD2 3.77Å; Y182-L242 HydrophobicContact CE1-CG 3.76Å; Y182-L242 HydrophobicContact CE2-CD1 3.43Å; Y182-L242 VanDerWaalsContact CE2-CD1 3.43Å; Y182-L242 HydrophobicContact CE2-CD2 4.42Å; Y182-L242 HydrophobicContact CE2-CG 3.53Å; Y182-L242 HydrophobicContact CG-CD1 3.72Å; Y182-L242 HydrophobicContact CG-CD2 4.4Å; Y182-L242 HydrophobicContact CG-CG 4.19Å; Y182-L242 VanDerWaalsContact CZ-CG 3.45Å
183	F	93.1	Very high	94.5	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.129	C	C	.	.			trans	-133	137.9	-175.3	-65.5	-91	0	0	0	111.4	D59 G63 W64 V67 V179 K186 R187 A190	D59-F183 WeakPolarHBondContact OD1-CA 3.3Å; G63-F183 WeakPolarHBondContact O-CE2 3.39Å; W64-F183 HydrophobicContact CD2-CZ 4.07Å; W64-F183 HydrophobicContact CE3-CZ 4.35Å; W64-F183 HydrophobicContact CG-CZ 4.46Å; W64-F183 HydrophobicContact CZ2-CE1 4.11Å; W64-F183 HydrophobicContact CZ2-CZ 4.39Å; V67-F183 HydrophobicContact CG2-CE2 3.69Å; V67-F183 HydrophobicContact CG2-CZ 4.15Å; V179-F183 HydrophobicContact CG1-CD2 4.21Å; V179-F183 WeakPolarHBondContact O-CD2 3.33Å; V179-F183 PolarHBondContact O-N 2.64Å; F183-K186 HydrophobicContact CD1-CB 4.29Å; F183-R187 HydrophobicContact CB-CB 4.36Å; F183-R187 PolarHBondContact O-NE 2.74Å; F183-A190 HydrophobicContact CB-CB 4.13Å; F183-A190 HydrophobicContact CD1-CB 3.84Å; F183-A190 HydrophobicContact CD2-CB 3.44Å; F183-A190 VanDerWaalsContact CD2-CB 3.44Å; F183-A190 HydrophobicContact CE1-CB 4.06Å; F183-A190 HydrophobicContact CE2-CB 3.69Å; F183-A190 HydrophobicContact CG-CB 3.53Å; F183-A190 HydrophobicContact CZ-CB 3.98Å
184	E	91.3	Very high	94.6	Very high	115 Å²	115	29 Å²	29	54%	0.537	13%	0.129	S	C	.	.	S	Bend	trans	-120.5	-57.7	173.5	-173.5	178.3	-169.7	0	0	110.1	P57 D59	P57-E184 HydrophobicContact CB-CB 4.21Å; P57-E184 HydrophobicContact CG-CB 4.14Å; D59-E184 PolarHBondContact OD1-N 2.84Å
185	K	92.5	Very high	94.7	Very high	170 Å²	170	29.1 Å²	29.1	74%	0.739	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72	-31.8	-177.2	-66.4	174	-175.6	168.8	0	113.5	D59	D59-K185 PolarHBondContact OD1-N 2.69Å; D59-K185 WeakPolarHBondContact OD2-CB 3.34Å; D59-K185 WeakPolarHBondContact OD2-CG 3.24Å; D59-K185 PolarHBondContact OD2-N 3.31Å
186	K	93.6	Very high	94.9	Very high	104 Å²	104	29.2 Å²	29.2	45%	0.452	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.6	26.8	-179.3	-60.7	178.5	-178.3	175.5	0	111.6	D59 F183 S188 L189 A190 D526	D59-K186 PolarHBondContact OD1-N 2.89Å; F183-K186 HydrophobicContact CD1-CB 4.29Å; K186-S188 VanDerWaalsContact C-N 3.3Å; K186-S188 PolarHBondContact O-N 3.31Å; K186-L189 PolarHBondContact O-N 2.93Å; K186-A190 WeakPolarHBondContact O-CB 3.29Å; K186-A190 PolarHBondContact O-N 3.33Å; K186-D526 WeakPolarHBondContact CA-OD2 3.42Å
187	R	95.5	Very high	95.1	Very high	34 Å²	34	29 Å²	29	13%	0.128	13%	0.13	C	C	.	.	H	α-helix	trans	-58.7	-43.9	-171	-175.8	-178.2	-67	143.1	-1.5	111.4	S180 F183 T191	S180-R187 PolarHBondContact O-NE 3.45Å; F183-R187 HydrophobicContact CB-CB 4.36Å; F183-R187 PolarHBondContact O-NE 2.74Å; R187-T191 VanDerWaalsContact O-CB 3.27Å; R187-T191 WeakPolarHBondContact O-CB 3.33Å; R187-T191 PolarHBondContact O-N 2.95Å; R187-T191 PolarHBondContact O-OG1 3.35Å
188	S	97.2	Very high	95.3	Very high	4 Å²	4	29 Å²	29	3%	0.028	13%	0.13	C	C	.	.	H	α-helix	trans	-73.1	-39.3	-175	-38.5	0	0	0	0	111.3	K186 G192 G522 S525 D526 V579	K186-S188 VanDerWaalsContact C-N 3.3Å; K186-S188 PolarHBondContact O-N 3.31Å; S188-G192 WeakPolarHBondContact O-CA 3.33Å; S188-G192 PolarHBondContact O-N 2.89Å; S188-G522 CarbonylContact C-O 3.35Å; S188-G522 VanDerWaalsContact CB-O 3.22Å; S188-G522 WeakPolarHBondContact CB-O 3.34Å; S188-G522 WeakPolarHBondContact O-CA 3.02Å; S188-S525 PolarHBondContact OG-OG 3.24Å; S188-D526 WeakPolarHBondContact CA-OD1 3.35Å; S188-D526 WeakPolarHBondContact CB-OD1 3.27Å; S188-D526 PolarHBondContact N-OD1 3.43Å; S188-D526 PolarHBondContact OG-OD1 2.9Å; S188-V579 WeakPolarHBondContact OG-CG1 3.48Å
189	L	97.7	Very high	95.5	Very high	34 Å²	34	27.6 Å²	27.6	18%	0.178	12%	0.124	C	C	.	.	H	α-helix	trans	-62.4	-48.7	172.2	177	60.5	0	0	0	112	K186 G192 I193 V519 G522 W523 D526	K186-L189 PolarHBondContact O-N 2.93Å; L189-G192 PolarHBondContact O-N 3.48Å; L189-I193 HydrophobicContact CD1-CD1 3.85Å; L189-I193 HydrophobicContact CD1-CG1 4.17Å; L189-I193 HydrophobicContact CG-CD1 3.97Å; L189-I193 WeakPolarHBondContact O-CG1 3.27Å; L189-I193 PolarHBondContact O-N 3.44Å; L189-V519 HydrophobicContact CD1-CG1 4.18Å; L189-G522 PolarHBondContact N-O 3.12Å; L189-W523 HydrophobicContact CD1-CB 4.14Å; L189-D526 VanDerWaalsContact CB-OD2 3.27Å; L189-D526 WeakPolarHBondContact CB-OD2 3.28Å; L189-D526 PolarHBondContact N-OD2 3.2Å
190	A	98.1	Very high	95.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.3	-44.5	-179	0	0	0	0	0	111.8	V67 V179 F183 K186 I193 A194	V67-A190 HydrophobicContact CG2-CB 4Å; V179-A190 HydrophobicContact CG1-CB 3.9Å; F183-A190 HydrophobicContact CB-CB 4.13Å; F183-A190 HydrophobicContact CD1-CB 3.84Å; F183-A190 HydrophobicContact CD2-CB 3.44Å; F183-A190 VanDerWaalsContact CD2-CB 3.44Å; F183-A190 HydrophobicContact CE1-CB 4.06Å; F183-A190 HydrophobicContact CE2-CB 3.69Å; F183-A190 HydrophobicContact CG-CB 3.53Å; F183-A190 HydrophobicContact CZ-CB 3.98Å; K186-A190 WeakPolarHBondContact O-CB 3.29Å; K186-A190 PolarHBondContact O-N 3.33Å; A190-I193 PolarHBondContact O-N 3.41Å; A190-A194 WeakPolarHBondContact O-CB 3.2Å; A190-A194 PolarHBondContact O-N 3.45Å
191	T	96.7	Very high	95.8	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.006	14%	0.139	C	C	.	.	H	α-helix	trans	-64.8	-42	174.6	-53.5	0	0	0	0	110.5	R187 I193 A194 V195 S575 A578 V579	R187-T191 VanDerWaalsContact O-CB 3.27Å; R187-T191 WeakPolarHBondContact O-CB 3.33Å; R187-T191 PolarHBondContact O-N 2.95Å; R187-T191 PolarHBondContact O-OG1 3.35Å; T191-I193 PolarHBondContact O-N 2.95Å; T191-A194 PolarHBondContact O-N 3.36Å; T191-V195 HydrophobicContact CG2-CG2 4.03Å; T191-V195 WeakPolarHBondContact O-CB 3.38Å; T191-V195 WeakPolarHBondContact O-CG2 3.49Å; T191-V195 PolarHBondContact O-N 3.45Å; T191-S575 WeakPolarHBondContact CG2-O 3.24Å; T191-A578 HydrophobicContact CG2-CB 4.34Å; T191-V579 HydrophobicContact CG2-CG2 4.34Å
192	G	97.7	Very high	96	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-55.9	-47.4	174.6	0	0	0	0	0	112.5	S188 L189 A196 R518	S188-G192 WeakPolarHBondContact O-CA 3.33Å; S188-G192 PolarHBondContact O-N 2.89Å; L189-G192 PolarHBondContact O-N 3.48Å; G192-A196 VanDerWaalsContact O-CB 3.31Å; G192-A196 WeakPolarHBondContact O-CB 3.38Å; G192-A196 PolarHBondContact O-N 2.87Å; G192-R518 WeakPolarHBondContact CA-O 3.43Å
193	I	98.4	Very high	96.1	Very high	46 Å²	46	31.8 Å²	31.8	24%	0.236	14%	0.144	C	C	.	.	H	α-helix	trans	-65	-52.1	175.3	-65.5	163.9	0	0	0	110.3	W64 V67 F71 L189 A190 T191 V195 A196 V519	W64-I193 HydrophobicContact CH2-CD1 4.13Å; W64-I193 HydrophobicContact CZ3-CD1 3.8Å; V67-I193 HydrophobicContact CG1-CB 3.96Å; V67-I193 HydrophobicContact CG1-CG2 3.53Å; F71-I193 VanDerWaalsContact CD2-O 3.31Å; F71-I193 WeakPolarHBondContact CD2-O 3.44Å; L189-I193 HydrophobicContact CD1-CD1 3.85Å; L189-I193 HydrophobicContact CD1-CG1 4.17Å; L189-I193 HydrophobicContact CG-CD1 3.97Å; L189-I193 WeakPolarHBondContact O-CG1 3.27Å; L189-I193 PolarHBondContact O-N 3.44Å; A190-I193 PolarHBondContact O-N 3.41Å; T191-I193 PolarHBondContact O-N 2.95Å; I193-V195 PolarHBondContact O-N 3.43Å; I193-A196 WeakPolarHBondContact O-CA 3.43Å; I193-A196 WeakPolarHBondContact O-CB 3.37Å; I193-A196 PolarHBondContact O-N 2.88Å; I193-V519 HydrophobicContact CG1-CG1 4.27Å; I193-V519 HydrophobicContact CG1-CG2 4.09Å
194	A	98.1	Very high	96.2	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-57.2	-37.1	-179.3	0	0	0	0	0	112.9	V67 F71 N74 V179 A190 T191	V67-A194 HydrophobicContact CG1-CB 4.19Å; F71-A194 WeakPolarHBondContact CA-O 3.4Å; F71-A194 PolarHBondContact N-O 2.91Å; N74-A194 PolarHBondContact ND2-O 3.34Å; V179-A194 HydrophobicContact CB-CB 4.44Å; V179-A194 HydrophobicContact CG1-CB 4.27Å; V179-A194 HydrophobicContact CG2-CB 3.58Å; A190-A194 WeakPolarHBondContact O-CB 3.2Å; A190-A194 PolarHBondContact O-N 3.45Å; T191-A194 PolarHBondContact O-N 3.36Å
195	V	97.1	Very high	96.5	Very high	4 Å²	4	28.7 Å²	28.7	2%	0.024	13%	0.132	C	C	.	.	H	α-helix	trans	-85	-18.6	180	-178.3	0	0	0	0	110.2	T191 I193 G197 S198 R518 I574	T191-V195 HydrophobicContact CG2-CG2 4.03Å; T191-V195 WeakPolarHBondContact O-CB 3.38Å; T191-V195 WeakPolarHBondContact O-CG2 3.49Å; T191-V195 PolarHBondContact O-N 3.45Å; I193-V195 PolarHBondContact O-N 3.43Å; V195-G197 PolarHBondContact O-N 3.42Å; V195-G197 VanDerWaalsContact O-N 3.08Å; V195-S198 PolarHBondContact O-N 2.78Å; V195-S198 VanDerWaalsContact O-N 3.1Å; V195-S198 PolarHBondContact O-OG 3.01Å; V195-R518 VanDerWaalsContact O-CD 3.22Å; V195-R518 WeakPolarHBondContact O-CD 3.27Å; V195-R518 PolarHBondContact O-NH1 2.7Å; V195-I574 HydrophobicContact CG1-CG2 4.04Å
196	A	98.3	Very high	96.5	Very high	2 Å²	2	20.6 Å²	20.6	2%	0.017	10%	0.097	C	C	.	.	H	α-helix	trans	-56.6	-23.4	171.2	0	0	0	0	0	113.4	F71 G192 I193 S198 G199 F200 T515 R518 V519	F71-A196 HydrophobicContact CD2-CB 4.46Å; F71-A196 HydrophobicContact CE2-CB 4.17Å; G192-A196 VanDerWaalsContact O-CB 3.31Å; G192-A196 WeakPolarHBondContact O-CB 3.38Å; G192-A196 PolarHBondContact O-N 2.87Å; I193-A196 WeakPolarHBondContact O-CA 3.43Å; I193-A196 WeakPolarHBondContact O-CB 3.37Å; I193-A196 PolarHBondContact O-N 2.88Å; A196-S198 PolarHBondContact O-N 2.95Å; A196-S198 VanDerWaalsContact O-N 3.15Å; A196-G199 PolarHBondContact O-N 3.47Å; A196-F200 PolarHBondContact O-N 3.32Å; A196-F200 VanDerWaalsContact O-N 3.11Å; A196-T515 HydrophobicContact CB-CG2 3.94Å; A196-R518 HydrophobicContact CB-CB 4.09Å; A196-V519 HydrophobicContact CB-CG2 3.97Å
197	G	97.9	Very high	96.5	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-48.2	-38.7	171.2	0	0	0	0	0	113.1	F71 T75 V195 G199 F200 G201	F71-G197 VanDerWaalsContact CD2-N 3.27Å; F71-G197 VanDerWaalsContact CE2-N 3.34Å; F71-G197 WeakPolarHBondContact O-CA 3.33Å; T75-G197 WeakPolarHBondContact CA-O 3.41Å; T75-G197 VanDerWaalsContact OG1-CA 3.29Å; T75-G197 WeakPolarHBondContact OG1-CA 3.09Å; T75-G197 PolarHBondContact OG1-O 3.19Å; T75-G197 VanDerWaalsContact OG1-O 3.11Å; V195-G197 PolarHBondContact O-N 3.42Å; V195-G197 VanDerWaalsContact O-N 3.08Å; G197-G199 PolarHBondContact O-N 2.87Å; G197-F200 CarbonylContact O-C 3.41Å; G197-F200 PolarHBondContact O-N 3.34Å; G197-G201 PolarHBondContact O-N 3.44Å
198	S	96.1	Very high	96.4	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-64.2	-38.6	178.3	-47.6	0	0	0	0	114.1	D78 V195 A196 G201 T202 R518	D78-S198 VanDerWaalsContact CB-CB 3.43Å; D78-S198 VanDerWaalsContact CG-OG 3.3Å; D78-S198 WeakPolarHBondContact OD2-CB 3.38Å; D78-S198 PolarHBondContact OD2-OG 2.94Å; V195-S198 PolarHBondContact O-N 2.78Å; V195-S198 VanDerWaalsContact O-N 3.1Å; V195-S198 PolarHBondContact O-OG 3.01Å; A196-S198 PolarHBondContact O-N 2.95Å; A196-S198 VanDerWaalsContact O-N 3.15Å; S198-G201 PolarHBondContact O-N 3.44Å; S198-T202 PolarHBondContact O-N 3.3Å; S198-T202 PolarHBondContact O-OG1 3.28Å; S198-R518 PolarHBondContact OG-NH1 3.46Å
199	G	95.3	Very high	96.3	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-67.5	-44.6	176.3	0	0	0	0	0	110.2	A196 G197 G201 T202 F203 G511 T515	A196-G199 PolarHBondContact O-N 3.47Å; G197-G199 PolarHBondContact O-N 2.87Å; G199-G201 VanDerWaalsContact C-N 3.29Å; G199-G201 PolarHBondContact O-N 3.03Å; G199-T202 WeakPolarHBondContact O-CB 3.3Å; G199-T202 PolarHBondContact O-N 3.25Å; G199-F203 PolarHBondContact O-N 2.84Å; G199-G511 CarbonylContact C-O 3.48Å; G199-G511 VanDerWaalsContact C-O 3.24Å; G199-G511 WeakPolarHBondContact CA-O 3.02Å; G199-G511 CarbonylContact O-C 3.6Å; G199-G511 VanDerWaalsContact O-C 3.25Å; G199-G511 WeakPolarHBondContact O-CA 3.43Å; G199-T515 WeakPolarHBondContact CA-OG1 3.19Å
200	F	97.5	Very high	96.1	Very high	75 Å²	75	18.8 Å²	18.8	33%	0.329	10%	0.099	S	C	.	.	H	α-helix	trans	-61.4	-41.1	175.6	-178.4	-103.5	0	0	0	111.2	F71 T75 A196 G197 F203 V204 T515	F71-F200 HydrophobicContact CE1-CB 4.34Å; F71-F200 AromaticContact CE1-CD1 3.73Å; F71-F200 HydrophobicContact CE1-CD1 3.73Å; F71-F200 HydrophobicContact CE1-CE1 4.31Å; F71-F200 HydrophobicContact CE1-CG 4.13Å; F71-F200 HydrophobicContact CE2-CB 4.33Å; F71-F200 HydrophobicContact CZ-CB 3.62Å; F71-F200 AromaticContact CZ-CD1 3.8Å; F71-F200 HydrophobicContact CZ-CD1 3.8Å; F71-F200 HydrophobicContact CZ-CD2 4.43Å; F71-F200 AromaticContact CZ-CG 3.69Å; F71-F200 HydrophobicContact CZ-CG 3.69Å; T75-F200 HydrophobicContact CG2-CD1 3.65Å; T75-F200 HydrophobicContact CG2-CE1 4.16Å; A196-F200 PolarHBondContact O-N 3.32Å; A196-F200 VanDerWaalsContact O-N 3.11Å; G197-F200 CarbonylContact O-C 3.41Å; G197-F200 PolarHBondContact O-N 3.34Å; F200-F203 HydrophobicContact CD2-CD1 4.15Å; F200-F203 HydrophobicContact CE2-CD1 4.29Å; F200-F203 HydrophobicContact CE2-CE1 4.4Å; F200-F203 WeakPolarHBondContact O-CB 3.37Å; F200-F203 PolarHBondContact O-N 2.8Å; F200-V204 HydrophobicContact CD1-CG2 4.24Å; F200-V204 HydrophobicContact CD2-CG2 4.35Å; F200-V204 HydrophobicContact CE1-CG2 3.81Å; F200-V204 HydrophobicContact CE2-CG2 3.93Å; F200-V204 HydrophobicContact CG-CG2 4.49Å; F200-V204 HydrophobicContact CZ-CG2 3.64Å; F200-V204 WeakPolarHBondContact O-CG2 3.35Å; F200-V204 PolarHBondContact O-N 3.26Å; F200-T515 PolarHBondContact N-OG1 2.94Å
201	G	97.5	Very high	95.9	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-58.5	-49	173	0	0	0	0	0	111.9	T75 G79 G197 S198 G199 F203 V204 F205	T75-G201 WeakPolarHBondContact O-CA 3.49Å; G79-G201 VanDerWaalsContact CA-C 3.48Å; G197-G201 PolarHBondContact O-N 3.44Å; S198-G201 PolarHBondContact O-N 3.44Å; G199-G201 VanDerWaalsContact C-N 3.29Å; G199-G201 PolarHBondContact O-N 3.03Å; G201-F203 VanDerWaalsContact C-N 3.29Å; G201-F203 PolarHBondContact O-N 3.19Å; G201-V204 PolarHBondContact O-N 3.1Å; G201-F205 WeakPolarHBondContact O-CA 3.3Å; G201-F205 WeakPolarHBondContact O-CB 3.35Å; G201-F205 VanDerWaalsContact O-CD2 3.26Å; G201-F205 WeakPolarHBondContact O-CD2 3.1Å; G201-F205 PolarHBondContact O-N 3.41Å
202	T	94.5	Very high	95.9	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-59	-43.5	176.5	-50.4	0	0	0	0	111.4	Y82 S198 G199 A206 F486 L507	Y82-T202 WeakPolarHBondContact CD2-OG1 3.46Å; S198-T202 PolarHBondContact O-N 3.3Å; S198-T202 PolarHBondContact O-OG1 3.28Å; G199-T202 WeakPolarHBondContact O-CB 3.3Å; G199-T202 PolarHBondContact O-N 3.25Å; T202-A206 VanDerWaalsContact O-CB 3.23Å; T202-A206 WeakPolarHBondContact O-CB 3.46Å; T202-A206 PolarHBondContact O-N 3.04Å; T202-A206 VanDerWaalsContact O-N 3.16Å; T202-F486 HydrophobicContact CG2-CD1 4.46Å; T202-F486 HydrophobicContact CG2-CE1 4.37Å; T202-L507 HydrophobicContact CG2-CD1 3.84Å; T202-L507 HydrophobicContact CG2-CG 3.78Å
203	F	93.8	Very high	95.8	Very high	78 Å²	78	22.4 Å²	22.4	34%	0.342	12%	0.123	S	C	.	.	H	α-helix	trans	-63.2	-42.7	178.2	159.7	-112.9	0	0	0	113.2	G199 F200 G201 P207 I512	G199-F203 PolarHBondContact O-N 2.84Å; F200-F203 HydrophobicContact CD2-CD1 4.15Å; F200-F203 HydrophobicContact CE2-CD1 4.29Å; F200-F203 HydrophobicContact CE2-CE1 4.4Å; F200-F203 WeakPolarHBondContact O-CB 3.37Å; F200-F203 PolarHBondContact O-N 2.8Å; G201-F203 VanDerWaalsContact C-N 3.29Å; G201-F203 PolarHBondContact O-N 3.19Å; F203-P207 WeakPolarHBondContact O-CD 3.28Å; F203-P207 WeakPolarHBondContact O-CG 3.36Å; F203-I512 HydrophobicContact CB-CG1 4.17Å; F203-I512 HydrophobicContact CD2-CD1 3.71Å; F203-I512 HydrophobicContact CD2-CG1 3.52Å; F203-I512 HydrophobicContact CE2-CD1 3.85Å; F203-I512 HydrophobicContact CE2-CG1 4.04Å; F203-I512 HydrophobicContact CG-CD1 4.47Å; F203-I512 HydrophobicContact CG-CG1 3.79Å
204	V	96.2	Very high	95.5	Very high	46 Å²	46	26.1 Å²	26.1	28%	0.279	14%	0.14	S	C	.	.	H	α-helix	trans	-81	-44.5	-178.4	172.2	0	0	0	0	111.6	F200 G201 A206 P207 L208	F200-V204 HydrophobicContact CD1-CG2 4.24Å; F200-V204 HydrophobicContact CD2-CG2 4.35Å; F200-V204 HydrophobicContact CE1-CG2 3.81Å; F200-V204 HydrophobicContact CE2-CG2 3.93Å; F200-V204 HydrophobicContact CG-CG2 4.49Å; F200-V204 HydrophobicContact CZ-CG2 3.64Å; F200-V204 WeakPolarHBondContact O-CG2 3.35Å; F200-V204 PolarHBondContact O-N 3.26Å; G201-V204 PolarHBondContact O-N 3.1Å; V204-A206 VanDerWaalsContact C-N 3.35Å; V204-A206 PolarHBondContact O-N 3.27Å; V204-P207 WeakPolarHBondContact O-CD 3.35Å; V204-P207 WeakPolarHBondContact O-CG 3.48Å; V204-L208 WeakPolarHBondContact O-CB 3.42Å; V204-L208 PolarHBondContact O-N 3.39Å
205	F	96	Very high	95.4	Very high	3 Å²	3	33 Å²	33	1%	0.013	17%	0.172	C	C	.	.	H	α-helix	trans	-74	-25.1	-173.6	-80.2	-110.7	0	0	0	112.6	T75 V76 G79 I80 S83 G201 L208 T209 L225 M228	T75-F205 HydrophobicContact CG2-CE2 4.23Å; V76-F205 HydrophobicContact CB-CZ 4.47Å; V76-F205 HydrophobicContact CG1-CZ 4.47Å; V76-F205 HydrophobicContact CG2-CZ 4.35Å; G79-F205 WeakPolarHBondContact O-CB 3.2Å; I80-F205 HydrophobicContact CD1-CE1 4.22Å; I80-F205 HydrophobicContact CG1-CD1 3.81Å; I80-F205 HydrophobicContact CG1-CE1 3.53Å; I80-F205 HydrophobicContact CG1-CZ 4.45Å; S83-F205 WeakPolarHBondContact OG-CB 3.23Å; G201-F205 WeakPolarHBondContact O-CA 3.3Å; G201-F205 WeakPolarHBondContact O-CB 3.35Å; G201-F205 VanDerWaalsContact O-CD2 3.26Å; G201-F205 WeakPolarHBondContact O-CD2 3.1Å; G201-F205 PolarHBondContact O-N 3.41Å; F205-L208 HydrophobicContact CD1-CD2 4.45Å; F205-T209 WeakPolarHBondContact O-CB 3.44Å; F205-T209 PolarHBondContact O-N 3.05Å; F205-T209 PolarHBondContact O-OG1 3.46Å; F205-L225 HydrophobicContact CD1-CD2 3.92Å; F205-L225 HydrophobicContact CE1-CD2 3.7Å; F205-M228 HydrophobicContact CE1-CE 4.02Å; F205-M228 HydrophobicContact CE1-SD 3.8Å; F205-M228 HydrophobicContact CE2-CE 4.1Å; F205-M228 HydrophobicContact CZ-CE 3.49Å; F205-M228 VanDerWaalsContact CZ-CE 3.49Å; F205-M228 HydrophobicContact CZ-SD 3.85Å
206	A	93.6	Very high	95.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-60	-62.9	175.6	0	0	0	0	0	112.3	S83 I86 T202 V204 L208 T209 T210 L507	S83-A206 PolarHBondContact OG-N 2.93Å; I86-A206 VanDerWaalsContact CD1-CA 3.48Å; I86-A206 HydrophobicContact CD1-CB 3.83Å; I86-A206 VanDerWaalsContact CD1-O 3.25Å; I86-A206 WeakPolarHBondContact CD1-O 3.31Å; T202-A206 VanDerWaalsContact O-CB 3.23Å; T202-A206 WeakPolarHBondContact O-CB 3.46Å; T202-A206 PolarHBondContact O-N 3.04Å; T202-A206 VanDerWaalsContact O-N 3.16Å; V204-A206 VanDerWaalsContact C-N 3.35Å; V204-A206 PolarHBondContact O-N 3.27Å; A206-L208 VanDerWaalsContact C-N 3.31Å; A206-L208 PolarHBondContact O-N 2.93Å; A206-T209 PolarHBondContact O-N 2.64Å; A206-T210 PolarHBondContact O-N 3.45Å; A206-T210 VanDerWaalsContact O-N 3.13Å; A206-T210 PolarHBondContact O-OG1 3.25Å; A206-L507 HydrophobicContact CB-CB 4.33Å; A206-L507 HydrophobicContact CB-CD2 4.03Å; A206-L507 HydrophobicContact CB-CG 4.24Å
207	P	92.6	Very high	95.3	Very high	59 Å²	59	40.8 Å²	40.8	38%	0.383	21%	0.209	S	C	.	.	H	α-helix	trans	-66	-33.7	177.9	27.3	-34.5	0	0	0	112.2	F203 V204 T210 A211	F203-P207 WeakPolarHBondContact O-CD 3.28Å; F203-P207 WeakPolarHBondContact O-CG 3.36Å; V204-P207 WeakPolarHBondContact O-CD 3.35Å; V204-P207 WeakPolarHBondContact O-CG 3.48Å; P207-T210 PolarHBondContact O-N 3.23Å; P207-A211 WeakPolarHBondContact O-CB 3.45Å; P207-A211 PolarHBondContact O-N 2.82Å
208	L	94.6	Very high	95.2	Very high	49 Å²	49	41.3 Å²	41.3	26%	0.257	21%	0.211	S	C	.	.	H	α-helix	trans	-60.6	-49	175.4	176.4	64.5	0	0	0	110.9	V204 F205 A206 T210 A211 L212 M228	V204-L208 WeakPolarHBondContact O-CB 3.42Å; V204-L208 PolarHBondContact O-N 3.39Å; F205-L208 HydrophobicContact CD1-CD2 4.45Å; A206-L208 VanDerWaalsContact C-N 3.31Å; A206-L208 PolarHBondContact O-N 2.93Å; L208-T210 VanDerWaalsContact C-N 3.33Å; L208-T210 PolarHBondContact O-N 3.09Å; L208-A211 PolarHBondContact O-N 3.36Å; L208-L212 HydrophobicContact CD1-CD1 3.98Å; L208-L212 HydrophobicContact CD1-CD2 4.33Å; L208-L212 HydrophobicContact CD1-CG 3.93Å; L208-L212 HydrophobicContact CG-CD1 3.93Å; L208-L212 HydrophobicContact CG-CG 4.22Å; L208-L212 WeakPolarHBondContact O-CB 3.36Å; L208-L212 WeakPolarHBondContact O-CG 3.36Å; L208-L212 PolarHBondContact O-N 3.29Å; L208-M228 HydrophobicContact CD2-CE 3.75Å; L208-M228 HydrophobicContact CD2-SD 3.99Å
209	T	95.1	Very high	95.2	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.018	23%	0.226	C	C	.	.	H	α-helix	trans	-63.6	-41	-179.3	-57.6	0	0	0	0	110.6	I86 M87 F205 A206 L212 L213 T221	I86-T209 HydrophobicContact CB-CG2 4.26Å; I86-T209 HydrophobicContact CG2-CG2 4.21Å; M87-T209 HydrophobicContact CG-CG2 3.81Å; M87-T209 HydrophobicContact SD-CG2 4.47Å; F205-T209 WeakPolarHBondContact O-CB 3.44Å; F205-T209 PolarHBondContact O-N 3.05Å; F205-T209 PolarHBondContact O-OG1 3.46Å; A206-T209 PolarHBondContact O-N 2.64Å; T209-L212 PolarHBondContact O-N 2.93Å; T209-L213 HydrophobicContact CG2-CD1 4.03Å; T209-L213 HydrophobicContact CG2-CG 4.33Å; T209-L213 WeakPolarHBondContact O-CB 3.4Å; T209-L213 WeakPolarHBondContact O-CG 3.34Å; T209-L213 PolarHBondContact O-N 3Å; T209-T221 HydrophobicContact CG2-CG2 4.28Å
210	T	93.6	Very high	95.3	Very high	28 Å²	28	45.6 Å²	45.6	17%	0.172	23%	0.234	C	C	.	.	H	α-helix	trans	-57.8	-52.2	173.2	-59.5	0	0	0	0	111.5	I86 A206 P207 L208 L212 L213 E214	I86-T210 WeakPolarHBondContact CG2-OG1 3.13Å; A206-T210 PolarHBondContact O-N 3.45Å; A206-T210 VanDerWaalsContact O-N 3.13Å; A206-T210 PolarHBondContact O-OG1 3.25Å; P207-T210 PolarHBondContact O-N 3.23Å; L208-T210 VanDerWaalsContact C-N 3.33Å; L208-T210 PolarHBondContact O-N 3.09Å; T210-L212 VanDerWaalsContact C-N 3.35Å; T210-L212 PolarHBondContact O-N 2.85Å; T210-L213 PolarHBondContact O-N 2.96Å; T210-E214 WeakPolarHBondContact O-CG 3.23Å; T210-E214 PolarHBondContact O-N 3.46Å
211	A	94.1	Very high	95.3	Very high	39 Å²	39	42 Å²	42	32%	0.322	22%	0.218	S	C	.	.	H	α-helix	trans	-62.8	-40.2	-179.9	0	0	0	0	0	112.5	P207 L208 E214 H215	P207-A211 WeakPolarHBondContact O-CB 3.45Å; P207-A211 PolarHBondContact O-N 2.82Å; L208-A211 PolarHBondContact O-N 3.36Å; A211-E214 PolarHBondContact O-N 3.23Å; A211-H215 PolarHBondContact O-CD2 2.96Å; A211-H215 PolarHBondContact O-N 3.48Å; A211-H215 VanDerWaalsContact O-N 3.12Å
212	L	96.3	Very high	95.3	Very high	15 Å²	15	42.2 Å²	42.2	8%	0.079	22%	0.219	C	C	.	.	H	α-helix	trans	-65.7	-38.7	177.3	-69.7	-176.4	0	0	0	112.1	L208 T209 T210 Y216 T221 I224	L208-L212 HydrophobicContact CD1-CD1 3.98Å; L208-L212 HydrophobicContact CD1-CD2 4.33Å; L208-L212 HydrophobicContact CD1-CG 3.93Å; L208-L212 HydrophobicContact CG-CD1 3.93Å; L208-L212 HydrophobicContact CG-CG 4.22Å; L208-L212 WeakPolarHBondContact O-CB 3.36Å; L208-L212 WeakPolarHBondContact O-CG 3.36Å; L208-L212 PolarHBondContact O-N 3.29Å; T209-L212 PolarHBondContact O-N 2.93Å; T210-L212 VanDerWaalsContact C-N 3.35Å; T210-L212 PolarHBondContact O-N 2.85Å; L212-Y216 HydrophobicContact CD2-CD2 3.9Å; L212-Y216 HydrophobicContact CD2-CE2 4.02Å; L212-Y216 WeakPolarHBondContact O-CA 3.44Å; L212-Y216 WeakPolarHBondContact O-CB 3.11Å; L212-Y216 PolarHBondContact O-N 2.96Å; L212-T221 HydrophobicContact CB-CG2 3.95Å; L212-T221 WeakPolarHBondContact CB-OG1 3.37Å; L212-T221 HydrophobicContact CD1-CG2 4.24Å; L212-T221 PolarHBondContact O-OG1 3.45Å; L212-I224 HydrophobicContact CD1-CB 4.09Å; L212-I224 HydrophobicContact CD1-CD1 4.37Å; L212-I224 HydrophobicContact CD1-CG2 3.78Å; L212-I224 HydrophobicContact CD2-CD1 3.48Å; L212-I224 VanDerWaalsContact CD2-CD1 3.48Å; L212-I224 HydrophobicContact CD2-CG2 4.39Å; L212-I224 HydrophobicContact CG-CD1 4.47Å
213	L	94.5	Very high	95.4	Very high	22 Å²	22	48.3 Å²	48.3	12%	0.115	24%	0.242	C	C	.	.	H	α-helix	trans	-65.3	-43.1	176.1	-75.3	170.5	0	0	0	111.5	I86 M87 E90 T209 T210 H215 G217 W218 T221	I86-L213 HydrophobicContact CG2-CD1 3.89Å; M87-L213 HydrophobicContact CG-CD1 3.95Å; M87-L213 HydrophobicContact CG-CD2 4.13Å; M87-L213 HydrophobicContact CG-CG 4.4Å; E90-L213 HydrophobicContact CG-CD2 4.41Å; T209-L213 HydrophobicContact CG2-CD1 4.03Å; T209-L213 HydrophobicContact CG2-CG 4.33Å; T209-L213 WeakPolarHBondContact O-CB 3.4Å; T209-L213 WeakPolarHBondContact O-CG 3.34Å; T209-L213 PolarHBondContact O-N 3Å; T210-L213 PolarHBondContact O-N 2.96Å; L213-H215 PolarHBondContact O-N 3.27Å; L213-G217 WeakPolarHBondContact O-CA 3.46Å; L213-G217 PolarHBondContact O-N 3.38Å; L213-W218 HydrophobicContact CD2-CB 3.87Å; L213-T221 PolarHBondContact N-OG1 3.19Å
214	E	93.4	Very high	95.6	Very high	124 Å²	124	47.7 Å²	47.7	58%	0.579	24%	0.242	S	C	*	.	H	α-helix	trans	-63.8	-39.5	179.4	-73.4	175.3	-177.7	0	0	112.6	T210 A211	T210-E214 WeakPolarHBondContact O-CG 3.23Å; T210-E214 PolarHBondContact O-N 3.46Å; A211-E214 PolarHBondContact O-N 3.23Å
215	H	95.6	Very high	95.7	Very high	145 Å²	145	45.5 Å²	45.5	67%	0.671	23%	0.229	S	C	*	.	H	α-helix	trans	-89.5	-35.7	-176.8	-71.8	-60	0	0	0	114.7	A211 L213	A211-H215 PolarHBondContact O-CD2 2.96Å; A211-H215 PolarHBondContact O-N 3.48Å; A211-H215 VanDerWaalsContact O-N 3.12Å; L213-H215 PolarHBondContact O-N 3.27Å
216	Y	96.3	Very high	95.8	Very high	147 Å²	147	45.7 Å²	45.7	58%	0.576	23%	0.23	S	C	*	.	H	α-helix	trans	-123.3	-2.6	-169.2	-56.6	-74.7	0	0	0	113.9	L212 G220 I224	L212-Y216 HydrophobicContact CD2-CD2 3.9Å; L212-Y216 HydrophobicContact CD2-CE2 4.02Å; L212-Y216 WeakPolarHBondContact O-CA 3.44Å; L212-Y216 WeakPolarHBondContact O-CB 3.11Å; L212-Y216 PolarHBondContact O-N 2.96Å; Y216-G220 PolarHBondContact O-N 3.17Å; Y216-I224 HydrophobicContact CD2-CD1 3.83Å; Y216-I224 HydrophobicContact CE2-CD1 3.93Å; Y216-I224 HydrophobicContact CG-CD1 4.39Å
217	G	96	Very high	96	Very high	23 Å²	23	47.2 Å²	47.2	24%	0.237	25%	0.246	C	C	.	.	H	α-helix	trans	63.9	-179.8	-172.2	0	0	0	0	0	112.9	L213 K219 G220 T221	L213-G217 WeakPolarHBondContact O-CA 3.46Å; L213-G217 PolarHBondContact O-N 3.38Å; G217-K219 VanDerWaalsContact C-N 3.33Å; G217-K219 PolarHBondContact O-N 3Å; G217-G220 PolarHBondContact O-N 3.39Å; G217-T221 WeakPolarHBondContact O-CB 3.44Å; G217-T221 PolarHBondContact O-N 3.47Å; G217-T221 PolarHBondContact O-OG1 3.32Å
218	W	95.7	Very high	96.3	Very high	11 Å²	11	47 Å²	47	4%	0.042	24%	0.24	C	C	.	.	H	α-helix	trans	-64.3	-35.5	-176.6	71.3	-95.1	0	0	0	113	E90 L91 Y94 F95 A150 L156 L213 T221 L222	E90-W218 HydrophobicContact CG-CB 4.23Å; L91-W218 HydrophobicContact CD2-CB 4.25Å; L91-W218 HydrophobicContact CD2-CD2 3.75Å; L91-W218 HydrophobicContact CD2-CE3 3.96Å; L91-W218 HydrophobicContact CD2-CG 3.9Å; Y94-W218 AromaticContact CD1-CZ2 3.99Å; Y94-W218 HydrophobicContact CD1-CZ2 3.99Å; Y94-W218 AromaticContact CD1-NE1 3.9Å; Y94-W218 AromaticContact CD2-NE1 3.76Å; Y94-W218 AromaticContact CE1-CZ2 3.76Å; Y94-W218 HydrophobicContact CE1-CZ2 3.76Å; Y94-W218 AromaticContact CG-NE1 3.63Å; F95-W218 HydrophobicContact CE2-CH2 4.36Å; F95-W218 HydrophobicContact CE2-CZ2 4.11Å; F95-W218 HydrophobicContact CZ-CH2 4.14Å; F95-W218 HydrophobicContact CZ-CZ2 4.03Å; A150-W218 HydrophobicContact CB-CH2 4.21Å; L156-W218 HydrophobicContact CD1-CZ3 4.24Å; L213-W218 HydrophobicContact CD2-CB 3.87Å; W218-T221 WeakPolarHBondContact O-CB 3.39Å; W218-T221 PolarHBondContact O-N 3.09Å; W218-L222 HydrophobicContact CE3-CD1 3.74Å; W218-L222 HydrophobicContact CE3-CG 4.46Å; W218-L222 HydrophobicContact CZ3-CD1 3.78Å; W218-L222 WeakPolarHBondContact O-CG 3.18Å; W218-L222 PolarHBondContact O-N 3.34Å
219	K	97.2	Very high	96.5	Very high	73 Å²	73	44.6 Å²	44.6	32%	0.317	23%	0.228	S	C	.	.	H	α-helix	trans	-66.8	-46.7	178	-67.3	-171.9	177.4	-161.1	0	112.2	T148 G217 T221 L222 W223	T148-K219 WeakPolarHBondContact O-CD 3.38Å; T148-K219 VanDerWaalsContact O-CE 3.31Å; T148-K219 WeakPolarHBondContact O-CE 3.27Å; T148-K219 PolarHBondContact O-NZ 3.42Å; G217-K219 VanDerWaalsContact C-N 3.33Å; G217-K219 PolarHBondContact O-N 3Å; K219-T221 VanDerWaalsContact C-N 3.32Å; K219-L222 PolarHBondContact O-N 3.43Å; K219-W223 PolarHBondContact O-N 3.11Å; K219-W223 VanDerWaalsContact O-N 3.14Å
220	G	97.3	Very high	96.6	Very high	17 Å²	17	46.2 Å²	46.2	18%	0.175	24%	0.241	C	C	.	.	H	α-helix	trans	-69.1	-33.2	177.7	0	0	0	0	0	112.5	Y216 G217 L222 W223 I224	Y216-G220 PolarHBondContact O-N 3.17Å; G217-G220 PolarHBondContact O-N 3.39Å; G220-L222 PolarHBondContact O-N 3.47Å; G220-W223 WeakPolarHBondContact O-CB 3.42Å; G220-W223 PolarHBondContact O-N 3Å; G220-I224 PolarHBondContact O-N 3.21Å; G220-I224 VanDerWaalsContact O-N 3.15Å
221	T	97.6	Very high	96.8	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-57.1	-49.2	169.4	-59.4	0	0	0	0	110.8	M87 T209 L212 L213 G217 W218 K219 W223 I224 L225	M87-T221 HydrophobicContact SD-CG2 4.27Å; T209-T221 HydrophobicContact CG2-CG2 4.28Å; L212-T221 HydrophobicContact CB-CG2 3.95Å; L212-T221 WeakPolarHBondContact CB-OG1 3.37Å; L212-T221 HydrophobicContact CD1-CG2 4.24Å; L212-T221 PolarHBondContact O-OG1 3.45Å; L213-T221 PolarHBondContact N-OG1 3.19Å; G217-T221 WeakPolarHBondContact O-CB 3.44Å; G217-T221 PolarHBondContact O-N 3.47Å; G217-T221 PolarHBondContact O-OG1 3.32Å; W218-T221 WeakPolarHBondContact O-CB 3.39Å; W218-T221 PolarHBondContact O-N 3.09Å; K219-T221 VanDerWaalsContact C-N 3.32Å; T221-W223 VanDerWaalsContact C-N 3.33Å; T221-W223 PolarHBondContact O-N 3.11Å; T221-I224 PolarHBondContact O-N 3.08Å; T221-L225 HydrophobicContact CG2-CD1 3.99Å; T221-L225 HydrophobicContact CG2-CG 4.22Å; T221-L225 VanDerWaalsContact O-CG 3.3Å; T221-L225 WeakPolarHBondContact O-CG 3.27Å; T221-L225 PolarHBondContact O-N 3.39Å
222	L	97.7	Very high	97	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-61.8	-36.6	178.2	-70.6	-178	0	0	0	113.5	M87 F144 T148 L156 Y160 W218 K219 G220 L225 S226	M87-L222 HydrophobicContact SD-CD2 4.47Å; F144-L222 HydrophobicContact CD1-CD2 4.3Å; T148-L222 HydrophobicContact CG2-CB 4.11Å; L156-L222 HydrophobicContact CD1-CD1 4.29Å; Y160-L222 HydrophobicContact CD2-CD2 3.64Å; Y160-L222 HydrophobicContact CE2-CD2 3.47Å; Y160-L222 VanDerWaalsContact CE2-CD2 3.47Å; W218-L222 HydrophobicContact CE3-CD1 3.74Å; W218-L222 HydrophobicContact CE3-CG 4.46Å; W218-L222 HydrophobicContact CZ3-CD1 3.78Å; W218-L222 WeakPolarHBondContact O-CG 3.18Å; W218-L222 PolarHBondContact O-N 3.34Å; K219-L222 PolarHBondContact O-N 3.43Å; G220-L222 PolarHBondContact O-N 3.47Å; L222-L225 PolarHBondContact O-N 3.27Å; L222-S226 WeakPolarHBondContact O-CB 3.17Å; L222-S226 PolarHBondContact O-N 3.4Å
223	W	96.9	Very high	97	Very high	129 Å²	129	47.3 Å²	47.3	49%	0.489	25%	0.245	S	C	.	.	H	α-helix	trans	-58.6	-48.3	173.1	-90.3	101.6	0	0	0	111.7	V145 T148 W149 K219 G220 T221 S226 G227	V145-W223 HydrophobicContact CG1-CH2 3.86Å; V145-W223 HydrophobicContact CG1-CZ2 4.23Å; V145-W223 HydrophobicContact CG1-CZ3 4.18Å; V145-W223 HydrophobicContact CG2-CE3 4.43Å; V145-W223 HydrophobicContact CG2-CZ3 4.26Å; T148-W223 VanDerWaalsContact CG2-CD1 3.45Å; T148-W223 HydrophobicContact CG2-CG 4.11Å; W149-W223 HydrophobicContact CH2-CZ2 4.37Å; W149-W223 HydrophobicContact CZ2-CZ2 4.44Å; K219-W223 PolarHBondContact O-N 3.11Å; K219-W223 VanDerWaalsContact O-N 3.14Å; G220-W223 WeakPolarHBondContact O-CB 3.42Å; G220-W223 PolarHBondContact O-N 3Å; T221-W223 VanDerWaalsContact C-N 3.33Å; T221-W223 PolarHBondContact O-N 3.11Å; W223-S226 WeakPolarHBondContact O-CB 3.36Å; W223-S226 PolarHBondContact O-N 2.99Å; W223-S226 PolarHBondContact O-OG 3.07Å; W223-G227 PolarHBondContact O-N 3.12Å
224	I	98	Very high	97.2	Very high	64 Å²	64	50.4 Å²	50.4	33%	0.328	26%	0.264	S	S	.	.	H	α-helix	trans	-67.2	-44.7	-179.2	-66.3	166.3	0	0	0	110.6	L212 Y216 G220 T221 S226 G227 M228	L212-I224 HydrophobicContact CD1-CB 4.09Å; L212-I224 HydrophobicContact CD1-CD1 4.37Å; L212-I224 HydrophobicContact CD1-CG2 3.78Å; L212-I224 HydrophobicContact CD2-CD1 3.48Å; L212-I224 VanDerWaalsContact CD2-CD1 3.48Å; L212-I224 HydrophobicContact CD2-CG2 4.39Å; L212-I224 HydrophobicContact CG-CD1 4.47Å; Y216-I224 HydrophobicContact CD2-CD1 3.83Å; Y216-I224 HydrophobicContact CE2-CD1 3.93Å; Y216-I224 HydrophobicContact CG-CD1 4.39Å; G220-I224 PolarHBondContact O-N 3.21Å; G220-I224 VanDerWaalsContact O-N 3.15Å; T221-I224 PolarHBondContact O-N 3.08Å; I224-S226 VanDerWaalsContact C-N 3.25Å; I224-S226 PolarHBondContact O-N 3.25Å; I224-G227 PolarHBondContact O-N 2.87Å; I224-G227 VanDerWaalsContact O-N 3.12Å; I224-M228 PolarHBondContact O-N 2.99Å
225	L	97.7	Very high	97.4	Very high	1 Å²	1	46 Å²	46	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-59.2	-36.7	175.5	-66.7	-176.3	0	0	0	112	I80 F144 F205 T221 L222 G227 M228 V229	I80-L225 HydrophobicContact CD1-CB 4.33Å; I80-L225 HydrophobicContact CD1-CD2 4.42Å; I80-L225 HydrophobicContact CG1-CD1 4.44Å; I80-L225 HydrophobicContact CG1-CD2 4.09Å; I80-L225 HydrophobicContact CG2-CD1 4.49Å; F144-L225 HydrophobicContact CD1-CB 3.93Å; F144-L225 HydrophobicContact CE1-CB 4.08Å; F144-L225 HydrophobicContact CE1-CD1 4.49Å; F205-L225 HydrophobicContact CD1-CD2 3.92Å; F205-L225 HydrophobicContact CE1-CD2 3.7Å; T221-L225 HydrophobicContact CG2-CD1 3.99Å; T221-L225 HydrophobicContact CG2-CG 4.22Å; T221-L225 VanDerWaalsContact O-CG 3.3Å; T221-L225 WeakPolarHBondContact O-CG 3.27Å; T221-L225 PolarHBondContact O-N 3.39Å; L222-L225 PolarHBondContact O-N 3.27Å; L225-G227 VanDerWaalsContact C-N 3.32Å; L225-G227 PolarHBondContact O-N 3.14Å; L225-M228 HydrophobicContact CD2-SD 4.07Å; L225-M228 WeakPolarHBondContact O-CB 3.06Å; L225-M228 PolarHBondContact O-N 3.46Å; L225-M228 VanDerWaalsContact O-N 3.16Å; L225-V229 WeakPolarHBondContact O-CG2 3.46Å; L225-V229 PolarHBondContact O-N 3.08Å
226	S	98	Very high	97.4	Very high	7 Å²	7	39 Å²	39	5%	0.049	21%	0.211	C	C	.	.	H	α-helix	trans	-61.9	-38.4	176.5	81.2	0	0	0	0	112.9	V145 L222 W223 I224 M228 V229 A230	V145-S226 WeakPolarHBondContact CG2-OG 3.41Å; L222-S226 WeakPolarHBondContact O-CB 3.17Å; L222-S226 PolarHBondContact O-N 3.4Å; W223-S226 WeakPolarHBondContact O-CB 3.36Å; W223-S226 PolarHBondContact O-N 2.99Å; W223-S226 PolarHBondContact O-OG 3.07Å; I224-S226 VanDerWaalsContact C-N 3.25Å; I224-S226 PolarHBondContact O-N 3.25Å; S226-M228 VanDerWaalsContact C-N 3.35Å; S226-V229 PolarHBondContact O-N 3.2Å; S226-A230 PolarHBondContact O-N 3.24Å
227	G	98	Very high	97.4	Very high	32 Å²	32	33.6 Å²	33.6	33%	0.33	20%	0.196	S	C	.	.	H	α-helix	trans	-66.8	-36	174.6	0	0	0	0	0	112.3	W223 I224 L225 A230 N231	W223-G227 PolarHBondContact O-N 3.12Å; I224-G227 PolarHBondContact O-N 2.87Å; I224-G227 VanDerWaalsContact O-N 3.12Å; L225-G227 VanDerWaalsContact C-N 3.32Å; L225-G227 PolarHBondContact O-N 3.14Å; G227-A230 WeakPolarHBondContact O-CB 3.46Å; G227-A230 PolarHBondContact O-N 2.84Å; G227-N231 PolarHBondContact O-N 3.47Å; G227-N231 PolarHBondContact O-ND2 2.97Å
228	M	97.9	Very high	97.4	Very high	53 Å²	53	35.1 Å²	35.1	26%	0.261	20%	0.198	S	C	.	.	H	α-helix	trans	-67	-40.4	173.9	-59.7	177.7	94.9	0	0	111.5	V76 F205 L208 I224 L225 S226 A230 N231	V76-M228 HydrophobicContact CG1-CB 4.26Å; F205-M228 HydrophobicContact CE1-CE 4.02Å; F205-M228 HydrophobicContact CE1-SD 3.8Å; F205-M228 HydrophobicContact CE2-CE 4.1Å; F205-M228 HydrophobicContact CZ-CE 3.49Å; F205-M228 VanDerWaalsContact CZ-CE 3.49Å; F205-M228 HydrophobicContact CZ-SD 3.85Å; L208-M228 HydrophobicContact CD2-CE 3.75Å; L208-M228 HydrophobicContact CD2-SD 3.99Å; I224-M228 PolarHBondContact O-N 2.99Å; L225-M228 HydrophobicContact CD2-SD 4.07Å; L225-M228 WeakPolarHBondContact O-CB 3.06Å; L225-M228 PolarHBondContact O-N 3.46Å; L225-M228 VanDerWaalsContact O-N 3.16Å; S226-M228 VanDerWaalsContact C-N 3.35Å; M228-A230 VanDerWaalsContact C-N 3.35Å; M228-N231 WeakPolarHBondContact O-CB 3.48Å; M228-N231 PolarHBondContact O-N 3.1Å
229	V	98.5	Very high	97.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.7	-41	173.3	174.5	0	0	0	0	111.2	V76 I80 F144 L168 I171 L225 S226 N231 C232	V76-V229 HydrophobicContact CG1-CG2 4.09Å; I80-V229 HydrophobicContact CD1-CG2 3.51Å; F144-V229 HydrophobicContact CE1-CG2 4.48Å; L168-V229 HydrophobicContact CD2-CG1 4.04Å; L168-V229 HydrophobicContact CD2-CG2 3.95Å; I171-V229 HydrophobicContact CD1-CG1 4.16Å; L225-V229 WeakPolarHBondContact O-CG2 3.46Å; L225-V229 PolarHBondContact O-N 3.08Å; S226-V229 PolarHBondContact O-N 3.2Å; V229-N231 VanDerWaalsContact C-N 3.27Å; V229-N231 PolarHBondContact O-N 3.3Å; V229-C232 WeakPolarHBondContact O-CB 3.26Å; V229-C232 PolarHBondContact O-N 2.71Å
230	A	98.2	Very high	96.8	Very high	36 Å²	36	36.8 Å²	36.8	30%	0.298	20%	0.203	S	C	.	.	H	α-helix	trans	-58.9	-36.9	176.8	0	0	0	0	0	112.7	M141 S226 G227 M228 C232 G233	M141-A230 HydrophobicContact CB-CB 4.23Å; M141-A230 HydrophobicContact CG-CB 4.06Å; M141-A230 HydrophobicContact SD-CB 3.68Å; S226-A230 PolarHBondContact O-N 3.24Å; G227-A230 WeakPolarHBondContact O-CB 3.46Å; G227-A230 PolarHBondContact O-N 2.84Å; M228-A230 VanDerWaalsContact C-N 3.35Å; A230-C232 PolarHBondContact O-N 3.4Å; A230-G233 PolarHBondContact O-N 3.48Å
231	N	97.7	Very high	95.9	Very high	91 Å²	91	37.8 Å²	37.8	49%	0.487	21%	0.207	S	C	.	.	H	α-helix	trans	-63.2	-20.1	175.9	-82.3	-84	0	0	0	113.3	G227 M228 V229 G233 V234 F235	G227-N231 PolarHBondContact O-N 3.47Å; G227-N231 PolarHBondContact O-ND2 2.97Å; M228-N231 WeakPolarHBondContact O-CB 3.48Å; M228-N231 PolarHBondContact O-N 3.1Å; V229-N231 VanDerWaalsContact C-N 3.27Å; V229-N231 PolarHBondContact O-N 3.3Å; N231-G233 PolarHBondContact O-N 3.16Å; N231-G233 VanDerWaalsContact O-N 3.17Å; N231-V234 WeakPolarHBondContact O-CB 3.43Å; N231-V234 PolarHBondContact O-N 3.11Å; N231-F235 PolarHBondContact O-N 3.47Å
232	C	98.2	Very high	94.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.7	-21.5	172	-63.4	0	0	0	0	112.9	A137 I171 V229 A230 V234 F235 G236	A137-C232 HydrophobicContact CB-CB 4.14Å; I171-C232 HydrophobicContact CD1-CB 3.72Å; I171-C232 HydrophobicContact CG1-CB 4.1Å; I171-C232 HydrophobicContact CG2-CB 3.94Å; V229-C232 WeakPolarHBondContact O-CB 3.26Å; V229-C232 PolarHBondContact O-N 2.71Å; A230-C232 PolarHBondContact O-N 3.4Å; C232-V234 VanDerWaalsContact C-N 3.3Å; C232-V234 PolarHBondContact O-N 3.21Å; C232-F235 PolarHBondContact O-N 3.32Å; C232-G236 PolarHBondContact O-N 3.4Å
233	G	97.4	Very high	93	Very high	15 Å²	15	48.8 Å²	48.8	16%	0.155	25%	0.25	C	S	.	.	H	α-helix	trans	-64.7	-33.8	171.9	0	0	0	0	0	112.7	A230 N231 G236 A237	A230-G233 PolarHBondContact O-N 3.48Å; N231-G233 PolarHBondContact O-N 3.16Å; N231-G233 VanDerWaalsContact O-N 3.17Å; G233-G236 PolarHBondContact O-N 3.49Å; G233-A237 PolarHBondContact O-N 2.69Å
234	V	97.7	Very high	90.7	Very high	86 Å²	86	48.5 Å²	48.5	52%	0.521	26%	0.255	S	S	.	.	H	α-helix	trans	-67.6	-45.6	174.8	-178.7	0	0	0	0	110.2	N231 C232 G236 A237 L238	N231-V234 WeakPolarHBondContact O-CB 3.43Å; N231-V234 PolarHBondContact O-N 3.11Å; C232-V234 VanDerWaalsContact C-N 3.3Å; C232-V234 PolarHBondContact O-N 3.21Å; V234-G236 VanDerWaalsContact C-N 3.32Å; V234-G236 PolarHBondContact O-N 3.47Å; V234-A237 WeakPolarHBondContact O-CB 3.36Å; V234-A237 PolarHBondContact O-N 2.83Å; V234-L238 PolarHBondContact O-N 2.78Å
235	F	97.3	Very high	87.9	Confident	31 Å²	31	48.1 Å²	48.1	14%	0.136	26%	0.258	C	S	.	.	H	α-helix	trans	-63.9	-39.2	174.9	-53.6	-47.8	0	0	0	111.6	A69 M72 N231 C232 A237 L238	A69-F235 HydrophobicContact CB-CB 4.25Å; M72-F235 HydrophobicContact CB-CD1 3.8Å; M72-F235 HydrophobicContact CB-CD2 3.61Å; M72-F235 HydrophobicContact CB-CE1 3.64Å; M72-F235 HydrophobicContact CB-CE2 3.48Å; M72-F235 VanDerWaalsContact CB-CE2 3.48Å; M72-F235 HydrophobicContact CB-CG 3.81Å; M72-F235 HydrophobicContact CB-CZ 3.5Å; M72-F235 HydrophobicContact CE-CE2 4.34Å; M72-F235 HydrophobicContact CE-CZ 3.83Å; M72-F235 HydrophobicContact CG-CD1 4.31Å; M72-F235 HydrophobicContact CG-CE1 3.85Å; M72-F235 HydrophobicContact CG-CE2 4.4Å; M72-F235 HydrophobicContact CG-CZ 3.93Å; N231-F235 PolarHBondContact O-N 3.47Å; C232-F235 PolarHBondContact O-N 3.32Å; F235-A237 VanDerWaalsContact C-N 3.3Å; F235-A237 PolarHBondContact O-N 3.32Å; F235-L238 WeakPolarHBondContact O-CB 3.45Å; F235-L238 PolarHBondContact O-N 3.2Å; F235-L238 VanDerWaalsContact O-N 3.1Å
236	G	95.6	Very high	85	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.4	-37.6	172.4	0	0	0	0	0	113.3	R130 C133 C232 G233 V234 L238 L239	R130-G236 WeakPolarHBondContact CA-O 3.2Å; R130-G236 WeakPolarHBondContact CG-O 3.36Å; C133-G236 WeakPolarHBondContact SG-CA 3.35Å; C232-G236 PolarHBondContact O-N 3.4Å; G233-G236 PolarHBondContact O-N 3.49Å; V234-G236 VanDerWaalsContact C-N 3.32Å; V234-G236 PolarHBondContact O-N 3.47Å; G236-L238 PolarHBondContact O-N 2.95Å; G236-L239 WeakPolarHBondContact O-CB 3.39Å; G236-L239 PolarHBondContact O-N 3.22Å; G236-L239 VanDerWaalsContact O-N 3.07Å
237	A	95.9	Very high	82.4	Confident	32 Å²	32	58.9 Å²	58.9	26%	0.264	32%	0.316	S	S	.	.	H	α-helix	trans	-62.9	-24.2	176.3	0	0	0	0	0	113.4	I134 G233 V234 F235	I134-A237 HydrophobicContact CD1-CB 4.3Å; G233-A237 PolarHBondContact O-N 2.69Å; V234-A237 WeakPolarHBondContact O-CB 3.36Å; V234-A237 PolarHBondContact O-N 2.83Å; F235-A237 VanDerWaalsContact C-N 3.3Å; F235-A237 PolarHBondContact O-N 3.32Å
238	L	96.2	Very high	79.8	Confident	55 Å²	55	58 Å²	58	29%	0.288	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-11.5	176.1	-59	174.8	0	0	0	113.5	Y62 V65 I66 A69 V234 F235 G236 W240	Y62-L238 WeakPolarHBondContact CE1-O 3.31Å; Y62-L238 PolarHBondContact OH-O 3.33Å; Y62-L238 VanDerWaalsContact OH-O 3.1Å; V65-L238 HydrophobicContact CG1-CB 4.32Å; V65-L238 HydrophobicContact CG1-CD1 4.37Å; V65-L238 HydrophobicContact CG1-CD2 4.47Å; I66-L238 WeakPolarHBondContact CD1-O 3.44Å; A69-L238 HydrophobicContact CB-CB 3.92Å; A69-L238 HydrophobicContact CB-CD1 4.08Å; V234-L238 PolarHBondContact O-N 2.78Å; F235-L238 WeakPolarHBondContact O-CB 3.45Å; F235-L238 PolarHBondContact O-N 3.2Å; F235-L238 VanDerWaalsContact O-N 3.1Å; G236-L238 PolarHBondContact O-N 2.95Å; L238-W240 PolarHBondContact O-N 2.85Å
239	L	92.3	Very high	77.3	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.016	31%	0.31	C	S	.	.			trans	-75.9	63	-179.4	-60.2	-179.8	0	0	0	111.9	I66 A69 A129 C133 P174 Y178 G236	I66-L239 HydrophobicContact CD1-CD2 4.28Å; I66-L239 HydrophobicContact CG2-CD2 4.15Å; A69-L239 HydrophobicContact CB-CD2 4.22Å; A129-L239 HydrophobicContact CB-CB 4.49Å; C133-L239 HydrophobicContact CB-CD1 4.07Å; P174-L239 HydrophobicContact CB-CD1 4.06Å; Y178-L239 HydrophobicContact CD1-CB 4.48Å; G236-L239 WeakPolarHBondContact O-CB 3.39Å; G236-L239 PolarHBondContact O-N 3.22Å; G236-L239 VanDerWaalsContact O-N 3.07Å
240	W	89	Confident	74.7	Confident	117 Å²	117	61.7 Å²	61.7	44%	0.443	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-69.3	137	-176.5	-159.6	-85.6	0	0	0	111.4	Y62 R130 Y178 Y182 L238	Y62-W240 HydrophobicContact CD1-CB 4.48Å; Y62-W240 HydrophobicContact CE1-CB 3.59Å; R130-W240 VanDerWaalsContact NH1-CZ3 3.31Å; Y178-W240 WeakPolarHBondContact CE1-O 3.48Å; Y182-W240 PolarHBondContact OH-O 3.21Å; L238-W240 PolarHBondContact O-N 2.85Å
241	P	78.2	Confident	72.3	Confident	38 Å²	38	61.9 Å²	61.9	25%	0.247	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-69.4	136.5	176.8	25.1	-31.9	0	0	0	112.9	Y178 R243	Y178-P241 VanDerWaalsContact OH-CA 3.3Å; Y178-P241 WeakPolarHBondContact OH-CA 3.15Å; Y178-P241 WeakPolarHBondContact OH-CB 3.48Å; P241-R243 PolarHBondContact O-N 3.09Å
242	L	76.6	Confident	69.9	Low	41 Å²	41	63.4 Å²	63.4	22%	0.215	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-59.4	118.1	169.5	-85.9	143	0	0	0	109.7	P55 P58 Y181 Y182 Q244	P55-L242 HydrophobicContact CB-CB 4.4Å; P55-L242 HydrophobicContact CG-CB 4.34Å; P58-L242 HydrophobicContact CG-CD2 4.27Å; Y181-L242 VanDerWaalsContact C-CD1 3.45Å; Y181-L242 WeakPolarHBondContact O-CD1 3.4Å; Y182-L242 HydrophobicContact CD1-CD1 4.12Å; Y182-L242 HydrophobicContact CD1-CD2 3.97Å; Y182-L242 HydrophobicContact CD1-CG 4.1Å; Y182-L242 HydrophobicContact CD2-CD1 3.34Å; Y182-L242 HydrophobicContact CD2-CG 3.92Å; Y182-L242 HydrophobicContact CE1-CD1 4.21Å; Y182-L242 HydrophobicContact CE1-CD2 3.77Å; Y182-L242 HydrophobicContact CE1-CG 3.76Å; Y182-L242 HydrophobicContact CE2-CD1 3.43Å; Y182-L242 VanDerWaalsContact CE2-CD1 3.43Å; Y182-L242 HydrophobicContact CE2-CD2 4.42Å; Y182-L242 HydrophobicContact CE2-CG 3.53Å; Y182-L242 HydrophobicContact CG-CD1 3.72Å; Y182-L242 HydrophobicContact CG-CD2 4.4Å; Y182-L242 HydrophobicContact CG-CG 4.19Å; Y182-L242 VanDerWaalsContact CZ-CG 3.45Å; L242-Q244 PolarHBondContact O-N 3.31Å
243	R	56.8	Low	67.5	Low	193 Å²	193	67 Å²	67	73%	0.728	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-67.3	121.8	173.7	-82	-177.7	170.7	-177.1	0.4	108.8	P241 S245	P241-R243 PolarHBondContact O-N 3.09Å; R243-S245 PolarHBondContact O-N 3.2Å
244	Q	50.2	Low	65.1	Low	123 Å²	123	74.1 Å²	74.1	58%	0.575	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-54.7	130.5	168.6	-62.6	179.9	-17.1	0	0	109.1	P55 L242	P55-Q244 HydrophobicContact CG-CG 4.23Å; L242-Q244 PolarHBondContact O-N 3.31Å
245	S	39.3	Very low	62.6	Low	56 Å²	56	75.9 Å²	75.9	39%	0.392	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-57.6	138.7	177.7	173.6	0	0	0	0	109.6	R243 A247 S248 A249	R243-S245 PolarHBondContact O-N 3.2Å; S245-A247 PolarHBondContact O-N 2.96Å; S245-A247 VanDerWaalsContact O-N 3.13Å; S245-A247 PolarHBondContact OG-N 3.39Å; S245-S248 WeakPolarHBondContact O-CA 3.28Å; S245-S248 WeakPolarHBondContact O-CB 3.18Å; S245-S248 PolarHBondContact O-N 2.84Å; S245-A249 PolarHBondContact O-N 2.9Å
246	K	36.3	Very low	60.3	Low	167 Å²	167	77.5 Å²	77.5	73%	0.726	39%	0.386	S	S	*	.	H	α-helix	trans	-52.5	-35.6	177	-75	-175	177.4	-176.1	0	111.9	A249 I250	K246-A249 PolarHBondContact O-N 3.17Å; K246-I250 WeakPolarHBondContact O-CB 3.45Å; K246-I250 WeakPolarHBondContact O-CD1 3.25Å; K246-I250 WeakPolarHBondContact O-CG1 3.22Å; K246-I250 PolarHBondContact O-N 3.23Å
247	A	44	Very low	58	Low	67 Å²	67	81 Å²	81	55%	0.554	41%	0.407	S	S	*	.	H	α-helix	trans	-66.5	-36.1	177.4	0	0	0	0	0	112.8	S245 S251	S245-A247 PolarHBondContact O-N 2.96Å; S245-A247 VanDerWaalsContact O-N 3.13Å; S245-A247 PolarHBondContact OG-N 3.39Å; A247-S251 WeakPolarHBondContact O-CB 3.46Å; A247-S251 PolarHBondContact O-N 3.33Å; A247-S251 PolarHBondContact O-OG 2.94Å
248	S	42	Very low	55.3	Low	15 Å²	15	84.7 Å²	84.7	11%	0.105	42%	0.422	C	S	.	.	H	α-helix	trans	-69.1	-42.7	174.7	-170.3	0	0	0	0	111	D53 S245 S251 Q252	D53-S248 WeakPolarHBondContact O-CB 3.3Å; D53-S248 PolarHBondContact O-OG 3.48Å; S245-S248 WeakPolarHBondContact O-CA 3.28Å; S245-S248 WeakPolarHBondContact O-CB 3.18Å; S245-S248 PolarHBondContact O-N 2.84Å; S248-S251 WeakPolarHBondContact CA-OG 3.49Å; S248-S251 PolarHBondContact O-N 3.32Å; S248-S251 PolarHBondContact O-OG 3.16Å; S248-Q252 VanDerWaalsContact O-CB 3.28Å; S248-Q252 WeakPolarHBondContact O-CB 3.29Å; S248-Q252 PolarHBondContact O-N 3.09Å
249	A	45.9	Very low	53.1	Low	43 Å²	43	87.7 Å²	87.7	36%	0.355	44%	0.442	S	S	.	.	H	α-helix	trans	-62.2	-46.6	175.3	0	0	0	0	0	112	S245 K246 Q252 E253	S245-A249 PolarHBondContact O-N 2.9Å; K246-A249 PolarHBondContact O-N 3.17Å; A249-Q252 PolarHBondContact O-N 3.29Å; A249-E253 VanDerWaalsContact O-CB 3.3Å; A249-E253 WeakPolarHBondContact O-CB 3.35Å; A249-E253 PolarHBondContact O-N 3.18Å
250	I	44.4	Very low	50.8	Low	86 Å²	86	92.8 Å²	92.8	44%	0.441	47%	0.47	S	S	.	.	H	α-helix	trans	-65.8	-38.9	179	-67.1	163.8	0	0	0	111.4	K246 R254	K246-I250 WeakPolarHBondContact O-CB 3.45Å; K246-I250 WeakPolarHBondContact O-CD1 3.25Å; K246-I250 WeakPolarHBondContact O-CG1 3.22Å; K246-I250 PolarHBondContact O-N 3.23Å; I250-R254 VanDerWaalsContact O-CB 3.27Å; I250-R254 WeakPolarHBondContact O-CB 3.41Å; I250-R254 PolarHBondContact O-N 3.41Å
251	S	47.2	Very low	48.1	Very low	41 Å²	41	91.8 Å²	91.8	29%	0.287	47%	0.472	S	S	.	.	H	α-helix	trans	-71.4	-37.6	178	54.6	0	0	0	0	112.4	A247 S248 E253 R254 R255	A247-S251 WeakPolarHBondContact O-CB 3.46Å; A247-S251 PolarHBondContact O-N 3.33Å; A247-S251 PolarHBondContact O-OG 2.94Å; S248-S251 WeakPolarHBondContact CA-OG 3.49Å; S248-S251 PolarHBondContact O-N 3.32Å; S248-S251 PolarHBondContact O-OG 3.16Å; S251-E253 VanDerWaalsContact C-N 3.34Å; S251-R254 PolarHBondContact O-N 3.25Å; S251-R255 WeakPolarHBondContact O-CB 3.48Å; S251-R255 PolarHBondContact O-N 3.39Å
252	Q	48	Very low	46.3	Very low	122 Å²	122	95.4 Å²	95.4	57%	0.57	50%	0.495	S	S	*	.	H	α-helix	trans	-65.4	-39.6	174.6	-160.7	171	10.2	0	0	111.2	S248 A249 R255 S256	S248-Q252 VanDerWaalsContact O-CB 3.28Å; S248-Q252 WeakPolarHBondContact O-CB 3.29Å; S248-Q252 PolarHBondContact O-N 3.09Å; A249-Q252 PolarHBondContact O-N 3.29Å; Q252-R255 PolarHBondContact O-N 3.41Å; Q252-S256 PolarHBondContact O-N 3.45Å; Q252-S256 PolarHBondContact O-OG 2.96Å
253	E	47.6	Very low	44.5	Very low	77 Å²	77	100.9 Å²	100.9	36%	0.36	52%	0.52	S	S	.	.	H	α-helix	trans	-65.7	-44.8	173.8	-175.2	169.7	-155.6	0	0	112.3	A249 S251 R255 S256 T257	A249-E253 VanDerWaalsContact O-CB 3.3Å; A249-E253 WeakPolarHBondContact O-CB 3.35Å; A249-E253 PolarHBondContact O-N 3.18Å; S251-E253 VanDerWaalsContact C-N 3.34Å; E253-R255 PolarHBondContact O-N 3.23Å; E253-S256 WeakPolarHBondContact CA-OG 3.13Å; E253-S256 PolarHBondContact O-N 3.23Å; E253-S256 PolarHBondContact O-OG 3.3Å; E253-T257 PolarHBondContact O-N 3.47Å; E253-T257 PolarHBondContact O-OG1 3.12Å
254	R	46.8	Very low	43.5	Very low	164 Å²	164	98.3 Å²	98.3	62%	0.619	52%	0.52	S	S	*	.	H	α-helix	trans	-62.6	-33.9	174.7	-154.7	-178.4	-68.3	-154.9	-0.4	111.3	I250 S251 T257 L258	I250-R254 VanDerWaalsContact O-CB 3.27Å; I250-R254 WeakPolarHBondContact O-CB 3.41Å; I250-R254 PolarHBondContact O-N 3.41Å; S251-R254 PolarHBondContact O-N 3.25Å; R254-T257 VanDerWaalsContact CA-OG1 3.3Å; R254-T257 WeakPolarHBondContact CA-OG1 3.11Å; R254-T257 PolarHBondContact O-OG1 3.24Å; R254-L258 HydrophobicContact CG-CD1 4.33Å; R254-L258 VanDerWaalsContact O-CB 3.28Å; R254-L258 WeakPolarHBondContact O-CB 3.48Å; R254-L258 WeakPolarHBondContact O-CD1 3.31Å; R254-L258 WeakPolarHBondContact O-CG 3.44Å; R254-L258 PolarHBondContact O-N 3.34Å
255	R	45.2	Very low	42.8	Very low	123 Å²	123	96.8 Å²	96.8	46%	0.464	52%	0.523	S	S	.	.	H	α-helix	trans	-73.4	-39.7	176.2	-157.7	-179.5	-65.8	-179.6	4.6	112	D51 N52 S251 Q252 E253 L258 V259	D51-R255 PolarHBondContact O-NH2 2.89Å; N52-R255 PolarHBondContact OD1-NH1 3.19Å; N52-R255 PolarHBondContact OD1-NH2 2.66Å; S251-R255 WeakPolarHBondContact O-CB 3.48Å; S251-R255 PolarHBondContact O-N 3.39Å; Q252-R255 PolarHBondContact O-N 3.41Å; E253-R255 PolarHBondContact O-N 3.23Å; R255-L258 PolarHBondContact O-N 3.47Å; R255-V259 VanDerWaalsContact O-CG2 3.3Å; R255-V259 WeakPolarHBondContact O-CG2 3.49Å; R255-V259 PolarHBondContact O-N 3.46Å; R255-V259 VanDerWaalsContact O-N 3.08Å
256	S	48.8	Very low	42.8	Very low	64 Å²	64	97.7 Å²	97.7	45%	0.448	53%	0.526	S	S	.	.	H	α-helix	trans	-64.3	-40.7	172.6	47.3	0	0	0	0	111.9	Q252 E253 V259 D260	Q252-S256 PolarHBondContact O-N 3.45Å; Q252-S256 PolarHBondContact O-OG 2.96Å; E253-S256 WeakPolarHBondContact CA-OG 3.13Å; E253-S256 PolarHBondContact O-N 3.23Å; E253-S256 PolarHBondContact O-OG 3.3Å; S256-V259 PolarHBondContact O-N 3.14Å; S256-D260 PolarHBondContact O-N 2.94Å
257	T	46.7	Very low	42.8	Very low	74 Å²	74	92.4 Å²	92.4	45%	0.454	51%	0.513	S	S	.	.	H	α-helix	trans	-68.6	-37.9	175.6	26.4	0	0	0	0	112.5	E253 R254 V259 D260 I261	E253-T257 PolarHBondContact O-N 3.47Å; E253-T257 PolarHBondContact O-OG1 3.12Å; R254-T257 VanDerWaalsContact CA-OG1 3.3Å; R254-T257 WeakPolarHBondContact CA-OG1 3.11Å; R254-T257 PolarHBondContact O-OG1 3.24Å; T257-V259 VanDerWaalsContact C-N 3.31Å; T257-V259 PolarHBondContact O-N 3.3Å; T257-D260 CarbonylContact O-C 3.56Å; T257-D260 WeakPolarHBondContact O-CA 2.98Å; T257-D260 PolarHBondContact O-N 2.94Å; T257-I261 WeakPolarHBondContact O-CG1 3.16Å; T257-I261 PolarHBondContact O-N 2.85Å; T257-I261 VanDerWaalsContact O-N 3.16Å
258	L	39.5	Very low	42.6	Very low	109 Å²	109	96.6 Å²	96.6	57%	0.571	52%	0.521	S	S	*	.	H	α-helix	trans	-66.9	-30.1	176.3	-79.4	164.8	0	0	0	113.4	R254 R255 D260 I261	R254-L258 HydrophobicContact CG-CD1 4.33Å; R254-L258 VanDerWaalsContact O-CB 3.28Å; R254-L258 WeakPolarHBondContact O-CB 3.48Å; R254-L258 WeakPolarHBondContact O-CD1 3.31Å; R254-L258 WeakPolarHBondContact O-CG 3.44Å; R254-L258 PolarHBondContact O-N 3.34Å; R255-L258 PolarHBondContact O-N 3.47Å; L258-D260 PolarHBondContact O-N 3.36Å; L258-I261 HydrophobicContact CD2-CD1 4.38Å
259	V	50.9	Low	42.2	Very low	118 Å²	118	103.1 Å²	103.1	72%	0.715	55%	0.55	S	S	*	.	H	α-helix	trans	-69.4	-25.7	171.7	173.3	0	0	0	0	111.2	R255 S256 T257	R255-V259 VanDerWaalsContact O-CG2 3.3Å; R255-V259 WeakPolarHBondContact O-CG2 3.49Å; R255-V259 PolarHBondContact O-N 3.46Å; R255-V259 VanDerWaalsContact O-N 3.08Å; S256-V259 PolarHBondContact O-N 3.14Å; T257-V259 VanDerWaalsContact C-N 3.31Å; T257-V259 PolarHBondContact O-N 3.3Å
260	D	43.5	Very low	41.8	Very low	111 Å²	111	103.6 Å²	103.6	59%	0.594	55%	0.554	S	S	*	*	H	α-helix	trans	-90.5	-5.9	179.6	-67.9	-30.9	0	0	0	113.9	S256 T257 L258 P262	S256-D260 PolarHBondContact O-N 2.94Å; T257-D260 CarbonylContact O-C 3.56Å; T257-D260 WeakPolarHBondContact O-CA 2.98Å; T257-D260 PolarHBondContact O-N 2.94Å; L258-D260 PolarHBondContact O-N 3.36Å; D260-P262 WeakPolarHBondContact O-CD 3.4Å
261	I	32.4	Very low	41.2	Very low	96 Å²	96	105.7 Å²	105.7	49%	0.492	57%	0.565	S	S	.	*	S	Bend	trans	-95	110.6	174	-59.4	160.8	0	0	0	108.3	T257 L258 E263	T257-I261 WeakPolarHBondContact O-CG1 3.16Å; T257-I261 PolarHBondContact O-N 2.85Å; T257-I261 VanDerWaalsContact O-N 3.16Å; L258-I261 HydrophobicContact CD2-CD1 4.38Å; I261-E263 PolarHBondContact O-N 2.7Å; I261-E263 VanDerWaalsContact O-N 3.09Å
262	P	39.8	Very low	40.6	Very low	114 Å²	114	111.2 Å²	111.2	74%	0.74	59%	0.591	S	S	*	*			trans	-62.6	116.4	176.4	-14.7	28.3	0	0	0	109.6	D260 L264	D260-P262 WeakPolarHBondContact O-CD 3.4Å; P262-L264 PolarHBondContact O-N 3.23Å
263	E	39.6	Very low	39.9	Very low	155 Å²	155	109 Å²	109	72%	0.724	59%	0.593	S	S	*	*			trans	5.7	71.2	167.5	-68.3	-178.3	155.4	0	0	116.8	I261 S265 V266	I261-E263 PolarHBondContact O-N 2.7Å; I261-E263 VanDerWaalsContact O-N 3.09Å; E263-S265 VanDerWaalsContact C-N 3.26Å; E263-V266 HydrophobicContact CB-CG2 4.11Å; E263-V266 HydrophobicContact CG-CG2 4.42Å
264	L	34.7	Very low	39	Very low	139 Å²	139	112.9 Å²	112.9	73%	0.728	61%	0.611	S	S	*	*	S	Bend	trans	-77.6	-15.6	166	-136.7	90.4	0	0	0	111.9	P262 V266 A267	P262-L264 PolarHBondContact O-N 3.23Å; L264-V266 VanDerWaalsContact C-N 3.29Å; L264-V266 PolarHBondContact O-N 3.48Å; L264-A267 PolarHBondContact O-N 2.92Å
265	S	36.5	Very low	38.2	Very low	91 Å²	91	113.5 Å²	113.5	64%	0.636	62%	0.621	S	S	*	*	H	α-helix	trans	-75.2	-14.5	179.8	59.9	0	0	0	0	114	E263	E263-S265 VanDerWaalsContact C-N 3.26Å
266	V	39.5	Very low	37.5	Very low	76 Å²	76	114.4 Å²	114.4	46%	0.461	64%	0.635	S	S	.	*	H	α-helix	trans	-87.7	-21.5	177	-176.3	0	0	0	0	111.3	E263 L264 A270	E263-V266 HydrophobicContact CB-CG2 4.11Å; E263-V266 HydrophobicContact CG-CG2 4.42Å; L264-V266 VanDerWaalsContact C-N 3.29Å; L264-V266 PolarHBondContact O-N 3.48Å; V266-A270 VanDerWaalsContact O-CB 3.3Å; V266-A270 WeakPolarHBondContact O-CB 3.24Å; V266-A270 PolarHBondContact O-N 2.95Å; V266-A270 VanDerWaalsContact O-N 3.09Å
267	A	36.7	Very low	36.6	Very low	55 Å²	55	120.5 Å²	120.5	46%	0.455	66%	0.657	S	S	.	*	H	α-helix	trans	-71.7	-32.9	-179.5	0	0	0	0	0	113.1	L264 L271	L264-A267 PolarHBondContact O-N 2.92Å; A267-L271 PolarHBondContact O-N 2.84Å
268	E	39.2	Very low	35.5	Very low	155 Å²	155	124.5 Å²	124.5	72%	0.724	68%	0.675	S	S	*	*	H	α-helix	trans	-73.3	-38.1	177	-90.5	-177.9	146	0	0	112.8	L272	E268-L272 PolarHBondContact O-N 2.95Å
269	E	34.4	Very low	34.9	Very low	152 Å²	152	125.8 Å²	125.8	71%	0.71	69%	0.688	S	S	*	*	H	α-helix	trans	-73.3	-31.9	175.7	-78.2	-173.1	157.5	0	0	112.5	L272 A273	E269-L272 PolarHBondContact O-N 3.42Å; E269-A273 PolarHBondContact O-N 3.31Å
270	A	36.7	Very low	33.8	Very low	53 Å²	53	124.8 Å²	124.8	44%	0.438	69%	0.692	S	S	.	*	H	α-helix	trans	-70.2	-31.9	177.1	0	0	0	0	0	113.1	V266	V266-A270 VanDerWaalsContact O-CB 3.3Å; V266-A270 WeakPolarHBondContact O-CB 3.24Å; V266-A270 PolarHBondContact O-N 2.95Å; V266-A270 VanDerWaalsContact O-N 3.09Å
271	L	31.2	Very low	32.9	Very low	131 Å²	131	128 Å²	128	69%	0.686	71%	0.709	S	S	*	*	H	α-helix	trans	-74.2	-27.1	175.6	-73.3	-173.1	0	0	0	113	A267	A267-L271 PolarHBondContact O-N 2.84Å
272	L	34.8	Very low	32.7	Very low	157 Å²	157	130.2 Å²	130.2	82%	0.822	73%	0.726	S	S	*	*	H	α-helix	trans	-81.5	-21.5	175	-73	171.2	0	0	0	113.4	E268 E269	E268-L272 PolarHBondContact O-N 2.95Å; E269-L272 PolarHBondContact O-N 3.42Å
273	A	34.2	Very low	32.1	Very low	75 Å²	75	134 Å²	134	62%	0.62	73%	0.731	S	S	*	*	S	Bend	trans	-89.3	-3.9	180	0	0	0	0	0	114.6	E269 E275	E269-A273 PolarHBondContact O-N 3.31Å; A273-E275 VanDerWaalsContact C-N 3.28Å; A273-E275 PolarHBondContact O-N 3.31Å
274	Q	28.7	Very low	31.5	Very low	158 Å²	158	132.8 Å²	132.8	74%	0.738	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-3.3	-174.6	-99.9	-168.5	-73.8	0	0	115.8
275	E	30.4	Very low	31.2	Very low	177 Å²	177	134.6 Å²	134.6	83%	0.827	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-4.7	-175.3	-148.8	167.4	-161.7	0	0	115.4	A273	A273-E275 VanDerWaalsContact C-N 3.28Å; A273-E275 PolarHBondContact O-N 3.31Å
276	N	28.5	Very low	30.7	Very low	142 Å²	142	139.3 Å²	139.3	76%	0.759	76%	0.758	S	S	*	*	S	Bend	trans	-144.9	109.4	177.3	-87.6	-38.6	0	0	0	112.5
277	E	29.9	Very low	30.1	Very low	193 Å²	193	142.6 Å²	142.6	90%	0.902	77%	0.773	S	S	*	*				151.1	94.6	129.4	-82.6	-176.5	163.6	0	0	111
278	N	24.8	Very low	29.7	Very low	157 Å²	157	146.5 Å²	146.5	84%	0.84	79%	0.791	S	S	*	*			trans	-76.7	147.2	156.3	-82.6	-35.8	0	0	0	109.7
279	T	26.1	Very low	29.1	Very low	137 Å²	137	149.4 Å²	149.4	84%	0.84	80%	0.796	S	S	*	*			trans	83.4	101.4	154	-3.1	0	0	0	0	118.1
280	A	29.3	Very low	28.9	Very low	96 Å²	96	148 Å²	148	79%	0.793	80%	0.799	S	S	*	*				-174.3	127.7	118.6	0	0	0	0	0	111.8
281	L	23.7	Very low	28.5	Very low	180 Å²	180	152.4 Å²	152.4	94%	0.942	82%	0.816	S	S	*	*			trans	-72.5	125.6	179.3	-74.6	142.8	0	0	0	111.9
282	V	29.2	Very low	28.5	Very low	142 Å²	142	151.2 Å²	151.2	86%	0.861	83%	0.825	S	S	*	*			trans	-131.2	129.6	165.2	-177.7	0	0	0	0	110
283	K	25.8	Very low	28.3	Very low	192 Å²	192	149.6 Å²	149.6	84%	0.835	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-74.1	157.4	-173.5	-75.1	178.3	176.6	178.4	0	113.1
284	P	27.9	Very low	28.4	Very low	131 Å²	131	150 Å²	150	85%	0.851	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-82.7	133.8	-165.1	1.6	17.1	0	0	0	112.2
285	L	27.5	Very low	28.6	Very low	177 Å²	177	149.3 Å²	149.3	93%	0.927	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-101.1	136.1	167.4	-83.7	165	0	0	0	110
286	E	27.1	Very low	28.9	Very low	190 Å²	190	146.6 Å²	146.6	89%	0.888	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-77.2	136.8	-162.5	-156.1	158.3	176.6	0	0	113.1	T288	E286-T288 PolarHBondContact O-N 2.75Å
287	N	27.3	Very low	29.4	Very low	144 Å²	144	147.7 Å²	147.7	77%	0.77	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-64.1	116.3	-175.9	-84.3	-40.2	0	0	0	112.6
288	T	26.5	Very low	29.8	Very low	138 Å²	138	145.5 Å²	145.5	85%	0.847	81%	0.805	S	S	*	*			trans	-122.1	94.9	152.8	16	0	0	0	0	108.5	E286 P290	E286-T288 PolarHBondContact O-N 2.75Å; T288-P290 WeakPolarHBondContact O-CD 3.28Å
289	R	27	Very low	30.3	Very low	216 Å²	216	140.7 Å²	140.7	82%	0.815	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-72	121.6	169.6	-74.6	180	-179.4	174	-0.5	108.5	N291	R289-N291 PolarHBondContact O-N 3.38Å
290	P	30.4	Very low	30.9	Very low	121 Å²	121	136.6 Å²	136.6	79%	0.786	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-78.7	119.1	163.9	22.9	-13.6	0	0	0	108.2	T288 A292	T288-P290 WeakPolarHBondContact O-CD 3.28Å; P290-A292 PolarHBondContact O-N 3Å
291	N	28.2	Very low	31.4	Very low	147 Å²	147	139 Å²	139	79%	0.786	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-53.6	120.2	172.2	-72.3	-26.8	0	0	0	109.7	R289 T293	R289-N291 PolarHBondContact O-N 3.38Å; N291-T293 VanDerWaalsContact C-N 3.3Å; N291-T293 PolarHBondContact O-N 2.92Å
292	A	31.5	Very low	32.3	Very low	106 Å²	106	134.4 Å²	134.4	88%	0.876	74%	0.736	S	S	*	*			trans	-65.3	89.9	170.6	0	0	0	0	0	108.9	P290 A294	P290-A292 PolarHBondContact O-N 3Å; A292-A294 PolarHBondContact O-N 3.28Å
293	T	30.7	Very low	33.2	Very low	123 Å²	123	130.2 Å²	130.2	76%	0.755	71%	0.709	S	S	*	*			trans	-66	121.8	171.7	44.3	0	0	0	0	108.9	N291 M295	N291-T293 VanDerWaalsContact C-N 3.3Å; N291-T293 PolarHBondContact O-N 2.92Å; T293-M295 PolarHBondContact O-N 2.87Å
294	A	36.1	Very low	34.1	Very low	84 Å²	84	123.4 Å²	123.4	69%	0.694	68%	0.681	S	S	*	*			trans	-41.3	130.1	172.1	0	0	0	0	0	111.2	A292 N296	A292-A294 PolarHBondContact O-N 3.28Å; A294-N296 PolarHBondContact O-N 2.96Å
295	M	33.7	Very low	35.1	Very low	143 Å²	143	123.6 Å²	123.6	70%	0.704	67%	0.669	S	S	*	*			trans	-45.1	110.9	176.9	-73.2	171.3	65.3	0	0	110.6	T293 H297	T293-M295 PolarHBondContact O-N 2.87Å; M295-H297 PolarHBondContact O-N 3.29Å; M295-H297 VanDerWaalsContact O-N 3.12Å
296	N	35.5	Very low	36	Very low	119 Å²	119	123.3 Å²	123.3	64%	0.636	66%	0.655	S	S	*	*			trans	-64.8	115.2	178.8	-80.4	-25	0	0	0	109	A294 E298 A299	A294-N296 PolarHBondContact O-N 2.96Å; N296-E298 PolarHBondContact O-N 3.17Å; N296-A299 PolarHBondContact O-N 3.11Å
297	H	39.7	Very low	37.2	Very low	166 Å²	166	116.2 Å²	116.2	77%	0.769	62%	0.623	S	S	*	*	H	α-helix	trans	-48	-14.1	172.1	-104.6	-84.3	0	0	0	114.5	M295	M295-H297 PolarHBondContact O-N 3.29Å; M295-H297 VanDerWaalsContact O-N 3.12Å
298	E	37.2	Very low	38.2	Very low	146 Å²	146	112.8 Å²	112.8	68%	0.682	61%	0.607	S	S	*	*	H	α-helix	trans	-75.3	-33.8	175.6	-73.1	-174.8	147.3	0	0	114.2	N296 V300 K301 C302	N296-E298 PolarHBondContact O-N 3.17Å; E298-V300 PolarHBondContact O-N 3.21Å; E298-K301 PolarHBondContact O-N 3.46Å; E298-C302 PolarHBondContact O-N 3.06Å
299	A	35.4	Very low	39.3	Very low	57 Å²	57	110 Å²	110	47%	0.471	59%	0.586	S	S	.	*	H	α-helix	trans	-64.5	-42.8	-177.3	0	0	0	0	0	111.7	N296 K301 C302 D303	N296-A299 PolarHBondContact O-N 3.11Å; A299-K301 VanDerWaalsContact C-N 3.34Å; A299-K301 PolarHBondContact O-N 3.44Å; A299-C302 WeakPolarHBondContact O-CB 3.24Å; A299-C302 PolarHBondContact O-N 3.48Å; A299-D303 PolarHBondContact O-N 3.09Å
300	V	40	Very low	40.3	Very low	50 Å²	50	105.1 Å²	105.1	30%	0.303	57%	0.574	S	S	.	*	H	α-helix	trans	-65.5	-35.7	177.2	-179.3	0	0	0	0	111.9	E298 C302 I304	E298-V300 PolarHBondContact O-N 3.21Å; V300-C302 VanDerWaalsContact C-N 3.35Å; V300-I304 HydrophobicContact CG1-CD1 4.22Å; V300-I304 WeakPolarHBondContact O-CG1 3.23Å; V300-I304 PolarHBondContact O-N 2.84Å
301	K	40	Very low	41.1	Very low	148 Å²	148	100.6 Å²	100.6	64%	0.643	55%	0.545	S	S	*	.	H	α-helix	trans	-66.2	-38.2	174.7	-73.4	179.8	179.9	177.3	0	111.7	E298 A299 F305	E298-K301 PolarHBondContact O-N 3.46Å; A299-K301 VanDerWaalsContact C-N 3.34Å; A299-K301 PolarHBondContact O-N 3.44Å; K301-F305 WeakPolarHBondContact O-CB 3.21Å; K301-F305 PolarHBondContact O-N 3.37Å
302	C	40.7	Very low	41.9	Very low	83 Å²	83	97.7 Å²	97.7	56%	0.561	53%	0.528	S	S	*	.	H	α-helix	trans	-63.8	-42.4	179.8	-101	0	0	0	0	112.8	E298 A299 V300 R306	E298-C302 PolarHBondContact O-N 3.06Å; A299-C302 WeakPolarHBondContact O-CB 3.24Å; A299-C302 PolarHBondContact O-N 3.48Å; V300-C302 VanDerWaalsContact C-N 3.35Å; C302-R306 VanDerWaalsContact O-CB 3.3Å; C302-R306 WeakPolarHBondContact O-CB 3.37Å; C302-R306 PolarHBondContact O-N 2.85Å
303	D	48.2	Very low	42.4	Very low	54 Å²	54	101.3 Å²	101.3	29%	0.289	52%	0.519	S	S	.	.	H	α-helix	trans	-67	-41.7	179	-80.4	-17.2	0	0	0	112.1	A299 R306 I307 S658	A299-D303 PolarHBondContact O-N 3.09Å; D303-R306 PolarHBondContact O-N 3.44Å; D303-I307 VanDerWaalsContact O-CG1 3.24Å; D303-I307 WeakPolarHBondContact O-CG1 3.22Å; D303-I307 PolarHBondContact O-N 2.73Å; D303-S658 WeakPolarHBondContact OD2-CB 3.5Å; D303-S658 PolarHBondContact OD2-OG 3.19Å
304	I	46	Very low	43.1	Very low	48 Å²	48	103.5 Å²	103.5	25%	0.246	52%	0.515	C	S	.	.	H	α-helix	trans	-64.3	-46.2	178.1	-65.4	170.1	0	0	0	110.6	V300 R306 I307 V308 L469	V300-I304 HydrophobicContact CG1-CD1 4.22Å; V300-I304 WeakPolarHBondContact O-CG1 3.23Å; V300-I304 PolarHBondContact O-N 2.84Å; I304-R306 VanDerWaalsContact C-N 3.34Å; I304-R306 PolarHBondContact O-N 2.95Å; I304-I307 PolarHBondContact O-N 3.06Å; I304-V308 WeakPolarHBondContact O-CG2 3.43Å; I304-V308 PolarHBondContact O-N 3.4Å; I304-L469 HydrophobicContact CG2-CD2 3.58Å
305	F	48.3	Very low	43.3	Very low	135 Å²	135	104.7 Å²	104.7	59%	0.592	51%	0.508	S	S	*	.	H	α-helix	trans	-65	-38.5	178.1	-168.6	-108.7	0	0	0	111.6	K301 V308 L309	K301-F305 WeakPolarHBondContact O-CB 3.21Å; K301-F305 PolarHBondContact O-N 3.37Å; F305-V308 PolarHBondContact O-N 3.42Å; F305-L309 HydrophobicContact CD1-CD1 3.59Å; F305-L309 HydrophobicContact CD1-CG 4.21Å; F305-L309 HydrophobicContact CE1-CD1 3.24Å; F305-L309 HydrophobicContact CE1-CG 3.97Å; F305-L309 HydrophobicContact CG-CD1 4.47Å; F305-L309 HydrophobicContact CZ-CD1 3.85Å; F305-L309 HydrophobicContact CZ-CD2 4.46Å; F305-L309 HydrophobicContact CZ-CG 4.18Å; F305-L309 WeakPolarHBondContact O-CB 3.25Å; F305-L309 WeakPolarHBondContact O-CG 3.26Å; F305-L309 PolarHBondContact O-N 3.46Å
306	R	46.6	Very low	43.7	Very low	172 Å²	172	102 Å²	102	65%	0.649	50%	0.504	S	S	*	.	H	α-helix	trans	-62.5	-43	172.4	-97.7	-176.4	150.6	168.5	-3.8	112.6	C302 D303 I304 L309 M310	C302-R306 VanDerWaalsContact O-CB 3.3Å; C302-R306 WeakPolarHBondContact O-CB 3.37Å; C302-R306 PolarHBondContact O-N 2.85Å; D303-R306 PolarHBondContact O-N 3.44Å; I304-R306 VanDerWaalsContact C-N 3.34Å; I304-R306 PolarHBondContact O-N 2.95Å; R306-L309 PolarHBondContact O-N 3.38Å; R306-M310 VanDerWaalsContact O-CB 3.28Å; R306-M310 WeakPolarHBondContact O-CB 3.29Å; R306-M310 VanDerWaalsContact O-CG 3.24Å; R306-M310 WeakPolarHBondContact O-CG 3.49Å; R306-M310 PolarHBondContact O-N 3.26Å
307	I	51.6	Low	43.8	Very low	41 Å²	41	99 Å²	99	21%	0.21	50%	0.495	C	S	.	.	H	α-helix	trans	-63	-48	177.7	-69	163	0	0	0	109.8	D303 I304 L309 M310 V311 L655	D303-I307 VanDerWaalsContact O-CG1 3.24Å; D303-I307 WeakPolarHBondContact O-CG1 3.22Å; D303-I307 PolarHBondContact O-N 2.73Å; I304-I307 PolarHBondContact O-N 3.06Å; I307-L309 VanDerWaalsContact C-N 3.35Å; I307-L309 PolarHBondContact O-N 2.97Å; I307-M310 PolarHBondContact O-N 3.41Å; I307-V311 HydrophobicContact CG2-CG2 4.5Å; I307-V311 WeakPolarHBondContact O-CB 3.3Å; I307-V311 WeakPolarHBondContact O-CG2 3.24Å; I307-V311 PolarHBondContact O-N 2.88Å; I307-L655 HydrophobicContact CG1-CD2 4.45Å
308	V	48.2	Very low	43.4	Very low	71 Å²	71	96.8 Å²	96.8	43%	0.43	49%	0.493	S	S	.	.	H	α-helix	trans	-60.3	-44.8	177.8	174.2	0	0	0	0	111	I304 F305 V311 I312	I304-V308 WeakPolarHBondContact O-CG2 3.43Å; I304-V308 PolarHBondContact O-N 3.4Å; F305-V308 PolarHBondContact O-N 3.42Å; V308-V311 PolarHBondContact O-N 3.47Å; V308-I312 HydrophobicContact CG1-CD1 3.78Å; V308-I312 VanDerWaalsContact O-CG1 3.24Å; V308-I312 WeakPolarHBondContact O-CG1 3.36Å; V308-I312 PolarHBondContact O-N 2.83Å
309	L	51.1	Low	43.2	Very low	79 Å²	79	97.7 Å²	97.7	41%	0.414	50%	0.498	S	S	.	.	H	α-helix	trans	-68.2	-39.3	176.8	-77.7	-179.3	0	0	0	113.5	F305 R306 I307 V311 I312 W313	F305-L309 HydrophobicContact CD1-CD1 3.59Å; F305-L309 HydrophobicContact CD1-CG 4.21Å; F305-L309 HydrophobicContact CE1-CD1 3.24Å; F305-L309 HydrophobicContact CE1-CG 3.97Å; F305-L309 HydrophobicContact CG-CD1 4.47Å; F305-L309 HydrophobicContact CZ-CD1 3.85Å; F305-L309 HydrophobicContact CZ-CD2 4.46Å; F305-L309 HydrophobicContact CZ-CG 4.18Å; F305-L309 WeakPolarHBondContact O-CB 3.25Å; F305-L309 WeakPolarHBondContact O-CG 3.26Å; F305-L309 PolarHBondContact O-N 3.46Å; R306-L309 PolarHBondContact O-N 3.38Å; I307-L309 VanDerWaalsContact C-N 3.35Å; I307-L309 PolarHBondContact O-N 2.97Å; L309-V311 VanDerWaalsContact C-N 3.26Å; L309-V311 PolarHBondContact O-N 2.97Å; L309-I312 PolarHBondContact O-N 3.4Å; L309-W313 WeakPolarHBondContact O-CB 3.27Å; L309-W313 PolarHBondContact O-N 3.43Å
310	M	46.8	Very low	43.4	Very low	114 Å²	114	101.3 Å²	101.3	56%	0.562	52%	0.517	S	S	*	.	H	α-helix	trans	-64.3	-36.6	175.8	-77.7	-175.9	95.9	0	0	110.7	R306 I307 Y314	R306-M310 VanDerWaalsContact O-CB 3.28Å; R306-M310 WeakPolarHBondContact O-CB 3.29Å; R306-M310 VanDerWaalsContact O-CG 3.24Å; R306-M310 WeakPolarHBondContact O-CG 3.49Å; R306-M310 PolarHBondContact O-N 3.26Å; I307-M310 PolarHBondContact O-N 3.41Å; M310-Y314 VanDerWaalsContact O-CB 3.23Å; M310-Y314 WeakPolarHBondContact O-CB 3.35Å; M310-Y314 PolarHBondContact O-N 3.15Å
311	V	47.6	Very low	43	Very low	27 Å²	27	103.9 Å²	103.9	16%	0.164	54%	0.536	C	S	.	.	H	α-helix	trans	-66.7	-47.7	173.5	169.8	0	0	0	0	110.9	I307 V308 L309 W313 Y314 I315 L642	I307-V311 HydrophobicContact CG2-CG2 4.5Å; I307-V311 WeakPolarHBondContact O-CB 3.3Å; I307-V311 WeakPolarHBondContact O-CG2 3.24Å; I307-V311 PolarHBondContact O-N 2.88Å; V308-V311 PolarHBondContact O-N 3.47Å; L309-V311 VanDerWaalsContact C-N 3.26Å; L309-V311 PolarHBondContact O-N 2.97Å; V311-W313 VanDerWaalsContact C-N 3.31Å; V311-W313 PolarHBondContact O-N 3Å; V311-Y314 PolarHBondContact O-N 2.94Å; V311-I315 HydrophobicContact CG1-CD1 3.77Å; V311-I315 VanDerWaalsContact O-CG1 3.24Å; V311-I315 WeakPolarHBondContact O-CG1 3.25Å; V311-I315 PolarHBondContact O-N 3.38Å; V311-L642 HydrophobicContact CB-CD2 4.43Å; V311-L642 HydrophobicContact CG1-CD1 3.72Å; V311-L642 HydrophobicContact CG1-CD2 3.59Å; V311-L642 HydrophobicContact CG1-CG 4.31Å; V311-L642 HydrophobicContact CG2-CD1 4.33Å; V311-L642 HydrophobicContact CG2-CD2 3.9Å
312	I	45.2	Very low	42.7	Very low	85 Å²	85	101.6 Å²	101.6	44%	0.436	55%	0.546	S	S	.	.	H	α-helix	trans	-60.3	-43.4	176	-68.6	165.4	0	0	0	110.6	V308 L309 I315 S316	V308-I312 HydrophobicContact CG1-CD1 3.78Å; V308-I312 VanDerWaalsContact O-CG1 3.24Å; V308-I312 WeakPolarHBondContact O-CG1 3.36Å; V308-I312 PolarHBondContact O-N 2.83Å; L309-I312 PolarHBondContact O-N 3.4Å; I312-I315 PolarHBondContact O-N 3.33Å; I312-S316 VanDerWaalsContact O-CB 3.28Å; I312-S316 WeakPolarHBondContact O-CB 3.31Å; I312-S316 PolarHBondContact O-N 3.02Å; I312-S316 PolarHBondContact O-OG 3.03Å
313	W	42.4	Very low	42.1	Very low	183 Å²	183	109.5 Å²	109.5	69%	0.693	56%	0.564	S	S	*	*	H	α-helix	trans	-64.6	-42.9	178.3	-175.8	78.1	0	0	0	111.5	L309 V311 S316 A317	L309-W313 WeakPolarHBondContact O-CB 3.27Å; L309-W313 PolarHBondContact O-N 3.43Å; V311-W313 VanDerWaalsContact C-N 3.31Å; V311-W313 PolarHBondContact O-N 3Å; W313-S316 PolarHBondContact O-N 2.76Å; W313-A317 WeakPolarHBondContact O-CB 3.25Å; W313-A317 PolarHBondContact O-N 3.22Å
314	Y	44.7	Very low	41	Very low	168 Å²	168	118.6 Å²	118.6	66%	0.659	59%	0.594	S	S	*	*	H	α-helix	trans	-65.7	-39.6	177	-172.6	-97.3	0	0	0	112.4	M310 V311	M310-Y314 VanDerWaalsContact O-CB 3.23Å; M310-Y314 WeakPolarHBondContact O-CB 3.35Å; M310-Y314 PolarHBondContact O-N 3.15Å; V311-Y314 PolarHBondContact O-N 2.94Å
315	I	40.5	Very low	40.1	Very low	109 Å²	109	128.1 Å²	128.1	56%	0.559	63%	0.627	S	S	*	*	H	α-helix	trans	-65.4	-42.8	174.6	-67	166.3	0	0	0	110.3	V311 I312 T318	V311-I315 HydrophobicContact CG1-CD1 3.77Å; V311-I315 VanDerWaalsContact O-CG1 3.24Å; V311-I315 WeakPolarHBondContact O-CG1 3.25Å; V311-I315 PolarHBondContact O-N 3.38Å; I312-I315 PolarHBondContact O-N 3.33Å; I315-T318 PolarHBondContact O-OG1 3.27Å
316	S	41.8	Very low	38.9	Very low	88 Å²	88	126.5 Å²	126.5	62%	0.615	63%	0.632	S	S	*	*	H	α-helix	trans	-74.7	-25.1	-177.8	-52.6	0	0	0	0	113.4	I312 W313 T318	I312-S316 VanDerWaalsContact O-CB 3.28Å; I312-S316 WeakPolarHBondContact O-CB 3.31Å; I312-S316 PolarHBondContact O-N 3.02Å; I312-S316 PolarHBondContact O-OG 3.03Å; W313-S316 PolarHBondContact O-N 2.76Å; S316-T318 PolarHBondContact O-N 3.33Å; S316-T318 VanDerWaalsContact O-N 3.14Å
317	A	38	Very low	38.1	Very low	55 Å²	55	125.5 Å²	125.5	46%	0.455	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.5	14.3	-178.3	0	0	0	0	0	113.9	W313 E319	W313-A317 WeakPolarHBondContact O-CB 3.25Å; W313-A317 PolarHBondContact O-N 3.22Å; A317-E319 PolarHBondContact O-N 3Å
318	T	31.4	Very low	36.7	Very low	119 Å²	119	133 Å²	133	73%	0.73	67%	0.666	S	S	*	*			trans	-79.5	56.6	171	48.2	0	0	0	0	111.4	I315 S316	I315-T318 PolarHBondContact O-OG1 3.27Å; S316-T318 PolarHBondContact O-N 3.33Å; S316-T318 VanDerWaalsContact O-N 3.14Å
319	E	32.5	Very low	35.8	Very low	166 Å²	166	138.6 Å²	138.6	78%	0.776	68%	0.68	S	S	*	*			trans	-101.8	116.5	167.8	-136.2	162.3	-154.8	0	0	108.6	A317 S321	A317-E319 PolarHBondContact O-N 3Å; E319-S321 PolarHBondContact O-N 2.95Å
320	P	40	Very low	34.6	Very low	133 Å²	133	138.9 Å²	138.9	86%	0.864	69%	0.689	S	S	*	*			trans	-82.3	80.9	-166.2	31.4	-33.4	0	0	0	111.3
321	S	31.3	Very low	33.7	Very low	103 Å²	103	140.3 Å²	140.3	72%	0.72	70%	0.698	S	S	*	*			trans	-152.9	76.8	171.8	49.8	0	0	0	0	112.5	E319	E319-S321 PolarHBondContact O-N 2.95Å
322	A	33.6	Very low	32.8	Very low	101 Å²	101	146.3 Å²	146.3	84%	0.835	72%	0.724	S	S	*	*			trans	-157.7	115.4	152.6	0	0	0	0	0	111.9
323	R	28.2	Very low	32	Very low	249 Å²	249	149 Å²	149	94%	0.94	74%	0.74	S	S	*	*			trans	-38.9	130.1	176.3	-97.1	167.7	172.4	169.9	-2.1	115.8	R325	R323-R325 PolarHBondContact O-N 3.42Å
324	R	25.6	Very low	31.7	Very low	245 Å²	245	145 Å²	145	93%	0.925	74%	0.735	S	S	*	*			trans	-4.6	112.3	148	-71.9	177.3	-178.5	176.8	0.3	115.7
325	R	26.8	Very low	31	Very low	248 Å²	248	144.7 Å²	144.7	94%	0.936	74%	0.738	S	S	*	*			trans	-115.9	106.1	134.9	-93.9	-176.5	-179.4	168.3	1.2	108.4	R323 H327	R323-R325 PolarHBondContact O-N 3.42Å; R325-H327 PolarHBondContact O-N 3.28Å; R325-H327 VanDerWaalsContact O-N 3.1Å
326	S	24.2	Very low	30.3	Very low	101 Å²	101	146.9 Å²	146.9	71%	0.706	74%	0.74	S	S	*	*			trans	-64	100.9	175.4	152.6	0	0	0	0	109.6
327	H	28.4	Very low	29.9	Very low	150 Å²	150	148.1 Å²	148.1	69%	0.694	75%	0.746	S	S	*	*			trans	-114.6	98.5	156.6	-92.2	-2.3	0	0	0	107.8	R325 Y329	R325-H327 PolarHBondContact O-N 3.28Å; R325-H327 VanDerWaalsContact O-N 3.1Å; H327-Y329 VanDerWaalsContact C-N 3.34Å; H327-Y329 HydrophobicContact CB-CD2 3.79Å; H327-Y329 HydrophobicContact CB-CE2 3.67Å; H327-Y329 AromaticContact CD2-CE2 3.91Å; H327-Y329 AromaticContact CG-CE2 3.92Å; H327-Y329 PolarHBondContact O-N 3Å
328	K	23.8	Very low	29.4	Very low	200 Å²	200	153.5 Å²	153.5	87%	0.87	77%	0.767	S	S	*	*			trans	-58.3	97.4	165.9	-83.9	179.7	172.5	179.7	0	107.6
329	Y	28	Very low	29.3	Very low	187 Å²	187	157.6 Å²	157.6	73%	0.733	77%	0.769	S	S	*	*			trans	-116.4	124.6	161.7	-75.1	-77.1	0	0	0	107.7	H327 L331	H327-Y329 VanDerWaalsContact C-N 3.34Å; H327-Y329 HydrophobicContact CB-CD2 3.79Å; H327-Y329 HydrophobicContact CB-CE2 3.67Å; H327-Y329 AromaticContact CD2-CE2 3.91Å; H327-Y329 AromaticContact CG-CE2 3.92Å; H327-Y329 PolarHBondContact O-N 3Å; Y329-L331 PolarHBondContact O-N 3.44Å
330	S	26.7	Very low	29.2	Very low	85 Å²	85	154.9 Å²	154.9	59%	0.594	76%	0.76	S	S	*	*			trans	-50.5	131.5	-179.8	-176.7	0	0	0	0	110.7	E332	S330-E332 PolarHBondContact O-N 3.27Å; S330-E332 PolarHBondContact OG-OE2 2.93Å
331	L	27.4	Very low	28.9	Very low	145 Å²	145	154.6 Å²	154.6	76%	0.759	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-64.6	0.2	179.1	-92.6	151	0	0	0	114	Y329 N333 V334	Y329-L331 PolarHBondContact O-N 3.44Å; L331-N333 VanDerWaalsContact C-N 3.33Å; L331-N333 PolarHBondContact O-N 3.49Å; L331-V334 HydrophobicContact CD2-CG2 4.2Å; L331-V334 PolarHBondContact O-N 3.34Å
332	E	28.2	Very low	28.8	Very low	153 Å²	153	158.9 Å²	158.9	72%	0.715	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-68.5	-25.2	-178.7	-85.1	176	134.1	0	0	114.5	S330 V334	S330-E332 PolarHBondContact O-N 3.27Å; S330-E332 PolarHBondContact OG-OE2 2.93Å; E332-V334 VanDerWaalsContact C-N 3.29Å; E332-V334 PolarHBondContact O-N 2.9Å
333	N	28.3	Very low	28.4	Very low	141 Å²	141	162.1 Å²	162.1	75%	0.754	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-85.4	3.2	-178.4	-72.8	-16	0	0	0	114.5	L331	L331-N333 VanDerWaalsContact C-N 3.33Å; L331-N333 PolarHBondContact O-N 3.49Å
334	V	35.6	Very low	28.4	Very low	99 Å²	99	161 Å²	161	60%	0.6	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-77.6	-25.2	176.7	176.4	0	0	0	0	111.9	L331 E332	L331-V334 HydrophobicContact CD2-CG2 4.2Å; L331-V334 PolarHBondContact O-N 3.34Å; E332-V334 VanDerWaalsContact C-N 3.29Å; E332-V334 PolarHBondContact O-N 2.9Å
335	F	31.4	Very low	28.8	Very low	162 Å²	162	158 Å²	158	71%	0.711	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	-14	-172.2	-78.7	-79.1	0	0	0	116.1
336	Y	26.2	Very low	28.7	Very low	155 Å²	155	154.8 Å²	154.8	61%	0.608	75%	0.748	S	S	*	*			trans	-147.6	88.2	-178.3	-63.8	-80.9	0	0	0	112.1	N338	Y336-N338 PolarHBondContact O-N 3.34Å
337	P	32.9	Very low	29.1	Very low	113 Å²	113	153.8 Å²	153.8	73%	0.734	74%	0.741	S	S	*	*			trans	-65.9	111.6	157.8	27.8	-28.1	0	0	0	106.9	R339	P337-R339 PolarHBondContact O-N 2.9Å
338	N	27.5	Very low	29.3	Very low	169 Å²	169	153 Å²	153	90%	0.904	74%	0.741	S	S	*	*			trans	-35	99.9	176.6	-128.1	-12.8	0	0	0	111	Y336 D340	Y336-N338 PolarHBondContact O-N 3.34Å; N338-D340 PolarHBondContact O-N 3.15Å
339	R	29.8	Very low	29.6	Very low	204 Å²	204	147.4 Å²	147.4	77%	0.77	73%	0.728	S	S	*	*			trans	-79	103.2	174	-99.7	-176.2	172.7	175	-2.8	107.2	P337 P341	P337-R339 PolarHBondContact O-N 2.9Å; R339-P341 WeakPolarHBondContact O-CD 3.29Å
340	D	29.7	Very low	29.4	Very low	109 Å²	109	145 Å²	145	58%	0.583	72%	0.722	S	S	*	*			trans	-58.6	120.2	170.7	-155.8	-16.6	0	0	0	109.1	N338 K342 M343	N338-D340 PolarHBondContact O-N 3.15Å; D340-K342 PolarHBondContact O-N 2.83Å; D340-M343 PolarHBondContact O-N 2.95Å; D340-M343 VanDerWaalsContact O-N 3.08Å
341	P	33.3	Very low	29.3	Very low	127 Å²	127	147.9 Å²	147.9	83%	0.825	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-3	-171.1	19.9	-30.9	0	0	0	115.1	R339	R339-P341 WeakPolarHBondContact O-CD 3.29Å
342	K	29	Very low	29.2	Very low	193 Å²	193	149.7 Å²	149.7	84%	0.839	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-2.7	174.2	-69	-172.3	178.1	-177.1	0	115	D340 R344	D340-K342 PolarHBondContact O-N 2.83Å; K342-R344 VanDerWaalsContact C-N 3.27Å; K342-R344 PolarHBondContact O-N 3.24Å
343	M	26.5	Very low	29.1	Very low	169 Å²	169	150.7 Å²	150.7	83%	0.833	74%	0.743	S	S	*	*			trans	-84.5	67.6	170.8	-74.9	-165.9	-175.1	0	0	111.7	D340 H345	D340-M343 PolarHBondContact O-N 2.95Å; D340-M343 VanDerWaalsContact O-N 3.08Å; M343-H345 PolarHBondContact O-N 3.49Å
344	R	27.7	Very low	29	Very low	227 Å²	227	149.3 Å²	149.3	86%	0.857	75%	0.745	S	S	*	*			trans	-67.4	121.8	153	-88	-170.8	-174.7	-162	3.9	107.5	K342 K346	K342-R344 VanDerWaalsContact C-N 3.27Å; K342-R344 PolarHBondContact O-N 3.24Å; R344-K346 PolarHBondContact O-N 3.48Å
345	H	32.7	Very low	28.6	Very low	181 Å²	181	156.2 Å²	156.2	84%	0.838	76%	0.76	S	S	*	*			trans	12.9	81.7	160.3	-81.4	-92.6	0	0	0	115.4	M343 S347	M343-H345 PolarHBondContact O-N 3.49Å; H345-S347 PolarHBondContact O-N 2.79Å
346	K	26.2	Very low	28.4	Very low	181 Å²	181	158 Å²	158	79%	0.787	77%	0.771	S	S	*	*			trans	-74.6	83.6	147.9	-75.9	-171.9	178.5	-176.3	0	106.3	R344 L348	R344-K346 PolarHBondContact O-N 3.48Å; K346-L348 PolarHBondContact O-N 3.24Å
347	S	31.9	Very low	28.4	Very low	80 Å²	80	162.1 Å²	162.1	56%	0.559	79%	0.785	S	S	*	*			trans	-47.1	129.2	156.4	178.7	0	0	0	0	106.9	H345 S349	H345-S347 PolarHBondContact O-N 2.79Å; S347-S349 PolarHBondContact O-N 3.01Å
348	L	31.7	Very low	28.1	Very low	132 Å²	132	162.4 Å²	162.4	69%	0.691	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	44.5	-175.5	-82.8	161	0	0	0	112.5	K346	K346-L348 PolarHBondContact O-N 3.24Å
349	S	30.9	Very low	28.2	Very low	84 Å²	84	159.6 Å²	159.6	59%	0.587	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	-7.4	167.5	55.5	0	0	0	0	113.5	S347	S347-S349 PolarHBondContact O-N 3.01Å
350	H	24.4	Very low	28.1	Very low	135 Å²	135	153.8 Å²	153.8	63%	0.625	79%	0.787	S	S	*	*			trans	-121	78.8	-176.5	-74.5	-88.6	0	0	0	113.5
351	L	24.7	Very low	28.1	Very low	146 Å²	146	158.9 Å²	158.9	76%	0.764	80%	0.804	S	S	*	*	S	Bend	trans	-161.9	79.8	158.4	-111.7	139.3	0	0	0	105.9
352	H	24.9	Very low	27.9	Very low	183 Å²	183	157.7 Å²	157.7	85%	0.847	80%	0.799	S	S	*	*			trans	176.8	61	161.1	-102.4	87	0	0	0	112.2
353	I	26.2	Very low	27.7	Very low	175 Å²	175	158.6 Å²	158.6	90%	0.897	80%	0.803	S	S	*	*			trans	-147.6	77	151	-52	-179.5	0	0	0	107.9
354	S	25.3	Very low	27.7	Very low	112 Å²	112	159.6 Å²	159.6	78%	0.783	81%	0.806	S	S	*	*	S	Bend	trans	-165.7	80.3	157	55.5	0	0	0	0	109.7
355	R	27.4	Very low	27.6	Very low	244 Å²	244	159.7 Å²	159.7	92%	0.921	81%	0.806	S	S	*	*			trans	166.6	83.5	150.9	-97.2	169.4	176.4	-169.1	-0.4	108.9
356	Q	27.1	Very low	27.2	Very low	199 Å²	199	157.8 Å²	157.8	93%	0.93	81%	0.807	S	S	*	*			trans	-143	99.5	147.5	-110.8	172	-15	0	0	107
357	R	26.3	Very low	27.1	Very low	242 Å²	242	157.4 Å²	157.4	91%	0.913	81%	0.808	S	S	*	*			trans	-74.4	134.9	177.6	-123.7	174.8	178.8	174	-2.7	108.2
358	S	27.4	Very low	27	Very low	119 Å²	119	159 Å²	159	83%	0.832	82%	0.819	S	S	*	*			trans	-15.8	115.1	167.9	59.6	0	0	0	0	116.8
359	S	28.5	Very low	26.9	Very low	109 Å²	109	160.2 Å²	160.2	76%	0.762	83%	0.825	S	S	*	*			trans	-109.8	127.5	158.7	55.7	0	0	0	0	109.1
360	G	29.5	Very low	26.7	Very low	82 Å²	82	165 Å²	165	85%	0.845	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-58.8	142.8	-163.6	0	0	0	0	0	116.7
361	F	29.7	Very low	26.8	Very low	216 Å²	216	162.8 Å²	162.8	95%	0.947	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-78.5	119.2	176.8	-94.9	-98.7	0	0	0	111.8
362	S	27.3	Very low	27	Very low	103 Å²	103	162.3 Å²	162.3	72%	0.72	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-83.6	118	160.1	57.2	0	0	0	0	109.6	Q364	S362-Q364 PolarHBondContact O-N 3.38Å
363	K	26.6	Very low	27.2	Very low	212 Å²	212	162.4 Å²	162.4	92%	0.922	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-52.9	120.6	174.1	-77.6	172.6	172.2	173.5	0	111.7
364	Q	26.1	Very low	27.4	Very low	190 Å²	190	162.8 Å²	162.8	89%	0.888	83%	0.825	S	S	*	*			trans	-140.9	142.6	158.8	-119.3	164	-24.4	0	0	111.5	S362	S362-Q364 PolarHBondContact O-N 3.38Å
365	R	24.9	Very low	27.9	Very low	229 Å²	229	161.1 Å²	161.1	86%	0.864	81%	0.811	S	S	*	*			trans	-64.7	144.1	-155.8	-78.8	172.9	175.4	174.4	-2.6	114.4	H367	R365-H367 PolarHBondContact O-N 3.45Å
366	T	25.2	Very low	28.4	Very low	141 Å²	141	155.9 Å²	155.9	87%	0.865	81%	0.807	S	S	*	*			trans	-56	113.9	172	50.5	0	0	0	0	112.5
367	H	24.1	Very low	28.7	Very low	172 Å²	172	149.7 Å²	149.7	80%	0.796	79%	0.789	S	S	*	*			trans	-101.9	136.4	163.7	-78.4	-93.4	0	0	0	109.7	R365 L369	R365-H367 PolarHBondContact O-N 3.45Å; H367-L369 PolarHBondContact O-N 2.9Å
368	S	29.9	Very low	29.2	Very low	115 Å²	115	142.9 Å²	142.9	80%	0.804	77%	0.771	S	S	*	*			trans	-61.6	120.8	-173	51.2	0	0	0	0	113.2	H370	S368-H370 PolarHBondContact O-N 3.42Å; S368-H370 VanDerWaalsContact O-N 3.09Å
369	L	29.2	Very low	29.9	Very low	156 Å²	156	141.3 Å²	141.3	82%	0.817	76%	0.758	S	S	*	*	S	Bend	trans	-79.3	72	-176.9	-70.2	165.2	0	0	0	112.8	H367	H367-L369 PolarHBondContact O-N 2.9Å
370	H	25.7	Very low	30.5	Very low	186 Å²	186	138.7 Å²	138.7	86%	0.861	74%	0.743	S	S	*	*	S	Bend	trans	-141.8	30.6	169.6	-149.5	-79.7	0	0	0	115.5	S368	S368-H370 PolarHBondContact O-N 3.42Å; S368-H370 VanDerWaalsContact O-N 3.09Å
371	S	27.6	Very low	31.2	Very low	88 Å²	88	138.7 Å²	138.7	62%	0.615	72%	0.724	S	S	*	*	S	Bend	trans	-135.2	11.8	170.1	65.2	0	0	0	0	115.3
372	L	29	Very low	31.8	Very low	135 Å²	135	134.9 Å²	134.9	71%	0.707	71%	0.712	S	S	*	*			trans	-102.9	8.8	-170.3	-101.5	156.3	0	0	0	116.7
373	Y	27.9	Very low	32.5	Very low	186 Å²	186	139.2 Å²	139.2	73%	0.729	72%	0.715	S	S	*	*	S	Bend	trans	-117.3	109.5	169.1	-86.6	-99.3	0	0	0	109.3
374	F	30.6	Very low	33.4	Very low	182 Å²	182	134.3 Å²	134.3	80%	0.798	69%	0.693	S	S	*	*	S	Bend	trans	112.1	20.8	165.1	-52.3	-65.7	0	0	0	122.2
375	P	36.6	Very low	34.6	Very low	77 Å²	77	128.5 Å²	128.5	50%	0.5	67%	0.672	S	S	.	*	S	Bend	trans	-102	47.2	163.6	38	-30.4	0	0	0	113.2
376	T	36.3	Very low	35.7	Very low	135 Å²	135	123.3 Å²	123.3	83%	0.828	66%	0.656	S	S	*	*			trans	-152.2	18.2	165.5	53	0	0	0	0	115.4	N378	T376-N378 PolarHBondContact O-N 3.27Å
377	A	34.2	Very low	36.7	Very low	68 Å²	68	120 Å²	120	56%	0.562	64%	0.638	S	S	*	*			trans	-85.3	93.5	167.2	0	0	0	0	0	108.8	P379	A377-P379 VanDerWaalsContact O-CD 3.26Å; A377-P379 WeakPolarHBondContact O-CD 3.3Å; A377-P379 VanDerWaalsContact O-N 3.12Å
378	N	36.4	Very low	37.7	Very low	99 Å²	99	119.3 Å²	119.3	53%	0.529	63%	0.629	S	S	.	*			trans	-55.8	118.6	171.7	-167.8	-17.1	0	0	0	107.9	T376 A380 D381	T376-N378 PolarHBondContact O-N 3.27Å; N378-A380 PolarHBondContact O-N 2.97Å; N378-A380 PolarHBondContact OD1-N 3.37Å; N378-D381 PolarHBondContact O-N 3.32Å
379	P	42	Very low	38.4	Very low	86 Å²	86	124.2 Å²	124.2	56%	0.558	64%	0.635	S	S	*	*	H	α-helix	trans	-54.6	-25.2	-176.7	-26	33.3	0	0	0	112.9	A377 D381 L382 Y383	A377-P379 VanDerWaalsContact O-CD 3.26Å; A377-P379 WeakPolarHBondContact O-CD 3.3Å; A377-P379 VanDerWaalsContact O-N 3.12Å; P379-D381 PolarHBondContact O-N 3.28Å; P379-L382 PolarHBondContact O-N 3.32Å; P379-Y383 WeakPolarHBondContact O-CD2 3.42Å
380	A	42.7	Very low	39.7	Very low	54 Å²	54	120.5 Å²	120.5	45%	0.446	62%	0.617	S	S	.	*	H	α-helix	trans	-62	-22.1	174	0	0	0	0	0	114.5	N378	N378-A380 PolarHBondContact O-N 2.97Å; N378-A380 PolarHBondContact OD1-N 3.37Å
381	D	43.6	Very low	41	Very low	83 Å²	83	114.9 Å²	114.9	44%	0.444	59%	0.592	S	S	.	*	H	α-helix	trans	-83.9	-22.8	177.2	-74.6	-30.9	0	0	0	113.2	N378 P379 Y383 K384	N378-D381 PolarHBondContact O-N 3.32Å; P379-D381 PolarHBondContact O-N 3.28Å; D381-Y383 PolarHBondContact O-N 2.95Å; D381-K384 PolarHBondContact O-N 3.2Å; D381-K384 IonicContact OD1-NZ 2.7Å; D381-K384 PolarHBondContact OD1-NZ 3.48Å
382	L	42.5	Very low	42.4	Very low	135 Å²	135	115 Å²	115	71%	0.707	58%	0.582	S	S	*	*	H	α-helix	trans	-67.6	-23.4	171.9	-78.1	158.4	0	0	0	112.3	P379	P379-L382 PolarHBondContact O-N 3.32Å
383	Y	41.5	Very low	43.6	Very low	195 Å²	195	113.6 Å²	113.6	77%	0.765	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	6.2	-179.3	-77	-79.5	0	0	0	115.1	P379 D381 P385	P379-Y383 WeakPolarHBondContact O-CD2 3.42Å; D381-Y383 PolarHBondContact O-N 2.95Å; Y383-P385 WeakPolarHBondContact O-CD 3.38Å
384	K	45.3	Very low	44.5	Very low	109 Å²	109	110.2 Å²	110.2	47%	0.474	57%	0.569	S	S	.	*			trans	-97.4	91	174.8	-69	171.5	-169	161.7	0	108.9	D381 F386 S387	D381-K384 PolarHBondContact O-N 3.2Å; D381-K384 IonicContact OD1-NZ 2.7Å; D381-K384 PolarHBondContact OD1-NZ 3.48Å; K384-F386 PolarHBondContact O-N 3.04Å; K384-S387 VanDerWaalsContact CB-OG 3.25Å; K384-S387 WeakPolarHBondContact CB-OG 3.15Å; K384-S387 PolarHBondContact O-N 3.1Å; K384-S387 PolarHBondContact O-OG 3.11Å
385	P	51.2	Low	45.5	Very low	67 Å²	67	102.8 Å²	102.8	44%	0.435	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-52	-34.2	-179.4	16.3	-29.1	0	0	0	112.3	Y383 S387 I391	Y383-P385 WeakPolarHBondContact O-CD 3.38Å; P385-S387 PolarHBondContact O-N 2.99Å; P385-I391 HydrophobicContact CB-CD1 3.9Å; P385-I391 WeakPolarHBondContact O-CD1 3.42Å
386	F	48.8	Very low	46.2	Very low	121 Å²	121	102.4 Å²	102.4	53%	0.531	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-78.9	-4.4	-178.6	-64.8	-69.4	0	0	0	116.9	K126 K384 F392	K126-F386 PolarHBondContact NZ-O 2.99Å; K384-F386 PolarHBondContact O-N 3.04Å; F386-F392 HydrophobicContact CD1-CE2 4.39Å; F386-F392 HydrophobicContact CD1-CZ 4.37Å; F386-F392 HydrophobicContact CE1-CZ 4.16Å
387	S	45.9	Very low	46.9	Very low	71 Å²	71	101 Å²	101	50%	0.497	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	-92.9	-12.5	174.8	52.3	0	0	0	0	113.2	K384 P385 K389	K384-S387 VanDerWaalsContact CB-OG 3.25Å; K384-S387 WeakPolarHBondContact CB-OG 3.15Å; K384-S387 PolarHBondContact O-N 3.1Å; K384-S387 PolarHBondContact O-OG 3.11Å; P385-S387 PolarHBondContact O-N 2.99Å; S387-K389 PolarHBondContact O-N 2.97Å
388	R	44.9	Very low	47.5	Very low	157 Å²	157	104.3 Å²	104.3	59%	0.592	54%	0.537	S	S	*	.			trans	-68.9	125.1	174	-89.1	-157.4	-91.6	-174.1	-7.1	111	D390 I391	R388-D390 WeakPolarHBondContact CB-OD1 3.12Å; R388-D390 PolarHBondContact O-N 2.81Å; R388-I391 HydrophobicContact CB-CB 4.29Å; R388-I391 WeakPolarHBondContact O-CG2 3.31Å
389	K	45.1	Very low	48.1	Very low	218 Å²	218	104.2 Å²	104.2	95%	0.948	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-21.8	-178.2	-71.1	-176.6	179.3	175.6	0	113	S387	S387-K389 PolarHBondContact O-N 2.97Å
390	D	55.7	Low	48.4	Very low	79 Å²	79	102.4 Å²	102.4	42%	0.422	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-7.3	-172.9	61.4	-38	0	0	0	114.4	R388 F392 Y393	R388-D390 WeakPolarHBondContact CB-OD1 3.12Å; R388-D390 PolarHBondContact O-N 2.81Å; D390-F392 PolarHBondContact O-N 3.41Å; D390-Y393 WeakPolarHBondContact O-CB 3.13Å; D390-Y393 PolarHBondContact O-N 3.2Å
391	I	54	Low	48.2	Very low	68 Å²	68	105.4 Å²	105.4	35%	0.349	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-26	-171	-170.8	166.4	0	0	0	114.5	P385 R388	P385-I391 HydrophobicContact CB-CD1 3.9Å; P385-I391 WeakPolarHBondContact O-CD1 3.42Å; R388-I391 HydrophobicContact CB-CB 4.29Å; R388-I391 WeakPolarHBondContact O-CG2 3.31Å
392	F	56.3	Low	48.3	Very low	90 Å²	90	107.7 Å²	107.7	40%	0.395	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.2	23.8	177.1	-58.6	-61	0	0	0	112.9	F127 F386 D390 P394	F127-F392 AromaticContact CD1-CD2 3.75Å; F127-F392 HydrophobicContact CD1-CD2 3.75Å; F127-F392 HydrophobicContact CD1-CE1 4.32Å; F127-F392 AromaticContact CD1-CE2 3.52Å; F127-F392 HydrophobicContact CD1-CE2 3.52Å; F127-F392 HydrophobicContact CD1-CG 4.28Å; F127-F392 AromaticContact CD1-CZ 3.85Å; F127-F392 HydrophobicContact CD1-CZ 3.85Å; F127-F392 HydrophobicContact CE1-CD2 4Å; F127-F392 HydrophobicContact CE1-CE1 4.35Å; F127-F392 AromaticContact CE1-CE2 3.29Å; F127-F392 HydrophobicContact CE1-CE2 3.29Å; F127-F392 AromaticContact CE1-CZ 3.51Å; F127-F392 HydrophobicContact CE1-CZ 3.51Å; F127-F392 HydrophobicContact CZ-CE2 4.44Å; F386-F392 HydrophobicContact CD1-CE2 4.39Å; F386-F392 HydrophobicContact CD1-CZ 4.37Å; F386-F392 HydrophobicContact CE1-CZ 4.16Å; D390-F392 PolarHBondContact O-N 3.41Å; F392-P394 WeakPolarHBondContact O-CD 3.45Å
393	Y	54	Low	48.3	Very low	105 Å²	105	105.6 Å²	105.6	41%	0.412	52%	0.519	S	S	.	.			trans	-55.5	115	175.4	-178.7	-109.1	0	0	0	109.8	D390 G395 L400	D390-Y393 WeakPolarHBondContact O-CB 3.13Å; D390-Y393 PolarHBondContact O-N 3.2Å; Y393-G395 WeakPolarHBondContact CD1-O 3.42Å; Y393-G395 PolarHBondContact O-N 2.95Å; Y393-L400 HydrophobicContact CD1-CD1 3.89Å; Y393-L400 HydrophobicContact CD1-CD2 4.34Å; Y393-L400 HydrophobicContact CD1-CG 4.11Å; Y393-L400 HydrophobicContact CE1-CD1 4.42Å; Y393-L400 HydrophobicContact CE1-CD2 4.36Å; Y393-L400 HydrophobicContact CE1-CG 4.16Å; Y393-L400 HydrophobicContact CG-CD1 4.38Å
394	P	47	Very low	48.3	Very low	116 Å²	116	100.8 Å²	100.8	75%	0.753	51%	0.51	S	S	*	.			trans	-80.7	-1.5	-173.6	31.8	-34.3	0	0	0	112.9	F392	F392-P394 WeakPolarHBondContact O-CD 3.45Å
395	G	50.7	Low	47.9	Very low	26 Å²	26	99.4 Å²	99.4	27%	0.268	51%	0.514	S	S	.	.	S	Bend	trans	-90.6	169.7	178.6	0	0	0	0	0	113	Y393 V397	Y393-G395 WeakPolarHBondContact CD1-O 3.42Å; Y393-G395 PolarHBondContact O-N 2.95Å; G395-V397 PolarHBondContact O-N 3.05Å
396	S	51.2	Low	47.2	Very low	69 Å²	69	103.7 Å²	103.7	48%	0.483	53%	0.528	S	S	.	.			trans	-62.4	131.5	175.7	176.8	0	0	0	0	111.1	H398 K399	S396-H398 PolarHBondContact O-N 2.9Å; S396-H398 PolarHBondContact OG-N 3.29Å; S396-K399 WeakPolarHBondContact O-CB 3.41Å; S396-K399 PolarHBondContact O-N 3.24Å
397	V	53	Low	46.7	Very low	104 Å²	104	102.3 Å²	102.3	63%	0.63	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-26.9	178.3	-166.9	0	0	0	0	111.8	G395 K399 L400 Q401	G395-V397 PolarHBondContact O-N 3.05Å; V397-K399 PolarHBondContact O-N 3.22Å; V397-L400 HydrophobicContact CG1-CD1 4.3Å; V397-L400 WeakPolarHBondContact O-CB 3.42Å; V397-L400 PolarHBondContact O-N 3.22Å; V397-Q401 PolarHBondContact O-N 3.02Å
398	H	46.4	Very low	45.9	Very low	138 Å²	138	105.7 Å²	105.7	64%	0.639	55%	0.546	S	S	*	.	H	α-helix	trans	-59.9	-28.6	174.1	-84.8	-47	0	0	0	113.2	S396 L400 Q401 E402	S396-H398 PolarHBondContact O-N 2.9Å; S396-H398 PolarHBondContact OG-N 3.29Å; H398-L400 VanDerWaalsContact C-N 3.29Å; H398-L400 PolarHBondContact O-N 3.3Å; H398-Q401 PolarHBondContact ND1-OE1 3.48Å; H398-Q401 PolarHBondContact O-N 3Å; H398-E402 PolarHBondContact O-N 3.4Å
399	K	48.5	Very low	45.2	Very low	98 Å²	98	102.6 Å²	102.6	43%	0.426	55%	0.554	S	S	.	*	H	α-helix	trans	-72	-23.1	173.7	-75.2	-176.9	175.3	180	0	113.3	S396 V397 I403	S396-K399 WeakPolarHBondContact O-CB 3.41Å; S396-K399 PolarHBondContact O-N 3.24Å; V397-K399 PolarHBondContact O-N 3.22Å; K399-I403 WeakPolarHBondContact O-CG1 3.28Å
400	L	47.9	Very low	44.3	Very low	48 Å²	48	101 Å²	101	25%	0.251	55%	0.547	S	S	.	.	H	α-helix	trans	-74.8	-34.4	173.3	-64.5	168.4	0	0	0	110.8	Y393 V397 H398 I403 T404	Y393-L400 HydrophobicContact CD1-CD1 3.89Å; Y393-L400 HydrophobicContact CD1-CD2 4.34Å; Y393-L400 HydrophobicContact CD1-CG 4.11Å; Y393-L400 HydrophobicContact CE1-CD1 4.42Å; Y393-L400 HydrophobicContact CE1-CD2 4.36Å; Y393-L400 HydrophobicContact CE1-CG 4.16Å; Y393-L400 HydrophobicContact CG-CD1 4.38Å; V397-L400 HydrophobicContact CG1-CD1 4.3Å; V397-L400 WeakPolarHBondContact O-CB 3.42Å; V397-L400 PolarHBondContact O-N 3.22Å; H398-L400 VanDerWaalsContact C-N 3.29Å; H398-L400 PolarHBondContact O-N 3.3Å; L400-I403 WeakPolarHBondContact O-CB 3.29Å; L400-I403 PolarHBondContact O-N 2.85Å; L400-T404 PolarHBondContact O-N 2.55Å; L400-T404 PolarHBondContact O-OG1 3.02Å; L400-T404 VanDerWaalsContact O-OG1 3.05Å
401	Q	38.9	Very low	42.9	Very low	116 Å²	116	105 Å²	105	54%	0.542	57%	0.567	S	S	.	*	H	α-helix	trans	-67.6	-36.6	176.7	-71	-175.8	-44.3	0	0	112.7	V397 H398 I403 T404 S405	V397-Q401 PolarHBondContact O-N 3.02Å; H398-Q401 PolarHBondContact ND1-OE1 3.48Å; H398-Q401 PolarHBondContact O-N 3Å; Q401-I403 PolarHBondContact O-N 3.04Å; Q401-T404 PolarHBondContact O-N 3.32Å; Q401-T404 VanDerWaalsContact O-N 3.12Å; Q401-S405 PolarHBondContact O-N 2.95Å; Q401-S405 PolarHBondContact O-OG 3.43Å
402	E	45.7	Very low	41.6	Very low	132 Å²	132	106.6 Å²	106.6	62%	0.617	58%	0.582	S	S	*	*	H	α-helix	trans	-63.1	-30.4	172.3	-89.8	179.7	156.8	0	0	112.7	H398 S405	H398-E402 PolarHBondContact O-N 3.4Å; E402-S405 PolarHBondContact O-OG 3.36Å
403	I	42.6	Very low	40.2	Very low	90 Å²	90	107.2 Å²	107.2	46%	0.462	60%	0.597	S	S	.	*	H	α-helix	trans	-71.1	-34.3	173.8	-64.7	167	0	0	0	110.7	K399 L400 Q401	K399-I403 WeakPolarHBondContact O-CG1 3.28Å; L400-I403 WeakPolarHBondContact O-CB 3.29Å; L400-I403 PolarHBondContact O-N 2.85Å; Q401-I403 PolarHBondContact O-N 3.04Å
404	T	40.9	Very low	38.8	Very low	95 Å²	95	110.7 Å²	110.7	58%	0.583	62%	0.617	S	S	*	*	H	α-helix	trans	-75.7	-35	178.9	-35.1	0	0	0	0	112.4	L400 Q401 Q406 S407	L400-T404 PolarHBondContact O-N 2.55Å; L400-T404 PolarHBondContact O-OG1 3.02Å; L400-T404 VanDerWaalsContact O-OG1 3.05Å; Q401-T404 PolarHBondContact O-N 3.32Å; Q401-T404 VanDerWaalsContact O-N 3.12Å; T404-Q406 PolarHBondContact O-N 2.92Å; T404-S407 PolarHBondContact O-N 3.46Å; T404-S407 PolarHBondContact O-OG 2.75Å
405	S	38.3	Very low	37.9	Very low	79 Å²	79	117.4 Å²	117.4	55%	0.552	63%	0.627	S	S	*	*	H	α-helix	trans	-74.5	-21.5	-173.3	62.7	0	0	0	0	114.5	Q401 E402 S407	Q401-S405 PolarHBondContact O-N 2.95Å; Q401-S405 PolarHBondContact O-OG 3.43Å; E402-S405 PolarHBondContact O-OG 3.36Å; S405-S407 PolarHBondContact O-N 3.26Å
406	Q	36.1	Very low	36.7	Very low	158 Å²	158	127.8 Å²	127.8	74%	0.738	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-72.2	-12.5	176.9	-70.3	-169.4	5.9	0	0	114	T404	T404-Q406 PolarHBondContact O-N 2.92Å
407	S	38.7	Very low	36	Very low	92 Å²	92	130.1 Å²	130.1	64%	0.643	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-83.9	-7	179.6	70.2	0	0	0	0	115.3	T404 S405	T404-S407 PolarHBondContact O-N 3.46Å; T404-S407 PolarHBondContact O-OG 2.75Å; S405-S407 PolarHBondContact O-N 3.26Å
408	N	29.1	Very low	34.8	Very low	142 Å²	142	132 Å²	132	76%	0.759	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-100	22.7	-172.4	-81.6	-10.4	0	0	0	115.6	F410	N408-F410 PolarHBondContact O-N 3.29Å; N408-F410 VanDerWaalsContact O-N 3.1Å
409	A	28.5	Very low	34.2	Very low	92 Å²	92	129.8 Å²	129.8	76%	0.76	69%	0.69	S	S	*	*	S	Bend	trans	-77.4	99.3	173.9	0	0	0	0	0	111.7
410	F	26.2	Very low	33.4	Very low	183 Å²	183	132.3 Å²	132.3	80%	0.803	71%	0.708	S	S	*	*			trans	75.6	91.9	152	-143.1	-95.8	0	0	0	118	N408 P412	N408-F410 PolarHBondContact O-N 3.29Å; N408-F410 VanDerWaalsContact O-N 3.1Å; F410-P412 HydrophobicContact CD1-CG 4.21Å; F410-P412 HydrophobicContact CE1-CG 4.01Å
411	I	26.9	Very low	32.8	Very low	165 Å²	165	136.7 Å²	136.7	85%	0.846	73%	0.727	S	S	*	*			trans	-120.5	110.5	165.1	-57.3	176.1	0	0	0	108.6
412	P	27.1	Very low	32.7	Very low	100 Å²	100	135.2 Å²	135.2	65%	0.649	73%	0.729	S	S	*	*			trans	-71.1	133.2	171.9	-14.1	29	0	0	0	111.2	F410	F410-P412 HydrophobicContact CD1-CG 4.21Å; F410-P412 HydrophobicContact CE1-CG 4.01Å
413	S	26.7	Very low	32.2	Very low	104 Å²	104	135.7 Å²	135.7	73%	0.727	74%	0.736	S	S	*	*			trans	-67.8	155.6	176.7	53.1	0	0	0	0	113.5
414	E	25.2	Very low	32.2	Very low	178 Å²	178	135.1 Å²	135.1	83%	0.832	74%	0.736	S	S	*	*			trans	101.4	100.4	159.8	-57.8	-175.9	149.9	0	0	118.1
415	R	26.8	Very low	32	Very low	256 Å²	256	136.3 Å²	136.3	97%	0.966	74%	0.739	S	S	*	*				-168.8	147.1	118.7	-107.4	174.2	-156.3	178.6	7.1	113.1
416	R	27.1	Very low	31.7	Very low	244 Å²	244	139.9 Å²	139.9	92%	0.921	75%	0.747	S	S	*	*			trans	-70	156.6	-167	-84.8	174.3	172.5	149.7	-2.5	115.4
417	P	35.3	Very low	31.6	Very low	119 Å²	119	138.7 Å²	138.7	77%	0.773	74%	0.74	S	S	*	*			trans	-98.6	138.8	-171.6	36.6	-29.9	0	0	0	113.9
418	T	28.7	Very low	31.6	Very low	144 Å²	144	136.4 Å²	136.4	88%	0.883	72%	0.722	S	S	*	*			trans	-156.3	112.3	159.8	51.3	0	0	0	0	109.8
419	A	34.1	Very low	31.8	Very low	91 Å²	91	137 Å²	137	75%	0.752	72%	0.72	S	S	*	*			trans	-179.4	142.9	144.3	0	0	0	0	0	111
420	D	31.6	Very low	31.9	Very low	150 Å²	150	139 Å²	139	80%	0.802	71%	0.714	S	S	*	*			trans	-70.3	148	-169.8	-163.8	-4.5	0	0	0	113.8
421	H	34.5	Very low	32.2	Very low	141 Å²	141	135.1 Å²	135.1	65%	0.653	70%	0.701	S	S	*	*			trans	-115	15.1	-158.1	-94.5	-67.3	0	0	0	115.5
422	S	36	Very low	32.6	Very low	84 Å²	84	133 Å²	133	59%	0.587	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-22.5	-170.6	37.3	0	0	0	0	116.3
423	D	36.1	Very low	33	Very low	143 Å²	143	131.8 Å²	131.8	77%	0.765	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-11.7	-175.1	-68.9	-29.1	0	0	0	114.7
424	V	42.8	Very low	33.5	Very low	77 Å²	77	135.1 Å²	135.1	47%	0.467	69%	0.693	S	S	.	*	H	α-helix	trans	-82.6	-32.1	-173.8	-175.2	0	0	0	0	111.8	E426 V428	V424-E426 PolarHBondContact O-N 2.72Å; V424-V428 HydrophobicContact CG1-CG2 4.31Å; V424-V428 WeakPolarHBondContact O-CG2 3.35Å; V424-V428 PolarHBondContact O-N 2.88Å
425	D	35.5	Very low	33.8	Very low	120 Å²	120	129.4 Å²	129.4	64%	0.642	68%	0.682	S	S	*	*	H	α-helix	trans	-69.9	-36.1	-173.1	-72.9	-25.3	0	0	0	112.4	V428 E429	D425-V428 PolarHBondContact O-N 3.34Å; D425-E429 PolarHBondContact O-N 3.38Å
426	E	32.4	Very low	33.8	Very low	154 Å²	154	125.4 Å²	125.4	72%	0.72	67%	0.674	S	S	*	*	H	α-helix	trans	-71	-34.8	-179.1	-164.2	172.7	-171.2	0	0	112.5	V424 Q430	V424-E426 PolarHBondContact O-N 2.72Å; E426-Q430 PolarHBondContact O-N 3.23Å
427	F	34.6	Very low	34.1	Very low	133 Å²	133	119.6 Å²	119.6	58%	0.583	67%	0.667	S	S	*	*	H	α-helix	trans	-71.2	-34.4	177.4	-174.4	-109.7	0	0	0	112.5	L431	F427-L431 HydrophobicContact CD1-CD1 3.81Å; F427-L431 HydrophobicContact CE1-CD1 3.39Å; F427-L431 HydrophobicContact CZ-CD1 3.83Å; F427-L431 PolarHBondContact O-N 2.96Å
428	V	38.8	Very low	34	Very low	45 Å²	45	120.3 Å²	120.3	27%	0.273	67%	0.67	S	S	.	*	H	α-helix	trans	-69.8	-37.9	178.3	173.6	0	0	0	0	111.2	V424 D425 Q430 L431 I432	V424-V428 HydrophobicContact CG1-CG2 4.31Å; V424-V428 WeakPolarHBondContact O-CG2 3.35Å; V424-V428 PolarHBondContact O-N 2.88Å; D425-V428 PolarHBondContact O-N 3.34Å; V428-Q430 PolarHBondContact O-N 2.93Å; V428-L431 PolarHBondContact O-N 2.84Å; V428-I432 HydrophobicContact CG1-CD1 4.04Å; V428-I432 WeakPolarHBondContact O-CG1 3.3Å; V428-I432 PolarHBondContact O-N 3.5Å
429	E	33.6	Very low	34.1	Very low	153 Å²	153	122.8 Å²	122.8	72%	0.715	67%	0.668	S	S	*	*	H	α-helix	trans	-63.9	-38.3	176.3	-78.7	-156.1	154.9	0	0	112.8	D425 I432 A433	D425-E429 PolarHBondContact O-N 3.38Å; E429-I432 PolarHBondContact O-N 3.49Å; E429-A433 PolarHBondContact O-N 3.08Å
430	Q	29.8	Very low	34.4	Very low	135 Å²	135	122 Å²	122	63%	0.631	66%	0.657	S	S	*	*	H	α-helix	trans	-64.2	-40.5	176.1	-91.1	-177.3	-14.9	0	0	112.8	E426 V428 I432 A433 E434	E426-Q430 PolarHBondContact O-N 3.23Å; V428-Q430 PolarHBondContact O-N 2.93Å; Q430-I432 VanDerWaalsContact C-N 3.3Å; Q430-I432 PolarHBondContact O-N 3.13Å; Q430-A433 PolarHBondContact O-N 3.33Å; Q430-E434 PolarHBondContact O-N 3.3Å
431	L	33.1	Very low	34.8	Very low	101 Å²	101	127 Å²	127	53%	0.529	67%	0.665	S	S	.	*	H	α-helix	trans	-65.9	-31.5	177.2	-88	156.1	0	0	0	112.9	F427 V428	F427-L431 HydrophobicContact CD1-CD1 3.81Å; F427-L431 HydrophobicContact CE1-CD1 3.39Å; F427-L431 HydrophobicContact CZ-CD1 3.83Å; F427-L431 PolarHBondContact O-N 2.96Å; V428-L431 PolarHBondContact O-N 2.84Å
432	I	34.4	Very low	35.3	Very low	121 Å²	121	130.1 Å²	130.1	62%	0.621	67%	0.671	S	S	*	*	H	α-helix	trans	-71.3	-34.2	176.4	-66.6	168.6	0	0	0	111.1	V428 E429 Q430	V428-I432 HydrophobicContact CG1-CD1 4.04Å; V428-I432 WeakPolarHBondContact O-CG1 3.3Å; V428-I432 PolarHBondContact O-N 3.5Å; E429-I432 PolarHBondContact O-N 3.49Å; Q430-I432 VanDerWaalsContact C-N 3.3Å; Q430-I432 PolarHBondContact O-N 3.13Å
433	A	35.9	Very low	35.8	Very low	75 Å²	75	129.9 Å²	129.9	62%	0.62	67%	0.668	S	S	*	*	H	α-helix	trans	-68.7	-35.8	-179.6	0	0	0	0	0	113	E429 Q430	E429-A433 PolarHBondContact O-N 3.08Å; Q430-A433 PolarHBondContact O-N 3.33Å
434	E	37.3	Very low	36.6	Very low	174 Å²	174	129.3 Å²	129.3	81%	0.813	67%	0.672	S	S	*	*	H	α-helix	trans	-80	-17.1	-177.8	-71.4	-170.3	155.5	0	0	114.1	Q430 Q436	Q430-E434 PolarHBondContact O-N 3.3Å; E434-Q436 PolarHBondContact O-N 2.99Å
435	G	31.3	Very low	37.5	Very low	58 Å²	58	130.2 Å²	130.2	60%	0.598	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	8.9	-174.3	0	0	0	0	0	116.9	P437	G435-P437 VanDerWaalsContact O-CD 3.25Å; G435-P437 WeakPolarHBondContact O-CD 3.41Å
436	Q	27	Very low	38.3	Very low	172 Å²	172	128 Å²	128	80%	0.804	67%	0.669	S	S	*	*			trans	-72.4	116.1	-175	-70.7	-147.1	-20.9	0	0	112.7	E434 T438	E434-Q436 PolarHBondContact O-N 2.99Å; Q436-T438 PolarHBondContact O-N 3.44Å
437	P	34	Very low	39.7	Very low	121 Å²	121	124.2 Å²	124.2	79%	0.786	66%	0.658	S	S	*	*			trans	-70.8	134.2	-175.5	27.1	-32.1	0	0	0	111.9	G435 K439	G435-P437 VanDerWaalsContact O-CD 3.25Å; G435-P437 WeakPolarHBondContact O-CD 3.41Å; P437-K439 PolarHBondContact O-N 3.27Å
438	T	32.8	Very low	40.7	Very low	134 Å²	134	122.7 Å²	122.7	82%	0.822	66%	0.661	S	S	*	*			trans	-42.8	130.2	179.6	53.5	0	0	0	0	113	Q436 S440	Q436-T438 PolarHBondContact O-N 3.44Å; T438-S440 PolarHBondContact O-N 3.18Å
439	K	31.3	Very low	41.4	Very low	197 Å²	197	124.7 Å²	124.7	86%	0.857	68%	0.677	S	S	*	*			trans	-49.4	88.3	178.2	-71.7	175.7	177.2	173.1	0	112.4	P437	P437-K439 PolarHBondContact O-N 3.27Å
440	S	39.7	Very low	42.7	Very low	74 Å²	74	120.8 Å²	120.8	52%	0.517	66%	0.663	S	S	.	*			trans	-73.3	137.1	168.1	92.1	0	0	0	0	109.1	T438 R442	T438-S440 PolarHBondContact O-N 3.18Å; S440-R442 PolarHBondContact O-N 3.41Å; S440-R442 VanDerWaalsContact O-N 3.12Å
441	R	41.1	Very low	44.1	Very low	256 Å²	256	115.1 Å²	115.1	97%	0.966	64%	0.639	S	S	*	*			trans	-63.7	111.8	-179	-72.6	-176.2	174.6	-164.1	-1.6	109
442	R	44.3	Very low	45.3	Very low	205 Å²	205	114.6 Å²	114.6	77%	0.774	64%	0.637	S	S	*	*			trans	-84.3	140.2	-174	-82.8	170.7	-104.6	-171.5	-6.9	111.6	S440	S440-R442 PolarHBondContact O-N 3.41Å; S440-R442 VanDerWaalsContact O-N 3.12Å
443	C	46.1	Very low	46.5	Very low	79 Å²	79	111.2 Å²	111.2	53%	0.534	62%	0.621	S	S	.	*			trans	-89.3	122.5	170.1	-148.5	0	0	0	0	108.8	C445	C443-C445 PolarHBondContact O-N 3.36Å; C443-C445 VanDerWaalsContact SG-SG 3.64Å
444	P	53.4	Low	47.6	Very low	131 Å²	131	109.8 Å²	109.8	85%	0.851	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-9.7	-171.7	24.4	-32.1	0	0	0	115
445	C	61.6	Low	48.8	Very low	96 Å²	96	105.4 Å²	105.4	65%	0.649	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-8.4	-173.7	55.3	0	0	0	0	115.6	C443	C443-C445 PolarHBondContact O-N 3.36Å; C443-C445 VanDerWaalsContact SG-SG 3.64Å
446	L	51.5	Low	50.3	Low	74 Å²	74	109.5 Å²	109.5	39%	0.387	60%	0.595	S	S	.	*	S	Bend	trans	-116.2	139.9	179.2	-99.6	76.9	0	0	0	111.9	V450	L446-V450 HydrophobicContact CD2-CB 4.22Å; L446-V450 HydrophobicContact CD2-CG1 3.79Å
447	P	62.8	Low	52	Low	74 Å²	74	102.9 Å²	102.9	48%	0.481	56%	0.564	S	S	.	*			trans	-53.7	140.2	167.2	-22	31.3	0	0	0	110.6	S449 V450 S451	P447-S449 PolarHBondContact O-N 3.19Å; P447-S449 VanDerWaalsContact O-N 3.11Å; P447-V450 HydrophobicContact CB-CG2 4.23Å; P447-V450 HydrophobicContact CG-CG2 4.3Å; P447-V450 PolarHBondContact O-N 3.13Å; P447-S451 PolarHBondContact O-N 2.89Å
448	P	54	Low	53.7	Low	101 Å²	101	98 Å²	98	66%	0.656	53%	0.532	S	S	*	.	H	α-helix	trans	-54.2	-37.8	-174	-25.7	32.1	0	0	0	113.6	N452	P448-N452 WeakPolarHBondContact O-CB 3.04Å; P448-N452 VanDerWaalsContact O-CG 3.31Å; P448-N452 PolarHBondContact O-N 3.2Å; P448-N452 PolarHBondContact O-ND2 3.08Å
449	S	55.3	Low	55.6	Low	87 Å²	87	94.8 Å²	94.8	61%	0.608	51%	0.51	S	S	*	.	H	α-helix	trans	-65.9	-37.2	178.3	28.4	0	0	0	0	112.8	P447 V453	P447-S449 PolarHBondContact O-N 3.19Å; P447-S449 VanDerWaalsContact O-N 3.11Å; S449-V453 WeakPolarHBondContact O-CB 3.4Å; S449-V453 WeakPolarHBondContact O-CG2 3.49Å; S449-V453 PolarHBondContact O-N 3.32Å
450	V	59.7	Low	57.8	Low	71 Å²	71	92.4 Å²	92.4	43%	0.43	50%	0.497	S	S	.	.	H	α-helix	trans	-77.4	-43.6	178.2	-174.8	0	0	0	0	110.4	L446 P447 N452 V453 V454	L446-V450 HydrophobicContact CD2-CB 4.22Å; L446-V450 HydrophobicContact CD2-CG1 3.79Å; P447-V450 HydrophobicContact CB-CG2 4.23Å; P447-V450 HydrophobicContact CG-CG2 4.3Å; P447-V450 PolarHBondContact O-N 3.13Å; V450-N452 PolarHBondContact O-N 2.88Å; V450-V453 PolarHBondContact O-N 3.35Å; V450-V454 HydrophobicContact CG1-CG2 4.19Å; V450-V454 WeakPolarHBondContact O-CG2 3.17Å; V450-V454 PolarHBondContact O-N 3.41Å
451	S	59.7	Low	59.7	Low	17 Å²	17	97.7 Å²	97.7	12%	0.119	51%	0.505	C	S	.	.	H	α-helix	trans	-61.1	-46.2	180	-179.1	0	0	0	0	111.8	P447 V453 V454 L455	P447-S451 PolarHBondContact O-N 2.89Å; S451-V453 VanDerWaalsContact C-N 3.3Å; S451-V453 PolarHBondContact O-N 3.3Å; S451-V454 PolarHBondContact O-N 3.36Å; S451-L455 VanDerWaalsContact O-CB 3.3Å; S451-L455 WeakPolarHBondContact O-CB 3.13Å; S451-L455 VanDerWaalsContact O-CG 3.28Å; S451-L455 WeakPolarHBondContact O-CG 3.42Å; S451-L455 PolarHBondContact O-N 3.46Å
452	N	58.8	Low	61.7	Low	90 Å²	90	85.9 Å²	85.9	48%	0.481	46%	0.462	S	S	.	.	H	α-helix	trans	-62.4	-38.9	177.8	-74.9	-15.5	0	0	0	111.8	P448 V450 N456	P448-N452 WeakPolarHBondContact O-CB 3.04Å; P448-N452 VanDerWaalsContact O-CG 3.31Å; P448-N452 PolarHBondContact O-N 3.2Å; P448-N452 PolarHBondContact O-ND2 3.08Å; V450-N452 PolarHBondContact O-N 2.88Å; N452-N456 WeakPolarHBondContact O-CB 3.33Å; N452-N456 PolarHBondContact O-N 3.38Å; N452-N456 PolarHBondContact O-ND2 3.28Å
453	V	59.4	Low	63.6	Low	49 Å²	49	79.2 Å²	79.2	30%	0.297	44%	0.441	S	S	.	.	H	α-helix	trans	-64.9	-49.9	176.8	168.7	0	0	0	0	110.6	K126 S449 V450 S451 N456 M457	K126-V453 HydrophobicContact CD-CG1 4.34Å; S449-V453 WeakPolarHBondContact O-CB 3.4Å; S449-V453 WeakPolarHBondContact O-CG2 3.49Å; S449-V453 PolarHBondContact O-N 3.32Å; V450-V453 PolarHBondContact O-N 3.35Å; S451-V453 VanDerWaalsContact C-N 3.3Å; S451-V453 PolarHBondContact O-N 3.3Å; V453-N456 PolarHBondContact O-N 3.39Å; V453-M457 HydrophobicContact CG1-SD 3.4Å; V453-M457 WeakPolarHBondContact CG1-SD 3.04Å; V453-M457 WeakPolarHBondContact O-CG 3.39Å; V453-M457 PolarHBondContact O-N 3.06Å; V453-M457 VanDerWaalsContact O-N 3.13Å
454	V	58.7	Low	65.4	Low	46 Å²	46	78.8 Å²	78.8	28%	0.279	44%	0.439	S	S	.	.	H	α-helix	trans	-63.6	-44	179.7	175.3	0	0	0	0	111.6	V450 S451 N456 M457 V458	V450-V454 HydrophobicContact CG1-CG2 4.19Å; V450-V454 WeakPolarHBondContact O-CG2 3.17Å; V450-V454 PolarHBondContact O-N 3.41Å; S451-V454 PolarHBondContact O-N 3.36Å; V454-N456 PolarHBondContact O-N 3.19Å; V454-M457 WeakPolarHBondContact O-CB 3.44Å; V454-M457 PolarHBondContact O-N 3.32Å; V454-M457 VanDerWaalsContact O-N 3.09Å; V454-V458 PolarHBondContact O-N 3.49Å
455	L	61.6	Low	66.9	Low	82 Å²	82	75.4 Å²	75.4	43%	0.429	41%	0.412	S	S	.	.	H	α-helix	trans	-65.9	-37.3	178.9	-72.4	173	0	0	0	112.2	S451 M457 V458	S451-L455 VanDerWaalsContact O-CB 3.3Å; S451-L455 WeakPolarHBondContact O-CB 3.13Å; S451-L455 VanDerWaalsContact O-CG 3.28Å; S451-L455 WeakPolarHBondContact O-CG 3.42Å; S451-L455 PolarHBondContact O-N 3.46Å; L455-M457 PolarHBondContact O-N 2.81Å; L455-V458 PolarHBondContact O-N 3.23Å
456	N	63.7	Low	68.2	Low	143 Å²	143	72 Å²	72	77%	0.765	39%	0.388	S	S	*	.	H	α-helix	trans	-70	-18.2	174.8	-71.2	-14.5	0	0	0	112.6	N452 V453 V454	N452-N456 WeakPolarHBondContact O-CB 3.33Å; N452-N456 PolarHBondContact O-N 3.38Å; N452-N456 PolarHBondContact O-ND2 3.28Å; V453-N456 PolarHBondContact O-N 3.39Å; V454-N456 PolarHBondContact O-N 3.19Å
457	M	63.4	Low	70.1	Confident	33 Å²	33	68.5 Å²	68.5	16%	0.163	37%	0.37	C	S	.	.	H	α-helix	trans	-88.2	-19.7	178.4	-69.3	159.9	68.9	0	0	112.9	G122 K126 V453 V454 L455 N592	G122-M457 WeakPolarHBondContact O-CE 3.35Å; K126-M457 HydrophobicContact CB-CE 3.29Å; K126-M457 HydrophobicContact CB-SD 4.28Å; K126-M457 HydrophobicContact CD-CE 3.68Å; K126-M457 HydrophobicContact CD-SD 3.67Å; K126-M457 HydrophobicContact CG-CE 4.08Å; V453-M457 HydrophobicContact CG1-SD 3.4Å; V453-M457 WeakPolarHBondContact CG1-SD 3.04Å; V453-M457 WeakPolarHBondContact O-CG 3.39Å; V453-M457 PolarHBondContact O-N 3.06Å; V453-M457 VanDerWaalsContact O-N 3.13Å; V454-M457 WeakPolarHBondContact O-CB 3.44Å; V454-M457 PolarHBondContact O-N 3.32Å; V454-M457 VanDerWaalsContact O-N 3.09Å; L455-M457 PolarHBondContact O-N 2.81Å; M457-N592 PolarHBondContact O-OD1 3.11Å
458	V	68.7	Low	71.5	Confident	19 Å²	19	65 Å²	65	12%	0.115	35%	0.347	C	S	.	.	S	Bend	trans	-108	108.5	-178.5	-179.3	0	0	0	0	110.6	P118 V454 L455 Y460 L596	P118-V458 HydrophobicContact CB-CG1 4.03Å; P118-V458 HydrophobicContact CB-CG2 3.86Å; P118-V458 VanDerWaalsContact O-CG2 3.27Å; P118-V458 WeakPolarHBondContact O-CG2 3.44Å; V454-V458 PolarHBondContact O-N 3.49Å; L455-V458 PolarHBondContact O-N 3.23Å; V458-Y460 PolarHBondContact O-N 3.07Å; V458-L596 HydrophobicContact CG1-CD2 4.25Å
459	N	72.9	Confident	73.4	Confident	67 Å²	67	62.7 Å²	62.7	36%	0.358	33%	0.329	S	S	.	.			trans	-81.4	82.6	177.5	-167.8	-2.7	0	0	0	112.2	R461 L462	N459-R461 PolarHBondContact O-N 3.35Å; N459-R461 VanDerWaalsContact OD1-CB 3.23Å; N459-R461 WeakPolarHBondContact OD1-CB 3.4Å; N459-R461 PolarHBondContact OD1-N 3.03Å; N459-L462 WeakPolarHBondContact O-CB 3.49Å; N459-L462 PolarHBondContact O-N 3.5Å
460	Y	76.6	Confident	75.2	Confident	147 Å²	147	59.5 Å²	59.5	58%	0.576	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-66.3	-14.9	176.7	60.3	-91.6	0	0	0	113.7	V458 L462 L463	V458-Y460 PolarHBondContact O-N 3.07Å; Y460-L462 PolarHBondContact O-N 3.34Å; Y460-L463 PolarHBondContact O-N 2.8Å
461	R	80.9	Confident	76.9	Confident	184 Å²	184	56.3 Å²	56.3	69%	0.694	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-59.8	-19.3	174	-58.8	-175.8	173.6	-155.8	-1.3	111.6	N459 L463 S464	N459-R461 PolarHBondContact O-N 3.35Å; N459-R461 VanDerWaalsContact OD1-CB 3.23Å; N459-R461 WeakPolarHBondContact OD1-CB 3.4Å; N459-R461 PolarHBondContact OD1-N 3.03Å; R461-L463 PolarHBondContact O-N 3.44Å; R461-S464 WeakPolarHBondContact O-CB 3.48Å; R461-S464 PolarHBondContact O-N 3.34Å; R461-S464 PolarHBondContact O-OG 3.21Å
462	L	82.7	Confident	78.6	Confident	9 Å²	9	55.9 Å²	55.9	5%	0.047	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-61.5	-30.9	175	-161.5	58.2	0	0	0	113.5	N459 Y460 S464 H465 M468 V585 A593 L596	N459-L462 WeakPolarHBondContact O-CB 3.49Å; N459-L462 PolarHBondContact O-N 3.5Å; Y460-L462 PolarHBondContact O-N 3.34Å; L462-S464 PolarHBondContact O-N 3.46Å; L462-H465 VanDerWaalsContact O-CB 3.29Å; L462-H465 WeakPolarHBondContact O-CB 3.23Å; L462-H465 PolarHBondContact O-N 3.17Å; L462-M468 HydrophobicContact CD2-SD 4.46Å; L462-M468 HydrophobicContact CG-CG 4.04Å; L462-M468 WeakPolarHBondContact O-CB 3.45Å; L462-V585 HydrophobicContact CD1-CB 4.14Å; L462-V585 HydrophobicContact CD1-CG1 3.93Å; L462-V585 HydrophobicContact CD2-CG2 4.46Å; L462-A593 VanDerWaalsContact CD2-CA 3.43Å; L462-A593 HydrophobicContact CD2-CB 3.4Å; L462-A593 VanDerWaalsContact CD2-CB 3.4Å; L462-L596 HydrophobicContact CB-CD1 4.03Å; L462-L596 HydrophobicContact CD2-CD1 4.45Å
463	L	85.2	Confident	80.3	Confident	65 Å²	65	54.8 Å²	54.8	34%	0.34	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-68	-12.2	173.4	-67.3	175.5	0	0	0	113.1	Y460 R461 H465 M468 L596	Y460-L463 PolarHBondContact O-N 2.8Å; R461-L463 PolarHBondContact O-N 3.44Å; L463-H465 VanDerWaalsContact C-N 3.27Å; L463-M468 HydrophobicContact CD2-CG 4.3Å; L463-L596 HydrophobicContact CD1-CD2 4.37Å; L463-L596 HydrophobicContact CG-CD1 4.23Å
464	S	82.6	Confident	82.1	Confident	70 Å²	70	52.4 Å²	52.4	49%	0.49	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-78.7	-13.5	171	-50.1	0	0	0	0	112.1	R461 L462	R461-S464 WeakPolarHBondContact O-CB 3.48Å; R461-S464 PolarHBondContact O-N 3.34Å; R461-S464 PolarHBondContact O-OG 3.21Å; L462-S464 PolarHBondContact O-N 3.46Å
465	H	85.6	Confident	83.8	Confident	60 Å²	60	50.3 Å²	50.3	28%	0.278	25%	0.252	S	S	.	.	S	Bend	trans	-76.2	124.8	172.9	-164.4	-89.6	0	0	0	109.6	L462 L463 S467 M468 L469	L462-H465 VanDerWaalsContact O-CB 3.29Å; L462-H465 WeakPolarHBondContact O-CB 3.23Å; L462-H465 PolarHBondContact O-N 3.17Å; L463-H465 VanDerWaalsContact C-N 3.27Å; H465-S467 PolarHBondContact ND1-N 3.19Å; H465-S467 PolarHBondContact O-N 3.02Å; H465-M468 HydrophobicContact CB-CB 4.1Å; H465-M468 WeakPolarHBondContact O-CB 3.36Å; H465-M468 PolarHBondContact O-N 3.46Å; H465-M468 VanDerWaalsContact O-N 3.08Å; H465-L469 PolarHBondContact O-N 3.3Å
466	P	89.2	Confident	85.4	Confident	25 Å²	25	49.6 Å²	49.6	16%	0.162	25%	0.248	C	C	.	.	H	α-helix	trans	-60.5	-41.6	-172.9	19.9	-30.7	0	0	0	112.8	M468 L469 I470 Y646	P466-M468 VanDerWaalsContact C-N 3.31Å; P466-M468 PolarHBondContact O-N 2.99Å; P466-L469 PolarHBondContact O-N 3.47Å; P466-I470 VanDerWaalsContact O-CG1 3.27Å; P466-I470 WeakPolarHBondContact O-CG1 3.25Å; P466-I470 PolarHBondContact O-N 3.46Å; P466-Y646 HydrophobicContact CB-CE1 4.27Å; P466-Y646 HydrophobicContact CB-CE2 4.24Å; P466-Y646 HydrophobicContact CG-CD1 4.44Å; P466-Y646 HydrophobicContact CG-CE1 3.62Å; P466-Y646 HydrophobicContact CG-CE2 3.92Å; P466-Y646 VanDerWaalsContact CG-OH 3.24Å; P466-Y646 WeakPolarHBondContact CG-OH 3.44Å
467	S	90.1	Very high	86.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.7	-40.9	176.2	-48.4	0	0	0	0	112.2	H465 I470 L471 E584 H647	H465-S467 PolarHBondContact ND1-N 3.19Å; H465-S467 PolarHBondContact O-N 3.02Å; S467-I470 PolarHBondContact O-N 3.27Å; S467-L471 WeakPolarHBondContact O-CB 3.34Å; S467-L471 VanDerWaalsContact O-CG 3.27Å; S467-L471 WeakPolarHBondContact O-CG 3.31Å; S467-L471 PolarHBondContact O-N 3.31Å; S467-E584 WeakPolarHBondContact CB-OE2 3.36Å; S467-E584 PolarHBondContact OG-OE2 2.99Å; S467-H647 PolarHBondContact OG-NE2 3.41Å
468	M	92.7	Very high	88.4	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.2	-42.8	179.1	-177	64.9	-171.6	0	0	110.9	L462 L463 H465 P466 L471 C472 L581 A593 L596 L597	L462-M468 HydrophobicContact CD2-SD 4.46Å; L462-M468 HydrophobicContact CG-CG 4.04Å; L462-M468 WeakPolarHBondContact O-CB 3.45Å; L463-M468 HydrophobicContact CD2-CG 4.3Å; H465-M468 HydrophobicContact CB-CB 4.1Å; H465-M468 WeakPolarHBondContact O-CB 3.36Å; H465-M468 PolarHBondContact O-N 3.46Å; H465-M468 VanDerWaalsContact O-N 3.08Å; P466-M468 VanDerWaalsContact C-N 3.31Å; P466-M468 PolarHBondContact O-N 2.99Å; M468-L471 PolarHBondContact O-N 3.44Å; M468-C472 PolarHBondContact O-N 3.01Å; M468-L581 HydrophobicContact CE-CD2 4.49Å; M468-L581 HydrophobicContact SD-CD2 3.82Å; M468-A593 HydrophobicContact CE-CB 4.36Å; M468-A593 WeakPolarHBondContact CE-O 3.48Å; M468-A593 HydrophobicContact SD-CB 4.32Å; M468-L596 HydrophobicContact CE-CB 3.73Å; M468-L597 HydrophobicContact CE-CB 4.22Å
469	L	93.5	Very high	89.7	Confident	52 Å²	52	41.8 Å²	41.8	27%	0.272	21%	0.207	S	C	.	.	H	α-helix	trans	-61.3	-47	177.2	-176.8	64.6	0	0	0	111.3	I304 H465 P466 L471 C472 V473	I304-L469 HydrophobicContact CG2-CD2 3.58Å; H465-L469 PolarHBondContact O-N 3.3Å; P466-L469 PolarHBondContact O-N 3.47Å; L469-L471 VanDerWaalsContact C-N 3.35Å; L469-L471 PolarHBondContact O-N 2.79Å; L469-C472 PolarHBondContact O-N 3.4Å; L469-V473 WeakPolarHBondContact O-CG2 3.02Å; L469-V473 PolarHBondContact O-N 3.22Å
470	I	94.9	Very high	90.7	Very high	21 Å²	21	40.5 Å²	40.5	11%	0.108	20%	0.2	C	C	.	.	H	α-helix	trans	-61.5	-44.2	177.3	-64.1	164.3	0	0	0	110.4	P466 S467 C472 V473 A474 I639 L642 I643	P466-I470 VanDerWaalsContact O-CG1 3.27Å; P466-I470 WeakPolarHBondContact O-CG1 3.25Å; P466-I470 PolarHBondContact O-N 3.46Å; S467-I470 PolarHBondContact O-N 3.27Å; I470-C472 PolarHBondContact O-N 2.91Å; I470-V473 PolarHBondContact O-N 3.22Å; I470-A474 VanDerWaalsContact O-CB 3.29Å; I470-A474 WeakPolarHBondContact O-CB 3.38Å; I470-A474 PolarHBondContact O-N 3.44Å; I470-I639 HydrophobicContact CG2-CG2 4.09Å; I470-I639 WeakPolarHBondContact CG2-O 3.34Å; I470-L642 HydrophobicContact CD1-CB 4.24Å; I470-L642 HydrophobicContact CG2-CB 4.14Å; I470-I643 HydrophobicContact CB-CD1 4.33Å; I470-I643 HydrophobicContact CB-CG1 3.86Å; I470-I643 HydrophobicContact CD1-CG1 4.24Å; I470-I643 HydrophobicContact CG2-CD1 4.03Å; I470-I643 HydrophobicContact CG2-CG1 3.57Å
471	L	94.8	Very high	91.5	Very high	3 Å²	3	33.5 Å²	33.5	2%	0.016	17%	0.172	C	C	.	.	H	α-helix	trans	-57.2	-46.4	175.3	-76.9	174.5	0	0	0	111.9	S467 M468 L469 N475 I580 L581 E584 L597 I643	S467-L471 WeakPolarHBondContact O-CB 3.34Å; S467-L471 VanDerWaalsContact O-CG 3.27Å; S467-L471 WeakPolarHBondContact O-CG 3.31Å; S467-L471 PolarHBondContact O-N 3.31Å; M468-L471 PolarHBondContact O-N 3.44Å; L469-L471 VanDerWaalsContact C-N 3.35Å; L469-L471 PolarHBondContact O-N 2.79Å; L471-N475 VanDerWaalsContact O-CB 3.28Å; L471-N475 WeakPolarHBondContact O-CB 3.34Å; L471-N475 PolarHBondContact O-N 2.83Å; L471-N475 PolarHBondContact O-ND2 3.39Å; L471-I580 HydrophobicContact CD1-CG2 4.09Å; L471-I580 HydrophobicContact CD2-CG2 3.92Å; L471-L581 HydrophobicContact CD1-CD2 3.85Å; L471-E584 HydrophobicContact CD1-CG 4.27Å; L471-L597 HydrophobicContact CB-CD1 4.16Å; L471-I643 HydrophobicContact CD2-CD1 3.48Å; L471-I643 VanDerWaalsContact CD2-CD1 3.48Å; L471-I643 HydrophobicContact CG-CD1 3.55Å
472	C	94.9	Very high	92.2	Very high	8 Å²	8	24.8 Å²	24.8	5%	0.054	14%	0.139	C	C	.	.	H	α-helix	trans	-62	-48.5	177.6	-79.3	0	0	0	0	112.5	M468 L469 I470 N475 I476 A600	M468-C472 PolarHBondContact O-N 3.01Å; L469-C472 PolarHBondContact O-N 3.4Å; I470-C472 PolarHBondContact O-N 2.91Å; C472-N475 PolarHBondContact O-N 3.49Å; C472-I476 WeakPolarHBondContact O-CG1 3.47Å; C472-I476 PolarHBondContact O-N 2.84Å; C472-A600 HydrophobicContact CB-CB 4.22Å
473	V	95.3	Very high	92.7	Very high	67 Å²	67	24.6 Å²	24.6	41%	0.406	14%	0.138	S	C	.	.	H	α-helix	trans	-62.2	-46.1	179.4	172.6	0	0	0	0	110.6	L469 I470 N475 I476 V477 I639	L469-V473 WeakPolarHBondContact O-CG2 3.02Å; L469-V473 PolarHBondContact O-N 3.22Å; I470-V473 PolarHBondContact O-N 3.22Å; V473-N475 VanDerWaalsContact C-N 3.3Å; V473-N475 PolarHBondContact O-N 3.37Å; V473-I476 PolarHBondContact O-N 3.33Å; V473-V477 WeakPolarHBondContact O-CG2 3.3Å; V473-V477 PolarHBondContact O-N 3.45Å; V473-I639 HydrophobicContact CG1-CG2 4.43Å
474	A	96.2	Very high	93.1	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-62.4	-39.8	178.7	0	0	0	0	0	111.6	I470 V477 G478 S636 I639 H640	I470-A474 VanDerWaalsContact O-CB 3.29Å; I470-A474 WeakPolarHBondContact O-CB 3.38Å; I470-A474 PolarHBondContact O-N 3.44Å; A474-V477 PolarHBondContact O-N 3.25Å; A474-G478 PolarHBondContact O-N 2.98Å; A474-S636 WeakPolarHBondContact O-CB 3.26Å; A474-S636 PolarHBondContact O-OG 3.46Å; A474-I639 HydrophobicContact CB-CB 3.86Å; A474-I639 HydrophobicContact CB-CG2 3.63Å; A474-H640 WeakPolarHBondContact CB-CE1 3.3Å; A474-H640 VanDerWaalsContact CB-ND1 3.25Å; A474-H640 WeakPolarHBondContact CB-ND1 3.27Å
475	N	95	Very high	93.7	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.011	10%	0.1	C	C	.	.	H	α-helix	trans	-69.8	-31.7	178.4	-89.9	-90.8	0	0	0	113.6	L471 C472 V473 M479 Y573 L597 R601 H640	L471-N475 VanDerWaalsContact O-CB 3.28Å; L471-N475 WeakPolarHBondContact O-CB 3.34Å; L471-N475 PolarHBondContact O-N 2.83Å; L471-N475 PolarHBondContact O-ND2 3.39Å; C472-N475 PolarHBondContact O-N 3.49Å; V473-N475 VanDerWaalsContact C-N 3.3Å; V473-N475 PolarHBondContact O-N 3.37Å; N475-M479 VanDerWaalsContact O-CB 3.23Å; N475-M479 WeakPolarHBondContact O-CB 3.37Å; N475-M479 WeakPolarHBondContact O-CG 3.15Å; N475-M479 PolarHBondContact O-N 3.19Å; N475-Y573 PolarHBondContact O-OH 3.05Å; N475-Y573 VanDerWaalsContact OD1-CE2 3.29Å; N475-Y573 WeakPolarHBondContact OD1-CE2 3.27Å; N475-Y573 PolarHBondContact OD1-OH 3.4Å; N475-L597 HydrophobicContact CB-CD1 3.84Å; N475-L597 HydrophobicContact CB-CG 4.49Å; N475-R601 HydrophobicContact CB-CG 3.9Å; N475-H640 PolarHBondContact ND2-NE2 3.13Å
476	I	94.3	Very high	94	Very high	67 Å²	67	15.6 Å²	15.6	34%	0.344	9%	0.087	S	C	.	.	H	α-helix	trans	-59.4	-52.8	171.1	-76.8	163.7	0	0	0	109.8	C472 V473 G478 M479 L480 A600 S604	C472-I476 WeakPolarHBondContact O-CG1 3.47Å; C472-I476 PolarHBondContact O-N 2.84Å; V473-I476 PolarHBondContact O-N 3.33Å; I476-G478 PolarHBondContact O-N 3.24Å; I476-M479 PolarHBondContact O-N 3.23Å; I476-L480 PolarHBondContact O-N 3.47Å; I476-A600 HydrophobicContact CD1-CB 3.98Å; I476-A600 HydrophobicContact CG1-CB 3.8Å; I476-A600 VanDerWaalsContact CG1-O 3.3Å; I476-A600 WeakPolarHBondContact CG1-O 3.07Å; I476-S604 WeakPolarHBondContact CA-OG 3.42Å; I476-S604 WeakPolarHBondContact CG2-OG 3Å; I476-S604 VanDerWaalsContact O-CB 3.28Å; I476-S604 WeakPolarHBondContact O-CB 3.19Å; I476-S604 PolarHBondContact O-OG 3.24Å; I476-S604 VanDerWaalsContact O-OG 3.12Å
477	V	95.8	Very high	94.2	Very high	31 Å²	31	15.1 Å²	15.1	19%	0.188	8%	0.083	C	C	.	.	H	α-helix	trans	-63.1	-45.1	-178.2	-178.8	0	0	0	0	111	V473 A474 L480 L632 A635 I639	V473-V477 WeakPolarHBondContact O-CG2 3.3Å; V473-V477 PolarHBondContact O-N 3.45Å; A474-V477 PolarHBondContact O-N 3.25Å; V477-L480 PolarHBondContact O-N 3.19Å; V477-L632 HydrophobicContact CG1-CB 4.47Å; V477-L632 HydrophobicContact CG1-CD2 4Å; V477-L632 WeakPolarHBondContact CG1-O 3.24Å; V477-A635 HydrophobicContact CG1-CB 4.03Å; V477-I639 HydrophobicContact CB-CD1 4.31Å; V477-I639 HydrophobicContact CG2-CD1 3.95Å
478	G	95.6	Very high	94.4	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-66.1	-40.7	-178.6	0	0	0	0	0	113.6	A474 I476 L480 G481 F482 S636	A474-G478 PolarHBondContact O-N 2.98Å; I476-G478 PolarHBondContact O-N 3.24Å; G478-L480 VanDerWaalsContact C-N 3.3Å; G478-L480 PolarHBondContact O-N 3.39Å; G478-G481 PolarHBondContact O-N 2.69Å; G478-F482 PolarHBondContact O-N 3.45Å; G478-F482 VanDerWaalsContact O-N 3.11Å; G478-S636 VanDerWaalsContact CA-CB 3.45Å
479	M	94.9	Very high	94.6	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-67	-27.4	-179.9	-79.3	-79.4	135.5	0	0	114.2	N475 I476 G481 F482 Y483 Y573 I574 R601	N475-M479 VanDerWaalsContact O-CB 3.23Å; N475-M479 WeakPolarHBondContact O-CB 3.37Å; N475-M479 WeakPolarHBondContact O-CG 3.15Å; N475-M479 PolarHBondContact O-N 3.19Å; I476-M479 PolarHBondContact O-N 3.23Å; M479-G481 PolarHBondContact O-N 3.3Å; M479-F482 HydrophobicContact CE-CB 4.38Å; M479-F482 HydrophobicContact CE-CD1 4.26Å; M479-F482 HydrophobicContact CE-CD2 4.35Å; M479-F482 HydrophobicContact CE-CG 4.07Å; M479-F482 PolarHBondContact O-N 3.49Å; M479-F482 HydrophobicContact SD-CB 4.42Å; M479-F482 HydrophobicContact SD-CD1 4.32Å; M479-F482 HydrophobicContact SD-CG 4.43Å; M479-Y483 HydrophobicContact SD-CE2 3.98Å; M479-Y573 HydrophobicContact CE-CD1 4.21Å; M479-Y573 HydrophobicContact CE-CE1 3.43Å; M479-Y573 VanDerWaalsContact CE-CE1 3.43Å; M479-Y573 PolarHBondContact N-OH 3.11Å; M479-I574 HydrophobicContact CE-CD1 3.57Å; M479-R601 HydrophobicContact CE-CG 4.47Å; M479-R601 HydrophobicContact CG-CB 3.61Å; M479-R601 HydrophobicContact CG-CG 3.56Å; M479-R601 HydrophobicContact SD-CB 4Å; M479-R601 HydrophobicContact SD-CG 4.17Å; M479-R601 PolarHBondContact SD-NE 3.11Å; M479-R601 VanDerWaalsContact SD-NE 3.4Å
480	L	93.6	Very high	94.6	Very high	40 Å²	40	13.4 Å²	13.4	21%	0.209	8%	0.075	C	C	.	.	H	α-helix	trans	-59.8	-34.4	175.1	-75.7	168.3	0	0	0	112	I476 V477 G478 S604 V607 G608 I611 L632	I476-L480 PolarHBondContact O-N 3.47Å; V477-L480 PolarHBondContact O-N 3.19Å; G478-L480 VanDerWaalsContact C-N 3.3Å; G478-L480 PolarHBondContact O-N 3.39Å; L480-S604 WeakPolarHBondContact CD2-O 3.34Å; L480-V607 HydrophobicContact CD2-CB 4.45Å; L480-G608 VanDerWaalsContact O-CA 3.31Å; L480-G608 WeakPolarHBondContact O-CA 3.35Å; L480-I611 HydrophobicContact CD2-CD1 4.32Å; L480-L632 HydrophobicContact CB-CD1 3.81Å; L480-L632 HydrophobicContact CD1-CD2 4.5Å
481	G	94.4	Very high	94.4	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-91.8	-25.1	177.1	0	0	0	0	0	114.5	G478 M479 Y483 V484 P485	G478-G481 PolarHBondContact O-N 2.69Å; M479-G481 PolarHBondContact O-N 3.3Å; G481-Y483 PolarHBondContact O-N 3.13Å; G481-V484 PolarHBondContact O-N 3.34Å; G481-P485 WeakPolarHBondContact O-CD 3.08Å
482	F	95.5	Very high	94.4	Very high	1 Å²	1	14 Å²	14	0%	0.004	8%	0.081	C	C	.	.	H	α-helix	trans	-56.1	-41.2	-170.2	173.6	-92.9	0	0	0	114.6	Y82 G478 M479 P485 F486 I570 Y573 I574	Y82-F482 AromaticContact CE1-CE1 3.64Å; Y82-F482 HydrophobicContact CE1-CE1 3.64Å; Y82-F482 HydrophobicContact CE1-CZ 4.15Å; Y82-F482 AromaticContact CZ-CE1 3.87Å; Y82-F482 AromaticContact CZ-CZ 3.93Å; G478-F482 PolarHBondContact O-N 3.45Å; G478-F482 VanDerWaalsContact O-N 3.11Å; M479-F482 HydrophobicContact CE-CB 4.38Å; M479-F482 HydrophobicContact CE-CD1 4.26Å; M479-F482 HydrophobicContact CE-CD2 4.35Å; M479-F482 HydrophobicContact CE-CG 4.07Å; M479-F482 PolarHBondContact O-N 3.49Å; M479-F482 HydrophobicContact SD-CB 4.42Å; M479-F482 HydrophobicContact SD-CD1 4.32Å; M479-F482 HydrophobicContact SD-CG 4.43Å; F482-P485 WeakPolarHBondContact O-CD 3.45Å; F482-F486 HydrophobicContact CD1-CE2 4.38Å; F482-F486 HydrophobicContact CE1-CD2 4.26Å; F482-F486 AromaticContact CE1-CE2 3.83Å; F482-F486 HydrophobicContact CE1-CE2 3.83Å; F482-F486 AromaticContact CE2-CE2 4Å; F482-F486 HydrophobicContact CE2-CE2 4Å; F482-F486 HydrophobicContact CZ-CD2 4.48Å; F482-F486 AromaticContact CZ-CE2 3.62Å; F482-F486 HydrophobicContact CZ-CE2 3.62Å; F482-F486 HydrophobicContact CZ-CZ 4.17Å; F482-F486 WeakPolarHBondContact O-CD2 2.87Å; F482-I570 HydrophobicContact CD2-CD1 3.9Å; F482-I570 HydrophobicContact CD2-CG1 3.69Å; F482-I570 HydrophobicContact CE2-CD1 4.28Å; F482-I570 HydrophobicContact CE2-CG1 3.56Å; F482-Y573 AromaticContact CD2-CD1 3.97Å; F482-Y573 HydrophobicContact CD2-CD1 3.97Å; F482-Y573 HydrophobicContact CD2-CE1 4.11Å; F482-Y573 HydrophobicContact CE2-CD1 4.41Å; F482-I574 HydrophobicContact CD2-CD1 4.46Å; F482-I574 HydrophobicContact CE2-CD1 3.89Å; F482-I574 HydrophobicContact CE2-CG1 3.88Å; F482-I574 HydrophobicContact CZ-CD1 4.08Å; F482-I574 HydrophobicContact CZ-CG1 4.03Å
483	Y	93.2	Very high	94.4	Very high	4 Å²	4	13.7 Å²	13.7	2%	0.016	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-17.3	-174.6	-74.5	-82.3	0	0	0	114.2	Y82 V110 Y113 M479 G481 F486 V487 A605	Y82-Y483 HydrophobicContact CD1-CD1 4.23Å; Y82-Y483 AromaticContact CD1-CE1 3.76Å; Y82-Y483 HydrophobicContact CD1-CE1 3.76Å; Y82-Y483 HydrophobicContact CE1-CD1 4.22Å; Y82-Y483 AromaticContact CE1-CE1 3.4Å; Y82-Y483 HydrophobicContact CE1-CE1 3.4Å; Y82-Y483 VanDerWaalsContact CE1-CE1 3.4Å; V110-Y483 HydrophobicContact CB-CE1 4.23Å; V110-Y483 HydrophobicContact CG1-CD1 4.1Å; V110-Y483 HydrophobicContact CG1-CD2 4.27Å; V110-Y483 HydrophobicContact CG1-CE1 3.29Å; V110-Y483 HydrophobicContact CG1-CE2 3.57Å; V110-Y483 WeakPolarHBondContact CG1-OH 3.47Å; V110-Y483 HydrophobicContact CG2-CD1 4.46Å; V110-Y483 HydrophobicContact CG2-CE1 3.93Å; Y113-Y483 PolarHBondContact OH-OH 3.41Å; M479-Y483 HydrophobicContact SD-CE2 3.98Å; G481-Y483 PolarHBondContact O-N 3.13Å; Y483-F486 PolarHBondContact O-N 2.97Å; Y483-F486 VanDerWaalsContact O-N 3.11Å; Y483-V487 WeakPolarHBondContact O-CG2 3.26Å; Y483-V487 PolarHBondContact O-N 2.94Å; Y483-A605 HydrophobicContact CD2-CB 3.8Å; Y483-A605 HydrophobicContact CE2-CB 3.4Å; Y483-A605 VanDerWaalsContact CE2-CB 3.4Å
484	V	93.2	Very high	94.3	Very high	4 Å²	4	14.1 Å²	14.1	2%	0.024	8%	0.076	C	C	.	.	H	α-helix	trans	-58.2	-47.4	-174.9	165.3	0	0	0	0	112.3	G481 F486 V487 Y488 A629	G481-V484 PolarHBondContact O-N 3.34Å; V484-F486 VanDerWaalsContact C-N 3.32Å; V484-F486 PolarHBondContact O-N 3.38Å; V484-V487 PolarHBondContact O-N 3.06Å; V484-Y488 HydrophobicContact CB-CD2 4.35Å; V484-Y488 HydrophobicContact CG1-CD2 4.04Å; V484-Y488 HydrophobicContact CG2-CD2 4.39Å; V484-Y488 WeakPolarHBondContact O-CB 3.22Å; V484-Y488 PolarHBondContact O-N 2.94Å; V484-A629 HydrophobicContact CB-CB 3.67Å; V484-A629 HydrophobicContact CG1-CB 3.82Å; V484-A629 HydrophobicContact CG2-CB 3.88Å
485	P	94.2	Very high	94.2	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-62.1	-35.6	176.2	-27.2	39.3	0	0	0	113.7	G481 F482 L489 T547 Y562 F566 F626	G481-P485 WeakPolarHBondContact O-CD 3.08Å; F482-P485 WeakPolarHBondContact O-CD 3.45Å; P485-L489 WeakPolarHBondContact O-CB 3.16Å; P485-L489 PolarHBondContact O-N 3.14Å; P485-T547 HydrophobicContact CG-CG2 4.15Å; P485-Y562 HydrophobicContact CB-CE1 4.37Å; P485-Y562 WeakPolarHBondContact CB-OH 3.4Å; P485-Y562 WeakPolarHBondContact CG-OH 3.4Å; P485-F566 HydrophobicContact CB-CD1 4.3Å; P485-F566 HydrophobicContact CB-CE1 3.8Å; P485-F566 HydrophobicContact CB-CE2 4.16Å; P485-F566 HydrophobicContact CB-CZ 3.73Å; P485-F566 HydrophobicContact CG-CD2 4.34Å; P485-F566 HydrophobicContact CG-CE1 4.21Å; P485-F566 HydrophobicContact CG-CE2 3.68Å; P485-F566 HydrophobicContact CG-CZ 3.61Å; P485-F626 HydrophobicContact CB-CE1 4.05Å; P485-F626 HydrophobicContact CG-CD1 4.47Å; P485-F626 HydrophobicContact CG-CE1 4.03Å
486	F	93.8	Very high	94.1	Very high	3 Å²	3	21 Å²	21	1%	0.013	12%	0.118	C	C	.	.	H	α-helix	trans	-71	-38.4	178.8	-64.2	-80.9	0	0	0	112.2	Y82 T202 F482 Y483 V484 L507 I510 F566	Y82-F486 HydrophobicContact CD1-CD1 4.38Å; Y82-F486 HydrophobicContact CD1-CD2 4.45Å; Y82-F486 HydrophobicContact CD1-CG 4.26Å; Y82-F486 HydrophobicContact CD2-CD1 4.41Å; Y82-F486 HydrophobicContact CD2-CE1 4.13Å; Y82-F486 AromaticContact CG-CD1 3.92Å; Y82-F486 HydrophobicContact CG-CD1 3.92Å; Y82-F486 HydrophobicContact CG-CE1 4.1Å; Y82-F486 HydrophobicContact CG-CG 4.25Å; T202-F486 HydrophobicContact CG2-CD1 4.46Å; T202-F486 HydrophobicContact CG2-CE1 4.37Å; F482-F486 HydrophobicContact CD1-CE2 4.38Å; F482-F486 HydrophobicContact CE1-CD2 4.26Å; F482-F486 AromaticContact CE1-CE2 3.83Å; F482-F486 HydrophobicContact CE1-CE2 3.83Å; F482-F486 AromaticContact CE2-CE2 4Å; F482-F486 HydrophobicContact CE2-CE2 4Å; F482-F486 HydrophobicContact CZ-CD2 4.48Å; F482-F486 AromaticContact CZ-CE2 3.62Å; F482-F486 HydrophobicContact CZ-CE2 3.62Å; F482-F486 HydrophobicContact CZ-CZ 4.17Å; F482-F486 WeakPolarHBondContact O-CD2 2.87Å; Y483-F486 PolarHBondContact O-N 2.97Å; Y483-F486 VanDerWaalsContact O-N 3.11Å; V484-F486 VanDerWaalsContact C-N 3.32Å; V484-F486 PolarHBondContact O-N 3.38Å; F486-L507 HydrophobicContact CD1-CD1 3.78Å; F486-I510 HydrophobicContact CE1-CG2 3.67Å; F486-I510 HydrophobicContact CZ-CG2 4.13Å; F486-F566 HydrophobicContact CD2-CE1 4.49Å; F486-F566 AromaticContact CE2-CE1 3.81Å; F486-F566 HydrophobicContact CE2-CE1 3.81Å; F486-F566 HydrophobicContact CE2-CZ 4.03Å; F486-F566 AromaticContact CZ-CE1 3.86Å; F486-F566 HydrophobicContact CZ-CE1 3.86Å; F486-F566 HydrophobicContact CZ-CZ 4.49Å
487	V	93.1	Very high	94.1	Very high	14 Å²	14	21 Å²	21	9%	0.085	13%	0.134	C	C	.	.	H	α-helix	trans	-82.4	-39.5	-176.4	177.8	0	0	0	0	112.4	L88 Y483 V484	L88-V487 HydrophobicContact CD1-CG1 4.05Å; Y483-V487 WeakPolarHBondContact O-CG2 3.26Å; Y483-V487 PolarHBondContact O-N 2.94Å; V484-V487 PolarHBondContact O-N 3.06Å
488	Y	93.9	Very high	94.1	Very high	2 Å²	2	20.3 Å²	20.3	1%	0.008	13%	0.131	C	C	.	.	H	α-helix	trans	-113.6	-9.8	-165.7	-61.5	-64.3	0	0	0	115.4	V99 V484 T490 A491 Y492 S609 G613 Y622	V99-Y488 HydrophobicContact CG1-CE1 4.46Å; V484-Y488 HydrophobicContact CB-CD2 4.35Å; V484-Y488 HydrophobicContact CG1-CD2 4.04Å; V484-Y488 HydrophobicContact CG2-CD2 4.39Å; V484-Y488 WeakPolarHBondContact O-CB 3.22Å; V484-Y488 PolarHBondContact O-N 2.94Å; Y488-T490 VanDerWaalsContact C-N 3.34Å; Y488-T490 PolarHBondContact O-N 3.38Å; Y488-A491 PolarHBondContact O-N 3.43Å; Y488-Y492 VanDerWaalsContact O-CB 3.32Å; Y488-Y492 WeakPolarHBondContact O-CB 3.37Å; Y488-Y492 PolarHBondContact O-N 2.93Å; Y488-S609 WeakPolarHBondContact CE2-O 3.17Å; Y488-S609 PolarHBondContact OH-O 3.45Å; Y488-G613 WeakPolarHBondContact OH-CA 3.36Å; Y488-G613 PolarHBondContact OH-N 3.28Å; Y488-G613 VanDerWaalsContact OH-N 3.14Å; Y488-Y622 HydrophobicContact CD1-CD1 4.08Å; Y488-Y622 AromaticContact CD1-CE1 3.68Å; Y488-Y622 HydrophobicContact CD1-CE1 3.68Å; Y488-Y622 HydrophobicContact CE1-CE1 4.41Å; Y488-Y622 HydrophobicContact CG-CD1 4.3Å; Y488-Y622 HydrophobicContact CG-CE1 4.34Å
489	L	95.7	Very high	94	Very high	3 Å²	3	23.3 Å²	23.3	2%	0.016	15%	0.15	C	C	.	.	H	α-helix	trans	-64.1	-38.9	-177.9	-178.9	63.7	0	0	0	112.9	P485 Y492 A493 L506 I510 L559 Y562 F626	P485-L489 WeakPolarHBondContact O-CB 3.16Å; P485-L489 PolarHBondContact O-N 3.14Å; L489-Y492 PolarHBondContact O-N 2.92Å; L489-A493 WeakPolarHBondContact O-CB 3.04Å; L489-A493 PolarHBondContact O-N 3.19Å; L489-L506 HydrophobicContact CD2-CB 4.09Å; L489-L506 HydrophobicContact CG-CB 4.46Å; L489-L506 HydrophobicContact CG-CD1 4.3Å; L489-I510 HydrophobicContact CD2-CD1 3.51Å; L489-L559 HydrophobicContact CD1-CD2 4.19Å; L489-Y562 HydrophobicContact CD1-CD1 3.95Å; L489-Y562 HydrophobicContact CD1-CE1 3.98Å; L489-Y562 HydrophobicContact CD2-CD1 4.17Å; L489-Y562 HydrophobicContact CD2-CE1 4.06Å; L489-F626 HydrophobicContact CB-CZ 3.98Å; L489-F626 HydrophobicContact CD1-CE1 4.33Å; L489-F626 HydrophobicContact CD1-CZ 4Å
490	T	93.6	Very high	93.6	Very high	11 Å²	11	29.7 Å²	29.7	7%	0.067	18%	0.177	C	C	.	.	H	α-helix	trans	-63.1	-51	177.3	54.3	0	0	0	0	110.5	Y488 Y492 A493 E494 L507	Y488-T490 VanDerWaalsContact C-N 3.34Å; Y488-T490 PolarHBondContact O-N 3.38Å; T490-Y492 VanDerWaalsContact C-N 3.27Å; T490-Y492 PolarHBondContact O-N 3.34Å; T490-A493 PolarHBondContact O-N 3.29Å; T490-A493 VanDerWaalsContact O-N 3.17Å; T490-E494 WeakPolarHBondContact O-CG 3.4Å; T490-E494 PolarHBondContact O-N 3.08Å; T490-L507 HydrophobicContact CG2-CB 4.48Å
491	A	92.1	Very high	93.4	Very high	24 Å²	24	33.6 Å²	33.6	20%	0.198	19%	0.194	C	C	.	.	H	α-helix	trans	-61	-35.5	176.6	0	0	0	0	0	112.4	Y488 S495 Y622	Y488-A491 PolarHBondContact O-N 3.43Å; A491-S495 WeakPolarHBondContact O-CB 3.48Å; A491-S495 PolarHBondContact O-N 3.33Å; A491-Y622 HydrophobicContact CB-CE1 4.18Å; A491-Y622 HydrophobicContact CB-CE2 3.91Å
492	Y	93.9	Very high	93.3	Very high	14 Å²	14	37.1 Å²	37.1	6%	0.055	21%	0.211	C	C	.	.	H	α-helix	trans	-66.6	-44.9	175.1	-177	-146.6	0	0	0	111.7	Y488 L489 T490 E494 S495 L496 F553 L559 Y622 F626	Y488-Y492 VanDerWaalsContact O-CB 3.32Å; Y488-Y492 WeakPolarHBondContact O-CB 3.37Å; Y488-Y492 PolarHBondContact O-N 2.93Å; L489-Y492 PolarHBondContact O-N 2.92Å; T490-Y492 VanDerWaalsContact C-N 3.27Å; T490-Y492 PolarHBondContact O-N 3.34Å; Y492-E494 PolarHBondContact O-N 3.48Å; Y492-S495 PolarHBondContact O-N 2.72Å; Y492-S495 PolarHBondContact O-OG 2.97Å; Y492-L496 HydrophobicContact CD2-CD1 4.39Å; Y492-L496 HydrophobicContact CD2-CG 4.38Å; Y492-L496 HydrophobicContact CE2-CD1 3.93Å; Y492-L496 HydrophobicContact CE2-CD2 4.3Å; Y492-L496 HydrophobicContact CE2-CG 4.07Å; Y492-L496 PolarHBondContact O-N 3.22Å; Y492-F553 PolarHBondContact OH-O 3.41Å; Y492-L559 HydrophobicContact CD1-CD2 4.11Å; Y492-L559 HydrophobicContact CE1-CD2 3.91Å; Y492-Y622 HydrophobicContact CD2-CD2 4.41Å; Y492-F626 HydrophobicContact CD1-CD2 4.05Å; Y492-F626 AromaticContact CD1-CE2 3.73Å; Y492-F626 HydrophobicContact CD1-CE2 3.73Å; Y492-F626 HydrophobicContact CD1-CZ 4.35Å; Y492-F626 HydrophobicContact CE1-CD2 4.49Å; Y492-F626 HydrophobicContact CG-CE2 4.14Å
493	A	95.7	Very high	93.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.3	-41.9	177	0	0	0	0	0	112.5	L489 T490 S495 L496 G497 S498 L506 L559	L489-A493 WeakPolarHBondContact O-CB 3.04Å; L489-A493 PolarHBondContact O-N 3.19Å; T490-A493 PolarHBondContact O-N 3.29Å; T490-A493 VanDerWaalsContact O-N 3.17Å; A493-S495 VanDerWaalsContact C-N 3.34Å; A493-L496 PolarHBondContact O-N 3.25Å; A493-G497 PolarHBondContact O-N 3.28Å; A493-S498 WeakPolarHBondContact O-CB 3.39Å; A493-S498 PolarHBondContact O-N 3.06Å; A493-S498 PolarHBondContact O-OG 3.39Å; A493-L506 HydrophobicContact CB-CD1 3.5Å; A493-L506 VanDerWaalsContact CB-CD1 3.5Å; A493-L559 HydrophobicContact CB-CD1 3.8Å
494	E	93.5	Very high	93.1	Very high	76 Å²	76	37.8 Å²	37.8	36%	0.355	22%	0.216	S	C	.	.	H	α-helix	trans	-63.4	-38.8	174.4	-68.6	179.7	-161.7	0	0	111.5	T490 Y492 L496 G497 S503	T490-E494 WeakPolarHBondContact O-CG 3.4Å; T490-E494 PolarHBondContact O-N 3.08Å; Y492-E494 PolarHBondContact O-N 3.48Å; E494-L496 PolarHBondContact O-N 3.2Å; E494-G497 WeakPolarHBondContact O-CA 3.4Å; E494-G497 PolarHBondContact O-N 3.05Å; E494-S503 WeakPolarHBondContact CG-OG 3.19Å
495	S	92.4	Very high	93.2	Very high	72 Å²	72	41.5 Å²	41.5	50%	0.503	24%	0.236	S	C	.	.	H	α-helix	trans	-65.3	-20.9	176.2	77.7	0	0	0	0	113.9	A491 Y492 A493	A491-S495 WeakPolarHBondContact O-CB 3.48Å; A491-S495 PolarHBondContact O-N 3.33Å; Y492-S495 PolarHBondContact O-N 2.72Å; Y492-S495 PolarHBondContact O-OG 2.97Å; A493-S495 VanDerWaalsContact C-N 3.34Å
496	L	94.1	Very high	93.3	Very high	74 Å²	74	41.5 Å²	41.5	39%	0.387	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	2.6	172.2	-63.8	176.4	0	0	0	112.9	Y492 A493 E494 L559	Y492-L496 HydrophobicContact CD2-CD1 4.39Å; Y492-L496 HydrophobicContact CD2-CG 4.38Å; Y492-L496 HydrophobicContact CE2-CD1 3.93Å; Y492-L496 HydrophobicContact CE2-CD2 4.3Å; Y492-L496 HydrophobicContact CE2-CG 4.07Å; Y492-L496 PolarHBondContact O-N 3.22Å; A493-L496 PolarHBondContact O-N 3.25Å; E494-L496 PolarHBondContact O-N 3.2Å; L496-L559 HydrophobicContact CD1-CD1 3.97Å
497	G	94.3	Very high	93.4	Very high	67 Å²	67	41.5 Å²	41.5	69%	0.691	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	95	13.4	177.2	0	0	0	0	0	115.6	A493 E494	A493-G497 PolarHBondContact O-N 3.28Å; E494-G497 WeakPolarHBondContact O-CA 3.4Å; E494-G497 PolarHBondContact O-N 3.05Å
498	S	94.6	Very high	93.5	Very high	17 Å²	17	41.1 Å²	41.1	12%	0.119	23%	0.234	C	C	.	.			trans	-74.1	150.6	174.5	-50.1	0	0	0	0	111.3	A493	A493-S498 WeakPolarHBondContact O-CB 3.39Å; A493-S498 PolarHBondContact O-N 3.06Å; A493-S498 PolarHBondContact O-OG 3.39Å
499	T	93.7	Very high	93.7	Very high	64 Å²	64	42 Å²	42	39%	0.393	24%	0.24	S	C	.	.			trans	-72.5	166.6	174.6	80.6	0	0	0	0	111.9	E501 Q502 S503	T499-E501 VanDerWaalsContact C-N 3.29Å; T499-E501 WeakPolarHBondContact CB-OE2 3.4Å; T499-E501 PolarHBondContact O-N 2.85Å; T499-E501 PolarHBondContact OG1-N 3.44Å; T499-E501 PolarHBondContact OG1-OE2 3.46Å; T499-Q502 PolarHBondContact O-N 3.45Å; T499-Q502 WeakPolarHBondContact OG1-CG 3.38Å; T499-Q502 PolarHBondContact OG1-N 3.21Å; T499-S503 WeakPolarHBondContact O-CB 3.25Å; T499-S503 PolarHBondContact O-N 2.88Å; T499-S503 PolarHBondContact O-OG 3.42Å
500	K	87.6	Confident	93.8	Very high	134 Å²	134	41.9 Å²	41.9	58%	0.583	24%	0.239	S	C	*	.	H	α-helix	trans	-61.7	-38.2	176.4	-71.8	-173.6	176.5	-176.8	0	111.9	S503 S504	K500-S503 PolarHBondContact O-N 2.98Å; K500-S504 WeakPolarHBondContact O-CB 3.37Å; K500-S504 PolarHBondContact O-N 3.35Å; K500-S504 PolarHBondContact O-OG 3.45Å
501	E	89.2	Confident	94	Very high	121 Å²	121	41.4 Å²	41.4	57%	0.565	24%	0.236	S	C	*	.	H	α-helix	trans	-68.5	-43.1	178.3	-54.9	71.4	-152.8	0	0	110.9	T499 S503 S504 L505	T499-E501 VanDerWaalsContact C-N 3.29Å; T499-E501 WeakPolarHBondContact CB-OE2 3.4Å; T499-E501 PolarHBondContact O-N 2.85Å; T499-E501 PolarHBondContact OG1-N 3.44Å; T499-E501 PolarHBondContact OG1-OE2 3.46Å; E501-S503 VanDerWaalsContact C-N 3.3Å; E501-S503 PolarHBondContact O-N 3.03Å; E501-S504 PolarHBondContact O-OG 2.82Å; E501-S504 VanDerWaalsContact O-OG 3.11Å; E501-L505 VanDerWaalsContact O-CB 3.28Å; E501-L505 WeakPolarHBondContact O-CB 3.26Å; E501-L505 PolarHBondContact O-N 2.66Å
502	Q	92.6	Very high	94.3	Very high	75 Å²	75	43.6 Å²	43.6	35%	0.35	24%	0.243	S	C	.	.	H	α-helix	trans	-62.4	-40.7	174.6	-76.1	178.9	-29.7	0	0	111.5	T499 L505 L506 Y556	T499-Q502 PolarHBondContact O-N 3.45Å; T499-Q502 WeakPolarHBondContact OG1-CG 3.38Å; T499-Q502 PolarHBondContact OG1-N 3.21Å; Q502-L505 WeakPolarHBondContact O-CB 3.03Å; Q502-L505 PolarHBondContact O-N 2.81Å; Q502-L506 PolarHBondContact O-N 2.72Å; Q502-Y556 HydrophobicContact CB-CD2 4.3Å; Q502-Y556 HydrophobicContact CB-CE2 3.66Å; Q502-Y556 HydrophobicContact CG-CE2 4.38Å; Q502-Y556 VanDerWaalsContact O-CE2 3.3Å; Q502-Y556 WeakPolarHBondContact O-CE2 3.35Å; Q502-Y556 PolarHBondContact O-OH 2.88Å
503	S	92.4	Very high	94.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-71	-44.1	-178.5	-58.7	0	0	0	0	111.8	E494 T499 K500 E501 L505 L506	E494-S503 WeakPolarHBondContact CG-OG 3.19Å; T499-S503 WeakPolarHBondContact O-CB 3.25Å; T499-S503 PolarHBondContact O-N 2.88Å; T499-S503 PolarHBondContact O-OG 3.42Å; K500-S503 PolarHBondContact O-N 2.98Å; E501-S503 VanDerWaalsContact C-N 3.3Å; E501-S503 PolarHBondContact O-N 3.03Å; S503-L505 VanDerWaalsContact C-N 3.29Å; S503-L505 PolarHBondContact O-N 3.4Å; S503-L506 WeakPolarHBondContact O-CB 3.21Å; S503-L506 PolarHBondContact O-N 2.9Å
504	S	92.4	Very high	94.6	Very high	18 Å²	18	44 Å²	44	13%	0.126	25%	0.247	C	C	.	.	H	α-helix	trans	-64.6	-34.4	174.2	69.5	0	0	0	0	112	K500 E501 L506 L507 S508	K500-S504 WeakPolarHBondContact O-CB 3.37Å; K500-S504 PolarHBondContact O-N 3.35Å; K500-S504 PolarHBondContact O-OG 3.45Å; E501-S504 PolarHBondContact O-OG 2.82Å; E501-S504 VanDerWaalsContact O-OG 3.11Å; S504-L506 VanDerWaalsContact C-N 3.27Å; S504-L506 PolarHBondContact O-N 3.2Å; S504-L507 PolarHBondContact O-N 2.78Å; S504-L507 VanDerWaalsContact O-N 3.17Å; S504-S508 PolarHBondContact O-N 3.47Å; S504-S508 VanDerWaalsContact O-N 3.07Å; S504-S508 PolarHBondContact O-OG 3.49Å
505	L	95	Very high	94.8	Very high	83 Å²	83	41.9 Å²	41.9	44%	0.435	24%	0.239	S	C	.	.	H	α-helix	trans	-60.3	-33.5	174.3	-177.1	62.8	0	0	0	112.7	E501 Q502 S503 L507 S508 V509 M560	E501-L505 VanDerWaalsContact O-CB 3.28Å; E501-L505 WeakPolarHBondContact O-CB 3.26Å; E501-L505 PolarHBondContact O-N 2.66Å; Q502-L505 WeakPolarHBondContact O-CB 3.03Å; Q502-L505 PolarHBondContact O-N 2.81Å; S503-L505 VanDerWaalsContact C-N 3.29Å; S503-L505 PolarHBondContact O-N 3.4Å; L505-L507 VanDerWaalsContact C-N 3.32Å; L505-L507 PolarHBondContact O-N 3.24Å; L505-S508 WeakPolarHBondContact O-CB 3.22Å; L505-S508 PolarHBondContact O-N 2.75Å; L505-V509 HydrophobicContact CD1-CG2 4.28Å; L505-V509 HydrophobicContact CG-CG2 4.38Å; L505-V509 WeakPolarHBondContact O-CG2 3.32Å; L505-V509 PolarHBondContact O-N 3.36Å; L505-M560 HydrophobicContact CD2-CE 4.18Å; L505-M560 HydrophobicContact CG-CE 4.18Å
506	L	96.8	Very high	95.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.1	-42.5	175.8	-67.4	172.7	0	0	0	111.8	L489 A493 Q502 S503 S504 V509 I510 Y556 L559 M560 S563	L489-L506 HydrophobicContact CD2-CB 4.09Å; L489-L506 HydrophobicContact CG-CB 4.46Å; L489-L506 HydrophobicContact CG-CD1 4.3Å; A493-L506 HydrophobicContact CB-CD1 3.5Å; A493-L506 VanDerWaalsContact CB-CD1 3.5Å; Q502-L506 PolarHBondContact O-N 2.72Å; S503-L506 WeakPolarHBondContact O-CB 3.21Å; S503-L506 PolarHBondContact O-N 2.9Å; S504-L506 VanDerWaalsContact C-N 3.27Å; S504-L506 PolarHBondContact O-N 3.2Å; L506-V509 PolarHBondContact O-N 2.94Å; L506-I510 WeakPolarHBondContact O-CG1 3.38Å; L506-I510 PolarHBondContact O-N 3.07Å; L506-I510 VanDerWaalsContact O-N 3.09Å; L506-Y556 HydrophobicContact CD1-CD2 4.5Å; L506-Y556 HydrophobicContact CD1-CE2 4.12Å; L506-Y556 HydrophobicContact CD2-CD2 4.45Å; L506-Y556 HydrophobicContact CD2-CE2 3.82Å; L506-Y556 HydrophobicContact CG-CE2 3.85Å; L506-L559 HydrophobicContact CD1-CB 4.1Å; L506-L559 HydrophobicContact CD1-CD1 4.34Å; L506-L559 HydrophobicContact CD2-CB 4.17Å; L506-M560 HydrophobicContact CD2-CB 4.13Å; L506-M560 HydrophobicContact CD2-CE 3.77Å; L506-M560 HydrophobicContact CD2-SD 4.15Å; L506-S563 WeakPolarHBondContact CB-OG 3.38Å; L506-S563 WeakPolarHBondContact O-CB 3.46Å; L506-S563 PolarHBondContact O-OG 3.41Å; L506-S563 VanDerWaalsContact O-OG 3.09Å
507	L	94.7	Very high	95.3	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-70	-38.9	178	-169.9	61.3	0	0	0	111.1	I86 T202 A206 F486 T490 S504 L505 V509 I510 G511	I86-L507 HydrophobicContact CD1-CD2 4.21Å; I86-L507 HydrophobicContact CG1-CD2 4.42Å; T202-L507 HydrophobicContact CG2-CD1 3.84Å; T202-L507 HydrophobicContact CG2-CG 3.78Å; A206-L507 HydrophobicContact CB-CB 4.33Å; A206-L507 HydrophobicContact CB-CD2 4.03Å; A206-L507 HydrophobicContact CB-CG 4.24Å; F486-L507 HydrophobicContact CD1-CD1 3.78Å; T490-L507 HydrophobicContact CG2-CB 4.48Å; S504-L507 PolarHBondContact O-N 2.78Å; S504-L507 VanDerWaalsContact O-N 3.17Å; L505-L507 VanDerWaalsContact C-N 3.32Å; L505-L507 PolarHBondContact O-N 3.24Å; L507-V509 VanDerWaalsContact C-N 3.32Å; L507-V509 PolarHBondContact O-N 3.14Å; L507-I510 HydrophobicContact CD1-CD1 4.45Å; L507-I510 WeakPolarHBondContact O-CB 3.23Å; L507-I510 PolarHBondContact O-N 3.1Å; L507-G511 PolarHBondContact O-N 3.43Å
508	S	95.8	Very high	95.5	Very high	7 Å²	7	36.5 Å²	36.5	5%	0.049	19%	0.189	C	C	.	.	H	α-helix	trans	-58.9	-43.2	173.6	-62.8	0	0	0	0	112.3	S504 L505 G511 I512	S504-S508 PolarHBondContact O-N 3.47Å; S504-S508 VanDerWaalsContact O-N 3.07Å; S504-S508 PolarHBondContact O-OG 3.49Å; L505-S508 WeakPolarHBondContact O-CB 3.22Å; L505-S508 PolarHBondContact O-N 2.75Å; S508-G511 WeakPolarHBondContact O-CA 3.37Å; S508-G511 PolarHBondContact O-N 3.02Å; S508-G511 VanDerWaalsContact O-N 3.11Å; S508-I512 WeakPolarHBondContact O-CG1 3.36Å; S508-I512 PolarHBondContact O-N 2.86Å
509	V	97.7	Very high	95.7	Very high	21 Å²	21	38.2 Å²	38.2	13%	0.127	20%	0.198	C	C	.	.	H	α-helix	trans	-67.8	-36.7	177.6	170.2	0	0	0	0	112.1	L505 L506 L507 G511 I512 T513 M560 V564	L505-V509 HydrophobicContact CD1-CG2 4.28Å; L505-V509 HydrophobicContact CG-CG2 4.38Å; L505-V509 WeakPolarHBondContact O-CG2 3.32Å; L505-V509 PolarHBondContact O-N 3.36Å; L506-V509 PolarHBondContact O-N 2.94Å; L507-V509 VanDerWaalsContact C-N 3.32Å; L507-V509 PolarHBondContact O-N 3.14Å; V509-G511 VanDerWaalsContact C-N 3.28Å; V509-G511 PolarHBondContact O-N 3.26Å; V509-I512 PolarHBondContact O-N 3.41Å; V509-T513 HydrophobicContact CG1-CG2 4.41Å; V509-T513 WeakPolarHBondContact O-CG2 3.48Å; V509-T513 PolarHBondContact O-N 3.01Å; V509-T513 PolarHBondContact O-OG1 3.15Å; V509-M560 HydrophobicContact CB-SD 4.01Å; V509-M560 HydrophobicContact CG1-SD 3.86Å; V509-M560 HydrophobicContact CG2-CE 4.3Å; V509-M560 HydrophobicContact CG2-SD 3.75Å; V509-V564 HydrophobicContact CG1-CB 4.49Å; V509-V564 HydrophobicContact CG1-CG2 3.48Å; V509-V564 VanDerWaalsContact CG1-CG2 3.48Å
510	I	97.6	Very high	95.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-56.1	-47.7	168.3	-71	170.7	0	0	0	109.3	F486 L489 L506 L507 I512 T513 N514 S563 F566	F486-I510 HydrophobicContact CE1-CG2 3.67Å; F486-I510 HydrophobicContact CZ-CG2 4.13Å; L489-I510 HydrophobicContact CD2-CD1 3.51Å; L506-I510 WeakPolarHBondContact O-CG1 3.38Å; L506-I510 PolarHBondContact O-N 3.07Å; L506-I510 VanDerWaalsContact O-N 3.09Å; L507-I510 HydrophobicContact CD1-CD1 4.45Å; L507-I510 WeakPolarHBondContact O-CB 3.23Å; L507-I510 PolarHBondContact O-N 3.1Å; I510-I512 PolarHBondContact O-N 3.11Å; I510-T513 PolarHBondContact O-N 3.29Å; I510-T513 PolarHBondContact O-OG1 3.08Å; I510-N514 WeakPolarHBondContact O-CB 3.43Å; I510-N514 PolarHBondContact O-N 3.11Å; I510-S563 WeakPolarHBondContact CG1-O 3.48Å; I510-F566 HydrophobicContact CD1-CD1 3.95Å; I510-F566 HydrophobicContact CD1-CE1 4.47Å; I510-F566 HydrophobicContact CG1-CD1 4.17Å; I510-F566 HydrophobicContact CG2-CD1 4.05Å; I510-F566 HydrophobicContact CG2-CE1 4.29Å
511	G	97.5	Very high	96.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-57.8	-48.4	178	0	0	0	0	0	113.9	G199 L507 S508 V509 N514 T515	G199-G511 CarbonylContact C-O 3.48Å; G199-G511 VanDerWaalsContact C-O 3.24Å; G199-G511 WeakPolarHBondContact CA-O 3.02Å; G199-G511 CarbonylContact O-C 3.6Å; G199-G511 VanDerWaalsContact O-C 3.25Å; G199-G511 WeakPolarHBondContact O-CA 3.43Å; L507-G511 PolarHBondContact O-N 3.43Å; S508-G511 WeakPolarHBondContact O-CA 3.37Å; S508-G511 PolarHBondContact O-N 3.02Å; S508-G511 VanDerWaalsContact O-N 3.11Å; V509-G511 VanDerWaalsContact C-N 3.28Å; V509-G511 PolarHBondContact O-N 3.26Å; G511-N514 PolarHBondContact O-N 3.5Å; G511-T515 PolarHBondContact O-N 3.34Å; G511-T515 PolarHBondContact O-OG1 3.45Å
512	I	98	Very high	96.8	Very high	71 Å²	71	27.9 Å²	27.9	36%	0.364	15%	0.149	S	C	.	.	H	α-helix	trans	-59.7	-53.4	179.2	-65.6	165.5	0	0	0	110.6	F203 S508 V509 I510 N514 T515 I516	F203-I512 HydrophobicContact CB-CG1 4.17Å; F203-I512 HydrophobicContact CD2-CD1 3.71Å; F203-I512 HydrophobicContact CD2-CG1 3.52Å; F203-I512 HydrophobicContact CE2-CD1 3.85Å; F203-I512 HydrophobicContact CE2-CG1 4.04Å; F203-I512 HydrophobicContact CG-CD1 4.47Å; F203-I512 HydrophobicContact CG-CG1 3.79Å; S508-I512 WeakPolarHBondContact O-CG1 3.36Å; S508-I512 PolarHBondContact O-N 2.86Å; V509-I512 PolarHBondContact O-N 3.41Å; I510-I512 PolarHBondContact O-N 3.11Å; I512-N514 VanDerWaalsContact C-N 3.32Å; I512-N514 PolarHBondContact O-N 3.09Å; I512-T515 WeakPolarHBondContact O-CB 3.45Å; I512-T515 PolarHBondContact O-N 3.29Å; I512-I516 HydrophobicContact CG2-CD1 4.07Å; I512-I516 WeakPolarHBondContact O-CG1 3.33Å; I512-I516 PolarHBondContact O-N 3.11Å; I512-I516 VanDerWaalsContact O-N 3.07Å
513	T	98.3	Very high	97	Very high	19 Å²	19	31.1 Å²	31.1	12%	0.117	16%	0.158	C	C	.	.	H	α-helix	trans	-70.3	-31.3	-176	54.3	0	0	0	0	112.3	V509 I510 I516 G517 V564 G567	V509-T513 HydrophobicContact CG1-CG2 4.41Å; V509-T513 WeakPolarHBondContact O-CG2 3.48Å; V509-T513 PolarHBondContact O-N 3.01Å; V509-T513 PolarHBondContact O-OG1 3.15Å; I510-T513 PolarHBondContact O-N 3.29Å; I510-T513 PolarHBondContact O-OG1 3.08Å; T513-I516 PolarHBondContact O-N 3.34Å; T513-G517 PolarHBondContact O-N 2.97Å; T513-V564 WeakPolarHBondContact CB-O 3.39Å; T513-V564 HydrophobicContact CG2-CB 4.27Å; T513-V564 HydrophobicContact CG2-CG1 4.04Å; T513-V564 HydrophobicContact CG2-CG2 4.3Å; T513-V564 PolarHBondContact OG1-O 3.26Å; T513-G567 WeakPolarHBondContact OG1-CA 3.34Å
514	N	97.7	Very high	97.3	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-65.6	-40.9	171.2	-164.8	-104.2	0	0	0	112.1	I510 G511 I512 G517 R518 G567 I570 A571	I510-N514 WeakPolarHBondContact O-CB 3.43Å; I510-N514 PolarHBondContact O-N 3.11Å; G511-N514 PolarHBondContact O-N 3.5Å; I512-N514 VanDerWaalsContact C-N 3.32Å; I512-N514 PolarHBondContact O-N 3.09Å; N514-G517 PolarHBondContact O-N 3.14Å; N514-R518 VanDerWaalsContact O-CG 3.27Å; N514-R518 WeakPolarHBondContact O-CG 3.45Å; N514-R518 PolarHBondContact O-N 3.46Å; N514-R518 VanDerWaalsContact OD1-CZ 3.26Å; N514-R518 PolarHBondContact OD1-NE 3.39Å; N514-R518 PolarHBondContact OD1-NH2 3.28Å; N514-R518 VanDerWaalsContact OD1-NH2 3.1Å; N514-G567 WeakPolarHBondContact CA-O 3.45Å; N514-G567 WeakPolarHBondContact CB-O 3.39Å; N514-G567 PolarHBondContact ND2-O 2.95Å; N514-I570 VanDerWaalsContact ND2-CG2 3.3Å; N514-I570 WeakPolarHBondContact ND2-CG2 3.5Å; N514-A571 WeakPolarHBondContact ND2-CA 3.23Å
515	T	98.3	Very high	97.4	Very high	30 Å²	30	32.3 Å²	32.3	18%	0.184	16%	0.163	C	C	.	.	H	α-helix	trans	-58.8	-50.4	174.1	-52.8	0	0	0	0	110.7	A196 G199 F200 G511 I512 G517 R518 V519	A196-T515 HydrophobicContact CB-CG2 3.94Å; G199-T515 WeakPolarHBondContact CA-OG1 3.19Å; F200-T515 PolarHBondContact N-OG1 2.94Å; G511-T515 PolarHBondContact O-N 3.34Å; G511-T515 PolarHBondContact O-OG1 3.45Å; I512-T515 WeakPolarHBondContact O-CB 3.45Å; I512-T515 PolarHBondContact O-N 3.29Å; T515-G517 PolarHBondContact O-N 2.99Å; T515-R518 PolarHBondContact O-N 2.89Å; T515-V519 PolarHBondContact O-N 3.19Å
516	I	98.4	Very high	97.4	Very high	100 Å²	100	30.6 Å²	30.6	51%	0.513	15%	0.154	S	C	.	.	H	α-helix	trans	-60.1	-47.1	177.8	-65	168	0	0	0	110.3	I512 T513 R518 V519 L520	I512-I516 HydrophobicContact CG2-CD1 4.07Å; I512-I516 WeakPolarHBondContact O-CG1 3.33Å; I512-I516 PolarHBondContact O-N 3.11Å; I512-I516 VanDerWaalsContact O-N 3.07Å; T513-I516 PolarHBondContact O-N 3.34Å; I516-R518 PolarHBondContact O-N 2.98Å; I516-V519 PolarHBondContact O-N 3.22Å; I516-L520 VanDerWaalsContact O-CB 3.24Å; I516-L520 WeakPolarHBondContact O-CB 3.43Å; I516-L520 PolarHBondContact O-N 3.29Å
517	G	98.5	Very high	97.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.3	-42.8	179.1	0	0	0	0	0	113.1	T513 N514 T515 V519 L520 F521	T513-G517 PolarHBondContact O-N 2.97Å; N514-G517 PolarHBondContact O-N 3.14Å; T515-G517 PolarHBondContact O-N 2.99Å; G517-V519 VanDerWaalsContact C-N 3.34Å; G517-V519 PolarHBondContact O-N 3.08Å; G517-L520 PolarHBondContact O-N 3.31Å; G517-F521 WeakPolarHBondContact O-CB 3.48Å; G517-F521 WeakPolarHBondContact O-CD2 3.45Å; G517-F521 PolarHBondContact O-N 2.86Å
518	R	98.3	Very high	97.2	Very high	1 Å²	1	45 Å²	45	0%	0.004	21%	0.211	C	C	.	.	H	α-helix	trans	-64.2	-39.7	-178.9	-72	-178.1	-174.7	-155.4	7	111.6	G192 V195 A196 S198 N514 T515 I516 G522 A571	G192-R518 WeakPolarHBondContact CA-O 3.43Å; V195-R518 VanDerWaalsContact O-CD 3.22Å; V195-R518 WeakPolarHBondContact O-CD 3.27Å; V195-R518 PolarHBondContact O-NH1 2.7Å; A196-R518 HydrophobicContact CB-CB 4.09Å; S198-R518 PolarHBondContact OG-NH1 3.46Å; N514-R518 VanDerWaalsContact O-CG 3.27Å; N514-R518 WeakPolarHBondContact O-CG 3.45Å; N514-R518 PolarHBondContact O-N 3.46Å; N514-R518 VanDerWaalsContact OD1-CZ 3.26Å; N514-R518 PolarHBondContact OD1-NE 3.39Å; N514-R518 PolarHBondContact OD1-NH2 3.28Å; N514-R518 VanDerWaalsContact OD1-NH2 3.1Å; T515-R518 PolarHBondContact O-N 2.89Å; I516-R518 PolarHBondContact O-N 2.98Å; R518-G522 PolarHBondContact O-N 3.48Å; R518-G522 VanDerWaalsContact O-N 3.08Å; R518-A571 HydrophobicContact CB-CB 4.45Å; R518-A571 HydrophobicContact CG-CB 3.67Å
519	V	98.4	Very high	97	Very high	53 Å²	53	52.8 Å²	52.8	32%	0.321	24%	0.24	S	C	.	.	H	α-helix	trans	-71.5	-47	175.5	-178.4	0	0	0	0	111.2	L189 I193 A196 T515 I516 G517 G522 W523	L189-V519 HydrophobicContact CD1-CG1 4.18Å; I193-V519 HydrophobicContact CG1-CG1 4.27Å; I193-V519 HydrophobicContact CG1-CG2 4.09Å; A196-V519 HydrophobicContact CB-CG2 3.97Å; T515-V519 PolarHBondContact O-N 3.19Å; I516-V519 PolarHBondContact O-N 3.22Å; G517-V519 VanDerWaalsContact C-N 3.34Å; G517-V519 PolarHBondContact O-N 3.08Å; V519-G522 PolarHBondContact O-N 2.94Å; V519-W523 PolarHBondContact O-N 3.37Å
520	L	98.1	Very high	96.9	Very high	71 Å²	71	53.1 Å²	53.1	37%	0.372	24%	0.242	S	C	.	.	H	α-helix	trans	-59.8	-54.4	-179	176.1	64.1	0	0	0	111.7	I516 G517 G522 W523 I524 L568	I516-L520 VanDerWaalsContact O-CB 3.24Å; I516-L520 WeakPolarHBondContact O-CB 3.43Å; I516-L520 PolarHBondContact O-N 3.29Å; G517-L520 PolarHBondContact O-N 3.31Å; L520-G522 VanDerWaalsContact C-N 3.31Å; L520-G522 PolarHBondContact O-N 3.26Å; L520-W523 PolarHBondContact O-N 3.39Å; L520-I524 HydrophobicContact CD1-CD1 3.93Å; L520-I524 HydrophobicContact CD1-CG1 4.39Å; L520-I524 HydrophobicContact CG-CD1 3.88Å; L520-I524 WeakPolarHBondContact O-CG1 3.46Å; L520-I524 PolarHBondContact O-N 3.36Å; L520-L568 HydrophobicContact CD2-CD1 4.41Å
521	F	98.4	Very high	96.7	Very high	30 Å²	30	55.4 Å²	55.4	13%	0.132	26%	0.256	C	S	.	.	H	α-helix	trans	-71.8	-27.5	-179.4	-70	-65.5	0	0	0	112.5	G517 I524 S525 I535 L568 F569 P572	G517-F521 WeakPolarHBondContact O-CB 3.48Å; G517-F521 WeakPolarHBondContact O-CD2 3.45Å; G517-F521 PolarHBondContact O-N 2.86Å; F521-I524 HydrophobicContact CD1-CD1 4.1Å; F521-I524 HydrophobicContact CE1-CD1 4.41Å; F521-S525 WeakPolarHBondContact O-CB 3.27Å; F521-S525 PolarHBondContact O-N 3.39Å; F521-I535 HydrophobicContact CB-CG2 4.16Å; F521-I535 HydrophobicContact CD1-CG2 3.47Å; F521-I535 VanDerWaalsContact CD1-CG2 3.47Å; F521-I535 HydrophobicContact CE1-CG2 4.09Å; F521-I535 HydrophobicContact CG-CG2 4.05Å; F521-L568 HydrophobicContact CE2-CD1 3.98Å; F521-L568 HydrophobicContact CE2-CG 4.2Å; F521-L568 WeakPolarHBondContact CE2-O 3.24Å; F521-F569 HydrophobicContact CZ-CD1 4.46Å; F521-P572 HydrophobicContact CB-CB 4.44Å; F521-P572 HydrophobicContact CB-CG 3.78Å; F521-P572 HydrophobicContact CD1-CG 4.14Å; F521-P572 HydrophobicContact CD2-CG 3.35Å; F521-P572 HydrophobicContact CE2-CG 3.88Å; F521-P572 HydrophobicContact CG-CG 3.5Å; F521-P572 VanDerWaalsContact CG-CG 3.5Å; F521-P572 HydrophobicContact CZ-CG 4.46Å
522	G	97.4	Very high	96.6	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.2	-48.3	166.7	0	0	0	0	0	111.7	S188 L189 R518 V519 L520 S525 D526	S188-G522 CarbonylContact C-O 3.35Å; S188-G522 VanDerWaalsContact CB-O 3.22Å; S188-G522 WeakPolarHBondContact CB-O 3.34Å; S188-G522 WeakPolarHBondContact O-CA 3.02Å; L189-G522 PolarHBondContact N-O 3.12Å; R518-G522 PolarHBondContact O-N 3.48Å; R518-G522 VanDerWaalsContact O-N 3.08Å; V519-G522 PolarHBondContact O-N 2.94Å; L520-G522 VanDerWaalsContact C-N 3.31Å; L520-G522 PolarHBondContact O-N 3.26Å; G522-S525 PolarHBondContact O-N 2.92Å; G522-D526 PolarHBondContact O-N 3.42Å
523	W	97.7	Very high	96.5	Very high	143 Å²	143	52.4 Å²	52.4	54%	0.542	24%	0.24	S	C	.	.	H	α-helix	trans	-66.6	-41.9	177.2	179.9	72.7	0	0	0	113.6	L189 V519 L520 S525 D526 Q527	L189-W523 HydrophobicContact CD1-CB 4.14Å; V519-W523 PolarHBondContact O-N 3.37Å; L520-W523 PolarHBondContact O-N 3.39Å; W523-S525 VanDerWaalsContact C-N 3.29Å; W523-S525 PolarHBondContact O-N 3.18Å; W523-D526 PolarHBondContact O-N 3.46Å; W523-Q527 PolarHBondContact O-NE2 3.45Å
524	I	97.7	Very high	96.4	Very high	37 Å²	37	54 Å²	54	19%	0.19	25%	0.25	C	S	.	.	H	α-helix	trans	-62.8	-38.7	177	-67	169	0	0	0	110.4	L520 F521 D526 Q527 W529 V530 I535	L520-I524 HydrophobicContact CD1-CD1 3.93Å; L520-I524 HydrophobicContact CD1-CG1 4.39Å; L520-I524 HydrophobicContact CG-CD1 3.88Å; L520-I524 WeakPolarHBondContact O-CG1 3.46Å; L520-I524 PolarHBondContact O-N 3.36Å; F521-I524 HydrophobicContact CD1-CD1 4.1Å; F521-I524 HydrophobicContact CE1-CD1 4.41Å; I524-D526 VanDerWaalsContact C-N 3.26Å; I524-D526 PolarHBondContact O-N 3.1Å; I524-Q527 VanDerWaalsContact O-CB 3.25Å; I524-Q527 WeakPolarHBondContact O-CB 3.31Å; I524-Q527 VanDerWaalsContact O-CG 3.31Å; I524-Q527 WeakPolarHBondContact O-CG 3.45Å; I524-Q527 PolarHBondContact O-N 3.48Å; I524-W529 HydrophobicContact CG2-CH2 4.31Å; I524-W529 HydrophobicContact CG2-CZ2 4.38Å; I524-V530 HydrophobicContact CG2-CG1 3.92Å; I524-V530 VanDerWaalsContact O-CG1 3.25Å; I524-V530 WeakPolarHBondContact O-CG1 3.42Å; I524-I535 HydrophobicContact CB-CD1 4.33Å; I524-I535 HydrophobicContact CG2-CD1 3.8Å
525	S	95.8	Very high	96.4	Very high	7 Å²	7	54.5 Å²	54.5	5%	0.049	25%	0.253	C	S	.	.	H	α-helix	trans	-67.4	-21.8	-179.6	-172.3	0	0	0	0	114.2	S188 F521 G522 W523 Q527 A532	S188-S525 PolarHBondContact OG-OG 3.24Å; F521-S525 WeakPolarHBondContact O-CB 3.27Å; F521-S525 PolarHBondContact O-N 3.39Å; G522-S525 PolarHBondContact O-N 2.92Å; W523-S525 VanDerWaalsContact C-N 3.29Å; W523-S525 PolarHBondContact O-N 3.18Å; S525-Q527 PolarHBondContact O-N 3.07Å; S525-A532 VanDerWaalsContact OG-CA 3.26Å; S525-A532 WeakPolarHBondContact OG-CA 3.14Å; S525-A532 VanDerWaalsContact OG-CB 3.23Å; S525-A532 WeakPolarHBondContact OG-CB 3.35Å; S525-A532 PolarHBondContact OG-N 3.11Å
526	D	95.4	Very high	96.4	Very high	46 Å²	46	53.2 Å²	53.2	25%	0.246	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-5.4	174	-73.3	-26	0	0	0	112.1	K186 S188 L189 G522 W523 I524	K186-D526 WeakPolarHBondContact CA-OD2 3.42Å; S188-D526 WeakPolarHBondContact CA-OD1 3.35Å; S188-D526 WeakPolarHBondContact CB-OD1 3.27Å; S188-D526 PolarHBondContact N-OD1 3.43Å; S188-D526 PolarHBondContact OG-OD1 2.9Å; L189-D526 VanDerWaalsContact CB-OD2 3.27Å; L189-D526 WeakPolarHBondContact CB-OD2 3.28Å; L189-D526 PolarHBondContact N-OD2 3.2Å; G522-D526 PolarHBondContact O-N 3.42Å; W523-D526 PolarHBondContact O-N 3.46Å; I524-D526 VanDerWaalsContact C-N 3.26Å; I524-D526 PolarHBondContact O-N 3.1Å
527	Q	94.7	Very high	96.3	Very high	64 Å²	64	48.5 Å²	48.5	30%	0.299	22%	0.22	S	C	.	.	S	Bend	trans	-80.9	135.8	178.1	-53.8	-58.6	-38.7	0	0	111.8	W523 I524 S525 W529 V530	W523-Q527 PolarHBondContact O-NE2 3.45Å; I524-Q527 VanDerWaalsContact O-CB 3.25Å; I524-Q527 WeakPolarHBondContact O-CB 3.31Å; I524-Q527 VanDerWaalsContact O-CG 3.31Å; I524-Q527 WeakPolarHBondContact O-CG 3.45Å; I524-Q527 PolarHBondContact O-N 3.48Å; S525-Q527 PolarHBondContact O-N 3.07Å; Q527-W529 HydrophobicContact CB-CG 4.48Å; Q527-W529 VanDerWaalsContact CB-NE1 3.27Å; Q527-W529 PolarHBondContact O-N 3.31Å; Q527-V530 PolarHBondContact O-N 3.42Å
528	R	90.8	Very high	96.3	Very high	241 Å²	241	52.3 Å²	52.3	91%	0.909	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.1	-171.4	-62.9	-179.4	179.2	176.3	0.4	115.9
529	W	93.3	Very high	96.3	Very high	171 Å²	171	52.5 Å²	52.5	65%	0.648	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	-6.4	-175	56.5	-90.5	0	0	0	113.4	I524 Q527	I524-W529 HydrophobicContact CG2-CH2 4.31Å; I524-W529 HydrophobicContact CG2-CZ2 4.38Å; Q527-W529 HydrophobicContact CB-CG 4.48Å; Q527-W529 VanDerWaalsContact CB-NE1 3.27Å; Q527-W529 PolarHBondContact O-N 3.31Å
530	V	94.3	Very high	96.2	Very high	27 Å²	27	50 Å²	50	16%	0.164	23%	0.226	C	C	.	.			trans	-141.7	146	-179.3	66.8	0	0	0	0	110.7	I524 Q527 I535	I524-V530 HydrophobicContact CG2-CG1 3.92Å; I524-V530 VanDerWaalsContact O-CG1 3.25Å; I524-V530 WeakPolarHBondContact O-CG1 3.42Å; Q527-V530 PolarHBondContact O-N 3.42Å; V530-I535 HydrophobicContact CG1-CD1 3.98Å; V530-I535 HydrophobicContact CG1-CG1 4.42Å; V530-I535 HydrophobicContact CG2-CD1 4.04Å; V530-I535 HydrophobicContact CG2-CG1 3.56Å
531	T	94	Very high	96.3	Very high	48 Å²	48	48.5 Å²	48.5	29%	0.294	22%	0.219	S	C	.	.			trans	-100.7	152.2	176.3	59.2	0	0	0	0	110.5	L533 T534 I535	T531-L533 PolarHBondContact O-N 3.01Å; T531-T534 PolarHBondContact O-N 2.94Å; T531-T534 VanDerWaalsContact O-N 3.13Å; T531-T534 WeakPolarHBondContact OG1-CB 3.29Å; T531-T534 PolarHBondContact OG1-N 3.35Å; T531-T534 PolarHBondContact OG1-OG1 3.35Å; T531-I535 PolarHBondContact O-N 2.92Å
532	A	96.3	Very high	96.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-53.1	-42	175	0	0	0	0	0	112.5	S525 T534 I535 N536 L576 V579 I580	S525-A532 VanDerWaalsContact OG-CA 3.26Å; S525-A532 WeakPolarHBondContact OG-CA 3.14Å; S525-A532 VanDerWaalsContact OG-CB 3.23Å; S525-A532 WeakPolarHBondContact OG-CB 3.35Å; S525-A532 PolarHBondContact OG-N 3.11Å; A532-T534 PolarHBondContact O-N 3.39Å; A532-I535 PolarHBondContact O-N 3.42Å; A532-N536 WeakPolarHBondContact O-CB 3.35Å; A532-N536 PolarHBondContact O-N 3.25Å; A532-L576 HydrophobicContact CB-CB 4.31Å; A532-L576 HydrophobicContact CB-CD1 4.22Å; A532-V579 HydrophobicContact CB-CB 4.32Å; A532-V579 HydrophobicContact CB-CG1 3.83Å; A532-I580 HydrophobicContact CB-CG1 3.72Å
533	L	95.2	Very high	96.3	Very high	8 Å²	8	52.9 Å²	52.9	4%	0.042	24%	0.238	C	C	.	.	H	α-helix	trans	-60.1	-46.6	178.9	-177.1	63.3	0	0	0	112.7	T531 I535 N536 N537 I580 I643 P644	T531-L533 PolarHBondContact O-N 3.01Å; L533-I535 PolarHBondContact O-N 3.48Å; L533-N536 PolarHBondContact O-N 3.48Å; L533-N537 WeakPolarHBondContact O-CB 3.22Å; L533-N537 PolarHBondContact O-N 3.33Å; L533-N537 PolarHBondContact O-OD1 2.97Å; L533-I580 HydrophobicContact CB-CG1 4.43Å; L533-I580 HydrophobicContact CD1-CG2 4.1Å; L533-I643 HydrophobicContact CD1-CD1 4.2Å; L533-I643 HydrophobicContact CD2-CB 3.98Å; L533-I643 HydrophobicContact CD2-CG2 3.65Å; L533-P644 HydrophobicContact CD2-CG 3.99Å
534	T	96.3	Very high	96.3	Very high	54 Å²	54	46 Å²	46	33%	0.331	21%	0.212	S	C	.	.	H	α-helix	trans	-61.7	-42.4	178.2	-59.3	0	0	0	0	111.8	T531 A532 N537 I538	T531-T534 PolarHBondContact O-N 2.94Å; T531-T534 VanDerWaalsContact O-N 3.13Å; T531-T534 WeakPolarHBondContact OG1-CB 3.29Å; T531-T534 PolarHBondContact OG1-N 3.35Å; T531-T534 PolarHBondContact OG1-OG1 3.35Å; A532-T534 PolarHBondContact O-N 3.39Å; T534-N537 PolarHBondContact O-N 3.16Å; T534-I538 HydrophobicContact CG2-CD1 3.92Å; T534-I538 WeakPolarHBondContact O-CG1 3.27Å; T534-I538 PolarHBondContact O-N 3.39Å; T534-I538 VanDerWaalsContact O-N 3.11Å
535	I	97.7	Very high	96.3	Very high	14 Å²	14	46.6 Å²	46.6	7%	0.072	22%	0.222	C	C	.	.	H	α-helix	trans	-60.9	-49.8	176.9	-62.1	170.2	0	0	0	110.2	F521 I524 V530 T531 A532 L533 N537 I538 S539 P572 L576	F521-I535 HydrophobicContact CB-CG2 4.16Å; F521-I535 HydrophobicContact CD1-CG2 3.47Å; F521-I535 VanDerWaalsContact CD1-CG2 3.47Å; F521-I535 HydrophobicContact CE1-CG2 4.09Å; F521-I535 HydrophobicContact CG-CG2 4.05Å; I524-I535 HydrophobicContact CB-CD1 4.33Å; I524-I535 HydrophobicContact CG2-CD1 3.8Å; V530-I535 HydrophobicContact CG1-CD1 3.98Å; V530-I535 HydrophobicContact CG1-CG1 4.42Å; V530-I535 HydrophobicContact CG2-CD1 4.04Å; V530-I535 HydrophobicContact CG2-CG1 3.56Å; T531-I535 PolarHBondContact O-N 2.92Å; A532-I535 PolarHBondContact O-N 3.42Å; L533-I535 PolarHBondContact O-N 3.48Å; I535-N537 VanDerWaalsContact C-N 3.33Å; I535-N537 PolarHBondContact O-N 3.31Å; I535-I538 PolarHBondContact O-N 3.48Å; I535-S539 WeakPolarHBondContact O-CB 3.35Å; I535-S539 PolarHBondContact O-N 3.38Å; I535-S539 PolarHBondContact O-OG 3.21Å; I535-P572 HydrophobicContact CG2-CB 4.07Å; I535-P572 HydrophobicContact CG2-CG 4.02Å; I535-L576 HydrophobicContact CB-CD1 4.05Å; I535-L576 HydrophobicContact CD1-CD1 4.41Å; I535-L576 HydrophobicContact CG2-CD1 3.99Å
536	N	97.4	Very high	96.4	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.011	23%	0.225	C	C	.	.	H	α-helix	trans	-56.2	-45.4	177.5	171.2	81.5	0	0	0	112.5	A532 L533 S539 L540 Y573 I580	A532-N536 WeakPolarHBondContact O-CB 3.35Å; A532-N536 PolarHBondContact O-N 3.25Å; L533-N536 PolarHBondContact O-N 3.48Å; N536-S539 PolarHBondContact O-N 2.92Å; N536-S539 PolarHBondContact O-OG 3.5Å; N536-S539 VanDerWaalsContact O-OG 3.06Å; N536-L540 WeakPolarHBondContact O-CB 3.35Å; N536-L540 WeakPolarHBondContact O-CG 3.32Å; N536-L540 PolarHBondContact O-N 2.97Å; N536-Y573 VanDerWaalsContact OD1-CA 3.28Å; N536-Y573 WeakPolarHBondContact OD1-CA 3.38Å; N536-I580 HydrophobicContact CB-CD1 3.71Å
537	N	97.1	Very high	96.6	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-67.1	-45.6	-175.8	-64.3	1.8	0	0	0	111.2	L533 T534 I535 L540 L541 H640 Y641	L533-N537 WeakPolarHBondContact O-CB 3.22Å; L533-N537 PolarHBondContact O-N 3.33Å; L533-N537 PolarHBondContact O-OD1 2.97Å; T534-N537 PolarHBondContact O-N 3.16Å; I535-N537 VanDerWaalsContact C-N 3.33Å; I535-N537 PolarHBondContact O-N 3.31Å; N537-L540 PolarHBondContact O-N 2.85Å; N537-L541 WeakPolarHBondContact O-CG 3.38Å; N537-L541 PolarHBondContact O-N 3.13Å; N537-H640 PolarHBondContact ND2-O 3.04Å; N537-H640 WeakPolarHBondContact OD1-CB 3.28Å; N537-Y641 HydrophobicContact CB-CD2 4.25Å
538	I	97.6	Very high	96.7	Very high	81 Å²	81	43.2 Å²	43.2	42%	0.415	21%	0.207	S	C	.	.	H	α-helix	trans	-61.4	-47.3	176	-67.4	171.2	0	0	0	109.7	T534 I535 L540 L541 F542	T534-I538 HydrophobicContact CG2-CD1 3.92Å; T534-I538 WeakPolarHBondContact O-CG1 3.27Å; T534-I538 PolarHBondContact O-N 3.39Å; T534-I538 VanDerWaalsContact O-N 3.11Å; I535-I538 PolarHBondContact O-N 3.48Å; I538-L540 VanDerWaalsContact C-N 3.34Å; I538-L540 PolarHBondContact O-N 3.23Å; I538-L541 PolarHBondContact O-N 3.5Å; I538-F542 HydrophobicContact CG2-CD2 3.72Å; I538-F542 HydrophobicContact CG2-CE2 3.73Å; I538-F542 WeakPolarHBondContact O-CD2 3.19Å; I538-F542 PolarHBondContact O-N 3.34Å; I538-F542 VanDerWaalsContact O-N 3.11Å
539	S	98	Very high	97	Very high	4 Å²	4	36 Å²	36	3%	0.028	19%	0.186	C	C	.	.	H	α-helix	trans	-63.7	-38.4	-176.7	82.2	0	0	0	0	112.4	I535 N536 F542 C543 F569	I535-S539 WeakPolarHBondContact O-CB 3.35Å; I535-S539 PolarHBondContact O-N 3.38Å; I535-S539 PolarHBondContact O-OG 3.21Å; N536-S539 PolarHBondContact O-N 2.92Å; N536-S539 PolarHBondContact O-OG 3.5Å; N536-S539 VanDerWaalsContact O-OG 3.06Å; S539-F542 PolarHBondContact O-N 3.45Å; S539-C543 WeakPolarHBondContact O-CB 3.18Å; S539-C543 PolarHBondContact O-N 3.02Å; S539-F569 WeakPolarHBondContact CB-O 3.32Å; S539-F569 PolarHBondContact OG-O 3.46Å; S539-F569 VanDerWaalsContact OG-O 3.14Å
540	L	98.1	Very high	97.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64.4	-40.9	175	-79.7	174.7	0	0	0	113	N536 N537 I538 C543 G544 I570 Y573 I633	N536-L540 WeakPolarHBondContact O-CB 3.35Å; N536-L540 WeakPolarHBondContact O-CG 3.32Å; N536-L540 PolarHBondContact O-N 2.97Å; N537-L540 PolarHBondContact O-N 2.85Å; I538-L540 VanDerWaalsContact C-N 3.34Å; I538-L540 PolarHBondContact O-N 3.23Å; L540-C543 PolarHBondContact O-N 3.24Å; L540-G544 PolarHBondContact O-N 3.4Å; L540-I570 HydrophobicContact CD2-CD1 4.4Å; L540-Y573 HydrophobicContact CD1-CD2 3.84Å; L540-Y573 HydrophobicContact CD1-CE2 4.17Å; L540-Y573 HydrophobicContact CD1-CG 4.47Å; L540-Y573 HydrophobicContact CD2-CD1 3.95Å; L540-Y573 HydrophobicContact CD2-CD2 3.84Å; L540-Y573 HydrophobicContact CD2-CE1 4.38Å; L540-Y573 HydrophobicContact CD2-CE2 4.34Å; L540-Y573 HydrophobicContact CD2-CG 3.66Å; L540-Y573 HydrophobicContact CG-CD2 4.19Å; L540-Y573 HydrophobicContact CG-CG 4.34Å; L540-I633 HydrophobicContact CD2-CG2 3.88Å
541	L	98.3	Very high	97.1	Very high	41 Å²	41	29.3 Å²	29.3	22%	0.215	16%	0.161	C	C	.	.	H	α-helix	trans	-62.8	-47.1	176.4	-67.1	173	0	0	0	111.2	N537 I538 A545 F634 L638	N537-L541 WeakPolarHBondContact O-CG 3.38Å; N537-L541 PolarHBondContact O-N 3.13Å; I538-L541 PolarHBondContact O-N 3.5Å; L541-A545 WeakPolarHBondContact O-CB 3.21Å; L541-A545 PolarHBondContact O-N 3.42Å; L541-F634 HydrophobicContact CB-CD2 4.44Å; L541-F634 HydrophobicContact CB-CE2 4.11Å; L541-F634 HydrophobicContact CD2-CD1 4.36Å; L541-F634 HydrophobicContact CD2-CD2 4.1Å; L541-F634 HydrophobicContact CD2-CE1 4.14Å; L541-F634 HydrophobicContact CD2-CE2 3.85Å; L541-F634 HydrophobicContact CD2-CG 4.34Å; L541-F634 HydrophobicContact CD2-CZ 3.87Å; L541-F634 WeakPolarHBondContact O-CD2 3.42Å; L541-F634 WeakPolarHBondContact O-CE2 3.45Å; L541-L638 HydrophobicContact CD2-CD2 3.84Å; L541-L638 HydrophobicContact CD2-CG 3.95Å
542	F	98	Very high	97.1	Very high	121 Å²	121	31.4 Å²	31.4	53%	0.531	17%	0.173	S	C	.	.	H	α-helix	trans	-63.3	-44.4	175.9	-83.1	-78.3	0	0	0	112	I538 S539 A545 L546 F569	I538-F542 HydrophobicContact CG2-CD2 3.72Å; I538-F542 HydrophobicContact CG2-CE2 3.73Å; I538-F542 WeakPolarHBondContact O-CD2 3.19Å; I538-F542 PolarHBondContact O-N 3.34Å; I538-F542 VanDerWaalsContact O-N 3.11Å; S539-F542 PolarHBondContact O-N 3.45Å; F542-A545 PolarHBondContact O-N 2.9Å; F542-L546 VanDerWaalsContact O-CB 3.25Å; F542-L546 WeakPolarHBondContact O-CB 3.19Å; F542-L546 PolarHBondContact O-N 2.86Å; F542-F569 HydrophobicContact CB-CD1 4.39Å; F542-F569 HydrophobicContact CB-CD2 4.5Å; F542-F569 HydrophobicContact CB-CG 4.33Å
543	C	98.1	Very high	97	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.3	-43.6	-179.8	-173.4	0	0	0	0	112.3	S539 L540 L546 T547 F566 F569 I570 I633	S539-C543 WeakPolarHBondContact O-CB 3.18Å; S539-C543 PolarHBondContact O-N 3.02Å; L540-C543 PolarHBondContact O-N 3.24Å; C543-L546 PolarHBondContact O-N 3.38Å; C543-T547 WeakPolarHBondContact O-CB 3.38Å; C543-T547 PolarHBondContact O-N 3.43Å; C543-T547 PolarHBondContact O-OG1 3.33Å; C543-F566 VanDerWaalsContact SG-CD2 3.52Å; C543-F569 HydrophobicContact CB-CB 4.02Å; C543-I570 HydrophobicContact CB-CD1 4.46Å; C543-I570 VanDerWaalsContact SG-CD1 3.53Å; C543-I633 HydrophobicContact CB-CG2 4.35Å
544	G	98.4	Very high	96.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-66.1	-41.5	177.9	0	0	0	0	0	112.8	L540 T547 S548 G630	L540-G544 PolarHBondContact O-N 3.4Å; G544-T547 PolarHBondContact O-N 2.88Å; G544-S548 WeakPolarHBondContact O-CB 3.49Å; G544-S548 PolarHBondContact O-N 2.92Å; G544-S548 PolarHBondContact O-OG 3.34Å; G544-G630 CarbonylContact C-O 3.4Å; G544-G630 VanDerWaalsContact CA-O 3.27Å; G544-G630 WeakPolarHBondContact CA-O 3.28Å; G544-G630 CarbonylContact O-C 3.24Å; G544-G630 VanDerWaalsContact O-CA 3.29Å; G544-G630 WeakPolarHBondContact O-CA 3.5Å
545	A	98.3	Very high	96.6	Very high	48 Å²	48	34.3 Å²	34.3	40%	0.397	20%	0.202	S	C	.	.	H	α-helix	trans	-63.3	-46.1	174.8	0	0	0	0	0	111.6	L541 F542 S548 L549 F634	L541-A545 WeakPolarHBondContact O-CB 3.21Å; L541-A545 PolarHBondContact O-N 3.42Å; F542-A545 PolarHBondContact O-N 2.9Å; A545-S548 PolarHBondContact O-N 3.35Å; A545-L549 WeakPolarHBondContact O-CB 3.22Å; A545-L549 PolarHBondContact O-N 3.37Å; A545-F634 HydrophobicContact CB-CD2 4.14Å; A545-F634 HydrophobicContact CB-CE2 4.23Å
546	L	98.2	Very high	96.5	Very high	22 Å²	22	36.4 Å²	36.4	12%	0.115	21%	0.21	C	C	.	.	H	α-helix	trans	-60.4	-45.5	176.2	175.1	70.9	0	0	0	112.2	F542 C543 S548 L549 C550 F553 Y562 L565 F566	F542-L546 VanDerWaalsContact O-CB 3.25Å; F542-L546 WeakPolarHBondContact O-CB 3.19Å; F542-L546 PolarHBondContact O-N 2.86Å; C543-L546 PolarHBondContact O-N 3.38Å; L546-S548 VanDerWaalsContact C-N 3.31Å; L546-S548 PolarHBondContact O-N 3.34Å; L546-L549 WeakPolarHBondContact O-CB 3.42Å; L546-L549 PolarHBondContact O-N 3Å; L546-C550 PolarHBondContact O-N 3.42Å; L546-F553 HydrophobicContact CD1-CE2 4.37Å; L546-F553 HydrophobicContact CD1-CZ 4.49Å; L546-Y562 HydrophobicContact CD1-CD2 4.16Å; L546-Y562 HydrophobicContact CD2-CD2 4.08Å; L546-Y562 HydrophobicContact CD2-CE2 4.3Å; L546-Y562 HydrophobicContact CG-CD2 3.76Å; L546-Y562 HydrophobicContact CG-CE2 4.04Å; L546-L565 HydrophobicContact CD1-CB 4.45Å; L546-L565 HydrophobicContact CD1-CD1 4.13Å; L546-L565 HydrophobicContact CD2-CB 3.39Å; L546-L565 HydrophobicContact CD2-CD1 4.5Å; L546-F566 HydrophobicContact CD2-CB 4.26Å
547	T	98	Very high	96.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.9	-37.6	179.4	-54.8	0	0	0	0	111.2	P485 C543 G544 C550 F626 A629 I633	P485-T547 HydrophobicContact CG-CG2 4.15Å; C543-T547 WeakPolarHBondContact O-CB 3.38Å; C543-T547 PolarHBondContact O-N 3.43Å; C543-T547 PolarHBondContact O-OG1 3.33Å; G544-T547 PolarHBondContact O-N 2.88Å; T547-C550 WeakPolarHBondContact O-CB 3.29Å; T547-C550 PolarHBondContact O-N 2.9Å; T547-F626 HydrophobicContact CG2-CD1 4.21Å; T547-A629 HydrophobicContact CG2-CB 4.33Å; T547-I633 HydrophobicContact CG2-CD1 4.49Å
548	S	97.4	Very high	96.5	Very high	24 Å²	24	44.6 Å²	44.6	17%	0.168	26%	0.257	C	S	.	.	H	α-helix	trans	-64.9	-42.6	173.3	-54.5	0	0	0	0	111.4	G544 A545 L546 C550 M551 G630 A631	G544-S548 WeakPolarHBondContact O-CB 3.49Å; G544-S548 PolarHBondContact O-N 2.92Å; G544-S548 PolarHBondContact O-OG 3.34Å; A545-S548 PolarHBondContact O-N 3.35Å; L546-S548 VanDerWaalsContact C-N 3.31Å; L546-S548 PolarHBondContact O-N 3.34Å; S548-C550 PolarHBondContact O-N 3.47Å; S548-M551 WeakPolarHBondContact O-CG 3.38Å; S548-M551 PolarHBondContact O-N 2.87Å; S548-G630 VanDerWaalsContact OG-CA 3.27Å; S548-G630 WeakPolarHBondContact OG-CA 3.38Å; S548-A631 PolarHBondContact OG-N 3.47Å
549	L	96.7	Very high	96.5	Very high	90 Å²	90	40.7 Å²	40.7	47%	0.471	24%	0.237	S	C	.	.	H	α-helix	trans	-65.6	-23.3	178	-173.7	64.2	0	0	0	112.7	A545 L546 M551 V552 F553	A545-L549 WeakPolarHBondContact O-CB 3.22Å; A545-L549 PolarHBondContact O-N 3.37Å; L546-L549 WeakPolarHBondContact O-CB 3.42Å; L546-L549 PolarHBondContact O-N 3Å; L549-M551 PolarHBondContact O-N 2.91Å; L549-V552 HydrophobicContact CD1-CG2 3.77Å; L549-V552 HydrophobicContact CG-CG2 4.31Å; L549-V552 WeakPolarHBondContact O-CG2 3.3Å; L549-V552 PolarHBondContact O-N 3.22Å; L549-F553 HydrophobicContact CB-CZ 4.48Å; L549-F553 HydrophobicContact CD2-CE1 4.05Å; L549-F553 HydrophobicContact CD2-CZ 3.9Å; L549-F553 HydrophobicContact CG-CE1 3.79Å; L549-F553 HydrophobicContact CG-CZ 3.87Å
550	C	95.5	Very high	96.5	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-54.3	-23.3	177.5	-167.1	0	0	0	0	113.1	L546 T547 S548 V552 F553 Y562 F626	L546-C550 PolarHBondContact O-N 3.42Å; T547-C550 WeakPolarHBondContact O-CB 3.29Å; T547-C550 PolarHBondContact O-N 2.9Å; S548-C550 PolarHBondContact O-N 3.47Å; C550-V552 PolarHBondContact O-N 3.46Å; C550-V552 VanDerWaalsContact O-N 3.11Å; C550-F553 HydrophobicContact CB-CD2 4.3Å; C550-F553 PolarHBondContact O-N 3.03Å; C550-F553 VanDerWaalsContact O-N 3.07Å; C550-Y562 HydrophobicContact CB-CD2 3.98Å; C550-Y562 HydrophobicContact CB-CE2 3.96Å; C550-Y562 HydrophobicContact CB-CG 4.45Å; C550-F626 HydrophobicContact CB-CB 4.26Å; C550-F626 HydrophobicContact CB-CD1 4.03Å; C550-F626 HydrophobicContact CB-CG 4.3Å
551	M	93.8	Very high	96.5	Very high	58 Å²	58	45.8 Å²	45.8	29%	0.286	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-58.5	-23.4	175.6	76.8	170.5	-78.4	0	0	114.7	S548 L549 K623 L627	S548-M551 WeakPolarHBondContact O-CG 3.38Å; S548-M551 PolarHBondContact O-N 2.87Å; L549-M551 PolarHBondContact O-N 2.91Å; M551-K623 HydrophobicContact CB-CB 4.02Å; M551-K623 WeakPolarHBondContact CB-O 3.42Å; M551-L627 HydrophobicContact SD-CB 4.28Å; M551-L627 HydrophobicContact SD-CD1 3.88Å; M551-L627 HydrophobicContact SD-CD2 3.93Å; M551-L627 HydrophobicContact SD-CG 4.24Å
552	V	94.7	Very high	96.5	Very high	91 Å²	91	43.9 Å²	43.9	55%	0.552	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-100.2	-0.9	179.6	-50.4	0	0	0	0	113.1	L549 C550 G554	L549-V552 HydrophobicContact CD1-CG2 3.77Å; L549-V552 HydrophobicContact CG-CG2 4.31Å; L549-V552 WeakPolarHBondContact O-CG2 3.3Å; L549-V552 PolarHBondContact O-N 3.22Å; C550-V552 PolarHBondContact O-N 3.46Å; C550-V552 VanDerWaalsContact O-N 3.11Å; V552-G554 PolarHBondContact O-N 3Å
553	F	93.3	Very high	96.5	Very high	22 Å²	22	38.1 Å²	38.1	10%	0.096	23%	0.23	C	C	.	.			trans	-81.5	100.7	-179.2	-65.3	-8.5	0	0	0	110	Y492 L546 L549 C550 L558 L559 Y562	Y492-F553 PolarHBondContact OH-O 3.41Å; L546-F553 HydrophobicContact CD1-CE2 4.37Å; L546-F553 HydrophobicContact CD1-CZ 4.49Å; L549-F553 HydrophobicContact CB-CZ 4.48Å; L549-F553 HydrophobicContact CD2-CE1 4.05Å; L549-F553 HydrophobicContact CD2-CZ 3.9Å; L549-F553 HydrophobicContact CG-CE1 3.79Å; L549-F553 HydrophobicContact CG-CZ 3.87Å; C550-F553 HydrophobicContact CB-CD2 4.3Å; C550-F553 PolarHBondContact O-N 3.03Å; C550-F553 VanDerWaalsContact O-N 3.07Å; F553-L558 HydrophobicContact CB-CB 3.79Å; F553-L558 HydrophobicContact CB-CD1 4.47Å; F553-L558 HydrophobicContact CD1-CB 4.1Å; F553-L558 HydrophobicContact CD1-CD1 4.11Å; F553-L558 HydrophobicContact CD1-CG 4.49Å; F553-L558 HydrophobicContact CD2-CB 4.25Å; F553-L558 HydrophobicContact CG-CB 3.79Å; F553-L559 HydrophobicContact CB-CD2 3.94Å; F553-Y562 HydrophobicContact CD2-CG 4.45Å; F553-Y562 HydrophobicContact CE2-CD2 4.3Å; F553-Y562 HydrophobicContact CE2-CG 4.42Å
554	G	90.7	Very high	96.5	Very high	53 Å²	53	40.8 Å²	40.8	55%	0.546	25%	0.246	S	C	.	.			trans	-99.8	4.3	-179.1	0	0	0	0	0	115.2	V552	V552-G554 PolarHBondContact O-N 3Å
555	S	94.1	Very high	96.5	Very high	49 Å²	49	43.6 Å²	43.6	34%	0.343	26%	0.261	S	S	.	.	S	Bend	trans	-127.4	149.9	-178.8	73.5	0	0	0	0	111.9	T557 L558 L559	S555-T557 PolarHBondContact O-N 3.34Å; S555-L558 PolarHBondContact O-N 2.77Å; S555-L558 VanDerWaalsContact O-N 3.1Å; S555-L558 WeakPolarHBondContact OG-CG 3.37Å; S555-L558 PolarHBondContact OG-N 3.32Å; S555-L559 PolarHBondContact O-N 3.41Å
556	Y	95.3	Very high	96.5	Very high	58 Å²	58	41.3 Å²	41.3	23%	0.227	24%	0.242	C	C	.	.	H	α-helix	trans	-56.1	-39.5	177	-178	-106.3	0	0	0	112.4	Q502 L506 L558 L559 M560	Q502-Y556 HydrophobicContact CB-CD2 4.3Å; Q502-Y556 HydrophobicContact CB-CE2 3.66Å; Q502-Y556 HydrophobicContact CG-CE2 4.38Å; Q502-Y556 VanDerWaalsContact O-CE2 3.3Å; Q502-Y556 WeakPolarHBondContact O-CE2 3.35Å; Q502-Y556 PolarHBondContact O-OH 2.88Å; L506-Y556 HydrophobicContact CD1-CD2 4.5Å; L506-Y556 HydrophobicContact CD1-CE2 4.12Å; L506-Y556 HydrophobicContact CD2-CD2 4.45Å; L506-Y556 HydrophobicContact CD2-CE2 3.82Å; L506-Y556 HydrophobicContact CG-CE2 3.85Å; Y556-L558 VanDerWaalsContact C-N 3.34Å; Y556-L558 PolarHBondContact O-N 3.25Å; Y556-L559 PolarHBondContact O-N 3.37Å; Y556-M560 HydrophobicContact CE1-CE 3.92Å; Y556-M560 HydrophobicContact CE2-CE 4.46Å; Y556-M560 WeakPolarHBondContact O-CB 3.17Å; Y556-M560 PolarHBondContact O-N 2.83Å; Y556-M560 WeakPolarHBondContact OH-CE 3.3Å
557	T	96.9	Very high	96.5	Very high	102 Å²	102	40.3 Å²	40.3	63%	0.626	24%	0.237	S	C	*	.	H	α-helix	trans	-61.5	-40	177.6	-51.4	0	0	0	0	112.5	S555 M560 T561	S555-T557 PolarHBondContact O-N 3.34Å; T557-M560 PolarHBondContact O-N 3.11Å; T557-T561 PolarHBondContact O-N 3.46Å; T557-T561 PolarHBondContact O-OG1 3.19Å
558	L	97.4	Very high	96.5	Very high	72 Å²	72	42.4 Å²	42.4	38%	0.377	25%	0.248	S	C	.	.	H	α-helix	trans	-70.1	-40.5	176.2	-70.8	173.8	0	0	0	111.4	F553 S555 Y556 M560 T561 Y562	F553-L558 HydrophobicContact CB-CB 3.79Å; F553-L558 HydrophobicContact CB-CD1 4.47Å; F553-L558 HydrophobicContact CD1-CB 4.1Å; F553-L558 HydrophobicContact CD1-CD1 4.11Å; F553-L558 HydrophobicContact CD1-CG 4.49Å; F553-L558 HydrophobicContact CD2-CB 4.25Å; F553-L558 HydrophobicContact CG-CB 3.79Å; S555-L558 PolarHBondContact O-N 2.77Å; S555-L558 VanDerWaalsContact O-N 3.1Å; S555-L558 WeakPolarHBondContact OG-CG 3.37Å; S555-L558 PolarHBondContact OG-N 3.32Å; Y556-L558 VanDerWaalsContact C-N 3.34Å; Y556-L558 PolarHBondContact O-N 3.25Å; L558-M560 VanDerWaalsContact C-N 3.28Å; L558-M560 PolarHBondContact O-N 3.31Å; L558-T561 PolarHBondContact O-N 2.84Å; L558-Y562 WeakPolarHBondContact O-CB 3.36Å; L558-Y562 PolarHBondContact O-N 3.31Å
559	L	97.7	Very high	96.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.6	-34.8	173	-67.5	-175.2	0	0	0	112.3	L489 Y492 A493 L496 L506 F553 S555 Y556 Y562 S563	L489-L559 HydrophobicContact CD1-CD2 4.19Å; Y492-L559 HydrophobicContact CD1-CD2 4.11Å; Y492-L559 HydrophobicContact CE1-CD2 3.91Å; A493-L559 HydrophobicContact CB-CD1 3.8Å; L496-L559 HydrophobicContact CD1-CD1 3.97Å; L506-L559 HydrophobicContact CD1-CB 4.1Å; L506-L559 HydrophobicContact CD1-CD1 4.34Å; L506-L559 HydrophobicContact CD2-CB 4.17Å; F553-L559 HydrophobicContact CB-CD2 3.94Å; S555-L559 PolarHBondContact O-N 3.41Å; Y556-L559 PolarHBondContact O-N 3.37Å; L559-Y562 WeakPolarHBondContact O-CB 3.46Å; L559-Y562 PolarHBondContact O-N 3.32Å; L559-S563 PolarHBondContact O-N 3.19Å; L559-S563 PolarHBondContact O-OG 2.85Å
560	M	97.7	Very high	96.6	Very high	41 Å²	41	39.4 Å²	39.4	20%	0.202	23%	0.228	C	C	.	.	H	α-helix	trans	-66.7	-43.1	174.1	-176.2	58	71.4	0	0	111.5	L505 L506 V509 Y556 T557 L558 Y562 S563 V564	L505-M560 HydrophobicContact CD2-CE 4.18Å; L505-M560 HydrophobicContact CG-CE 4.18Å; L506-M560 HydrophobicContact CD2-CB 4.13Å; L506-M560 HydrophobicContact CD2-CE 3.77Å; L506-M560 HydrophobicContact CD2-SD 4.15Å; V509-M560 HydrophobicContact CB-SD 4.01Å; V509-M560 HydrophobicContact CG1-SD 3.86Å; V509-M560 HydrophobicContact CG2-CE 4.3Å; V509-M560 HydrophobicContact CG2-SD 3.75Å; Y556-M560 HydrophobicContact CE1-CE 3.92Å; Y556-M560 HydrophobicContact CE2-CE 4.46Å; Y556-M560 WeakPolarHBondContact O-CB 3.17Å; Y556-M560 PolarHBondContact O-N 2.83Å; Y556-M560 WeakPolarHBondContact OH-CE 3.3Å; T557-M560 PolarHBondContact O-N 3.11Å; L558-M560 VanDerWaalsContact C-N 3.28Å; L558-M560 PolarHBondContact O-N 3.31Å; M560-Y562 VanDerWaalsContact C-N 3.3Å; M560-Y562 PolarHBondContact O-N 3.44Å; M560-S563 WeakPolarHBondContact O-CB 3.4Å; M560-S563 PolarHBondContact O-N 2.91Å; M560-V564 WeakPolarHBondContact O-CG2 3.36Å; M560-V564 PolarHBondContact O-N 3.33Å
561	T	97.5	Very high	96.7	Very high	70 Å²	70	39.4 Å²	39.4	43%	0.429	23%	0.228	S	C	.	.	H	α-helix	trans	-63.2	-40.7	174.9	-57.7	0	0	0	0	110.8	T557 L558 V564 L565	T557-T561 PolarHBondContact O-N 3.46Å; T557-T561 PolarHBondContact O-OG1 3.19Å; L558-T561 PolarHBondContact O-N 2.84Å; T561-V564 PolarHBondContact O-N 2.75Å; T561-L565 HydrophobicContact CG2-CD1 4.01Å; T561-L565 HydrophobicContact CG2-CG 4.46Å; T561-L565 WeakPolarHBondContact O-CG 3.39Å; T561-L565 PolarHBondContact O-N 2.84Å
562	Y	98.2	Very high	96.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-56.6	-51.3	171	171.6	-103.3	0	0	0	111.8	P485 L489 L546 C550 F553 L558 L559 M560 V564 L565 F566 F626	P485-Y562 HydrophobicContact CB-CE1 4.37Å; P485-Y562 WeakPolarHBondContact CB-OH 3.4Å; P485-Y562 WeakPolarHBondContact CG-OH 3.4Å; L489-Y562 HydrophobicContact CD1-CD1 3.95Å; L489-Y562 HydrophobicContact CD1-CE1 3.98Å; L489-Y562 HydrophobicContact CD2-CD1 4.17Å; L489-Y562 HydrophobicContact CD2-CE1 4.06Å; L546-Y562 HydrophobicContact CD1-CD2 4.16Å; L546-Y562 HydrophobicContact CD2-CD2 4.08Å; L546-Y562 HydrophobicContact CD2-CE2 4.3Å; L546-Y562 HydrophobicContact CG-CD2 3.76Å; L546-Y562 HydrophobicContact CG-CE2 4.04Å; C550-Y562 HydrophobicContact CB-CD2 3.98Å; C550-Y562 HydrophobicContact CB-CE2 3.96Å; C550-Y562 HydrophobicContact CB-CG 4.45Å; F553-Y562 HydrophobicContact CD2-CG 4.45Å; F553-Y562 HydrophobicContact CE2-CD2 4.3Å; F553-Y562 HydrophobicContact CE2-CG 4.42Å; L558-Y562 WeakPolarHBondContact O-CB 3.36Å; L558-Y562 PolarHBondContact O-N 3.31Å; L559-Y562 WeakPolarHBondContact O-CB 3.46Å; L559-Y562 PolarHBondContact O-N 3.32Å; M560-Y562 VanDerWaalsContact C-N 3.3Å; M560-Y562 PolarHBondContact O-N 3.44Å; Y562-V564 VanDerWaalsContact C-N 3.3Å; Y562-V564 PolarHBondContact O-N 3.11Å; Y562-L565 PolarHBondContact O-N 2.96Å; Y562-F566 HydrophobicContact CD2-CB 4.45Å; Y562-F566 HydrophobicContact CE1-CB 4.31Å; Y562-F566 HydrophobicContact CE1-CG 4.47Å; Y562-F566 HydrophobicContact CE2-CB 4.02Å; Y562-F566 HydrophobicContact CE2-CD2 4.28Å; Y562-F566 HydrophobicContact CE2-CG 4.39Å; Y562-F566 AromaticContact CZ-CD2 3.98Å; Y562-F566 AromaticContact CZ-CG 3.98Å; Y562-F566 WeakPolarHBondContact O-CB 3.34Å; Y562-F566 PolarHBondContact O-N 3.21Å; Y562-F566 WeakPolarHBondContact OH-CD2 3.36Å; Y562-F626 HydrophobicContact CE1-CE1 4.06Å
563	S	98.2	Very high	97	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-55.4	-44.6	178.7	-74.6	0	0	0	0	112.7	L506 I510 L559 M560 G567	L506-S563 WeakPolarHBondContact CB-OG 3.38Å; L506-S563 WeakPolarHBondContact O-CB 3.46Å; L506-S563 PolarHBondContact O-OG 3.41Å; L506-S563 VanDerWaalsContact O-OG 3.09Å; I510-S563 WeakPolarHBondContact CG1-O 3.48Å; L559-S563 PolarHBondContact O-N 3.19Å; L559-S563 PolarHBondContact O-OG 2.85Å; M560-S563 WeakPolarHBondContact O-CB 3.4Å; M560-S563 PolarHBondContact O-N 2.91Å; S563-G567 PolarHBondContact O-N 3.31Å
564	V	98.5	Very high	97.1	Very high	56 Å²	56	31.6 Å²	31.6	34%	0.339	19%	0.186	S	C	.	.	H	α-helix	trans	-62.3	-50.8	178.9	168	0	0	0	0	111.3	V509 T513 M560 T561 Y562 L568	V509-V564 HydrophobicContact CG1-CB 4.49Å; V509-V564 HydrophobicContact CG1-CG2 3.48Å; V509-V564 VanDerWaalsContact CG1-CG2 3.48Å; T513-V564 WeakPolarHBondContact CB-O 3.39Å; T513-V564 HydrophobicContact CG2-CB 4.27Å; T513-V564 HydrophobicContact CG2-CG1 4.04Å; T513-V564 HydrophobicContact CG2-CG2 4.3Å; T513-V564 PolarHBondContact OG1-O 3.26Å; M560-V564 WeakPolarHBondContact O-CG2 3.36Å; M560-V564 PolarHBondContact O-N 3.33Å; T561-V564 PolarHBondContact O-N 2.75Å; Y562-V564 VanDerWaalsContact C-N 3.3Å; Y562-V564 PolarHBondContact O-N 3.11Å; V564-L568 WeakPolarHBondContact O-CB 3.38Å; V564-L568 PolarHBondContact O-N 3.39Å
565	L	98.4	Very high	97.3	Very high	60 Å²	60	29.1 Å²	29.1	31%	0.314	16%	0.16	S	C	.	.	H	α-helix	trans	-73.4	-38.8	-175.5	-64.9	177.6	0	0	0	111.9	L546 T561 Y562 L568 F569	L546-L565 HydrophobicContact CD1-CB 4.45Å; L546-L565 HydrophobicContact CD1-CD1 4.13Å; L546-L565 HydrophobicContact CD2-CB 3.39Å; L546-L565 HydrophobicContact CD2-CD1 4.5Å; T561-L565 HydrophobicContact CG2-CD1 4.01Å; T561-L565 HydrophobicContact CG2-CG 4.46Å; T561-L565 WeakPolarHBondContact O-CG 3.39Å; T561-L565 PolarHBondContact O-N 2.84Å; Y562-L565 PolarHBondContact O-N 2.96Å; L565-L568 PolarHBondContact O-N 3.33Å; L565-F569 HydrophobicContact CB-CD2 4.34Å; L565-F569 HydrophobicContact CB-CE2 4.49Å; L565-F569 HydrophobicContact CD2-CE2 4.13Å; L565-F569 VanDerWaalsContact O-CD2 3.23Å; L565-F569 WeakPolarHBondContact O-CD2 3.26Å; L565-F569 PolarHBondContact O-N 3.38Å
566	F	98.4	Very high	97.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.3	-51	176.2	176.8	-97.8	0	0	0	110.3	P485 F486 I510 C543 L546 Y562 L568 F569 I570	P485-F566 HydrophobicContact CB-CD1 4.3Å; P485-F566 HydrophobicContact CB-CE1 3.8Å; P485-F566 HydrophobicContact CB-CE2 4.16Å; P485-F566 HydrophobicContact CB-CZ 3.73Å; P485-F566 HydrophobicContact CG-CD2 4.34Å; P485-F566 HydrophobicContact CG-CE1 4.21Å; P485-F566 HydrophobicContact CG-CE2 3.68Å; P485-F566 HydrophobicContact CG-CZ 3.61Å; F486-F566 HydrophobicContact CD2-CE1 4.49Å; F486-F566 AromaticContact CE2-CE1 3.81Å; F486-F566 HydrophobicContact CE2-CE1 3.81Å; F486-F566 HydrophobicContact CE2-CZ 4.03Å; F486-F566 AromaticContact CZ-CE1 3.86Å; F486-F566 HydrophobicContact CZ-CE1 3.86Å; F486-F566 HydrophobicContact CZ-CZ 4.49Å; I510-F566 HydrophobicContact CD1-CD1 3.95Å; I510-F566 HydrophobicContact CD1-CE1 4.47Å; I510-F566 HydrophobicContact CG1-CD1 4.17Å; I510-F566 HydrophobicContact CG2-CD1 4.05Å; I510-F566 HydrophobicContact CG2-CE1 4.29Å; C543-F566 VanDerWaalsContact SG-CD2 3.52Å; L546-F566 HydrophobicContact CD2-CB 4.26Å; Y562-F566 HydrophobicContact CD2-CB 4.45Å; Y562-F566 HydrophobicContact CE1-CB 4.31Å; Y562-F566 HydrophobicContact CE1-CG 4.47Å; Y562-F566 HydrophobicContact CE2-CB 4.02Å; Y562-F566 HydrophobicContact CE2-CD2 4.28Å; Y562-F566 HydrophobicContact CE2-CG 4.39Å; Y562-F566 AromaticContact CZ-CD2 3.98Å; Y562-F566 AromaticContact CZ-CG 3.98Å; Y562-F566 WeakPolarHBondContact O-CB 3.34Å; Y562-F566 PolarHBondContact O-N 3.21Å; Y562-F566 WeakPolarHBondContact OH-CD2 3.36Å; F566-L568 VanDerWaalsContact C-N 3.3Å; F566-L568 PolarHBondContact O-N 2.69Å; F566-F569 PolarHBondContact O-N 2.83Å; F566-I570 HydrophobicContact CD1-CG2 4.34Å; F566-I570 HydrophobicContact CE1-CG2 4.04Å; F566-I570 HydrophobicContact CE2-CB 4.3Å; F566-I570 HydrophobicContact CE2-CD1 4.43Å; F566-I570 HydrophobicContact CE2-CG1 4.34Å; F566-I570 HydrophobicContact CZ-CB 4.24Å; F566-I570 HydrophobicContact CZ-CG1 4.15Å; F566-I570 HydrophobicContact CZ-CG2 4.21Å; F566-I570 VanDerWaalsContact O-CB 3.31Å; F566-I570 WeakPolarHBondContact O-CB 3.33Å; F566-I570 WeakPolarHBondContact O-CG2 3.37Å; F566-I570 PolarHBondContact O-N 3.25Å
567	G	98	Very high	97.5	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-56.4	-44.1	178.1	0	0	0	0	0	112	T513 N514 S563	T513-G567 WeakPolarHBondContact OG1-CA 3.34Å; N514-G567 WeakPolarHBondContact CA-O 3.45Å; N514-G567 WeakPolarHBondContact CB-O 3.39Å; N514-G567 PolarHBondContact ND2-O 2.95Å; S563-G567 PolarHBondContact O-N 3.31Å
568	L	98.2	Very high	97.4	Very high	44 Å²	44	19.6 Å²	19.6	23%	0.23	11%	0.106	C	C	.	.	H	α-helix	trans	-64.2	-53.8	177.2	-177	63.5	0	0	0	113.2	L520 F521 V564 L565 F566 A571	L520-L568 HydrophobicContact CD2-CD1 4.41Å; F521-L568 HydrophobicContact CE2-CD1 3.98Å; F521-L568 HydrophobicContact CE2-CG 4.2Å; F521-L568 WeakPolarHBondContact CE2-O 3.24Å; V564-L568 WeakPolarHBondContact O-CB 3.38Å; V564-L568 PolarHBondContact O-N 3.39Å; L565-L568 PolarHBondContact O-N 3.33Å; F566-L568 VanDerWaalsContact C-N 3.3Å; F566-L568 PolarHBondContact O-N 2.69Å; L568-A571 VanDerWaalsContact O-CB 3.27Å; L568-A571 WeakPolarHBondContact O-CB 3.33Å; L568-A571 PolarHBondContact O-N 2.92Å
569	F	98.1	Very high	97.3	Very high	52 Å²	52	16.3 Å²	16.3	23%	0.228	9%	0.088	C	C	.	.	H	α-helix	trans	-81	-20.3	-171.2	-71.4	-61.6	0	0	0	114.6	F521 S539 F542 C543 L565 F566 A571 P572	F521-F569 HydrophobicContact CZ-CD1 4.46Å; S539-F569 WeakPolarHBondContact CB-O 3.32Å; S539-F569 PolarHBondContact OG-O 3.46Å; S539-F569 VanDerWaalsContact OG-O 3.14Å; F542-F569 HydrophobicContact CB-CD1 4.39Å; F542-F569 HydrophobicContact CB-CD2 4.5Å; F542-F569 HydrophobicContact CB-CG 4.33Å; C543-F569 HydrophobicContact CB-CB 4.02Å; L565-F569 HydrophobicContact CB-CD2 4.34Å; L565-F569 HydrophobicContact CB-CE2 4.49Å; L565-F569 HydrophobicContact CD2-CE2 4.13Å; L565-F569 VanDerWaalsContact O-CD2 3.23Å; L565-F569 WeakPolarHBondContact O-CD2 3.26Å; L565-F569 PolarHBondContact O-N 3.38Å; F566-F569 PolarHBondContact O-N 2.83Å; F569-A571 VanDerWaalsContact C-N 3.28Å; F569-P572 WeakPolarHBondContact O-CD 3.4Å
570	I	97.4	Very high	97.3	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-79.5	-13.8	171.3	-156	67.9	0	0	0	112.2	F482 N514 L540 C543 F566 Y573	F482-I570 HydrophobicContact CD2-CD1 3.9Å; F482-I570 HydrophobicContact CD2-CG1 3.69Å; F482-I570 HydrophobicContact CE2-CD1 4.28Å; F482-I570 HydrophobicContact CE2-CG1 3.56Å; N514-I570 VanDerWaalsContact ND2-CG2 3.3Å; N514-I570 WeakPolarHBondContact ND2-CG2 3.5Å; L540-I570 HydrophobicContact CD2-CD1 4.4Å; C543-I570 HydrophobicContact CB-CD1 4.46Å; C543-I570 VanDerWaalsContact SG-CD1 3.53Å; F566-I570 HydrophobicContact CD1-CG2 4.34Å; F566-I570 HydrophobicContact CE1-CG2 4.04Å; F566-I570 HydrophobicContact CE2-CB 4.3Å; F566-I570 HydrophobicContact CE2-CD1 4.43Å; F566-I570 HydrophobicContact CE2-CG1 4.34Å; F566-I570 HydrophobicContact CZ-CB 4.24Å; F566-I570 HydrophobicContact CZ-CG1 4.15Å; F566-I570 HydrophobicContact CZ-CG2 4.21Å; F566-I570 VanDerWaalsContact O-CB 3.31Å; F566-I570 WeakPolarHBondContact O-CB 3.33Å; F566-I570 WeakPolarHBondContact O-CG2 3.37Å; F566-I570 PolarHBondContact O-N 3.25Å; I570-Y573 HydrophobicContact CD1-CD1 3.89Å; I570-Y573 HydrophobicContact CG1-CD1 4.44Å; I570-Y573 WeakPolarHBondContact O-CB 3.19Å; I570-Y573 PolarHBondContact O-N 3.29Å
571	A	98.2	Very high	97.2	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-57.4	-50	-176.6	0	0	0	0	0	114.5	N514 R518 L568 F569 Y573 I574 S575	N514-A571 WeakPolarHBondContact ND2-CA 3.23Å; R518-A571 HydrophobicContact CB-CB 4.45Å; R518-A571 HydrophobicContact CG-CB 3.67Å; L568-A571 VanDerWaalsContact O-CB 3.27Å; L568-A571 WeakPolarHBondContact O-CB 3.33Å; L568-A571 PolarHBondContact O-N 2.92Å; F569-A571 VanDerWaalsContact C-N 3.28Å; A571-Y573 PolarHBondContact O-N 3.1Å; A571-I574 PolarHBondContact O-N 3.28Å; A571-S575 PolarHBondContact O-N 2.88Å; A571-S575 PolarHBondContact O-OG 2.79Å; A571-S575 VanDerWaalsContact O-OG 3.05Å
572	P	97.8	Very high	97	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.4	-30.9	-178.8	-24.1	36.2	0	0	0	113.1	F521 I535 F569 I574 L576	F521-P572 HydrophobicContact CB-CB 4.44Å; F521-P572 HydrophobicContact CB-CG 3.78Å; F521-P572 HydrophobicContact CD1-CG 4.14Å; F521-P572 HydrophobicContact CD2-CG 3.35Å; F521-P572 HydrophobicContact CE2-CG 3.88Å; F521-P572 HydrophobicContact CG-CG 3.5Å; F521-P572 VanDerWaalsContact CG-CG 3.5Å; F521-P572 HydrophobicContact CZ-CG 4.46Å; I535-P572 HydrophobicContact CG2-CB 4.07Å; I535-P572 HydrophobicContact CG2-CG 4.02Å; F569-P572 WeakPolarHBondContact O-CD 3.4Å; P572-I574 PolarHBondContact O-N 3.1Å; P572-L576 HydrophobicContact CB-CD1 3.92Å; P572-L576 HydrophobicContact CB-CG 4.22Å; P572-L576 VanDerWaalsContact O-CB 3.31Å; P572-L576 WeakPolarHBondContact O-CB 3.26Å; P572-L576 PolarHBondContact O-N 2.94Å
573	Y	97.1	Very high	96.7	Very high	1 Å²	1	15.9 Å²	15.9	0%	0.004	8%	0.082	C	C	.	.	H	α-helix	trans	-56.5	-39.2	-178.2	-177.9	-141.7	0	0	0	112.1	N475 M479 F482 N536 L540 I570 A571 T577	N475-Y573 PolarHBondContact O-OH 3.05Å; N475-Y573 VanDerWaalsContact OD1-CE2 3.29Å; N475-Y573 WeakPolarHBondContact OD1-CE2 3.27Å; N475-Y573 PolarHBondContact OD1-OH 3.4Å; M479-Y573 HydrophobicContact CE-CD1 4.21Å; M479-Y573 HydrophobicContact CE-CE1 3.43Å; M479-Y573 VanDerWaalsContact CE-CE1 3.43Å; M479-Y573 PolarHBondContact N-OH 3.11Å; F482-Y573 AromaticContact CD2-CD1 3.97Å; F482-Y573 HydrophobicContact CD2-CD1 3.97Å; F482-Y573 HydrophobicContact CD2-CE1 4.11Å; F482-Y573 HydrophobicContact CE2-CD1 4.41Å; N536-Y573 VanDerWaalsContact OD1-CA 3.28Å; N536-Y573 WeakPolarHBondContact OD1-CA 3.38Å; L540-Y573 HydrophobicContact CD1-CD2 3.84Å; L540-Y573 HydrophobicContact CD1-CE2 4.17Å; L540-Y573 HydrophobicContact CD1-CG 4.47Å; L540-Y573 HydrophobicContact CD2-CD1 3.95Å; L540-Y573 HydrophobicContact CD2-CD2 3.84Å; L540-Y573 HydrophobicContact CD2-CE1 4.38Å; L540-Y573 HydrophobicContact CD2-CE2 4.34Å; L540-Y573 HydrophobicContact CD2-CG 3.66Å; L540-Y573 HydrophobicContact CG-CD2 4.19Å; L540-Y573 HydrophobicContact CG-CG 4.34Å; I570-Y573 HydrophobicContact CD1-CD1 3.89Å; I570-Y573 HydrophobicContact CG1-CD1 4.44Å; I570-Y573 WeakPolarHBondContact O-CB 3.19Å; I570-Y573 PolarHBondContact O-N 3.29Å; A571-Y573 PolarHBondContact O-N 3.1Å; Y573-T577 PolarHBondContact O-OG1 2.97Å
574	I	94.8	Very high	96.5	Very high	6 Å²	6	17.4 Å²	17.4	3%	0.031	9%	0.089	C	C	.	.	H	α-helix	trans	-94.2	-46.8	179.2	-50.5	-55.2	0	0	0	111.3	V195 M479 F482 A571 P572 L576 T577	V195-I574 HydrophobicContact CG1-CG2 4.04Å; M479-I574 HydrophobicContact CE-CD1 3.57Å; F482-I574 HydrophobicContact CD2-CD1 4.46Å; F482-I574 HydrophobicContact CE2-CD1 3.89Å; F482-I574 HydrophobicContact CE2-CG1 3.88Å; F482-I574 HydrophobicContact CZ-CD1 4.08Å; F482-I574 HydrophobicContact CZ-CG1 4.03Å; A571-I574 PolarHBondContact O-N 3.28Å; P572-I574 PolarHBondContact O-N 3.1Å; I574-L576 PolarHBondContact O-N 2.93Å; I574-T577 PolarHBondContact O-N 3.27Å
575	S	96	Very high	96.1	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-71.1	-32.5	-172.5	59.7	0	0	0	0	114.4	T191 A571	T191-S575 WeakPolarHBondContact CG2-O 3.24Å; A571-S575 PolarHBondContact O-N 2.88Å; A571-S575 PolarHBondContact O-OG 2.79Å; A571-S575 VanDerWaalsContact O-OG 3.05Å
576	L	96.2	Very high	95.6	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-4.3	-178.6	-58.2	-173.6	0	0	0	112.9	A532 I535 P572 I574 A578 V579 I580	A532-L576 HydrophobicContact CB-CB 4.31Å; A532-L576 HydrophobicContact CB-CD1 4.22Å; I535-L576 HydrophobicContact CB-CD1 4.05Å; I535-L576 HydrophobicContact CD1-CD1 4.41Å; I535-L576 HydrophobicContact CG2-CD1 3.99Å; P572-L576 HydrophobicContact CB-CD1 3.92Å; P572-L576 HydrophobicContact CB-CG 4.22Å; P572-L576 VanDerWaalsContact O-CB 3.31Å; P572-L576 WeakPolarHBondContact O-CB 3.26Å; P572-L576 PolarHBondContact O-N 2.94Å; I574-L576 PolarHBondContact O-N 2.93Å; L576-A578 PolarHBondContact O-N 2.81Å; L576-V579 HydrophobicContact CD2-CG2 4.47Å; L576-V579 WeakPolarHBondContact O-CB 3.1Å; L576-V579 PolarHBondContact O-N 3.21Å; L576-V579 VanDerWaalsContact O-N 3.11Å; L576-I580 HydrophobicContact CB-CD1 4.2Å; L576-I580 HydrophobicContact CB-CG1 4.46Å; L576-I580 WeakPolarHBondContact O-CB 3.39Å; L576-I580 VanDerWaalsContact O-CG1 3.26Å; L576-I580 WeakPolarHBondContact O-CG1 3.44Å; L576-I580 PolarHBondContact O-N 3.5Å
577	T	96.5	Very high	95.1	Very high	6 Å²	6	16.4 Å²	16.4	4%	0.037	9%	0.09	C	C	.	.	H	α-helix	trans	-53.4	-51.8	-179.5	-75.4	0	0	0	0	112.3	Y573 I574 V579 I580 L581 F594 L597	Y573-T577 PolarHBondContact O-OG1 2.97Å; I574-T577 PolarHBondContact O-N 3.27Å; T577-V579 VanDerWaalsContact C-N 3.3Å; T577-V579 PolarHBondContact O-N 3.04Å; T577-I580 PolarHBondContact O-N 3.27Å; T577-L581 HydrophobicContact CG2-CD1 4.21Å; T577-L581 WeakPolarHBondContact O-CG 3.42Å; T577-L581 PolarHBondContact O-N 2.87Å; T577-F594 HydrophobicContact CG2-CD2 4.2Å; T577-F594 HydrophobicContact CG2-CE2 3.91Å; T577-L597 HydrophobicContact CG2-CD2 3.29Å
578	A	95.1	Very high	94.4	Very high	3 Å²	3	24.7 Å²	24.7	3%	0.025	13%	0.128	C	C	.	.	H	α-helix	trans	-64.4	-38	-179.6	0	0	0	0	0	111.4	T191 L576 L581 V582 L590 F594	T191-A578 HydrophobicContact CG2-CB 4.34Å; L576-A578 PolarHBondContact O-N 2.81Å; A578-L581 PolarHBondContact O-N 3.45Å; A578-V582 WeakPolarHBondContact O-CG2 3.44Å; A578-V582 PolarHBondContact O-N 2.92Å; A578-L590 HydrophobicContact CB-CD1 4.36Å; A578-L590 WeakPolarHBondContact O-CD1 3.43Å; A578-F594 HydrophobicContact CB-CD2 4.11Å; A578-F594 HydrophobicContact CB-CE2 4.06Å
579	V	96	Very high	93.9	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.018	14%	0.135	C	C	.	.	H	α-helix	trans	-63	-49.1	177.4	-177.4	0	0	0	0	110.9	S188 T191 A532 L576 T577 L581 V582 E583	S188-V579 WeakPolarHBondContact OG-CG1 3.48Å; T191-V579 HydrophobicContact CG2-CG2 4.34Å; A532-V579 HydrophobicContact CB-CB 4.32Å; A532-V579 HydrophobicContact CB-CG1 3.83Å; L576-V579 HydrophobicContact CD2-CG2 4.47Å; L576-V579 WeakPolarHBondContact O-CB 3.1Å; L576-V579 PolarHBondContact O-N 3.21Å; L576-V579 VanDerWaalsContact O-N 3.11Å; T577-V579 VanDerWaalsContact C-N 3.3Å; T577-V579 PolarHBondContact O-N 3.04Å; V579-L581 VanDerWaalsContact C-N 3.26Å; V579-L581 PolarHBondContact O-N 3.41Å; V579-V582 PolarHBondContact O-N 2.94Å; V579-E583 PolarHBondContact O-N 3.49Å
580	I	96.8	Very high	93.5	Very high	5 Å²	5	23.8 Å²	23.8	3%	0.026	12%	0.124	C	C	.	.	H	α-helix	trans	-56.9	-42.8	176.7	-68.5	165.2	0	0	0	110.2	L471 A532 L533 N536 L576 T577 V582 E583 E584	L471-I580 HydrophobicContact CD1-CG2 4.09Å; L471-I580 HydrophobicContact CD2-CG2 3.92Å; A532-I580 HydrophobicContact CB-CG1 3.72Å; L533-I580 HydrophobicContact CB-CG1 4.43Å; L533-I580 HydrophobicContact CD1-CG2 4.1Å; N536-I580 HydrophobicContact CB-CD1 3.71Å; L576-I580 HydrophobicContact CB-CD1 4.2Å; L576-I580 HydrophobicContact CB-CG1 4.46Å; L576-I580 WeakPolarHBondContact O-CB 3.39Å; L576-I580 VanDerWaalsContact O-CG1 3.26Å; L576-I580 WeakPolarHBondContact O-CG1 3.44Å; L576-I580 PolarHBondContact O-N 3.5Å; T577-I580 PolarHBondContact O-N 3.27Å; I580-V582 VanDerWaalsContact C-N 3.34Å; I580-V582 PolarHBondContact O-N 3.48Å; I580-E583 PolarHBondContact O-N 2.93Å; I580-E584 HydrophobicContact CG2-CG 4.21Å; I580-E584 WeakPolarHBondContact O-CB 3.39Å; I580-E584 VanDerWaalsContact O-CG 3.32Å; I580-E584 WeakPolarHBondContact O-CG 3.31Å; I580-E584 PolarHBondContact O-N 3.2Å
581	L	95.4	Very high	93	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-63.6	-39.7	176.3	-70.2	170.9	0	0	0	112.1	M468 L471 T577 A578 V579 E584 V585 L590 A593 F594 L597	M468-L581 HydrophobicContact CE-CD2 4.49Å; M468-L581 HydrophobicContact SD-CD2 3.82Å; L471-L581 HydrophobicContact CD1-CD2 3.85Å; T577-L581 HydrophobicContact CG2-CD1 4.21Å; T577-L581 WeakPolarHBondContact O-CG 3.42Å; T577-L581 PolarHBondContact O-N 2.87Å; A578-L581 PolarHBondContact O-N 3.45Å; V579-L581 VanDerWaalsContact C-N 3.26Å; V579-L581 PolarHBondContact O-N 3.41Å; L581-E584 PolarHBondContact O-N 3.37Å; L581-V585 WeakPolarHBondContact O-CG2 3.22Å; L581-V585 PolarHBondContact O-N 3.08Å; L581-L590 HydrophobicContact CB-CD1 3.89Å; L581-A593 HydrophobicContact CB-CB 4.41Å; L581-A593 HydrophobicContact CD1-CB 4.3Å; L581-A593 HydrophobicContact CD2-CB 4Å; L581-A593 HydrophobicContact CG-CB 4.48Å; L581-F594 HydrophobicContact CD1-CB 3.91Å; L581-F594 HydrophobicContact CD1-CD2 3.82Å; L581-F594 HydrophobicContact CD1-CG 4.32Å; L581-L597 HydrophobicContact CD1-CB 4.43Å; L581-L597 HydrophobicContact CD1-CD2 3.9Å; L581-L597 HydrophobicContact CD2-CD2 4.31Å; L581-L597 HydrophobicContact CG-CD2 4.3Å
582	V	93.4	Very high	92.6	Very high	11 Å²	11	25.1 Å²	25.1	7%	0.067	13%	0.131	C	C	.	.	H	α-helix	trans	-65.6	-39.3	174.1	-175.9	0	0	0	0	111.7	A578 V579 I580 G586 L587 L590	A578-V582 WeakPolarHBondContact O-CG2 3.44Å; A578-V582 PolarHBondContact O-N 2.92Å; V579-V582 PolarHBondContact O-N 2.94Å; I580-V582 VanDerWaalsContact C-N 3.34Å; I580-V582 PolarHBondContact O-N 3.48Å; V582-G586 WeakPolarHBondContact O-CA 3.41Å; V582-G586 PolarHBondContact O-N 3.48Å; V582-L587 HydrophobicContact CG1-CB 3.98Å; V582-L587 HydrophobicContact CG1-CD1 4.41Å; V582-L587 HydrophobicContact CG2-CD1 4.01Å; V582-L590 HydrophobicContact CG2-CB 4.23Å; V582-L590 HydrophobicContact CG2-CD1 3.71Å; V582-L590 HydrophobicContact CG2-CD2 3.68Å; V582-L590 HydrophobicContact CG2-CG 4.06Å
583	E	93	Very high	92.4	Very high	86 Å²	86	25.1 Å²	25.1	40%	0.402	13%	0.131	S	C	.	.	H	α-helix	trans	-63.9	-38.1	176.4	-70.6	-178.8	168.5	0	0	112.4	V579 I580	V579-E583 PolarHBondContact O-N 3.49Å; I580-E583 PolarHBondContact O-N 2.93Å
584	E	92.8	Very high	92.2	Very high	31 Å²	31	25.2 Å²	25.2	15%	0.145	13%	0.132	C	C	.	.	H	α-helix	trans	-88	-39.2	-174.1	-70.1	-64.1	139.1	0	0	114.4	S467 L471 I580 L581 H647	S467-E584 WeakPolarHBondContact CB-OE2 3.36Å; S467-E584 PolarHBondContact OG-OE2 2.99Å; L471-E584 HydrophobicContact CD1-CG 4.27Å; I580-E584 HydrophobicContact CG2-CG 4.21Å; I580-E584 WeakPolarHBondContact O-CB 3.39Å; I580-E584 VanDerWaalsContact O-CG 3.32Å; I580-E584 WeakPolarHBondContact O-CG 3.31Å; I580-E584 PolarHBondContact O-N 3.2Å; L581-E584 PolarHBondContact O-N 3.37Å; E584-H647 IonicContact OE1-CE1 3.38Å; E584-H647 PolarHBondContact OE1-CE1 2.72Å; E584-H647 IonicContact OE2-CE1 3.23Å; E584-H647 PolarHBondContact OE2-CE1 3.19Å; E584-H647 VanDerWaalsContact OE2-CE1 3.23Å; E584-H647 IonicContact OE2-NE2 3.48Å; E584-H647 PolarHBondContact OE2-NE2 3.25Å
585	V	90.1	Very high	92.2	Very high	21 Å²	21	25 Å²	25	13%	0.127	13%	0.13	C	C	.	.	H	α-helix	trans	-122.8	-6.6	-174.8	-57.1	0	0	0	0	114.6	L462 L581 Q589 A593	L462-V585 HydrophobicContact CD1-CB 4.14Å; L462-V585 HydrophobicContact CD1-CG1 3.93Å; L462-V585 HydrophobicContact CD2-CG2 4.46Å; L581-V585 WeakPolarHBondContact O-CG2 3.22Å; L581-V585 PolarHBondContact O-N 3.08Å; V585-Q589 HydrophobicContact CG2-CB 4.27Å; V585-A593 HydrophobicContact CG2-CB 3.64Å
586	G	88.5	Confident	92	Very high	30 Å²	30	25.5 Å²	25.5	31%	0.309	13%	0.133	S	C	.	.			trans	88.3	161	178.8	0	0	0	0	0	114.8	V582 E588 Q589 L590	V582-G586 WeakPolarHBondContact O-CA 3.41Å; V582-G586 PolarHBondContact O-N 3.48Å; G586-E588 PolarHBondContact O-N 2.74Å; G586-Q589 PolarHBondContact O-N 3.01Å; G586-L590 PolarHBondContact O-N 3.41Å
587	L	86.8	Confident	91.9	Very high	44 Å²	44	25.6 Å²	25.6	23%	0.23	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-68.4	-34.8	-172	-176.5	63.5	0	0	0	113	Y181 V582 Q589 L590	Y181-L587 HydrophobicContact CD1-CD1 4.12Å; Y181-L587 HydrophobicContact CD1-CD2 4.24Å; Y181-L587 HydrophobicContact CD1-CG 4.08Å; Y181-L587 HydrophobicContact CE1-CD1 4.15Å; Y181-L587 HydrophobicContact CE1-CG 4.02Å; Y181-L587 HydrophobicContact CG-CD1 4.36Å; Y181-L587 PolarHBondContact OH-O 2.71Å; V582-L587 HydrophobicContact CG1-CB 3.98Å; V582-L587 HydrophobicContact CG1-CD1 4.41Å; V582-L587 HydrophobicContact CG2-CD1 4.01Å; L587-Q589 PolarHBondContact O-N 3.36Å; L587-L590 HydrophobicContact CD1-CB 4.49Å; L587-L590 HydrophobicContact CD1-CD2 3.91Å; L587-L590 WeakPolarHBondContact O-CB 3.46Å; L587-L590 PolarHBondContact O-N 3.03Å
588	E	84.6	Confident	91.8	Very high	174 Å²	174	25.3 Å²	25.3	81%	0.813	13%	0.132	S	C	*	.	G	3₁₀ helix	trans	-62.9	-32.9	-179.4	-62.4	-176.2	175.7	0	0	112.4	G586	G586-E588 PolarHBondContact O-N 2.74Å
589	Q	86.8	Confident	91.7	Very high	77 Å²	77	28 Å²	28	36%	0.36	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-94.7	-3.7	-178.7	-59.8	-175.6	15.7	0	0	112.6	V585 G586 L587 T591 N592 A593	V585-Q589 HydrophobicContact CG2-CB 4.27Å; G586-Q589 PolarHBondContact O-N 3.01Å; L587-Q589 PolarHBondContact O-N 3.36Å; Q589-T591 PolarHBondContact O-N 3.38Å; Q589-N592 PolarHBondContact O-N 2.92Å; Q589-N592 VanDerWaalsContact O-N 3.14Å; Q589-A593 WeakPolarHBondContact O-CB 3.43Å; Q589-A593 PolarHBondContact O-N 3.47Å
590	L	89.2	Confident	91.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-50.9	-51.2	-173.3	175.3	59.7	0	0	0	112.4	V177 S180 Y181 A578 L581 V582 G586 L587 N592 A593 F594	V177-L590 HydrophobicContact CB-CD2 4.41Å; S180-L590 VanDerWaalsContact CB-CD2 3.43Å; Y181-L590 HydrophobicContact CE2-CD2 4.16Å; A578-L590 HydrophobicContact CB-CD1 4.36Å; A578-L590 WeakPolarHBondContact O-CD1 3.43Å; L581-L590 HydrophobicContact CB-CD1 3.89Å; V582-L590 HydrophobicContact CG2-CB 4.23Å; V582-L590 HydrophobicContact CG2-CD1 3.71Å; V582-L590 HydrophobicContact CG2-CD2 3.68Å; V582-L590 HydrophobicContact CG2-CG 4.06Å; G586-L590 PolarHBondContact O-N 3.41Å; L587-L590 HydrophobicContact CD1-CB 4.49Å; L587-L590 HydrophobicContact CD1-CD2 3.91Å; L587-L590 WeakPolarHBondContact O-CB 3.46Å; L587-L590 PolarHBondContact O-N 3.03Å; L590-N592 VanDerWaalsContact C-N 3.33Å; L590-N592 PolarHBondContact O-N 3.46Å; L590-A593 PolarHBondContact O-N 2.96Å; L590-F594 WeakPolarHBondContact O-CB 3.27Å; L590-F594 PolarHBondContact O-N 3.27Å
591	T	88.5	Confident	91.3	Very high	3 Å²	3	28.3 Å²	28.3	2%	0.018	15%	0.149	C	C	.	.	H	α-helix	trans	-60.2	-43	-176	-60.9	0	0	0	0	111.7	S121 I124 N125 Y181 Q589 G595	S121-T591 WeakPolarHBondContact CB-O 3.25Å; S121-T591 WeakPolarHBondContact O-CG2 3.17Å; I124-T591 HydrophobicContact CB-CG2 4.15Å; I124-T591 HydrophobicContact CD1-CG2 4.39Å; I124-T591 HydrophobicContact CG2-CG2 4.12Å; N125-T591 WeakPolarHBondContact OD1-CG2 3.31Å; Y181-T591 PolarHBondContact OH-OG1 2.92Å; Q589-T591 PolarHBondContact O-N 3.38Å; T591-G595 PolarHBondContact O-N 3.12Å
592	N	89.9	Confident	91	Very high	26 Å²	26	28.3 Å²	28.3	14%	0.139	15%	0.149	C	C	.	.	H	α-helix	trans	-71.2	-41.4	177	-71	-21.4	0	0	0	112.2	N125 M457 Q589 L590 G595 L596	N125-N592 PolarHBondContact ND2-OD1 3.23Å; N125-N592 VanDerWaalsContact ND2-OD1 3.11Å; M457-N592 PolarHBondContact O-OD1 3.11Å; Q589-N592 PolarHBondContact O-N 2.92Å; Q589-N592 VanDerWaalsContact O-N 3.14Å; L590-N592 VanDerWaalsContact C-N 3.33Å; L590-N592 PolarHBondContact O-N 3.46Å; N592-G595 PolarHBondContact O-N 2.92Å; N592-L596 WeakPolarHBondContact O-CG 3.41Å; N592-L596 PolarHBondContact O-N 3.19Å
593	A	92.5	Very high	90.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-48.7	177.5	0	0	0	0	0	111.4	L462 M468 L581 V585 Q589 L590 G595 L596 L597	L462-A593 VanDerWaalsContact CD2-CA 3.43Å; L462-A593 HydrophobicContact CD2-CB 3.4Å; L462-A593 VanDerWaalsContact CD2-CB 3.4Å; M468-A593 HydrophobicContact CE-CB 4.36Å; M468-A593 WeakPolarHBondContact CE-O 3.48Å; M468-A593 HydrophobicContact SD-CB 4.32Å; L581-A593 HydrophobicContact CB-CB 4.41Å; L581-A593 HydrophobicContact CD1-CB 4.3Å; L581-A593 HydrophobicContact CD2-CB 4Å; L581-A593 HydrophobicContact CG-CB 4.48Å; V585-A593 HydrophobicContact CG2-CB 3.64Å; Q589-A593 WeakPolarHBondContact O-CB 3.43Å; Q589-A593 PolarHBondContact O-N 3.47Å; L590-A593 PolarHBondContact O-N 2.96Å; A593-G595 PolarHBondContact O-N 3.43Å; A593-L596 PolarHBondContact O-N 2.94Å; A593-L597 WeakPolarHBondContact O-CB 3.39Å; A593-L597 PolarHBondContact O-N 2.76Å
594	F	93.7	Very high	90.4	Very high	3 Å²	3	27.7 Å²	27.7	1%	0.013	15%	0.151	C	C	.	.	H	α-helix	trans	-62.6	-44.2	178.5	-166.9	-92.6	0	0	0	110.7	Y172 I173 C176 V177 T577 A578 L581 L590 L596 L597 V598	Y172-F594 HydrophobicContact CE1-CE1 4.03Å; Y172-F594 HydrophobicContact CE1-CZ 4.06Å; I173-F594 HydrophobicContact CD1-CD1 3.95Å; I173-F594 HydrophobicContact CD1-CE1 3.76Å; I173-F594 HydrophobicContact CG2-CD1 4.31Å; C176-F594 HydrophobicContact CB-CE1 3.84Å; C176-F594 HydrophobicContact CB-CE2 4.26Å; C176-F594 HydrophobicContact CB-CZ 3.5Å; V177-F594 HydrophobicContact CG1-CB 3.77Å; V177-F594 HydrophobicContact CG1-CD1 3.52Å; V177-F594 HydrophobicContact CG1-CD2 4.22Å; V177-F594 HydrophobicContact CG1-CE1 4.12Å; V177-F594 HydrophobicContact CG1-CG 3.58Å; T577-F594 HydrophobicContact CG2-CD2 4.2Å; T577-F594 HydrophobicContact CG2-CE2 3.91Å; A578-F594 HydrophobicContact CB-CD2 4.11Å; A578-F594 HydrophobicContact CB-CE2 4.06Å; L581-F594 HydrophobicContact CD1-CB 3.91Å; L581-F594 HydrophobicContact CD1-CD2 3.82Å; L581-F594 HydrophobicContact CD1-CG 4.32Å; L590-F594 WeakPolarHBondContact O-CB 3.27Å; L590-F594 PolarHBondContact O-N 3.27Å; F594-L596 PolarHBondContact O-N 3.31Å; F594-L597 PolarHBondContact O-N 3.09Å; F594-V598 HydrophobicContact CD1-CG2 3.81Å; F594-V598 HydrophobicContact CE1-CG2 3.58Å; F594-V598 HydrophobicContact CE2-CG2 4.46Å; F594-V598 HydrophobicContact CG-CG2 4.37Å; F594-V598 HydrophobicContact CZ-CG2 3.91Å; F594-V598 WeakPolarHBondContact O-CB 3.39Å; F594-V598 VanDerWaalsContact O-CG2 3.25Å; F594-V598 WeakPolarHBondContact O-CG2 3.3Å; F594-V598 PolarHBondContact O-N 3.05Å
595	G	93.6	Very high	90.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-58.7	-43.8	175.7	0	0	0	0	0	113.5	G117 P118 T591 N592 A593 L599	G117-G595 VanDerWaalsContact C-CA 3.47Å; G117-G595 WeakPolarHBondContact O-CA 3.48Å; P118-G595 WeakPolarHBondContact CD-O 3.23Å; T591-G595 PolarHBondContact O-N 3.12Å; N592-G595 PolarHBondContact O-N 2.92Å; A593-G595 PolarHBondContact O-N 3.43Å; G595-L599 WeakPolarHBondContact O-CB 3.48Å; G595-L599 PolarHBondContact O-N 2.93Å
596	L	92.6	Very high	90	Very high	11 Å²	11	27.8 Å²	27.8	6%	0.058	15%	0.151	C	C	.	.	H	α-helix	trans	-68.7	-39.1	176.8	-72.2	169.8	0	0	0	112.7	V458 L462 L463 M468 N592 A593 F594 L599 A600	V458-L596 HydrophobicContact CG1-CD2 4.25Å; L462-L596 HydrophobicContact CB-CD1 4.03Å; L462-L596 HydrophobicContact CD2-CD1 4.45Å; L463-L596 HydrophobicContact CD1-CD2 4.37Å; L463-L596 HydrophobicContact CG-CD1 4.23Å; M468-L596 HydrophobicContact CE-CB 3.73Å; N592-L596 WeakPolarHBondContact O-CG 3.41Å; N592-L596 PolarHBondContact O-N 3.19Å; A593-L596 PolarHBondContact O-N 2.94Å; F594-L596 PolarHBondContact O-N 3.31Å; L596-L599 WeakPolarHBondContact O-CB 3.32Å; L596-A600 PolarHBondContact O-N 3.18Å
597	L	94.6	Very high	90.1	Very high	2 Å²	2	29 Å²	29	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-66	-45.4	176.6	-172.3	69.7	0	0	0	111	M468 L471 N475 T577 L581 A593 F594 L599 A600 R601	M468-L597 HydrophobicContact CE-CB 4.22Å; L471-L597 HydrophobicContact CB-CD1 4.16Å; N475-L597 HydrophobicContact CB-CD1 3.84Å; N475-L597 HydrophobicContact CB-CG 4.49Å; T577-L597 HydrophobicContact CG2-CD2 3.29Å; L581-L597 HydrophobicContact CD1-CB 4.43Å; L581-L597 HydrophobicContact CD1-CD2 3.9Å; L581-L597 HydrophobicContact CD2-CD2 4.31Å; L581-L597 HydrophobicContact CG-CD2 4.3Å; A593-L597 WeakPolarHBondContact O-CB 3.39Å; A593-L597 PolarHBondContact O-N 2.76Å; F594-L597 PolarHBondContact O-N 3.09Å; L597-L599 VanDerWaalsContact C-N 3.33Å; L597-L599 PolarHBondContact O-N 3.42Å; L597-A600 WeakPolarHBondContact O-CB 3.19Å; L597-A600 PolarHBondContact O-N 3.21Å; L597-A600 VanDerWaalsContact O-N 3.14Å; L597-R601 WeakPolarHBondContact O-CG 3.25Å; L597-R601 PolarHBondContact O-N 3.22Å
598	V	94.5	Very high	90.1	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-68	-32.9	179.9	175.4	0	0	0	0	111.4	S114 Y172 I173 F594 A600 R601 G602	S114-V598 WeakPolarHBondContact CB-O 3.39Å; S114-V598 CarbonylContact O-C 3.6Å; S114-V598 WeakPolarHBondContact O-CG1 3.15Å; Y172-V598 HydrophobicContact CE1-CG2 4.43Å; I173-V598 HydrophobicContact CD1-CB 4.05Å; I173-V598 HydrophobicContact CD1-CG1 3.76Å; I173-V598 HydrophobicContact CD1-CG2 4.15Å; F594-V598 HydrophobicContact CD1-CG2 3.81Å; F594-V598 HydrophobicContact CE1-CG2 3.58Å; F594-V598 HydrophobicContact CE2-CG2 4.46Å; F594-V598 HydrophobicContact CG-CG2 4.37Å; F594-V598 HydrophobicContact CZ-CG2 3.91Å; F594-V598 WeakPolarHBondContact O-CB 3.39Å; F594-V598 VanDerWaalsContact O-CG2 3.25Å; F594-V598 WeakPolarHBondContact O-CG2 3.3Å; F594-V598 PolarHBondContact O-N 3.05Å; V598-A600 PolarHBondContact O-N 3.43Å; V598-R601 WeakPolarHBondContact O-CB 3.33Å; V598-R601 PolarHBondContact O-N 3.03Å; V598-G602 PolarHBondContact O-N 3.03Å
599	L	93.1	Very high	90.2	Very high	61 Å²	61	18.8 Å²	18.8	32%	0.319	10%	0.104	S	C	.	.	H	α-helix	trans	-55.2	-50.5	167.3	178.2	71.4	0	0	0	111.6	S114 L115 P118 G595 L596 L597 R601 G602 V603	S114-L599 PolarHBondContact O-N 3.32Å; L115-L599 HydrophobicContact CD2-CD1 3.73Å; P118-L599 HydrophobicContact CG-CB 3.93Å; P118-L599 HydrophobicContact CG-CD1 4.25Å; P118-L599 HydrophobicContact CG-CD2 3.9Å; P118-L599 HydrophobicContact CG-CG 4.24Å; G595-L599 WeakPolarHBondContact O-CB 3.48Å; G595-L599 PolarHBondContact O-N 2.93Å; L596-L599 WeakPolarHBondContact O-CB 3.32Å; L597-L599 VanDerWaalsContact C-N 3.33Å; L597-L599 PolarHBondContact O-N 3.42Å; L599-R601 VanDerWaalsContact C-N 3.28Å; L599-R601 PolarHBondContact O-N 3.03Å; L599-G602 PolarHBondContact O-N 3.46Å; L599-G602 VanDerWaalsContact O-N 3.08Å; L599-V603 PolarHBondContact O-N 3.36Å
600	A	90.6	Very high	90.3	Very high	13 Å²	13	15.3 Å²	15.3	11%	0.107	9%	0.088	C	C	.	.	H	α-helix	trans	-60.9	-39.8	-179.5	0	0	0	0	0	111.3	C472 I476 L596 L597 V598 S604	C472-A600 HydrophobicContact CB-CB 4.22Å; I476-A600 HydrophobicContact CD1-CB 3.98Å; I476-A600 HydrophobicContact CG1-CB 3.8Å; I476-A600 VanDerWaalsContact CG1-O 3.3Å; I476-A600 WeakPolarHBondContact CG1-O 3.07Å; L596-A600 PolarHBondContact O-N 3.18Å; L597-A600 WeakPolarHBondContact O-CB 3.19Å; L597-A600 PolarHBondContact O-N 3.21Å; L597-A600 VanDerWaalsContact O-N 3.14Å; V598-A600 PolarHBondContact O-N 3.43Å; A600-S604 PolarHBondContact O-OG 3.01Å
601	R	93.8	Very high	90.4	Very high	1 Å²	1	18.7 Å²	18.7	0%	0.004	11%	0.105	C	C	.	.	H	α-helix	trans	-62.4	-41.3	172.5	-66.3	176.2	50	173.2	-11	112.3	N475 M479 L597 V598 L599 S604 A605	N475-R601 HydrophobicContact CB-CG 3.9Å; M479-R601 HydrophobicContact CE-CG 4.47Å; M479-R601 HydrophobicContact CG-CB 3.61Å; M479-R601 HydrophobicContact CG-CG 3.56Å; M479-R601 HydrophobicContact SD-CB 4Å; M479-R601 HydrophobicContact SD-CG 4.17Å; M479-R601 PolarHBondContact SD-NE 3.11Å; M479-R601 VanDerWaalsContact SD-NE 3.4Å; L597-R601 WeakPolarHBondContact O-CG 3.25Å; L597-R601 PolarHBondContact O-N 3.22Å; V598-R601 WeakPolarHBondContact O-CB 3.33Å; V598-R601 PolarHBondContact O-N 3.03Å; L599-R601 VanDerWaalsContact C-N 3.28Å; L599-R601 PolarHBondContact O-N 3.03Å; R601-S604 WeakPolarHBondContact O-CB 3.19Å; R601-S604 PolarHBondContact O-N 3.48Å; R601-S604 VanDerWaalsContact O-N 3.15Å; R601-A605 WeakPolarHBondContact O-CB 3.22Å; R601-A605 PolarHBondContact O-N 3.29Å
602	G	89.4	Confident	90.4	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-64.4	-40.9	-175.7	0	0	0	0	0	114.8	G111 V598 L599 S604 A605 M606	G111-G602 WeakPolarHBondContact CA-O 3.33Å; V598-G602 PolarHBondContact O-N 3.03Å; L599-G602 PolarHBondContact O-N 3.46Å; L599-G602 VanDerWaalsContact O-N 3.08Å; G602-S604 PolarHBondContact O-N 3.39Å; G602-A605 PolarHBondContact O-N 3.04Å; G602-M606 PolarHBondContact O-N 3.06Å; G602-M606 VanDerWaalsContact O-N 3.16Å
603	V	85.2	Confident	90.4	Very high	81 Å²	81	17.5 Å²	17.5	49%	0.491	10%	0.099	S	C	.	.	H	α-helix	trans	-56.7	-41.1	173.4	178	0	0	0	0	110.6	L115 L599 V607	L115-V603 HydrophobicContact CD2-CG2 3.69Å; L599-V603 PolarHBondContact O-N 3.36Å; V603-V607 WeakPolarHBondContact O-CG2 3.39Å
604	S	88.4	Confident	90.3	Very high	4 Å²	4	19.1 Å²	19.1	3%	0.028	11%	0.113	C	C	.	.	H	α-helix	trans	-76	-45.1	-175.5	-53.3	0	0	0	0	111.9	I476 L480 A600 R601 G602 M606 V607 G608	I476-S604 WeakPolarHBondContact CA-OG 3.42Å; I476-S604 WeakPolarHBondContact CG2-OG 3Å; I476-S604 VanDerWaalsContact O-CB 3.28Å; I476-S604 WeakPolarHBondContact O-CB 3.19Å; I476-S604 PolarHBondContact O-OG 3.24Å; I476-S604 VanDerWaalsContact O-OG 3.12Å; L480-S604 WeakPolarHBondContact CD2-O 3.34Å; A600-S604 PolarHBondContact O-OG 3.01Å; R601-S604 WeakPolarHBondContact O-CB 3.19Å; R601-S604 PolarHBondContact O-N 3.48Å; R601-S604 VanDerWaalsContact O-N 3.15Å; G602-S604 PolarHBondContact O-N 3.39Å; S604-M606 PolarHBondContact O-N 3.43Å; S604-V607 PolarHBondContact O-N 3.33Å; S604-V607 VanDerWaalsContact O-N 3.14Å; S604-G608 PolarHBondContact O-N 3.01Å
605	A	87	Confident	90.3	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62.1	-33.4	179.3	0	0	0	0	0	112.8	V110 Y483 R601 G602 V607	V110-A605 HydrophobicContact CG1-CB 3.73Å; Y483-A605 HydrophobicContact CD2-CB 3.8Å; Y483-A605 HydrophobicContact CE2-CB 3.4Å; Y483-A605 VanDerWaalsContact CE2-CB 3.4Å; R601-A605 WeakPolarHBondContact O-CB 3.22Å; R601-A605 PolarHBondContact O-N 3.29Å; G602-A605 PolarHBondContact O-N 3.04Å; A605-V607 VanDerWaalsContact C-N 3.28Å; A605-V607 PolarHBondContact O-N 3.33Å
606	M	87.5	Confident	90.1	Very high	54 Å²	54	23.4 Å²	23.4	27%	0.266	13%	0.132	S	C	.	.	H	α-helix	trans	-65.5	-32.8	177.7	-152.3	175.9	61.5	0	0	112.5	W104 V108 L115 G602 S604 P610	W104-M606 HydrophobicContact CZ3-CG 4.02Å; W104-M606 WeakPolarHBondContact CZ3-O 3.31Å; V108-M606 HydrophobicContact CG2-CG 4.45Å; L115-M606 HydrophobicContact CD1-SD 4.49Å; G602-M606 PolarHBondContact O-N 3.06Å; G602-M606 VanDerWaalsContact O-N 3.16Å; S604-M606 PolarHBondContact O-N 3.43Å; M606-P610 WeakPolarHBondContact O-CD 3.49Å
607	V	89.6	Confident	90.1	Very high	55 Å²	55	26.5 Å²	26.5	33%	0.333	15%	0.149	S	C	.	.	H	α-helix	trans	-100.2	-27.4	-174.2	-171.9	0	0	0	0	112.2	L480 V603 S604 A605 P610 I611	L480-V607 HydrophobicContact CD2-CB 4.45Å; V603-V607 WeakPolarHBondContact O-CG2 3.39Å; S604-V607 PolarHBondContact O-N 3.33Å; S604-V607 VanDerWaalsContact O-N 3.14Å; A605-V607 VanDerWaalsContact C-N 3.28Å; A605-V607 PolarHBondContact O-N 3.33Å; V607-P610 WeakPolarHBondContact O-CD 3.38Å; V607-I611 HydrophobicContact CG1-CD1 3.63Å; V607-I611 HydrophobicContact CG1-CG1 3.98Å; V607-I611 VanDerWaalsContact O-CG1 3.31Å; V607-I611 WeakPolarHBondContact O-CG1 3.36Å; V607-I611 PolarHBondContact O-N 3.46Å
608	G	87.7	Confident	90	Very high	2 Å²	2	31 Å²	31	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-58.1	-53.1	-174.4	0	0	0	0	0	114	L480 S604 I611 G612	L480-G608 VanDerWaalsContact O-CA 3.31Å; L480-G608 WeakPolarHBondContact O-CA 3.35Å; S604-G608 PolarHBondContact O-N 3.01Å; G608-I611 WeakPolarHBondContact O-CB 3.45Å; G608-I611 PolarHBondContact O-N 3.26Å; G608-G612 PolarHBondContact O-N 2.84Å; G608-G612 VanDerWaalsContact O-N 3.08Å
609	S	87	Confident	90	Very high	2 Å²	2	34 Å²	34	1%	0.014	20%	0.199	C	C	.	.	H	α-helix	trans	-65.5	-46.6	179.9	-26.2	0	0	0	0	112.2	S107 Y488 I611 G612 G613	S107-S609 VanDerWaalsContact OG-CB 3.22Å; S107-S609 WeakPolarHBondContact OG-CB 3.32Å; S107-S609 PolarHBondContact OG-OG 2.8Å; Y488-S609 WeakPolarHBondContact CE2-O 3.17Å; Y488-S609 PolarHBondContact OH-O 3.45Å; S609-I611 PolarHBondContact O-N 2.82Å; S609-G612 CarbonylContact O-C 3.39Å; S609-G612 VanDerWaalsContact O-CA 3.29Å; S609-G612 WeakPolarHBondContact O-CA 3.41Å; S609-G612 PolarHBondContact O-N 3.08Å; S609-G613 PolarHBondContact O-N 3.04Å
610	P	88.5	Confident	89.9	Confident	3 Å²	3	33.8 Å²	33.8	2%	0.019	21%	0.212	C	C	.	.	H	α-helix	trans	-59.2	-30.9	175.4	-27.5	36.7	0	0	0	114.4	Q100 W104 S107 M606 V607 G613 A614	Q100-P610 HydrophobicContact CG-CB 4.31Å; Q100-P610 PolarHBondContact NE2-O 2.98Å; W104-P610 HydrophobicContact CD2-CB 4.15Å; W104-P610 HydrophobicContact CD2-CG 3.58Å; W104-P610 HydrophobicContact CE3-CG 3.89Å; W104-P610 HydrophobicContact CG-CG 4.04Å; W104-P610 HydrophobicContact CH2-CB 4.41Å; W104-P610 HydrophobicContact CH2-CG 4.14Å; W104-P610 HydrophobicContact CZ2-CB 3.74Å; W104-P610 HydrophobicContact CZ2-CG 3.84Å; W104-P610 HydrophobicContact CZ3-CG 4.17Å; S107-P610 WeakPolarHBondContact OG-CD 3.48Å; M606-P610 WeakPolarHBondContact O-CD 3.49Å; V607-P610 WeakPolarHBondContact O-CD 3.38Å; P610-G613 PolarHBondContact O-N 3.35Å; P610-A614 WeakPolarHBondContact O-CB 3.32Å; P610-A614 PolarHBondContact O-N 2.72Å
611	I	90.3	Very high	89.9	Confident	72 Å²	72	34.4 Å²	34.4	37%	0.369	22%	0.217	S	C	.	.	H	α-helix	trans	-62.7	-47.1	168.5	-71.7	168.7	0	0	0	109.9	L480 V607 G608 S609 G613 A614 V615	L480-I611 HydrophobicContact CD2-CD1 4.32Å; V607-I611 HydrophobicContact CG1-CD1 3.63Å; V607-I611 HydrophobicContact CG1-CG1 3.98Å; V607-I611 VanDerWaalsContact O-CG1 3.31Å; V607-I611 WeakPolarHBondContact O-CG1 3.36Å; V607-I611 PolarHBondContact O-N 3.46Å; G608-I611 WeakPolarHBondContact O-CB 3.45Å; G608-I611 PolarHBondContact O-N 3.26Å; S609-I611 PolarHBondContact O-N 2.82Å; I611-G613 VanDerWaalsContact C-N 3.27Å; I611-G613 PolarHBondContact O-N 3.38Å; I611-A614 PolarHBondContact O-N 2.8Å; I611-A614 VanDerWaalsContact O-N 3.13Å; I611-V615 HydrophobicContact CG2-CG2 4.38Å; I611-V615 WeakPolarHBondContact O-CG2 3.46Å; I611-V615 PolarHBondContact O-N 3.05Å
612	G	89.5	Confident	89.8	Confident	3 Å²	3	35.4 Å²	35.4	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-56.5	-39.8	174.8	0	0	0	0	0	113.2	G608 S609 Y616 S625	G608-G612 PolarHBondContact O-N 2.84Å; G608-G612 VanDerWaalsContact O-N 3.08Å; S609-G612 CarbonylContact O-C 3.39Å; S609-G612 VanDerWaalsContact O-CA 3.29Å; S609-G612 WeakPolarHBondContact O-CA 3.41Å; S609-G612 PolarHBondContact O-N 3.08Å; G612-Y616 PolarHBondContact O-N 2.94Å; G612-Y616 VanDerWaalsContact O-N 3.13Å; G612-S625 PolarHBondContact O-OG 2.98Å
613	G	88.5	Confident	90	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-66.1	-42.4	173.1	0	0	0	0	0	113.1	Y488 S609 P610 I611 V615 Y616 D617	Y488-G613 WeakPolarHBondContact OH-CA 3.36Å; Y488-G613 PolarHBondContact OH-N 3.28Å; Y488-G613 VanDerWaalsContact OH-N 3.14Å; S609-G613 PolarHBondContact O-N 3.04Å; P610-G613 PolarHBondContact O-N 3.35Å; I611-G613 VanDerWaalsContact C-N 3.27Å; I611-G613 PolarHBondContact O-N 3.38Å; G613-V615 PolarHBondContact O-N 3.12Å; G613-Y616 WeakPolarHBondContact O-CB 3.33Å; G613-Y616 PolarHBondContact O-N 3.32Å; G613-D617 VanDerWaalsContact O-CG 3.3Å; G613-D617 PolarHBondContact O-N 3.16Å
614	A	91.8	Very high	90.5	Very high	35 Å²	35	38.9 Å²	38.9	29%	0.289	23%	0.229	S	C	.	.	H	α-helix	trans	-65.3	-37.6	176.4	0	0	0	0	0	112.9	P610 I611 Y616 D617 S618	P610-A614 WeakPolarHBondContact O-CB 3.32Å; P610-A614 PolarHBondContact O-N 2.72Å; I611-A614 PolarHBondContact O-N 2.8Å; I611-A614 VanDerWaalsContact O-N 3.13Å; A614-Y616 VanDerWaalsContact C-N 3.29Å; A614-D617 PolarHBondContact O-N 2.97Å; A614-S618 WeakPolarHBondContact O-CB 3.25Å; A614-S618 PolarHBondContact O-N 3.34Å; A614-S618 PolarHBondContact O-OG 3.05Å
615	V	93.7	Very high	90.8	Very high	27 Å²	27	38.8 Å²	38.8	16%	0.164	23%	0.228	C	C	.	.	H	α-helix	trans	-62.9	-40.5	173.4	172.9	0	0	0	0	110	I611 G613 S618 T619 F624	I611-V615 HydrophobicContact CG2-CG2 4.38Å; I611-V615 WeakPolarHBondContact O-CG2 3.46Å; I611-V615 PolarHBondContact O-N 3.05Å; G613-V615 PolarHBondContact O-N 3.12Å; V615-S618 PolarHBondContact O-OG 3.41Å; V615-S618 VanDerWaalsContact O-OG 3.11Å; V615-T619 HydrophobicContact CG1-CG2 4.4Å; V615-T619 WeakPolarHBondContact O-CB 3.31Å; V615-T619 WeakPolarHBondContact O-CG2 3.27Å; V615-T619 PolarHBondContact O-N 3.44Å; V615-T619 PolarHBondContact O-OG1 2.81Å; V615-F624 HydrophobicContact CG1-CB 3.66Å
616	Y	90	Very high	91.2	Very high	65 Å²	65	38.8 Å²	38.8	26%	0.255	23%	0.228	S	C	.	.	H	α-helix	trans	-64.1	-49.9	173.4	175.7	-97.4	0	0	0	111.9	G612 G613 A614 S618 T619 G620 Y622	G612-Y616 PolarHBondContact O-N 2.94Å; G612-Y616 VanDerWaalsContact O-N 3.13Å; G613-Y616 WeakPolarHBondContact O-CB 3.33Å; G613-Y616 PolarHBondContact O-N 3.32Å; A614-Y616 VanDerWaalsContact C-N 3.29Å; Y616-S618 PolarHBondContact O-N 3.48Å; Y616-T619 PolarHBondContact O-N 3.08Å; Y616-G620 VanDerWaalsContact O-CA 3.3Å; Y616-G620 WeakPolarHBondContact O-CA 3.43Å; Y616-G620 PolarHBondContact O-N 3.27Å; Y616-Y622 HydrophobicContact CD1-CE1 4.35Å; Y616-Y622 AromaticContact CD2-CD1 3.56Å; Y616-Y622 HydrophobicContact CD2-CD1 3.56Å; Y616-Y622 AromaticContact CD2-CD2 3.84Å; Y616-Y622 HydrophobicContact CD2-CD2 3.84Å; Y616-Y622 AromaticContact CD2-CE1 3.52Å; Y616-Y622 HydrophobicContact CD2-CE1 3.52Å; Y616-Y622 AromaticContact CD2-CE2 3.81Å; Y616-Y622 HydrophobicContact CD2-CE2 3.81Å; Y616-Y622 AromaticContact CD2-CG 3.71Å; Y616-Y622 HydrophobicContact CD2-CG 3.71Å; Y616-Y622 AromaticContact CD2-CZ 3.64Å; Y616-Y622 HydrophobicContact CE2-CD1 4.15Å; Y616-Y622 AromaticContact CE2-CD2 3.62Å; Y616-Y622 HydrophobicContact CE2-CD2 3.62Å; Y616-Y622 AromaticContact CE2-CE1 3.9Å; Y616-Y622 HydrophobicContact CE2-CE1 3.9Å; Y616-Y622 AromaticContact CE2-CE2 3.34Å; Y616-Y622 HydrophobicContact CE2-CE2 3.34Å; Y616-Y622 HydrophobicContact CE2-CG 4.01Å; Y616-Y622 AromaticContact CE2-CZ 3.49Å; Y616-Y622 VanDerWaalsContact CE2-CZ 3.49Å; Y616-Y622 HydrophobicContact CG-CD1 4.07Å; Y616-Y622 AromaticContact CG-CE1 3.77Å; Y616-Y622 HydrophobicContact CG-CE1 3.77Å; Y616-Y622 AromaticContact CZ-CE2 3.89Å; Y616-Y622 AromaticContact CZ-CZ 3.8Å
617	D	91.6	Very high	91.7	Very high	76 Å²	76	39.2 Å²	39.2	41%	0.406	23%	0.232	S	C	.	.	H	α-helix	trans	-60.1	-31.9	-177.8	-69.7	-17.1	0	0	0	112.3	Q100 G613 A614	Q100-D617 WeakPolarHBondContact CB-OD2 3.34Å; G613-D617 VanDerWaalsContact O-CG 3.3Å; G613-D617 PolarHBondContact O-N 3.16Å; A614-D617 PolarHBondContact O-N 2.97Å
618	S	92.5	Very high	92	Very high	96 Å²	96	39.5 Å²	39.5	67%	0.671	23%	0.234	S	C	*	.	H	α-helix	trans	-86	-33.5	178.9	54.9	0	0	0	0	114.7	A614 V615 Y616	A614-S618 WeakPolarHBondContact O-CB 3.25Å; A614-S618 PolarHBondContact O-N 3.34Å; A614-S618 PolarHBondContact O-OG 3.05Å; V615-S618 PolarHBondContact O-OG 3.41Å; V615-S618 VanDerWaalsContact O-OG 3.11Å; Y616-S618 PolarHBondContact O-N 3.48Å
619	T	94	Very high	92.4	Very high	63 Å²	63	39.6 Å²	39.6	39%	0.387	23%	0.234	S	C	.	.	H	α-helix	trans	-101.4	-17	-175.3	64.2	0	0	0	0	113.9	V615 Y616 A621 F624	V615-T619 HydrophobicContact CG1-CG2 4.4Å; V615-T619 WeakPolarHBondContact O-CB 3.31Å; V615-T619 WeakPolarHBondContact O-CG2 3.27Å; V615-T619 PolarHBondContact O-N 3.44Å; V615-T619 PolarHBondContact O-OG1 2.81Å; Y616-T619 PolarHBondContact O-N 3.08Å; T619-A621 PolarHBondContact O-N 2.93Å; T619-A621 PolarHBondContact OG1-N 3.27Å; T619-A621 PolarHBondContact OG1-O 2.93Å; T619-F624 HydrophobicContact CG2-CB 4.39Å; T619-F624 HydrophobicContact CG2-CD2 3.85Å; T619-F624 HydrophobicContact CG2-CE2 4.45Å; T619-F624 HydrophobicContact CG2-CG 4.32Å
620	G	90.4	Very high	92.9	Very high	57 Å²	57	39.5 Å²	39.5	59%	0.588	23%	0.233	S	C	*	.	S	Bend	trans	68.9	8.9	-171.4	0	0	0	0	0	114.6	Y616	Y616-G620 VanDerWaalsContact O-CA 3.3Å; Y616-G620 WeakPolarHBondContact O-CA 3.43Å; Y616-G620 PolarHBondContact O-N 3.27Å
621	A	91.7	Very high	93.3	Very high	26 Å²	26	41.9 Å²	41.9	22%	0.215	25%	0.253	C	S	.	.			trans	-141.7	124.6	-173.1	0	0	0	0	0	113.9	T619 K623 F624	T619-A621 PolarHBondContact O-N 2.93Å; T619-A621 PolarHBondContact OG1-N 3.27Å; T619-A621 PolarHBondContact OG1-O 2.93Å; A621-K623 HydrophobicContact CB-CD 4.38Å; A621-K623 HydrophobicContact CB-CG 3.95Å; A621-K623 PolarHBondContact O-N 3.44Å; A621-F624 HydrophobicContact CB-CD2 4.1Å; A621-F624 HydrophobicContact CB-CE2 4.27Å; A621-F624 PolarHBondContact O-N 2.97Å
622	Y	91.6	Very high	93.6	Very high	23 Å²	23	40.7 Å²	40.7	9%	0.09	25%	0.247	C	C	.	.	H	α-helix	trans	-61.8	-27.3	179.7	-70.2	-69.6	0	0	0	113.7	Y488 A491 Y492 Y616 F624 S625 F626	Y488-Y622 HydrophobicContact CD1-CD1 4.08Å; Y488-Y622 AromaticContact CD1-CE1 3.68Å; Y488-Y622 HydrophobicContact CD1-CE1 3.68Å; Y488-Y622 HydrophobicContact CE1-CE1 4.41Å; Y488-Y622 HydrophobicContact CG-CD1 4.3Å; Y488-Y622 HydrophobicContact CG-CE1 4.34Å; A491-Y622 HydrophobicContact CB-CE1 4.18Å; A491-Y622 HydrophobicContact CB-CE2 3.91Å; Y492-Y622 HydrophobicContact CD2-CD2 4.41Å; Y616-Y622 HydrophobicContact CD1-CE1 4.35Å; Y616-Y622 AromaticContact CD2-CD1 3.56Å; Y616-Y622 HydrophobicContact CD2-CD1 3.56Å; Y616-Y622 AromaticContact CD2-CD2 3.84Å; Y616-Y622 HydrophobicContact CD2-CD2 3.84Å; Y616-Y622 AromaticContact CD2-CE1 3.52Å; Y616-Y622 HydrophobicContact CD2-CE1 3.52Å; Y616-Y622 AromaticContact CD2-CE2 3.81Å; Y616-Y622 HydrophobicContact CD2-CE2 3.81Å; Y616-Y622 AromaticContact CD2-CG 3.71Å; Y616-Y622 HydrophobicContact CD2-CG 3.71Å; Y616-Y622 AromaticContact CD2-CZ 3.64Å; Y616-Y622 HydrophobicContact CE2-CD1 4.15Å; Y616-Y622 AromaticContact CE2-CD2 3.62Å; Y616-Y622 HydrophobicContact CE2-CD2 3.62Å; Y616-Y622 AromaticContact CE2-CE1 3.9Å; Y616-Y622 HydrophobicContact CE2-CE1 3.9Å; Y616-Y622 AromaticContact CE2-CE2 3.34Å; Y616-Y622 HydrophobicContact CE2-CE2 3.34Å; Y616-Y622 HydrophobicContact CE2-CG 4.01Å; Y616-Y622 AromaticContact CE2-CZ 3.49Å; Y616-Y622 VanDerWaalsContact CE2-CZ 3.49Å; Y616-Y622 HydrophobicContact CG-CD1 4.07Å; Y616-Y622 AromaticContact CG-CE1 3.77Å; Y616-Y622 HydrophobicContact CG-CE1 3.77Å; Y616-Y622 AromaticContact CZ-CE2 3.89Å; Y616-Y622 AromaticContact CZ-CZ 3.8Å; Y622-F624 PolarHBondContact O-N 3.41Å; Y622-F624 VanDerWaalsContact O-N 3.1Å; Y622-S625 WeakPolarHBondContact O-CA 3.41Å; Y622-S625 VanDerWaalsContact O-CB 3.31Å; Y622-S625 WeakPolarHBondContact O-CB 3.39Å; Y622-S625 PolarHBondContact O-N 2.7Å; Y622-F626 WeakPolarHBondContact O-CD2 3.29Å; Y622-F626 PolarHBondContact O-N 3.34Å
623	K	94.5	Very high	94	Very high	80 Å²	80	40.5 Å²	40.5	35%	0.348	25%	0.246	S	C	.	.	H	α-helix	trans	-52.6	-34.1	-179.1	67.5	-176.5	178.4	-178.9	0	113.6	M551 A621 F626 L627	M551-K623 HydrophobicContact CB-CB 4.02Å; M551-K623 WeakPolarHBondContact CB-O 3.42Å; A621-K623 HydrophobicContact CB-CD 4.38Å; A621-K623 HydrophobicContact CB-CG 3.95Å; A621-K623 PolarHBondContact O-N 3.44Å; K623-F626 PolarHBondContact O-N 3.42Å; K623-L627 PolarHBondContact O-N 2.93Å; K623-L627 VanDerWaalsContact O-N 3.1Å
624	F	95.1	Very high	94.5	Very high	74 Å²	74	44.1 Å²	44.1	33%	0.325	26%	0.262	S	S	.	.	H	α-helix	trans	-76	-31	178.5	-63.8	-65.1	0	0	0	112.4	V615 T619 A621 Y622 F626 L627 V628	V615-F624 HydrophobicContact CG1-CB 3.66Å; T619-F624 HydrophobicContact CG2-CB 4.39Å; T619-F624 HydrophobicContact CG2-CD2 3.85Å; T619-F624 HydrophobicContact CG2-CE2 4.45Å; T619-F624 HydrophobicContact CG2-CG 4.32Å; A621-F624 HydrophobicContact CB-CD2 4.1Å; A621-F624 HydrophobicContact CB-CE2 4.27Å; A621-F624 PolarHBondContact O-N 2.97Å; Y622-F624 PolarHBondContact O-N 3.41Å; Y622-F624 VanDerWaalsContact O-N 3.1Å; F624-F626 VanDerWaalsContact C-N 3.31Å; F624-F626 PolarHBondContact O-N 3.37Å; F624-L627 PolarHBondContact O-N 3.41Å; F624-V628 WeakPolarHBondContact O-CG2 3.34Å; F624-V628 PolarHBondContact O-N 3.44Å
625	S	94	Very high	94.8	Very high	1 Å²	1	44 Å²	44	1%	0.007	26%	0.261	C	S	.	.	H	α-helix	trans	-63.1	-39.9	172.2	-48.3	0	0	0	0	110.9	G612 Y622 A629	G612-S625 PolarHBondContact O-OG 2.98Å; Y622-S625 WeakPolarHBondContact O-CA 3.41Å; Y622-S625 VanDerWaalsContact O-CB 3.31Å; Y622-S625 WeakPolarHBondContact O-CB 3.39Å; Y622-S625 PolarHBondContact O-N 2.7Å; S625-A629 VanDerWaalsContact O-CB 3.26Å; S625-A629 WeakPolarHBondContact O-CB 3.5Å; S625-A629 PolarHBondContact O-N 3.39Å
626	F	96.4	Very high	95	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-66.3	-41.9	173.6	-79.5	-87.7	0	0	0	112.9	P485 L489 Y492 T547 C550 Y562 Y622 K623 F624 V628 A629 G630	P485-F626 HydrophobicContact CB-CE1 4.05Å; P485-F626 HydrophobicContact CG-CD1 4.47Å; P485-F626 HydrophobicContact CG-CE1 4.03Å; L489-F626 HydrophobicContact CB-CZ 3.98Å; L489-F626 HydrophobicContact CD1-CE1 4.33Å; L489-F626 HydrophobicContact CD1-CZ 4Å; Y492-F626 HydrophobicContact CD1-CD2 4.05Å; Y492-F626 AromaticContact CD1-CE2 3.73Å; Y492-F626 HydrophobicContact CD1-CE2 3.73Å; Y492-F626 HydrophobicContact CD1-CZ 4.35Å; Y492-F626 HydrophobicContact CE1-CD2 4.49Å; Y492-F626 HydrophobicContact CG-CE2 4.14Å; T547-F626 HydrophobicContact CG2-CD1 4.21Å; C550-F626 HydrophobicContact CB-CB 4.26Å; C550-F626 HydrophobicContact CB-CD1 4.03Å; C550-F626 HydrophobicContact CB-CG 4.3Å; Y562-F626 HydrophobicContact CE1-CE1 4.06Å; Y622-F626 WeakPolarHBondContact O-CD2 3.29Å; Y622-F626 PolarHBondContact O-N 3.34Å; K623-F626 PolarHBondContact O-N 3.42Å; F624-F626 VanDerWaalsContact C-N 3.31Å; F624-F626 PolarHBondContact O-N 3.37Å; F626-V628 PolarHBondContact O-N 3Å; F626-A629 PolarHBondContact O-N 3.45Å; F626-G630 PolarHBondContact O-N 3.22Å
627	L	96.8	Very high	95.3	Very high	63 Å²	63	39.7 Å²	39.7	33%	0.33	24%	0.241	S	C	.	.	H	α-helix	trans	-58	-50.2	176.1	177.6	61.7	0	0	0	111.7	M551 K623 F624 G630 A631	M551-L627 HydrophobicContact SD-CB 4.28Å; M551-L627 HydrophobicContact SD-CD1 3.88Å; M551-L627 HydrophobicContact SD-CD2 3.93Å; M551-L627 HydrophobicContact SD-CG 4.24Å; K623-L627 PolarHBondContact O-N 2.93Å; K623-L627 VanDerWaalsContact O-N 3.1Å; F624-L627 PolarHBondContact O-N 3.41Å; L627-G630 PolarHBondContact O-N 3.42Å; L627-A631 WeakPolarHBondContact O-CB 3.3Å; L627-A631 PolarHBondContact O-N 3.45Å
628	V	95.8	Very high	95.6	Very high	62 Å²	62	40.5 Å²	40.5	38%	0.376	25%	0.245	S	C	.	.	H	α-helix	trans	-63.3	-45.6	179.2	174	0	0	0	0	110.8	F624 F626 G630 A631 L632	F624-V628 WeakPolarHBondContact O-CG2 3.34Å; F624-V628 PolarHBondContact O-N 3.44Å; F626-V628 PolarHBondContact O-N 3Å; V628-G630 PolarHBondContact O-N 3.3Å; V628-A631 PolarHBondContact O-N 3.12Å; V628-L632 HydrophobicContact CG1-CD1 4.01Å; V628-L632 WeakPolarHBondContact O-CG 3.3Å; V628-L632 PolarHBondContact O-N 3.19Å; V628-L632 VanDerWaalsContact O-N 3.11Å
629	A	96.3	Very high	95.8	Very high	3 Å²	3	37.9 Å²	37.9	3%	0.025	22%	0.223	C	C	.	.	H	α-helix	trans	-59.9	-44.9	177.8	0	0	0	0	0	112.5	V484 T547 S625 F626 L632 I633	V484-A629 HydrophobicContact CB-CB 3.67Å; V484-A629 HydrophobicContact CG1-CB 3.82Å; V484-A629 HydrophobicContact CG2-CB 3.88Å; T547-A629 HydrophobicContact CG2-CB 4.33Å; S625-A629 VanDerWaalsContact O-CB 3.26Å; S625-A629 WeakPolarHBondContact O-CB 3.5Å; S625-A629 PolarHBondContact O-N 3.39Å; F626-A629 PolarHBondContact O-N 3.45Å; A629-L632 PolarHBondContact O-N 3.44Å; A629-I633 WeakPolarHBondContact O-CG1 3.4Å; A629-I633 PolarHBondContact O-N 2.88Å
630	G	97.8	Very high	96	Very high	0 Å²	0	35 Å²	35	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.2	-40.8	179	0	0	0	0	0	112.9	G544 S548 F626 L627 V628 L632 I633 F634	G544-G630 CarbonylContact C-O 3.4Å; G544-G630 VanDerWaalsContact CA-O 3.27Å; G544-G630 WeakPolarHBondContact CA-O 3.28Å; G544-G630 CarbonylContact O-C 3.24Å; G544-G630 VanDerWaalsContact O-CA 3.29Å; G544-G630 WeakPolarHBondContact O-CA 3.5Å; S548-G630 VanDerWaalsContact OG-CA 3.27Å; S548-G630 WeakPolarHBondContact OG-CA 3.38Å; F626-G630 PolarHBondContact O-N 3.22Å; L627-G630 PolarHBondContact O-N 3.42Å; V628-G630 PolarHBondContact O-N 3.3Å; G630-L632 VanDerWaalsContact C-N 3.31Å; G630-L632 PolarHBondContact O-N 3.07Å; G630-I633 PolarHBondContact O-N 3.33Å; G630-F634 WeakPolarHBondContact O-CB 3.44Å; G630-F634 PolarHBondContact O-N 3.23Å
631	A	97.5	Very high	96.2	Very high	53 Å²	53	38.6 Å²	38.6	44%	0.438	20%	0.202	S	C	.	.	H	α-helix	trans	-61.1	-40.2	175.6	0	0	0	0	0	111.9	S548 L627 V628 F634 A635	S548-A631 PolarHBondContact OG-N 3.47Å; L627-A631 WeakPolarHBondContact O-CB 3.3Å; L627-A631 PolarHBondContact O-N 3.45Å; V628-A631 PolarHBondContact O-N 3.12Å; A631-F634 PolarHBondContact O-N 3.43Å; A631-A635 WeakPolarHBondContact O-CB 3.42Å; A631-A635 PolarHBondContact O-N 2.88Å
632	L	97.1	Very high	96.4	Very high	47 Å²	47	39.2 Å²	39.2	25%	0.246	20%	0.201	C	C	.	.	H	α-helix	trans	-66.4	-45.5	176.3	-70.8	166.1	0	0	0	112.2	V477 L480 V628 A629 G630 F634 A635 S636	V477-L632 HydrophobicContact CG1-CB 4.47Å; V477-L632 HydrophobicContact CG1-CD2 4Å; V477-L632 WeakPolarHBondContact CG1-O 3.24Å; L480-L632 HydrophobicContact CB-CD1 3.81Å; L480-L632 HydrophobicContact CD1-CD2 4.5Å; V628-L632 HydrophobicContact CG1-CD1 4.01Å; V628-L632 WeakPolarHBondContact O-CG 3.3Å; V628-L632 PolarHBondContact O-N 3.19Å; V628-L632 VanDerWaalsContact O-N 3.11Å; A629-L632 PolarHBondContact O-N 3.44Å; G630-L632 VanDerWaalsContact C-N 3.31Å; G630-L632 PolarHBondContact O-N 3.07Å; L632-F634 VanDerWaalsContact C-N 3.31Å; L632-F634 PolarHBondContact O-N 3.05Å; L632-A635 PolarHBondContact O-N 2.84Å; L632-S636 PolarHBondContact O-N 2.88Å
633	I	98	Very high	96.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-41.5	175.8	-66.3	167.3	0	0	0	110.6	L540 C543 T547 A629 G630 S636 G637	L540-I633 HydrophobicContact CD2-CG2 3.88Å; C543-I633 HydrophobicContact CB-CG2 4.35Å; T547-I633 HydrophobicContact CG2-CD1 4.49Å; A629-I633 WeakPolarHBondContact O-CG1 3.4Å; A629-I633 PolarHBondContact O-N 2.88Å; G630-I633 PolarHBondContact O-N 3.33Å; I633-S636 VanDerWaalsContact O-CB 3.3Å; I633-S636 WeakPolarHBondContact O-CB 3.5Å; I633-S636 PolarHBondContact O-N 3.09Å; I633-G637 PolarHBondContact O-N 2.89Å; I633-G637 VanDerWaalsContact O-N 3.15Å
634	F	98.3	Very high	96.5	Very high	76 Å²	76	36.3 Å²	36.3	33%	0.333	19%	0.193	S	C	.	.	H	α-helix	trans	-63.7	-46	177.5	-168.5	-90.8	0	0	0	111.7	L541 A545 G630 A631 L632 S636 G637 L638	L541-F634 HydrophobicContact CB-CD2 4.44Å; L541-F634 HydrophobicContact CB-CE2 4.11Å; L541-F634 HydrophobicContact CD2-CD1 4.36Å; L541-F634 HydrophobicContact CD2-CD2 4.1Å; L541-F634 HydrophobicContact CD2-CE1 4.14Å; L541-F634 HydrophobicContact CD2-CE2 3.85Å; L541-F634 HydrophobicContact CD2-CG 4.34Å; L541-F634 HydrophobicContact CD2-CZ 3.87Å; L541-F634 WeakPolarHBondContact O-CD2 3.42Å; L541-F634 WeakPolarHBondContact O-CE2 3.45Å; A545-F634 HydrophobicContact CB-CD2 4.14Å; A545-F634 HydrophobicContact CB-CE2 4.23Å; G630-F634 WeakPolarHBondContact O-CB 3.44Å; G630-F634 PolarHBondContact O-N 3.23Å; A631-F634 PolarHBondContact O-N 3.43Å; L632-F634 VanDerWaalsContact C-N 3.31Å; L632-F634 PolarHBondContact O-N 3.05Å; F634-S636 VanDerWaalsContact C-N 3.27Å; F634-S636 PolarHBondContact O-N 2.72Å; F634-G637 PolarHBondContact O-N 2.8Å; F634-G637 VanDerWaalsContact O-N 3.09Å; F634-L638 HydrophobicContact CD1-CD1 3.98Å; F634-L638 HydrophobicContact CD1-CG 4.23Å; F634-L638 HydrophobicContact CE1-CD1 3.84Å; F634-L638 HydrophobicContact CE1-CD2 4.3Å; F634-L638 HydrophobicContact CE1-CG 4.06Å; F634-L638 PolarHBondContact O-N 2.88Å; F634-L638 VanDerWaalsContact O-N 3.11Å
635	A	97.9	Very high	96.4	Very high	33 Å²	33	35.8 Å²	35.8	27%	0.273	19%	0.194	S	C	.	.	H	α-helix	trans	-59.6	-38.5	175.2	0	0	0	0	0	111.8	V477 A631 L632 G637 L638 I639	V477-A635 HydrophobicContact CG1-CB 4.03Å; A631-A635 WeakPolarHBondContact O-CB 3.42Å; A631-A635 PolarHBondContact O-N 2.88Å; L632-A635 PolarHBondContact O-N 2.84Å; A635-G637 VanDerWaalsContact C-N 3.33Å; A635-G637 PolarHBondContact O-N 2.96Å; A635-L638 WeakPolarHBondContact O-CB 3.38Å; A635-L638 PolarHBondContact O-N 3.2Å; A635-I639 VanDerWaalsContact O-CG1 3.26Å; A635-I639 WeakPolarHBondContact O-CG1 3.19Å; A635-I639 PolarHBondContact O-N 2.94Å
636	S	97.5	Very high	96.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-57.8	-44.4	172.7	-175	0	0	0	0	112.3	A474 G478 L632 I633 F634 L638 I639 H640	A474-S636 WeakPolarHBondContact O-CB 3.26Å; A474-S636 PolarHBondContact O-OG 3.46Å; G478-S636 VanDerWaalsContact CA-CB 3.45Å; L632-S636 PolarHBondContact O-N 2.88Å; I633-S636 VanDerWaalsContact O-CB 3.3Å; I633-S636 WeakPolarHBondContact O-CB 3.5Å; I633-S636 PolarHBondContact O-N 3.09Å; F634-S636 VanDerWaalsContact C-N 3.27Å; F634-S636 PolarHBondContact O-N 2.72Å; S636-L638 VanDerWaalsContact C-N 3.34Å; S636-L638 PolarHBondContact O-N 3.41Å; S636-I639 PolarHBondContact O-N 2.92Å; S636-H640 PolarHBondContact O-N 3.39Å; S636-H640 PolarHBondContact O-ND1 2.92Å; S636-H640 PolarHBondContact OG-CE1 3.47Å
637	G	97	Very high	96	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.1	-41.5	175.5	0	0	0	0	0	112.8	I633 F634 A635 H640 Y641	I633-G637 PolarHBondContact O-N 2.89Å; I633-G637 VanDerWaalsContact O-N 3.15Å; F634-G637 PolarHBondContact O-N 2.8Å; F634-G637 VanDerWaalsContact O-N 3.09Å; A635-G637 VanDerWaalsContact C-N 3.33Å; A635-G637 PolarHBondContact O-N 2.96Å; G637-H640 PolarHBondContact O-N 3.37Å; G637-Y641 PolarHBondContact O-N 3.32Å
638	L	97.7	Very high	95.7	Very high	94 Å²	94	44.3 Å²	44.3	49%	0.492	23%	0.225	S	C	.	.	H	α-helix	trans	-63.5	-43.3	175.6	-67.3	176.7	0	0	0	112.2	L541 F634 A635 S636 Y641	L541-L638 HydrophobicContact CD2-CD2 3.84Å; L541-L638 HydrophobicContact CD2-CG 3.95Å; F634-L638 HydrophobicContact CD1-CD1 3.98Å; F634-L638 HydrophobicContact CD1-CG 4.23Å; F634-L638 HydrophobicContact CE1-CD1 3.84Å; F634-L638 HydrophobicContact CE1-CD2 4.3Å; F634-L638 HydrophobicContact CE1-CG 4.06Å; F634-L638 PolarHBondContact O-N 2.88Å; F634-L638 VanDerWaalsContact O-N 3.11Å; A635-L638 WeakPolarHBondContact O-CB 3.38Å; A635-L638 PolarHBondContact O-N 3.2Å; S636-L638 VanDerWaalsContact C-N 3.34Å; S636-L638 PolarHBondContact O-N 3.41Å; L638-Y641 VanDerWaalsContact O-CB 3.29Å; L638-Y641 WeakPolarHBondContact O-CB 3.22Å; L638-Y641 PolarHBondContact O-N 2.86Å; L638-Y641 VanDerWaalsContact O-N 3.17Å
639	I	97.4	Very high	95.5	Very high	40 Å²	40	43.5 Å²	43.5	21%	0.205	22%	0.218	C	C	.	.	H	α-helix	trans	-65.8	-40.2	179.5	-62.4	163.4	0	0	0	110.7	I470 V473 A474 V477 A635 S636 Y641 L642	I470-I639 HydrophobicContact CG2-CG2 4.09Å; I470-I639 WeakPolarHBondContact CG2-O 3.34Å; V473-I639 HydrophobicContact CG1-CG2 4.43Å; A474-I639 HydrophobicContact CB-CB 3.86Å; A474-I639 HydrophobicContact CB-CG2 3.63Å; V477-I639 HydrophobicContact CB-CD1 4.31Å; V477-I639 HydrophobicContact CG2-CD1 3.95Å; A635-I639 VanDerWaalsContact O-CG1 3.26Å; A635-I639 WeakPolarHBondContact O-CG1 3.19Å; A635-I639 PolarHBondContact O-N 2.94Å; S636-I639 PolarHBondContact O-N 2.92Å; I639-Y641 PolarHBondContact O-N 3.25Å; I639-L642 HydrophobicContact CG2-CD1 4.2Å; I639-L642 WeakPolarHBondContact O-CB 3.47Å; I639-L642 VanDerWaalsContact O-CG 3.25Å; I639-L642 WeakPolarHBondContact O-CG 3.18Å; I639-L642 PolarHBondContact O-N 3.08Å
640	H	96.4	Very high	95	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.009	23%	0.229	C	C	.	.	H	α-helix	trans	-61.6	-27.9	175.5	-75.8	90.2	0	0	0	112.8	A474 N475 N537 S636 G637 L642 I643 P644	A474-H640 WeakPolarHBondContact CB-CE1 3.3Å; A474-H640 VanDerWaalsContact CB-ND1 3.25Å; A474-H640 WeakPolarHBondContact CB-ND1 3.27Å; N475-H640 PolarHBondContact ND2-NE2 3.13Å; N537-H640 PolarHBondContact ND2-O 3.04Å; N537-H640 WeakPolarHBondContact OD1-CB 3.28Å; S636-H640 PolarHBondContact O-N 3.39Å; S636-H640 PolarHBondContact O-ND1 2.92Å; S636-H640 PolarHBondContact OG-CE1 3.47Å; G637-H640 PolarHBondContact O-N 3.37Å; H640-L642 PolarHBondContact O-N 3.06Å; H640-I643 PolarHBondContact O-N 2.86Å; H640-I643 VanDerWaalsContact O-N 3.13Å; H640-P644 WeakPolarHBondContact O-CD 3.4Å
641	Y	95.3	Very high	94.5	Very high	133 Å²	133	50.1 Å²	50.1	52%	0.522	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-14	176.7	-138.7	-82.5	0	0	0	113.3	N537 G637 L638 I639 I643 P644 L645	N537-Y641 HydrophobicContact CB-CD2 4.25Å; G637-Y641 PolarHBondContact O-N 3.32Å; L638-Y641 VanDerWaalsContact O-CB 3.29Å; L638-Y641 WeakPolarHBondContact O-CB 3.22Å; L638-Y641 PolarHBondContact O-N 2.86Å; L638-Y641 VanDerWaalsContact O-N 3.17Å; I639-Y641 PolarHBondContact O-N 3.25Å; Y641-I643 PolarHBondContact O-N 3.1Å; Y641-P644 WeakPolarHBondContact O-CD 3.33Å; Y641-L645 PolarHBondContact O-N 2.9Å
642	L	95.2	Very high	94.1	Very high	39 Å²	39	53.6 Å²	53.6	20%	0.204	27%	0.27	C	S	.	.	H	α-helix	trans	-68.8	-22.1	172.9	-57.3	175.6	0	0	0	112.7	V311 I470 I639 H640 L645 Y646	V311-L642 HydrophobicContact CB-CD2 4.43Å; V311-L642 HydrophobicContact CG1-CD1 3.72Å; V311-L642 HydrophobicContact CG1-CD2 3.59Å; V311-L642 HydrophobicContact CG1-CG 4.31Å; V311-L642 HydrophobicContact CG2-CD1 4.33Å; V311-L642 HydrophobicContact CG2-CD2 3.9Å; I470-L642 HydrophobicContact CD1-CB 4.24Å; I470-L642 HydrophobicContact CG2-CB 4.14Å; I639-L642 HydrophobicContact CG2-CD1 4.2Å; I639-L642 WeakPolarHBondContact O-CB 3.47Å; I639-L642 VanDerWaalsContact O-CG 3.25Å; I639-L642 WeakPolarHBondContact O-CG 3.18Å; I639-L642 PolarHBondContact O-N 3.08Å; H640-L642 PolarHBondContact O-N 3.06Å; L642-L645 HydrophobicContact CD2-CD2 4.25Å; L642-Y646 WeakPolarHBondContact O-CB 3.4Å; L642-Y646 PolarHBondContact O-N 2.7Å
643	I	94.9	Very high	93.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-70.2	-53.4	179.3	-60	165.4	0	0	0	111	I470 L471 L533 H640 Y641 L645 Y646 H647	I470-I643 HydrophobicContact CB-CD1 4.33Å; I470-I643 HydrophobicContact CB-CG1 3.86Å; I470-I643 HydrophobicContact CD1-CG1 4.24Å; I470-I643 HydrophobicContact CG2-CD1 4.03Å; I470-I643 HydrophobicContact CG2-CG1 3.57Å; L471-I643 HydrophobicContact CD2-CD1 3.48Å; L471-I643 VanDerWaalsContact CD2-CD1 3.48Å; L471-I643 HydrophobicContact CG-CD1 3.55Å; L533-I643 HydrophobicContact CD1-CD1 4.2Å; L533-I643 HydrophobicContact CD2-CB 3.98Å; L533-I643 HydrophobicContact CD2-CG2 3.65Å; H640-I643 PolarHBondContact O-N 2.86Å; H640-I643 VanDerWaalsContact O-N 3.13Å; Y641-I643 PolarHBondContact O-N 3.1Å; I643-L645 VanDerWaalsContact C-N 3.26Å; I643-L645 PolarHBondContact O-N 2.81Å; I643-Y646 WeakPolarHBondContact O-CB 3.42Å; I643-Y646 PolarHBondContact O-N 3.45Å; I643-Y646 VanDerWaalsContact O-N 3.16Å; I643-H647 PolarHBondContact O-N 3.09Å
644	P	94.4	Very high	92.7	Very high	42 Å²	42	58.8 Å²	58.8	27%	0.273	31%	0.309	S	S	.	.	H	α-helix	trans	-58	-37.9	172.1	-24.6	33.9	0	0	0	113.1	L533 H640 Y641 H647 W648	L533-P644 HydrophobicContact CD2-CG 3.99Å; H640-P644 WeakPolarHBondContact O-CD 3.4Å; Y641-P644 WeakPolarHBondContact O-CD 3.33Å; P644-H647 PolarHBondContact O-N 3.42Å; P644-W648 WeakPolarHBondContact O-CB 3.26Å; P644-W648 PolarHBondContact O-N 3.46Å
645	L	91.8	Very high	91.6	Very high	64 Å²	64	57 Å²	57	34%	0.335	30%	0.303	S	S	.	.	H	α-helix	trans	-62.3	-44.8	176	178.9	61.9	0	0	0	111.5	Y641 L642 I643 H647 W648 L649	Y641-L645 PolarHBondContact O-N 2.9Å; L642-L645 HydrophobicContact CD2-CD2 4.25Å; I643-L645 VanDerWaalsContact C-N 3.26Å; I643-L645 PolarHBondContact O-N 2.81Å; L645-H647 PolarHBondContact O-N 2.75Å; L645-W648 HydrophobicContact CD1-CE3 4.27Å; L645-W648 PolarHBondContact O-N 3.09Å; L645-L649 HydrophobicContact CD1-CD1 4.43Å; L645-L649 HydrophobicContact CD1-CG 4.36Å; L645-L649 HydrophobicContact CG-CD1 4.21Å; L645-L649 WeakPolarHBondContact O-CG 3.3Å; L645-L649 PolarHBondContact O-N 3.36Å
646	Y	91.8	Very high	89.9	Confident	29 Å²	29	63.3 Å²	63.3	11%	0.114	32%	0.324	C	S	.	.	H	α-helix	trans	-59.1	-45.9	174.9	166.9	-106.6	0	0	0	111.3	P466 L642 I643 W648 L649 R650 L655	P466-Y646 HydrophobicContact CB-CE1 4.27Å; P466-Y646 HydrophobicContact CB-CE2 4.24Å; P466-Y646 HydrophobicContact CG-CD1 4.44Å; P466-Y646 HydrophobicContact CG-CE1 3.62Å; P466-Y646 HydrophobicContact CG-CE2 3.92Å; P466-Y646 VanDerWaalsContact CG-OH 3.24Å; P466-Y646 WeakPolarHBondContact CG-OH 3.44Å; L642-Y646 WeakPolarHBondContact O-CB 3.4Å; L642-Y646 PolarHBondContact O-N 2.7Å; I643-Y646 WeakPolarHBondContact O-CB 3.42Å; I643-Y646 PolarHBondContact O-N 3.45Å; I643-Y646 VanDerWaalsContact O-N 3.16Å; Y646-W648 VanDerWaalsContact C-N 3.33Å; Y646-W648 PolarHBondContact O-N 3.28Å; Y646-L649 PolarHBondContact O-N 3.48Å; Y646-R650 WeakPolarHBondContact O-CB 3.35Å; Y646-R650 PolarHBondContact O-N 3.37Å; Y646-L655 HydrophobicContact CD2-CD1 3.46Å; Y646-L655 VanDerWaalsContact CD2-CD1 3.46Å; Y646-L655 HydrophobicContact CE2-CD1 3.69Å
647	H	91.2	Very high	88	Confident	78 Å²	78	65.9 Å²	65.9	36%	0.361	34%	0.338	S	S	.	.	H	α-helix	trans	-61.2	-40.6	176	-68.7	173	0	0	0	112.5	S467 E584 I643 P644 L645 R650 G651	S467-H647 PolarHBondContact OG-NE2 3.41Å; E584-H647 IonicContact OE1-CE1 3.38Å; E584-H647 PolarHBondContact OE1-CE1 2.72Å; E584-H647 IonicContact OE2-CE1 3.23Å; E584-H647 PolarHBondContact OE2-CE1 3.19Å; E584-H647 VanDerWaalsContact OE2-CE1 3.23Å; E584-H647 IonicContact OE2-NE2 3.48Å; E584-H647 PolarHBondContact OE2-NE2 3.25Å; I643-H647 PolarHBondContact O-N 3.09Å; P644-H647 PolarHBondContact O-N 3.42Å; L645-H647 PolarHBondContact O-N 2.75Å; H647-R650 PolarHBondContact O-N 3.26Å; H647-G651 PolarHBondContact O-N 3.42Å
648	W	90	Very high	85.8	Confident	136 Å²	136	68 Å²	68	52%	0.515	35%	0.353	S	S	.	.	H	α-helix	trans	-65.6	-44.9	176.7	-179.8	87.6	0	0	0	112.7	P644 L645 Y646 R650 G651 K652	P644-W648 WeakPolarHBondContact O-CB 3.26Å; P644-W648 PolarHBondContact O-N 3.46Å; L645-W648 HydrophobicContact CD1-CE3 4.27Å; L645-W648 PolarHBondContact O-N 3.09Å; Y646-W648 VanDerWaalsContact C-N 3.33Å; Y646-W648 PolarHBondContact O-N 3.28Å; W648-R650 VanDerWaalsContact C-N 3.33Å; W648-R650 PolarHBondContact O-N 2.92Å; W648-G651 PolarHBondContact O-N 3.11Å; W648-K652 HydrophobicContact CD2-CD 4.32Å; W648-K652 VanDerWaalsContact CE2-CE 3.48Å; W648-K652 HydrophobicContact CE3-CD 4.46Å; W648-K652 HydrophobicContact CH2-CD 3.93Å; W648-K652 HydrophobicContact CZ2-CD 3.77Å; W648-K652 HydrophobicContact CZ3-CD 4.26Å; W648-K652 PolarHBondContact O-N 3.18Å
649	L	91.3	Very high	83.4	Confident	44 Å²	44	73.4 Å²	73.4	23%	0.23	37%	0.366	C	S	.	.	H	α-helix	trans	-63	-40.3	176.9	-71.4	173.5	0	0	0	111.8	L645 Y646 K652 G653 I654 L655	L645-L649 HydrophobicContact CD1-CD1 4.43Å; L645-L649 HydrophobicContact CD1-CG 4.36Å; L645-L649 HydrophobicContact CG-CD1 4.21Å; L645-L649 WeakPolarHBondContact O-CG 3.3Å; L645-L649 PolarHBondContact O-N 3.36Å; Y646-L649 PolarHBondContact O-N 3.48Å; L649-K652 PolarHBondContact O-N 3.05Å; L649-G653 PolarHBondContact O-N 3.46Å; L649-I654 HydrophobicContact CD2-CB 4.49Å; L649-I654 HydrophobicContact CD2-CD1 3.78Å; L649-I654 HydrophobicContact CD2-CG2 4.43Å; L649-I654 PolarHBondContact O-N 3.2Å; L649-I654 VanDerWaalsContact O-N 3.11Å; L649-L655 HydrophobicContact CB-CD1 3.68Å; L649-L655 HydrophobicContact CB-CG 4.03Å; L649-L655 HydrophobicContact CD1-CD1 4.26Å
650	R	87.3	Confident	80.4	Confident	71 Å²	71	78.7 Å²	78.7	27%	0.268	39%	0.391	S	S	.	.	H	α-helix	trans	-65.3	-43.4	174.4	-168.1	-178.6	-174.7	-168.7	4.6	111.4	Y646 H647 W648 K652 G653 D657	Y646-R650 WeakPolarHBondContact O-CB 3.35Å; Y646-R650 PolarHBondContact O-N 3.37Å; H647-R650 PolarHBondContact O-N 3.26Å; W648-R650 VanDerWaalsContact C-N 3.33Å; W648-R650 PolarHBondContact O-N 2.92Å; R650-K652 PolarHBondContact O-N 2.95Å; R650-G653 PolarHBondContact O-N 3.46Å; R650-D657 IonicContact NH2-OD2 2.88Å; R650-D657 PolarHBondContact NH2-OD2 3.28Å
651	G	87.5	Confident	77.4	Confident	72 Å²	72	85.7 Å²	85.7	74%	0.742	43%	0.433	S	S	*	.	H	α-helix	trans	-61.2	-28.4	176.1	0	0	0	0	0	113.5	H647 W648 G653	H647-G651 PolarHBondContact O-N 3.42Å; W648-G651 PolarHBondContact O-N 3.11Å; G651-G653 VanDerWaalsContact C-N 3.32Å
652	K	88.2	Confident	76.5	Confident	126 Å²	126	83.4 Å²	83.4	55%	0.548	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-1	172.5	-73.4	-164.8	169.1	-171.2	0	114.7	W648 L649 R650 I654	W648-K652 HydrophobicContact CD2-CD 4.32Å; W648-K652 VanDerWaalsContact CE2-CE 3.48Å; W648-K652 HydrophobicContact CE3-CD 4.46Å; W648-K652 HydrophobicContact CH2-CD 3.93Å; W648-K652 HydrophobicContact CZ2-CD 3.77Å; W648-K652 HydrophobicContact CZ3-CD 4.26Å; W648-K652 PolarHBondContact O-N 3.18Å; L649-K652 PolarHBondContact O-N 3.05Å; R650-K652 PolarHBondContact O-N 2.95Å; K652-I654 HydrophobicContact CB-CD1 3.93Å; K652-I654 HydrophobicContact CB-CG1 4.01Å; K652-I654 HydrophobicContact CD-CD1 4.29Å; K652-I654 PolarHBondContact O-N 3.48Å
653	G	83.8	Confident	75.5	Confident	52 Å²	52	85.7 Å²	85.7	54%	0.536	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	13	-177	0	0	0	0	0	114.5	L649 R650 G651	L649-G653 PolarHBondContact O-N 3.46Å; R650-G653 PolarHBondContact O-N 3.46Å; G651-G653 VanDerWaalsContact C-N 3.32Å
654	I	81.5	Confident	74.4	Confident	104 Å²	104	90.4 Å²	90.4	53%	0.533	47%	0.465	S	S	.	.	S	Bend	trans	-71.5	-37.9	178.2	-63.7	168.8	0	0	0	109.9	L649 K652	L649-I654 HydrophobicContact CD2-CB 4.49Å; L649-I654 HydrophobicContact CD2-CD1 3.78Å; L649-I654 HydrophobicContact CD2-CG2 4.43Å; L649-I654 PolarHBondContact O-N 3.2Å; L649-I654 VanDerWaalsContact O-N 3.11Å; K652-I654 HydrophobicContact CB-CD1 3.93Å; K652-I654 HydrophobicContact CB-CG1 4.01Å; K652-I654 HydrophobicContact CD-CD1 4.29Å; K652-I654 PolarHBondContact O-N 3.48Å
655	L	74.7	Confident	73.3	Confident	39 Å²	39	93.3 Å²	93.3	20%	0.204	48%	0.476	C	S	.	.	S	Bend	trans	-95.9	112.5	172.4	-63.5	171.7	0	0	0	108.2	I307 Y646 L649	I307-L655 HydrophobicContact CG1-CD2 4.45Å; Y646-L655 HydrophobicContact CD2-CD1 3.46Å; Y646-L655 VanDerWaalsContact CD2-CD1 3.46Å; Y646-L655 HydrophobicContact CE2-CD1 3.69Å; L649-L655 HydrophobicContact CB-CD1 3.68Å; L649-L655 HydrophobicContact CB-CG 4.03Å; L649-L655 HydrophobicContact CD1-CD1 4.26Å
656	K	63.5	Low	72.1	Confident	164 Å²	164	95.1 Å²	95.1	71%	0.713	49%	0.485	S	S	*	.			trans	-74.8	147.8	170.3	-78.1	-175.1	175.9	-177.7	0	109.7	S658	K656-S658 PolarHBondContact O-N 2.87Å
657	D	56.5	Low	70.8	Confident	55 Å²	55	99.5 Å²	99.5	29%	0.294	51%	0.51	S	S	.	.			trans	-62.6	125.2	174.8	-145.3	-46	0	0	0	108.5	R650 R659 Q660	R650-D657 IonicContact NH2-OD2 2.88Å; R650-D657 PolarHBondContact NH2-OD2 3.28Å; D657-R659 PolarHBondContact O-N 2.92Å; D657-R659 PolarHBondContact OD1-N 3.42Å; D657-Q660 HydrophobicContact CB-CB 4.32Å; D657-Q660 HydrophobicContact CB-CG 4.12Å; D657-Q660 PolarHBondContact O-N 2.84Å
658	S	52.2	Low	69.3	Low	44 Å²	44	101.1 Å²	101.1	31%	0.308	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-8.4	172.6	-44.2	0	0	0	0	112.2	D303 K656	D303-S658 WeakPolarHBondContact OD2-CB 3.5Å; D303-S658 PolarHBondContact OD2-OG 3.19Å; K656-S658 PolarHBondContact O-N 2.87Å
659	R	45.6	Very low	67.7	Low	207 Å²	207	98.4 Å²	98.4	78%	0.781	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-10.3	170.3	-64.1	-174.2	-170.3	178.7	4.9	114.8	D657	D657-R659 PolarHBondContact O-N 2.92Å; D657-R659 PolarHBondContact OD1-N 3.42Å
660	Q	35.3	Very low	65.8	Low	152 Å²	152	102.9 Å²	102.9	71%	0.71	55%	0.545	S	S	*	.			trans	-93.6	1.5	174.8	-77.7	-166.3	-11.6	0	0	113.2	D657	D657-Q660 HydrophobicContact CB-CB 4.32Å; D657-Q660 HydrophobicContact CB-CG 4.12Å; D657-Q660 PolarHBondContact O-N 2.84Å
661	V	33	Very low	63.8	Low	149 Å²	149	105.8 Å²	105.8	90%	0.903	57%	0.57	S	S	*	*			trans	-110.5	0	168.1	-172.8	0	0	0	0	107.3

Retrieved 661 of 661 residues in 457.6 ms (Link to these results)

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