A0A087YLC0_POEFO Loading...

N-alpha-acetyltransferase 35, NatC auxiliary subunit

AlphaFold DB , UniProt , Accession A0A087YLC0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 743 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	23.1	Very low	27.8	Very low	225 Å²	225	141.3 Å²	141.3	100%	1.108	72%	0.722	S	S	*	*				0	92.4	0	-164.1	-171.6	-65	0	0	105.5
2	F	23.7	Very low	27.9	Very low	198 Å²	198	145.5 Å²	145.5	87%	0.868	73%	0.732	S	S	*	*			trans	-126.9	122	178.3	-78.1	-79.3	0	0	0	106.6
3	Q	23.4	Very low	28.2	Very low	90 Å²	90	146 Å²	146	42%	0.421	74%	0.738	S	S	.	*			trans	-119.1	145.8	171.2	-83.3	-162.8	11.7	0	0	109.7	M41	Q3-M41 HydrophobicContact CB-CE 3.91Å; Q3-M41 HydrophobicContact CG-CE 3.81Å; Q3-M41 PolarHBondContact NE2-SD 3.11Å; Q3-M41 PolarHBondContact OE1-SD 3.31Å
4	S	25.3	Very low	28.6	Very low	111 Å²	111	142.2 Å²	142.2	78%	0.776	71%	0.714	S	S	*	*			trans	-60.9	143.3	-167.5	51.6	0	0	0	0	115.1
5	I	30.1	Very low	28.9	Very low	91 Å²	91	143.3 Å²	143.3	47%	0.467	72%	0.722	S	S	.	*			trans	-123.5	133.9	161.1	-65.8	162.8	0	0	0	108.3	M83	I5-M83 HydrophobicContact CB-CE 3.92Å
6	Q	25.8	Very low	29.4	Very low	171 Å²	171	139.4 Å²	139.4	80%	0.799	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-87.4	116.5	178.1	-154.2	176.9	-0.4	0	0	108.8	M84	Q6-M84 HydrophobicContact CB-CE 4.36Å; Q6-M84 HydrophobicContact CG-CE 3.92Å
7	C	29.8	Very low	29.7	Very low	92 Å²	92	134.9 Å²	134.9	62%	0.622	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-96.5	123.8	175.9	-154.4	0	0	0	0	110.5
8	S	28.7	Very low	30.1	Very low	84 Å²	84	132.2 Å²	132.2	59%	0.587	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-77.5	138.9	176.5	175.5	0	0	0	0	111	E10	S8-E10 PolarHBondContact O-N 3.13Å
9	K	28.3	Very low	30.2	Very low	202 Å²	202	131 Å²	131	88%	0.878	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	6	-172.3	-88.1	177.6	174.2	174.9	0	117
10	E	30.9	Very low	30.1	Very low	176 Å²	176	130.2 Å²	130.2	82%	0.822	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-2.9	-167	-88.2	-175.9	155.2	0	0	117.2	S8	S8-E10 PolarHBondContact O-N 3.13Å
11	L	36.5	Very low	30	Very low	114 Å²	114	130 Å²	130	60%	0.597	67%	0.672	S	S	*	*			trans	-111.7	65.7	-176.9	-87.9	138.2	0	0	0	112.6	N13 K14	L11-N13 PolarHBondContact O-N 3.42Å; L11-N13 VanDerWaalsContact O-N 3.15Å; L11-K14 HydrophobicContact CD2-CB 4.42Å
12	K	29.5	Very low	30.7	Very low	192 Å²	192	125.5 Å²	125.5	84%	0.835	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-5.9	-175.8	-84.8	-175.2	174.8	-178.9	0	116.7
13	N	31.3	Very low	30.8	Very low	152 Å²	152	126 Å²	126	81%	0.813	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.7	14	-170.8	-77.1	-17.4	0	0	0	116.3	L11	L11-N13 PolarHBondContact O-N 3.42Å; L11-N13 VanDerWaalsContact O-N 3.15Å
14	K	34.3	Very low	31	Very low	93 Å²	93	127.4 Å²	127.4	40%	0.404	67%	0.671	S	S	.	*			trans	-126.5	113.1	174.5	-72.8	-168.6	173.4	-164.1	0	109.8	L11 L16 L61	L11-K14 HydrophobicContact CD2-CB 4.42Å; K14-L16 PolarHBondContact O-N 3.32Å; K14-L61 PolarHBondContact NZ-O 3.16Å
15	L	32.7	Very low	31.2	Very low	158 Å²	158	125.5 Å²	125.5	83%	0.827	66%	0.662	S	S	*	*			trans	-70.8	107	172.8	-152.1	88.8	0	0	0	107.6
16	L	37.1	Very low	31.3	Very low	82 Å²	82	126.9 Å²	126.9	43%	0.429	67%	0.674	S	S	.	*			trans	-108.5	103.1	-179.3	-117.7	134.2	0	0	0	108.4	K14 V18 F54	K14-L16 PolarHBondContact O-N 3.32Å; L16-V18 HydrophobicContact CB-CG2 4.48Å; L16-V18 HydrophobicContact CD2-CG2 3.7Å; L16-V18 PolarHBondContact O-N 2.66Å; L16-F54 HydrophobicContact CD2-CE1 3.84Å; L16-F54 HydrophobicContact CD2-CZ 4Å
17	L	35.4	Very low	31.4	Very low	63 Å²	63	127.3 Å²	127.3	33%	0.33	68%	0.676	S	S	.	*			trans	-83	102.9	168.2	-135.6	97.2	0	0	0	107.3	F72 A77 A80	L17-F72 HydrophobicContact CD2-CE1 3.79Å; L17-F72 HydrophobicContact CD2-CE2 4.35Å; L17-F72 HydrophobicContact CD2-CZ 3.44Å; L17-F72 VanDerWaalsContact CD2-CZ 3.44Å; L17-A77 HydrophobicContact CD1-CB 3.83Å; L17-A77 HydrophobicContact CD2-CB 4.26Å; L17-A80 HydrophobicContact CD1-CB 4.21Å
18	V	36	Very low	31.7	Very low	85 Å²	85	129.6 Å²	129.6	52%	0.515	68%	0.683	S	S	.	*			trans	-94.9	105.4	179.1	-177.7	0	0	0	0	109	L16	L16-V18 HydrophobicContact CB-CG2 4.48Å; L16-V18 HydrophobicContact CD2-CG2 3.7Å; L16-V18 PolarHBondContact O-N 2.66Å
19	T	31.3	Very low	31.7	Very low	110 Å²	110	133.4 Å²	133.4	68%	0.675	70%	0.697	S	S	*	*			trans	-93.1	118.9	157.3	-39.9	0	0	0	0	106.7	V21	T19-V21 PolarHBondContact O-N 3.09Å; T19-V21 VanDerWaalsContact O-N 3.07Å
20	M	29.7	Very low	31.9	Very low	115 Å²	115	130.3 Å²	130.3	57%	0.567	69%	0.689	S	S	*	*			trans	-57.5	116.3	176.6	-91.2	-176.2	77.9	0	0	109.9	M22	M20-M22 HydrophobicContact CE-CE 3.21Å; M20-M22 HydrophobicContact CE-CG 3.8Å; M20-M22 HydrophobicContact CE-SD 4.32Å; M20-M22 HydrophobicContact SD-CE 3.96Å
21	V	27.8	Very low	31.8	Very low	126 Å²	126	128 Å²	128	76%	0.764	69%	0.688	S	S	*	*			trans	-98.3	107.7	164.6	-179.8	0	0	0	0	106.8	T19	T19-V21 PolarHBondContact O-N 3.09Å; T19-V21 VanDerWaalsContact O-N 3.07Å
22	M	36.7	Very low	31.4	Very low	131 Å²	131	125.8 Å²	125.8	65%	0.645	69%	0.692	S	S	*	*			trans	-89.5	132.8	-178.8	-66.8	177	174.5	0	0	110.2	M20 W47	M20-M22 HydrophobicContact CE-CE 3.21Å; M20-M22 HydrophobicContact CE-CG 3.8Å; M20-M22 HydrophobicContact CE-SD 4.32Å; M20-M22 HydrophobicContact SD-CE 3.96Å; M22-W47 HydrophobicContact CE-CH2 4.4Å; M22-W47 HydrophobicContact CE-CZ3 4.12Å
23	K	26.7	Very low	31.3	Very low	207 Å²	207	129 Å²	129	90%	0.9	70%	0.699	S	S	*	*			trans	-123.3	128.7	170.9	-155.5	178.7	-175.3	-175.3	0	108.1
24	S	27.1	Very low	31.2	Very low	121 Å²	121	128.5 Å²	128.5	85%	0.846	70%	0.701	S	S	*	*			trans	-90.7	129.1	176.6	58.6	0	0	0	0	110.8
25	A	29.5	Very low	31.2	Very low	71 Å²	71	131.6 Å²	131.6	59%	0.587	72%	0.721	S	S	*	*			trans	-151	148.3	162.5	0	0	0	0	0	109.4
26	V	31.9	Very low	31.3	Very low	119 Å²	119	126.8 Å²	126.8	72%	0.721	71%	0.71	S	S	*	*			trans	-96.6	130.4	-171.1	176.6	0	0	0	0	109.8
27	E	29	Very low	31.5	Very low	180 Å²	180	127.6 Å²	127.6	84%	0.841	71%	0.714	S	S	*	*				-180	139.5	129.7	-97.3	169.7	-170.1	0	0	110.5
28	D	34.6	Very low	32	Very low	141 Å²	141	127.7 Å²	127.7	75%	0.754	72%	0.718	S	S	*	*			trans	-71.9	139.8	178.2	-90.3	-32.7	0	0	0	111.4
29	D	29.3	Very low	32.5	Very low	164 Å²	164	131.5 Å²	131.5	88%	0.877	73%	0.73	S	S	*	*				-170.5	163.1	115.3	-121.9	-18.1	0	0	0	113.2
30	D	32.1	Very low	33.3	Very low	136 Å²	136	135.4 Å²	135.4	73%	0.727	74%	0.738	S	S	*	*			trans	-83	167.8	-151.1	-157	2.3	0	0	0	117
31	T	29.6	Very low	34	Very low	129 Å²	129	132.6 Å²	132.6	79%	0.791	72%	0.724	S	S	*	*			trans	95.1	111	156	73.9	0	0	0	0	121.5
32	G	29	Very low	35.1	Very low	67 Å²	67	133.9 Å²	133.9	69%	0.691	72%	0.72	S	S	*	*			trans	131.9	110.3	139.5	0	0	0	0	0	117.7
33	W	26.2	Very low	35.8	Very low	259 Å²	259	133.6 Å²	133.6	98%	0.981	72%	0.721	S	S	*	*			trans	88.5	89	173.5	-61.5	88.8	0	0	0	117.2	L35	W33-L35 PolarHBondContact O-N 3.36Å; W33-L35 VanDerWaalsContact O-N 3.13Å
34	V	29.1	Very low	37.1	Very low	141 Å²	141	132.1 Å²	132.1	86%	0.855	72%	0.723	S	S	*	*			trans	-82.9	86.5	178.1	-174.6	0	0	0	0	111	G36	V34-G36 PolarHBondContact O-N 3.15Å
35	L	34.9	Very low	38.7	Very low	158 Å²	158	128.6 Å²	128.6	83%	0.827	70%	0.701	S	S	*	*			trans	-72.3	100.6	139.9	-87.7	162.8	0	0	0	105.2	W33 I37	W33-L35 PolarHBondContact O-N 3.36Å; W33-L35 VanDerWaalsContact O-N 3.13Å; L35-I37 PolarHBondContact O-N 3.34Å
36	G	33.4	Very low	41	Very low	57 Å²	57	129.6 Å²	129.6	59%	0.588	70%	0.696	S	S	*	*			trans	-52.8	115.4	-175.5	0	0	0	0	0	111	V34 P38	V34-G36 PolarHBondContact O-N 3.15Å; G36-P38 WeakPolarHBondContact O-CD 3.36Å
37	I	42.5	Very low	43.2	Very low	99 Å²	99	130.7 Å²	130.7	51%	0.508	69%	0.688	S	S	.	*			trans	-54	121.2	170.6	-61.6	172.4	0	0	0	106.5	L35 E39 M41	L35-I37 PolarHBondContact O-N 3.34Å; I37-E39 PolarHBondContact O-N 2.93Å; I37-M41 HydrophobicContact CG2-CB 3.42Å; I37-M41 VanDerWaalsContact CG2-CB 3.42Å
38	P	45.3	Very low	45.9	Very low	66 Å²	66	126.7 Å²	126.7	43%	0.429	68%	0.676	S	S	.	*			trans	-53.4	136.9	179.7	-27	35.9	0	0	0	109.6	G36 K40 M41	G36-P38 WeakPolarHBondContact O-CD 3.36Å; P38-K40 PolarHBondContact O-N 3.26Å; P38-M41 PolarHBondContact O-N 2.91Å
39	E	47.4	Very low	48.3	Very low	164 Å²	164	126.2 Å²	126.2	77%	0.766	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-49.8	-26.4	-173.7	-78.9	-176.8	140.2	0	0	114.5	I37 M41 K42	I37-E39 PolarHBondContact O-N 2.93Å; E39-M41 VanDerWaalsContact C-N 3.26Å; E39-M41 PolarHBondContact O-N 2.98Å; E39-K42 PolarHBondContact O-N 3.29Å
40	K	47.5	Very low	51.2	Low	192 Å²	192	122.3 Å²	122.3	84%	0.835	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-69.9	-11.9	175.3	-68.6	-173.6	176.9	-177	0	115.5	P38	P38-K40 PolarHBondContact O-N 3.26Å
41	M	44.9	Very low	53.9	Low	56 Å²	56	119.2 Å²	119.2	28%	0.276	64%	0.637	S	S	.	*	G	3₁₀ helix	trans	-103.4	2.9	175.5	-91.5	-160.6	177.9	0	0	113.5	Q3 I37 P38 E39 N43	Q3-M41 HydrophobicContact CB-CE 3.91Å; Q3-M41 HydrophobicContact CG-CE 3.81Å; Q3-M41 PolarHBondContact NE2-SD 3.11Å; Q3-M41 PolarHBondContact OE1-SD 3.31Å; I37-M41 HydrophobicContact CG2-CB 3.42Å; I37-M41 VanDerWaalsContact CG2-CB 3.42Å; P38-M41 PolarHBondContact O-N 2.91Å; E39-M41 VanDerWaalsContact C-N 3.26Å; E39-M41 PolarHBondContact O-N 2.98Å; M41-N43 PolarHBondContact O-N 3.41Å
42	K	50.7	Low	56.8	Low	154 Å²	154	120.9 Å²	120.9	67%	0.67	64%	0.636	S	S	*	*			trans	-72.5	47.6	162.7	-69.3	-177.8	174.5	176.2	0	111.4	E39	E39-K42 PolarHBondContact O-N 3.29Å
43	N	50.9	Low	59.8	Low	124 Å²	124	124.5 Å²	124.5	66%	0.663	64%	0.635	S	S	*	*	S	Bend	trans	-77.8	143.9	154.8	-74.5	-15.9	0	0	0	106.2	M41 A45	M41-N43 PolarHBondContact O-N 3.41Å; N43-A45 PolarHBondContact O-N 2.85Å
44	N	54	Low	62.8	Low	177 Å²	177	116.6 Å²	116.6	95%	0.947	61%	0.607	S	S	*	*	S	Bend	trans	-60.9	60.4	179.6	-69.3	-16.1	0	0	0	113.4
45	A	61.8	Low	65.7	Low	47 Å²	47	116 Å²	116	39%	0.388	59%	0.593	S	S	.	*			trans	-116.6	124	179.4	0	0	0	0	0	108.9	N43 W47	N43-A45 PolarHBondContact O-N 2.85Å; A45-W47 HydrophobicContact CB-CZ2 4.34Å; A45-W47 PolarHBondContact O-N 3.47Å; A45-W47 PolarHBondContact O-NE1 2.61Å
46	N	76.1	Confident	68.4	Low	92 Å²	92	110 Å²	110	49%	0.492	57%	0.57	S	S	.	*			trans	-78.6	112.4	171.8	-71.6	4.8	0	0	0	108.3
47	W	79.1	Confident	71.1	Confident	141 Å²	141	109.9 Å²	109.9	53%	0.534	56%	0.563	S	S	.	*			trans	-89.1	130.5	-178.6	-60.7	93.4	0	0	0	110	M22 A45	M22-W47 HydrophobicContact CE-CH2 4.4Å; M22-W47 HydrophobicContact CE-CZ3 4.12Å; A45-W47 HydrophobicContact CB-CZ2 4.34Å; A45-W47 PolarHBondContact O-N 3.47Å; A45-W47 PolarHBondContact O-NE1 2.61Å
48	V	86.3	Confident	73.3	Confident	97 Å²	97	106.4 Å²	106.4	59%	0.588	55%	0.547	S	S	*	.			trans	-112.9	129.5	174.6	-177.8	0	0	0	0	109	I50	V48-I50 PolarHBondContact O-N 3Å
49	D	83.6	Confident	75.4	Confident	131 Å²	131	111.6 Å²	111.6	70%	0.701	56%	0.563	S	S	*	*			trans	-79.2	115.9	175.8	-176.9	4.6	0	0	0	110.9	T51	D49-T51 WeakPolarHBondContact OD1-CB 3.47Å; D49-T51 PolarHBondContact OD1-N 3.37Å; D49-T51 PolarHBondContact OD1-OG1 3.36Å
50	I	91.6	Very high	77.6	Confident	81 Å²	81	111.5 Å²	111.5	42%	0.415	56%	0.563	S	S	.	*			trans	-105.3	12.9	178.6	63.2	165.3	0	0	0	113.3	V48 H52 E53 F54	V48-I50 PolarHBondContact O-N 3Å; I50-H52 VanDerWaalsContact C-N 3.33Å; I50-H52 PolarHBondContact O-N 3.31Å; I50-E53 PolarHBondContact O-N 2.87Å; I50-F54 WeakPolarHBondContact O-CB 3.47Å; I50-F54 PolarHBondContact O-N 3.34Å
51	T	88.7	Confident	79.6	Confident	71 Å²	71	105 Å²	105	44%	0.436	54%	0.537	S	S	.	.	H	α-helix	trans	-58.7	-42.1	-171.4	-59.9	0	0	0	0	112.7	D49 K55	D49-T51 WeakPolarHBondContact OD1-CB 3.47Å; D49-T51 PolarHBondContact OD1-N 3.37Å; D49-T51 PolarHBondContact OD1-OG1 3.36Å; T51-K55 HydrophobicContact CG2-CD 4.39Å; T51-K55 WeakPolarHBondContact O-CB 3.33Å; T51-K55 WeakPolarHBondContact O-CG 3.17Å; T51-K55 PolarHBondContact O-N 3.02Å; T51-K55 VanDerWaalsContact O-N 3.11Å
52	H	90.3	Very high	81.8	Confident	164 Å²	164	107.3 Å²	107.3	76%	0.759	55%	0.55	S	S	*	*	H	α-helix	trans	-70.9	-44.4	-179.3	-174.6	-90.1	0	0	0	111.9	I50 K55 G56	I50-H52 VanDerWaalsContact C-N 3.33Å; I50-H52 PolarHBondContact O-N 3.31Å; H52-K55 PolarHBondContact O-N 3.11Å; H52-G56 PolarHBondContact O-N 3.27Å
53	E	92.3	Very high	83.6	Confident	144 Å²	144	107.5 Å²	107.5	67%	0.673	56%	0.558	S	S	*	*	H	α-helix	trans	-60.8	-46.1	177.1	-63.2	-178.2	175.3	0	0	111.3	I50 G56 A57	I50-E53 PolarHBondContact O-N 2.87Å; E53-G56 WeakPolarHBondContact O-CA 3.42Å; E53-G56 PolarHBondContact O-N 2.98Å; E53-G56 VanDerWaalsContact O-N 3.15Å; E53-A57 PolarHBondContact O-N 2.78Å
54	F	88.5	Confident	85.2	Confident	93 Å²	93	105.4 Å²	105.4	41%	0.408	57%	0.565	S	S	.	*	H	α-helix	trans	-61.2	-47.5	177.9	-173.3	-97.6	0	0	0	111.9	L16 I50 G56 A57 C58	L16-F54 HydrophobicContact CD2-CE1 3.84Å; L16-F54 HydrophobicContact CD2-CZ 4Å; I50-F54 WeakPolarHBondContact O-CB 3.47Å; I50-F54 PolarHBondContact O-N 3.34Å; F54-G56 VanDerWaalsContact C-N 3.25Å; F54-G56 PolarHBondContact O-N 3.07Å; F54-A57 PolarHBondContact O-N 2.83Å; F54-C58 VanDerWaalsContact CE1-SG 3.57Å; F54-C58 PolarHBondContact O-N 2.94Å; F54-C58 PolarHBondContact O-SG 3.42Å
55	K	89.3	Confident	86.9	Confident	128 Å²	128	101.7 Å²	101.7	56%	0.557	54%	0.542	S	S	*	.	H	α-helix	trans	-62.4	-32.8	175.1	-76.9	-179.8	-179.6	177.4	0	112.6	T51 H52	T51-K55 HydrophobicContact CG2-CD 4.39Å; T51-K55 WeakPolarHBondContact O-CB 3.33Å; T51-K55 WeakPolarHBondContact O-CG 3.17Å; T51-K55 PolarHBondContact O-N 3.02Å; T51-K55 VanDerWaalsContact O-N 3.11Å; H52-K55 PolarHBondContact O-N 3.11Å
56	G	91.9	Very high	88	Confident	32 Å²	32	102.9 Å²	102.9	33%	0.33	54%	0.542	S	S	.	.	H	α-helix	trans	-59.9	-56.2	172	0	0	0	0	0	111.3	H52 E53 F54 C58 K59	H52-G56 PolarHBondContact O-N 3.27Å; E53-G56 WeakPolarHBondContact O-CA 3.42Å; E53-G56 PolarHBondContact O-N 2.98Å; E53-G56 VanDerWaalsContact O-N 3.15Å; F54-G56 VanDerWaalsContact C-N 3.25Å; F54-G56 PolarHBondContact O-N 3.07Å; G56-C58 VanDerWaalsContact C-N 3.33Å; G56-C58 PolarHBondContact O-N 2.91Å; G56-K59 WeakPolarHBondContact O-CB 3.36Å; G56-K59 PolarHBondContact O-N 3.47Å; G56-K59 VanDerWaalsContact O-N 3.09Å
57	A	90.2	Very high	88.6	Confident	54 Å²	54	105.2 Å²	105.2	45%	0.446	55%	0.554	S	S	.	*	H	α-helix	trans	-60.2	-38.6	179.5	0	0	0	0	0	112.9	E53 F54 K59 E60	E53-A57 PolarHBondContact O-N 2.78Å; F54-A57 PolarHBondContact O-N 2.83Å; A57-K59 PolarHBondContact O-N 2.8Å; A57-K59 VanDerWaalsContact O-N 3.11Å; A57-E60 WeakPolarHBondContact O-CB 3.38Å; A57-E60 PolarHBondContact O-N 2.92Å
58	C	88.6	Confident	88.9	Confident	27 Å²	27	102.6 Å²	102.6	18%	0.182	55%	0.547	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-18.4	177.3	-68.1	0	0	0	0	114.4	F54 G56 E60	F54-C58 VanDerWaalsContact CE1-SG 3.57Å; F54-C58 PolarHBondContact O-N 2.94Å; F54-C58 PolarHBondContact O-SG 3.42Å; G56-C58 VanDerWaalsContact C-N 3.33Å; G56-C58 PolarHBondContact O-N 2.91Å; C58-E60 VanDerWaalsContact C-N 3.28Å
59	K	90.5	Very high	89	Confident	175 Å²	175	102.9 Å²	102.9	76%	0.761	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-21.1	175	-68.5	173.8	-177.8	177.2	0	112.5	G56 A57 L61	G56-K59 WeakPolarHBondContact O-CB 3.36Å; G56-K59 PolarHBondContact O-N 3.47Å; G56-K59 VanDerWaalsContact O-N 3.09Å; A57-K59 PolarHBondContact O-N 2.8Å; A57-K59 VanDerWaalsContact O-N 3.11Å; K59-L61 VanDerWaalsContact C-N 3.26Å
60	E	92.2	Very high	89.1	Confident	162 Å²	162	106.6 Å²	106.6	76%	0.757	56%	0.555	S	S	*	*	S	Bend	trans	-74.8	-18.2	177.4	-58.7	-179.5	-174.7	0	0	112.3	A57 C58	A57-E60 WeakPolarHBondContact O-CB 3.38Å; A57-E60 PolarHBondContact O-N 2.92Å; C58-E60 VanDerWaalsContact C-N 3.28Å
61	L	90.7	Very high	89	Confident	55 Å²	55	110.3 Å²	110.3	29%	0.288	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-76.8	125.6	177.8	-67.2	171	0	0	0	112.1	K14 K59 E65 L67	K14-L61 PolarHBondContact NZ-O 3.16Å; K59-L61 VanDerWaalsContact C-N 3.26Å; L61-E65 HydrophobicContact CD2-CB 4.17Å; L61-L67 HydrophobicContact CD1-CB 4.45Å; L61-L67 HydrophobicContact CD2-CB 4.46Å
62	N	91.3	Very high	88.8	Confident	104 Å²	104	109.3 Å²	109.3	56%	0.556	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-71.6	163.9	173.9	-60.3	-57.8	0	0	0	112	G64 E65	N62-G64 PolarHBondContact O-N 3.3Å; N62-E65 HydrophobicContact CB-CG 4.05Å; N62-E65 PolarHBondContact N-OE2 3.19Å; N62-E65 PolarHBondContact ND2-OE1 3.15Å; N62-E65 PolarHBondContact ND2-OE2 3.39Å; N62-E65 PolarHBondContact O-N 3.23Å; N62-E65 VanDerWaalsContact O-N 3.16Å
63	L	88.1	Confident	88.5	Confident	159 Å²	159	103 Å²	103	83%	0.832	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	125.9	174.3	-173.8	69.7	0	0	0	110
64	G	85.4	Confident	88.2	Confident	80 Å²	80	101.2 Å²	101.2	83%	0.825	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.4	-6.9	-177.1	0	0	0	0	0	114.4	N62	N62-G64 PolarHBondContact O-N 3.3Å
65	E	89	Confident	87.9	Confident	98 Å²	98	104.6 Å²	104.6	46%	0.458	55%	0.553	S	S	.	*			trans	-84.9	137.8	173.2	-68.8	177.9	172.7	0	0	111.3	L61 N62	L61-E65 HydrophobicContact CD2-CB 4.17Å; N62-E65 HydrophobicContact CB-CG 4.05Å; N62-E65 PolarHBondContact N-OE2 3.19Å; N62-E65 PolarHBondContact ND2-OE1 3.15Å; N62-E65 PolarHBondContact ND2-OE2 3.39Å; N62-E65 PolarHBondContact O-N 3.23Å; N62-E65 VanDerWaalsContact O-N 3.16Å
66	L	85.2	Confident	87.5	Confident	72 Å²	72	104 Å²	104	38%	0.377	55%	0.552	S	S	.	*			trans	-128.1	124.3	173.2	-179.6	71.6	0	0	0	108.8	L74	L66-L74 HydrophobicContact CD2-CD2 3.31Å
67	L	87.7	Confident	87	Confident	142 Å²	142	103.5 Å²	103.5	74%	0.743	55%	0.546	S	S	*	.			trans	-88.2	116.2	171.8	-175	67.4	0	0	0	109.3	L61	L61-L67 HydrophobicContact CD1-CB 4.45Å; L61-L67 HydrophobicContact CD2-CB 4.46Å
68	H	85.8	Confident	86.5	Confident	85 Å²	85	108.1 Å²	108.1	39%	0.394	56%	0.56	S	S	.	*			trans	-149.4	168.4	175.2	65.3	91	0	0	0	110.1	F72	H68-F72 HydrophobicContact CB-CB 4.43Å; H68-F72 HydrophobicContact CB-CD1 3.91Å; H68-F72 PolarHBondContact CE1-O 3.4Å; H68-F72 VanDerWaalsContact CE1-O 3.28Å; H68-F72 PolarHBondContact ND1-O 2.88Å; H68-F72 VanDerWaalsContact ND1-O 3.17Å
69	D	88.1	Confident	85.9	Confident	103 Å²	103	111.7 Å²	111.7	55%	0.551	59%	0.585	S	S	*	*			trans	-65.9	148.7	175	-173.9	-93.7	0	0	0	111.4	L71 F72	D69-L71 PolarHBondContact O-N 3.28Å; D69-L71 VanDerWaalsContact O-N 3.15Å; D69-L71 WeakPolarHBondContact OD1-CB 3.45Å; D69-L71 PolarHBondContact OD1-N 3.17Å; D69-F72 HydrophobicContact CB-CB 4.27Å; D69-F72 WeakPolarHBondContact O-CB 3.31Å; D69-F72 PolarHBondContact O-N 3.01Å
70	K	86.6	Confident	85.5	Confident	209 Å²	209	105.7 Å²	105.7	91%	0.909	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-25.9	-179.2	-66.6	-176.8	-179.3	179.4	0	113.5
71	L	89.6	Confident	84.8	Confident	159 Å²	159	100.6 Å²	100.6	83%	0.832	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-11.9	178.8	-58.8	176.6	0	0	0	112.8	D69 G73	D69-L71 PolarHBondContact O-N 3.28Å; D69-L71 VanDerWaalsContact O-N 3.15Å; D69-L71 WeakPolarHBondContact OD1-CB 3.45Å; D69-L71 PolarHBondContact OD1-N 3.17Å; L71-G73 PolarHBondContact O-N 3.15Å
72	F	84.1	Confident	84.3	Confident	50 Å²	50	103.4 Å²	103.4	22%	0.219	56%	0.557	C	S	.	*			trans	-78.2	117	179.4	-177	-100.9	0	0	0	110.7	L17 H68 D69 E76 A77	L17-F72 HydrophobicContact CD2-CE1 3.79Å; L17-F72 HydrophobicContact CD2-CE2 4.35Å; L17-F72 HydrophobicContact CD2-CZ 3.44Å; L17-F72 VanDerWaalsContact CD2-CZ 3.44Å; H68-F72 HydrophobicContact CB-CB 4.43Å; H68-F72 HydrophobicContact CB-CD1 3.91Å; H68-F72 PolarHBondContact CE1-O 3.4Å; H68-F72 VanDerWaalsContact CE1-O 3.28Å; H68-F72 PolarHBondContact ND1-O 2.88Å; H68-F72 VanDerWaalsContact ND1-O 3.17Å; D69-F72 HydrophobicContact CB-CB 4.27Å; D69-F72 WeakPolarHBondContact O-CB 3.31Å; D69-F72 PolarHBondContact O-N 3.01Å; F72-E76 VanDerWaalsContact CD2-OE2 3.26Å; F72-E76 WeakPolarHBondContact CD2-OE2 3.43Å; F72-E76 HydrophobicContact CE2-CB 3.89Å; F72-E76 WeakPolarHBondContact CE2-OE2 3.43Å; F72-E76 HydrophobicContact CZ-CB 4.2Å; F72-A77 HydrophobicContact CE1-CB 4.12Å; F72-A77 HydrophobicContact CZ-CB 3.98Å
73	G	83.6	Confident	83.8	Confident	31 Å²	31	102.8 Å²	102.8	32%	0.32	55%	0.552	S	S	.	*			trans	-89.3	135.5	177.4	0	0	0	0	0	112	L71 F75 E76	L71-G73 PolarHBondContact O-N 3.15Å; G73-F75 PolarHBondContact O-N 3.44Å; G73-E76 WeakPolarHBondContact O-CB 3.34Å; G73-E76 PolarHBondContact O-N 2.66Å
74	L	85.6	Confident	83.4	Confident	107 Å²	107	99.2 Å²	99.2	56%	0.56	53%	0.532	S	S	*	.	H	α-helix	trans	-58.9	-21.1	176.1	-73.3	-179.5	0	0	0	114.3	L66 E76 A77	L66-L74 HydrophobicContact CD2-CD2 3.31Å; L74-E76 VanDerWaalsContact C-N 3.28Å; L74-E76 PolarHBondContact O-N 2.82Å; L74-A77 WeakPolarHBondContact O-CB 3.33Å; L74-A77 PolarHBondContact O-N 2.88Å
75	F	82.5	Confident	83.1	Confident	164 Å²	164	97.3 Å²	97.3	72%	0.719	50%	0.503	S	S	*	.	H	α-helix	trans	-62.8	-35.3	172.1	-176.1	-100.9	0	0	0	112.1	G73 A77 M78	G73-F75 PolarHBondContact O-N 3.44Å; F75-A77 VanDerWaalsContact C-N 3.28Å; F75-A77 PolarHBondContact O-N 3.21Å; F75-M78 HydrophobicContact CD2-SD 4.15Å; F75-M78 HydrophobicContact CE2-SD 4.49Å; F75-M78 WeakPolarHBondContact O-CB 3.16Å; F75-M78 PolarHBondContact O-N 3.29Å
76	E	79.9	Confident	82.4	Confident	115 Å²	115	96.4 Å²	96.4	54%	0.537	51%	0.506	S	S	.	.	H	α-helix	trans	-67.2	-32.9	177.6	-59.3	179.9	160.2	0	0	111.4	F72 G73 L74 M78 S79	F72-E76 VanDerWaalsContact CD2-OE2 3.26Å; F72-E76 WeakPolarHBondContact CD2-OE2 3.43Å; F72-E76 HydrophobicContact CE2-CB 3.89Å; F72-E76 WeakPolarHBondContact CE2-OE2 3.43Å; F72-E76 HydrophobicContact CZ-CB 4.2Å; G73-E76 WeakPolarHBondContact O-CB 3.34Å; G73-E76 PolarHBondContact O-N 2.66Å; L74-E76 VanDerWaalsContact C-N 3.28Å; L74-E76 PolarHBondContact O-N 2.82Å; E76-M78 PolarHBondContact O-N 3.43Å; E76-S79 PolarHBondContact O-N 3.02Å
77	A	81.9	Confident	82	Confident	23 Å²	23	100.9 Å²	100.9	19%	0.19	52%	0.522	C	S	.	.	H	α-helix	trans	-64.5	-20.9	175.3	0	0	0	0	0	113.2	L17 F72 L74 F75 S79 A80	L17-A77 HydrophobicContact CD1-CB 3.83Å; L17-A77 HydrophobicContact CD2-CB 4.26Å; F72-A77 HydrophobicContact CE1-CB 4.12Å; F72-A77 HydrophobicContact CZ-CB 3.98Å; L74-A77 WeakPolarHBondContact O-CB 3.33Å; L74-A77 PolarHBondContact O-N 2.88Å; F75-A77 VanDerWaalsContact C-N 3.28Å; F75-A77 PolarHBondContact O-N 3.21Å; A77-S79 PolarHBondContact O-N 3.47Å; A77-A80 VanDerWaalsContact O-CB 3.23Å; A77-A80 WeakPolarHBondContact O-CB 3.29Å; A77-A80 PolarHBondContact O-N 2.92Å; A77-A80 VanDerWaalsContact O-N 3.12Å
78	M	80.9	Confident	81.3	Confident	150 Å²	150	95.9 Å²	95.9	74%	0.739	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-19.5	176.9	-68.4	-173.5	44.6	0	0	113.6	F75 E76	F75-M78 HydrophobicContact CD2-SD 4.15Å; F75-M78 HydrophobicContact CE2-SD 4.49Å; F75-M78 WeakPolarHBondContact O-CB 3.16Å; F75-M78 PolarHBondContact O-N 3.29Å; E76-M78 PolarHBondContact O-N 3.43Å
79	S	76.3	Confident	80.8	Confident	103 Å²	103	93.5 Å²	93.5	72%	0.72	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	0.6	176.6	-59.2	0	0	0	0	112.8	E76 A77	E76-S79 PolarHBondContact O-N 3.02Å; A77-S79 PolarHBondContact O-N 3.47Å
80	A	80.8	Confident	80	Confident	48 Å²	48	90 Å²	90	40%	0.397	47%	0.47	S	S	.	.			trans	-69.9	148.3	-180	0	0	0	0	0	111.4	L17 A77	L17-A80 HydrophobicContact CD1-CB 4.21Å; A77-A80 VanDerWaalsContact O-CB 3.23Å; A77-A80 WeakPolarHBondContact O-CB 3.29Å; A77-A80 PolarHBondContact O-N 2.92Å; A77-A80 VanDerWaalsContact O-N 3.12Å
81	I	77.3	Confident	79.2	Confident	56 Å²	56	81.8 Å²	81.8	29%	0.287	45%	0.445	S	S	.	.			trans	-97.9	142.1	171	-84.6	158.7	0	0	0	110.8	M88 P329	I81-M88 HydrophobicContact CG1-CB 4.45Å; I81-M88 HydrophobicContact CG2-CB 4.14Å; I81-M88 WeakPolarHBondContact CG2-O 3.47Å; I81-P329 HydrophobicContact CD1-CB 3.31Å; I81-P329 WeakPolarHBondContact CD1-O 3.03Å
82	E	81.4	Confident	78.4	Confident	113 Å²	113	76.8 Å²	76.8	53%	0.528	42%	0.419	S	S	.	.			trans	-89.1	113.4	166.3	-166.8	171.3	175.3	0	0	110.1	D85 M88	E82-D85 HydrophobicContact CB-CB 3.96Å; E82-D85 HydrophobicContact CG-CB 4.09Å; E82-D85 PolarHBondContact O-N 3.35Å; E82-M88 HydrophobicContact CB-CB 4.38Å; E82-M88 HydrophobicContact CB-CE 3.45Å; E82-M88 VanDerWaalsContact CB-CE 3.45Å; E82-M88 HydrophobicContact CB-SD 3.91Å; E82-M88 HydrophobicContact CG-CE 4.3Å; E82-M88 WeakPolarHBondContact OE2-CE 3.45Å
83	M	80.3	Confident	77.4	Confident	92 Å²	92	75.2 Å²	75.2	45%	0.453	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	147.3	171.1	-68.4	-175.4	-64.6	0	0	110.2	I5 D85	I5-M83 HydrophobicContact CB-CE 3.92Å; M83-D85 PolarHBondContact O-N 3.42Å; M83-D85 VanDerWaalsContact O-N 3.17Å
84	M	78.5	Confident	76.3	Confident	83 Å²	83	74.9 Å²	74.9	41%	0.409	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	66	-1.5	-175.8	-52.8	-171.7	168.5	0	0	116.2	Q6 P86 D89 M92	Q6-M84 HydrophobicContact CB-CE 4.36Å; Q6-M84 HydrophobicContact CG-CE 3.92Å; M84-P86 WeakPolarHBondContact O-CD 3.43Å; M84-D89 PolarHBondContact N-OD2 3.37Å; M84-M92 HydrophobicContact CB-SD 4.41Å
85	D	79.8	Confident	74.9	Confident	41 Å²	41	76.2 Å²	76.2	22%	0.219	42%	0.417	C	S	.	.			trans	-78.1	123.2	168	-177.5	-77.8	0	0	0	109.7	E82 M83 K87 M88 D89	E82-D85 HydrophobicContact CB-CB 3.96Å; E82-D85 HydrophobicContact CG-CB 4.09Å; E82-D85 PolarHBondContact O-N 3.35Å; M83-D85 PolarHBondContact O-N 3.42Å; M83-D85 VanDerWaalsContact O-N 3.17Å; D85-K87 PolarHBondContact O-N 3.41Å; D85-K87 VanDerWaalsContact O-N 3.07Å; D85-K87 VanDerWaalsContact OD1-CA 3.29Å; D85-K87 WeakPolarHBondContact OD1-CA 3.31Å; D85-K87 VanDerWaalsContact OD1-CB 3.29Å; D85-K87 WeakPolarHBondContact OD1-CB 3.34Å; D85-K87 PolarHBondContact OD1-N 2.87Å; D85-M88 HydrophobicContact CB-CB 4.08Å; D85-M88 HydrophobicContact CB-CE 4.07Å; D85-M88 HydrophobicContact CB-CG 4.23Å; D85-M88 PolarHBondContact O-N 3.17Å; D85-M88 PolarHBondContact OD1-N 3.21Å; D85-D89 WeakPolarHBondContact O-CB 3.4Å; D85-D89 PolarHBondContact O-N 3.17Å
86	P	74.8	Confident	73.7	Confident	79 Å²	79	73.6 Å²	73.6	51%	0.513	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.1	-177.3	-24.9	34.7	0	0	0	115.5	M84	M84-P86 WeakPolarHBondContact O-CD 3.43Å
87	K	75.9	Confident	72.8	Confident	165 Å²	165	70.5 Å²	70.5	72%	0.717	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-18.7	178.9	-61.3	-179.3	179.2	177.8	0	113	D85 F331 P332	D85-K87 PolarHBondContact O-N 3.41Å; D85-K87 VanDerWaalsContact O-N 3.07Å; D85-K87 VanDerWaalsContact OD1-CA 3.29Å; D85-K87 WeakPolarHBondContact OD1-CA 3.31Å; D85-K87 VanDerWaalsContact OD1-CB 3.29Å; D85-K87 WeakPolarHBondContact OD1-CB 3.34Å; D85-K87 PolarHBondContact OD1-N 2.87Å; K87-F331 WeakPolarHBondContact O-CD1 3.41Å; K87-P332 WeakPolarHBondContact O-CD 3.42Å
88	M	74.3	Confident	71.8	Confident	38 Å²	38	77.7 Å²	77.7	19%	0.187	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-28.5	-178.5	-54.4	-162.2	-110	0	0	113.3	I81 E82 D85 F331	I81-M88 HydrophobicContact CG1-CB 4.45Å; I81-M88 HydrophobicContact CG2-CB 4.14Å; I81-M88 WeakPolarHBondContact CG2-O 3.47Å; E82-M88 HydrophobicContact CB-CB 4.38Å; E82-M88 HydrophobicContact CB-CE 3.45Å; E82-M88 VanDerWaalsContact CB-CE 3.45Å; E82-M88 HydrophobicContact CB-SD 3.91Å; E82-M88 HydrophobicContact CG-CE 4.3Å; E82-M88 WeakPolarHBondContact OE2-CE 3.45Å; D85-M88 HydrophobicContact CB-CB 4.08Å; D85-M88 HydrophobicContact CB-CE 4.07Å; D85-M88 HydrophobicContact CB-CG 4.23Å; D85-M88 PolarHBondContact O-N 3.17Å; D85-M88 PolarHBondContact OD1-N 3.21Å; M88-F331 HydrophobicContact CG-CD1 3.89Å; M88-F331 HydrophobicContact CG-CE1 3.58Å; M88-F331 HydrophobicContact SD-CE1 3.9Å
89	D	75.6	Confident	71.4	Confident	34 Å²	34	75 Å²	75	18%	0.182	41%	0.412	C	S	.	.			trans	-96.8	104.5	-177.4	-171.1	-10.4	0	0	0	111.5	M84 D85 G91 M92	M84-D89 PolarHBondContact N-OD2 3.37Å; D85-D89 WeakPolarHBondContact O-CB 3.4Å; D85-D89 PolarHBondContact O-N 3.17Å; D89-G91 PolarHBondContact O-N 3.12Å; D89-G91 VanDerWaalsContact OD1-CA 3.31Å; D89-G91 WeakPolarHBondContact OD1-CA 3.23Å; D89-G91 PolarHBondContact OD1-N 2.92Å; D89-M92 HydrophobicContact CB-CB 4.34Å; D89-M92 HydrophobicContact CB-CG 3.75Å; D89-M92 WeakPolarHBondContact O-CB 3.16Å; D89-M92 PolarHBondContact O-N 3.19Å; D89-M92 VanDerWaalsContact O-N 3.12Å
90	A	69.9	Low	71.5	Confident	29 Å²	29	76.6 Å²	76.6	24%	0.24	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-29.4	173.4	0	0	0	0	0	112.7	M92 I93 Q324 P332	A90-M92 VanDerWaalsContact C-N 3.26Å; A90-M92 PolarHBondContact O-N 3.36Å; A90-I93 PolarHBondContact O-N 3.44Å; A90-Q324 HydrophobicContact CB-CG 4.43Å; A90-Q324 PolarHBondContact O-NE2 3.23Å; A90-P332 HydrophobicContact CB-CG 4.3Å
91	G	70.8	Confident	71.6	Confident	37 Å²	37	76.8 Å²	76.8	38%	0.381	40%	0.402	S	S	.	.	H	α-helix	trans	-65.2	-26.6	177.2	0	0	0	0	0	113.7	D89 I93 G94 N95	D89-G91 PolarHBondContact O-N 3.12Å; D89-G91 VanDerWaalsContact OD1-CA 3.31Å; D89-G91 WeakPolarHBondContact OD1-CA 3.23Å; D89-G91 PolarHBondContact OD1-N 2.92Å; G91-I93 PolarHBondContact O-N 3.49Å; G91-G94 PolarHBondContact O-N 3.3Å; G91-N95 PolarHBondContact O-N 2.82Å; G91-N95 PolarHBondContact O-ND2 3.29Å
92	M	71.9	Confident	71.9	Confident	55 Å²	55	75.1 Å²	75.1	27%	0.271	39%	0.394	S	S	.	.	H	α-helix	trans	-66.3	-24.7	177.4	-73.7	-66.6	-73.9	0	0	113.1	M84 D89 A90 Q96	M84-M92 HydrophobicContact CB-SD 4.41Å; D89-M92 HydrophobicContact CB-CB 4.34Å; D89-M92 HydrophobicContact CB-CG 3.75Å; D89-M92 WeakPolarHBondContact O-CB 3.16Å; D89-M92 PolarHBondContact O-N 3.19Å; D89-M92 VanDerWaalsContact O-N 3.12Å; A90-M92 VanDerWaalsContact C-N 3.26Å; A90-M92 PolarHBondContact O-N 3.36Å; M92-Q96 VanDerWaalsContact O-CG 3.31Å; M92-Q96 WeakPolarHBondContact O-CG 3.46Å; M92-Q96 PolarHBondContact O-NE2 2.77Å
93	I	63.8	Low	72.3	Confident	16 Å²	16	72.7 Å²	72.7	8%	0.082	38%	0.384	C	S	.	.	H	α-helix	trans	-85.1	-40.5	179.2	-64.6	155.2	0	0	0	111.1	A90 G91 N95 Q96 V97 P332 Y334	A90-I93 PolarHBondContact O-N 3.44Å; G91-I93 PolarHBondContact O-N 3.49Å; I93-N95 PolarHBondContact O-N 3.43Å; I93-Q96 WeakPolarHBondContact O-CB 3.31Å; I93-Q96 PolarHBondContact O-N 3.12Å; I93-V97 PolarHBondContact O-N 3.3Å; I93-P332 HydrophobicContact CD1-CB 3.48Å; I93-P332 VanDerWaalsContact CD1-CB 3.48Å; I93-P332 HydrophobicContact CD1-CG 3.64Å; I93-Y334 WeakPolarHBondContact CD1-OH 3.32Å
94	G	59.3	Low	72.8	Confident	25 Å²	25	68.5 Å²	68.5	26%	0.258	36%	0.364	S	S	.	.	H	α-helix	trans	-57.9	-31.4	175.7	0	0	0	0	0	112.3	G91	G91-G94 PolarHBondContact O-N 3.3Å
95	N	57.1	Low	73.4	Confident	134 Å²	134	70.2 Å²	70.2	72%	0.717	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-13	175.3	-66.6	-20.6	0	0	0	114.4	G91 I93	G91-N95 PolarHBondContact O-N 2.82Å; G91-N95 PolarHBondContact O-ND2 3.29Å; I93-N95 PolarHBondContact O-N 3.43Å
96	Q	56.5	Low	74	Confident	110 Å²	110	72 Å²	72	51%	0.514	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-20.8	176.2	-76	170.3	33.9	0	0	112.6	M92 I93 N98	M92-Q96 VanDerWaalsContact O-CG 3.31Å; M92-Q96 WeakPolarHBondContact O-CG 3.46Å; M92-Q96 PolarHBondContact O-NE2 2.77Å; I93-Q96 WeakPolarHBondContact O-CB 3.31Å; I93-Q96 PolarHBondContact O-N 3.12Å; Q96-N98 PolarHBondContact O-N 3.26Å
97	V	61.7	Low	74.7	Confident	50 Å²	50	68.3 Å²	68.3	30%	0.303	35%	0.354	S	S	.	.			trans	-88	106.9	177.9	-168	0	0	0	0	108.5	I93 R99 L321	I93-V97 PolarHBondContact O-N 3.3Å; V97-R99 HydrophobicContact CG1-CB 4.08Å; V97-R99 HydrophobicContact CG1-CG 3.54Å; V97-R99 PolarHBondContact O-N 2.82Å; V97-L321 HydrophobicContact CB-CD1 4.1Å; V97-L321 HydrophobicContact CG1-CD1 4.45Å; V97-L321 HydrophobicContact CG2-CD1 3.51Å
98	N	61.6	Low	75.4	Confident	173 Å²	173	62.9 Å²	62.9	93%	0.925	33%	0.332	S	S	*	.			trans	-68.9	26.4	176.4	-74.4	-17.9	0	0	0	113.5	Q96	Q96-N98 PolarHBondContact O-N 3.26Å
99	R	72.6	Confident	76.3	Confident	95 Å²	95	70.3 Å²	70.3	36%	0.358	36%	0.364	S	S	.	.	S	Bend	trans	-124.5	141.1	-179.9	95.3	-168.1	-179.3	177.5	-1.7	109.9	V97 V101 E319	V97-R99 HydrophobicContact CG1-CB 4.08Å; V97-R99 HydrophobicContact CG1-CG 3.54Å; V97-R99 PolarHBondContact O-N 2.82Å; R99-V101 PolarHBondContact O-N 3.49Å; R99-E319 IonicContact CZ-OE1 3.64Å; R99-E319 IonicContact CZ-OE2 3.68Å; R99-E319 IonicContact NE-OE2 3.97Å; R99-E319 IonicContact NH2-OE1 2.75Å; R99-E319 PolarHBondContact NH2-OE1 3.35Å; R99-E319 IonicContact NH2-OE2 2.66Å; R99-E319 PolarHBondContact NH2-OE2 2.97Å
100	K	76.7	Confident	77	Confident	136 Å²	136	73.5 Å²	73.5	59%	0.591	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-69.9	120.6	175	-173.3	-178.8	174.3	-166.9	0	109.3	L102 E110	K100-L102 HydrophobicContact CD-CD2 3.72Å; K100-L102 HydrophobicContact CG-CD2 3.84Å; K100-L102 PolarHBondContact O-N 3.33Å; K100-E110 IonicContact NZ-OE1 2.77Å; K100-E110 PolarHBondContact NZ-OE1 3.07Å
101	V	83	Confident	77.7	Confident	52 Å²	52	75 Å²	75	32%	0.315	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-77	118.5	172.5	178.2	0	0	0	0	108.2	R99 E319 L321 V322	R99-V101 PolarHBondContact O-N 3.49Å; V101-E319 HydrophobicContact CG1-CG 3.64Å; V101-L321 HydrophobicContact CG1-CB 4.26Å; V101-L321 HydrophobicContact CG2-CB 3.86Å; V101-L321 HydrophobicContact CG2-CD1 4.33Å; V101-V322 HydrophobicContact CG1-CB 4.43Å
102	L	85.3	Confident	78.5	Confident	20 Å²	20	75.8 Å²	75.8	11%	0.105	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-101.5	136.6	-177	-58.1	176.7	0	0	0	110.8	K100 Q106 A107 E110 A112	K100-L102 HydrophobicContact CD-CD2 3.72Å; K100-L102 HydrophobicContact CG-CD2 3.84Å; K100-L102 PolarHBondContact O-N 3.33Å; L102-Q106 HydrophobicContact CB-CB 4.33Å; L102-Q106 HydrophobicContact CD2-CB 4.2Å; L102-A107 HydrophobicContact CB-CB 4Å; L102-A107 HydrophobicContact CD1-CB 4.34Å; L102-E110 HydrophobicContact CD1-CB 4.38Å; L102-E110 WeakPolarHBondContact CD1-OE2 3.19Å; L102-E110 VanDerWaalsContact CD2-OE2 3.31Å; L102-E110 WeakPolarHBondContact CD2-OE2 3.34Å; L102-A112 HydrophobicContact CD1-CB 3.98Å
103	N	88.8	Confident	79.4	Confident	62 Å²	62	73.7 Å²	73.7	33%	0.332	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-79.4	171.9	164.3	70.7	32.2	0	0	0	110.7	E105 Q106 A107	N103-E105 PolarHBondContact O-N 3.41Å; N103-E105 PolarHBondContact OD1-N 3.47Å; N103-Q106 PolarHBondContact O-N 2.88Å; N103-Q106 VanDerWaalsContact OD1-CB 3.29Å; N103-Q106 WeakPolarHBondContact OD1-CB 3.34Å; N103-Q106 WeakPolarHBondContact OD1-CG 3.29Å; N103-Q106 PolarHBondContact OD1-N 3.35Å; N103-A107 VanDerWaalsContact O-CB 3.28Å; N103-A107 WeakPolarHBondContact O-CB 3.26Å; N103-A107 PolarHBondContact O-N 2.91Å
104	F	90.6	Very high	80.7	Confident	5 Å²	5	77.5 Å²	77.5	2%	0.022	41%	0.405	C	S	.	.	H	α-helix	trans	-54.7	-50.8	-175	-177.1	-121.6	0	0	0	113.7	Q106 A107 I108 I113 V115 L151 Y152 H154 N155 L158 I159	F104-Q106 PolarHBondContact O-N 3.38Å; F104-A107 PolarHBondContact O-N 3.01Å; F104-I108 HydrophobicContact CD1-CD1 4.1Å; F104-I108 HydrophobicContact CD2-CD1 4.43Å; F104-I108 HydrophobicContact CE1-CD1 3.8Å; F104-I108 HydrophobicContact CE2-CD1 4.14Å; F104-I108 HydrophobicContact CG-CD1 4.42Å; F104-I108 HydrophobicContact CZ-CD1 3.82Å; F104-I108 WeakPolarHBondContact O-CG1 3.35Å; F104-I108 PolarHBondContact O-N 3.25Å; F104-I113 HydrophobicContact CD2-CD1 3.27Å; F104-I113 HydrophobicContact CE2-CD1 3.41Å; F104-I113 VanDerWaalsContact CE2-CD1 3.41Å; F104-I113 HydrophobicContact CG-CD1 4.36Å; F104-V115 HydrophobicContact CE2-CG1 4.48Å; F104-V115 HydrophobicContact CZ-CG1 4.23Å; F104-L151 HydrophobicContact CB-CB 4.08Å; F104-L151 HydrophobicContact CD2-CB 3.71Å; F104-L151 WeakPolarHBondContact CD2-O 3.47Å; F104-L151 HydrophobicContact CG-CB 4.34Å; F104-L151 WeakPolarHBondContact CG-O 3.45Å; F104-Y152 AromaticContact CE2-CD1 3.77Å; F104-Y152 HydrophobicContact CE2-CD1 3.77Å; F104-Y152 HydrophobicContact CE2-CE1 4.26Å; F104-Y152 HydrophobicContact CE2-CG 4.47Å; F104-Y152 HydrophobicContact CZ-CD1 4.37Å; F104-H154 HydrophobicContact CB-CB 4.42Å; F104-N155 HydrophobicContact CD1-CB 3.82Å; F104-N155 HydrophobicContact CE1-CB 3.91Å; F104-N155 WeakPolarHBondContact CE1-O 3.28Å; F104-L158 HydrophobicContact CD1-CD1 4.23Å; F104-L158 HydrophobicContact CE1-CB 3.91Å; F104-L158 HydrophobicContact CE1-CD1 3.97Å; F104-L158 HydrophobicContact CE1-CG 4.4Å; F104-L158 HydrophobicContact CZ-CB 4.46Å; F104-I159 HydrophobicContact CZ-CG1 4.19Å
105	E	92.1	Very high	82.3	Confident	119 Å²	119	77.2 Å²	77.2	56%	0.556	40%	0.397	S	S	*	.	H	α-helix	trans	-65.6	-39.9	-178.7	-67.2	163.1	176.8	0	0	112.3	N103 I108 K109 L158	N103-E105 PolarHBondContact O-N 3.41Å; N103-E105 PolarHBondContact OD1-N 3.47Å; E105-I108 PolarHBondContact O-N 3.09Å; E105-K109 WeakPolarHBondContact O-CB 3.29Å; E105-K109 PolarHBondContact O-N 3.28Å; E105-L158 HydrophobicContact CG-CD1 4.13Å
106	Q	91.2	Very high	84	Confident	77 Å²	77	76 Å²	76	36%	0.36	39%	0.386	S	S	.	.	H	α-helix	trans	-64.8	-42.4	174.8	-71.3	169.4	-9.5	0	0	111.3	L102 N103 F104 I108 K109 E110	L102-Q106 HydrophobicContact CB-CB 4.33Å; L102-Q106 HydrophobicContact CD2-CB 4.2Å; N103-Q106 PolarHBondContact O-N 2.88Å; N103-Q106 VanDerWaalsContact OD1-CB 3.29Å; N103-Q106 WeakPolarHBondContact OD1-CB 3.34Å; N103-Q106 WeakPolarHBondContact OD1-CG 3.29Å; N103-Q106 PolarHBondContact OD1-N 3.35Å; F104-Q106 PolarHBondContact O-N 3.38Å; Q106-I108 VanDerWaalsContact C-N 3.31Å; Q106-I108 PolarHBondContact O-N 2.84Å; Q106-K109 PolarHBondContact O-N 3.02Å; Q106-E110 WeakPolarHBondContact O-CB 3.39Å; Q106-E110 WeakPolarHBondContact O-CG 2.95Å; Q106-E110 PolarHBondContact O-N 3.26Å
107	A	89.9	Confident	85.6	Confident	2 Å²	2	78.2 Å²	78.2	2%	0.017	40%	0.396	C	S	.	.	H	α-helix	trans	-65.1	-35.1	178.9	0	0	0	0	0	112	L102 N103 F104 G111 A112 I113 L151	L102-A107 HydrophobicContact CB-CB 4Å; L102-A107 HydrophobicContact CD1-CB 4.34Å; N103-A107 VanDerWaalsContact O-CB 3.28Å; N103-A107 WeakPolarHBondContact O-CB 3.26Å; N103-A107 PolarHBondContact O-N 2.91Å; F104-A107 PolarHBondContact O-N 3.01Å; A107-G111 PolarHBondContact O-N 3.01Å; A107-A112 HydrophobicContact CB-CB 4.34Å; A107-A112 PolarHBondContact O-N 3.25Å; A107-I113 HydrophobicContact CB-CB 4.47Å; A107-I113 HydrophobicContact CB-CD1 3.9Å; A107-I113 HydrophobicContact CB-CG1 3.7Å; A107-I113 HydrophobicContact CB-CG2 4.06Å; A107-I113 PolarHBondContact O-N 3.27Å; A107-L151 HydrophobicContact CB-CD1 4.01Å
108	I	91.8	Very high	87.1	Confident	52 Å²	52	76.5 Å²	76.5	27%	0.267	39%	0.385	S	S	.	.	H	α-helix	trans	-64.8	-50.5	171.2	-64.1	167.3	0	0	0	109.9	F104 E105 Q106 E110 G111 I113 V115 L158	F104-I108 HydrophobicContact CD1-CD1 4.1Å; F104-I108 HydrophobicContact CD2-CD1 4.43Å; F104-I108 HydrophobicContact CE1-CD1 3.8Å; F104-I108 HydrophobicContact CE2-CD1 4.14Å; F104-I108 HydrophobicContact CG-CD1 4.42Å; F104-I108 HydrophobicContact CZ-CD1 3.82Å; F104-I108 WeakPolarHBondContact O-CG1 3.35Å; F104-I108 PolarHBondContact O-N 3.25Å; E105-I108 PolarHBondContact O-N 3.09Å; Q106-I108 VanDerWaalsContact C-N 3.31Å; Q106-I108 PolarHBondContact O-N 2.84Å; I108-E110 VanDerWaalsContact C-N 3.3Å; I108-E110 PolarHBondContact O-N 2.73Å; I108-G111 PolarHBondContact O-N 3.17Å; I108-I113 HydrophobicContact CG1-CD1 3.78Å; I108-I113 HydrophobicContact CG1-CG1 3.85Å; I108-V115 HydrophobicContact CD1-CG1 3.64Å; I108-V115 HydrophobicContact CG1-CG1 3.72Å; I108-L158 HydrophobicContact CD1-CB 4.43Å; I108-L158 HydrophobicContact CD1-CD1 4.29Å
109	K	91.7	Very high	88.7	Confident	193 Å²	193	70.7 Å²	70.7	84%	0.839	36%	0.358	S	S	*	.	H	α-helix	trans	-61.7	-37.5	-176.4	-173.3	179.8	179.5	-178.8	0	112.7	E105 Q106 G111	E105-K109 WeakPolarHBondContact O-CB 3.29Å; E105-K109 PolarHBondContact O-N 3.28Å; Q106-K109 PolarHBondContact O-N 3.02Å; K109-G111 VanDerWaalsContact C-N 3.26Å
110	E	89.9	Confident	89.8	Confident	101 Å²	101	67.9 Å²	67.9	47%	0.472	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-0.7	177.5	-66.4	-177.1	-162.7	0	0	112.9	K100 L102 Q106 I108 A112	K100-E110 IonicContact NZ-OE1 2.77Å; K100-E110 PolarHBondContact NZ-OE1 3.07Å; L102-E110 HydrophobicContact CD1-CB 4.38Å; L102-E110 WeakPolarHBondContact CD1-OE2 3.19Å; L102-E110 VanDerWaalsContact CD2-OE2 3.31Å; L102-E110 WeakPolarHBondContact CD2-OE2 3.34Å; Q106-E110 WeakPolarHBondContact O-CB 3.39Å; Q106-E110 WeakPolarHBondContact O-CG 2.95Å; Q106-E110 PolarHBondContact O-N 3.26Å; I108-E110 VanDerWaalsContact C-N 3.3Å; I108-E110 PolarHBondContact O-N 2.73Å; E110-A112 PolarHBondContact O-N 3.05Å
111	G	86.1	Confident	90.7	Very high	61 Å²	61	62.8 Å²	62.8	63%	0.629	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	13.7	-179.7	0	0	0	0	0	114.2	A107 I108 K109 I113	A107-G111 PolarHBondContact O-N 3.01Å; I108-G111 PolarHBondContact O-N 3.17Å; K109-G111 VanDerWaalsContact C-N 3.26Å; G111-I113 VanDerWaalsContact C-N 3.31Å
112	A	86.3	Confident	91.2	Very high	53 Å²	53	61.3 Å²	61.3	44%	0.438	32%	0.321	S	S	.	.	S	Bend	trans	-73.2	-23.8	179.5	0	0	0	0	0	112.6	L102 A107 E110	L102-A112 HydrophobicContact CD1-CB 3.98Å; A107-A112 HydrophobicContact CB-CB 4.34Å; A107-A112 PolarHBondContact O-N 3.25Å; E110-A112 PolarHBondContact O-N 3.05Å
113	I	91.2	Very high	91.8	Very high	12 Å²	12	60.5 Å²	60.5	6%	0.062	32%	0.317	C	S	.	.	S	Bend	trans	-129.5	147.3	173.8	63.8	168.8	0	0	0	111.4	F104 A107 I108 G111 M316	F104-I113 HydrophobicContact CD2-CD1 3.27Å; F104-I113 HydrophobicContact CE2-CD1 3.41Å; F104-I113 VanDerWaalsContact CE2-CD1 3.41Å; F104-I113 HydrophobicContact CG-CD1 4.36Å; A107-I113 HydrophobicContact CB-CB 4.47Å; A107-I113 HydrophobicContact CB-CD1 3.9Å; A107-I113 HydrophobicContact CB-CG1 3.7Å; A107-I113 HydrophobicContact CB-CG2 4.06Å; A107-I113 PolarHBondContact O-N 3.27Å; I108-I113 HydrophobicContact CG1-CD1 3.78Å; I108-I113 HydrophobicContact CG1-CG1 3.85Å; G111-I113 VanDerWaalsContact C-N 3.31Å; I113-M316 HydrophobicContact CG2-CG 4.28Å
114	K	92	Very high	92.1	Very high	96 Å²	96	57.6 Å²	57.6	42%	0.417	30%	0.301	S	S	.	.			trans	-97.1	139	174.4	-62.2	177.2	-175.3	168.1	0	110.1	L118 E122 Y152 M316	K114-L118 HydrophobicContact CB-CD1 4.34Å; K114-L118 HydrophobicContact CB-CG 4.14Å; K114-E122 IonicContact NZ-OE1 3.37Å; K114-E122 PolarHBondContact NZ-OE1 3.23Å; K114-E122 IonicContact NZ-OE2 2.66Å; K114-Y152 VanDerWaalsContact O-CE1 3.26Å; K114-Y152 WeakPolarHBondContact O-CE1 3.4Å; K114-Y152 PolarHBondContact O-OH 3.47Å; K114-M316 HydrophobicContact CB-CE 4.49Å; K114-M316 HydrophobicContact CB-SD 4.42Å; K114-M316 HydrophobicContact CD-CE 4.18Å; K114-M316 HydrophobicContact CG-CE 4.37Å
115	V	92.3	Very high	92.3	Very high	18 Å²	18	57.3 Å²	57.3	11%	0.109	30%	0.3	C	S	.	.	S	Bend	trans	-112.8	-10.6	174.2	-67.3	0	0	0	0	113.5	F104 I108 E160 E161	F104-V115 HydrophobicContact CE2-CG1 4.48Å; F104-V115 HydrophobicContact CZ-CG1 4.23Å; I108-V115 HydrophobicContact CD1-CG1 3.64Å; I108-V115 HydrophobicContact CG1-CG1 3.72Å; V115-E160 PolarHBondContact O-N 3.24Å; V115-E161 PolarHBondContact O-N 3.24Å
116	K	92.3	Very high	92.4	Very high	108 Å²	108	51.8 Å²	51.8	47%	0.47	27%	0.274	S	S	.	.	S	Bend	trans	-138.6	160.6	178.7	67.6	-178	-175.2	175	0	109.8	L118 E160	K116-L118 PolarHBondContact O-N 2.86Å; K116-E160 HydrophobicContact CB-CB 3.94Å; K116-E160 WeakPolarHBondContact CD-OE2 3.35Å
117	E	90.3	Very high	92.7	Very high	158 Å²	158	48.1 Å²	48.1	74%	0.738	26%	0.257	S	S	*	.	S	Bend	trans	54.3	39.9	174.9	-60.2	172	-167.6	0	0	112.5
118	L	94.1	Very high	93	Very high	14 Å²	14	48 Å²	48	7%	0.073	26%	0.256	C	S	.	.			trans	-74.4	133.3	173.7	-71.5	95.5	0	0	0	109.4	K114 K116 E122 L123 I126 E161 L164	K114-L118 HydrophobicContact CB-CD1 4.34Å; K114-L118 HydrophobicContact CB-CG 4.14Å; K116-L118 PolarHBondContact O-N 2.86Å; L118-E122 HydrophobicContact CB-CB 4.42Å; L118-E122 HydrophobicContact CD2-CB 4.31Å; L118-L123 HydrophobicContact CB-CD2 3.99Å; L118-L123 HydrophobicContact CB-CG 3.95Å; L118-L123 HydrophobicContact CD2-CD2 4.24Å; L118-I126 HydrophobicContact CD2-CD1 3.71Å; L118-E161 HydrophobicContact CB-CG 4.42Å; L118-E161 HydrophobicContact CD1-CB 3.7Å; L118-E161 HydrophobicContact CD1-CG 4.03Å; L118-L164 HydrophobicContact CD1-CD2 4.35Å; L118-L164 HydrophobicContact CD2-CD2 4.01Å
119	S	94.7	Very high	93.1	Very high	51 Å²	51	45.8 Å²	45.8	36%	0.357	25%	0.245	S	C	.	.			trans	-68.4	156.8	173.1	65	0	0	0	0	111.4	P121 E122 L123	S119-P121 VanDerWaalsContact C-N 3.34Å; S119-E122 WeakPolarHBondContact CB-OE2 3.49Å; S119-E122 PolarHBondContact N-OE2 3.18Å; S119-E122 WeakPolarHBondContact O-CB 3.35Å; S119-E122 PolarHBondContact O-N 2.68Å; S119-E122 VanDerWaalsContact O-N 3.11Å; S119-E122 VanDerWaalsContact OG-CD 3.24Å; S119-E122 VanDerWaalsContact OG-CG 3.24Å; S119-E122 WeakPolarHBondContact OG-CG 3.24Å; S119-E122 PolarHBondContact OG-N 3.43Å; S119-E122 PolarHBondContact OG-OE2 2.87Å; S119-L123 PolarHBondContact O-N 2.86Å
120	L	95.1	Very high	93.3	Very high	36 Å²	36	36.8 Å²	36.8	19%	0.188	21%	0.206	C	C	.	.	H	α-helix	trans	-56.1	-42.7	177.5	-57.6	167.8	0	0	0	112.4	E122 L123 I124 E244 Q247 C248 L251	L120-E122 PolarHBondContact O-N 3.13Å; L120-L123 PolarHBondContact O-N 2.87Å; L120-I124 WeakPolarHBondContact O-CB 3.27Å; L120-I124 WeakPolarHBondContact O-CD1 3.36Å; L120-I124 WeakPolarHBondContact O-CG1 3.37Å; L120-I124 PolarHBondContact O-N 3.48Å; L120-E244 HydrophobicContact CD1-CG 4.29Å; L120-Q247 HydrophobicContact CB-CB 3.8Å; L120-Q247 HydrophobicContact CD1-CB 3.71Å; L120-Q247 HydrophobicContact CG-CB 4.4Å; L120-C248 VanDerWaalsContact CD1-SG 3.51Å; L120-L251 HydrophobicContact CD2-CD2 3.71Å
121	P	95.4	Very high	93.7	Very high	29 Å²	29	32.2 Å²	32.2	19%	0.188	18%	0.184	C	C	.	.	H	α-helix	trans	-62.2	-37.3	174.9	-26.6	38.3	0	0	0	114.4	S119 G125 Y299 G300 I301	S119-P121 VanDerWaalsContact C-N 3.34Å; P121-G125 PolarHBondContact O-N 3.26Å; P121-Y299 WeakPolarHBondContact CA-O 3.3Å; P121-Y299 WeakPolarHBondContact CB-O 3.48Å; P121-G300 WeakPolarHBondContact O-CA 3.13Å; P121-I301 HydrophobicContact CB-CG1 3.97Å; P121-I301 PolarHBondContact O-N 3.24Å
122	E	95.1	Very high	94.1	Very high	20 Å²	20	29.4 Å²	29.4	9%	0.093	16%	0.155	C	C	.	.	H	α-helix	trans	-62.3	-49	175.7	-75.2	165.4	143.4	0	0	110.1	K114 L118 S119 L120 I124 G125 I126 I301 M316	K114-E122 IonicContact NZ-OE1 3.37Å; K114-E122 PolarHBondContact NZ-OE1 3.23Å; K114-E122 IonicContact NZ-OE2 2.66Å; L118-E122 HydrophobicContact CB-CB 4.42Å; L118-E122 HydrophobicContact CD2-CB 4.31Å; S119-E122 WeakPolarHBondContact CB-OE2 3.49Å; S119-E122 PolarHBondContact N-OE2 3.18Å; S119-E122 WeakPolarHBondContact O-CB 3.35Å; S119-E122 PolarHBondContact O-N 2.68Å; S119-E122 VanDerWaalsContact O-N 3.11Å; S119-E122 VanDerWaalsContact OG-CD 3.24Å; S119-E122 VanDerWaalsContact OG-CG 3.24Å; S119-E122 WeakPolarHBondContact OG-CG 3.24Å; S119-E122 PolarHBondContact OG-N 3.43Å; S119-E122 PolarHBondContact OG-OE2 2.87Å; L120-E122 PolarHBondContact O-N 3.13Å; E122-I124 PolarHBondContact O-N 2.87Å; E122-G125 PolarHBondContact O-N 3.1Å; E122-I126 WeakPolarHBondContact O-CB 3.21Å; E122-I126 WeakPolarHBondContact O-CD1 3.21Å; E122-I126 VanDerWaalsContact O-CG1 3.25Å; E122-I126 WeakPolarHBondContact O-CG1 3.39Å; E122-I126 PolarHBondContact O-N 3.06Å; E122-I301 HydrophobicContact CB-CD1 4.26Å; E122-I301 HydrophobicContact CG-CD1 3.34Å; E122-I301 HydrophobicContact CG-CG1 4.4Å; E122-M316 HydrophobicContact CB-CE 4.3Å; E122-M316 HydrophobicContact CG-CE 3.78Å; E122-M316 WeakPolarHBondContact OE1-CE 3.41Å
123	L	96.2	Very high	94.5	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.021	14%	0.135	C	C	.	.	H	α-helix	trans	-59.6	-47.7	178.5	-70.1	172.7	0	0	0	112.4	L118 S119 L120 G125 I126 I127 E161 A163 L164 L251	L118-L123 HydrophobicContact CB-CD2 3.99Å; L118-L123 HydrophobicContact CB-CG 3.95Å; L118-L123 HydrophobicContact CD2-CD2 4.24Å; S119-L123 PolarHBondContact O-N 2.86Å; L120-L123 PolarHBondContact O-N 2.87Å; L123-G125 PolarHBondContact O-N 2.78Å; L123-I126 PolarHBondContact O-N 3.44Å; L123-I127 WeakPolarHBondContact O-CB 3.25Å; L123-I127 WeakPolarHBondContact O-CD1 3.26Å; L123-I127 VanDerWaalsContact O-CG1 3.25Å; L123-I127 WeakPolarHBondContact O-CG1 3.41Å; L123-I127 PolarHBondContact O-N 3.07Å; L123-E161 HydrophobicContact CD1-CG 4.34Å; L123-E161 HydrophobicContact CD2-CG 3.96Å; L123-A163 HydrophobicContact CD1-CB 4.45Å; L123-L164 HydrophobicContact CD2-CB 3.75Å; L123-L164 HydrophobicContact CD2-CD2 4.49Å; L123-L164 HydrophobicContact CD2-CG 4.49Å; L123-L251 HydrophobicContact CB-CD1 3.95Å; L123-L251 HydrophobicContact CB-CD2 4.29Å; L123-L251 HydrophobicContact CD1-CD2 3.72Å
124	I	96.6	Very high	94.8	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-59.9	-48	178.8	-68.2	163.5	0	0	0	110.4	L120 E122 I126 I127 D128 Q247 A250 L251 G300	L120-I124 WeakPolarHBondContact O-CB 3.27Å; L120-I124 WeakPolarHBondContact O-CD1 3.36Å; L120-I124 WeakPolarHBondContact O-CG1 3.37Å; L120-I124 PolarHBondContact O-N 3.48Å; E122-I124 PolarHBondContact O-N 2.87Å; I124-I126 PolarHBondContact O-N 2.96Å; I124-I127 PolarHBondContact O-N 3.48Å; I124-D128 PolarHBondContact O-N 3.23Å; I124-Q247 HydrophobicContact CD1-CB 4.36Å; I124-A250 HydrophobicContact CD1-CB 3.76Å; I124-A250 HydrophobicContact CG1-CB 4.42Å; I124-L251 HydrophobicContact CG1-CB 4.19Å; I124-G300 VanDerWaalsContact CG2-CA 3.44Å
125	G	94.1	Very high	95	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.8	-42.6	-179.6	0	0	0	0	0	112.8	P121 E122 L123 T129 R340	P121-G125 PolarHBondContact O-N 3.26Å; E122-G125 PolarHBondContact O-N 3.1Å; L123-G125 PolarHBondContact O-N 2.78Å; G125-T129 WeakPolarHBondContact O-CB 3.37Å; G125-T129 PolarHBondContact O-N 3.5Å; G125-T129 VanDerWaalsContact O-N 3.14Å; G125-T129 PolarHBondContact O-OG1 3.43Å; G125-R340 PolarHBondContact O-NH2 2.82Å; G125-R340 VanDerWaalsContact O-NH2 3.12Å
126	I	95.1	Very high	95.1	Very high	3 Å²	3	21.2 Å²	21.2	2%	0.015	11%	0.108	C	C	.	.	H	α-helix	trans	-62.8	-47	177.4	-69.1	161.6	0	0	0	110.4	L118 E122 L123 I124 T129 C130 Y152 L164 M315 F318	L118-I126 HydrophobicContact CD2-CD1 3.71Å; E122-I126 WeakPolarHBondContact O-CB 3.21Å; E122-I126 WeakPolarHBondContact O-CD1 3.21Å; E122-I126 VanDerWaalsContact O-CG1 3.25Å; E122-I126 WeakPolarHBondContact O-CG1 3.39Å; E122-I126 PolarHBondContact O-N 3.06Å; L123-I126 PolarHBondContact O-N 3.44Å; I124-I126 PolarHBondContact O-N 2.96Å; I126-T129 PolarHBondContact O-N 3.26Å; I126-C130 WeakPolarHBondContact O-CB 3.34Å; I126-C130 PolarHBondContact O-N 2.83Å; I126-Y152 HydrophobicContact CD1-CD2 4.5Å; I126-Y152 HydrophobicContact CD1-CE2 3.65Å; I126-Y152 HydrophobicContact CG1-CE2 4.24Å; I126-Y152 HydrophobicContact CG2-CD2 4.04Å; I126-Y152 HydrophobicContact CG2-CE2 4.23Å; I126-L164 HydrophobicContact CG2-CD1 3.84Å; I126-M315 HydrophobicContact CB-CE 4.37Å; I126-M315 HydrophobicContact CG1-CE 3.84Å; I126-F318 HydrophobicContact CG2-CE2 4.16Å
127	I	96.8	Very high	95.2	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-62.3	-47.8	-179.7	-70.7	167.4	0	0	0	111.6	L123 I124 T129 C130 F131 F167 L251 R254 I255	L123-I127 WeakPolarHBondContact O-CB 3.25Å; L123-I127 WeakPolarHBondContact O-CD1 3.26Å; L123-I127 VanDerWaalsContact O-CG1 3.25Å; L123-I127 WeakPolarHBondContact O-CG1 3.41Å; L123-I127 PolarHBondContact O-N 3.07Å; I124-I127 PolarHBondContact O-N 3.48Å; I127-T129 PolarHBondContact O-N 3.46Å; I127-C130 WeakPolarHBondContact O-CB 3.47Å; I127-C130 PolarHBondContact O-N 2.91Å; I127-F131 HydrophobicContact CG2-CD2 3.94Å; I127-F131 HydrophobicContact CG2-CE2 3.53Å; I127-F131 HydrophobicContact CG2-CZ 4.08Å; I127-F131 PolarHBondContact O-N 2.72Å; I127-F167 HydrophobicContact CB-CE1 4.21Å; I127-F167 HydrophobicContact CB-CE2 4.21Å; I127-F167 HydrophobicContact CB-CZ 4Å; I127-F167 HydrophobicContact CD1-CD2 4.3Å; I127-F167 HydrophobicContact CD1-CG 4.24Å; I127-F167 HydrophobicContact CG1-CD1 3.72Å; I127-F167 HydrophobicContact CG1-CD2 3.95Å; I127-F167 HydrophobicContact CG1-CE1 3.79Å; I127-F167 HydrophobicContact CG1-CE2 4.02Å; I127-F167 HydrophobicContact CG1-CG 3.8Å; I127-F167 HydrophobicContact CG1-CZ 3.95Å; I127-F167 HydrophobicContact CG2-CD2 4.1Å; I127-F167 HydrophobicContact CG2-CE1 4.33Å; I127-F167 HydrophobicContact CG2-CE2 3.49Å; I127-F167 VanDerWaalsContact CG2-CE2 3.49Å; I127-F167 HydrophobicContact CG2-CZ 3.62Å; I127-L251 HydrophobicContact CD1-CD1 3.53Å; I127-R254 HydrophobicContact CG2-CB 3.9Å; I127-R254 HydrophobicContact CG2-CG 4.22Å; I127-I255 HydrophobicContact CD1-CD1 4.11Å
128	D	95.7	Very high	95.3	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-61.5	-37	-179.8	-74	-10.9	0	0	0	111.5	I124 F131 C132 R254 R340	I124-D128 PolarHBondContact O-N 3.23Å; D128-F131 PolarHBondContact O-N 3.29Å; D128-C132 PolarHBondContact O-N 3.01Å; D128-C132 PolarHBondContact O-SG 3.34Å; D128-R254 IonicContact OD1-CZ 3.83Å; D128-R254 IonicContact OD1-NE 3.33Å; D128-R254 PolarHBondContact OD1-NE 2.99Å; D128-R254 IonicContact OD1-NH2 3.98Å; D128-R254 PolarHBondContact OD1-NH2 2.95Å; D128-R254 IonicContact OD2-CZ 2.64Å; D128-R254 IonicContact OD2-NE 3.93Å; D128-R254 PolarHBondContact OD2-NE 3.24Å; D128-R254 IonicContact OD2-NH2 3.46Å; D128-R254 PolarHBondContact OD2-NH2 3.43Å; D128-R340 HydrophobicContact CB-CG 4.37Å
129	T	94.3	Very high	95.1	Very high	4 Å²	4	13.2 Å²	13.2	3%	0.025	7%	0.072	C	C	.	.	H	α-helix	trans	-72.5	-39	178.2	-49.6	0	0	0	0	111.5	G125 I126 I127 F131 C132 C133 P313 M315 F318 R340	G125-T129 WeakPolarHBondContact O-CB 3.37Å; G125-T129 PolarHBondContact O-N 3.5Å; G125-T129 VanDerWaalsContact O-N 3.14Å; G125-T129 PolarHBondContact O-OG1 3.43Å; I126-T129 PolarHBondContact O-N 3.26Å; I127-T129 PolarHBondContact O-N 3.46Å; T129-F131 VanDerWaalsContact C-N 3.29Å; T129-F131 PolarHBondContact O-N 3.42Å; T129-C132 WeakPolarHBondContact O-CB 3.38Å; T129-C132 PolarHBondContact O-N 3.37Å; T129-C132 VanDerWaalsContact O-N 3.16Å; T129-C133 PolarHBondContact O-N 3.07Å; T129-C133 PolarHBondContact O-SG 3.14Å; T129-C133 VanDerWaalsContact O-SG 3.33Å; T129-P313 HydrophobicContact CG2-CB 4.16Å; T129-P313 HydrophobicContact CG2-CG 3.6Å; T129-M315 WeakPolarHBondContact CB-SD 3.5Å; T129-M315 HydrophobicContact CG2-SD 3.5Å; T129-M315 VanDerWaalsContact CG2-SD 3.5Å; T129-M315 PolarHBondContact OG1-SD 3.28Å; T129-F318 HydrophobicContact CG2-CD1 3.97Å; T129-F318 HydrophobicContact CG2-CD2 4.44Å; T129-F318 HydrophobicContact CG2-CE1 3.57Å; T129-F318 HydrophobicContact CG2-CE2 4.08Å; T129-F318 HydrophobicContact CG2-CG 4.38Å; T129-F318 HydrophobicContact CG2-CZ 3.62Å; T129-R340 PolarHBondContact OG1-NH2 3.05Å
130	C	96.2	Very high	94.9	Very high	4 Å²	4	12 Å²	12	3%	0.027	7%	0.067	C	C	.	.	H	α-helix	trans	-58.4	-40.6	171	-84.8	0	0	0	0	112.3	I126 I127 C133 L134 C150 F167 L171	I126-C130 WeakPolarHBondContact O-CB 3.34Å; I126-C130 PolarHBondContact O-N 2.83Å; I127-C130 WeakPolarHBondContact O-CB 3.47Å; I127-C130 PolarHBondContact O-N 2.91Å; C130-C133 PolarHBondContact O-N 3.18Å; C130-L134 WeakPolarHBondContact O-CB 3.33Å; C130-L134 PolarHBondContact O-N 3.25Å; C130-C150 VanDerWaalsContact SG-SG 3.61Å; C130-F167 HydrophobicContact CB-CE1 3.61Å; C130-F167 HydrophobicContact CB-CZ 3.73Å; C130-L171 HydrophobicContact CB-CD2 3.62Å
131	F	97.3	Very high	94.6	Very high	5 Å²	5	13.5 Å²	13.5	2%	0.022	7%	0.074	C	C	.	.	H	α-helix	trans	-64.8	-41.5	173.4	-75.3	-35.8	0	0	0	112.7	I127 D128 T129 C133 L134 I135 F167 F257 T258 M343 F347	I127-F131 HydrophobicContact CG2-CD2 3.94Å; I127-F131 HydrophobicContact CG2-CE2 3.53Å; I127-F131 HydrophobicContact CG2-CZ 4.08Å; I127-F131 PolarHBondContact O-N 2.72Å; D128-F131 PolarHBondContact O-N 3.29Å; T129-F131 VanDerWaalsContact C-N 3.29Å; T129-F131 PolarHBondContact O-N 3.42Å; F131-C133 VanDerWaalsContact C-N 3.32Å; F131-C133 PolarHBondContact O-N 3.24Å; F131-L134 WeakPolarHBondContact O-CB 3.12Å; F131-L134 PolarHBondContact O-N 2.64Å; F131-I135 VanDerWaalsContact O-CG1 3.31Å; F131-I135 WeakPolarHBondContact O-CG1 3.44Å; F131-I135 PolarHBondContact O-N 3.04Å; F131-F167 AromaticContact CE1-CE2 3.91Å; F131-F167 HydrophobicContact CE1-CE2 3.91Å; F131-F167 HydrophobicContact CE1-CZ 4.29Å; F131-F167 HydrophobicContact CE2-CE2 4.49Å; F131-F167 AromaticContact CZ-CE2 3.85Å; F131-F167 HydrophobicContact CZ-CE2 3.85Å; F131-F167 HydrophobicContact CZ-CZ 4.48Å; F131-F257 HydrophobicContact CE1-CD1 4.29Å; F131-F257 HydrophobicContact CE1-CE1 4.38Å; F131-F257 HydrophobicContact CE2-CD1 4.29Å; F131-F257 AromaticContact CZ-CD1 3.76Å; F131-F257 HydrophobicContact CZ-CD1 3.76Å; F131-F257 HydrophobicContact CZ-CE1 4.23Å; F131-T258 WeakPolarHBondContact CZ-OG1 3.24Å; F131-M343 HydrophobicContact CB-CG 4.05Å; F131-M343 HydrophobicContact CB-SD 3.4Å; F131-M343 WeakPolarHBondContact CB-SD 3.35Å; F131-M343 HydrophobicContact CD2-SD 3.77Å; F131-M343 HydrophobicContact CG-SD 4.04Å; F131-F347 HydrophobicContact CB-CE2 3.88Å; F131-F347 HydrophobicContact CB-CZ 4.21Å; F131-F347 HydrophobicContact CD1-CE2 4.06Å; F131-F347 AromaticContact CD1-CZ 3.86Å; F131-F347 HydrophobicContact CD1-CZ 3.86Å; F131-F347 HydrophobicContact CD2-CE2 4.39Å; F131-F347 HydrophobicContact CE1-CZ 4.5Å; F131-F347 AromaticContact CG-CE2 3.88Å; F131-F347 HydrophobicContact CG-CE2 3.88Å; F131-F347 HydrophobicContact CG-CZ 4.14Å
132	C	95.5	Very high	94.4	Very high	3 Å²	3	12.2 Å²	12.2	2%	0.02	7%	0.065	C	C	.	.	H	α-helix	trans	-60.5	-43	174.1	-63.9	0	0	0	0	111.5	D128 T129 I135 T136 I337 I338	D128-C132 PolarHBondContact O-N 3.01Å; D128-C132 PolarHBondContact O-SG 3.34Å; T129-C132 WeakPolarHBondContact O-CB 3.38Å; T129-C132 PolarHBondContact O-N 3.37Å; T129-C132 VanDerWaalsContact O-N 3.16Å; C132-I135 PolarHBondContact O-N 3.35Å; C132-T136 WeakPolarHBondContact O-CB 3.13Å; C132-T136 PolarHBondContact O-N 3.13Å; C132-T136 PolarHBondContact O-OG1 3.05Å; C132-I337 HydrophobicContact CB-CG2 3.71Å; C132-I338 HydrophobicContact CB-CG1 3.86Å
133	C	95.1	Very high	94.2	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-62.3	-43.4	174.2	-69.7	0	0	0	0	112.4	T129 C130 F131 I135 T136 W137 T146 V147	T129-C133 PolarHBondContact O-N 3.07Å; T129-C133 PolarHBondContact O-SG 3.14Å; T129-C133 VanDerWaalsContact O-SG 3.33Å; C130-C133 PolarHBondContact O-N 3.18Å; F131-C133 VanDerWaalsContact C-N 3.32Å; F131-C133 PolarHBondContact O-N 3.24Å; C133-I135 PolarHBondContact O-N 3.22Å; C133-T136 PolarHBondContact O-N 2.76Å; C133-W137 PolarHBondContact O-N 3.3Å; C133-T146 WeakPolarHBondContact O-CB 3.43Å; C133-V147 HydrophobicContact CB-CG2 4.34Å
134	L	96.6	Very high	93.9	Very high	3 Å²	3	11.1 Å²	11.1	2%	0.016	6%	0.06	C	C	.	.	H	α-helix	trans	-58.6	-47.7	175.9	175.8	68.8	0	0	0	111.3	C130 F131 W137 L138 L171 V174 F347	C130-L134 WeakPolarHBondContact O-CB 3.33Å; C130-L134 PolarHBondContact O-N 3.25Å; F131-L134 WeakPolarHBondContact O-CB 3.12Å; F131-L134 PolarHBondContact O-N 2.64Å; L134-W137 HydrophobicContact CD1-CE3 3.86Å; L134-W137 HydrophobicContact CD1-CZ3 4.05Å; L134-W137 WeakPolarHBondContact O-CB 3.27Å; L134-W137 PolarHBondContact O-N 3.25Å; L134-L138 HydrophobicContact CG-CD1 4.34Å; L134-L138 WeakPolarHBondContact O-CG 3.24Å; L134-L138 PolarHBondContact O-N 3.34Å; L134-L171 HydrophobicContact CB-CD1 4.15Å; L134-L171 HydrophobicContact CD1-CD1 4.3Å; L134-L171 HydrophobicContact CD2-CD1 4.06Å; L134-L171 HydrophobicContact CG-CD1 4.4Å; L134-V174 HydrophobicContact CD1-CG1 4.16Å; L134-V174 HydrophobicContact CD2-CG1 3.94Å; L134-F347 HydrophobicContact CD2-CZ 4.38Å
135	I	96.3	Very high	93.5	Very high	1 Å²	1	12.6 Å²	12.6	1%	0.005	7%	0.067	C	C	.	.	H	α-helix	trans	-64	-44.8	179.5	-66.8	166.4	0	0	0	110.5	F131 C132 C133 W137 L138 E139 I338 M343 Y346 F347	F131-I135 VanDerWaalsContact O-CG1 3.31Å; F131-I135 WeakPolarHBondContact O-CG1 3.44Å; F131-I135 PolarHBondContact O-N 3.04Å; C132-I135 PolarHBondContact O-N 3.35Å; C133-I135 PolarHBondContact O-N 3.22Å; I135-W137 PolarHBondContact O-N 3.32Å; I135-L138 PolarHBondContact O-N 2.96Å; I135-L138 VanDerWaalsContact O-N 3.07Å; I135-E139 PolarHBondContact O-N 3.26Å; I135-I338 HydrophobicContact CB-CD1 3.7Å; I135-I338 HydrophobicContact CB-CG1 4.28Å; I135-I338 HydrophobicContact CD1-CD1 3.67Å; I135-I338 HydrophobicContact CG1-CD1 4.3Å; I135-I338 HydrophobicContact CG2-CD1 3.52Å; I135-I338 HydrophobicContact CG2-CG1 4.23Å; I135-M343 HydrophobicContact CD1-CB 4.21Å; I135-M343 HydrophobicContact CD1-CG 3.79Å; I135-Y346 HydrophobicContact CB-CD1 4.1Å; I135-Y346 HydrophobicContact CB-CE1 4.22Å; I135-Y346 HydrophobicContact CB-CG 4.45Å; I135-Y346 HydrophobicContact CD1-CD1 3.65Å; I135-Y346 HydrophobicContact CD1-CE1 4.47Å; I135-Y346 HydrophobicContact CD1-CG 4.06Å; I135-Y346 HydrophobicContact CG1-CD1 3.47Å; I135-Y346 VanDerWaalsContact CG1-CD1 3.47Å; I135-Y346 HydrophobicContact CG1-CE1 3.8Å; I135-Y346 HydrophobicContact CG1-CG 4.16Å; I135-Y346 HydrophobicContact CG2-CD1 3.53Å; I135-Y346 HydrophobicContact CG2-CD2 3.64Å; I135-Y346 HydrophobicContact CG2-CE1 3.71Å; I135-Y346 HydrophobicContact CG2-CE2 3.83Å; I135-Y346 HydrophobicContact CG2-CG 3.48Å; I135-Y346 VanDerWaalsContact CG2-CG 3.48Å; I135-F347 HydrophobicContact CD1-CD2 4.01Å; I135-F347 HydrophobicContact CD1-CE1 4.39Å; I135-F347 HydrophobicContact CD1-CE2 3.71Å; I135-F347 HydrophobicContact CD1-CG 4.48Å; I135-F347 HydrophobicContact CD1-CZ 3.9Å; I135-F347 HydrophobicContact CG1-CE1 4.32Å; I135-F347 HydrophobicContact CG1-CE2 4.36Å; I135-F347 HydrophobicContact CG1-CZ 4.04Å
136	T	94	Very high	93.5	Very high	2 Å²	2	12.6 Å²	12.6	1%	0.012	7%	0.067	C	C	.	.	H	α-helix	trans	-59.8	-38	178.4	-51.6	0	0	0	0	111.3	C132 C133 E139 H141 T146 K336 I337 I338	C132-T136 WeakPolarHBondContact O-CB 3.13Å; C132-T136 PolarHBondContact O-N 3.13Å; C132-T136 PolarHBondContact O-OG1 3.05Å; C133-T136 PolarHBondContact O-N 2.76Å; T136-E139 PolarHBondContact O-N 2.71Å; T136-H141 HydrophobicContact CG2-CB 4.12Å; T136-H141 WeakPolarHBondContact CG2-CD2 3.42Å; T136-H141 WeakPolarHBondContact O-CB 3.32Å; T136-H141 PolarHBondContact O-CD2 2.78Å; T136-H141 VanDerWaalsContact O-CD2 3.29Å; T136-H141 PolarHBondContact O-N 3.14Å; T136-T146 HydrophobicContact CG2-CG2 3.7Å; T136-K336 WeakPolarHBondContact CG2-O 3.2Å; T136-I337 HydrophobicContact CG2-CD1 4.07Å; T136-I338 PolarHBondContact OG1-N 3.39Å
137	W	93.8	Very high	93.5	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-65.7	-44.4	172.5	171.8	56	0	0	0	112.9	C133 L134 I135 E139 G140 L143 T146 V147 C175 A178 R179 F193 Q194	C133-W137 PolarHBondContact O-N 3.3Å; L134-W137 HydrophobicContact CD1-CE3 3.86Å; L134-W137 HydrophobicContact CD1-CZ3 4.05Å; L134-W137 WeakPolarHBondContact O-CB 3.27Å; L134-W137 PolarHBondContact O-N 3.25Å; I135-W137 PolarHBondContact O-N 3.32Å; W137-E139 PolarHBondContact O-N 3.05Å; W137-G140 PolarHBondContact O-N 3.32Å; W137-L143 HydrophobicContact CD2-CD2 3.59Å; W137-L143 HydrophobicContact CD2-CG 4.1Å; W137-L143 VanDerWaalsContact CE2-CD2 3.45Å; W137-L143 HydrophobicContact CE3-CD2 4.2Å; W137-L143 HydrophobicContact CG-CD2 3.78Å; W137-L143 HydrophobicContact CG-CG 4.13Å; W137-L143 HydrophobicContact CH2-CD2 4.42Å; W137-L143 HydrophobicContact CZ2-CD1 3.85Å; W137-L143 HydrophobicContact CZ2-CD2 3.83Å; W137-L143 HydrophobicContact CZ2-CG 3.91Å; W137-T146 WeakPolarHBondContact CB-OG1 3.3Å; W137-V147 HydrophobicContact CB-CG2 4.27Å; W137-C175 HydrophobicContact CH2-CB 3.96Å; W137-C175 VanDerWaalsContact CH2-O 3.25Å; W137-C175 WeakPolarHBondContact CH2-O 3.22Å; W137-C175 HydrophobicContact CZ3-CB 3.89Å; W137-A178 HydrophobicContact CH2-CB 4.15Å; W137-A178 HydrophobicContact CZ3-CB 4.03Å; W137-R179 HydrophobicContact CH2-CB 4.11Å; W137-R179 HydrophobicContact CZ2-CB 4.2Å; W137-F193 AromaticContact CD2-CE2 3.92Å; W137-F193 HydrophobicContact CD2-CE2 3.92Å; W137-F193 HydrophobicContact CD2-CZ 4.16Å; W137-F193 AromaticContact CE2-CE2 3.46Å; W137-F193 VanDerWaalsContact CE2-CE2 3.46Å; W137-F193 AromaticContact CE2-CZ 3.3Å; W137-F193 HydrophobicContact CE3-CE2 4.41Å; W137-F193 HydrophobicContact CG-CE2 4.45Å; W137-F193 HydrophobicContact CH2-CE2 4.2Å; W137-F193 AromaticContact CH2-CZ 3.6Å; W137-F193 HydrophobicContact CH2-CZ 3.6Å; W137-F193 AromaticContact CZ2-CE1 3.9Å; W137-F193 HydrophobicContact CZ2-CE1 3.9Å; W137-F193 AromaticContact CZ2-CE2 3.71Å; W137-F193 HydrophobicContact CZ2-CE2 3.71Å; W137-F193 AromaticContact CZ2-CZ 3.05Å; W137-F193 HydrophobicContact CZ2-CZ 3.05Å; W137-F193 HydrophobicContact CZ3-CZ 4.33Å; W137-F193 AromaticContact NE1-CE2 3.54Å; W137-F193 AromaticContact NE1-CZ 3.58Å; W137-Q194 PolarHBondContact NE1-O 3.42Å
138	L	93.1	Very high	93.3	Very high	5 Å²	5	12.6 Å²	12.6	3%	0.026	7%	0.067	C	C	.	.	H	α-helix	trans	-62.8	-22	177.3	-69.3	176.3	0	0	0	113.2	L134 I135 G140 A178 F193 V383 L384	L134-L138 HydrophobicContact CG-CD1 4.34Å; L134-L138 WeakPolarHBondContact O-CG 3.24Å; L134-L138 PolarHBondContact O-N 3.34Å; I135-L138 PolarHBondContact O-N 2.96Å; I135-L138 VanDerWaalsContact O-N 3.07Å; L138-G140 VanDerWaalsContact C-N 3.28Å; L138-A178 HydrophobicContact CD2-CB 4.25Å; L138-F193 HydrophobicContact CD2-CE2 4.28Å; L138-V383 WeakPolarHBondContact O-CG1 3.46Å; L138-L384 HydrophobicContact CD1-CD2 4.15Å; L138-L384 HydrophobicContact CD2-CB 4.23Å; L138-L384 HydrophobicContact CD2-CD2 4.27Å
139	E	90.9	Very high	93.1	Very high	107 Å²	107	12.8 Å²	12.8	50%	0.5	7%	0.068	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	8.9	173.5	-68.7	-67.2	122	0	0	113.5	I135 T136 W137 Y346	I135-E139 PolarHBondContact O-N 3.26Å; T136-E139 PolarHBondContact O-N 2.71Å; W137-E139 PolarHBondContact O-N 3.05Å; E139-Y346 HydrophobicContact CG-CE2 4.14Å; E139-Y346 VanDerWaalsContact OE1-CE2 3.24Å; E139-Y346 WeakPolarHBondContact OE1-CE2 3.46Å; E139-Y346 PolarHBondContact OE1-OH 3.14Å
140	G	89.2	Confident	93.1	Very high	25 Å²	25	12.6 Å²	12.6	26%	0.258	7%	0.067	S	C	.	.	T	Hydrogen-bonded Turn	trans	108.2	-0.5	167.1	0	0	0	0	0	115.9	W137 L138	W137-G140 PolarHBondContact O-N 3.32Å; L138-G140 VanDerWaalsContact C-N 3.28Å
141	H	89.7	Confident	93	Very high	69 Å²	69	12.7 Å²	12.7	32%	0.319	7%	0.067	S	C	.	.			trans	-74.3	166.2	175.6	-69	-79.1	0	0	0	112.5	T136 T146 A335	T136-H141 HydrophobicContact CG2-CB 4.12Å; T136-H141 WeakPolarHBondContact CG2-CD2 3.42Å; T136-H141 WeakPolarHBondContact O-CB 3.32Å; T136-H141 PolarHBondContact O-CD2 2.78Å; T136-H141 VanDerWaalsContact O-CD2 3.29Å; T136-H141 PolarHBondContact O-N 3.14Å; H141-T146 HydrophobicContact CB-CG2 3.74Å; H141-A335 HydrophobicContact CB-CB 4.1Å
142	S	89.8	Confident	92.9	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.007	7%	0.067	C	C	.	.			trans	-71.9	140.4	178	-179.3	0	0	0	0	112.9	A144 Q145 T146 Q194 Y198	S142-A144 PolarHBondContact O-N 3.11Å; S142-A144 PolarHBondContact OG-N 3.38Å; S142-Q145 PolarHBondContact O-N 2.78Å; S142-Q145 VanDerWaalsContact O-N 3.14Å; S142-T146 WeakPolarHBondContact O-CG2 3.4Å; S142-T146 PolarHBondContact O-N 3.28Å; S142-T146 PolarHBondContact O-OG1 2.99Å; S142-Q194 VanDerWaalsContact CB-NE2 3.27Å; S142-Q194 PolarHBondContact OG-NE2 2.7Å; S142-Y198 WeakPolarHBondContact OG-CE2 3.45Å; S142-Y198 PolarHBondContact OG-OH 3.41Å; S142-Y198 VanDerWaalsContact OG-OH 3.05Å
143	L	91.3	Very high	92.9	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	-54.7	-41	169.3	-85.1	168.6	0	0	0	112.4	W137 Q145 T146 V147 F148 T197 M202	W137-L143 HydrophobicContact CD2-CD2 3.59Å; W137-L143 HydrophobicContact CD2-CG 4.1Å; W137-L143 VanDerWaalsContact CE2-CD2 3.45Å; W137-L143 HydrophobicContact CE3-CD2 4.2Å; W137-L143 HydrophobicContact CG-CD2 3.78Å; W137-L143 HydrophobicContact CG-CG 4.13Å; W137-L143 HydrophobicContact CH2-CD2 4.42Å; W137-L143 HydrophobicContact CZ2-CD1 3.85Å; W137-L143 HydrophobicContact CZ2-CD2 3.83Å; W137-L143 HydrophobicContact CZ2-CG 3.91Å; L143-Q145 PolarHBondContact O-N 2.77Å; L143-T146 PolarHBondContact O-N 3.27Å; L143-V147 HydrophobicContact CD2-CB 3.97Å; L143-V147 HydrophobicContact CD2-CG2 4.04Å; L143-V147 PolarHBondContact O-N 3.45Å; L143-F148 HydrophobicContact CB-CD2 3.68Å; L143-F148 HydrophobicContact CB-CE2 3.69Å; L143-F148 HydrophobicContact CD1-CE2 4.02Å; L143-F148 HydrophobicContact CD2-CE2 4.36Å; L143-F148 HydrophobicContact CG-CE2 4.22Å; L143-F148 WeakPolarHBondContact O-CB 3.16Å; L143-F148 PolarHBondContact O-N 3.37Å; L143-T197 HydrophobicContact CD1-CG2 4.37Å; L143-M202 HydrophobicContact CD1-CE 3.58Å
144	A	90.3	Very high	92.8	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.008	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-60.8	-30.7	-179.2	0	0	0	0	0	112.6	S142 Y198 N323 L327	S142-A144 PolarHBondContact O-N 3.11Å; S142-A144 PolarHBondContact OG-N 3.38Å; A144-Y198 HydrophobicContact CB-CD1 4.47Å; A144-Y198 HydrophobicContact CB-CD2 3.66Å; A144-Y198 HydrophobicContact CB-CE2 3.73Å; A144-Y198 HydrophobicContact CB-CG 4.04Å; A144-N323 HydrophobicContact CB-CB 3.93Å; A144-N323 WeakPolarHBondContact O-CB 3.36Å; A144-N323 PolarHBondContact O-ND2 3.15Å; A144-L327 HydrophobicContact CB-CD2 3.76Å
145	Q	88.9	Confident	92.6	Very high	32 Å²	32	16.9 Å²	16.9	15%	0.15	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-99.8	-2.8	-176.6	-55.2	-175	-67	0	0	113.3	S142 L143 T149 H312 L327 R333 A335	S142-Q145 PolarHBondContact O-N 2.78Å; S142-Q145 VanDerWaalsContact O-N 3.14Å; L143-Q145 PolarHBondContact O-N 2.77Å; Q145-T149 VanDerWaalsContact C-CG2 3.44Å; Q145-T149 WeakPolarHBondContact O-CG2 3.41Å; Q145-H312 PolarHBondContact O-CE1 3.42Å; Q145-L327 HydrophobicContact CG-CD1 4Å; Q145-L327 HydrophobicContact CG-CD2 3.63Å; Q145-L327 HydrophobicContact CG-CG 4.45Å; Q145-R333 PolarHBondContact NE2-O 3.32Å; Q145-A335 HydrophobicContact CB-CB 3.95Å
146	T	93	Very high	92.5	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125	-95.6	-176.7	55.2	0	0	0	0	110.2	C133 T136 W137 H141 S142 L143 F148 T149 A335 I337	C133-T146 WeakPolarHBondContact O-CB 3.43Å; T136-T146 HydrophobicContact CG2-CG2 3.7Å; W137-T146 WeakPolarHBondContact CB-OG1 3.3Å; H141-T146 HydrophobicContact CB-CG2 3.74Å; S142-T146 WeakPolarHBondContact O-CG2 3.4Å; S142-T146 PolarHBondContact O-N 3.28Å; S142-T146 PolarHBondContact O-OG1 2.99Å; L143-T146 PolarHBondContact O-N 3.27Å; T146-F148 VanDerWaalsContact C-N 3.32Å; T146-F148 PolarHBondContact O-N 3.24Å; T146-T149 WeakPolarHBondContact O-CB 3.34Å; T146-T149 WeakPolarHBondContact O-CG2 3.46Å; T146-T149 PolarHBondContact O-N 3.27Å; T146-T149 PolarHBondContact O-OG1 3.29Å; T146-A335 HydrophobicContact CG2-CB 3.99Å; T146-I337 HydrophobicContact CG2-CD1 4.02Å
147	V	94.8	Very high	92.4	Very high	2 Å²	2	21.6 Å²	21.6	1%	0.012	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-58.3	-42.4	-174.8	179.2	0	0	0	0	111.6	C133 W137 L143 T149 C150 V153 L171	C133-V147 HydrophobicContact CB-CG2 4.34Å; W137-V147 HydrophobicContact CB-CG2 4.27Å; L143-V147 HydrophobicContact CD2-CB 3.97Å; L143-V147 HydrophobicContact CD2-CG2 4.04Å; L143-V147 PolarHBondContact O-N 3.45Å; V147-T149 PolarHBondContact O-N 3.29Å; V147-C150 VanDerWaalsContact O-CB 3.32Å; V147-C150 WeakPolarHBondContact O-CB 3.21Å; V147-C150 PolarHBondContact O-N 3.43Å; V147-C150 VanDerWaalsContact O-N 3.14Å; V147-V153 HydrophobicContact CG1-CG2 4.48Å; V147-L171 HydrophobicContact CG1-CD2 4.27Å; V147-L171 HydrophobicContact CG1-CG 4.49Å
148	F	93.9	Very high	92.4	Very high	1 Å²	1	25.1 Å²	25.1	0%	0.004	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-81.1	6.7	-179.5	-61.5	-43	0	0	0	114.3	L143 T146 V153 H154 L172 F200 M202 N323	L143-F148 HydrophobicContact CB-CD2 3.68Å; L143-F148 HydrophobicContact CB-CE2 3.69Å; L143-F148 HydrophobicContact CD1-CE2 4.02Å; L143-F148 HydrophobicContact CD2-CE2 4.36Å; L143-F148 HydrophobicContact CG-CE2 4.22Å; L143-F148 WeakPolarHBondContact O-CB 3.16Å; L143-F148 PolarHBondContact O-N 3.37Å; T146-F148 VanDerWaalsContact C-N 3.32Å; T146-F148 PolarHBondContact O-N 3.24Å; F148-V153 HydrophobicContact CD1-CG2 3.89Å; F148-V153 HydrophobicContact CE1-CG2 4.43Å; F148-H154 PolarHBondContact O-CE1 3.33Å; F148-H154 PolarHBondContact O-NE2 2.98Å; F148-L172 HydrophobicContact CE1-CD2 3.93Å; F148-F200 HydrophobicContact CB-CD2 4.31Å; F148-F200 HydrophobicContact CB-CE2 4.07Å; F148-F200 HydrophobicContact CB-CZ 4.2Å; F148-F200 HydrophobicContact CD1-CB 4.31Å; F148-F200 HydrophobicContact CD1-CD1 4.14Å; F148-F200 HydrophobicContact CD1-CD2 4.36Å; F148-F200 HydrophobicContact CD1-CG 4.02Å; F148-F200 HydrophobicContact CD2-CB 4.06Å; F148-F200 HydrophobicContact CD2-CD1 4.46Å; F148-F200 AromaticContact CD2-CD2 3.27Å; F148-F200 HydrophobicContact CD2-CD2 3.27Å; F148-F200 AromaticContact CD2-CE2 3.81Å; F148-F200 HydrophobicContact CD2-CE2 3.81Å; F148-F200 AromaticContact CD2-CG 3.68Å; F148-F200 HydrophobicContact CD2-CG 3.68Å; F148-F200 HydrophobicContact CE1-CB 3.75Å; F148-F200 HydrophobicContact CE1-CD1 4.32Å; F148-F200 AromaticContact CE1-CG 3.97Å; F148-F200 HydrophobicContact CE1-CG 3.97Å; F148-F200 HydrophobicContact CE2-CB 3.45Å; F148-F200 VanDerWaalsContact CE2-CB 3.45Å; F148-F200 AromaticContact CE2-CD2 3.51Å; F148-F200 HydrophobicContact CE2-CD2 3.51Å; F148-F200 HydrophobicContact CE2-CE2 4.46Å; F148-F200 AromaticContact CE2-CG 3.62Å; F148-F200 HydrophobicContact CE2-CG 3.62Å; F148-F200 HydrophobicContact CG-CB 4.46Å; F148-F200 HydrophobicContact CG-CD1 4.23Å; F148-F200 AromaticContact CG-CD2 3.76Å; F148-F200 HydrophobicContact CG-CD2 3.76Å; F148-F200 HydrophobicContact CG-CE1 4.47Å; F148-F200 HydrophobicContact CG-CE2 4.03Å; F148-F200 AromaticContact CG-CG 3.89Å; F148-F200 HydrophobicContact CG-CG 3.89Å; F148-F200 HydrophobicContact CG-CZ 4.39Å; F148-F200 HydrophobicContact CZ-CB 3.27Å; F148-F200 HydrophobicContact CZ-CD2 4.16Å; F148-F200 AromaticContact CZ-CG 3.77Å; F148-F200 HydrophobicContact CZ-CG 3.77Å; F148-M202 HydrophobicContact CE1-SD 4.43Å; F148-M202 HydrophobicContact CE2-CE 4.09Å; F148-M202 HydrophobicContact CZ-CE 3.53Å; F148-M202 HydrophobicContact CZ-SD 3.83Å; F148-N323 WeakPolarHBondContact CB-ND2 3.43Å; F148-N323 PolarHBondContact O-ND2 3.13Å
149	T	92.2	Very high	92.6	Very high	3 Å²	3	25 Å²	25	2%	0.018	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-73	-23.2	161.8	66.4	0	0	0	0	111.1	Q145 T146 V147 L151 F318 E319	Q145-T149 VanDerWaalsContact C-CG2 3.44Å; Q145-T149 WeakPolarHBondContact O-CG2 3.41Å; T146-T149 WeakPolarHBondContact O-CB 3.34Å; T146-T149 WeakPolarHBondContact O-CG2 3.46Å; T146-T149 PolarHBondContact O-N 3.27Å; T146-T149 PolarHBondContact O-OG1 3.29Å; V147-T149 PolarHBondContact O-N 3.29Å; T149-L151 PolarHBondContact O-N 3.11Å; T149-F318 CarbonylContact O-C 3.6Å; T149-F318 WeakPolarHBondContact O-CA 3.49Å; T149-E319 PolarHBondContact O-N 2.97Å
150	C	94.1	Very high	92.8	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.007	14%	0.135	C	C	.	.	B	Isolated β-bridge	trans	-73.2	116.1	170.7	-177.3	0	0	0	0	110.1	C130 V147 Y152 V153 H154 G317 F318	C130-C150 VanDerWaalsContact SG-SG 3.61Å; V147-C150 VanDerWaalsContact O-CB 3.32Å; V147-C150 WeakPolarHBondContact O-CB 3.21Å; V147-C150 PolarHBondContact O-N 3.43Å; V147-C150 VanDerWaalsContact O-N 3.14Å; C150-Y152 VanDerWaalsContact C-N 3.3Å; C150-Y152 PolarHBondContact O-N 3.12Å; C150-V153 HydrophobicContact CB-CG2 4.2Å; C150-V153 WeakPolarHBondContact O-CG2 3.45Å; C150-H154 PolarHBondContact O-CD2 3.08Å; C150-H154 PolarHBondContact O-NE2 2.75Å; C150-G317 CarbonylContact C-O 3.57Å; C150-G317 WeakPolarHBondContact CA-O 3.34Å; C150-F318 HydrophobicContact CB-CD1 3.96Å; C150-F318 HydrophobicContact CB-CE1 3.6Å; C150-F318 HydrophobicContact CB-CZ 3.93Å
151	L	94.1	Very high	93.1	Very high	6 Å²	6	26.6 Å²	26.6	3%	0.031	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-69.6	-29.3	-179.4	-59.3	-179.4	0	0	0	112	F104 A107 T149 V153 H154 G317 E319 V322	F104-L151 HydrophobicContact CB-CB 4.08Å; F104-L151 HydrophobicContact CD2-CB 3.71Å; F104-L151 WeakPolarHBondContact CD2-O 3.47Å; F104-L151 HydrophobicContact CG-CB 4.34Å; F104-L151 WeakPolarHBondContact CG-O 3.45Å; A107-L151 HydrophobicContact CB-CD1 4.01Å; T149-L151 PolarHBondContact O-N 3.11Å; L151-V153 PolarHBondContact O-N 3.36Å; L151-H154 WeakPolarHBondContact O-CB 3.37Å; L151-H154 PolarHBondContact O-N 3.13Å; L151-G317 PolarHBondContact N-O 3.22Å; L151-E319 HydrophobicContact CD1-CB 4.38Å; L151-E319 HydrophobicContact CD2-CB 4.24Å; L151-E319 HydrophobicContact CG-CB 4.41Å; L151-V322 HydrophobicContact CD2-CB 4.21Å; L151-V322 HydrophobicContact CD2-CG1 4.21Å; L151-V322 HydrophobicContact CD2-CG2 3.82Å
152	Y	95.2	Very high	93.4	Very high	1 Å²	1	26.5 Å²	26.5	0%	0.004	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-60.1	-31.3	-180	-66.6	-67.9	0	0	0	113.4	F104 K114 I126 C150 H154 I159 L164 M316	F104-Y152 AromaticContact CE2-CD1 3.77Å; F104-Y152 HydrophobicContact CE2-CD1 3.77Å; F104-Y152 HydrophobicContact CE2-CE1 4.26Å; F104-Y152 HydrophobicContact CE2-CG 4.47Å; F104-Y152 HydrophobicContact CZ-CD1 4.37Å; K114-Y152 VanDerWaalsContact O-CE1 3.26Å; K114-Y152 WeakPolarHBondContact O-CE1 3.4Å; K114-Y152 PolarHBondContact O-OH 3.47Å; I126-Y152 HydrophobicContact CD1-CD2 4.5Å; I126-Y152 HydrophobicContact CD1-CE2 3.65Å; I126-Y152 HydrophobicContact CG1-CE2 4.24Å; I126-Y152 HydrophobicContact CG2-CD2 4.04Å; I126-Y152 HydrophobicContact CG2-CE2 4.23Å; C150-Y152 VanDerWaalsContact C-N 3.3Å; C150-Y152 PolarHBondContact O-N 3.12Å; Y152-H154 VanDerWaalsContact C-N 3.3Å; Y152-H154 PolarHBondContact O-N 3.29Å; Y152-I159 HydrophobicContact CD1-CD1 4.14Å; Y152-I159 HydrophobicContact CD1-CG1 4.31Å; Y152-L164 HydrophobicContact CD1-CD2 3.64Å; Y152-L164 HydrophobicContact CD1-CG 4.48Å; Y152-L164 HydrophobicContact CD2-CD2 4.26Å; Y152-L164 HydrophobicContact CE1-CD2 3.62Å; Y152-L164 HydrophobicContact CE2-CD2 4.23Å; Y152-L164 HydrophobicContact CG-CD2 3.97Å; Y152-M316 PolarHBondContact OH-SD 3.38Å
153	V	94.9	Very high	93.8	Very high	3 Å²	3	26.7 Å²	26.7	2%	0.018	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-81.5	-8.5	179.7	-59.8	0	0	0	0	113.2	V147 F148 C150 L151 A168 L171 L172	V147-V153 HydrophobicContact CG1-CG2 4.48Å; F148-V153 HydrophobicContact CD1-CG2 3.89Å; F148-V153 HydrophobicContact CE1-CG2 4.43Å; C150-V153 HydrophobicContact CB-CG2 4.2Å; C150-V153 WeakPolarHBondContact O-CG2 3.45Å; L151-V153 PolarHBondContact O-N 3.36Å; V153-A168 HydrophobicContact CG1-CB 4.23Å; V153-L171 HydrophobicContact CG1-CD2 4.1Å; V153-L172 HydrophobicContact CB-CD1 4.37Å; V153-L172 HydrophobicContact CB-CD2 4.01Å; V153-L172 HydrophobicContact CB-CG 4.16Å; V153-L172 HydrophobicContact CG1-CG 4.48Å
154	H	93.3	Very high	94.1	Very high	50 Å²	50	26.8 Å²	26.8	23%	0.231	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-38.3	179	-66.2	-172.5	0	0	0	111.9	F104 F148 C150 L151 Y152 F200	F104-H154 HydrophobicContact CB-CB 4.42Å; F148-H154 PolarHBondContact O-CE1 3.33Å; F148-H154 PolarHBondContact O-NE2 2.98Å; C150-H154 PolarHBondContact O-CD2 3.08Å; C150-H154 PolarHBondContact O-NE2 2.75Å; L151-H154 WeakPolarHBondContact O-CB 3.37Å; L151-H154 PolarHBondContact O-N 3.13Å; Y152-H154 VanDerWaalsContact C-N 3.3Å; Y152-H154 PolarHBondContact O-N 3.29Å; H154-F200 AromaticContact CD2-CE1 3.63Å; H154-F200 AromaticContact CE1-CE1 3.93Å; H154-F200 AromaticContact CG-CE1 3.9Å; H154-F200 AromaticContact NE2-CE1 3.67Å
155	N	92.8	Very high	94.4	Very high	45 Å²	45	29.1 Å²	29.1	24%	0.241	15%	0.15	C	C	.	.			trans	-147.2	79.8	177.4	-168.9	-6.7	0	0	0	111.9	F104 D157 L158	F104-N155 HydrophobicContact CD1-CB 3.82Å; F104-N155 HydrophobicContact CE1-CB 3.91Å; F104-N155 WeakPolarHBondContact CE1-O 3.28Å; N155-D157 PolarHBondContact O-N 3.12Å; N155-D157 PolarHBondContact OD1-N 2.86Å; N155-L158 HydrophobicContact CB-CD1 4.5Å; N155-L158 PolarHBondContact O-N 3.14Å
156	P	94	Very high	94.8	Very high	13 Å²	13	27.7 Å²	27.7	8%	0.084	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-61.3	-16.6	-179.2	-24.7	35	0	0	0	115	L158 I159 K165 A168 L169 L172	P156-L158 VanDerWaalsContact C-N 3.3Å; P156-L158 PolarHBondContact O-N 2.94Å; P156-I159 HydrophobicContact CB-CD1 4.34Å; P156-I159 WeakPolarHBondContact O-CB 3.33Å; P156-I159 PolarHBondContact O-N 2.78Å; P156-K165 WeakPolarHBondContact O-CE 3.48Å; P156-A168 HydrophobicContact CB-CB 4.46Å; P156-A168 HydrophobicContact CG-CB 4.44Å; P156-L169 HydrophobicContact CB-CD2 3.81Å; P156-L169 HydrophobicContact CB-CG 4.02Å; P156-L169 HydrophobicContact CG-CD2 4.02Å; P156-L172 HydrophobicContact CG-CD1 3.82Å
157	D	92.1	Very high	95.1	Very high	88 Å²	88	27.7 Å²	27.7	47%	0.471	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-67.7	-31.3	-177.4	-70.3	-36.3	0	0	0	112.4	N155 I159 K165	N155-D157 PolarHBondContact O-N 3.12Å; N155-D157 PolarHBondContact OD1-N 2.86Å; D157-I159 VanDerWaalsContact C-N 3.29Å; D157-I159 PolarHBondContact O-N 2.93Å; D157-K165 PolarHBondContact O-NZ 2.94Å
158	L	93.9	Very high	95.2	Very high	74 Å²	74	27.7 Å²	27.7	39%	0.387	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-81.4	-3.2	178.1	-55	175.9	0	0	0	113.7	F104 E105 I108 N155 P156	F104-L158 HydrophobicContact CD1-CD1 4.23Å; F104-L158 HydrophobicContact CE1-CB 3.91Å; F104-L158 HydrophobicContact CE1-CD1 3.97Å; F104-L158 HydrophobicContact CE1-CG 4.4Å; F104-L158 HydrophobicContact CZ-CB 4.46Å; E105-L158 HydrophobicContact CG-CD1 4.13Å; I108-L158 HydrophobicContact CD1-CB 4.43Å; I108-L158 HydrophobicContact CD1-CD1 4.29Å; N155-L158 HydrophobicContact CB-CD1 4.5Å; N155-L158 PolarHBondContact O-N 3.14Å; P156-L158 VanDerWaalsContact C-N 3.3Å; P156-L158 PolarHBondContact O-N 2.94Å
159	I	95.4	Very high	95.4	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.01	15%	0.145	C	C	.	.			trans	-79.2	123.4	174.9	-54	174.3	0	0	0	108.2	F104 Y152 P156 D157 E161 L164 K165 A168	F104-I159 HydrophobicContact CZ-CG1 4.19Å; Y152-I159 HydrophobicContact CD1-CD1 4.14Å; Y152-I159 HydrophobicContact CD1-CG1 4.31Å; P156-I159 HydrophobicContact CB-CD1 4.34Å; P156-I159 WeakPolarHBondContact O-CB 3.33Å; P156-I159 PolarHBondContact O-N 2.78Å; D157-I159 VanDerWaalsContact C-N 3.29Å; D157-I159 PolarHBondContact O-N 2.93Å; I159-E161 HydrophobicContact CG2-CB 4.36Å; I159-L164 HydrophobicContact CD1-CG 4.38Å; I159-L164 HydrophobicContact CG2-CB 4.05Å; I159-L164 HydrophobicContact CG2-CD2 4.22Å; I159-L164 HydrophobicContact CG2-CG 4.15Å; I159-K165 HydrophobicContact CB-CB 4.07Å; I159-K165 HydrophobicContact CB-CG 4.44Å; I159-K165 HydrophobicContact CG2-CB 3.96Å; I159-K165 WeakPolarHBondContact O-CD 3.5Å; I159-K165 PolarHBondContact O-NZ 2.99Å; I159-A168 HydrophobicContact CD1-CB 4.07Å
160	E	95.4	Very high	95.7	Very high	124 Å²	124	27.7 Å²	27.7	58%	0.579	14%	0.144	S	C	*	.			trans	-92.2	-31.9	177.2	-65.9	178.9	-155.2	0	0	111.5	V115 K116 P162	V115-E160 PolarHBondContact O-N 3.24Å; K116-E160 HydrophobicContact CB-CB 3.94Å; K116-E160 WeakPolarHBondContact CD-OE2 3.35Å; E160-P162 WeakPolarHBondContact O-CD 3.48Å
161	E	96.3	Very high	95.9	Very high	42 Å²	42	27.8 Å²	27.8	20%	0.196	14%	0.144	C	C	.	.			trans	-65.2	111.1	177	-176.8	53.5	-126.7	0	0	111.7	V115 L118 L123 I159 A163 L164 K165	V115-E161 PolarHBondContact O-N 3.24Å; L118-E161 HydrophobicContact CB-CG 4.42Å; L118-E161 HydrophobicContact CD1-CB 3.7Å; L118-E161 HydrophobicContact CD1-CG 4.03Å; L123-E161 HydrophobicContact CD1-CG 4.34Å; L123-E161 HydrophobicContact CD2-CG 3.96Å; I159-E161 HydrophobicContact CG2-CB 4.36Å; E161-A163 VanDerWaalsContact C-N 3.34Å; E161-A163 PolarHBondContact O-N 3.13Å; E161-L164 HydrophobicContact CB-CB 4.25Å; E161-L164 HydrophobicContact CG-CB 4.18Å; E161-L164 PolarHBondContact O-N 2.9Å; E161-K165 PolarHBondContact O-N 2.71Å
162	P	96.4	Very high	96.1	Very high	67 Å²	67	27.6 Å²	27.6	44%	0.435	14%	0.143	S	C	.	.	H	α-helix	trans	-60.7	-39.8	-169.7	-26.2	35.7	0	0	0	113.7	E160 K165 A166 V218	E160-P162 WeakPolarHBondContact O-CD 3.48Å; P162-K165 PolarHBondContact O-N 3.2Å; P162-A166 WeakPolarHBondContact O-CB 3.5Å; P162-A166 PolarHBondContact O-N 3.16Å; P162-V218 HydrophobicContact CB-CG2 4.32Å
163	A	97.1	Very high	96.2	Very high	6 Å²	6	28.2 Å²	28.2	5%	0.05	15%	0.146	C	C	.	.	H	α-helix	trans	-64	-44.7	-179.2	0	0	0	0	0	112	L123 E161 F167 V218	L123-A163 HydrophobicContact CD1-CB 4.45Å; E161-A163 VanDerWaalsContact C-N 3.34Å; E161-A163 PolarHBondContact O-N 3.13Å; A163-F167 VanDerWaalsContact O-CB 3.28Å; A163-F167 WeakPolarHBondContact O-CB 3.46Å; A163-F167 PolarHBondContact O-N 3.4Å; A163-V218 HydrophobicContact CB-CG1 3.7Å
164	L	97.4	Very high	96.3	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-69.4	-39.7	178.7	-174.9	57.7	0	0	0	111.6	L118 L123 I126 Y152 I159 E161 F167 A168	L118-L164 HydrophobicContact CD1-CD2 4.35Å; L118-L164 HydrophobicContact CD2-CD2 4.01Å; L123-L164 HydrophobicContact CD2-CB 3.75Å; L123-L164 HydrophobicContact CD2-CD2 4.49Å; L123-L164 HydrophobicContact CD2-CG 4.49Å; I126-L164 HydrophobicContact CG2-CD1 3.84Å; Y152-L164 HydrophobicContact CD1-CD2 3.64Å; Y152-L164 HydrophobicContact CD1-CG 4.48Å; Y152-L164 HydrophobicContact CD2-CD2 4.26Å; Y152-L164 HydrophobicContact CE1-CD2 3.62Å; Y152-L164 HydrophobicContact CE2-CD2 4.23Å; Y152-L164 HydrophobicContact CG-CD2 3.97Å; I159-L164 HydrophobicContact CD1-CG 4.38Å; I159-L164 HydrophobicContact CG2-CB 4.05Å; I159-L164 HydrophobicContact CG2-CD2 4.22Å; I159-L164 HydrophobicContact CG2-CG 4.15Å; E161-L164 HydrophobicContact CB-CB 4.25Å; E161-L164 HydrophobicContact CG-CB 4.18Å; E161-L164 PolarHBondContact O-N 2.9Å; L164-F167 PolarHBondContact O-N 2.89Å; L164-A168 VanDerWaalsContact O-CB 3.3Å; L164-A168 WeakPolarHBondContact O-CB 3.25Å; L164-A168 PolarHBondContact O-N 3Å
165	K	97.5	Very high	96.5	Very high	51 Å²	51	26 Å²	26	22%	0.222	14%	0.136	C	C	.	.	H	α-helix	trans	-61.5	-49.9	177	-174.1	174.9	-161.9	145	0	111.9	P156 D157 I159 E161 P162 F167 A168 L169 M214	P156-K165 WeakPolarHBondContact O-CE 3.48Å; D157-K165 PolarHBondContact O-NZ 2.94Å; I159-K165 HydrophobicContact CB-CB 4.07Å; I159-K165 HydrophobicContact CB-CG 4.44Å; I159-K165 HydrophobicContact CG2-CB 3.96Å; I159-K165 WeakPolarHBondContact O-CD 3.5Å; I159-K165 PolarHBondContact O-NZ 2.99Å; E161-K165 PolarHBondContact O-N 2.71Å; P162-K165 PolarHBondContact O-N 3.2Å; K165-F167 VanDerWaalsContact C-N 3.32Å; K165-F167 PolarHBondContact O-N 3.37Å; K165-A168 PolarHBondContact O-N 3.48Å; K165-L169 HydrophobicContact CG-CD1 4.33Å; K165-L169 WeakPolarHBondContact O-CG 3.38Å; K165-L169 PolarHBondContact O-N 3.41Å; K165-L169 VanDerWaalsContact O-N 3.11Å; K165-M214 HydrophobicContact CD-CE 4.33Å; K165-M214 HydrophobicContact CG-CE 4.25Å
166	A	97.9	Very high	96.6	Very high	1 Å²	1	25 Å²	25	1%	0.008	13%	0.13	C	C	.	.	H	α-helix	trans	-61.8	-42.2	178.2	0	0	0	0	0	111.3	P162 G170 M214 L215 V218	P162-A166 WeakPolarHBondContact O-CB 3.5Å; P162-A166 PolarHBondContact O-N 3.16Å; A166-G170 PolarHBondContact O-N 3.49Å; A166-M214 HydrophobicContact CB-CB 4.03Å; A166-L215 HydrophobicContact CB-CD2 3.96Å; A166-L215 HydrophobicContact CB-CG 4.27Å; A166-V218 HydrophobicContact CB-CG2 3.99Å
167	F	98.4	Very high	96.7	Very high	1 Å²	1	24.7 Å²	24.7	0%	0.004	13%	0.128	C	C	.	.	H	α-helix	trans	-63	-48.2	175.6	175.5	-97.9	0	0	0	112.8	I127 C130 F131 A163 L164 K165 L169 G170 L171 I255 T258	I127-F167 HydrophobicContact CB-CE1 4.21Å; I127-F167 HydrophobicContact CB-CE2 4.21Å; I127-F167 HydrophobicContact CB-CZ 4Å; I127-F167 HydrophobicContact CD1-CD2 4.3Å; I127-F167 HydrophobicContact CD1-CG 4.24Å; I127-F167 HydrophobicContact CG1-CD1 3.72Å; I127-F167 HydrophobicContact CG1-CD2 3.95Å; I127-F167 HydrophobicContact CG1-CE1 3.79Å; I127-F167 HydrophobicContact CG1-CE2 4.02Å; I127-F167 HydrophobicContact CG1-CG 3.8Å; I127-F167 HydrophobicContact CG1-CZ 3.95Å; I127-F167 HydrophobicContact CG2-CD2 4.1Å; I127-F167 HydrophobicContact CG2-CE1 4.33Å; I127-F167 HydrophobicContact CG2-CE2 3.49Å; I127-F167 VanDerWaalsContact CG2-CE2 3.49Å; I127-F167 HydrophobicContact CG2-CZ 3.62Å; C130-F167 HydrophobicContact CB-CE1 3.61Å; C130-F167 HydrophobicContact CB-CZ 3.73Å; F131-F167 AromaticContact CE1-CE2 3.91Å; F131-F167 HydrophobicContact CE1-CE2 3.91Å; F131-F167 HydrophobicContact CE1-CZ 4.29Å; F131-F167 HydrophobicContact CE2-CE2 4.49Å; F131-F167 AromaticContact CZ-CE2 3.85Å; F131-F167 HydrophobicContact CZ-CE2 3.85Å; F131-F167 HydrophobicContact CZ-CZ 4.48Å; A163-F167 VanDerWaalsContact O-CB 3.28Å; A163-F167 WeakPolarHBondContact O-CB 3.46Å; A163-F167 PolarHBondContact O-N 3.4Å; L164-F167 PolarHBondContact O-N 2.89Å; K165-F167 VanDerWaalsContact C-N 3.32Å; K165-F167 PolarHBondContact O-N 3.37Å; F167-L169 PolarHBondContact O-N 2.97Å; F167-G170 CarbonylContact O-C 3.46Å; F167-G170 WeakPolarHBondContact O-CA 3.49Å; F167-G170 PolarHBondContact O-N 3.34Å; F167-G170 VanDerWaalsContact O-N 3.09Å; F167-L171 HydrophobicContact CE1-CD2 4.24Å; F167-L171 HydrophobicContact CZ-CD2 4.45Å; F167-L171 WeakPolarHBondContact O-CB 3.44Å; F167-L171 PolarHBondContact O-N 3.07Å; F167-I255 HydrophobicContact CB-CD1 3.98Å; F167-T258 HydrophobicContact CD2-CG2 3.89Å; F167-T258 WeakPolarHBondContact CD2-OG1 3.4Å; F167-T258 HydrophobicContact CE2-CG2 4.09Å; F167-T258 WeakPolarHBondContact CE2-OG1 3.32Å
168	A	97.9	Very high	96.9	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.008	11%	0.106	C	C	.	.	H	α-helix	trans	-60.4	-43.8	-179	0	0	0	0	0	111.8	V153 P156 I159 L164 K165 L171 L172	V153-A168 HydrophobicContact CG1-CB 4.23Å; P156-A168 HydrophobicContact CB-CB 4.46Å; P156-A168 HydrophobicContact CG-CB 4.44Å; I159-A168 HydrophobicContact CD1-CB 4.07Å; L164-A168 VanDerWaalsContact O-CB 3.3Å; L164-A168 WeakPolarHBondContact O-CB 3.25Å; L164-A168 PolarHBondContact O-N 3Å; K165-A168 PolarHBondContact O-N 3.48Å; A168-L171 PolarHBondContact O-N 3.34Å; A168-L172 WeakPolarHBondContact O-CG 3.25Å; A168-L172 PolarHBondContact O-N 3.45Å; A168-L172 VanDerWaalsContact O-N 3.1Å
169	L	98.1	Very high	96.9	Very high	5 Å²	5	20.1 Å²	20.1	3%	0.026	10%	0.099	C	C	.	.	H	α-helix	trans	-63.2	-42.4	172.9	-68.9	171.1	0	0	0	111.6	P156 K165 F167 L171 L172 K173 A203 V206 V211 M214	P156-L169 HydrophobicContact CB-CD2 3.81Å; P156-L169 HydrophobicContact CB-CG 4.02Å; P156-L169 HydrophobicContact CG-CD2 4.02Å; K165-L169 HydrophobicContact CG-CD1 4.33Å; K165-L169 WeakPolarHBondContact O-CG 3.38Å; K165-L169 PolarHBondContact O-N 3.41Å; K165-L169 VanDerWaalsContact O-N 3.11Å; F167-L169 PolarHBondContact O-N 2.97Å; L169-L171 PolarHBondContact O-N 3.48Å; L169-L172 PolarHBondContact O-N 3.06Å; L169-K173 WeakPolarHBondContact O-CG 3.49Å; L169-K173 PolarHBondContact O-N 3.38Å; L169-A203 HydrophobicContact CD2-CB 3.65Å; L169-V206 HydrophobicContact CD2-CG2 4.37Å; L169-V211 HydrophobicContact CB-CG1 3.99Å; L169-V211 HydrophobicContact CB-CG2 4.1Å; L169-M214 HydrophobicContact CD1-CE 3.86Å; L169-M214 HydrophobicContact CD1-SD 4.05Å
170	G	98.1	Very high	96.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-59.8	-44.6	176.3	0	0	0	0	0	112.9	A166 F167 K173 V174	A166-G170 PolarHBondContact O-N 3.49Å; F167-G170 CarbonylContact O-C 3.46Å; F167-G170 WeakPolarHBondContact O-CA 3.49Å; F167-G170 PolarHBondContact O-N 3.34Å; F167-G170 VanDerWaalsContact O-N 3.09Å; G170-K173 PolarHBondContact O-N 3.34Å; G170-V174 WeakPolarHBondContact O-CG2 3.47Å; G170-V174 PolarHBondContact O-N 2.91Å
171	L	98.2	Very high	96.6	Very high	3 Å²	3	17.8 Å²	17.8	2%	0.016	9%	0.088	C	C	.	.	H	α-helix	trans	-63	-44.8	177.8	-177.9	63.6	0	0	0	112	C130 L134 V147 V153 F167 A168 L169 K173 V174 C175	C130-L171 HydrophobicContact CB-CD2 3.62Å; L134-L171 HydrophobicContact CB-CD1 4.15Å; L134-L171 HydrophobicContact CD1-CD1 4.3Å; L134-L171 HydrophobicContact CD2-CD1 4.06Å; L134-L171 HydrophobicContact CG-CD1 4.4Å; V147-L171 HydrophobicContact CG1-CD2 4.27Å; V147-L171 HydrophobicContact CG1-CG 4.49Å; V153-L171 HydrophobicContact CG1-CD2 4.1Å; F167-L171 HydrophobicContact CE1-CD2 4.24Å; F167-L171 HydrophobicContact CZ-CD2 4.45Å; F167-L171 WeakPolarHBondContact O-CB 3.44Å; F167-L171 PolarHBondContact O-N 3.07Å; A168-L171 PolarHBondContact O-N 3.34Å; L169-L171 PolarHBondContact O-N 3.48Å; L171-K173 VanDerWaalsContact C-N 3.3Å; L171-K173 PolarHBondContact O-N 2.85Å; L171-V174 PolarHBondContact O-N 3.47Å; L171-C175 PolarHBondContact O-N 3.11Å; L171-C175 PolarHBondContact O-SG 3.05Å
172	L	97.6	Very high	96.4	Very high	2 Å²	2	15.9 Å²	15.9	1%	0.01	8%	0.079	C	C	.	.	H	α-helix	trans	-59.8	-41.3	175.5	-73.7	171.9	0	0	0	111.7	F148 V153 P156 A168 L169 C175 D176 M202 A203	F148-L172 HydrophobicContact CE1-CD2 3.93Å; V153-L172 HydrophobicContact CB-CD1 4.37Å; V153-L172 HydrophobicContact CB-CD2 4.01Å; V153-L172 HydrophobicContact CB-CG 4.16Å; V153-L172 HydrophobicContact CG1-CG 4.48Å; P156-L172 HydrophobicContact CG-CD1 3.82Å; A168-L172 WeakPolarHBondContact O-CG 3.25Å; A168-L172 PolarHBondContact O-N 3.45Å; A168-L172 VanDerWaalsContact O-N 3.1Å; L169-L172 PolarHBondContact O-N 3.06Å; L172-C175 WeakPolarHBondContact O-CB 3.49Å; L172-C175 PolarHBondContact O-N 3.2Å; L172-D176 PolarHBondContact O-N 3.28Å; L172-M202 HydrophobicContact CD2-SD 4.1Å; L172-A203 HydrophobicContact CB-CB 4.01Å; L172-A203 HydrophobicContact CD1-CB 3.98Å
173	K	97.7	Very high	96.1	Very high	13 Å²	13	16.3 Å²	16.3	6%	0.057	8%	0.078	C	C	.	.	H	α-helix	trans	-66.8	-40.4	175.8	-70.9	-63.9	-170.2	162.9	0	113.1	L169 G170 L171 C175 D176 I177 A203 V206 D208 V211 L262	L169-K173 WeakPolarHBondContact O-CG 3.49Å; L169-K173 PolarHBondContact O-N 3.38Å; G170-K173 PolarHBondContact O-N 3.34Å; L171-K173 VanDerWaalsContact C-N 3.3Å; L171-K173 PolarHBondContact O-N 2.85Å; K173-C175 VanDerWaalsContact C-N 3.29Å; K173-C175 PolarHBondContact O-N 3.43Å; K173-D176 PolarHBondContact O-N 3.4Å; K173-I177 WeakPolarHBondContact O-CG1 3.47Å; K173-I177 PolarHBondContact O-N 3.28Å; K173-A203 WeakPolarHBondContact CE-O 3.46Å; K173-V206 WeakPolarHBondContact CE-O 3.25Å; K173-V206 PolarHBondContact NZ-O 3.28Å; K173-D208 WeakPolarHBondContact CD-OD1 3.33Å; K173-D208 VanDerWaalsContact CE-OD1 3.28Å; K173-D208 WeakPolarHBondContact CE-OD1 3.25Å; K173-D208 IonicContact NZ-OD1 2.86Å; K173-D208 PolarHBondContact NZ-OD1 2.89Å; K173-V211 HydrophobicContact CG-CG1 4.43Å; K173-V211 HydrophobicContact CG-CG2 4.17Å; K173-L262 HydrophobicContact CB-CD1 3.66Å; K173-L262 HydrophobicContact CB-CD2 4.2Å
174	V	97.6	Very high	95.7	Very high	6 Å²	6	21.8 Å²	21.8	4%	0.036	10%	0.101	C	C	.	.	H	α-helix	trans	-58.8	-44.4	172	168.2	0	0	0	0	110.2	L134 G170 L171 A178 L261 L262 L265	L134-V174 HydrophobicContact CD1-CG1 4.16Å; L134-V174 HydrophobicContact CD2-CG1 3.94Å; G170-V174 WeakPolarHBondContact O-CG2 3.47Å; G170-V174 PolarHBondContact O-N 2.91Å; L171-V174 PolarHBondContact O-N 3.47Å; V174-A178 VanDerWaalsContact O-CB 3.23Å; V174-A178 WeakPolarHBondContact O-CB 3.36Å; V174-A178 PolarHBondContact O-N 3.5Å; V174-L261 HydrophobicContact CG1-CD2 4.42Å; V174-L262 HydrophobicContact CG2-CB 3.99Å; V174-L262 HydrophobicContact CG2-CD1 4.11Å; V174-L265 HydrophobicContact CB-CD1 4.42Å; V174-L265 HydrophobicContact CG1-CD1 3.87Å; V174-L265 HydrophobicContact CG2-CD1 4.3Å
175	C	96.8	Very high	95.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-62.3	-45	176.1	-63.4	0	0	0	0	111.8	W137 L171 L172 K173 A178 R179 M202	W137-C175 HydrophobicContact CH2-CB 3.96Å; W137-C175 VanDerWaalsContact CH2-O 3.25Å; W137-C175 WeakPolarHBondContact CH2-O 3.22Å; W137-C175 HydrophobicContact CZ3-CB 3.89Å; L171-C175 PolarHBondContact O-N 3.11Å; L171-C175 PolarHBondContact O-SG 3.05Å; L172-C175 WeakPolarHBondContact O-CB 3.49Å; L172-C175 PolarHBondContact O-N 3.2Å; K173-C175 VanDerWaalsContact C-N 3.29Å; K173-C175 PolarHBondContact O-N 3.43Å; C175-A178 PolarHBondContact O-N 3.43Å; C175-R179 VanDerWaalsContact O-CB 3.26Å; C175-R179 WeakPolarHBondContact O-CB 3.28Å; C175-R179 PolarHBondContact O-N 3.28Å; C175-M202 HydrophobicContact CB-SD 4.28Å
176	D	95.7	Very high	94.7	Very high	25 Å²	25	21.8 Å²	21.8	13%	0.134	11%	0.111	C	C	.	.	H	α-helix	trans	-63.4	-47	-178.6	-155.9	29.1	0	0	0	112.5	L172 K173 R179 E180 M202	L172-D176 PolarHBondContact O-N 3.28Å; K173-D176 PolarHBondContact O-N 3.4Å; D176-R179 PolarHBondContact O-N 3.1Å; D176-R179 IonicContact OD1-CZ 3.69Å; D176-R179 IonicContact OD1-NE 3.24Å; D176-R179 PolarHBondContact OD1-NE 2.81Å; D176-R179 IonicContact OD1-NH2 3.85Å; D176-R179 PolarHBondContact OD1-NH2 3.09Å; D176-E180 WeakPolarHBondContact O-CB 3.26Å; D176-E180 PolarHBondContact O-N 2.93Å; D176-M202 HydrophobicContact CB-CB 3.71Å; D176-M202 HydrophobicContact CB-CG 4.16Å
177	I	95.7	Very high	93.7	Very high	6 Å²	6	22.2 Å²	22.2	3%	0.031	11%	0.113	C	C	.	.	H	α-helix	trans	-64.8	-43.9	179.5	-62.7	167.4	0	0	0	110.3	K173 R179 E180 K181 L262 L265 I266 T269	K173-I177 WeakPolarHBondContact O-CG1 3.47Å; K173-I177 PolarHBondContact O-N 3.28Å; I177-R179 PolarHBondContact O-N 3.44Å; I177-E180 PolarHBondContact O-N 2.96Å; I177-K181 HydrophobicContact CG2-CG 4.23Å; I177-K181 WeakPolarHBondContact O-CB 3.39Å; I177-K181 WeakPolarHBondContact O-CG 3.46Å; I177-K181 PolarHBondContact O-N 3.4Å; I177-L262 HydrophobicContact CD1-CD1 3.84Å; I177-L265 HydrophobicContact CD1-CB 4.39Å; I177-L265 HydrophobicContact CG2-CB 3.96Å; I177-I266 HydrophobicContact CD1-CG1 3.65Å; I177-T269 HydrophobicContact CG2-CG2 3.89Å
178	A	95.1	Very high	92.2	Very high	1 Å²	1	25 Å²	25	1%	0.008	13%	0.125	C	C	.	.	H	α-helix	trans	-58.8	-48.5	176.7	0	0	0	0	0	111.1	W137 L138 V174 C175 E180 K181 V182 L384	W137-A178 HydrophobicContact CH2-CB 4.15Å; W137-A178 HydrophobicContact CZ3-CB 4.03Å; L138-A178 HydrophobicContact CD2-CB 4.25Å; V174-A178 VanDerWaalsContact O-CB 3.23Å; V174-A178 WeakPolarHBondContact O-CB 3.36Å; V174-A178 PolarHBondContact O-N 3.5Å; C175-A178 PolarHBondContact O-N 3.43Å; A178-E180 PolarHBondContact O-N 3.43Å; A178-K181 PolarHBondContact O-N 2.83Å; A178-V182 WeakPolarHBondContact O-CB 3.28Å; A178-V182 WeakPolarHBondContact O-CG2 3.08Å; A178-V182 PolarHBondContact O-N 3.04Å; A178-L384 HydrophobicContact CB-CD1 3.89Å; A178-L384 HydrophobicContact CB-CD2 4.46Å
179	R	93.8	Very high	90.5	Very high	65 Å²	65	30.4 Å²	30.4	25%	0.245	15%	0.15	C	C	.	.	H	α-helix	trans	-59.3	-46.8	176.8	-176.7	-170.3	66.8	87.7	3.6	111.9	W137 C175 D176 I177 K181 V182 N183 A195	W137-R179 HydrophobicContact CH2-CB 4.11Å; W137-R179 HydrophobicContact CZ2-CB 4.2Å; C175-R179 VanDerWaalsContact O-CB 3.26Å; C175-R179 WeakPolarHBondContact O-CB 3.28Å; C175-R179 PolarHBondContact O-N 3.28Å; D176-R179 PolarHBondContact O-N 3.1Å; D176-R179 IonicContact OD1-CZ 3.69Å; D176-R179 IonicContact OD1-NE 3.24Å; D176-R179 PolarHBondContact OD1-NE 2.81Å; D176-R179 IonicContact OD1-NH2 3.85Å; D176-R179 PolarHBondContact OD1-NH2 3.09Å; I177-R179 PolarHBondContact O-N 3.44Å; R179-K181 VanDerWaalsContact C-N 3.33Å; R179-K181 PolarHBondContact O-N 3.47Å; R179-V182 PolarHBondContact O-N 2.97Å; R179-N183 WeakPolarHBondContact O-CB 3.35Å; R179-N183 VanDerWaalsContact O-CG 3.28Å; R179-N183 PolarHBondContact O-N 2.77Å; R179-A195 WeakPolarHBondContact CD-O 3.4Å; R179-A195 HydrophobicContact CG-CB 4.09Å
180	E	92.6	Very high	89.1	Confident	65 Å²	65	36.9 Å²	36.9	30%	0.304	18%	0.18	S	C	.	.	H	α-helix	trans	-59.3	-45.4	178.1	-172	-163.6	150.4	0	0	111.2	D176 I177 A178 N183 K184	D176-E180 WeakPolarHBondContact O-CB 3.26Å; D176-E180 PolarHBondContact O-N 2.93Å; I177-E180 PolarHBondContact O-N 2.96Å; A178-E180 PolarHBondContact O-N 3.43Å; E180-N183 PolarHBondContact O-N 2.8Å; E180-K184 HydrophobicContact CG-CD 4.23Å; E180-K184 WeakPolarHBondContact O-CB 3.38Å; E180-K184 WeakPolarHBondContact O-CG 3.34Å; E180-K184 PolarHBondContact O-N 3.03Å; E180-K184 VanDerWaalsContact OE1-CE 3.25Å; E180-K184 WeakPolarHBondContact OE1-CE 3.41Å; E180-K184 IonicContact OE1-NZ 3.38Å; E180-K184 PolarHBondContact OE1-NZ 3.11Å
181	K	92.2	Very high	88.3	Confident	12 Å²	12	41 Å²	41	5%	0.052	20%	0.199	C	C	.	.	H	α-helix	trans	-64.5	-44.6	179.7	-71.6	-69.5	-178.7	178	0	112.3	I177 A178 R179 K184 A185 F268 L388 T391	I177-K181 HydrophobicContact CG2-CG 4.23Å; I177-K181 WeakPolarHBondContact O-CB 3.39Å; I177-K181 WeakPolarHBondContact O-CG 3.46Å; I177-K181 PolarHBondContact O-N 3.4Å; A178-K181 PolarHBondContact O-N 2.83Å; R179-K181 VanDerWaalsContact C-N 3.33Å; R179-K181 PolarHBondContact O-N 3.47Å; K181-K184 PolarHBondContact O-N 3.28Å; K181-A185 WeakPolarHBondContact O-CB 3.33Å; K181-A185 PolarHBondContact O-N 3.41Å; K181-F268 WeakPolarHBondContact CE-O 3.38Å; K181-F268 PolarHBondContact NZ-O 3.4Å; K181-L388 HydrophobicContact CB-CD2 4.5Å; K181-L388 HydrophobicContact CD-CD2 4.22Å; K181-L388 HydrophobicContact CG-CD2 4.07Å; K181-T391 HydrophobicContact CD-CG2 4.3Å; K181-T391 VanDerWaalsContact CD-OG1 3.31Å; K181-T391 WeakPolarHBondContact CD-OG1 3.38Å; K181-T391 PolarHBondContact NZ-OG1 3.49Å
182	V	92.4	Very high	87.5	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.012	20%	0.204	C	C	.	.	H	α-helix	trans	-62	-48.1	177	172.5	0	0	0	0	110.7	A178 R179 K184 A185 A186 V187 F193 V383 S387	A178-V182 WeakPolarHBondContact O-CB 3.28Å; A178-V182 WeakPolarHBondContact O-CG2 3.08Å; A178-V182 PolarHBondContact O-N 3.04Å; R179-V182 PolarHBondContact O-N 2.97Å; V182-K184 PolarHBondContact O-N 3.06Å; V182-A185 PolarHBondContact O-N 2.73Å; V182-A186 PolarHBondContact O-N 3.33Å; V182-V187 HydrophobicContact CB-CG2 4.29Å; V182-V187 HydrophobicContact CG1-CG2 3.38Å; V182-F193 HydrophobicContact CB-CD1 4.26Å; V182-F193 HydrophobicContact CB-CE1 4.12Å; V182-F193 HydrophobicContact CG1-CB 3.99Å; V182-F193 HydrophobicContact CG1-CD1 3.42Å; V182-F193 VanDerWaalsContact CG1-CD1 3.42Å; V182-F193 HydrophobicContact CG1-CE1 3.78Å; V182-F193 HydrophobicContact CG1-CG 3.77Å; V182-F193 HydrophobicContact CG1-CZ 4.43Å; V182-F193 HydrophobicContact CG2-CE1 4.5Å; V182-F193 HydrophobicContact CG2-CZ 4.43Å; V182-V383 HydrophobicContact CG1-CG2 4.02Å; V182-V383 HydrophobicContact CG2-CG1 4.49Å; V182-V383 HydrophobicContact CG2-CG2 4.26Å; V182-S387 WeakPolarHBondContact CA-OG 3.2Å
183	N	90.4	Very high	87	Confident	76 Å²	76	42 Å²	42	41%	0.406	21%	0.205	S	C	.	.	H	α-helix	trans	-62.2	-41.6	177.5	-73.3	-2.9	0	0	0	112.5	R179 E180 A185 A186 A195	R179-N183 WeakPolarHBondContact O-CB 3.35Å; R179-N183 VanDerWaalsContact O-CG 3.28Å; R179-N183 PolarHBondContact O-N 2.77Å; E180-N183 PolarHBondContact O-N 2.8Å; N183-A185 VanDerWaalsContact C-N 3.34Å; N183-A185 PolarHBondContact O-N 2.82Å; N183-A186 PolarHBondContact O-N 2.91Å; N183-A186 VanDerWaalsContact O-N 3.12Å; N183-A195 VanDerWaalsContact OD1-CB 3.25Å; N183-A195 WeakPolarHBondContact OD1-CB 3.48Å
184	K	89.6	Confident	86.5	Confident	121 Å²	121	42.8 Å²	42.8	53%	0.526	21%	0.209	S	C	.	.	H	α-helix	trans	-65.1	-35.5	177.1	-79.9	179.9	172.3	177	0	113.2	E180 K181 V182 A186 T391	E180-K184 HydrophobicContact CG-CD 4.23Å; E180-K184 WeakPolarHBondContact O-CB 3.38Å; E180-K184 WeakPolarHBondContact O-CG 3.34Å; E180-K184 PolarHBondContact O-N 3.03Å; E180-K184 VanDerWaalsContact OE1-CE 3.25Å; E180-K184 WeakPolarHBondContact OE1-CE 3.41Å; E180-K184 IonicContact OE1-NZ 3.38Å; E180-K184 PolarHBondContact OE1-NZ 3.11Å; K181-K184 PolarHBondContact O-N 3.28Å; V182-K184 PolarHBondContact O-N 3.06Å; K184-A186 PolarHBondContact O-N 3.29Å; K184-T391 HydrophobicContact CB-CG2 3.82Å
185	A	89.2	Confident	85.9	Confident	3 Å²	3	42.8 Å²	42.8	3%	0.025	21%	0.209	C	C	.	.	H	α-helix	trans	-70.6	-10.5	176	0	0	0	0	0	113	K181 V182 N183 V187 Q390 T391 Q455	K181-A185 WeakPolarHBondContact O-CB 3.33Å; K181-A185 PolarHBondContact O-N 3.41Å; V182-A185 PolarHBondContact O-N 2.73Å; N183-A185 VanDerWaalsContact C-N 3.34Å; N183-A185 PolarHBondContact O-N 2.82Å; A185-V187 HydrophobicContact CB-CG1 4.18Å; A185-V187 PolarHBondContact O-N 3.09Å; A185-Q390 HydrophobicContact CB-CB 4.18Å; A185-Q390 PolarHBondContact O-OE1 3.29Å; A185-T391 HydrophobicContact CB-CG2 4.23Å; A185-Q455 PolarHBondContact O-NE2 3.23Å
186	A	84.5	Confident	85.5	Confident	50 Å²	50	47 Å²	47	41%	0.413	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	31.9	-176.2	0	0	0	0	0	113.4	V182 N183 K184 H459	V182-A186 PolarHBondContact O-N 3.33Å; N183-A186 PolarHBondContact O-N 2.91Å; N183-A186 VanDerWaalsContact O-N 3.12Å; K184-A186 PolarHBondContact O-N 3.29Å; A186-H459 PolarHBondContact O-CE1 3.09Å
187	V	76.4	Confident	85.1	Confident	9 Å²	9	47.6 Å²	47.6	6%	0.055	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-69.9	136.2	167.7	-62.7	0	0	0	0	108.3	V182 A185 E189 V383	V182-V187 HydrophobicContact CB-CG2 4.29Å; V182-V187 HydrophobicContact CG1-CG2 3.38Å; A185-V187 HydrophobicContact CB-CG1 4.18Å; A185-V187 PolarHBondContact O-N 3.09Å; V187-E189 PolarHBondContact O-N 3.45Å; V187-V383 HydrophobicContact CB-CG2 4.24Å; V187-V383 HydrophobicContact CG2-CG2 3.53Å
188	F	66.6	Low	84.6	Confident	61 Å²	61	49 Å²	49	27%	0.268	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-65.6	128.1	-158.5	-72.4	-89.4	0	0	0	113.6	E191 D192 H459 R463	F188-E191 HydrophobicContact CB-CB 4.35Å; F188-D192 PolarHBondContact O-N 2.84Å; F188-D192 VanDerWaalsContact O-N 3.15Å; F188-H459 AromaticContact CD2-ND1 3.47Å; F188-H459 WeakPolarHBondContact CD2-ND1 3.35Å; F188-H459 AromaticContact CE2-CE1 3.62Å; F188-H459 AromaticContact CE2-ND1 3.34Å; F188-H459 VanDerWaalsContact CE2-ND1 3.34Å; F188-H459 WeakPolarHBondContact CE2-ND1 3.34Å; F188-R463 HydrophobicContact CD2-CB 4.25Å; F188-R463 HydrophobicContact CD2-CG 3.74Å; F188-R463 HydrophobicContact CE2-CB 3.92Å; F188-R463 HydrophobicContact CE2-CG 3.74Å
189	E	62.3	Low	84.2	Confident	114 Å²	114	52.4 Å²	52.4	53%	0.533	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-66.5	138.6	176.2	-162.9	173	-169.1	0	0	110.6	V187 E191 F193	V187-E189 PolarHBondContact O-N 3.45Å; E189-E191 PolarHBondContact O-N 3.22Å; E189-E191 VanDerWaalsContact O-N 3.13Å; E189-F193 WeakPolarHBondContact CA-O 3.11Å
190	E	69.1	Low	83.9	Confident	141 Å²	141	51.2 Å²	51.2	66%	0.659	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	-3.8	-179.3	-48.9	-164.5	151.5	0	0	117.1	F193	E190-F193 PolarHBondContact N-O 3.29Å
191	E	80.5	Confident	83.6	Confident	85 Å²	85	56.4 Å²	56.4	40%	0.397	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-57.1	168.9	-175	-177.2	146.3	0	0	111.4	F188 E189 N460 R463	F188-E191 HydrophobicContact CB-CB 4.35Å; E189-E191 PolarHBondContact O-N 3.22Å; E189-E191 VanDerWaalsContact O-N 3.13Å; E191-N460 PolarHBondContact OE1-ND2 3.14Å; E191-R463 WeakPolarHBondContact OE1-CG 3.2Å; E191-R463 IonicContact OE1-NE 2.77Å; E191-R463 PolarHBondContact OE1-NE 3.49Å; E191-R463 IonicContact OE2-CZ 3.57Å; E191-R463 IonicContact OE2-NE 3.22Å; E191-R463 PolarHBondContact OE2-NE 3.01Å; E191-R463 IonicContact OE2-NH2 3.52Å; E191-R463 PolarHBondContact OE2-NH2 3.09Å
192	D	80.8	Confident	83.5	Confident	23 Å²	23	56 Å²	56	12%	0.123	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-30.9	-179.7	-84.4	-5.3	0	0	0	112	F188 V383 R386 N460	F188-D192 PolarHBondContact O-N 2.84Å; F188-D192 VanDerWaalsContact O-N 3.15Å; D192-V383 HydrophobicContact CB-CG2 4.2Å; D192-R386 VanDerWaalsContact CG-NH2 3.3Å; D192-R386 IonicContact OD1-NH2 3.09Å; D192-R386 IonicContact OD2-CZ 2.86Å; D192-R386 IonicContact OD2-NH1 3.04Å; D192-R386 PolarHBondContact OD2-NH1 3.44Å; D192-R386 IonicContact OD2-NH2 2.8Å; D192-R386 PolarHBondContact OD2-NH2 3.16Å; D192-N460 WeakPolarHBondContact OD1-CB 3.08Å; D192-N460 PolarHBondContact OD1-ND2 2.99Å
193	F	87.8	Confident	83.3	Confident	4 Å²	4	56.2 Å²	56.2	2%	0.018	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-162.6	146.3	-169.9	-176	-104.7	0	0	0	113.2	W137 L138 V182 E189 E190 A195 V383	W137-F193 AromaticContact CD2-CE2 3.92Å; W137-F193 HydrophobicContact CD2-CE2 3.92Å; W137-F193 HydrophobicContact CD2-CZ 4.16Å; W137-F193 AromaticContact CE2-CE2 3.46Å; W137-F193 VanDerWaalsContact CE2-CE2 3.46Å; W137-F193 AromaticContact CE2-CZ 3.3Å; W137-F193 HydrophobicContact CE3-CE2 4.41Å; W137-F193 HydrophobicContact CG-CE2 4.45Å; W137-F193 HydrophobicContact CH2-CE2 4.2Å; W137-F193 AromaticContact CH2-CZ 3.6Å; W137-F193 HydrophobicContact CH2-CZ 3.6Å; W137-F193 AromaticContact CZ2-CE1 3.9Å; W137-F193 HydrophobicContact CZ2-CE1 3.9Å; W137-F193 AromaticContact CZ2-CE2 3.71Å; W137-F193 HydrophobicContact CZ2-CE2 3.71Å; W137-F193 AromaticContact CZ2-CZ 3.05Å; W137-F193 HydrophobicContact CZ2-CZ 3.05Å; W137-F193 HydrophobicContact CZ3-CZ 4.33Å; W137-F193 AromaticContact NE1-CE2 3.54Å; W137-F193 AromaticContact NE1-CZ 3.58Å; L138-F193 HydrophobicContact CD2-CE2 4.28Å; V182-F193 HydrophobicContact CB-CD1 4.26Å; V182-F193 HydrophobicContact CB-CE1 4.12Å; V182-F193 HydrophobicContact CG1-CB 3.99Å; V182-F193 HydrophobicContact CG1-CD1 3.42Å; V182-F193 VanDerWaalsContact CG1-CD1 3.42Å; V182-F193 HydrophobicContact CG1-CE1 3.78Å; V182-F193 HydrophobicContact CG1-CG 3.77Å; V182-F193 HydrophobicContact CG1-CZ 4.43Å; V182-F193 HydrophobicContact CG2-CE1 4.5Å; V182-F193 HydrophobicContact CG2-CZ 4.43Å; E189-F193 WeakPolarHBondContact CA-O 3.11Å; E190-F193 PolarHBondContact N-O 3.29Å; F193-A195 HydrophobicContact CD1-CB 3.91Å; F193-A195 HydrophobicContact CE1-CB 3.8Å; F193-V383 HydrophobicContact CB-CG1 4.45Å; F193-V383 HydrophobicContact CB-CG2 4.13Å; F193-V383 HydrophobicContact CD2-CG1 3.98Å
194	Q	87.4	Confident	83.1	Confident	30 Å²	30	57.9 Å²	57.9	14%	0.14	30%	0.302	C	S	.	.			trans	-109.9	99.4	176.5	-167	159.1	-33.4	0	0	110.8	W137 S142 Y198	W137-Q194 PolarHBondContact NE1-O 3.42Å; S142-Q194 VanDerWaalsContact CB-NE2 3.27Å; S142-Q194 PolarHBondContact OG-NE2 2.7Å; Q194-Y198 PolarHBondContact NE2-OH 3.15Å
195	A	85.7	Confident	83.1	Confident	5 Å²	5	57.4 Å²	57.4	4%	0.041	31%	0.305	C	S	.	.			trans	-83.3	-13.4	-173.9	0	0	0	0	0	114.2	R179 N183 F193 T197	R179-A195 WeakPolarHBondContact CD-O 3.4Å; R179-A195 HydrophobicContact CG-CB 4.09Å; N183-A195 VanDerWaalsContact OD1-CB 3.25Å; N183-A195 WeakPolarHBondContact OD1-CB 3.48Å; F193-A195 HydrophobicContact CD1-CB 3.91Å; F193-A195 HydrophobicContact CE1-CB 3.8Å; A195-T197 PolarHBondContact O-N 2.94Å
196	M	87.6	Confident	83.3	Confident	89 Å²	89	57.8 Å²	57.8	44%	0.438	31%	0.307	S	S	.	.			trans	-53.3	122.9	-179.1	-78.1	-85.3	-96	0	0	112	Y198	M196-Y198 HydrophobicContact CB-CD2 4.3Å; M196-Y198 HydrophobicContact CB-CE2 3.8Å; M196-Y198 VanDerWaalsContact O-CD2 3.22Å; M196-Y198 WeakPolarHBondContact O-CD2 3.42Å; M196-Y198 VanDerWaalsContact O-CE2 3.27Å; M196-Y198 WeakPolarHBondContact O-CE2 3.33Å
197	T	87.1	Confident	83.9	Confident	37 Å²	37	59.7 Å²	59.7	23%	0.227	31%	0.314	C	S	.	.			trans	-94.5	-6	-178.2	63.8	0	0	0	0	113.5	L143 A195 G199 F200 M202	L143-T197 HydrophobicContact CD1-CG2 4.37Å; A195-T197 PolarHBondContact O-N 2.94Å; T197-G199 PolarHBondContact O-N 3.32Å; T197-F200 WeakPolarHBondContact O-CB 3.36Å; T197-F200 VanDerWaalsContact O-CD2 3.27Å; T197-F200 WeakPolarHBondContact O-CD2 3.47Å; T197-F200 PolarHBondContact O-N 3.34Å; T197-M202 HydrophobicContact CG2-CE 3.64Å
198	Y	85.9	Confident	84.8	Confident	36 Å²	36	61.7 Å²	61.7	14%	0.141	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	27.9	177.6	-58.1	-86.9	0	0	0	114.9	S142 A144 Q194 M196 F200 L326	S142-Y198 WeakPolarHBondContact OG-CE2 3.45Å; S142-Y198 PolarHBondContact OG-OH 3.41Å; S142-Y198 VanDerWaalsContact OG-OH 3.05Å; A144-Y198 HydrophobicContact CB-CD1 4.47Å; A144-Y198 HydrophobicContact CB-CD2 3.66Å; A144-Y198 HydrophobicContact CB-CE2 3.73Å; A144-Y198 HydrophobicContact CB-CG 4.04Å; Q194-Y198 PolarHBondContact NE2-OH 3.15Å; M196-Y198 HydrophobicContact CB-CD2 4.3Å; M196-Y198 HydrophobicContact CB-CE2 3.8Å; M196-Y198 VanDerWaalsContact O-CD2 3.22Å; M196-Y198 WeakPolarHBondContact O-CD2 3.42Å; M196-Y198 VanDerWaalsContact O-CE2 3.27Å; M196-Y198 WeakPolarHBondContact O-CE2 3.33Å; Y198-F200 VanDerWaalsContact C-N 3.28Å; Y198-F200 PolarHBondContact O-N 2.81Å; Y198-L326 HydrophobicContact CD1-CB 4.09Å; Y198-L326 VanDerWaalsContact CD1-O 3.24Å; Y198-L326 WeakPolarHBondContact CD1-O 3.32Å; Y198-L326 WeakPolarHBondContact CE1-O 3.38Å
199	G	85.5	Confident	86.2	Confident	73 Å²	73	65.6 Å²	65.6	75%	0.753	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	1.8	-178	0	0	0	0	0	114.9	T197	T197-G199 PolarHBondContact O-N 3.32Å
200	F	87.9	Confident	87.9	Confident	39 Å²	39	67.7 Å²	67.7	17%	0.171	35%	0.35	C	S	.	.			trans	-68.8	144	172.9	-72	-80.4	0	0	0	111.7	F148 H154 T197 Y198 N323 L326	F148-F200 HydrophobicContact CB-CD2 4.31Å; F148-F200 HydrophobicContact CB-CE2 4.07Å; F148-F200 HydrophobicContact CB-CZ 4.2Å; F148-F200 HydrophobicContact CD1-CB 4.31Å; F148-F200 HydrophobicContact CD1-CD1 4.14Å; F148-F200 HydrophobicContact CD1-CD2 4.36Å; F148-F200 HydrophobicContact CD1-CG 4.02Å; F148-F200 HydrophobicContact CD2-CB 4.06Å; F148-F200 HydrophobicContact CD2-CD1 4.46Å; F148-F200 AromaticContact CD2-CD2 3.27Å; F148-F200 HydrophobicContact CD2-CD2 3.27Å; F148-F200 AromaticContact CD2-CE2 3.81Å; F148-F200 HydrophobicContact CD2-CE2 3.81Å; F148-F200 AromaticContact CD2-CG 3.68Å; F148-F200 HydrophobicContact CD2-CG 3.68Å; F148-F200 HydrophobicContact CE1-CB 3.75Å; F148-F200 HydrophobicContact CE1-CD1 4.32Å; F148-F200 AromaticContact CE1-CG 3.97Å; F148-F200 HydrophobicContact CE1-CG 3.97Å; F148-F200 HydrophobicContact CE2-CB 3.45Å; F148-F200 VanDerWaalsContact CE2-CB 3.45Å; F148-F200 AromaticContact CE2-CD2 3.51Å; F148-F200 HydrophobicContact CE2-CD2 3.51Å; F148-F200 HydrophobicContact CE2-CE2 4.46Å; F148-F200 AromaticContact CE2-CG 3.62Å; F148-F200 HydrophobicContact CE2-CG 3.62Å; F148-F200 HydrophobicContact CG-CB 4.46Å; F148-F200 HydrophobicContact CG-CD1 4.23Å; F148-F200 AromaticContact CG-CD2 3.76Å; F148-F200 HydrophobicContact CG-CD2 3.76Å; F148-F200 HydrophobicContact CG-CE1 4.47Å; F148-F200 HydrophobicContact CG-CE2 4.03Å; F148-F200 AromaticContact CG-CG 3.89Å; F148-F200 HydrophobicContact CG-CG 3.89Å; F148-F200 HydrophobicContact CG-CZ 4.39Å; F148-F200 HydrophobicContact CZ-CB 3.27Å; F148-F200 HydrophobicContact CZ-CD2 4.16Å; F148-F200 AromaticContact CZ-CG 3.77Å; F148-F200 HydrophobicContact CZ-CG 3.77Å; H154-F200 AromaticContact CD2-CE1 3.63Å; H154-F200 AromaticContact CE1-CE1 3.93Å; H154-F200 AromaticContact CG-CE1 3.9Å; H154-F200 AromaticContact NE2-CE1 3.67Å; T197-F200 WeakPolarHBondContact O-CB 3.36Å; T197-F200 VanDerWaalsContact O-CD2 3.27Å; T197-F200 WeakPolarHBondContact O-CD2 3.47Å; T197-F200 PolarHBondContact O-N 3.34Å; Y198-F200 VanDerWaalsContact C-N 3.28Å; Y198-F200 PolarHBondContact O-N 2.81Å; F200-N323 VanDerWaalsContact CZ-OD1 3.25Å; F200-N323 WeakPolarHBondContact CZ-OD1 3.45Å; F200-L326 HydrophobicContact CE2-CD1 3.56Å; F200-L326 HydrophobicContact CZ-CD1 3.87Å
201	K	86.9	Confident	89.2	Confident	175 Å²	175	61 Å²	61	76%	0.761	32%	0.319	S	S	*	.			trans	-89.1	132.8	177.6	-63.5	179	-178.5	175.1	0	110.1	A203	K201-A203 VanDerWaalsContact C-N 3.3Å; K201-A203 PolarHBondContact O-N 3.36Å
202	M	89.6	Confident	90	Very high	4 Å²	4	58 Å²	58	2%	0.02	31%	0.307	C	S	.	.			trans	-93.1	42.4	179.5	-59.5	-63.2	-170.6	0	0	113.4	L143 F148 L172 C175 D176 T197 N204	L143-M202 HydrophobicContact CD1-CE 3.58Å; F148-M202 HydrophobicContact CE1-SD 4.43Å; F148-M202 HydrophobicContact CE2-CE 4.09Å; F148-M202 HydrophobicContact CZ-CE 3.53Å; F148-M202 HydrophobicContact CZ-SD 3.83Å; L172-M202 HydrophobicContact CD2-SD 4.1Å; C175-M202 HydrophobicContact CB-SD 4.28Å; D176-M202 HydrophobicContact CB-CB 3.71Å; D176-M202 HydrophobicContact CB-CG 4.16Å; T197-M202 HydrophobicContact CG2-CE 3.64Å; M202-N204 VanDerWaalsContact C-N 3.26Å; M202-N204 PolarHBondContact O-N 2.75Å; M202-N204 PolarHBondContact O-OD1 3.15Å
203	A	88.8	Confident	90.9	Very high	5 Å²	5	58.2 Å²	58.2	4%	0.041	32%	0.315	C	S	.	.	S	Bend	trans	56.4	34.8	-175.5	0	0	0	0	0	114.5	L169 L172 K173 K201 N205 V206	L169-A203 HydrophobicContact CD2-CB 3.65Å; L172-A203 HydrophobicContact CB-CB 4.01Å; L172-A203 HydrophobicContact CD1-CB 3.98Å; K173-A203 WeakPolarHBondContact CE-O 3.46Å; K201-A203 VanDerWaalsContact C-N 3.3Å; K201-A203 PolarHBondContact O-N 3.36Å; A203-N205 PolarHBondContact O-N 3.23Å; A203-N205 VanDerWaalsContact O-N 3.12Å; A203-V206 PolarHBondContact O-N 2.72Å; A203-V206 VanDerWaalsContact O-N 3.08Å
204	N	85.8	Confident	91.4	Very high	112 Å²	112	60.1 Å²	60.1	60%	0.599	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-16.8	-177.9	-61.4	-0.3	0	0	0	113.7	M202 V206	M202-N204 VanDerWaalsContact C-N 3.26Å; M202-N204 PolarHBondContact O-N 2.75Å; M202-N204 PolarHBondContact O-OD1 3.15Å; N204-V206 VanDerWaalsContact C-N 3.27Å
205	N	89.6	Confident	91.9	Very high	110 Å²	110	58.7 Å²	58.7	59%	0.588	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-11	175.6	60.4	-31.6	0	0	0	113.7	A203	A203-N205 PolarHBondContact O-N 3.23Å; A203-N205 VanDerWaalsContact O-N 3.12Å
206	V	93.9	Very high	92.5	Very high	11 Å²	11	61.9 Å²	61.9	7%	0.067	33%	0.33	C	S	.	.	S	Bend	trans	-120.4	135.2	-179.9	-169	0	0	0	0	109.3	L169 K173 A203 N204 R210 V211	L169-V206 HydrophobicContact CD2-CG2 4.37Å; K173-V206 WeakPolarHBondContact CE-O 3.25Å; K173-V206 PolarHBondContact NZ-O 3.28Å; A203-V206 PolarHBondContact O-N 2.72Å; A203-V206 VanDerWaalsContact O-N 3.08Å; N204-V206 VanDerWaalsContact C-N 3.27Å; V206-R210 HydrophobicContact CG1-CB 3.9Å; V206-R210 HydrophobicContact CG1-CG 3.73Å; V206-V211 HydrophobicContact CB-CG2 4.1Å; V206-V211 HydrophobicContact CG1-CG2 3.6Å
207	T	96.4	Very high	93	Very high	91 Å²	91	62.8 Å²	62.8	56%	0.558	34%	0.337	S	S	*	.			trans	-74.5	152.1	178.7	63.1	0	0	0	0	111.4	L209 R210 V211	T207-L209 VanDerWaalsContact C-N 3.26Å; T207-L209 PolarHBondContact O-N 2.95Å; T207-R210 PolarHBondContact O-N 3.2Å; T207-R210 WeakPolarHBondContact OG1-CB 3.31Å; T207-R210 PolarHBondContact OG1-N 3.03Å; T207-V211 PolarHBondContact O-N 3.31Å
208	D	95.4	Very high	93.5	Very high	51 Å²	51	61.6 Å²	61.6	27%	0.273	33%	0.329	S	S	.	.	H	α-helix	trans	-58.8	-41	178.9	-59.3	-8.5	0	0	0	111.4	K173 R210 V211 T212 I266	K173-D208 WeakPolarHBondContact CD-OD1 3.33Å; K173-D208 VanDerWaalsContact CE-OD1 3.28Å; K173-D208 WeakPolarHBondContact CE-OD1 3.25Å; K173-D208 IonicContact NZ-OD1 2.86Å; K173-D208 PolarHBondContact NZ-OD1 2.89Å; D208-R210 VanDerWaalsContact C-N 3.34Å; D208-R210 PolarHBondContact O-N 3.07Å; D208-V211 PolarHBondContact O-N 2.96Å; D208-T212 WeakPolarHBondContact O-CG2 3.2Å; D208-T212 PolarHBondContact O-N 2.96Å; D208-T212 PolarHBondContact O-OG1 2.88Å; D208-I266 HydrophobicContact CB-CD1 3.74Å; D208-I266 HydrophobicContact CB-CG1 4.26Å
209	L	96	Very high	94.1	Very high	143 Å²	143	60.5 Å²	60.5	75%	0.749	33%	0.326	S	S	*	.	H	α-helix	trans	-57.6	-45.5	174.6	-177.6	63.6	0	0	0	111.5	T207 T212 G213	T207-L209 VanDerWaalsContact C-N 3.26Å; T207-L209 PolarHBondContact O-N 2.95Å; L209-T212 WeakPolarHBondContact CA-OG1 3.49Å; L209-T212 PolarHBondContact O-N 3.26Å; L209-T212 PolarHBondContact O-OG1 3.46Å; L209-G213 PolarHBondContact O-N 3.38Å
210	R	97.4	Very high	94.7	Very high	157 Å²	157	60.2 Å²	60.2	59%	0.592	31%	0.307	S	S	*	.	H	α-helix	trans	-64.9	-43	178.8	178.7	167.9	174.2	-167.1	4.5	111.8	V206 T207 D208 G213 M214	V206-R210 HydrophobicContact CG1-CB 3.9Å; V206-R210 HydrophobicContact CG1-CG 3.73Å; T207-R210 PolarHBondContact O-N 3.2Å; T207-R210 WeakPolarHBondContact OG1-CB 3.31Å; T207-R210 PolarHBondContact OG1-N 3.03Å; D208-R210 VanDerWaalsContact C-N 3.34Å; D208-R210 PolarHBondContact O-N 3.07Å; R210-G213 PolarHBondContact O-N 2.99Å; R210-M214 HydrophobicContact CG-SD 4.32Å; R210-M214 WeakPolarHBondContact O-CG 3.43Å; R210-M214 PolarHBondContact O-N 3.31Å
211	V	97.6	Very high	95.1	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-64.2	-44.5	177.5	178.6	0	0	0	0	111.2	L169 K173 V206 T207 D208 G213 M214 L215 L262	L169-V211 HydrophobicContact CB-CG1 3.99Å; L169-V211 HydrophobicContact CB-CG2 4.1Å; K173-V211 HydrophobicContact CG-CG1 4.43Å; K173-V211 HydrophobicContact CG-CG2 4.17Å; V206-V211 HydrophobicContact CB-CG2 4.1Å; V206-V211 HydrophobicContact CG1-CG2 3.6Å; T207-V211 PolarHBondContact O-N 3.31Å; D208-V211 PolarHBondContact O-N 2.96Å; V211-G213 VanDerWaalsContact C-N 3.3Å; V211-G213 PolarHBondContact O-N 3.35Å; V211-M214 PolarHBondContact O-N 3.49Å; V211-L215 HydrophobicContact CG1-CD1 4.34Å; V211-L215 PolarHBondContact O-N 3.02Å; V211-L262 HydrophobicContact CG1-CD2 3.89Å
212	T	97.7	Very high	95.5	Very high	23 Å²	23	53.9 Å²	53.9	14%	0.141	28%	0.281	C	S	.	.	H	α-helix	trans	-63.5	-35.2	175.7	58.7	0	0	0	0	112.6	D208 L209 K216 L262 I266	D208-T212 WeakPolarHBondContact O-CG2 3.2Å; D208-T212 PolarHBondContact O-N 2.96Å; D208-T212 PolarHBondContact O-OG1 2.88Å; L209-T212 WeakPolarHBondContact CA-OG1 3.49Å; L209-T212 PolarHBondContact O-N 3.26Å; L209-T212 PolarHBondContact O-OG1 3.46Å; T212-K216 WeakPolarHBondContact O-CB 3.4Å; T212-K216 PolarHBondContact O-N 2.96Å; T212-L262 HydrophobicContact CG2-CD2 3.9Å; T212-L262 HydrophobicContact CG2-CG 4.11Å; T212-I266 HydrophobicContact CG2-CD1 3.8Å
213	G	98.3	Very high	95.8	Very high	28 Å²	28	56.6 Å²	56.6	29%	0.289	29%	0.293	S	S	.	.	H	α-helix	trans	-63	-48.6	171.8	0	0	0	0	0	112.4	L209 R210 V211 L215 K216 D217	L209-G213 PolarHBondContact O-N 3.38Å; R210-G213 PolarHBondContact O-N 2.99Å; V211-G213 VanDerWaalsContact C-N 3.3Å; V211-G213 PolarHBondContact O-N 3.35Å; G213-L215 VanDerWaalsContact C-N 3.34Å; G213-L215 PolarHBondContact O-N 3.37Å; G213-K216 CarbonylContact O-C 3.29Å; G213-K216 WeakPolarHBondContact O-CA 3.48Å; G213-K216 WeakPolarHBondContact O-CB 3.28Å; G213-K216 PolarHBondContact O-N 2.98Å; G213-D217 VanDerWaalsContact O-CG 3.31Å; G213-D217 PolarHBondContact O-N 3.36Å
214	M	98.3	Very high	96	Very high	43 Å²	43	64.4 Å²	64.4	21%	0.212	32%	0.322	C	S	.	.	H	α-helix	trans	-59.1	-43.1	176.6	-69.5	174	66.7	0	0	112.4	K165 A166 L169 R210 V211 K216 D217 V218	K165-M214 HydrophobicContact CD-CE 4.33Å; K165-M214 HydrophobicContact CG-CE 4.25Å; A166-M214 HydrophobicContact CB-CB 4.03Å; L169-M214 HydrophobicContact CD1-CE 3.86Å; L169-M214 HydrophobicContact CD1-SD 4.05Å; R210-M214 HydrophobicContact CG-SD 4.32Å; R210-M214 WeakPolarHBondContact O-CG 3.43Å; R210-M214 PolarHBondContact O-N 3.31Å; V211-M214 PolarHBondContact O-N 3.49Å; M214-K216 VanDerWaalsContact C-N 3.27Å; M214-K216 PolarHBondContact O-N 2.98Å; M214-D217 PolarHBondContact O-N 3.28Å; M214-V218 WeakPolarHBondContact O-CG2 3.42Å; M214-V218 PolarHBondContact O-N 3.42Å; M214-V218 VanDerWaalsContact O-N 3.13Å
215	L	98.4	Very high	96.3	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-62.7	-36.1	174.6	-74.2	167	0	0	0	111.9	A166 V211 G213 E219 I255 T258 R259 L262	A166-L215 HydrophobicContact CB-CD2 3.96Å; A166-L215 HydrophobicContact CB-CG 4.27Å; V211-L215 HydrophobicContact CG1-CD1 4.34Å; V211-L215 PolarHBondContact O-N 3.02Å; G213-L215 VanDerWaalsContact C-N 3.34Å; G213-L215 PolarHBondContact O-N 3.37Å; L215-E219 WeakPolarHBondContact O-CB 3.39Å; L215-E219 PolarHBondContact O-N 2.91Å; L215-I255 HydrophobicContact CD2-CG2 4.15Å; L215-T258 HydrophobicContact CD1-CG2 4.34Å; L215-T258 HydrophobicContact CD2-CG2 4.42Å; L215-R259 HydrophobicContact CB-CB 3.95Å; L215-R259 HydrophobicContact CB-CG 4.01Å; L215-R259 HydrophobicContact CD1-CB 4.15Å; L215-R259 HydrophobicContact CD1-CG 4.46Å; L215-L262 HydrophobicContact CD1-CD2 4.12Å
216	K	98.4	Very high	96.4	Very high	72 Å²	72	58.9 Å²	58.9	31%	0.313	29%	0.288	S	S	.	.	H	α-helix	trans	-70	-40.7	177.8	-177.2	56.7	-178.2	141.2	0	112	T212 G213 M214 V218 E219 D220	T212-K216 WeakPolarHBondContact O-CB 3.4Å; T212-K216 PolarHBondContact O-N 2.96Å; G213-K216 CarbonylContact O-C 3.29Å; G213-K216 WeakPolarHBondContact O-CA 3.48Å; G213-K216 WeakPolarHBondContact O-CB 3.28Å; G213-K216 PolarHBondContact O-N 2.98Å; M214-K216 VanDerWaalsContact C-N 3.27Å; M214-K216 PolarHBondContact O-N 2.98Å; K216-V218 PolarHBondContact O-N 2.93Å; K216-E219 IonicContact NZ-OE1 3.2Å; K216-E219 PolarHBondContact NZ-OE1 3.41Å; K216-E219 WeakPolarHBondContact O-CB 3.18Å; K216-E219 PolarHBondContact O-N 3.24Å; K216-D220 WeakPolarHBondContact CE-OD2 3.38Å; K216-D220 VanDerWaalsContact NZ-CG 3.32Å; K216-D220 IonicContact NZ-OD1 2.75Å; K216-D220 PolarHBondContact NZ-OD1 2.77Å; K216-D220 IonicContact NZ-OD2 3.68Å; K216-D220 PolarHBondContact NZ-OD2 3.12Å; K216-D220 PolarHBondContact O-N 3.42Å
217	D	98.3	Very high	96.2	Very high	109 Å²	109	64.9 Å²	64.9	58%	0.583	31%	0.313	S	S	*	.	H	α-helix	trans	-61.4	-45.1	176.5	-65	-26.4	0	0	0	111.1	G213 M214 D220 E221	G213-D217 VanDerWaalsContact O-CG 3.31Å; G213-D217 PolarHBondContact O-N 3.36Å; M214-D217 PolarHBondContact O-N 3.28Å; D217-D220 PolarHBondContact O-N 3.41Å; D217-E221 PolarHBondContact O-N 2.94Å
218	V	98.1	Very high	95.6	Very high	11 Å²	11	65.1 Å²	65.1	7%	0.067	32%	0.319	C	S	.	.	H	α-helix	trans	-63.2	-43.9	174.3	173.2	0	0	0	0	111	P162 A163 A166 M214 K216 D220 E221 L222 I255	P162-V218 HydrophobicContact CB-CG2 4.32Å; A163-V218 HydrophobicContact CB-CG1 3.7Å; A166-V218 HydrophobicContact CB-CG2 3.99Å; M214-V218 WeakPolarHBondContact O-CG2 3.42Å; M214-V218 PolarHBondContact O-N 3.42Å; M214-V218 VanDerWaalsContact O-N 3.13Å; K216-V218 PolarHBondContact O-N 2.93Å; V218-D220 VanDerWaalsContact C-N 3.31Å; V218-D220 PolarHBondContact O-N 3.47Å; V218-E221 PolarHBondContact O-N 3.47Å; V218-L222 HydrophobicContact CG1-CD1 3.86Å; V218-L222 HydrophobicContact CG1-CG 4.35Å; V218-L222 WeakPolarHBondContact O-CB 3.46Å; V218-L222 WeakPolarHBondContact O-CG 3.23Å; V218-L222 PolarHBondContact O-N 2.98Å; V218-I255 HydrophobicContact CB-CG2 4.29Å; V218-I255 HydrophobicContact CG1-CD1 4.49Å; V218-I255 HydrophobicContact CG1-CG1 4.17Å; V218-I255 HydrophobicContact CG1-CG2 3.97Å
219	E	97.4	Very high	94.9	Very high	13 Å²	13	63.8 Å²	63.8	6%	0.061	31%	0.313	C	S	.	.	H	α-helix	trans	-55.9	-45.6	175	177.9	-168.8	133.2	0	0	111.2	L215 K216 L222 Q223 F252 I255 K256 R259	L215-E219 WeakPolarHBondContact O-CB 3.39Å; L215-E219 PolarHBondContact O-N 2.91Å; K216-E219 IonicContact NZ-OE1 3.2Å; K216-E219 PolarHBondContact NZ-OE1 3.41Å; K216-E219 WeakPolarHBondContact O-CB 3.18Å; K216-E219 PolarHBondContact O-N 3.24Å; E219-L222 PolarHBondContact O-N 3.01Å; E219-Q223 VanDerWaalsContact O-CB 3.3Å; E219-Q223 WeakPolarHBondContact O-CB 3.39Å; E219-Q223 PolarHBondContact O-N 2.91Å; E219-F252 HydrophobicContact CG-CD2 4.07Å; E219-F252 HydrophobicContact CG-CE2 3.4Å; E219-F252 VanDerWaalsContact CG-CE2 3.4Å; E219-F252 HydrophobicContact CG-CZ 4.13Å; E219-I255 HydrophobicContact CB-CG2 4.42Å; E219-K256 HydrophobicContact CG-CB 4.35Å; E219-R259 IonicContact OE1-NH2 2.66Å; E219-R259 PolarHBondContact OE1-NH2 2.95Å; E219-R259 IonicContact OE2-CZ 3.17Å; E219-R259 IonicContact OE2-NE 2.72Å; E219-R259 PolarHBondContact OE2-NE 3.47Å; E219-R259 IonicContact OE2-NH2 2.78Å; E219-R259 PolarHBondContact OE2-NH2 3.45Å
220	D	97.7	Very high	93.9	Very high	67 Å²	67	66 Å²	66	36%	0.358	31%	0.311	S	S	.	.	H	α-helix	trans	-71.3	-32.8	-178.7	-73.3	-27	0	0	0	113	K216 D217 V218 R224	K216-D220 WeakPolarHBondContact CE-OD2 3.38Å; K216-D220 VanDerWaalsContact NZ-CG 3.32Å; K216-D220 IonicContact NZ-OD1 2.75Å; K216-D220 PolarHBondContact NZ-OD1 2.77Å; K216-D220 IonicContact NZ-OD2 3.68Å; K216-D220 PolarHBondContact NZ-OD2 3.12Å; K216-D220 PolarHBondContact O-N 3.42Å; D217-D220 PolarHBondContact O-N 3.41Å; V218-D220 VanDerWaalsContact C-N 3.31Å; V218-D220 PolarHBondContact O-N 3.47Å; D220-R224 WeakPolarHBondContact O-CG 3.35Å; D220-R224 PolarHBondContact O-N 3.3Å; D220-R224 VanDerWaalsContact O-N 3.16Å; D220-R224 PolarHBondContact O-NE 3.41Å
221	E	96.6	Very high	92.6	Very high	74 Å²	74	60.5 Å²	60.5	35%	0.346	30%	0.297	S	S	.	.	H	α-helix	trans	-64.6	-50.3	169.8	-168.5	-169.7	146.4	0	0	111.7	D217 V218 Q223 R224 K225	D217-E221 PolarHBondContact O-N 2.94Å; V218-E221 PolarHBondContact O-N 3.47Å; E221-Q223 VanDerWaalsContact C-N 3.3Å; E221-Q223 PolarHBondContact O-N 3.49Å; E221-R224 WeakPolarHBondContact O-CB 3.37Å; E221-R224 PolarHBondContact O-N 3.36Å; E221-R224 VanDerWaalsContact O-N 3.11Å; E221-K225 PolarHBondContact O-N 3.48Å; E221-K225 WeakPolarHBondContact OE1-CE 3.41Å; E221-K225 IonicContact OE1-NZ 3.59Å; E221-K225 PolarHBondContact OE1-NZ 2.62Å
222	L	95.6	Very high	91.5	Very high	7 Å²	7	69.9 Å²	69.9	4%	0.037	33%	0.332	C	S	.	.	H	α-helix	trans	-62.1	-38.7	178	-70.4	171.5	0	0	0	111.3	V218 E219 R224 K225 V226 L251 F252 I255	V218-L222 HydrophobicContact CG1-CD1 3.86Å; V218-L222 HydrophobicContact CG1-CG 4.35Å; V218-L222 WeakPolarHBondContact O-CB 3.46Å; V218-L222 WeakPolarHBondContact O-CG 3.23Å; V218-L222 PolarHBondContact O-N 2.98Å; E219-L222 PolarHBondContact O-N 3.01Å; L222-R224 VanDerWaalsContact C-N 3.29Å; L222-R224 PolarHBondContact O-N 3.46Å; L222-K225 PolarHBondContact O-N 3.33Å; L222-K225 VanDerWaalsContact O-N 3.17Å; L222-V226 VanDerWaalsContact O-CG2 3.29Å; L222-V226 WeakPolarHBondContact O-CG2 3.35Å; L222-V226 PolarHBondContact O-N 3Å; L222-L251 HydrophobicContact CD1-CD2 4.17Å; L222-L251 HydrophobicContact CD1-CG 3.87Å; L222-L251 HydrophobicContact CD2-CD2 3.9Å; L222-L251 HydrophobicContact CD2-CG 4.35Å; L222-F252 HydrophobicContact CB-CB 4.08Å; L222-F252 HydrophobicContact CB-CD2 4.04Å; L222-F252 HydrophobicContact CD1-CB 4.49Å; L222-I255 HydrophobicContact CD1-CB 4.42Å; L222-I255 HydrophobicContact CD1-CG1 4.02Å
223	Q	95.4	Very high	89.8	Confident	61 Å²	61	78.7 Å²	78.7	29%	0.285	37%	0.372	S	S	.	.	H	α-helix	trans	-61.2	-37.6	175.2	-172.5	65.8	13.5	0	0	112	E219 E221 K227 F252	E219-Q223 VanDerWaalsContact O-CB 3.3Å; E219-Q223 WeakPolarHBondContact O-CB 3.39Å; E219-Q223 PolarHBondContact O-N 2.91Å; E221-Q223 VanDerWaalsContact C-N 3.3Å; E221-Q223 PolarHBondContact O-N 3.49Å; Q223-K227 VanDerWaalsContact O-CG 3.31Å; Q223-K227 WeakPolarHBondContact O-CG 3.21Å; Q223-K227 PolarHBondContact O-N 3.37Å; Q223-F252 HydrophobicContact CB-CD2 4.32Å; Q223-F252 HydrophobicContact CB-CE2 3.88Å; Q223-F252 HydrophobicContact CG-CE2 4.44Å
224	R	94.7	Very high	88.3	Confident	169 Å²	169	81.5 Å²	81.5	64%	0.638	40%	0.401	S	S	*	.	H	α-helix	trans	-65.7	-44.6	173.9	-75.5	-179.1	-73.6	159.4	-2.5	111.2	D220 E221 L222 K227 S228	D220-R224 WeakPolarHBondContact O-CG 3.35Å; D220-R224 PolarHBondContact O-N 3.3Å; D220-R224 VanDerWaalsContact O-N 3.16Å; D220-R224 PolarHBondContact O-NE 3.41Å; E221-R224 WeakPolarHBondContact O-CB 3.37Å; E221-R224 PolarHBondContact O-N 3.36Å; E221-R224 VanDerWaalsContact O-N 3.11Å; L222-R224 VanDerWaalsContact C-N 3.29Å; L222-R224 PolarHBondContact O-N 3.46Å; R224-K227 PolarHBondContact O-N 3.28Å; R224-S228 PolarHBondContact O-N 2.93Å; R224-S228 PolarHBondContact O-OG 3.42Å
225	K	90.6	Very high	87.2	Confident	91 Å²	91	85 Å²	85	40%	0.396	42%	0.417	S	S	.	.	H	α-helix	trans	-62	-41.4	175.8	-68.3	-179.3	-175	168.7	0	112.5	E221 L222 K227 S228 T229	E221-K225 PolarHBondContact O-N 3.48Å; E221-K225 WeakPolarHBondContact OE1-CE 3.41Å; E221-K225 IonicContact OE1-NZ 3.59Å; E221-K225 PolarHBondContact OE1-NZ 2.62Å; L222-K225 PolarHBondContact O-N 3.33Å; L222-K225 VanDerWaalsContact O-N 3.17Å; K225-K227 VanDerWaalsContact C-N 3.33Å; K225-K227 PolarHBondContact O-N 3.41Å; K225-S228 WeakPolarHBondContact CA-OG 3.37Å; K225-S228 PolarHBondContact O-N 3.06Å; K225-S228 PolarHBondContact O-OG 3.11Å; K225-T229 WeakPolarHBondContact O-CB 3.48Å; K225-T229 WeakPolarHBondContact O-CG2 3.35Å; K225-T229 PolarHBondContact O-N 3.39Å; K225-T229 PolarHBondContact O-OG1 3.23Å
226	V	91.5	Very high	85.5	Confident	15 Å²	15	94.5 Å²	94.5	9%	0.091	46%	0.461	C	S	.	.	H	α-helix	trans	-63.2	-40	175.2	169.8	0	0	0	0	111.1	L222 T229 R230 H245 C248 L249 F252	L222-V226 VanDerWaalsContact O-CG2 3.29Å; L222-V226 WeakPolarHBondContact O-CG2 3.35Å; L222-V226 PolarHBondContact O-N 3Å; V226-T229 PolarHBondContact O-OG1 2.95Å; V226-R230 PolarHBondContact O-N 3.13Å; V226-H245 PolarHBondContact O-CE1 3.15Å; V226-H245 VanDerWaalsContact O-CE1 3.27Å; V226-H245 PolarHBondContact O-ND1 3.47Å; V226-C248 HydrophobicContact CG2-CB 3.94Å; V226-L249 HydrophobicContact CG1-CD1 4.19Å; V226-L249 HydrophobicContact CG2-CB 4.33Å; V226-F252 HydrophobicContact CG2-CB 4.49Å
227	K	89.5	Confident	84.3	Confident	137 Å²	137	94.2 Å²	94.2	60%	0.596	46%	0.458	S	S	*	.	H	α-helix	trans	-68.4	-39.9	176	-75	175.2	-178.4	179.2	0	112.5	Q223 R224 K225 T229 R230	Q223-K227 VanDerWaalsContact O-CG 3.31Å; Q223-K227 WeakPolarHBondContact O-CG 3.21Å; Q223-K227 PolarHBondContact O-N 3.37Å; R224-K227 PolarHBondContact O-N 3.28Å; K225-K227 VanDerWaalsContact C-N 3.33Å; K225-K227 PolarHBondContact O-N 3.41Å; K227-T229 VanDerWaalsContact C-N 3.33Å; K227-R230 WeakPolarHBondContact O-CB 3.47Å; K227-R230 PolarHBondContact O-N 3.39Å
228	S	85.3	Confident	83.5	Confident	97 Å²	97	93.2 Å²	93.2	68%	0.678	45%	0.452	S	S	*	.	H	α-helix	trans	-71.5	-29.2	-179.9	61.3	0	0	0	0	112.9	R224 K225 R230	R224-S228 PolarHBondContact O-N 2.93Å; R224-S228 PolarHBondContact O-OG 3.42Å; K225-S228 WeakPolarHBondContact CA-OG 3.37Å; K225-S228 PolarHBondContact O-N 3.06Å; K225-S228 PolarHBondContact O-OG 3.11Å; S228-R230 VanDerWaalsContact C-N 3.32Å
229	T	79.9	Confident	82.9	Confident	22 Å²	22	97.3 Å²	97.3	14%	0.135	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	3.1	177.2	53.9	0	0	0	0	113.2	K225 V226 K227 R237 H245	K225-T229 WeakPolarHBondContact O-CB 3.48Å; K225-T229 WeakPolarHBondContact O-CG2 3.35Å; K225-T229 PolarHBondContact O-N 3.39Å; K225-T229 PolarHBondContact O-OG1 3.23Å; V226-T229 PolarHBondContact O-OG1 2.95Å; K227-T229 VanDerWaalsContact C-N 3.33Å; T229-R237 PolarHBondContact O-NH2 3.42Å; T229-H245 PolarHBondContact OG1-ND1 3.5Å
230	R	76.3	Confident	82.3	Confident	191 Å²	191	102.3 Å²	102.3	72%	0.721	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-78.4	124.8	-179.4	-170.6	-179.9	-177	-176.2	2	111	V226 K227 S228	V226-R230 PolarHBondContact O-N 3.13Å; K227-R230 WeakPolarHBondContact O-CB 3.47Å; K227-R230 PolarHBondContact O-N 3.39Å; S228-R230 VanDerWaalsContact C-N 3.32Å
231	S	70.1	Confident	81.7	Confident	41 Å²	41	101.8 Å²	101.8	29%	0.287	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-72.1	147.8	174.8	-160.7	0	0	0	0	112.3
232	R	73.7	Confident	81.3	Confident	196 Å²	196	101.2 Å²	101.2	74%	0.74	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-76.1	153.9	170.7	-65.8	178.3	177	-178.7	0.5	110.2	G234 E235	R232-G234 PolarHBondContact O-N 2.87Å; R232-E235 PolarHBondContact O-N 2.9Å
233	Q	62.5	Low	81	Confident	209 Å²	209	104.5 Å²	104.5	98%	0.977	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	121.3	176.1	-94.5	-178.1	-16.4	0	0	110
234	G	66.3	Low	80.7	Confident	87 Å²	87	106.3 Å²	106.3	90%	0.897	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.3	-6.3	176.8	0	0	0	0	0	116	R232	R232-G234 PolarHBondContact O-N 2.87Å
235	E	74.9	Confident	80.6	Confident	117 Å²	117	99.2 Å²	99.2	55%	0.547	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-87.7	130.4	174.9	-74.3	172.8	175.6	0	0	111.2	R232	R232-E235 PolarHBondContact O-N 2.9Å
236	Q	62.5	Low	80.8	Confident	198 Å²	198	97.5 Å²	97.5	93%	0.925	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-72.1	132.4	169.3	-84	-170.2	-9.9	0	0	109.9
237	R	73.3	Confident	81	Confident	66 Å²	66	98.3 Å²	98.3	25%	0.249	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-87.9	137.9	-172.8	-142.6	173	-177.2	173.5	2.9	111.2	T229 P239 E242 H245	T229-R237 PolarHBondContact O-NH2 3.42Å; R237-P239 WeakPolarHBondContact O-CD 3.34Å; R237-E242 WeakPolarHBondContact CD-OE2 3.25Å; R237-E242 HydrophobicContact CG-CB 4.27Å; R237-E242 IonicContact CZ-OE1 2.62Å; R237-E242 IonicContact CZ-OE2 3.02Å; R237-E242 IonicContact NE-OE2 3.71Å; R237-E242 PolarHBondContact NE-OE2 3.44Å; R237-E242 IonicContact NH1-OE1 3.36Å; R237-E242 PolarHBondContact NH1-OE1 2.9Å; R237-E242 IonicContact NH1-OE2 3.72Å; R237-E242 PolarHBondContact NH1-OE2 2.92Å; R237-H245 PolarHBondContact NH2-CD2 3Å; R237-H245 PolarHBondContact NH2-ND1 3.03Å
238	N	81.8	Confident	81.2	Confident	88 Å²	88	91.9 Å²	91.9	47%	0.471	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-63.6	126.6	161.9	-178.9	-19.1	0	0	0	108.1	D240 V241 E242	N238-D240 PolarHBondContact O-N 3.16Å; N238-D240 PolarHBondContact OD1-N 2.87Å; N238-D240 VanDerWaalsContact OD1-N 3.08Å; N238-V241 HydrophobicContact CB-CB 4.33Å; N238-V241 HydrophobicContact CB-CG2 4.01Å; N238-V241 PolarHBondContact O-N 2.99Å; N238-V241 VanDerWaalsContact O-N 3.12Å; N238-E242 PolarHBondContact O-N 3.31Å
239	P	85.1	Confident	81.8	Confident	98 Å²	98	89.7 Å²	89.7	64%	0.636	45%	0.452	S	S	*	.	H	α-helix	trans	-51.3	-36.2	178.7	-29.1	35.7	0	0	0	114.7	R237 E242 L243	R237-P239 WeakPolarHBondContact O-CD 3.34Å; P239-E242 WeakPolarHBondContact O-CB 3.44Å; P239-E242 PolarHBondContact O-N 3.39Å; P239-L243 WeakPolarHBondContact O-CB 3.27Å; P239-L243 PolarHBondContact O-N 3.5Å
240	D	85.1	Confident	82.6	Confident	117 Å²	117	88.8 Å²	88.8	63%	0.626	45%	0.446	S	S	*	.	H	α-helix	trans	-69.7	-38.6	-179	-62.3	-37.6	0	0	0	111.6	N238 L243 E244	N238-D240 PolarHBondContact O-N 3.16Å; N238-D240 PolarHBondContact OD1-N 2.87Å; N238-D240 VanDerWaalsContact OD1-N 3.08Å; D240-L243 PolarHBondContact O-N 3.16Å; D240-E244 WeakPolarHBondContact O-CB 3.38Å; D240-E244 PolarHBondContact O-N 3.36Å
241	V	84.5	Confident	83.6	Confident	56 Å²	56	79.8 Å²	79.8	34%	0.339	41%	0.412	S	S	.	.	H	α-helix	trans	-74.2	-32.1	177.9	-177.5	0	0	0	0	111.2	N238 H245	N238-V241 HydrophobicContact CB-CB 4.33Å; N238-V241 HydrophobicContact CB-CG2 4.01Å; N238-V241 PolarHBondContact O-N 2.99Å; N238-V241 VanDerWaalsContact O-N 3.12Å; V241-H245 WeakPolarHBondContact O-CB 3.44Å; V241-H245 PolarHBondContact O-N 3.16Å; V241-H245 VanDerWaalsContact O-N 3.07Å
242	E	88.1	Confident	85	Confident	63 Å²	63	78.5 Å²	78.5	29%	0.294	40%	0.402	S	S	.	.	H	α-helix	trans	-59.9	-51.6	167.9	-179.8	62.5	-112.2	0	0	110.4	R237 N238 P239 E244 H245 Q246	R237-E242 WeakPolarHBondContact CD-OE2 3.25Å; R237-E242 HydrophobicContact CG-CB 4.27Å; R237-E242 IonicContact CZ-OE1 2.62Å; R237-E242 IonicContact CZ-OE2 3.02Å; R237-E242 IonicContact NE-OE2 3.71Å; R237-E242 PolarHBondContact NE-OE2 3.44Å; R237-E242 IonicContact NH1-OE1 3.36Å; R237-E242 PolarHBondContact NH1-OE1 2.9Å; R237-E242 IonicContact NH1-OE2 3.72Å; R237-E242 PolarHBondContact NH1-OE2 2.92Å; N238-E242 PolarHBondContact O-N 3.31Å; P239-E242 WeakPolarHBondContact O-CB 3.44Å; P239-E242 PolarHBondContact O-N 3.39Å; E242-E244 PolarHBondContact O-N 3.39Å; E242-H245 WeakPolarHBondContact O-CB 3.32Å; E242-H245 PolarHBondContact O-N 3.44Å; E242-Q246 HydrophobicContact CG-CG 4.43Å; E242-Q246 WeakPolarHBondContact O-CG 3.38Å; E242-Q246 PolarHBondContact O-N 2.98Å; E242-Q246 VanDerWaalsContact OE1-CG 3.27Å; E242-Q246 WeakPolarHBondContact OE1-CG 3.41Å; E242-Q246 PolarHBondContact OE1-NE2 3.2Å
243	L	90.4	Very high	86.1	Confident	76 Å²	76	69.8 Å²	69.8	40%	0.398	37%	0.37	S	S	.	.	H	α-helix	trans	-60.9	-46.9	-177.6	-179.1	61.7	0	0	0	111.5	P239 D240 H245 Q246 Q247 Y299	P239-L243 WeakPolarHBondContact O-CB 3.27Å; P239-L243 PolarHBondContact O-N 3.5Å; D240-L243 PolarHBondContact O-N 3.16Å; L243-H245 VanDerWaalsContact C-N 3.3Å; L243-H245 PolarHBondContact O-N 3.28Å; L243-Q246 PolarHBondContact O-N 3.35Å; L243-Q247 HydrophobicContact CD1-CG 4.36Å; L243-Q247 WeakPolarHBondContact O-CB 3.36Å; L243-Q247 VanDerWaalsContact O-CG 3.28Å; L243-Q247 WeakPolarHBondContact O-CG 3.3Å; L243-Q247 PolarHBondContact O-N 3.42Å; L243-Y299 HydrophobicContact CD1-CD1 3.94Å; L243-Y299 HydrophobicContact CD1-CE1 3.86Å
244	E	89.8	Confident	87.8	Confident	99 Å²	99	59.8 Å²	59.8	46%	0.463	32%	0.323	S	S	.	.	H	α-helix	trans	-59.7	-41.6	176.6	-173.2	-176.5	-177.1	0	0	111.6	L120 D240 E242 Q247 C248	L120-E244 HydrophobicContact CD1-CG 4.29Å; D240-E244 WeakPolarHBondContact O-CB 3.38Å; D240-E244 PolarHBondContact O-N 3.36Å; E242-E244 PolarHBondContact O-N 3.39Å; E244-Q247 PolarHBondContact O-N 3Å; E244-C248 WeakPolarHBondContact O-CB 3.38Å; E244-C248 PolarHBondContact O-N 3.24Å; E244-C248 PolarHBondContact O-SG 3.26Å; E244-C248 VanDerWaalsContact O-SG 3.33Å
245	H	92.1	Very high	89.4	Confident	20 Å²	20	55.7 Å²	55.7	9%	0.093	28%	0.28	C	S	.	.	H	α-helix	trans	-63.4	-46	175.8	177.8	86.3	0	0	0	112.6	V226 T229 R237 V241 E242 L243 Q247 C248 L249	V226-H245 PolarHBondContact O-CE1 3.15Å; V226-H245 VanDerWaalsContact O-CE1 3.27Å; V226-H245 PolarHBondContact O-ND1 3.47Å; T229-H245 PolarHBondContact OG1-ND1 3.5Å; R237-H245 PolarHBondContact NH2-CD2 3Å; R237-H245 PolarHBondContact NH2-ND1 3.03Å; V241-H245 WeakPolarHBondContact O-CB 3.44Å; V241-H245 PolarHBondContact O-N 3.16Å; V241-H245 VanDerWaalsContact O-N 3.07Å; E242-H245 WeakPolarHBondContact O-CB 3.32Å; E242-H245 PolarHBondContact O-N 3.44Å; L243-H245 VanDerWaalsContact C-N 3.3Å; L243-H245 PolarHBondContact O-N 3.28Å; H245-Q247 VanDerWaalsContact C-N 3.31Å; H245-Q247 PolarHBondContact O-N 3.12Å; H245-C248 PolarHBondContact O-N 2.79Å; H245-L249 WeakPolarHBondContact O-CB 3.49Å; H245-L249 PolarHBondContact O-N 2.79Å
246	Q	94.2	Very high	90.5	Very high	55 Å²	55	52.7 Å²	52.7	26%	0.257	27%	0.266	S	S	.	.	H	α-helix	trans	-62.5	-41	178.5	-68	-61.6	-27.8	0	0	111.1	E242 L243 L249 A250 Y299	E242-Q246 HydrophobicContact CG-CG 4.43Å; E242-Q246 WeakPolarHBondContact O-CG 3.38Å; E242-Q246 PolarHBondContact O-N 2.98Å; E242-Q246 VanDerWaalsContact OE1-CG 3.27Å; E242-Q246 WeakPolarHBondContact OE1-CG 3.41Å; E242-Q246 PolarHBondContact OE1-NE2 3.2Å; L243-Q246 PolarHBondContact O-N 3.35Å; Q246-L249 PolarHBondContact O-N 3.08Å; Q246-A250 WeakPolarHBondContact O-CB 3.45Å; Q246-A250 PolarHBondContact O-N 3Å; Q246-Y299 HydrophobicContact CB-CD2 4.39Å; Q246-Y299 HydrophobicContact CB-CE1 4.26Å; Q246-Y299 HydrophobicContact CB-CE2 3.76Å
247	Q	95.3	Very high	92.2	Very high	31 Å²	31	43.3 Å²	43.3	15%	0.145	22%	0.222	C	C	.	.	H	α-helix	trans	-65.1	-43.6	174.7	-72.3	173.4	-1.3	0	0	112.2	L120 I124 L243 E244 H245 L249 A250 L251 Y299	L120-Q247 HydrophobicContact CB-CB 3.8Å; L120-Q247 HydrophobicContact CD1-CB 3.71Å; L120-Q247 HydrophobicContact CG-CB 4.4Å; I124-Q247 HydrophobicContact CD1-CB 4.36Å; L243-Q247 HydrophobicContact CD1-CG 4.36Å; L243-Q247 WeakPolarHBondContact O-CB 3.36Å; L243-Q247 VanDerWaalsContact O-CG 3.28Å; L243-Q247 WeakPolarHBondContact O-CG 3.3Å; L243-Q247 PolarHBondContact O-N 3.42Å; E244-Q247 PolarHBondContact O-N 3Å; H245-Q247 VanDerWaalsContact C-N 3.31Å; H245-Q247 PolarHBondContact O-N 3.12Å; Q247-L249 VanDerWaalsContact C-N 3.35Å; Q247-L249 PolarHBondContact O-N 3.48Å; Q247-A250 WeakPolarHBondContact O-CB 3.48Å; Q247-A250 PolarHBondContact O-N 3.37Å; Q247-L251 PolarHBondContact O-N 2.89Å; Q247-Y299 HydrophobicContact CG-CD1 4.42Å; Q247-Y299 HydrophobicContact CG-CG 4.36Å
248	C	95.3	Very high	93.4	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.02	21%	0.211	C	C	.	.	H	α-helix	trans	-60.7	-44.3	174.6	-77.9	0	0	0	0	111.7	L120 V226 E244 H245 L251 F252	L120-C248 VanDerWaalsContact CD1-SG 3.51Å; V226-C248 HydrophobicContact CG2-CB 3.94Å; E244-C248 WeakPolarHBondContact O-CB 3.38Å; E244-C248 PolarHBondContact O-N 3.24Å; E244-C248 PolarHBondContact O-SG 3.26Å; E244-C248 VanDerWaalsContact O-SG 3.33Å; H245-C248 PolarHBondContact O-N 2.79Å; C248-L251 PolarHBondContact O-N 3.38Å; C248-F252 WeakPolarHBondContact O-CB 3.28Å; C248-F252 PolarHBondContact O-N 2.7Å
249	L	96.3	Very high	94.2	Very high	51 Å²	51	38 Å²	38	27%	0.267	20%	0.195	S	C	.	.	H	α-helix	trans	-65.5	-39.8	177.9	-177	60.9	0	0	0	111.5	V226 H245 Q246 Q247 F252 N253	V226-L249 HydrophobicContact CG1-CD1 4.19Å; V226-L249 HydrophobicContact CG2-CB 4.33Å; H245-L249 WeakPolarHBondContact O-CB 3.49Å; H245-L249 PolarHBondContact O-N 2.79Å; Q246-L249 PolarHBondContact O-N 3.08Å; Q247-L249 VanDerWaalsContact C-N 3.35Å; Q247-L249 PolarHBondContact O-N 3.48Å; L249-F252 HydrophobicContact CD1-CD1 4.3Å; L249-F252 PolarHBondContact O-N 2.87Å; L249-N253 VanDerWaalsContact O-CG 3.29Å; L249-N253 PolarHBondContact O-N 3.02Å; L249-N253 PolarHBondContact O-ND2 2.82Å
250	A	97.4	Very high	94.9	Very high	2 Å²	2	33.3 Å²	33.3	2%	0.017	17%	0.165	C	C	.	.	H	α-helix	trans	-60.7	-45.9	175.5	0	0	0	0	0	112	I124 Q246 Q247 R254 Y299	I124-A250 HydrophobicContact CD1-CB 3.76Å; I124-A250 HydrophobicContact CG1-CB 4.42Å; Q246-A250 WeakPolarHBondContact O-CB 3.45Å; Q246-A250 PolarHBondContact O-N 3Å; Q247-A250 WeakPolarHBondContact O-CB 3.48Å; Q247-A250 PolarHBondContact O-N 3.37Å; A250-R254 WeakPolarHBondContact O-CD 3.49Å; A250-R254 WeakPolarHBondContact O-CG 3.44Å; A250-R254 PolarHBondContact O-N 3.31Å; A250-R254 PolarHBondContact O-NH1 3.43Å; A250-Y299 HydrophobicContact CB-CD2 4.35Å
251	L	97.9	Very high	95.5	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.016	14%	0.141	C	C	.	.	H	α-helix	trans	-66.6	-44	176.4	-178.3	59.7	0	0	0	111.5	L120 L123 I124 I127 L222 Q247 C248 N253 R254 I255	L120-L251 HydrophobicContact CD2-CD2 3.71Å; L123-L251 HydrophobicContact CB-CD1 3.95Å; L123-L251 HydrophobicContact CB-CD2 4.29Å; L123-L251 HydrophobicContact CD1-CD2 3.72Å; I124-L251 HydrophobicContact CG1-CB 4.19Å; I127-L251 HydrophobicContact CD1-CD1 3.53Å; L222-L251 HydrophobicContact CD1-CD2 4.17Å; L222-L251 HydrophobicContact CD1-CG 3.87Å; L222-L251 HydrophobicContact CD2-CD2 3.9Å; L222-L251 HydrophobicContact CD2-CG 4.35Å; Q247-L251 PolarHBondContact O-N 2.89Å; C248-L251 PolarHBondContact O-N 3.38Å; L251-N253 VanDerWaalsContact C-N 3.34Å; L251-N253 PolarHBondContact O-N 2.63Å; L251-R254 PolarHBondContact O-N 2.85Å; L251-I255 HydrophobicContact CD1-CG1 4.25Å; L251-I255 HydrophobicContact CG-CG1 4.48Å; L251-I255 WeakPolarHBondContact O-CG1 3.47Å; L251-I255 PolarHBondContact O-N 2.91Å
252	F	98.1	Very high	96.1	Very high	14 Å²	14	26.2 Å²	26.2	6%	0.061	13%	0.125	C	C	.	.	H	α-helix	trans	-53.5	-49.3	175.8	169.4	-95.5	0	0	0	112	E219 L222 Q223 V226 C248 L249 R254 I255 K256	E219-F252 HydrophobicContact CG-CD2 4.07Å; E219-F252 HydrophobicContact CG-CE2 3.4Å; E219-F252 VanDerWaalsContact CG-CE2 3.4Å; E219-F252 HydrophobicContact CG-CZ 4.13Å; L222-F252 HydrophobicContact CB-CB 4.08Å; L222-F252 HydrophobicContact CB-CD2 4.04Å; L222-F252 HydrophobicContact CD1-CB 4.49Å; Q223-F252 HydrophobicContact CB-CD2 4.32Å; Q223-F252 HydrophobicContact CB-CE2 3.88Å; Q223-F252 HydrophobicContact CG-CE2 4.44Å; V226-F252 HydrophobicContact CG2-CB 4.49Å; C248-F252 WeakPolarHBondContact O-CB 3.28Å; C248-F252 PolarHBondContact O-N 2.7Å; L249-F252 HydrophobicContact CD1-CD1 4.3Å; L249-F252 PolarHBondContact O-N 2.87Å; F252-R254 VanDerWaalsContact C-N 3.29Å; F252-R254 PolarHBondContact O-N 3.47Å; F252-I255 PolarHBondContact O-N 3.42Å; F252-K256 HydrophobicContact CE1-CD 3.91Å; F252-K256 HydrophobicContact CZ-CD 3.75Å; F252-K256 VanDerWaalsContact O-CB 3.3Å; F252-K256 WeakPolarHBondContact O-CB 3.5Å; F252-K256 PolarHBondContact O-N 3.25Å
253	N	98.3	Very high	96.6	Very high	12 Å²	12	24.6 Å²	24.6	6%	0.064	12%	0.12	C	C	.	.	H	α-helix	trans	-61.6	-37.8	-178.6	-71.1	-36.9	0	0	0	112.1	L249 L251 F257 I293	L249-N253 VanDerWaalsContact O-CG 3.29Å; L249-N253 PolarHBondContact O-N 3.02Å; L249-N253 PolarHBondContact O-ND2 2.82Å; L251-N253 VanDerWaalsContact C-N 3.34Å; L251-N253 PolarHBondContact O-N 2.63Å; N253-F257 WeakPolarHBondContact O-CB 3.42Å; N253-F257 PolarHBondContact O-N 2.91Å; N253-I293 HydrophobicContact CB-CG1 4Å
254	R	98.4	Very high	97	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-70	-43.5	178.3	-71.3	163.2	173.3	75.1	-1.8	113	I127 D128 A250 L251 F252 F257 T258 I293 S296	I127-R254 HydrophobicContact CG2-CB 3.9Å; I127-R254 HydrophobicContact CG2-CG 4.22Å; D128-R254 IonicContact OD1-CZ 3.83Å; D128-R254 IonicContact OD1-NE 3.33Å; D128-R254 PolarHBondContact OD1-NE 2.99Å; D128-R254 IonicContact OD1-NH2 3.98Å; D128-R254 PolarHBondContact OD1-NH2 2.95Å; D128-R254 IonicContact OD2-CZ 2.64Å; D128-R254 IonicContact OD2-NE 3.93Å; D128-R254 PolarHBondContact OD2-NE 3.24Å; D128-R254 IonicContact OD2-NH2 3.46Å; D128-R254 PolarHBondContact OD2-NH2 3.43Å; A250-R254 WeakPolarHBondContact O-CD 3.49Å; A250-R254 WeakPolarHBondContact O-CG 3.44Å; A250-R254 PolarHBondContact O-N 3.31Å; A250-R254 PolarHBondContact O-NH1 3.43Å; L251-R254 PolarHBondContact O-N 2.85Å; F252-R254 VanDerWaalsContact C-N 3.29Å; F252-R254 PolarHBondContact O-N 3.47Å; R254-F257 PolarHBondContact O-N 2.97Å; R254-T258 PolarHBondContact O-N 3.47Å; R254-T258 PolarHBondContact O-OG1 3.07Å; R254-I293 HydrophobicContact CG-CG1 4.28Å; R254-S296 PolarHBondContact NH1-OG 2.9Å; R254-S296 PolarHBondContact NH2-O 2.91Å
255	I	98.6	Very high	97.3	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-64	-46.9	175.7	-65.7	-61.8	0	0	0	110.3	I127 F167 L215 V218 E219 L222 L251 F252 F257 T258 R259	I127-I255 HydrophobicContact CD1-CD1 4.11Å; F167-I255 HydrophobicContact CB-CD1 3.98Å; L215-I255 HydrophobicContact CD2-CG2 4.15Å; V218-I255 HydrophobicContact CB-CG2 4.29Å; V218-I255 HydrophobicContact CG1-CD1 4.49Å; V218-I255 HydrophobicContact CG1-CG1 4.17Å; V218-I255 HydrophobicContact CG1-CG2 3.97Å; E219-I255 HydrophobicContact CB-CG2 4.42Å; L222-I255 HydrophobicContact CD1-CB 4.42Å; L222-I255 HydrophobicContact CD1-CG1 4.02Å; L251-I255 HydrophobicContact CD1-CG1 4.25Å; L251-I255 HydrophobicContact CG-CG1 4.48Å; L251-I255 WeakPolarHBondContact O-CG1 3.47Å; L251-I255 PolarHBondContact O-N 2.91Å; F252-I255 PolarHBondContact O-N 3.42Å; I255-F257 VanDerWaalsContact C-N 3.34Å; I255-F257 PolarHBondContact O-N 2.91Å; I255-T258 WeakPolarHBondContact O-CB 3.38Å; I255-T258 PolarHBondContact O-N 3.2Å; I255-R259 PolarHBondContact O-N 3.33Å
256	K	98.6	Very high	97.5	Very high	54 Å²	54	17.1 Å²	17.1	24%	0.235	8%	0.084	C	C	.	.	H	α-helix	trans	-61.5	-42.5	177.1	-173.1	177.7	176.2	-177.1	0	111.7	E219 F252 R259 L260 L289	E219-K256 HydrophobicContact CG-CB 4.35Å; F252-K256 HydrophobicContact CE1-CD 3.91Å; F252-K256 HydrophobicContact CZ-CD 3.75Å; F252-K256 VanDerWaalsContact O-CB 3.3Å; F252-K256 WeakPolarHBondContact O-CB 3.5Å; F252-K256 PolarHBondContact O-N 3.25Å; K256-R259 PolarHBondContact O-N 2.85Å; K256-L260 HydrophobicContact CG-CD1 4.19Å; K256-L260 HydrophobicContact CG-CG 4.49Å; K256-L260 WeakPolarHBondContact O-CG 3.49Å; K256-L260 PolarHBondContact O-N 2.95Å; K256-L289 HydrophobicContact CB-CD1 3.95Å; K256-L289 HydrophobicContact CD-CD1 3.94Å; K256-L289 HydrophobicContact CD-CD2 4.18Å; K256-L289 HydrophobicContact CG-CD1 3.72Å
257	F	98.7	Very high	97.6	Very high	2 Å²	2	14.6 Å²	14.6	1%	0.009	7%	0.073	C	C	.	.	H	α-helix	trans	-60	-47	175	178.4	-94.8	0	0	0	111.7	F131 N253 R254 I255 R259 L260 L261 A286 L289 L290 I293 F347 I351	F131-F257 HydrophobicContact CE1-CD1 4.29Å; F131-F257 HydrophobicContact CE1-CE1 4.38Å; F131-F257 HydrophobicContact CE2-CD1 4.29Å; F131-F257 AromaticContact CZ-CD1 3.76Å; F131-F257 HydrophobicContact CZ-CD1 3.76Å; F131-F257 HydrophobicContact CZ-CE1 4.23Å; N253-F257 WeakPolarHBondContact O-CB 3.42Å; N253-F257 PolarHBondContact O-N 2.91Å; R254-F257 PolarHBondContact O-N 2.97Å; I255-F257 VanDerWaalsContact C-N 3.34Å; I255-F257 PolarHBondContact O-N 2.91Å; F257-R259 VanDerWaalsContact C-N 3.32Å; F257-R259 PolarHBondContact O-N 3.4Å; F257-L260 PolarHBondContact O-N 3.15Å; F257-L261 HydrophobicContact CE1-CD2 4.17Å; F257-L261 WeakPolarHBondContact O-CB 3.47Å; F257-L261 PolarHBondContact O-N 3.49Å; F257-A286 HydrophobicContact CD2-CB 4.02Å; F257-A286 HydrophobicContact CE2-CB 4.02Å; F257-L289 HydrophobicContact CB-CB 4.49Å; F257-L289 HydrophobicContact CB-CD1 4.03Å; F257-L289 HydrophobicContact CD2-CB 4.43Å; F257-L290 HydrophobicContact CD2-CD2 4.19Å; F257-L290 HydrophobicContact CE2-CD2 3.56Å; F257-L290 HydrophobicContact CE2-CG 4.22Å; F257-L290 HydrophobicContact CZ-CD2 3.98Å; F257-I293 HydrophobicContact CB-CD1 3.81Å; F257-I293 HydrophobicContact CD2-CD1 4.25Å; F257-I293 HydrophobicContact CG-CD1 3.97Å; F257-F347 HydrophobicContact CE1-CD1 4.27Å; F257-F347 HydrophobicContact CE1-CD2 4.13Å; F257-F347 HydrophobicContact CE1-CE1 4.23Å; F257-F347 HydrophobicContact CE1-CE2 4.07Å; F257-F347 HydrophobicContact CE1-CG 4.24Å; F257-F347 HydrophobicContact CE1-CZ 4.14Å; F257-F347 HydrophobicContact CZ-CB 4.1Å; F257-F347 AromaticContact CZ-CD1 3.9Å; F257-F347 HydrophobicContact CZ-CD1 3.9Å; F257-F347 HydrophobicContact CZ-CD2 4.05Å; F257-F347 HydrophobicContact CZ-CE1 4.31Å; F257-F347 HydrophobicContact CZ-CE2 4.42Å; F257-F347 AromaticContact CZ-CG 3.78Å; F257-F347 HydrophobicContact CZ-CG 3.78Å; F257-I351 HydrophobicContact CE2-CD1 3.98Å
258	T	98.6	Very high	97.5	Very high	3 Å²	3	13.5 Å²	13.5	2%	0.018	7%	0.067	C	C	.	.	H	α-helix	trans	-57.5	-45.5	176.9	-52.9	0	0	0	0	111.3	F131 F167 L215 R254 I255 L262	F131-T258 WeakPolarHBondContact CZ-OG1 3.24Å; F167-T258 HydrophobicContact CD2-CG2 3.89Å; F167-T258 WeakPolarHBondContact CD2-OG1 3.4Å; F167-T258 HydrophobicContact CE2-CG2 4.09Å; F167-T258 WeakPolarHBondContact CE2-OG1 3.32Å; L215-T258 HydrophobicContact CD1-CG2 4.34Å; L215-T258 HydrophobicContact CD2-CG2 4.42Å; R254-T258 PolarHBondContact O-N 3.47Å; R254-T258 PolarHBondContact O-OG1 3.07Å; I255-T258 WeakPolarHBondContact O-CB 3.38Å; I255-T258 PolarHBondContact O-N 3.2Å; T258-L262 WeakPolarHBondContact O-CB 3.18Å; T258-L262 PolarHBondContact O-N 3.24Å
259	R	98.5	Very high	97.3	Very high	38 Å²	38	16 Å²	16	14%	0.143	8%	0.082	C	C	.	.	H	α-helix	trans	-61.2	-49.9	176.8	-169.9	-176.8	57.2	70.4	-0.6	111.5	L215 E219 I255 K256 F257 L261 L262 T263	L215-R259 HydrophobicContact CB-CB 3.95Å; L215-R259 HydrophobicContact CB-CG 4.01Å; L215-R259 HydrophobicContact CD1-CB 4.15Å; L215-R259 HydrophobicContact CD1-CG 4.46Å; E219-R259 IonicContact OE1-NH2 2.66Å; E219-R259 PolarHBondContact OE1-NH2 2.95Å; E219-R259 IonicContact OE2-CZ 3.17Å; E219-R259 IonicContact OE2-NE 2.72Å; E219-R259 PolarHBondContact OE2-NE 3.47Å; E219-R259 IonicContact OE2-NH2 2.78Å; E219-R259 PolarHBondContact OE2-NH2 3.45Å; I255-R259 PolarHBondContact O-N 3.33Å; K256-R259 PolarHBondContact O-N 2.85Å; F257-R259 VanDerWaalsContact C-N 3.32Å; F257-R259 PolarHBondContact O-N 3.4Å; R259-L261 PolarHBondContact O-N 3.17Å; R259-L262 PolarHBondContact O-N 3.48Å; R259-T263 WeakPolarHBondContact O-CB 3.45Å; R259-T263 PolarHBondContact O-N 2.99Å; R259-T263 PolarHBondContact O-OG1 2.93Å
260	L	98.5	Very high	96.9	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-62.5	-42.2	-179.1	-70.3	174.2	0	0	0	112	K256 F257 A264 L282 Q285 A286 L289	K256-L260 HydrophobicContact CG-CD1 4.19Å; K256-L260 HydrophobicContact CG-CG 4.49Å; K256-L260 WeakPolarHBondContact O-CG 3.49Å; K256-L260 PolarHBondContact O-N 2.95Å; F257-L260 PolarHBondContact O-N 3.15Å; L260-A264 VanDerWaalsContact O-CB 3.28Å; L260-A264 WeakPolarHBondContact O-CB 3.22Å; L260-A264 PolarHBondContact O-N 3.43Å; L260-L282 HydrophobicContact CD2-CD2 3.69Å; L260-Q285 HydrophobicContact CD1-CB 3.76Å; L260-Q285 HydrophobicContact CD2-CB 4.39Å; L260-A286 HydrophobicContact CB-CB 4.05Å; L260-A286 HydrophobicContact CD1-CB 4.37Å; L260-L289 HydrophobicContact CD1-CD1 3.76Å
261	L	98.1	Very high	96.2	Very high	23 Å²	23	23.5 Å²	23.5	12%	0.12	11%	0.112	C	C	.	.	H	α-helix	trans	-61.2	-49.2	175.5	179	62.4	0	0	0	111.2	V174 F257 R259 A264 L265 F347	V174-L261 HydrophobicContact CG1-CD2 4.42Å; F257-L261 HydrophobicContact CE1-CD2 4.17Å; F257-L261 WeakPolarHBondContact O-CB 3.47Å; F257-L261 PolarHBondContact O-N 3.49Å; R259-L261 PolarHBondContact O-N 3.17Å; L261-A264 PolarHBondContact O-N 2.9Å; L261-L265 HydrophobicContact CD1-CD1 4.39Å; L261-L265 HydrophobicContact CG-CD1 4.38Å; L261-L265 WeakPolarHBondContact O-CG 3.4Å; L261-L265 PolarHBondContact O-N 3.2Å; L261-F347 HydrophobicContact CD2-CE1 4.24Å
262	L	98.1	Very high	95.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.3	-48.7	178	175.2	58.1	0	0	0	111.5	K173 V174 I177 V211 T212 L215 T258 R259 A264 L265 I266	K173-L262 HydrophobicContact CB-CD1 3.66Å; K173-L262 HydrophobicContact CB-CD2 4.2Å; V174-L262 HydrophobicContact CG2-CB 3.99Å; V174-L262 HydrophobicContact CG2-CD1 4.11Å; I177-L262 HydrophobicContact CD1-CD1 3.84Å; V211-L262 HydrophobicContact CG1-CD2 3.89Å; T212-L262 HydrophobicContact CG2-CD2 3.9Å; T212-L262 HydrophobicContact CG2-CG 4.11Å; L215-L262 HydrophobicContact CD1-CD2 4.12Å; T258-L262 WeakPolarHBondContact O-CB 3.18Å; T258-L262 PolarHBondContact O-N 3.24Å; R259-L262 PolarHBondContact O-N 3.48Å; L262-A264 VanDerWaalsContact C-N 3.3Å; L262-A264 PolarHBondContact O-N 2.87Å; L262-L265 PolarHBondContact O-N 3.36Å; L262-I266 HydrophobicContact CD1-CD1 3.89Å; L262-I266 HydrophobicContact CD1-CG1 4.13Å; L262-I266 HydrophobicContact CG-CD1 3.78Å; L262-I266 HydrophobicContact CG-CG1 4.48Å; L262-I266 VanDerWaalsContact O-CG1 3.27Å; L262-I266 WeakPolarHBondContact O-CG1 3.33Å; L262-I266 PolarHBondContact O-N 3.38Å
263	T	97.9	Very high	94.8	Very high	30 Å²	30	31.8 Å²	31.8	18%	0.184	16%	0.156	C	C	.	.	H	α-helix	trans	-62.4	-37.6	179.2	-51.4	0	0	0	0	111.8	R259 I266 A267 L282	R259-T263 WeakPolarHBondContact O-CB 3.45Å; R259-T263 PolarHBondContact O-N 2.99Å; R259-T263 PolarHBondContact O-OG1 2.93Å; T263-I266 PolarHBondContact O-N 3.01Å; T263-A267 PolarHBondContact O-N 2.69Å; T263-L282 HydrophobicContact CG2-CD1 3.62Å; T263-L282 HydrophobicContact CG2-CD2 4.38Å
264	A	97.8	Very high	94.3	Very high	2 Å²	2	34.3 Å²	34.3	2%	0.017	18%	0.175	C	C	.	.	H	α-helix	trans	-63.6	-44.5	174.6	0	0	0	0	0	111.9	L260 L261 L262 I266 A267 F268 L282 V283	L260-A264 VanDerWaalsContact O-CB 3.28Å; L260-A264 WeakPolarHBondContact O-CB 3.22Å; L260-A264 PolarHBondContact O-N 3.43Å; L261-A264 PolarHBondContact O-N 2.9Å; L262-A264 VanDerWaalsContact C-N 3.3Å; L262-A264 PolarHBondContact O-N 2.87Å; A264-I266 PolarHBondContact O-N 3.4Å; A264-A267 WeakPolarHBondContact O-CB 3.43Å; A264-A267 PolarHBondContact O-N 3.03Å; A264-A267 VanDerWaalsContact O-N 3.16Å; A264-F268 VanDerWaalsContact O-CD2 3.26Å; A264-F268 WeakPolarHBondContact O-CD2 3.43Å; A264-F268 PolarHBondContact O-N 2.9Å; A264-L282 HydrophobicContact CB-CB 3.99Å; A264-L282 HydrophobicContact CB-CD1 4.45Å; A264-V283 HydrophobicContact CB-CG2 3.67Å
265	L	97.1	Very high	93.9	Very high	8 Å²	8	34.5 Å²	34.5	4%	0.042	18%	0.176	C	C	.	.	H	α-helix	trans	-64.8	-38.1	176.6	-69.4	175.2	0	0	0	112.3	V174 I177 L261 L262 A267 F268 T269 L388	V174-L265 HydrophobicContact CB-CD1 4.42Å; V174-L265 HydrophobicContact CG1-CD1 3.87Å; V174-L265 HydrophobicContact CG2-CD1 4.3Å; I177-L265 HydrophobicContact CD1-CB 4.39Å; I177-L265 HydrophobicContact CG2-CB 3.96Å; L261-L265 HydrophobicContact CD1-CD1 4.39Å; L261-L265 HydrophobicContact CG-CD1 4.38Å; L261-L265 WeakPolarHBondContact O-CG 3.4Å; L261-L265 PolarHBondContact O-N 3.2Å; L262-L265 PolarHBondContact O-N 3.36Å; L265-A267 VanDerWaalsContact C-N 3.3Å; L265-A267 PolarHBondContact O-N 3.19Å; L265-F268 WeakPolarHBondContact O-CB 3.32Å; L265-F268 PolarHBondContact O-N 3.39Å; L265-T269 PolarHBondContact O-N 3.34Å; L265-L388 HydrophobicContact CD2-CD1 4.12Å; L265-L388 HydrophobicContact CD2-CD2 4.35Å
266	I	96.3	Very high	93.5	Very high	28 Å²	28	35 Å²	35	14%	0.144	18%	0.179	C	C	.	.	H	α-helix	trans	-61.5	-39.6	172.1	-67.1	161	0	0	0	110.7	I177 D208 T212 L262 T263 A264 F268 T269	I177-I266 HydrophobicContact CD1-CG1 3.65Å; D208-I266 HydrophobicContact CB-CD1 3.74Å; D208-I266 HydrophobicContact CB-CG1 4.26Å; T212-I266 HydrophobicContact CG2-CD1 3.8Å; L262-I266 HydrophobicContact CD1-CD1 3.89Å; L262-I266 HydrophobicContact CD1-CG1 4.13Å; L262-I266 HydrophobicContact CG-CD1 3.78Å; L262-I266 HydrophobicContact CG-CG1 4.48Å; L262-I266 VanDerWaalsContact O-CG1 3.27Å; L262-I266 WeakPolarHBondContact O-CG1 3.33Å; L262-I266 PolarHBondContact O-N 3.38Å; T263-I266 PolarHBondContact O-N 3.01Å; A264-I266 PolarHBondContact O-N 3.4Å; I266-F268 PolarHBondContact O-N 3.42Å; I266-T269 PolarHBondContact O-N 3.05Å; I266-T269 PolarHBondContact O-OG1 3.31Å
267	A	95.6	Very high	93.3	Very high	2 Å²	2	34.9 Å²	34.9	2%	0.017	19%	0.185	C	C	.	.	H	α-helix	trans	-61.5	-31.8	177.9	0	0	0	0	0	112.2	T263 A264 L265 T269 K270 S275 A279	T263-A267 PolarHBondContact O-N 2.69Å; A264-A267 WeakPolarHBondContact O-CB 3.43Å; A264-A267 PolarHBondContact O-N 3.03Å; A264-A267 VanDerWaalsContact O-N 3.16Å; L265-A267 VanDerWaalsContact C-N 3.3Å; L265-A267 PolarHBondContact O-N 3.19Å; A267-T269 VanDerWaalsContact C-N 3.3Å; A267-T269 PolarHBondContact O-N 2.88Å; A267-K270 PolarHBondContact O-N 2.86Å; A267-S275 WeakPolarHBondContact CB-O 3.49Å; A267-S275 WeakPolarHBondContact O-CB 3.18Å; A267-A279 HydrophobicContact CB-CB 3.89Å
268	F	93.3	Very high	93.1	Very high	7 Å²	7	38.6 Å²	38.6	3%	0.031	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-14.7	172	-76.2	-73.3	0	0	0	114.4	K181 A264 L265 I266 K270 V276 A279 V354 V357 L388 T392	K181-F268 WeakPolarHBondContact CE-O 3.38Å; K181-F268 PolarHBondContact NZ-O 3.4Å; A264-F268 VanDerWaalsContact O-CD2 3.26Å; A264-F268 WeakPolarHBondContact O-CD2 3.43Å; A264-F268 PolarHBondContact O-N 2.9Å; L265-F268 WeakPolarHBondContact O-CB 3.32Å; L265-F268 PolarHBondContact O-N 3.39Å; I266-F268 PolarHBondContact O-N 3.42Å; F268-K270 VanDerWaalsContact C-N 3.35Å; F268-V276 HydrophobicContact CE1-CG1 4.25Å; F268-A279 HydrophobicContact CD2-CB 4.14Å; F268-A279 HydrophobicContact CE2-CB 3.73Å; F268-A279 HydrophobicContact CZ-CB 4.09Å; F268-V354 HydrophobicContact CE2-CG1 3.66Å; F268-V354 HydrophobicContact CZ-CG1 3.83Å; F268-V357 HydrophobicContact CE1-CG1 4.06Å; F268-V357 HydrophobicContact CZ-CG1 4.36Å; F268-L388 HydrophobicContact CB-CD2 3.89Å; F268-L388 HydrophobicContact CD1-CD2 4.36Å; F268-L388 HydrophobicContact CD2-CD1 4.41Å; F268-L388 HydrophobicContact CD2-CD2 4.08Å; F268-L388 HydrophobicContact CE2-CD1 4.39Å; F268-L388 HydrophobicContact CG-CD2 3.87Å; F268-T392 VanDerWaalsContact CD1-OG1 3.3Å; F268-T392 WeakPolarHBondContact CD1-OG1 3.34Å
269	T	90.7	Very high	92.9	Very high	55 Å²	55	38.5 Å²	38.5	34%	0.337	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-19.4	175	71.5	0	0	0	0	112.4	I177 L265 I266 A267	I177-T269 HydrophobicContact CG2-CG2 3.89Å; L265-T269 PolarHBondContact O-N 3.34Å; I266-T269 PolarHBondContact O-N 3.05Å; I266-T269 PolarHBondContact O-OG1 3.31Å; A267-T269 VanDerWaalsContact C-N 3.3Å; A267-T269 PolarHBondContact O-N 2.88Å
270	K	88.3	Confident	92.8	Very high	97 Å²	97	39.9 Å²	39.9	42%	0.422	21%	0.209	S	C	.	.	S	Bend	trans	-73.4	150	175.1	-59.5	175	-176.8	173.4	0	110.6	A267 F268 S275 E278	A267-K270 PolarHBondContact O-N 2.86Å; F268-K270 VanDerWaalsContact C-N 3.35Å; K270-S275 WeakPolarHBondContact CB-OG 3.34Å; K270-S275 WeakPolarHBondContact CD-OG 3.47Å; K270-E278 IonicContact NZ-OE2 3.72Å; K270-E278 PolarHBondContact NZ-OE2 3.48Å
271	K	82.3	Confident	92.7	Very high	114 Å²	114	46.7 Å²	46.7	50%	0.496	24%	0.239	S	C	.	.	S	Bend	trans	-83.5	-14.5	-178.1	-58.3	-163.6	178.7	-162.4	0	114.5	I395 D396	K271-I395 HydrophobicContact CB-CD1 3.99Å; K271-I395 HydrophobicContact CD-CG2 4.37Å; K271-I395 HydrophobicContact CG-CD1 4.27Å; K271-I395 HydrophobicContact CG-CG2 4.29Å; K271-D396 IonicContact NZ-OD1 2.93Å; K271-D396 IonicContact NZ-OD2 3.83Å; K271-D396 PolarHBondContact NZ-OD2 3.2Å
272	E	83.1	Confident	92.7	Very high	127 Å²	127	46.5 Å²	46.5	59%	0.593	24%	0.238	S	C	*	.			trans	-87.2	136.4	-171.7	-59.7	175	-176.1	0	0	111.9	S274 S275	E272-S274 VanDerWaalsContact CB-OG 3.31Å; E272-S274 WeakPolarHBondContact CB-OG 3.33Å; E272-S274 PolarHBondContact O-N 3.22Å; E272-S274 PolarHBondContact OE2-OG 3.01Å; E272-S274 VanDerWaalsContact OE2-OG 3.13Å; E272-S275 VanDerWaalsContact O-CB 3.29Å; E272-S275 WeakPolarHBondContact O-CB 3.45Å; E272-S275 PolarHBondContact O-N 2.71Å
273	T	84.1	Confident	92.6	Very high	64 Å²	64	47 Å²	47	39%	0.393	24%	0.241	S	C	.	.	H	α-helix	trans	-62.4	-27.9	175.7	53.1	0	0	0	0	113.1	S275 V276 S277 V361 F401	T273-S275 PolarHBondContact O-N 3.37Å; T273-V276 WeakPolarHBondContact O-CB 3.35Å; T273-V276 PolarHBondContact O-N 2.84Å; T273-S277 PolarHBondContact O-N 3.29Å; T273-V361 HydrophobicContact CG2-CG1 4.42Å; T273-F401 HydrophobicContact CG2-CB 3.69Å; T273-F401 HydrophobicContact CG2-CD1 4.25Å; T273-F401 HydrophobicContact CG2-CG 3.98Å
274	S	87.7	Confident	92.6	Very high	66 Å²	66	47.3 Å²	47.3	46%	0.462	25%	0.247	S	C	.	.	H	α-helix	trans	-54.7	-34.2	172.3	58.5	0	0	0	0	112.5	E272 S277 E278	E272-S274 VanDerWaalsContact CB-OG 3.31Å; E272-S274 WeakPolarHBondContact CB-OG 3.33Å; E272-S274 PolarHBondContact O-N 3.22Å; E272-S274 PolarHBondContact OE2-OG 3.01Å; E272-S274 VanDerWaalsContact OE2-OG 3.13Å; S274-S277 PolarHBondContact O-N 3.36Å; S274-E278 PolarHBondContact O-N 2.95Å
275	S	89.8	Confident	92.6	Very high	4 Å²	4	51.6 Å²	51.6	3%	0.028	27%	0.266	C	S	.	.	H	α-helix	trans	-73.5	-28.2	-180	-58.3	0	0	0	0	111.9	A267 K270 E272 T273 S277 E278 A279	A267-S275 WeakPolarHBondContact CB-O 3.49Å; A267-S275 WeakPolarHBondContact O-CB 3.18Å; K270-S275 WeakPolarHBondContact CB-OG 3.34Å; K270-S275 WeakPolarHBondContact CD-OG 3.47Å; E272-S275 VanDerWaalsContact O-CB 3.29Å; E272-S275 WeakPolarHBondContact O-CB 3.45Å; E272-S275 PolarHBondContact O-N 2.71Å; T273-S275 PolarHBondContact O-N 3.37Å; S275-S277 VanDerWaalsContact C-N 3.35Å; S275-E278 WeakPolarHBondContact O-CB 3.32Å; S275-E278 PolarHBondContact O-N 2.77Å; S275-A279 PolarHBondContact O-N 2.95Å
276	V	91.5	Very high	92.6	Very high	9 Å²	9	51.3 Å²	51.3	6%	0.055	27%	0.266	C	S	.	.	H	α-helix	trans	-67.5	-38.4	173.7	-177.4	0	0	0	0	110.8	F268 T273 E278 A279 Q280 C358 V361 T392	F268-V276 HydrophobicContact CE1-CG1 4.25Å; T273-V276 WeakPolarHBondContact O-CB 3.35Å; T273-V276 PolarHBondContact O-N 2.84Å; V276-E278 VanDerWaalsContact C-N 3.33Å; V276-E278 PolarHBondContact O-N 3.13Å; V276-A279 WeakPolarHBondContact O-CB 3.29Å; V276-A279 PolarHBondContact O-N 3.01Å; V276-Q280 PolarHBondContact O-N 3.39Å; V276-C358 HydrophobicContact CG1-CB 3.81Å; V276-V361 HydrophobicContact CB-CG1 3.96Å; V276-V361 HydrophobicContact CG1-CG1 3.81Å; V276-V361 HydrophobicContact CG2-CG1 4.11Å; V276-T392 HydrophobicContact CG2-CG2 3.76Å
277	S	92.6	Very high	92.6	Very high	52 Å²	52	51 Å²	51	36%	0.364	27%	0.267	S	S	.	.	H	α-helix	trans	-66.4	-34.3	173.2	-54.9	0	0	0	0	112.4	T273 S274 S275 K281	T273-S277 PolarHBondContact O-N 3.29Å; S274-S277 PolarHBondContact O-N 3.36Å; S275-S277 VanDerWaalsContact C-N 3.35Å; S277-K281 PolarHBondContact O-N 2.96Å
278	E	94.4	Very high	92.7	Very high	81 Å²	81	56.7 Å²	56.7	38%	0.379	30%	0.297	S	S	.	.	H	α-helix	trans	-63.1	-47.7	169.8	-174.3	-175.2	-171.1	0	0	110.7	K270 S274 S275 V276 Q280 K281 L282	K270-E278 IonicContact NZ-OE2 3.72Å; K270-E278 PolarHBondContact NZ-OE2 3.48Å; S274-E278 PolarHBondContact O-N 2.95Å; S275-E278 WeakPolarHBondContact O-CB 3.32Å; S275-E278 PolarHBondContact O-N 2.77Å; V276-E278 VanDerWaalsContact C-N 3.33Å; V276-E278 PolarHBondContact O-N 3.13Å; E278-Q280 VanDerWaalsContact C-N 3.29Å; E278-Q280 PolarHBondContact O-N 3.34Å; E278-K281 PolarHBondContact O-N 3.34Å; E278-K281 VanDerWaalsContact O-N 3.16Å; E278-L282 HydrophobicContact CG-CD1 4.08Å; E278-L282 WeakPolarHBondContact O-CG 3.43Å; E278-L282 PolarHBondContact O-N 2.86Å; E278-L282 VanDerWaalsContact O-N 3.07Å
279	A	95.6	Very high	92.9	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-56.6	-42.8	176.6	0	0	0	0	0	111.8	A267 F268 S275 V276 K281 L282 V283	A267-A279 HydrophobicContact CB-CB 3.89Å; F268-A279 HydrophobicContact CD2-CB 4.14Å; F268-A279 HydrophobicContact CE2-CB 3.73Å; F268-A279 HydrophobicContact CZ-CB 4.09Å; S275-A279 PolarHBondContact O-N 2.95Å; V276-A279 WeakPolarHBondContact O-CB 3.29Å; V276-A279 PolarHBondContact O-N 3.01Å; A279-K281 VanDerWaalsContact C-N 3.32Å; A279-K281 PolarHBondContact O-N 3.24Å; A279-L282 PolarHBondContact O-N 2.94Å; A279-V283 WeakPolarHBondContact O-CB 3.43Å; A279-V283 VanDerWaalsContact O-CG2 3.23Å; A279-V283 WeakPolarHBondContact O-CG2 3.39Å; A279-V283 PolarHBondContact O-N 2.91Å
280	Q	95.8	Very high	93.3	Very high	67 Å²	67	54.7 Å²	54.7	31%	0.313	28%	0.284	S	S	.	.	H	α-helix	trans	-59	-42.7	178.6	-164.8	176.7	30.4	0	0	112	V276 E278 A284 C358 D359	V276-Q280 PolarHBondContact O-N 3.39Å; E278-Q280 VanDerWaalsContact C-N 3.29Å; E278-Q280 PolarHBondContact O-N 3.34Å; Q280-A284 WeakPolarHBondContact O-CB 3.3Å; Q280-A284 PolarHBondContact O-N 2.84Å; Q280-C358 HydrophobicContact CB-CB 3.87Å; Q280-C358 HydrophobicContact CG-CB 3.96Å; Q280-D359 PolarHBondContact NE2-OD1 3.29Å
281	K	96.5	Very high	93.7	Very high	145 Å²	145	54.2 Å²	54.2	63%	0.63	29%	0.291	S	S	*	.	H	α-helix	trans	-65.7	-42.1	176.4	-67.6	174.8	-176	175.7	0	112	S277 E278 A279 A284 Q285	S277-K281 PolarHBondContact O-N 2.96Å; E278-K281 PolarHBondContact O-N 3.34Å; E278-K281 VanDerWaalsContact O-N 3.16Å; A279-K281 VanDerWaalsContact C-N 3.32Å; A279-K281 PolarHBondContact O-N 3.24Å; K281-A284 PolarHBondContact O-N 3.46Å; K281-Q285 WeakPolarHBondContact O-CG 3.33Å; K281-Q285 PolarHBondContact O-N 3.22Å; K281-Q285 VanDerWaalsContact O-N 3.08Å
282	L	97.6	Very high	94.4	Very high	19 Å²	19	50.8 Å²	50.8	10%	0.099	28%	0.281	C	S	.	.	H	α-helix	trans	-65.7	-42.9	179.3	-68.7	166.4	0	0	0	111.6	L260 T263 A264 E278 A279 A284 Q285 A286	L260-L282 HydrophobicContact CD2-CD2 3.69Å; T263-L282 HydrophobicContact CG2-CD1 3.62Å; T263-L282 HydrophobicContact CG2-CD2 4.38Å; A264-L282 HydrophobicContact CB-CB 3.99Å; A264-L282 HydrophobicContact CB-CD1 4.45Å; E278-L282 HydrophobicContact CG-CD1 4.08Å; E278-L282 WeakPolarHBondContact O-CG 3.43Å; E278-L282 PolarHBondContact O-N 2.86Å; E278-L282 VanDerWaalsContact O-N 3.07Å; A279-L282 PolarHBondContact O-N 2.94Å; L282-A284 VanDerWaalsContact C-N 3.35Å; L282-Q285 PolarHBondContact O-N 3.25Å; L282-A286 PolarHBondContact O-N 3.44Å
283	V	96.6	Very high	95.1	Very high	10 Å²	10	44.9 Å²	44.9	6%	0.061	25%	0.253	C	S	.	.	H	α-helix	trans	-67.6	-35.6	177.5	172.1	0	0	0	0	111.2	A264 A279 A286 A287 I351 V354 K355	A264-V283 HydrophobicContact CB-CG2 3.67Å; A279-V283 WeakPolarHBondContact O-CB 3.43Å; A279-V283 VanDerWaalsContact O-CG2 3.23Å; A279-V283 WeakPolarHBondContact O-CG2 3.39Å; A279-V283 PolarHBondContact O-N 2.91Å; V283-A286 PolarHBondContact O-N 3.05Å; V283-A287 PolarHBondContact O-N 3.34Å; V283-I351 HydrophobicContact CG1-CB 4Å; V283-I351 HydrophobicContact CG1-CG1 4.06Å; V283-I351 HydrophobicContact CG1-CG2 3.55Å; V283-V354 HydrophobicContact CG1-CB 4.41Å; V283-V354 HydrophobicContact CG1-CG1 4.32Å; V283-V354 HydrophobicContact CG2-CG1 3.85Å; V283-K355 HydrophobicContact CG1-CG 3.91Å
284	A	97	Very high	95.6	Very high	37 Å²	37	46.7 Å²	46.7	31%	0.306	26%	0.257	S	S	.	.	H	α-helix	trans	-62	-46.6	171.2	0	0	0	0	0	112	Q280 K281 L282 A286 A287 D288	Q280-A284 WeakPolarHBondContact O-CB 3.3Å; Q280-A284 PolarHBondContact O-N 2.84Å; K281-A284 PolarHBondContact O-N 3.46Å; L282-A284 VanDerWaalsContact C-N 3.35Å; A284-A286 VanDerWaalsContact C-N 3.31Å; A284-A286 PolarHBondContact O-N 2.83Å; A284-A287 VanDerWaalsContact O-CB 3.25Å; A284-A287 WeakPolarHBondContact O-CB 3.33Å; A284-A287 PolarHBondContact O-N 3.17Å; A284-A287 VanDerWaalsContact O-N 3.16Å; A284-D288 PolarHBondContact O-N 3.35Å
285	Q	97.8	Very high	96.1	Very high	91 Å²	91	47.4 Å²	47.4	43%	0.425	26%	0.262	S	S	.	.	H	α-helix	trans	-63.9	-35.2	175.4	-69.3	174.5	42.3	0	0	112.8	L260 K281 L282 A287 D288	L260-Q285 HydrophobicContact CD1-CB 3.76Å; L260-Q285 HydrophobicContact CD2-CB 4.39Å; K281-Q285 WeakPolarHBondContact O-CG 3.33Å; K281-Q285 PolarHBondContact O-N 3.22Å; K281-Q285 VanDerWaalsContact O-N 3.08Å; L282-Q285 PolarHBondContact O-N 3.25Å; Q285-A287 VanDerWaalsContact C-N 3.3Å; Q285-D288 PolarHBondContact O-N 2.92Å
286	A	97.8	Very high	96.4	Very high	3 Å²	3	47.5 Å²	47.5	3%	0.025	26%	0.263	C	S	.	.	H	α-helix	trans	-65.8	-35.2	175.6	0	0	0	0	0	111.5	F257 L260 L282 V283 A284 D288 L289 I351	F257-A286 HydrophobicContact CD2-CB 4.02Å; F257-A286 HydrophobicContact CE2-CB 4.02Å; L260-A286 HydrophobicContact CB-CB 4.05Å; L260-A286 HydrophobicContact CD1-CB 4.37Å; L282-A286 PolarHBondContact O-N 3.44Å; V283-A286 PolarHBondContact O-N 3.05Å; A284-A286 VanDerWaalsContact C-N 3.31Å; A284-A286 PolarHBondContact O-N 2.83Å; A286-D288 VanDerWaalsContact C-N 3.32Å; A286-D288 PolarHBondContact O-N 3.01Å; A286-L289 PolarHBondContact O-N 2.92Å; A286-I351 HydrophobicContact CB-CD1 3.91Å
287	A	97.5	Very high	96.5	Very high	20 Å²	20	47.7 Å²	47.7	17%	0.165	26%	0.263	C	S	.	.	H	α-helix	trans	-60.7	-41.3	176.3	0	0	0	0	0	111.9	V283 A284 Q285 L289 L290 P291 I351	V283-A287 PolarHBondContact O-N 3.34Å; A284-A287 VanDerWaalsContact O-CB 3.25Å; A284-A287 WeakPolarHBondContact O-CB 3.33Å; A284-A287 PolarHBondContact O-N 3.17Å; A284-A287 VanDerWaalsContact O-N 3.16Å; Q285-A287 VanDerWaalsContact C-N 3.3Å; A287-L289 PolarHBondContact O-N 3.37Å; A287-L289 VanDerWaalsContact O-N 3.15Å; A287-L290 WeakPolarHBondContact O-CB 3.36Å; A287-L290 PolarHBondContact O-N 2.83Å; A287-P291 WeakPolarHBondContact O-CD 3.34Å; A287-I351 HydrophobicContact CB-CD1 4.38Å; A287-I351 HydrophobicContact CB-CG2 3.71Å
288	D	97.6	Very high	96.6	Very high	122 Å²	122	51.9 Å²	51.9	65%	0.652	28%	0.277	S	S	*	.	H	α-helix	trans	-64.1	-19.8	179.9	-62.1	-26.2	0	0	0	112.9	A284 Q285 A286 P292	A284-D288 PolarHBondContact O-N 3.35Å; Q285-D288 PolarHBondContact O-N 2.92Å; A286-D288 VanDerWaalsContact C-N 3.32Å; A286-D288 PolarHBondContact O-N 3.01Å; D288-P292 WeakPolarHBondContact O-CD 3.32Å
289	L	97.7	Very high	96.5	Very high	13 Å²	13	50.5 Å²	50.5	7%	0.068	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-14	177.1	-59.6	175.1	0	0	0	113.3	K256 F257 L260 A286 A287 P292 I293	K256-L289 HydrophobicContact CB-CD1 3.95Å; K256-L289 HydrophobicContact CD-CD1 3.94Å; K256-L289 HydrophobicContact CD-CD2 4.18Å; K256-L289 HydrophobicContact CG-CD1 3.72Å; F257-L289 HydrophobicContact CB-CB 4.49Å; F257-L289 HydrophobicContact CB-CD1 4.03Å; F257-L289 HydrophobicContact CD2-CB 4.43Å; L260-L289 HydrophobicContact CD1-CD1 3.76Å; A286-L289 PolarHBondContact O-N 2.92Å; A287-L289 PolarHBondContact O-N 3.37Å; A287-L289 VanDerWaalsContact O-N 3.15Å; L289-P292 VanDerWaalsContact O-CD 3.26Å; L289-P292 WeakPolarHBondContact O-CD 3.3Å; L289-P292 VanDerWaalsContact O-CG 3.28Å; L289-P292 WeakPolarHBondContact O-CG 3.38Å; L289-I293 HydrophobicContact CB-CD1 4.29Å; L289-I293 WeakPolarHBondContact O-CB 3.4Å; L289-I293 WeakPolarHBondContact O-CD1 3.31Å; L289-I293 WeakPolarHBondContact O-CG1 3.31Å; L289-I293 PolarHBondContact O-N 3.41Å; L289-I293 VanDerWaalsContact O-N 3.08Å
290	L	97.1	Very high	96.4	Very high	7 Å²	7	50.8 Å²	50.8	4%	0.037	27%	0.272	C	S	.	.	H	α-helix	trans	-66.8	-46.7	-177.8	-70.4	-176.9	0	0	0	113.5	F257 A287 I293 H294 V344 F347 S348 I351	F257-L290 HydrophobicContact CD2-CD2 4.19Å; F257-L290 HydrophobicContact CE2-CD2 3.56Å; F257-L290 HydrophobicContact CE2-CG 4.22Å; F257-L290 HydrophobicContact CZ-CD2 3.98Å; A287-L290 WeakPolarHBondContact O-CB 3.36Å; A287-L290 PolarHBondContact O-N 2.83Å; L290-I293 PolarHBondContact O-N 3.33Å; L290-H294 PolarHBondContact O-N 2.69Å; L290-V344 HydrophobicContact CB-CG1 3.83Å; L290-V344 HydrophobicContact CD2-CG1 4.24Å; L290-V344 HydrophobicContact CG-CG1 4.45Å; L290-F347 HydrophobicContact CD1-CB 4.18Å; L290-F347 HydrophobicContact CD2-CB 3.8Å; L290-S348 VanDerWaalsContact CD1-CA 3.49Å; L290-I351 HydrophobicContact CD1-CD1 3.99Å; L290-I351 HydrophobicContact CG-CD1 4.45Å
291	P	97.3	Very high	96.1	Very high	88 Å²	88	51.3 Å²	51.3	57%	0.571	28%	0.276	S	S	*	.	H	α-helix	trans	-57.5	-47.2	175.9	-23.1	32.9	0	0	0	114.5	A287 I293 H294 S295	A287-P291 WeakPolarHBondContact O-CD 3.34Å; P291-I293 VanDerWaalsContact C-N 3.32Å; P291-I293 PolarHBondContact O-N 3.43Å; P291-H294 WeakPolarHBondContact O-CB 3.35Å; P291-H294 PolarHBondContact O-N 3.19Å; P291-S295 PolarHBondContact O-N 3.47Å; P291-S295 VanDerWaalsContact O-N 3.09Å; P291-S295 PolarHBondContact O-OG 3.41Å
292	P	96.8	Very high	95.4	Very high	41 Å²	41	48.5 Å²	48.5	27%	0.266	27%	0.265	S	S	.	.	H	α-helix	trans	-71.4	-23.7	176.8	27.9	-34.7	0	0	0	113.3	D288 L289 S295 S296	D288-P292 WeakPolarHBondContact O-CD 3.32Å; L289-P292 VanDerWaalsContact O-CD 3.26Å; L289-P292 WeakPolarHBondContact O-CD 3.3Å; L289-P292 VanDerWaalsContact O-CG 3.28Å; L289-P292 WeakPolarHBondContact O-CG 3.38Å; P292-S295 PolarHBondContact O-OG 2.91Å; P292-S296 VanDerWaalsContact O-CB 3.32Å; P292-S296 WeakPolarHBondContact O-CB 3.47Å; P292-S296 PolarHBondContact O-N 3.5Å; P292-S296 PolarHBondContact O-OG 2.86Å
293	I	97.4	Very high	94.2	Very high	3 Å²	3	49.5 Å²	49.5	2%	0.015	27%	0.273	C	S	.	.	H	α-helix	trans	-66.1	-46.5	168.7	-72.9	166.9	0	0	0	110	N253 R254 F257 L289 L290 P291 S295 S296 I297 M343 V344	N253-I293 HydrophobicContact CB-CG1 4Å; R254-I293 HydrophobicContact CG-CG1 4.28Å; F257-I293 HydrophobicContact CB-CD1 3.81Å; F257-I293 HydrophobicContact CD2-CD1 4.25Å; F257-I293 HydrophobicContact CG-CD1 3.97Å; L289-I293 HydrophobicContact CB-CD1 4.29Å; L289-I293 WeakPolarHBondContact O-CB 3.4Å; L289-I293 WeakPolarHBondContact O-CD1 3.31Å; L289-I293 WeakPolarHBondContact O-CG1 3.31Å; L289-I293 PolarHBondContact O-N 3.41Å; L289-I293 VanDerWaalsContact O-N 3.08Å; L290-I293 PolarHBondContact O-N 3.33Å; P291-I293 VanDerWaalsContact C-N 3.32Å; P291-I293 PolarHBondContact O-N 3.43Å; I293-S295 PolarHBondContact O-N 3.46Å; I293-S296 PolarHBondContact O-N 3.21Å; I293-S296 VanDerWaalsContact O-N 3.13Å; I293-S296 PolarHBondContact O-OG 2.69Å; I293-I297 PolarHBondContact O-N 2.81Å; I293-M343 HydrophobicContact CG2-CE 4Å; I293-V344 HydrophobicContact CG2-CG2 4.11Å
294	H	96.4	Very high	92.6	Very high	103 Å²	103	56.7 Å²	56.7	48%	0.477	31%	0.306	S	S	.	.	H	α-helix	trans	-58.2	-49.1	179.2	-174.6	-96.9	0	0	0	112.5	L290 P291 S296 I297 V344	L290-H294 PolarHBondContact O-N 2.69Å; P291-H294 WeakPolarHBondContact O-CB 3.35Å; P291-H294 PolarHBondContact O-N 3.19Å; H294-S296 PolarHBondContact O-N 3.38Å; H294-S296 VanDerWaalsContact O-N 3.15Å; H294-I297 WeakPolarHBondContact O-CG1 3.44Å; H294-I297 PolarHBondContact O-N 3Å; H294-V344 HydrophobicContact CB-CB 4.36Å; H294-V344 HydrophobicContact CB-CG1 4.13Å; H294-V344 HydrophobicContact CB-CG2 3.97Å
295	S	96.4	Very high	90.5	Very high	81 Å²	81	61.5 Å²	61.5	57%	0.566	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-11.4	-179.7	63.9	0	0	0	0	114	P291 P292 I293	P291-S295 PolarHBondContact O-N 3.47Å; P291-S295 VanDerWaalsContact O-N 3.09Å; P291-S295 PolarHBondContact O-OG 3.41Å; P292-S295 PolarHBondContact O-OG 2.91Å; I293-S295 PolarHBondContact O-N 3.46Å
296	S	96.5	Very high	87.9	Confident	6 Å²	6	64.5 Å²	64.5	4%	0.042	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	5.9	-177	61.3	0	0	0	0	114.6	R254 P292 I293 H294 Q298 Y299	R254-S296 PolarHBondContact NH1-OG 2.9Å; R254-S296 PolarHBondContact NH2-O 2.91Å; P292-S296 VanDerWaalsContact O-CB 3.32Å; P292-S296 WeakPolarHBondContact O-CB 3.47Å; P292-S296 PolarHBondContact O-N 3.5Å; P292-S296 PolarHBondContact O-OG 2.86Å; I293-S296 PolarHBondContact O-N 3.21Å; I293-S296 VanDerWaalsContact O-N 3.13Å; I293-S296 PolarHBondContact O-OG 2.69Å; H294-S296 PolarHBondContact O-N 3.38Å; H294-S296 VanDerWaalsContact O-N 3.15Å; S296-Q298 PolarHBondContact O-N 3.33Å; S296-Y299 PolarHBondContact O-N 2.97Å; S296-Y299 VanDerWaalsContact O-N 3.15Å
297	I	94.2	Very high	85.1	Confident	13 Å²	13	69 Å²	69	7%	0.067	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-55.5	-38.5	177.2	-68.3	170.6	0	0	0	111.6	I293 H294 Y299 G300 Q302 R340 V344	I293-I297 PolarHBondContact O-N 2.81Å; H294-I297 WeakPolarHBondContact O-CG1 3.44Å; H294-I297 PolarHBondContact O-N 3Å; I297-Y299 PolarHBondContact O-N 3.5Å; I297-Y299 VanDerWaalsContact O-N 3.16Å; I297-G300 PolarHBondContact O-N 2.65Å; I297-Q302 PolarHBondContact O-NE2 2.79Å; I297-R340 WeakPolarHBondContact CD1-O 3.36Å; I297-R340 HydrophobicContact CG2-CB 3.95Å; I297-V344 HydrophobicContact CD1-CG2 4.34Å
298	Q	93.6	Very high	82.3	Confident	139 Å²	139	74.1 Å²	74.1	65%	0.65	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-63.5	-19.1	-178.5	67.7	-172.9	13.9	0	0	114.3	S296 G300	S296-Q298 PolarHBondContact O-N 3.33Å; Q298-G300 VanDerWaalsContact C-N 3.31Å
299	Y	94.4	Very high	79.8	Confident	53 Å²	53	77.6 Å²	77.6	21%	0.208	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-81.2	-10.5	-179.5	-63.1	-53.3	0	0	0	113.6	P121 L243 Q246 Q247 A250 S296 I297	P121-Y299 WeakPolarHBondContact CA-O 3.3Å; P121-Y299 WeakPolarHBondContact CB-O 3.48Å; L243-Y299 HydrophobicContact CD1-CD1 3.94Å; L243-Y299 HydrophobicContact CD1-CE1 3.86Å; Q246-Y299 HydrophobicContact CB-CD2 4.39Å; Q246-Y299 HydrophobicContact CB-CE1 4.26Å; Q246-Y299 HydrophobicContact CB-CE2 3.76Å; Q247-Y299 HydrophobicContact CG-CD1 4.42Å; Q247-Y299 HydrophobicContact CG-CG 4.36Å; A250-Y299 HydrophobicContact CB-CD2 4.35Å; S296-Y299 PolarHBondContact O-N 2.97Å; S296-Y299 VanDerWaalsContact O-N 3.15Å; I297-Y299 PolarHBondContact O-N 3.5Å; I297-Y299 VanDerWaalsContact O-N 3.16Å
300	G	91.8	Very high	77.5	Confident	6 Å²	6	78.7 Å²	78.7	6%	0.062	43%	0.426	C	S	.	.	S	Bend	trans	-84	156.5	171.7	0	0	0	0	0	112.5	P121 I124 I297 Q298 Q302	P121-G300 WeakPolarHBondContact O-CA 3.13Å; I124-G300 VanDerWaalsContact CG2-CA 3.44Å; I297-G300 PolarHBondContact O-N 2.65Å; Q298-G300 VanDerWaalsContact C-N 3.31Å; G300-Q302 PolarHBondContact O-N 3.41Å; G300-Q302 PolarHBondContact O-NE2 2.94Å
301	I	89.2	Confident	75.5	Confident	78 Å²	78	83.2 Å²	83.2	40%	0.4	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-62	127.1	167.7	-67	-175	0	0	0	109	P121 E122 R340	P121-I301 HydrophobicContact CB-CG1 3.97Å; P121-I301 PolarHBondContact O-N 3.24Å; E122-I301 HydrophobicContact CB-CD1 4.26Å; E122-I301 HydrophobicContact CG-CD1 3.34Å; E122-I301 HydrophobicContact CG-CG1 4.4Å; I301-R340 PolarHBondContact O-NH1 3.16Å; I301-R340 PolarHBondContact O-NH2 2.89Å
302	Q	82.3	Confident	73.7	Confident	85 Å²	85	80.5 Å²	80.5	40%	0.397	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-86.2	151	177.2	-53.4	-54.6	-37.1	0	0	110.4	I297 G300	I297-Q302 PolarHBondContact O-NE2 2.79Å; G300-Q302 PolarHBondContact O-N 3.41Å; G300-Q302 PolarHBondContact O-NE2 2.94Å
303	S	71.9	Confident	71.9	Confident	40 Å²	40	79.6 Å²	79.6	28%	0.28	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-63.4	143.2	174.3	56.4	0	0	0	0	110.2	N305	S303-N305 PolarHBondContact O-N 3.43Å; S303-N305 VanDerWaalsContact O-N 3.11Å
304	Q	63.8	Low	70.5	Confident	162 Å²	162	82.4 Å²	82.4	76%	0.757	44%	0.439	S	S	*	.			trans	-68.2	112.2	170.9	-65.3	-174.2	2	0	0	108
305	N	52.7	Low	69.7	Low	137 Å²	137	78.6 Å²	78.6	73%	0.733	42%	0.421	S	S	*	.			trans	-68.2	145.5	167.3	-72.6	-23.2	0	0	0	108.2	S303	S303-N305 PolarHBondContact O-N 3.43Å; S303-N305 VanDerWaalsContact O-N 3.11Å
306	D	44.1	Very low	69.3	Low	155 Å²	155	77.1 Å²	77.1	83%	0.829	41%	0.406	S	S	*	.			trans	85.9	85.3	-178.1	-56.7	-30.8	0	0	0	116.4
307	T	37.9	Very low	68.9	Low	96 Å²	96	77 Å²	77	59%	0.589	41%	0.406	S	S	*	.			trans	-159.8	109.1	132.5	15.4	0	0	0	0	111.6
308	T	39.8	Very low	68.7	Low	129 Å²	129	77 Å²	77	79%	0.791	41%	0.405	S	S	*	.	S	Bend	trans	26.8	107.6	146.6	57.6	0	0	0	0	118.8
309	K	43.9	Very low	68.4	Low	195 Å²	195	71.2 Å²	71.2	85%	0.848	38%	0.379	S	S	*	.	S	Bend	trans	66.6	64.2	161	-58.2	-176.5	179.8	179	0	116
310	G	50.3	Low	67.9	Low	36 Å²	36	69.8 Å²	69.8	37%	0.371	38%	0.376	S	S	.	.			trans	160	116.9	162.6	0	0	0	0	0	111.3	H312	G310-H312 PolarHBondContact O-N 2.77Å
311	D	55.9	Low	67.5	Low	102 Å²	102	71 Å²	71	55%	0.545	38%	0.38	S	S	.	.			trans	-71.3	34.5	-178.6	-73.1	-10	0	0	0	113.1	K336	D311-K336 HydrophobicContact CB-CG 3.96Å; D311-K336 WeakPolarHBondContact OD2-CD 3.29Å; D311-K336 WeakPolarHBondContact OD2-CE 3.45Å; D311-K336 IonicContact OD2-NZ 2.76Å; D311-K336 PolarHBondContact OD2-NZ 3.44Å; D311-K336 VanDerWaalsContact OD2-NZ 3.09Å
312	H	58.9	Low	67.3	Low	30 Å²	30	68.7 Å²	68.7	14%	0.139	37%	0.37	C	S	.	.			trans	-97.1	136.8	178.5	-76.7	-78.5	0	0	0	111.4	Q145 G310 I314 P320 A335	Q145-H312 PolarHBondContact O-CE1 3.42Å; G310-H312 PolarHBondContact O-N 2.77Å; H312-I314 PolarHBondContact O-N 3.32Å; H312-I314 VanDerWaalsContact O-N 3.13Å; H312-P320 HydrophobicContact CB-CB 3.81Å; H312-P320 HydrophobicContact CB-CG 3.39Å; H312-A335 PolarHBondContact CE1-O 2.66Å; H312-A335 PolarHBondContact NE2-O 3.25Å
313	P	59.4	Low	67.5	Low	22 Å²	22	65 Å²	65	14%	0.143	35%	0.353	C	S	.	.			trans	-66.5	115.1	178.4	26	-31.1	0	0	0	110.1	T129 M315	T129-P313 HydrophobicContact CG2-CB 4.16Å; T129-P313 HydrophobicContact CG2-CG 3.6Å; P313-M315 PolarHBondContact O-N 2.95Å
314	I	67.9	Low	67.9	Low	62 Å²	62	64.9 Å²	64.9	32%	0.318	35%	0.348	S	S	.	.			trans	-84.1	102	167.8	-57.7	174	0	0	0	106.8	H312	H312-I314 PolarHBondContact O-N 3.32Å; H312-I314 VanDerWaalsContact O-N 3.13Å
315	M	79.8	Confident	68.6	Low	23 Å²	23	69 Å²	69	11%	0.113	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-147.1	159.9	178.5	64.9	174	-73.7	0	0	110.6	I126 T129 P313 G317 F318	I126-M315 HydrophobicContact CB-CE 4.37Å; I126-M315 HydrophobicContact CG1-CE 3.84Å; T129-M315 WeakPolarHBondContact CB-SD 3.5Å; T129-M315 HydrophobicContact CG2-SD 3.5Å; T129-M315 VanDerWaalsContact CG2-SD 3.5Å; T129-M315 PolarHBondContact OG1-SD 3.28Å; P313-M315 PolarHBondContact O-N 2.95Å; M315-G317 PolarHBondContact O-N 3.49Å; M315-F318 HydrophobicContact CE-CD2 3.92Å; M315-F318 HydrophobicContact CE-CE2 3.75Å; M315-F318 HydrophobicContact CG-CB 3.94Å; M315-F318 HydrophobicContact CG-CD2 3.43Å; M315-F318 VanDerWaalsContact CG-CD2 3.43Å; M315-F318 HydrophobicContact CG-CE2 4.15Å; M315-F318 HydrophobicContact CG-CG 3.9Å; M315-F318 PolarHBondContact O-N 3.47Å; M315-F318 HydrophobicContact SD-CD2 3.66Å; M315-F318 HydrophobicContact SD-CE2 3.76Å; M315-F318 HydrophobicContact SD-CG 4.34Å
316	M	86.2	Confident	69.8	Low	51 Å²	51	66.2 Å²	66.2	25%	0.251	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	127	178.9	-168.6	-121.4	-67.3	0	0	110.5	I113 K114 E122 Y152	I113-M316 HydrophobicContact CG2-CG 4.28Å; K114-M316 HydrophobicContact CB-CE 4.49Å; K114-M316 HydrophobicContact CB-SD 4.42Å; K114-M316 HydrophobicContact CD-CE 4.18Å; K114-M316 HydrophobicContact CG-CE 4.37Å; E122-M316 HydrophobicContact CB-CE 4.3Å; E122-M316 HydrophobicContact CG-CE 3.78Å; E122-M316 WeakPolarHBondContact OE1-CE 3.41Å; Y152-M316 PolarHBondContact OH-SD 3.38Å
317	G	88.1	Confident	71.3	Confident	4 Å²	4	60.7 Å²	60.7	4%	0.041	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.7	-4.8	-179	0	0	0	0	0	116.2	C150 L151 M315	C150-G317 CarbonylContact C-O 3.57Å; C150-G317 WeakPolarHBondContact CA-O 3.34Å; L151-G317 PolarHBondContact N-O 3.22Å; M315-G317 PolarHBondContact O-N 3.49Å
318	F	90.1	Very high	72.8	Confident	11 Å²	11	58.5 Å²	58.5	5%	0.048	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-118.7	121.6	179.7	-69.4	-104.9	0	0	0	111.5	I126 T129 T149 C150 M315	I126-F318 HydrophobicContact CG2-CE2 4.16Å; T129-F318 HydrophobicContact CG2-CD1 3.97Å; T129-F318 HydrophobicContact CG2-CD2 4.44Å; T129-F318 HydrophobicContact CG2-CE1 3.57Å; T129-F318 HydrophobicContact CG2-CE2 4.08Å; T129-F318 HydrophobicContact CG2-CG 4.38Å; T129-F318 HydrophobicContact CG2-CZ 3.62Å; T149-F318 CarbonylContact O-C 3.6Å; T149-F318 WeakPolarHBondContact O-CA 3.49Å; C150-F318 HydrophobicContact CB-CD1 3.96Å; C150-F318 HydrophobicContact CB-CE1 3.6Å; C150-F318 HydrophobicContact CB-CZ 3.93Å; M315-F318 HydrophobicContact CE-CD2 3.92Å; M315-F318 HydrophobicContact CE-CE2 3.75Å; M315-F318 HydrophobicContact CG-CB 3.94Å; M315-F318 HydrophobicContact CG-CD2 3.43Å; M315-F318 VanDerWaalsContact CG-CD2 3.43Å; M315-F318 HydrophobicContact CG-CE2 4.15Å; M315-F318 HydrophobicContact CG-CG 3.9Å; M315-F318 PolarHBondContact O-N 3.47Å; M315-F318 HydrophobicContact SD-CD2 3.66Å; M315-F318 HydrophobicContact SD-CE2 3.76Å; M315-F318 HydrophobicContact SD-CG 4.34Å
319	E	88.1	Confident	74	Confident	19 Å²	19	57 Å²	57	9%	0.089	29%	0.292	C	S	.	.			trans	-126.5	99.9	177.4	179.3	52.3	-96.8	0	0	109.9	R99 V101 T149 L151 L321 V322	R99-E319 IonicContact CZ-OE1 3.64Å; R99-E319 IonicContact CZ-OE2 3.68Å; R99-E319 IonicContact NE-OE2 3.97Å; R99-E319 IonicContact NH2-OE1 2.75Å; R99-E319 PolarHBondContact NH2-OE1 3.35Å; R99-E319 IonicContact NH2-OE2 2.66Å; R99-E319 PolarHBondContact NH2-OE2 2.97Å; V101-E319 HydrophobicContact CG1-CG 3.64Å; T149-E319 PolarHBondContact O-N 2.97Å; L151-E319 HydrophobicContact CD1-CB 4.38Å; L151-E319 HydrophobicContact CD2-CB 4.24Å; L151-E319 HydrophobicContact CG-CB 4.41Å; E319-L321 PolarHBondContact O-N 3.43Å; E319-L321 PolarHBondContact OE1-N 3.1Å; E319-V322 HydrophobicContact CB-CB 4.08Å; E319-V322 HydrophobicContact CG-CB 3.88Å; E319-V322 WeakPolarHBondContact O-CB 3.33Å; E319-V322 WeakPolarHBondContact O-CG1 3.11Å; E319-V322 PolarHBondContact O-N 3.36Å
320	P	84.1	Confident	75	Confident	22 Å²	22	51 Å²	51	14%	0.143	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-27.5	-175.8	-26.7	36.8	0	0	0	114.3	H312	H312-P320 HydrophobicContact CB-CB 3.81Å; H312-P320 HydrophobicContact CB-CG 3.39Å
321	L	83.4	Confident	75.8	Confident	31 Å²	31	55.2 Å²	55.2	16%	0.162	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-2.5	-175.8	-60.1	-179.4	0	0	0	113.7	V97 V101 E319 N323 Q324	V97-L321 HydrophobicContact CB-CD1 4.1Å; V97-L321 HydrophobicContact CG1-CD1 4.45Å; V97-L321 HydrophobicContact CG2-CD1 3.51Å; V101-L321 HydrophobicContact CG1-CB 4.26Å; V101-L321 HydrophobicContact CG2-CB 3.86Å; V101-L321 HydrophobicContact CG2-CD1 4.33Å; E319-L321 PolarHBondContact O-N 3.43Å; E319-L321 PolarHBondContact OE1-N 3.1Å; L321-N323 PolarHBondContact O-N 3.26Å; L321-N323 VanDerWaalsContact O-N 3.1Å; L321-Q324 WeakPolarHBondContact O-CB 3.5Å; L321-Q324 PolarHBondContact O-N 3.44Å; L321-Q324 VanDerWaalsContact O-N 3.13Å
322	V	85.8	Confident	76.2	Confident	31 Å²	31	52.1 Å²	52.1	19%	0.188	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-33.1	-174.6	69.6	0	0	0	0	112.6	V101 L151 E319	V101-V322 HydrophobicContact CG1-CB 4.43Å; L151-V322 HydrophobicContact CD2-CB 4.21Å; L151-V322 HydrophobicContact CD2-CG1 4.21Å; L151-V322 HydrophobicContact CD2-CG2 3.82Å; E319-V322 HydrophobicContact CB-CB 4.08Å; E319-V322 HydrophobicContact CG-CB 3.88Å; E319-V322 WeakPolarHBondContact O-CB 3.33Å; E319-V322 WeakPolarHBondContact O-CG1 3.11Å; E319-V322 PolarHBondContact O-N 3.36Å
323	N	86.1	Confident	76.6	Confident	8 Å²	8	59.1 Å²	59.1	4%	0.043	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	10.3	-175.6	-59.6	-36.1	0	0	0	113.9	A144 F148 F200 L321 R325 L326 L327	A144-N323 HydrophobicContact CB-CB 3.93Å; A144-N323 WeakPolarHBondContact O-CB 3.36Å; A144-N323 PolarHBondContact O-ND2 3.15Å; F148-N323 WeakPolarHBondContact CB-ND2 3.43Å; F148-N323 PolarHBondContact O-ND2 3.13Å; F200-N323 VanDerWaalsContact CZ-OD1 3.25Å; F200-N323 WeakPolarHBondContact CZ-OD1 3.45Å; L321-N323 PolarHBondContact O-N 3.26Å; L321-N323 VanDerWaalsContact O-N 3.1Å; N323-R325 PolarHBondContact O-N 3.47Å; N323-R325 VanDerWaalsContact O-N 3.09Å; N323-L326 HydrophobicContact CB-CB 4.49Å; N323-L326 HydrophobicContact CB-CD1 4.09Å; N323-L326 WeakPolarHBondContact O-CB 3.47Å; N323-L326 PolarHBondContact O-N 3.36Å; N323-L327 PolarHBondContact O-N 3.31Å
324	Q	79.1	Confident	77.1	Confident	36 Å²	36	64 Å²	64	17%	0.168	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-56.6	-33.5	-174.4	-172.7	172.1	32.6	0	0	112.9	A90 L321 L326	A90-Q324 HydrophobicContact CB-CG 4.43Å; A90-Q324 PolarHBondContact O-NE2 3.23Å; L321-Q324 WeakPolarHBondContact O-CB 3.5Å; L321-Q324 PolarHBondContact O-N 3.44Å; L321-Q324 VanDerWaalsContact O-N 3.13Å; Q324-L326 VanDerWaalsContact C-N 3.3Å; Q324-L326 PolarHBondContact O-N 3.09Å
325	R	78.4	Confident	77.5	Confident	249 Å²	249	61 Å²	61	94%	0.94	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-76.7	-12.5	177.6	-63.2	-179.3	178.8	175	-0.9	114.5	N323	N323-R325 PolarHBondContact O-N 3.47Å; N323-R325 VanDerWaalsContact O-N 3.09Å
326	L	78.5	Confident	77.8	Confident	78 Å²	78	66.1 Å²	66.1	41%	0.408	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-90.3	-19.6	176.8	-62.7	177	0	0	0	112.1	Y198 F200 N323 Q324	Y198-L326 HydrophobicContact CD1-CB 4.09Å; Y198-L326 VanDerWaalsContact CD1-O 3.24Å; Y198-L326 WeakPolarHBondContact CD1-O 3.32Å; Y198-L326 WeakPolarHBondContact CE1-O 3.38Å; F200-L326 HydrophobicContact CE2-CD1 3.56Å; F200-L326 HydrophobicContact CZ-CD1 3.87Å; N323-L326 HydrophobicContact CB-CB 4.49Å; N323-L326 HydrophobicContact CB-CD1 4.09Å; N323-L326 WeakPolarHBondContact O-CB 3.47Å; N323-L326 PolarHBondContact O-N 3.36Å; Q324-L326 VanDerWaalsContact C-N 3.3Å; Q324-L326 PolarHBondContact O-N 3.09Å
327	L	75.7	Confident	78	Confident	40 Å²	40	64.4 Å²	64.4	21%	0.209	31%	0.305	C	S	.	.	S	Bend	trans	-64.3	140.6	179.1	-59.7	177.6	0	0	0	109.4	A144 Q145 N323	A144-L327 HydrophobicContact CB-CD2 3.76Å; Q145-L327 HydrophobicContact CG-CD1 4Å; Q145-L327 HydrophobicContact CG-CD2 3.63Å; Q145-L327 HydrophobicContact CG-CG 4.45Å; N323-L327 PolarHBondContact O-N 3.31Å
328	P	69.1	Low	78.1	Confident	50 Å²	50	66.5 Å²	66.5	33%	0.325	32%	0.315	S	S	.	.			trans	-58.4	153.6	175	27.9	-34.4	0	0	0	108.9	T330	P328-T330 HydrophobicContact CB-CG2 4.08Å; P328-T330 HydrophobicContact CG-CG2 3.95Å; P328-T330 PolarHBondContact O-N 3.14Å; P328-T330 PolarHBondContact O-OG1 3.08Å
329	P	64.8	Low	78	Confident	97 Å²	97	72.6 Å²	72.6	63%	0.63	34%	0.341	S	S	*	.	S	Bend	trans	-66.7	87.1	173.7	36	-37.2	0	0	0	105.9	I81	I81-P329 HydrophobicContact CD1-CB 3.31Å; I81-P329 WeakPolarHBondContact CD1-O 3.03Å
330	T	65.5	Low	78.1	Confident	68 Å²	68	72.6 Å²	72.6	42%	0.417	34%	0.34	S	S	.	.	S	Bend	trans	-138.5	162.2	175.9	56.6	0	0	0	0	108.2	P328	P328-T330 HydrophobicContact CB-CG2 4.08Å; P328-T330 HydrophobicContact CG-CG2 3.95Å; P328-T330 PolarHBondContact O-N 3.14Å; P328-T330 PolarHBondContact O-OG1 3.08Å
331	F	66.7	Low	78.2	Confident	126 Å²	126	76.6 Å²	76.6	55%	0.553	36%	0.357	S	S	*	.			trans	-49.8	132.7	176	-57.5	-80.9	0	0	0	110.5	K87 M88 R333	K87-F331 WeakPolarHBondContact O-CD1 3.41Å; M88-F331 HydrophobicContact CG-CD1 3.89Å; M88-F331 HydrophobicContact CG-CE1 3.58Å; M88-F331 HydrophobicContact SD-CE1 3.9Å; F331-R333 PolarHBondContact O-N 3.14Å
332	P	63.6	Low	78.7	Confident	36 Å²	36	79.3 Å²	79.3	23%	0.234	37%	0.372	C	S	.	.			trans	-57.7	107.1	179.9	-24.9	36.3	0	0	0	111.2	K87 A90 I93	K87-P332 WeakPolarHBondContact O-CD 3.42Å; A90-P332 HydrophobicContact CB-CG 4.3Å; I93-P332 HydrophobicContact CD1-CB 3.48Å; I93-P332 VanDerWaalsContact CD1-CB 3.48Å; I93-P332 HydrophobicContact CD1-CG 3.64Å
333	R	67.6	Low	79.1	Confident	177 Å²	177	77.9 Å²	77.9	67%	0.668	36%	0.363	S	S	*	.			trans	-95.3	132.4	171.6	-63.5	-175.3	-173.1	-178.9	2.9	108.6	Q145 F331	Q145-R333 PolarHBondContact NE2-O 3.32Å; F331-R333 PolarHBondContact O-N 3.14Å
334	Y	69.5	Low	79.5	Confident	124 Å²	124	78.2 Å²	78.2	49%	0.486	37%	0.365	S	S	.	.			trans	-97.1	126.1	173.7	-61.2	-83.7	0	0	0	109.4	I93 K336	I93-Y334 WeakPolarHBondContact CD1-OH 3.32Å; Y334-K336 PolarHBondContact O-N 3.31Å
335	A	78.2	Confident	80.4	Confident	1 Å²	1	79 Å²	79	1%	0.008	38%	0.378	C	S	.	.			trans	-81.9	109.3	174	0	0	0	0	0	108.6	H141 Q145 T146 H312 I337	H141-A335 HydrophobicContact CB-CB 4.1Å; Q145-A335 HydrophobicContact CB-CB 3.95Å; T146-A335 HydrophobicContact CG2-CB 3.99Å; H312-A335 PolarHBondContact CE1-O 2.66Å; H312-A335 PolarHBondContact NE2-O 3.25Å; A335-I337 PolarHBondContact O-N 3.42Å; A335-I337 VanDerWaalsContact O-N 3.13Å
336	K	85.6	Confident	81.2	Confident	130 Å²	130	68.5 Å²	68.5	57%	0.565	34%	0.338	S	S	*	.			trans	-73.5	106	173.7	-177.8	170.4	-174.2	154.9	0	108.8	T136 D311 Y334 I338	T136-K336 WeakPolarHBondContact CG2-O 3.2Å; D311-K336 HydrophobicContact CB-CG 3.96Å; D311-K336 WeakPolarHBondContact OD2-CD 3.29Å; D311-K336 WeakPolarHBondContact OD2-CE 3.45Å; D311-K336 IonicContact OD2-NZ 2.76Å; D311-K336 PolarHBondContact OD2-NZ 3.44Å; D311-K336 VanDerWaalsContact OD2-NZ 3.09Å; Y334-K336 PolarHBondContact O-N 3.31Å; K336-I338 PolarHBondContact O-N 3Å
337	I	89.1	Confident	82.1	Confident	15 Å²	15	65 Å²	65	8%	0.077	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-67.7	132	177.9	-53.8	-56.3	0	0	0	108.6	C132 T136 T146 A335	C132-I337 HydrophobicContact CB-CG2 3.71Å; T136-I337 HydrophobicContact CG2-CD1 4.07Å; T146-I337 HydrophobicContact CG2-CD1 4.02Å; A335-I337 PolarHBondContact O-N 3.42Å; A335-I337 VanDerWaalsContact O-N 3.13Å
338	I	90.6	Very high	83.1	Confident	48 Å²	48	65.3 Å²	65.3	25%	0.246	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-61.5	156.3	177.8	64.5	149.3	0	0	0	111.5	C132 I135 T136 K336 M343	C132-I338 HydrophobicContact CB-CG1 3.86Å; I135-I338 HydrophobicContact CB-CD1 3.7Å; I135-I338 HydrophobicContact CB-CG1 4.28Å; I135-I338 HydrophobicContact CD1-CD1 3.67Å; I135-I338 HydrophobicContact CG1-CD1 4.3Å; I135-I338 HydrophobicContact CG2-CD1 3.52Å; I135-I338 HydrophobicContact CG2-CG1 4.23Å; T136-I338 PolarHBondContact OG1-N 3.39Å; K336-I338 PolarHBondContact O-N 3Å; I338-M343 HydrophobicContact CD1-CB 4.37Å
339	K	89.6	Confident	84.4	Confident	138 Å²	138	68.6 Å²	68.6	60%	0.6	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-77.6	155.3	178	-56.8	-176.9	177.3	-179.2	0	111.3	E341 D342 M343	K339-E341 VanDerWaalsContact C-N 3.26Å; K339-E341 VanDerWaalsContact CB-OE2 3.3Å; K339-E341 WeakPolarHBondContact CB-OE2 3.38Å; K339-E341 PolarHBondContact O-N 3.36Å; K339-D342 PolarHBondContact O-N 3.47Å; K339-D342 VanDerWaalsContact O-N 3.16Å; K339-M343 PolarHBondContact O-N 3.24Å
340	R	88.4	Confident	86	Confident	20 Å²	20	64.3 Å²	64.3	8%	0.075	31%	0.306	C	S	.	.	H	α-helix	trans	-65.6	-30.4	-179.3	-67.6	-177.6	-179.1	175.8	0.9	112.4	G125 D128 T129 I297 I301 D342 M343	G125-R340 PolarHBondContact O-NH2 2.82Å; G125-R340 VanDerWaalsContact O-NH2 3.12Å; D128-R340 HydrophobicContact CB-CG 4.37Å; T129-R340 PolarHBondContact OG1-NH2 3.05Å; I297-R340 WeakPolarHBondContact CD1-O 3.36Å; I297-R340 HydrophobicContact CG2-CB 3.95Å; I301-R340 PolarHBondContact O-NH1 3.16Å; I301-R340 PolarHBondContact O-NH2 2.89Å; R340-D342 VanDerWaalsContact C-N 3.3Å; R340-D342 PolarHBondContact O-N 3.35Å; R340-M343 VanDerWaalsContact O-CB 3.28Å; R340-M343 WeakPolarHBondContact O-CB 3.36Å; R340-M343 PolarHBondContact O-N 2.84Å
341	E	87.7	Confident	87.5	Confident	105 Å²	105	61.4 Å²	61.4	49%	0.491	29%	0.288	S	S	.	.	H	α-helix	trans	-65.8	-36.5	176.2	-58.6	76.2	-165	0	0	111.2	K339	K339-E341 VanDerWaalsContact C-N 3.26Å; K339-E341 VanDerWaalsContact CB-OE2 3.3Å; K339-E341 WeakPolarHBondContact CB-OE2 3.38Å; K339-E341 PolarHBondContact O-N 3.36Å
342	D	92.5	Very high	88.9	Confident	89 Å²	89	60.7 Å²	60.7	48%	0.476	29%	0.286	S	S	.	.	H	α-helix	trans	-78.5	-21.8	-179.5	-60.9	-41	0	0	0	112.6	K339 R340 V344 A345 Y346	K339-D342 PolarHBondContact O-N 3.47Å; K339-D342 VanDerWaalsContact O-N 3.16Å; R340-D342 VanDerWaalsContact C-N 3.3Å; R340-D342 PolarHBondContact O-N 3.35Å; D342-V344 PolarHBondContact O-N 3.23Å; D342-A345 PolarHBondContact O-N 3.25Å; D342-Y346 PolarHBondContact O-N 3.46Å
343	M	94.6	Very high	90.4	Very high	1 Å²	1	61.2 Å²	61.2	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-53.7	-48	180	175.1	-167.6	61	0	0	112.3	F131 I135 I293 I338 K339 R340 Y346 F347	F131-M343 HydrophobicContact CB-CG 4.05Å; F131-M343 HydrophobicContact CB-SD 3.4Å; F131-M343 WeakPolarHBondContact CB-SD 3.35Å; F131-M343 HydrophobicContact CD2-SD 3.77Å; F131-M343 HydrophobicContact CG-SD 4.04Å; I135-M343 HydrophobicContact CD1-CB 4.21Å; I135-M343 HydrophobicContact CD1-CG 3.79Å; I293-M343 HydrophobicContact CG2-CE 4Å; I338-M343 HydrophobicContact CD1-CB 4.37Å; K339-M343 PolarHBondContact O-N 3.24Å; R340-M343 VanDerWaalsContact O-CB 3.28Å; R340-M343 WeakPolarHBondContact O-CB 3.36Å; R340-M343 PolarHBondContact O-N 2.84Å; M343-Y346 PolarHBondContact O-N 2.9Å; M343-F347 HydrophobicContact CG-CD2 3.84Å; M343-F347 HydrophobicContact CG-CE2 3.73Å; M343-F347 WeakPolarHBondContact O-CD2 3.36Å; M343-F347 PolarHBondContact O-N 3.45Å; M343-F347 HydrophobicContact SD-CE2 4.38Å
344	V	95.7	Very high	91.8	Very high	14 Å²	14	53.4 Å²	53.4	9%	0.085	26%	0.255	C	S	.	.	H	α-helix	trans	-68.6	-40.7	-176.8	-179	0	0	0	0	110.8	L290 I293 H294 I297 D342 Y346 F347 S348	L290-V344 HydrophobicContact CB-CG1 3.83Å; L290-V344 HydrophobicContact CD2-CG1 4.24Å; L290-V344 HydrophobicContact CG-CG1 4.45Å; I293-V344 HydrophobicContact CG2-CG2 4.11Å; H294-V344 HydrophobicContact CB-CB 4.36Å; H294-V344 HydrophobicContact CB-CG1 4.13Å; H294-V344 HydrophobicContact CB-CG2 3.97Å; I297-V344 HydrophobicContact CD1-CG2 4.34Å; D342-V344 PolarHBondContact O-N 3.23Å; V344-Y346 VanDerWaalsContact C-N 3.3Å; V344-Y346 PolarHBondContact O-N 3.32Å; V344-F347 PolarHBondContact O-N 2.87Å; V344-S348 WeakPolarHBondContact O-CB 3.16Å; V344-S348 PolarHBondContact O-N 3.47Å
345	A	96.1	Very high	93.1	Very high	52 Å²	52	50.7 Å²	50.7	43%	0.43	25%	0.246	S	C	.	.	H	α-helix	trans	-61.9	-40.1	176.7	0	0	0	0	0	111.4	D342 K349	D342-A345 PolarHBondContact O-N 3.25Å; A345-K349 WeakPolarHBondContact O-CG 3.36Å; A345-K349 PolarHBondContact O-N 3.44Å
346	Y	96.6	Very high	93.9	Very high	30 Å²	30	52.7 Å²	52.7	12%	0.118	26%	0.258	C	S	.	.	H	α-helix	trans	-63.1	-51.6	174.5	-176.8	-87.7	0	0	0	111.9	I135 E139 D342 M343 V344 S348 K349 L350	I135-Y346 HydrophobicContact CB-CD1 4.1Å; I135-Y346 HydrophobicContact CB-CE1 4.22Å; I135-Y346 HydrophobicContact CB-CG 4.45Å; I135-Y346 HydrophobicContact CD1-CD1 3.65Å; I135-Y346 HydrophobicContact CD1-CE1 4.47Å; I135-Y346 HydrophobicContact CD1-CG 4.06Å; I135-Y346 HydrophobicContact CG1-CD1 3.47Å; I135-Y346 VanDerWaalsContact CG1-CD1 3.47Å; I135-Y346 HydrophobicContact CG1-CE1 3.8Å; I135-Y346 HydrophobicContact CG1-CG 4.16Å; I135-Y346 HydrophobicContact CG2-CD1 3.53Å; I135-Y346 HydrophobicContact CG2-CD2 3.64Å; I135-Y346 HydrophobicContact CG2-CE1 3.71Å; I135-Y346 HydrophobicContact CG2-CE2 3.83Å; I135-Y346 HydrophobicContact CG2-CG 3.48Å; I135-Y346 VanDerWaalsContact CG2-CG 3.48Å; E139-Y346 HydrophobicContact CG-CE2 4.14Å; E139-Y346 VanDerWaalsContact OE1-CE2 3.24Å; E139-Y346 WeakPolarHBondContact OE1-CE2 3.46Å; E139-Y346 PolarHBondContact OE1-OH 3.14Å; D342-Y346 PolarHBondContact O-N 3.46Å; M343-Y346 PolarHBondContact O-N 2.9Å; V344-Y346 VanDerWaalsContact C-N 3.3Å; V344-Y346 PolarHBondContact O-N 3.32Å; Y346-S348 VanDerWaalsContact C-N 3.28Å; Y346-S348 PolarHBondContact O-N 3.32Å; Y346-K349 PolarHBondContact O-N 3.38Å; Y346-L350 HydrophobicContact CE1-CB 4.37Å; Y346-L350 HydrophobicContact CE1-CD2 4.26Å; Y346-L350 PolarHBondContact O-N 3.21Å
347	F	97.5	Very high	94.5	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.018	23%	0.231	C	C	.	.	H	α-helix	trans	-62.1	-35.5	179.2	-79.3	-54.6	0	0	0	112.5	F131 L134 I135 F257 L261 L290 M343 V344 L350 I351	F131-F347 HydrophobicContact CB-CE2 3.88Å; F131-F347 HydrophobicContact CB-CZ 4.21Å; F131-F347 HydrophobicContact CD1-CE2 4.06Å; F131-F347 AromaticContact CD1-CZ 3.86Å; F131-F347 HydrophobicContact CD1-CZ 3.86Å; F131-F347 HydrophobicContact CD2-CE2 4.39Å; F131-F347 HydrophobicContact CE1-CZ 4.5Å; F131-F347 AromaticContact CG-CE2 3.88Å; F131-F347 HydrophobicContact CG-CE2 3.88Å; F131-F347 HydrophobicContact CG-CZ 4.14Å; L134-F347 HydrophobicContact CD2-CZ 4.38Å; I135-F347 HydrophobicContact CD1-CD2 4.01Å; I135-F347 HydrophobicContact CD1-CE1 4.39Å; I135-F347 HydrophobicContact CD1-CE2 3.71Å; I135-F347 HydrophobicContact CD1-CG 4.48Å; I135-F347 HydrophobicContact CD1-CZ 3.9Å; I135-F347 HydrophobicContact CG1-CE1 4.32Å; I135-F347 HydrophobicContact CG1-CE2 4.36Å; I135-F347 HydrophobicContact CG1-CZ 4.04Å; F257-F347 HydrophobicContact CE1-CD1 4.27Å; F257-F347 HydrophobicContact CE1-CD2 4.13Å; F257-F347 HydrophobicContact CE1-CE1 4.23Å; F257-F347 HydrophobicContact CE1-CE2 4.07Å; F257-F347 HydrophobicContact CE1-CG 4.24Å; F257-F347 HydrophobicContact CE1-CZ 4.14Å; F257-F347 HydrophobicContact CZ-CB 4.1Å; F257-F347 AromaticContact CZ-CD1 3.9Å; F257-F347 HydrophobicContact CZ-CD1 3.9Å; F257-F347 HydrophobicContact CZ-CD2 4.05Å; F257-F347 HydrophobicContact CZ-CE1 4.31Å; F257-F347 HydrophobicContact CZ-CE2 4.42Å; F257-F347 AromaticContact CZ-CG 3.78Å; F257-F347 HydrophobicContact CZ-CG 3.78Å; L261-F347 HydrophobicContact CD2-CE1 4.24Å; L290-F347 HydrophobicContact CD1-CB 4.18Å; L290-F347 HydrophobicContact CD2-CB 3.8Å; M343-F347 HydrophobicContact CG-CD2 3.84Å; M343-F347 HydrophobicContact CG-CE2 3.73Å; M343-F347 WeakPolarHBondContact O-CD2 3.36Å; M343-F347 PolarHBondContact O-N 3.45Å; M343-F347 HydrophobicContact SD-CE2 4.38Å; V344-F347 PolarHBondContact O-N 2.87Å; F347-L350 HydrophobicContact CD1-CD2 4.2Å; F347-L350 PolarHBondContact O-N 3.17Å; F347-I351 VanDerWaalsContact O-CB 3.29Å; F347-I351 WeakPolarHBondContact O-CB 3.44Å; F347-I351 VanDerWaalsContact O-CG1 3.27Å; F347-I351 WeakPolarHBondContact O-CG1 3.44Å; F347-I351 PolarHBondContact O-N 3.31Å
348	S	96.8	Very high	94.8	Very high	46 Å²	46	45.8 Å²	45.8	32%	0.322	23%	0.228	S	C	.	.	H	α-helix	trans	-59.1	-50	174.5	-164.4	0	0	0	0	111	L290 V344 Y346 L350 I351 E352	L290-S348 VanDerWaalsContact CD1-CA 3.49Å; V344-S348 WeakPolarHBondContact O-CB 3.16Å; V344-S348 PolarHBondContact O-N 3.47Å; Y346-S348 VanDerWaalsContact C-N 3.28Å; Y346-S348 PolarHBondContact O-N 3.32Å; S348-L350 PolarHBondContact O-N 2.92Å; S348-I351 PolarHBondContact O-N 3.34Å; S348-E352 WeakPolarHBondContact O-CG 3.39Å; S348-E352 PolarHBondContact O-N 2.89Å
349	K	96.6	Very high	95	Very high	120 Å²	120	46.6 Å²	46.6	52%	0.522	23%	0.233	S	C	.	.	H	α-helix	trans	-63.1	-40.6	176.5	-69.9	177.7	-178.3	177.5	0	112.3	A345 Y346 E352 R353	A345-K349 WeakPolarHBondContact O-CG 3.36Å; A345-K349 PolarHBondContact O-N 3.44Å; Y346-K349 PolarHBondContact O-N 3.38Å; K349-E352 PolarHBondContact O-N 3.34Å; K349-R353 WeakPolarHBondContact O-CB 3.48Å; K349-R353 WeakPolarHBondContact O-CD 3.48Å; K349-R353 WeakPolarHBondContact O-CG 3.45Å; K349-R353 PolarHBondContact O-N 3.01Å
350	L	96.6	Very high	95.2	Very high	6 Å²	6	40 Å²	40	3%	0.031	20%	0.204	C	C	.	.	H	α-helix	trans	-61.5	-47.2	176.2	176	62	0	0	0	111.1	Y346 F347 S348 R353 V354 C382 L384	Y346-L350 HydrophobicContact CE1-CB 4.37Å; Y346-L350 HydrophobicContact CE1-CD2 4.26Å; Y346-L350 PolarHBondContact O-N 3.21Å; F347-L350 HydrophobicContact CD1-CD2 4.2Å; F347-L350 PolarHBondContact O-N 3.17Å; S348-L350 PolarHBondContact O-N 2.92Å; L350-R353 PolarHBondContact O-N 3.25Å; L350-V354 HydrophobicContact CD1-CG2 4.09Å; L350-V354 HydrophobicContact CG-CG2 4.42Å; L350-V354 VanDerWaalsContact O-CG2 3.27Å; L350-V354 WeakPolarHBondContact O-CG2 3.43Å; L350-V354 PolarHBondContact O-N 3.21Å; L350-C382 VanDerWaalsContact CD1-SG 3.57Å; L350-L384 HydrophobicContact CD1-CD2 4.45Å; L350-L384 HydrophobicContact CD2-CD2 4.43Å
351	I	97	Very high	95.3	Very high	8 Å²	8	40.4 Å²	40.4	4%	0.041	21%	0.209	C	C	.	.	H	α-helix	trans	-61.1	-44.4	178.3	-78.3	-176.8	0	0	0	111.1	F257 V283 A286 A287 L290 F347 S348 V354 K355	F257-I351 HydrophobicContact CE2-CD1 3.98Å; V283-I351 HydrophobicContact CG1-CB 4Å; V283-I351 HydrophobicContact CG1-CG1 4.06Å; V283-I351 HydrophobicContact CG1-CG2 3.55Å; A286-I351 HydrophobicContact CB-CD1 3.91Å; A287-I351 HydrophobicContact CB-CD1 4.38Å; A287-I351 HydrophobicContact CB-CG2 3.71Å; L290-I351 HydrophobicContact CD1-CD1 3.99Å; L290-I351 HydrophobicContact CG-CD1 4.45Å; F347-I351 VanDerWaalsContact O-CB 3.29Å; F347-I351 WeakPolarHBondContact O-CB 3.44Å; F347-I351 VanDerWaalsContact O-CG1 3.27Å; F347-I351 WeakPolarHBondContact O-CG1 3.44Å; F347-I351 PolarHBondContact O-N 3.31Å; S348-I351 PolarHBondContact O-N 3.34Å; I351-V354 PolarHBondContact O-N 3.46Å; I351-K355 HydrophobicContact CG2-CD 4.43Å; I351-K355 WeakPolarHBondContact O-CG 3.16Å; I351-K355 PolarHBondContact O-N 3.47Å
352	E	96.4	Very high	95.5	Very high	110 Å²	110	41.1 Å²	41.1	51%	0.514	22%	0.216	S	C	.	.	H	α-helix	trans	-59.4	-47.9	174.8	-75.2	170	-170	0	0	111.5	S348 K349 V354 K355 T356	S348-E352 WeakPolarHBondContact O-CG 3.39Å; S348-E352 PolarHBondContact O-N 2.89Å; K349-E352 PolarHBondContact O-N 3.34Å; E352-V354 VanDerWaalsContact C-N 3.34Å; E352-V354 PolarHBondContact O-N 2.77Å; E352-K355 WeakPolarHBondContact O-CB 3.41Å; E352-K355 PolarHBondContact O-N 3.46Å; E352-T356 PolarHBondContact O-N 3.08Å; E352-T356 PolarHBondContact O-OG1 2.73Å
353	R	96.6	Very high	95.5	Very high	48 Å²	48	38.2 Å²	38.2	18%	0.181	20%	0.201	C	C	.	.	H	α-helix	trans	-59.7	-43.9	176.1	-69.3	162.1	-179.4	171.5	-5.9	111.6	K349 L350 K355 T356 V357 F376 S380	K349-R353 WeakPolarHBondContact O-CB 3.48Å; K349-R353 WeakPolarHBondContact O-CD 3.48Å; K349-R353 WeakPolarHBondContact O-CG 3.45Å; K349-R353 PolarHBondContact O-N 3.01Å; L350-R353 PolarHBondContact O-N 3.25Å; R353-K355 VanDerWaalsContact C-N 3.34Å; R353-T356 WeakPolarHBondContact O-CB 3.27Å; R353-T356 PolarHBondContact O-N 2.75Å; R353-V357 WeakPolarHBondContact O-CG2 2.88Å; R353-V357 PolarHBondContact O-N 2.64Å; R353-F376 HydrophobicContact CB-CE2 4.27Å; R353-F376 HydrophobicContact CB-CZ 4.34Å; R353-S380 PolarHBondContact NH2-O 2.89Å
354	V	96.9	Very high	95.1	Very high	12 Å²	12	43.7 Å²	43.7	7%	0.073	24%	0.235	C	C	.	.	H	α-helix	trans	-66.2	-36.1	178.2	174.3	0	0	0	0	111.4	F268 V283 L350 I351 E352 T356 V357 C358 L388	F268-V354 HydrophobicContact CE2-CG1 3.66Å; F268-V354 HydrophobicContact CZ-CG1 3.83Å; V283-V354 HydrophobicContact CG1-CB 4.41Å; V283-V354 HydrophobicContact CG1-CG1 4.32Å; V283-V354 HydrophobicContact CG2-CG1 3.85Å; L350-V354 HydrophobicContact CD1-CG2 4.09Å; L350-V354 HydrophobicContact CG-CG2 4.42Å; L350-V354 VanDerWaalsContact O-CG2 3.27Å; L350-V354 WeakPolarHBondContact O-CG2 3.43Å; L350-V354 PolarHBondContact O-N 3.21Å; I351-V354 PolarHBondContact O-N 3.46Å; E352-V354 VanDerWaalsContact C-N 3.34Å; E352-V354 PolarHBondContact O-N 2.77Å; V354-T356 VanDerWaalsContact C-N 3.35Å; V354-V357 WeakPolarHBondContact O-CB 3.04Å; V354-V357 PolarHBondContact O-N 2.76Å; V354-C358 PolarHBondContact O-N 3.33Å; V354-C358 PolarHBondContact O-SG 3.13Å; V354-C358 VanDerWaalsContact O-SG 3.35Å; V354-L388 HydrophobicContact CG2-CD1 3.92Å
355	K	95.9	Very high	94.8	Very high	68 Å²	68	46.6 Å²	46.6	30%	0.296	25%	0.25	S	C	.	.	H	α-helix	trans	-60.4	-45.4	171.5	-74.4	172.9	179.9	178.1	0	111	V283 I351 E352 R353 V357 C358 D359	V283-K355 HydrophobicContact CG1-CG 3.91Å; I351-K355 HydrophobicContact CG2-CD 4.43Å; I351-K355 WeakPolarHBondContact O-CG 3.16Å; I351-K355 PolarHBondContact O-N 3.47Å; E352-K355 WeakPolarHBondContact O-CB 3.41Å; E352-K355 PolarHBondContact O-N 3.46Å; R353-K355 VanDerWaalsContact C-N 3.34Å; K355-V357 VanDerWaalsContact C-N 3.33Å; K355-V357 PolarHBondContact O-N 3.21Å; K355-C358 WeakPolarHBondContact O-CB 3.27Å; K355-C358 PolarHBondContact O-N 3.16Å; K355-C358 VanDerWaalsContact O-N 3.12Å; K355-D359 PolarHBondContact O-N 3.1Å
356	T	96	Very high	94.7	Very high	42 Å²	42	44.1 Å²	44.1	26%	0.258	23%	0.23	S	C	.	.	H	α-helix	trans	-58.8	-45.9	173.3	-53.8	0	0	0	0	110.7	E352 R353 V354 C358 D359 F372 F376	E352-T356 PolarHBondContact O-N 3.08Å; E352-T356 PolarHBondContact O-OG1 2.73Å; R353-T356 WeakPolarHBondContact O-CB 3.27Å; R353-T356 PolarHBondContact O-N 2.75Å; V354-T356 VanDerWaalsContact C-N 3.35Å; T356-C358 PolarHBondContact O-N 2.91Å; T356-D359 WeakPolarHBondContact O-CB 3.41Å; T356-D359 PolarHBondContact O-N 3.22Å; T356-F372 HydrophobicContact CG2-CE2 4.44Å; T356-F372 HydrophobicContact CG2-CZ 4Å; T356-F372 VanDerWaalsContact O-CZ 3.28Å; T356-F372 WeakPolarHBondContact O-CZ 3.47Å; T356-F376 HydrophobicContact CG2-CD2 3.88Å; T356-F376 HydrophobicContact CG2-CE2 4.28Å
357	V	96.5	Very high	94.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-53.6	-40.5	175.2	171.8	0	0	0	0	111.9	F268 R353 V354 K355 D359 V360 F376 L388 L389	F268-V357 HydrophobicContact CE1-CG1 4.06Å; F268-V357 HydrophobicContact CZ-CG1 4.36Å; R353-V357 WeakPolarHBondContact O-CG2 2.88Å; R353-V357 PolarHBondContact O-N 2.64Å; V354-V357 WeakPolarHBondContact O-CB 3.04Å; V354-V357 PolarHBondContact O-N 2.76Å; K355-V357 VanDerWaalsContact C-N 3.33Å; K355-V357 PolarHBondContact O-N 3.21Å; V357-D359 PolarHBondContact O-N 2.99Å; V357-V360 WeakPolarHBondContact O-CB 3.39Å; V357-V360 WeakPolarHBondContact O-CG1 3.44Å; V357-V360 PolarHBondContact O-N 3.06Å; V357-F376 HydrophobicContact CG2-CE1 4.25Å; V357-F376 HydrophobicContact CG2-CE2 3.92Å; V357-F376 HydrophobicContact CG2-CZ 3.6Å; V357-L388 HydrophobicContact CG1-CB 4.27Å; V357-L389 HydrophobicContact CG1-CB 4.21Å; V357-L389 HydrophobicContact CG1-CD1 4.34Å; V357-L389 HydrophobicContact CG2-CB 3.95Å
358	C	95.4	Very high	94.4	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.007	24%	0.238	C	C	.	.	H	α-helix	trans	-61.8	-29.6	177.1	-65.3	0	0	0	0	113.1	V276 Q280 V354 K355 T356 V360 V361	V276-C358 HydrophobicContact CG1-CB 3.81Å; Q280-C358 HydrophobicContact CB-CB 3.87Å; Q280-C358 HydrophobicContact CG-CB 3.96Å; V354-C358 PolarHBondContact O-N 3.33Å; V354-C358 PolarHBondContact O-SG 3.13Å; V354-C358 VanDerWaalsContact O-SG 3.35Å; K355-C358 WeakPolarHBondContact O-CB 3.27Å; K355-C358 PolarHBondContact O-N 3.16Å; K355-C358 VanDerWaalsContact O-N 3.12Å; T356-C358 PolarHBondContact O-N 2.91Å; C358-V360 PolarHBondContact O-N 3.47Å; C358-V361 VanDerWaalsContact O-CG2 3.29Å; C358-V361 WeakPolarHBondContact O-CG2 3.49Å
359	D	94.9	Very high	94.3	Very high	64 Å²	64	42.4 Å²	42.4	34%	0.342	22%	0.223	S	C	.	.	H	α-helix	trans	-72.1	-14.3	-177.3	-61.8	-35	0	0	0	113.1	Q280 K355 T356 V357 V361 N362 F372	Q280-D359 PolarHBondContact NE2-OD1 3.29Å; K355-D359 PolarHBondContact O-N 3.1Å; T356-D359 WeakPolarHBondContact O-CB 3.41Å; T356-D359 PolarHBondContact O-N 3.22Å; V357-D359 PolarHBondContact O-N 2.99Å; D359-V361 PolarHBondContact O-N 3.07Å; D359-V361 VanDerWaalsContact O-N 3.16Å; D359-N362 WeakPolarHBondContact O-CB 3.42Å; D359-N362 PolarHBondContact O-N 2.89Å; D359-N362 PolarHBondContact O-ND2 3.36Å; D359-F372 HydrophobicContact CB-CE2 4.49Å
360	V	93.6	Very high	94.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-58.1	-30.5	178	77.2	0	0	0	0	112.2	V357 C358 N362 T363 I369 F372 F373 L389 T392 F401	V357-V360 WeakPolarHBondContact O-CB 3.39Å; V357-V360 WeakPolarHBondContact O-CG1 3.44Å; V357-V360 PolarHBondContact O-N 3.06Å; C358-V360 PolarHBondContact O-N 3.47Å; V360-N362 PolarHBondContact O-N 3.2Å; V360-N362 VanDerWaalsContact O-N 3.17Å; V360-T363 WeakPolarHBondContact O-CB 3.27Å; V360-T363 PolarHBondContact O-N 3.42Å; V360-I369 HydrophobicContact CG2-CD1 3.63Å; V360-F372 HydrophobicContact CB-CD1 4.29Å; V360-F372 HydrophobicContact CB-CE1 3.85Å; V360-F372 HydrophobicContact CB-CE2 4.39Å; V360-F372 HydrophobicContact CB-CZ 3.9Å; V360-F372 HydrophobicContact CG2-CD1 3.89Å; V360-F372 HydrophobicContact CG2-CE1 3.94Å; V360-F372 HydrophobicContact CG2-CG 4.35Å; V360-F372 HydrophobicContact CG2-CZ 4.39Å; V360-F373 HydrophobicContact CG2-CE2 4.46Å; V360-L389 HydrophobicContact CB-CD1 3.89Å; V360-L389 HydrophobicContact CG1-CD1 4.07Å; V360-L389 HydrophobicContact CG2-CD1 3.84Å; V360-T392 HydrophobicContact CG1-CG2 4.32Å; V360-F401 HydrophobicContact CG1-CE1 4Å; V360-F401 HydrophobicContact CG1-CZ 4.42Å; V360-F401 HydrophobicContact CG2-CZ 4.48Å
361	V	91.8	Very high	94.1	Very high	29 Å²	29	39.3 Å²	39.3	18%	0.176	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-65.8	-18.7	179.9	-53.7	0	0	0	0	112.8	T273 V276 C358 D359 T363 F401	T273-V361 HydrophobicContact CG2-CG1 4.42Å; V276-V361 HydrophobicContact CB-CG1 3.96Å; V276-V361 HydrophobicContact CG1-CG1 3.81Å; V276-V361 HydrophobicContact CG2-CG1 4.11Å; C358-V361 VanDerWaalsContact O-CG2 3.29Å; C358-V361 WeakPolarHBondContact O-CG2 3.49Å; D359-V361 PolarHBondContact O-N 3.07Å; D359-V361 VanDerWaalsContact O-N 3.16Å; V361-T363 VanDerWaalsContact C-N 3.27Å; V361-F401 HydrophobicContact CG1-CE1 4.18Å
362	N	92.3	Very high	94.1	Very high	119 Å²	119	40.3 Å²	40.3	64%	0.636	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-82.2	-8.9	175.9	-57.7	-47	0	0	0	112.2	D359 V360	D359-N362 WeakPolarHBondContact O-CB 3.42Å; D359-N362 PolarHBondContact O-N 2.89Å; D359-N362 PolarHBondContact O-ND2 3.36Å; V360-N362 PolarHBondContact O-N 3.2Å; V360-N362 VanDerWaalsContact O-N 3.17Å
363	T	90.9	Very high	94	Very high	29 Å²	29	35.1 Å²	35.1	18%	0.178	19%	0.192	C	C	.	.			trans	-101	111.6	-178.1	-54.9	0	0	0	0	109.9	V360 V361 G368 I369	V360-T363 WeakPolarHBondContact O-CB 3.27Å; V360-T363 PolarHBondContact O-N 3.42Å; V361-T363 VanDerWaalsContact C-N 3.27Å; T363-G368 VanDerWaalsContact CG2-C 3.44Å; T363-I369 HydrophobicContact CG2-CD1 3.77Å; T363-I369 HydrophobicContact CG2-CG1 3.93Å; T363-I369 WeakPolarHBondContact O-CD1 3.36Å
364	T	86.3	Confident	93.9	Very high	116 Å²	116	33.6 Å²	33.6	71%	0.712	19%	0.188	S	C	*	.			trans	-105.2	-12.7	-170.9	55.7	0	0	0	0	114.6
365	N	90.3	Very high	93.7	Very high	74 Å²	74	38.3 Å²	38.3	40%	0.396	21%	0.209	S	C	.	.	S	Bend	trans	-106.7	147.6	-176.6	73.6	88.8	0	0	0	111.6	H367 G368 I369	N365-H367 PolarHBondContact O-N 3.17Å; N365-G368 PolarHBondContact O-N 2.86Å; N365-G368 WeakPolarHBondContact OD1-CA 3.29Å; N365-G368 PolarHBondContact OD1-N 3.28Å; N365-I369 PolarHBondContact O-N 2.85Å
366	L	93.9	Very high	93.7	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-61.6	-45.7	-172.3	-178	59.1	0	0	0	113.2	G368 I369 L370 M406 M409 I410 A413 F450 I454 W509	L366-G368 VanDerWaalsContact C-N 3.34Å; L366-G368 PolarHBondContact O-N 2.93Å; L366-I369 PolarHBondContact O-N 3.06Å; L366-L370 HydrophobicContact CG-CD1 4.28Å; L366-L370 WeakPolarHBondContact O-CG 3.28Å; L366-L370 PolarHBondContact O-N 3.27Å; L366-M406 HydrophobicContact CD1-SD 4.4Å; L366-M409 HydrophobicContact CB-CE 4.32Å; L366-M409 HydrophobicContact CB-CG 4.15Å; L366-M409 HydrophobicContact CB-SD 4.36Å; L366-M409 HydrophobicContact CD1-SD 4.15Å; L366-I410 HydrophobicContact CD2-CG1 3.98Å; L366-A413 HydrophobicContact CB-CB 3.8Å; L366-A413 HydrophobicContact CD2-CB 4.06Å; L366-F450 HydrophobicContact CD2-CD1 3.92Å; L366-F450 HydrophobicContact CD2-CE1 4.11Å; L366-F450 HydrophobicContact CD2-CG 4.41Å; L366-I454 HydrophobicContact CD1-CD1 4.06Å; L366-W509 HydrophobicContact CD2-CH2 4.3Å; L366-W509 HydrophobicContact CD2-CZ2 3.97Å
367	H	93.8	Very high	93.6	Very high	25 Å²	25	33.5 Å²	33.5	12%	0.116	19%	0.185	C	C	.	.	H	α-helix	trans	-62.8	-42.4	179.8	-64.6	128.6	0	0	0	111.5	N365 I369 L370 D371 F417 W509 Y512 H513	N365-H367 PolarHBondContact O-N 3.17Å; H367-I369 VanDerWaalsContact C-N 3.33Å; H367-I369 PolarHBondContact O-N 3.18Å; H367-L370 PolarHBondContact O-N 3.37Å; H367-D371 VanDerWaalsContact O-CG 3.25Å; H367-D371 PolarHBondContact O-N 3.35Å; H367-F417 AromaticContact CE1-CD2 3.4Å; H367-F417 WeakPolarHBondContact CE1-CD2 3.27Å; H367-F417 AromaticContact CE1-CG 3.76Å; H367-W509 AromaticContact CE1-NE1 3.58Å; H367-W509 AromaticContact NE2-NE1 3.59Å; H367-Y512 AromaticContact CD2-CE1 3.81Å; H367-Y512 AromaticContact NE2-CE1 3.56Å; H367-H513 AromaticContact CD2-CE1 3.55Å; H367-H513 AromaticContact NE2-CE1 3.38Å; H367-H513 PolarHBondContact NE2-CE1 3.48Å; H367-H513 AromaticContact NE2-NE2 3.51Å
368	G	93.5	Very high	93.3	Very high	19 Å²	19	36 Å²	36	20%	0.196	20%	0.197	C	C	.	.	H	α-helix	trans	-62.2	-37.1	173.6	0	0	0	0	0	113.1	T363 N365 L366 F372	T363-G368 VanDerWaalsContact CG2-C 3.44Å; N365-G368 PolarHBondContact O-N 2.86Å; N365-G368 WeakPolarHBondContact OD1-CA 3.29Å; N365-G368 PolarHBondContact OD1-N 3.28Å; L366-G368 VanDerWaalsContact C-N 3.34Å; L366-G368 PolarHBondContact O-N 2.93Å; G368-F372 WeakPolarHBondContact O-CB 3.41Å; G368-F372 PolarHBondContact O-N 3.14Å
369	I	95.1	Very high	93	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-66.4	-45.1	173.4	-72.6	-64.5	0	0	0	111.3	V360 T363 N365 L366 H367 D371 F372 F373 F393 F401 M409 I454	V360-I369 HydrophobicContact CG2-CD1 3.63Å; T363-I369 HydrophobicContact CG2-CD1 3.77Å; T363-I369 HydrophobicContact CG2-CG1 3.93Å; T363-I369 WeakPolarHBondContact O-CD1 3.36Å; N365-I369 PolarHBondContact O-N 2.85Å; L366-I369 PolarHBondContact O-N 3.06Å; H367-I369 VanDerWaalsContact C-N 3.33Å; H367-I369 PolarHBondContact O-N 3.18Å; I369-D371 VanDerWaalsContact C-N 3.31Å; I369-D371 PolarHBondContact O-N 3.22Å; I369-F372 PolarHBondContact O-N 3.2Å; I369-F373 HydrophobicContact CG2-CD2 3.87Å; I369-F373 HydrophobicContact CG2-CE2 3.94Å; I369-F373 WeakPolarHBondContact O-CD2 3.43Å; I369-F373 PolarHBondContact O-N 3.45Å; I369-F393 HydrophobicContact CB-CE2 4.36Å; I369-F393 HydrophobicContact CB-CZ 4.43Å; I369-F393 HydrophobicContact CD1-CD2 3.94Å; I369-F393 HydrophobicContact CD1-CE2 3.78Å; I369-F393 HydrophobicContact CG1-CD2 4.38Å; I369-F393 HydrophobicContact CG1-CE2 3.73Å; I369-F393 HydrophobicContact CG1-CZ 4.22Å; I369-F393 HydrophobicContact CG2-CD1 4.25Å; I369-F393 HydrophobicContact CG2-CD2 4.24Å; I369-F393 HydrophobicContact CG2-CE1 3.9Å; I369-F393 HydrophobicContact CG2-CE2 3.79Å; I369-F393 HydrophobicContact CG2-CG 4.48Å; I369-F393 HydrophobicContact CG2-CZ 3.65Å; I369-F401 HydrophobicContact CD1-CZ 4.45Å; I369-M409 HydrophobicContact CB-CE 4.16Å; I369-M409 HydrophobicContact CG1-CE 3.48Å; I369-M409 VanDerWaalsContact CG1-CE 3.48Å; I369-I454 HydrophobicContact CG2-CD1 4.05Å
370	L	95.4	Very high	92.7	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-58.9	-45.5	177.3	-72.5	167.8	0	0	0	111.1	L366 H367 F373 C374 L453 I454	L366-L370 HydrophobicContact CG-CD1 4.28Å; L366-L370 WeakPolarHBondContact O-CG 3.28Å; L366-L370 PolarHBondContact O-N 3.27Å; H367-L370 PolarHBondContact O-N 3.37Å; L370-F373 PolarHBondContact O-N 3.38Å; L370-C374 PolarHBondContact O-N 3.3Å; L370-C374 PolarHBondContact O-SG 3.26Å; L370-L453 HydrophobicContact CD2-CD2 3.84Å; L370-L453 HydrophobicContact CD2-CG 3.98Å; L370-I454 HydrophobicContact CD2-CD1 4.45Å; L370-I454 HydrophobicContact CD2-CG1 3.64Å
371	D	93.7	Very high	92.6	Very high	58 Å²	58	42.1 Å²	42.1	31%	0.31	23%	0.232	S	C	.	.	H	α-helix	trans	-66	-42.5	177.9	-64.8	-13.4	0	0	0	111.1	H367 I369 F373 C374 E375 R516	H367-D371 VanDerWaalsContact O-CG 3.25Å; H367-D371 PolarHBondContact O-N 3.35Å; I369-D371 VanDerWaalsContact C-N 3.31Å; I369-D371 PolarHBondContact O-N 3.22Å; D371-F373 PolarHBondContact O-N 3.07Å; D371-C374 PolarHBondContact O-N 3.03Å; D371-E375 WeakPolarHBondContact O-CB 3.23Å; D371-E375 WeakPolarHBondContact O-CG 3.33Å; D371-E375 PolarHBondContact O-N 3.36Å; D371-R516 IonicContact OD1-CZ 3.33Å; D371-R516 IonicContact OD1-NH1 2.69Å; D371-R516 PolarHBondContact OD1-NH1 3.17Å; D371-R516 IonicContact OD1-NH2 2.82Å; D371-R516 PolarHBondContact OD1-NH2 3.44Å
372	F	95.9	Very high	92.6	Very high	30 Å²	30	41.2 Å²	41.2	13%	0.132	23%	0.227	C	C	.	.	H	α-helix	trans	-57.1	-46.5	174.9	-176.4	-77.2	0	0	0	112	T356 D359 V360 G368 I369 F376 L389	T356-F372 HydrophobicContact CG2-CE2 4.44Å; T356-F372 HydrophobicContact CG2-CZ 4Å; T356-F372 VanDerWaalsContact O-CZ 3.28Å; T356-F372 WeakPolarHBondContact O-CZ 3.47Å; D359-F372 HydrophobicContact CB-CE2 4.49Å; V360-F372 HydrophobicContact CB-CD1 4.29Å; V360-F372 HydrophobicContact CB-CE1 3.85Å; V360-F372 HydrophobicContact CB-CE2 4.39Å; V360-F372 HydrophobicContact CB-CZ 3.9Å; V360-F372 HydrophobicContact CG2-CD1 3.89Å; V360-F372 HydrophobicContact CG2-CE1 3.94Å; V360-F372 HydrophobicContact CG2-CG 4.35Å; V360-F372 HydrophobicContact CG2-CZ 4.39Å; G368-F372 WeakPolarHBondContact O-CB 3.41Å; G368-F372 PolarHBondContact O-N 3.14Å; I369-F372 PolarHBondContact O-N 3.2Å; F372-F376 HydrophobicContact CE1-CB 4.42Å; F372-F376 WeakPolarHBondContact O-CB 3.46Å; F372-F376 PolarHBondContact O-N 2.87Å; F372-L389 HydrophobicContact CD1-CD1 4.15Å; F372-L389 HydrophobicContact CD1-CD2 4.24Å; F372-L389 HydrophobicContact CE1-CD1 3.59Å; F372-L389 HydrophobicContact CE1-CD2 3.95Å; F372-L389 HydrophobicContact CE1-CG 4.44Å
373	F	96.2	Very high	92.7	Very high	1 Å²	1	35.8 Å²	35.8	0%	0.004	20%	0.198	C	C	.	.	H	α-helix	trans	-65.1	-40.6	177.7	-92.2	-106.9	0	0	0	111.9	V360 I369 L370 D371 S377 L389 Q390 F393 I454 H457	V360-F373 HydrophobicContact CG2-CE2 4.46Å; I369-F373 HydrophobicContact CG2-CD2 3.87Å; I369-F373 HydrophobicContact CG2-CE2 3.94Å; I369-F373 WeakPolarHBondContact O-CD2 3.43Å; I369-F373 PolarHBondContact O-N 3.45Å; L370-F373 PolarHBondContact O-N 3.38Å; D371-F373 PolarHBondContact O-N 3.07Å; F373-S377 VanDerWaalsContact O-CB 3.23Å; F373-S377 WeakPolarHBondContact O-CB 3.12Å; F373-S377 PolarHBondContact O-N 2.82Å; F373-L389 HydrophobicContact CD1-CD2 3.94Å; F373-L389 HydrophobicContact CD1-CG 4.28Å; F373-L389 HydrophobicContact CD2-CD2 4.22Å; F373-L389 HydrophobicContact CD2-CG 4.43Å; F373-L389 HydrophobicContact CE1-CD2 3.95Å; F373-L389 HydrophobicContact CE1-CG 3.76Å; F373-L389 HydrophobicContact CE2-CD1 3.99Å; F373-L389 HydrophobicContact CE2-CD2 4.23Å; F373-L389 HydrophobicContact CE2-CG 3.94Å; F373-L389 HydrophobicContact CG-CD2 4.09Å; F373-L389 HydrophobicContact CZ-CD1 4.04Å; F373-L389 HydrophobicContact CZ-CD2 4.11Å; F373-L389 HydrophobicContact CZ-CG 3.59Å; F373-Q390 HydrophobicContact CE1-CG 4.01Å; F373-F393 HydrophobicContact CE2-CB 4.05Å; F373-F393 HydrophobicContact CE2-CD1 4.05Å; F373-F393 HydrophobicContact CE2-CG 4.02Å; F373-F393 HydrophobicContact CZ-CB 3.87Å; F373-F393 HydrophobicContact CZ-CD1 4.05Å; F373-F393 HydrophobicContact CZ-CG 4.16Å; F373-I454 HydrophobicContact CD1-CG2 3.82Å; F373-I454 WeakPolarHBondContact CD1-O 3.32Å; F373-I454 HydrophobicContact CD2-CG2 4.05Å; F373-I454 HydrophobicContact CE1-CG2 3.55Å; F373-I454 HydrophobicContact CE2-CG2 3.79Å; F373-I454 HydrophobicContact CG-CG2 4.05Å; F373-I454 HydrophobicContact CZ-CG2 3.52Å; F373-H457 HydrophobicContact CB-CB 3.85Å; F373-H457 HydrophobicContact CD1-CB 4.3Å
374	C	94.1	Very high	92.9	Very high	15 Å²	15	34.7 Å²	34.7	10%	0.101	19%	0.191	C	C	.	.	H	α-helix	trans	-61.7	-52.8	175.1	-70.2	0	0	0	0	111.3	L370 D371 F376 S377 E378	L370-C374 PolarHBondContact O-N 3.3Å; L370-C374 PolarHBondContact O-SG 3.26Å; D371-C374 PolarHBondContact O-N 3.03Å; C374-F376 PolarHBondContact O-N 3.42Å; C374-S377 WeakPolarHBondContact O-CB 3.5Å; C374-S377 PolarHBondContact O-N 3.17Å; C374-E378 WeakPolarHBondContact O-CG 3.18Å; C374-E378 PolarHBondContact O-N 3.08Å
375	E	93.1	Very high	93.3	Very high	111 Å²	111	29.2 Å²	29.2	52%	0.519	16%	0.158	S	C	.	.	H	α-helix	trans	-61.3	-43	-179.7	-72.7	179	-174.3	0	0	111.8	D371 S377 E378 Q379	D371-E375 WeakPolarHBondContact O-CB 3.23Å; D371-E375 WeakPolarHBondContact O-CG 3.33Å; D371-E375 PolarHBondContact O-N 3.36Å; E375-S377 VanDerWaalsContact C-N 3.34Å; E375-S377 PolarHBondContact O-N 3.47Å; E375-E378 PolarHBondContact O-N 3.4Å; E375-Q379 WeakPolarHBondContact O-CG 3.26Å
376	F	95.3	Very high	93.5	Very high	5 Å²	5	26.6 Å²	26.6	2%	0.022	14%	0.142	C	C	.	.	H	α-helix	trans	-62.5	-43.5	175.8	-175.6	-104.2	0	0	0	111	R353 T356 V357 F372 C374 E378 Q379 P381 R386 L389	R353-F376 HydrophobicContact CB-CE2 4.27Å; R353-F376 HydrophobicContact CB-CZ 4.34Å; T356-F376 HydrophobicContact CG2-CD2 3.88Å; T356-F376 HydrophobicContact CG2-CE2 4.28Å; V357-F376 HydrophobicContact CG2-CE1 4.25Å; V357-F376 HydrophobicContact CG2-CE2 3.92Å; V357-F376 HydrophobicContact CG2-CZ 3.6Å; F372-F376 HydrophobicContact CE1-CB 4.42Å; F372-F376 WeakPolarHBondContact O-CB 3.46Å; F372-F376 PolarHBondContact O-N 2.87Å; C374-F376 PolarHBondContact O-N 3.42Å; F376-E378 PolarHBondContact O-N 3.07Å; F376-Q379 WeakPolarHBondContact O-CB 3.18Å; F376-Q379 PolarHBondContact O-N 2.9Å; F376-P381 HydrophobicContact CD1-CB 4.25Å; F376-P381 HydrophobicContact CD1-CG 3.71Å; F376-P381 HydrophobicContact CE1-CB 3.58Å; F376-P381 HydrophobicContact CE1-CG 3.48Å; F376-P381 VanDerWaalsContact CE1-CG 3.48Å; F376-P381 HydrophobicContact CE2-CB 4.36Å; F376-P381 HydrophobicContact CG-CG 4.45Å; F376-P381 HydrophobicContact CZ-CB 3.64Å; F376-P381 HydrophobicContact CZ-CG 4.04Å; F376-P381 WeakPolarHBondContact O-CD 3.4Å; F376-P381 WeakPolarHBondContact O-CG 3.32Å; F376-R386 HydrophobicContact CE1-CG 4.39Å; F376-L389 HydrophobicContact CB-CD2 4.05Å; F376-L389 HydrophobicContact CD1-CD2 3.35Å; F376-L389 HydrophobicContact CE1-CB 4.32Å; F376-L389 HydrophobicContact CE1-CD2 3.93Å; F376-L389 HydrophobicContact CG-CD2 3.8Å
377	S	93.6	Very high	93.5	Very high	4 Å²	4	26.5 Å²	26.5	3%	0.028	14%	0.142	C	C	.	.	H	α-helix	trans	-64.1	-38.5	178.1	-179.4	0	0	0	0	113.2	F373 C374 E375 Q379 S380 P381 H457 R461 Q464	F373-S377 VanDerWaalsContact O-CB 3.23Å; F373-S377 WeakPolarHBondContact O-CB 3.12Å; F373-S377 PolarHBondContact O-N 2.82Å; C374-S377 WeakPolarHBondContact O-CB 3.5Å; C374-S377 PolarHBondContact O-N 3.17Å; E375-S377 VanDerWaalsContact C-N 3.34Å; E375-S377 PolarHBondContact O-N 3.47Å; S377-Q379 PolarHBondContact O-N 3.31Å; S377-Q379 VanDerWaalsContact O-N 3.14Å; S377-S380 PolarHBondContact O-N 3.29Å; S377-P381 WeakPolarHBondContact O-CD 3.3Å; S377-H457 WeakPolarHBondContact CB-O 3.35Å; S377-H457 PolarHBondContact OG-O 3.45Å; S377-R461 PolarHBondContact OG-NH1 3Å; S377-R461 VanDerWaalsContact OG-NH1 3.15Å; S377-Q464 PolarHBondContact OG-NE2 2.96Å
378	E	90.1	Very high	93.6	Very high	54 Å²	54	25.3 Å²	25.3	25%	0.252	14%	0.136	S	C	.	.	H	α-helix	trans	-62	-22	-179.9	-77.7	-178	170.9	0	0	113.3	C374 E375 F376 S380 K735 Y736	C374-E378 WeakPolarHBondContact O-CG 3.18Å; C374-E378 PolarHBondContact O-N 3.08Å; E375-E378 PolarHBondContact O-N 3.4Å; F376-E378 PolarHBondContact O-N 3.07Å; E378-S380 PolarHBondContact O-N 3.48Å; E378-K735 PolarHBondContact O-NZ 2.93Å; E378-Y736 PolarHBondContact OE1-OH 3.41Å
379	Q	89.7	Confident	93.6	Very high	111 Å²	111	24.6 Å²	24.6	52%	0.519	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	1.7	174.5	-60.1	173.6	25	0	0	113.5	E375 F376 S377	E375-Q379 WeakPolarHBondContact O-CG 3.26Å; F376-Q379 WeakPolarHBondContact O-CB 3.18Å; F376-Q379 PolarHBondContact O-N 2.9Å; S377-Q379 PolarHBondContact O-N 3.31Å; S377-Q379 VanDerWaalsContact O-N 3.14Å
380	S	88.4	Confident	93.5	Very high	75 Å²	75	25 Å²	25	52%	0.524	13%	0.13	S	C	.	.			trans	50.1	57.3	-174.8	-56.7	0	0	0	0	113.3	R353 S377 E378	R353-S380 PolarHBondContact NH2-O 2.89Å; S377-S380 PolarHBondContact O-N 3.29Å; E378-S380 PolarHBondContact O-N 3.48Å
381	P	91.9	Very high	93.3	Very high	7 Å²	7	25.4 Å²	25.4	5%	0.045	13%	0.132	C	C	.	.			trans	-67.1	147.1	-180	26.3	-33	0	0	0	112	F376 S377 S385 R386	F376-P381 HydrophobicContact CD1-CB 4.25Å; F376-P381 HydrophobicContact CD1-CG 3.71Å; F376-P381 HydrophobicContact CE1-CB 3.58Å; F376-P381 HydrophobicContact CE1-CG 3.48Å; F376-P381 VanDerWaalsContact CE1-CG 3.48Å; F376-P381 HydrophobicContact CE2-CB 4.36Å; F376-P381 HydrophobicContact CG-CG 4.45Å; F376-P381 HydrophobicContact CZ-CB 3.64Å; F376-P381 HydrophobicContact CZ-CG 4.04Å; F376-P381 WeakPolarHBondContact O-CD 3.4Å; F376-P381 WeakPolarHBondContact O-CG 3.32Å; S377-P381 WeakPolarHBondContact O-CD 3.3Å; P381-S385 WeakPolarHBondContact CB-OG 3.36Å; P381-R386 HydrophobicContact CB-CG 4Å; P381-R386 HydrophobicContact CG-CG 3.5Å; P381-R386 WeakPolarHBondContact O-CD 3.38Å; P381-R386 PolarHBondContact O-NE 3.5Å; P381-R386 VanDerWaalsContact O-NE 3.14Å
382	C	91.8	Very high	93.2	Very high	9 Å²	9	23.1 Å²	23.1	6%	0.061	12%	0.12	C	C	.	.			trans	-62.6	161	176.2	66.1	0	0	0	0	111.9	L350 L384 S385 R386	L350-C382 VanDerWaalsContact CD1-SG 3.57Å; C382-L384 VanDerWaalsContact C-N 3.28Å; C382-L384 PolarHBondContact O-N 2.82Å; C382-S385 PolarHBondContact N-OG 3.36Å; C382-S385 PolarHBondContact O-N 3.48Å; C382-S385 PolarHBondContact O-OG 3.4Å; C382-S385 PolarHBondContact SG-OG 3.33Å; C382-R386 PolarHBondContact O-N 2.62Å; C382-R386 VanDerWaalsContact O-N 3.07Å
383	V	93.2	Very high	93	Very high	6 Å²	6	21.7 Å²	21.7	4%	0.036	11%	0.114	C	C	.	.	H	α-helix	trans	-56.4	-40.4	-174.1	70.5	0	0	0	0	113	L138 V182 V187 D192 F193 R386 S387	L138-V383 WeakPolarHBondContact O-CG1 3.46Å; V182-V383 HydrophobicContact CG1-CG2 4.02Å; V182-V383 HydrophobicContact CG2-CG1 4.49Å; V182-V383 HydrophobicContact CG2-CG2 4.26Å; V187-V383 HydrophobicContact CB-CG2 4.24Å; V187-V383 HydrophobicContact CG2-CG2 3.53Å; D192-V383 HydrophobicContact CB-CG2 4.2Å; F193-V383 HydrophobicContact CB-CG1 4.45Å; F193-V383 HydrophobicContact CB-CG2 4.13Å; F193-V383 HydrophobicContact CD2-CG1 3.98Å; V383-R386 PolarHBondContact O-N 3.16Å; V383-S387 WeakPolarHBondContact O-CB 3.28Å; V383-S387 PolarHBondContact O-N 3.09Å; V383-S387 PolarHBondContact O-OG 3.3Å
384	L	94.9	Very high	92.5	Very high	6 Å²	6	22.2 Å²	22.2	3%	0.031	12%	0.117	C	C	.	.	H	α-helix	trans	-63.8	-49.5	179.1	179.3	58	0	0	0	111.3	L138 A178 L350 C382 R386 S387 L388	L138-L384 HydrophobicContact CD1-CD2 4.15Å; L138-L384 HydrophobicContact CD2-CB 4.23Å; L138-L384 HydrophobicContact CD2-CD2 4.27Å; A178-L384 HydrophobicContact CB-CD1 3.89Å; A178-L384 HydrophobicContact CB-CD2 4.46Å; L350-L384 HydrophobicContact CD1-CD2 4.45Å; L350-L384 HydrophobicContact CD2-CD2 4.43Å; C382-L384 VanDerWaalsContact C-N 3.28Å; C382-L384 PolarHBondContact O-N 2.82Å; L384-R386 VanDerWaalsContact C-N 3.34Å; L384-R386 PolarHBondContact O-N 2.9Å; L384-S387 PolarHBondContact O-N 3.36Å; L384-S387 VanDerWaalsContact O-N 3.13Å; L384-L388 HydrophobicContact CD1-CD1 4.33Å; L384-L388 HydrophobicContact CD1-CG 4.17Å; L384-L388 HydrophobicContact CG-CD1 4.16Å; L384-L388 HydrophobicContact CG-CG 4.43Å; L384-L388 WeakPolarHBondContact O-CG 3.41Å; L384-L388 PolarHBondContact O-N 3.09Å
385	S	95.4	Very high	91.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66.3	-35.2	-178.3	56.5	0	0	0	0	112.6	P381 C382 S387 L389	P381-S385 WeakPolarHBondContact CB-OG 3.36Å; C382-S385 PolarHBondContact N-OG 3.36Å; C382-S385 PolarHBondContact O-N 3.48Å; C382-S385 PolarHBondContact O-OG 3.4Å; C382-S385 PolarHBondContact SG-OG 3.33Å; S385-S387 VanDerWaalsContact C-N 3.33Å; S385-L389 PolarHBondContact O-N 3.26Å; S385-L389 VanDerWaalsContact O-N 3.07Å
386	R	93.8	Very high	90.3	Very high	19 Å²	19	22.4 Å²	22.4	7%	0.072	12%	0.12	C	C	.	.	H	α-helix	trans	-62.1	-42.4	170.9	-71.2	-173.5	-70.3	122.4	-11.1	111.9	D192 F376 P381 C382 V383 L384 L389 Q390 G458 H459	D192-R386 VanDerWaalsContact CG-NH2 3.3Å; D192-R386 IonicContact OD1-NH2 3.09Å; D192-R386 IonicContact OD2-CZ 2.86Å; D192-R386 IonicContact OD2-NH1 3.04Å; D192-R386 PolarHBondContact OD2-NH1 3.44Å; D192-R386 IonicContact OD2-NH2 2.8Å; D192-R386 PolarHBondContact OD2-NH2 3.16Å; F376-R386 HydrophobicContact CE1-CG 4.39Å; P381-R386 HydrophobicContact CB-CG 4Å; P381-R386 HydrophobicContact CG-CG 3.5Å; P381-R386 WeakPolarHBondContact O-CD 3.38Å; P381-R386 PolarHBondContact O-NE 3.5Å; P381-R386 VanDerWaalsContact O-NE 3.14Å; C382-R386 PolarHBondContact O-N 2.62Å; C382-R386 VanDerWaalsContact O-N 3.07Å; V383-R386 PolarHBondContact O-N 3.16Å; L384-R386 VanDerWaalsContact C-N 3.34Å; L384-R386 PolarHBondContact O-N 2.9Å; R386-L389 PolarHBondContact O-N 3.26Å; R386-Q390 WeakPolarHBondContact O-CG 3.29Å; R386-Q390 PolarHBondContact O-N 3.22Å; R386-Q390 VanDerWaalsContact O-N 3.08Å; R386-G458 WeakPolarHBondContact CD-O 3.41Å; R386-G458 PolarHBondContact NH1-O 3.31Å; R386-H459 VanDerWaalsContact NH1-C 3.29Å
387	S	94.3	Very high	88.8	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-70.4	-37.9	-179	-56	0	0	0	0	112.1	V182 V383 L384 S385 T391	V182-S387 WeakPolarHBondContact CA-OG 3.2Å; V383-S387 WeakPolarHBondContact O-CB 3.28Å; V383-S387 PolarHBondContact O-N 3.09Å; V383-S387 PolarHBondContact O-OG 3.3Å; L384-S387 PolarHBondContact O-N 3.36Å; L384-S387 VanDerWaalsContact O-N 3.13Å; S385-S387 VanDerWaalsContact C-N 3.33Å; S387-T391 WeakPolarHBondContact O-CB 3.5Å; S387-T391 VanDerWaalsContact O-CG2 3.3Å; S387-T391 WeakPolarHBondContact O-CG2 3.4Å; S387-T391 PolarHBondContact O-N 3.26Å; S387-T391 PolarHBondContact O-OG1 3.31Å
388	L	95.2	Very high	87.5	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.6	-45.7	172.4	-70.3	175	0	0	0	111	K181 L265 F268 V354 V357 L384 T391 T392	K181-L388 HydrophobicContact CB-CD2 4.5Å; K181-L388 HydrophobicContact CD-CD2 4.22Å; K181-L388 HydrophobicContact CG-CD2 4.07Å; L265-L388 HydrophobicContact CD2-CD1 4.12Å; L265-L388 HydrophobicContact CD2-CD2 4.35Å; F268-L388 HydrophobicContact CB-CD2 3.89Å; F268-L388 HydrophobicContact CD1-CD2 4.36Å; F268-L388 HydrophobicContact CD2-CD1 4.41Å; F268-L388 HydrophobicContact CD2-CD2 4.08Å; F268-L388 HydrophobicContact CE2-CD1 4.39Å; F268-L388 HydrophobicContact CG-CD2 3.87Å; V354-L388 HydrophobicContact CG2-CD1 3.92Å; V357-L388 HydrophobicContact CG1-CB 4.27Å; L384-L388 HydrophobicContact CD1-CD1 4.33Å; L384-L388 HydrophobicContact CD1-CG 4.17Å; L384-L388 HydrophobicContact CG-CD1 4.16Å; L384-L388 HydrophobicContact CG-CG 4.43Å; L384-L388 WeakPolarHBondContact O-CG 3.41Å; L384-L388 PolarHBondContact O-N 3.09Å; L388-T391 PolarHBondContact O-OG1 3.17Å; L388-T392 WeakPolarHBondContact O-CB 3.33Å; L388-T392 PolarHBondContact O-N 3.19Å; L388-T392 PolarHBondContact O-OG1 3.06Å
389	L	94.8	Very high	87	Confident	3 Å²	3	36.4 Å²	36.4	2%	0.016	18%	0.184	C	C	.	.	H	α-helix	trans	-58.3	-52.7	177	-179.3	56.3	0	0	0	112.1	V357 V360 F372 F373 F376 S385 R386 T391 T392 F393	V357-L389 HydrophobicContact CG1-CB 4.21Å; V357-L389 HydrophobicContact CG1-CD1 4.34Å; V357-L389 HydrophobicContact CG2-CB 3.95Å; V360-L389 HydrophobicContact CB-CD1 3.89Å; V360-L389 HydrophobicContact CG1-CD1 4.07Å; V360-L389 HydrophobicContact CG2-CD1 3.84Å; F372-L389 HydrophobicContact CD1-CD1 4.15Å; F372-L389 HydrophobicContact CD1-CD2 4.24Å; F372-L389 HydrophobicContact CE1-CD1 3.59Å; F372-L389 HydrophobicContact CE1-CD2 3.95Å; F372-L389 HydrophobicContact CE1-CG 4.44Å; F373-L389 HydrophobicContact CD1-CD2 3.94Å; F373-L389 HydrophobicContact CD1-CG 4.28Å; F373-L389 HydrophobicContact CD2-CD2 4.22Å; F373-L389 HydrophobicContact CD2-CG 4.43Å; F373-L389 HydrophobicContact CE1-CD2 3.95Å; F373-L389 HydrophobicContact CE1-CG 3.76Å; F373-L389 HydrophobicContact CE2-CD1 3.99Å; F373-L389 HydrophobicContact CE2-CD2 4.23Å; F373-L389 HydrophobicContact CE2-CG 3.94Å; F373-L389 HydrophobicContact CG-CD2 4.09Å; F373-L389 HydrophobicContact CZ-CD1 4.04Å; F373-L389 HydrophobicContact CZ-CD2 4.11Å; F373-L389 HydrophobicContact CZ-CG 3.59Å; F376-L389 HydrophobicContact CB-CD2 4.05Å; F376-L389 HydrophobicContact CD1-CD2 3.35Å; F376-L389 HydrophobicContact CE1-CB 4.32Å; F376-L389 HydrophobicContact CE1-CD2 3.93Å; F376-L389 HydrophobicContact CG-CD2 3.8Å; S385-L389 PolarHBondContact O-N 3.26Å; S385-L389 VanDerWaalsContact O-N 3.07Å; R386-L389 PolarHBondContact O-N 3.26Å; L389-T391 PolarHBondContact O-N 3.27Å; L389-T392 PolarHBondContact O-N 2.95Å; L389-F393 PolarHBondContact O-N 3.04Å; L389-F393 VanDerWaalsContact O-N 3.09Å
390	Q	92.5	Very high	86.8	Confident	10 Å²	10	31.4 Å²	31.4	5%	0.047	16%	0.161	C	C	.	.	H	α-helix	trans	-58.1	-51.2	-179.9	-74.5	-176.9	81.2	0	0	111.9	A185 F373 R386 T392 F393 L394 Q455 G458	A185-Q390 HydrophobicContact CB-CB 4.18Å; A185-Q390 PolarHBondContact O-OE1 3.29Å; F373-Q390 HydrophobicContact CE1-CG 4.01Å; R386-Q390 WeakPolarHBondContact O-CG 3.29Å; R386-Q390 PolarHBondContact O-N 3.22Å; R386-Q390 VanDerWaalsContact O-N 3.08Å; Q390-T392 VanDerWaalsContact C-N 3.3Å; Q390-T392 PolarHBondContact O-N 2.89Å; Q390-F393 PolarHBondContact O-N 3.04Å; Q390-L394 PolarHBondContact O-N 3.38Å; Q390-Q455 VanDerWaalsContact OE1-CG 3.23Å; Q390-Q455 PolarHBondContact OE1-O 3.4Å; Q390-G458 VanDerWaalsContact NE2-CA 3.33Å; Q390-G458 PolarHBondContact NE2-O 2.99Å
391	T	91.3	Very high	86.6	Confident	9 Å²	9	28.8 Å²	28.8	6%	0.055	14%	0.14	C	C	.	.	H	α-helix	trans	-74.3	-19.5	-176.4	60.1	0	0	0	0	113.5	K181 K184 A185 S387 L388 L389 I395	K181-T391 HydrophobicContact CD-CG2 4.3Å; K181-T391 VanDerWaalsContact CD-OG1 3.31Å; K181-T391 WeakPolarHBondContact CD-OG1 3.38Å; K181-T391 PolarHBondContact NZ-OG1 3.49Å; K184-T391 HydrophobicContact CB-CG2 3.82Å; A185-T391 HydrophobicContact CB-CG2 4.23Å; S387-T391 WeakPolarHBondContact O-CB 3.5Å; S387-T391 VanDerWaalsContact O-CG2 3.3Å; S387-T391 WeakPolarHBondContact O-CG2 3.4Å; S387-T391 PolarHBondContact O-N 3.26Å; S387-T391 PolarHBondContact O-OG1 3.31Å; L388-T391 PolarHBondContact O-OG1 3.17Å; L389-T391 PolarHBondContact O-N 3.27Å; T391-I395 WeakPolarHBondContact O-CG1 3.47Å
392	T	91.8	Very high	86	Confident	10 Å²	10	29.1 Å²	29.1	6%	0.061	15%	0.146	C	C	.	.	H	α-helix	trans	-75.4	-42.8	172.8	-60.1	0	0	0	0	110.7	F268 V276 V360 L388 L389 Q390	F268-T392 VanDerWaalsContact CD1-OG1 3.3Å; F268-T392 WeakPolarHBondContact CD1-OG1 3.34Å; V276-T392 HydrophobicContact CG2-CG2 3.76Å; V360-T392 HydrophobicContact CG1-CG2 4.32Å; L388-T392 WeakPolarHBondContact O-CB 3.33Å; L388-T392 PolarHBondContact O-N 3.19Å; L388-T392 PolarHBondContact O-OG1 3.06Å; L389-T392 PolarHBondContact O-N 2.95Å; Q390-T392 VanDerWaalsContact C-N 3.3Å; Q390-T392 PolarHBondContact O-N 2.89Å
393	F	90.8	Very high	85.5	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-77.7	-46.4	179.9	-179.1	-105.9	0	0	0	112.3	I369 F373 L389 Q390 V400 F401 M406 M409 I454	I369-F393 HydrophobicContact CB-CE2 4.36Å; I369-F393 HydrophobicContact CB-CZ 4.43Å; I369-F393 HydrophobicContact CD1-CD2 3.94Å; I369-F393 HydrophobicContact CD1-CE2 3.78Å; I369-F393 HydrophobicContact CG1-CD2 4.38Å; I369-F393 HydrophobicContact CG1-CE2 3.73Å; I369-F393 HydrophobicContact CG1-CZ 4.22Å; I369-F393 HydrophobicContact CG2-CD1 4.25Å; I369-F393 HydrophobicContact CG2-CD2 4.24Å; I369-F393 HydrophobicContact CG2-CE1 3.9Å; I369-F393 HydrophobicContact CG2-CE2 3.79Å; I369-F393 HydrophobicContact CG2-CG 4.48Å; I369-F393 HydrophobicContact CG2-CZ 3.65Å; F373-F393 HydrophobicContact CE2-CB 4.05Å; F373-F393 HydrophobicContact CE2-CD1 4.05Å; F373-F393 HydrophobicContact CE2-CG 4.02Å; F373-F393 HydrophobicContact CZ-CB 3.87Å; F373-F393 HydrophobicContact CZ-CD1 4.05Å; F373-F393 HydrophobicContact CZ-CG 4.16Å; L389-F393 PolarHBondContact O-N 3.04Å; L389-F393 VanDerWaalsContact O-N 3.09Å; Q390-F393 PolarHBondContact O-N 3.04Å; F393-V400 HydrophobicContact CD2-CG1 4.14Å; F393-V400 HydrophobicContact CE2-CB 4.44Å; F393-V400 HydrophobicContact CE2-CG1 3.45Å; F393-V400 VanDerWaalsContact CE2-CG1 3.45Å; F393-V400 HydrophobicContact CE2-CG2 4.36Å; F393-V400 HydrophobicContact CZ-CB 4.46Å; F393-V400 HydrophobicContact CZ-CG1 3.87Å; F393-V400 HydrophobicContact CZ-CG2 3.9Å; F393-V400 WeakPolarHBondContact O-CA 3.28Å; F393-F401 HydrophobicContact CB-CE1 4.43Å; F393-F401 HydrophobicContact CD2-CD1 4.44Å; F393-F401 AromaticContact CD2-CE1 3.8Å; F393-F401 HydrophobicContact CD2-CE1 3.8Å; F393-F401 HydrophobicContact CD2-CE2 4.1Å; F393-F401 AromaticContact CD2-CZ 3.61Å; F393-F401 HydrophobicContact CD2-CZ 3.61Å; F393-F401 HydrophobicContact CE2-CE2 4.22Å; F393-F401 HydrophobicContact CE2-CZ 4.14Å; F393-F401 PolarHBondContact O-N 3.25Å; F393-M406 HydrophobicContact CE1-CE 4.13Å; F393-M406 HydrophobicContact CZ-CE 4.25Å; F393-M409 HydrophobicContact CE2-CE 4.29Å; F393-M409 HydrophobicContact CE2-SD 4.43Å; F393-M409 HydrophobicContact CZ-CE 4.33Å; F393-M409 HydrophobicContact CZ-SD 4.05Å; F393-I454 HydrophobicContact CD1-CD1 4.37Å; F393-I454 HydrophobicContact CD1-CG2 3.77Å; F393-I454 HydrophobicContact CE1-CD1 3.46Å; F393-I454 VanDerWaalsContact CE1-CD1 3.46Å; F393-I454 HydrophobicContact CE1-CG2 3.96Å; F393-I454 HydrophobicContact CZ-CD1 4.05Å
394	L	86.3	Confident	85.2	Confident	13 Å²	13	38 Å²	38	7%	0.068	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-117.2	82.4	-179.5	-68.6	169.4	0	0	0	111.2	Q390 M406 C451 I454	Q390-L394 PolarHBondContact O-N 3.38Å; L394-M406 HydrophobicContact CD2-CE 4.07Å; L394-C451 HydrophobicContact CD1-CB 4.27Å; L394-I454 HydrophobicContact CD1-CB 4.36Å; L394-I454 HydrophobicContact CD1-CG2 4.16Å
395	I	73.7	Confident	85	Confident	41 Å²	41	41.5 Å²	41.5	21%	0.21	21%	0.21	C	C	.	.	S	Bend	trans	-67.1	-43.5	-175.6	-63	170.3	0	0	0	112.7	K271 T391	K271-I395 HydrophobicContact CB-CD1 3.99Å; K271-I395 HydrophobicContact CD-CG2 4.37Å; K271-I395 HydrophobicContact CG-CD1 4.27Å; K271-I395 HydrophobicContact CG-CG2 4.29Å; T391-I395 WeakPolarHBondContact O-CG1 3.47Å
396	D	68.2	Low	84.8	Confident	88 Å²	88	41.7 Å²	41.7	47%	0.471	21%	0.211	S	C	.	.	S	Bend	trans	-130.2	27.5	-174.3	-64.2	-44.6	0	0	0	111.9	K271 K398	K271-D396 IonicContact NZ-OD1 2.93Å; K271-D396 IonicContact NZ-OD2 3.83Å; K271-D396 PolarHBondContact NZ-OD2 3.2Å; D396-K398 PolarHBondContact O-N 3.4Å
397	N	64.1	Low	84.8	Confident	98 Å²	98	43.5 Å²	43.5	52%	0.524	22%	0.22	S	C	.	.	S	Bend	trans	56.1	7.3	-177.6	-66.6	-15.8	0	0	0	117.1
398	K	65.1	Low	84.8	Confident	163 Å²	163	47 Å²	47	71%	0.709	24%	0.239	S	C	*	.	S	Bend	trans	-132.2	-20.7	-177.6	-63.6	-175.5	-178.6	-177.6	0	114.7	D396	D396-K398 PolarHBondContact O-N 3.4Å
399	K	80.4	Confident	84.7	Confident	96 Å²	96	47.7 Å²	47.7	42%	0.417	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.3	-177	-64.3	-171.5	-179.3	-174.8	0	111.2	G402 H404	K399-G402 VanDerWaalsContact CD-O 3.28Å; K399-G402 WeakPolarHBondContact CD-O 3.31Å; K399-H404 CarbonylContact C-O 3.57Å; K399-H404 WeakPolarHBondContact CA-O 3.22Å
400	V	84.1	Confident	84.7	Confident	7 Å²	7	47.5 Å²	47.5	4%	0.042	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	123.1	172	174	0	0	0	0	108.1	F393 G402 T403 H404 M406 M409	F393-V400 HydrophobicContact CD2-CG1 4.14Å; F393-V400 HydrophobicContact CE2-CB 4.44Å; F393-V400 HydrophobicContact CE2-CG1 3.45Å; F393-V400 VanDerWaalsContact CE2-CG1 3.45Å; F393-V400 HydrophobicContact CE2-CG2 4.36Å; F393-V400 HydrophobicContact CZ-CB 4.46Å; F393-V400 HydrophobicContact CZ-CG1 3.87Å; F393-V400 HydrophobicContact CZ-CG2 3.9Å; F393-V400 WeakPolarHBondContact O-CA 3.28Å; V400-G402 PolarHBondContact O-N 3.22Å; V400-T403 PolarHBondContact O-N 3.47Å; V400-H404 HydrophobicContact CB-CB 4.34Å; V400-H404 PolarHBondContact N-O 2.9Å; V400-H404 PolarHBondContact O-N 3.44Å; V400-M406 HydrophobicContact CG2-CB 4.48Å; V400-M406 HydrophobicContact CG2-CE 3.74Å; V400-M406 HydrophobicContact CG2-SD 4.22Å; V400-M409 HydrophobicContact CG1-SD 4.31Å; V400-M409 HydrophobicContact CG2-SD 4.08Å
401	F	84.7	Confident	84.9	Confident	19 Å²	19	48.5 Å²	48.5	8%	0.083	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	52	27	-175.1	-57.1	-58.5	0	0	0	114.1	T273 V360 V361 I369 F393 T403	T273-F401 HydrophobicContact CG2-CB 3.69Å; T273-F401 HydrophobicContact CG2-CD1 4.25Å; T273-F401 HydrophobicContact CG2-CG 3.98Å; V360-F401 HydrophobicContact CG1-CE1 4Å; V360-F401 HydrophobicContact CG1-CZ 4.42Å; V360-F401 HydrophobicContact CG2-CZ 4.48Å; V361-F401 HydrophobicContact CG1-CE1 4.18Å; I369-F401 HydrophobicContact CD1-CZ 4.45Å; F393-F401 HydrophobicContact CB-CE1 4.43Å; F393-F401 HydrophobicContact CD2-CD1 4.44Å; F393-F401 AromaticContact CD2-CE1 3.8Å; F393-F401 HydrophobicContact CD2-CE1 3.8Å; F393-F401 HydrophobicContact CD2-CE2 4.1Å; F393-F401 AromaticContact CD2-CZ 3.61Å; F393-F401 HydrophobicContact CD2-CZ 3.61Å; F393-F401 HydrophobicContact CE2-CE2 4.22Å; F393-F401 HydrophobicContact CE2-CZ 4.14Å; F393-F401 PolarHBondContact O-N 3.25Å; F401-T403 PolarHBondContact O-N 3.22Å
402	G	79.5	Confident	85	Confident	15 Å²	15	51.3 Å²	51.3	16%	0.155	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	-9.3	180	0	0	0	0	0	115.8	K399 V400	K399-G402 VanDerWaalsContact CD-O 3.28Å; K399-G402 WeakPolarHBondContact CD-O 3.31Å; V400-G402 PolarHBondContact O-N 3.22Å
403	T	81.9	Confident	85.2	Confident	88 Å²	88	51 Å²	51	54%	0.54	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	-40	-171.8	53.3	0	0	0	0	113.8	V400 F401	V400-T403 PolarHBondContact O-N 3.47Å; F401-T403 PolarHBondContact O-N 3.22Å
404	H	85.9	Confident	85.4	Confident	114 Å²	114	51 Å²	51	53%	0.528	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	147.2	-171.4	-58.2	-72.9	0	0	0	112.4	K399 V400	K399-H404 CarbonylContact C-O 3.57Å; K399-H404 WeakPolarHBondContact CA-O 3.22Å; V400-H404 HydrophobicContact CB-CB 4.34Å; V400-H404 PolarHBondContact N-O 2.9Å; V400-H404 PolarHBondContact O-N 3.44Å
405	L	90.4	Very high	85.7	Confident	79 Å²	79	54.7 Å²	54.7	41%	0.414	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	139.8	173	-62.7	175.1	0	0	0	109.9	Q407 D408 M409	L405-Q407 HydrophobicContact CB-CB 4.4Å; L405-Q407 PolarHBondContact O-N 2.87Å; L405-D408 PolarHBondContact O-N 2.86Å; L405-D408 VanDerWaalsContact O-N 3.09Å; L405-M409 PolarHBondContact O-N 3.04Å
406	M	92.1	Very high	86.4	Confident	4 Å²	4	60.5 Å²	60.5	2%	0.02	29%	0.292	C	S	.	.	H	α-helix	trans	-56.3	-33.1	172.9	-180	55.9	78	0	0	111.8	L366 F393 L394 V400 D408 M409 I410 I454	L366-M406 HydrophobicContact CD1-SD 4.4Å; F393-M406 HydrophobicContact CE1-CE 4.13Å; F393-M406 HydrophobicContact CZ-CE 4.25Å; L394-M406 HydrophobicContact CD2-CE 4.07Å; V400-M406 HydrophobicContact CG2-CB 4.48Å; V400-M406 HydrophobicContact CG2-CE 3.74Å; V400-M406 HydrophobicContact CG2-SD 4.22Å; M406-D408 VanDerWaalsContact C-N 3.31Å; M406-D408 PolarHBondContact O-N 2.92Å; M406-M409 PolarHBondContact O-N 2.74Å; M406-M409 HydrophobicContact SD-CB 4.47Å; M406-M409 HydrophobicContact SD-SD 4.37Å; M406-I410 HydrophobicContact CG-CD1 3.78Å; M406-I410 HydrophobicContact CG-CG1 4.31Å; M406-I410 WeakPolarHBondContact O-CG1 3.28Å; M406-I410 PolarHBondContact O-N 3.49Å; M406-I410 HydrophobicContact SD-CD1 4.33Å; M406-I410 HydrophobicContact SD-CG1 4.28Å; M406-I454 HydrophobicContact CE-CD1 4.08Å
407	Q	93.8	Very high	87.6	Confident	56 Å²	56	56.4 Å²	56.4	26%	0.262	27%	0.27	S	S	.	.	H	α-helix	trans	-57	-41.5	176.6	-62.8	178.4	8.2	0	0	112.9	L405 I410 K411 V443 T444 S447	L405-Q407 HydrophobicContact CB-CB 4.4Å; L405-Q407 PolarHBondContact O-N 2.87Å; Q407-I410 PolarHBondContact O-N 3.14Å; Q407-K411 WeakPolarHBondContact O-CG 3.21Å; Q407-K411 PolarHBondContact O-N 3.3Å; Q407-V443 VanDerWaalsContact CA-CG1 3.43Å; Q407-V443 HydrophobicContact CB-CG1 3.57Å; Q407-V443 HydrophobicContact CG-CG1 3.97Å; Q407-V443 VanDerWaalsContact O-CG1 3.28Å; Q407-V443 WeakPolarHBondContact O-CG1 3.32Å; Q407-T444 PolarHBondContact NE2-OG1 2.78Å; Q407-S447 WeakPolarHBondContact CG-OG 3.42Å
408	D	93.4	Very high	88.9	Confident	74 Å²	74	51.8 Å²	51.8	40%	0.396	25%	0.245	S	C	.	.	H	α-helix	trans	-68.3	-42.5	-179.7	-63.1	-38	0	0	0	110.6	L405 M406 I410 K411 D412	L405-D408 PolarHBondContact O-N 2.86Å; L405-D408 VanDerWaalsContact O-N 3.09Å; M406-D408 VanDerWaalsContact C-N 3.31Å; M406-D408 PolarHBondContact O-N 2.92Å; D408-I410 VanDerWaalsContact C-N 3.32Å; D408-I410 PolarHBondContact O-N 3.08Å; D408-K411 PolarHBondContact O-N 3.32Å; D408-D412 PolarHBondContact O-N 2.83Å
409	M	93.6	Very high	90.1	Very high	14 Å²	14	45.4 Å²	45.4	7%	0.069	22%	0.221	C	C	.	.	H	α-helix	trans	-62.1	-39.1	175.9	-162.4	-175.3	-164.6	0	0	112.2	L366 I369 F393 V400 L405 M406 D412 A413	L366-M409 HydrophobicContact CB-CE 4.32Å; L366-M409 HydrophobicContact CB-CG 4.15Å; L366-M409 HydrophobicContact CB-SD 4.36Å; L366-M409 HydrophobicContact CD1-SD 4.15Å; I369-M409 HydrophobicContact CB-CE 4.16Å; I369-M409 HydrophobicContact CG1-CE 3.48Å; I369-M409 VanDerWaalsContact CG1-CE 3.48Å; F393-M409 HydrophobicContact CE2-CE 4.29Å; F393-M409 HydrophobicContact CE2-SD 4.43Å; F393-M409 HydrophobicContact CZ-CE 4.33Å; F393-M409 HydrophobicContact CZ-SD 4.05Å; V400-M409 HydrophobicContact CG1-SD 4.31Å; V400-M409 HydrophobicContact CG2-SD 4.08Å; L405-M409 PolarHBondContact O-N 3.04Å; M406-M409 PolarHBondContact O-N 2.74Å; M406-M409 HydrophobicContact SD-CB 4.47Å; M406-M409 HydrophobicContact SD-SD 4.37Å; M409-D412 PolarHBondContact O-N 2.88Å; M409-A413 WeakPolarHBondContact O-CB 3.28Å; M409-A413 PolarHBondContact O-N 3.27Å
410	I	95.8	Very high	90.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-66.3	-45.3	174.8	-71	166.7	0	0	0	110.9	L366 M406 Q407 D408 D412 A413 L414 V443 C446 F450 W509	L366-I410 HydrophobicContact CD2-CG1 3.98Å; M406-I410 HydrophobicContact CG-CD1 3.78Å; M406-I410 HydrophobicContact CG-CG1 4.31Å; M406-I410 WeakPolarHBondContact O-CG1 3.28Å; M406-I410 PolarHBondContact O-N 3.49Å; M406-I410 HydrophobicContact SD-CD1 4.33Å; M406-I410 HydrophobicContact SD-CG1 4.28Å; Q407-I410 PolarHBondContact O-N 3.14Å; D408-I410 VanDerWaalsContact C-N 3.32Å; D408-I410 PolarHBondContact O-N 3.08Å; I410-D412 VanDerWaalsContact C-N 3.28Å; I410-D412 PolarHBondContact O-N 2.95Å; I410-A413 WeakPolarHBondContact O-CB 3.22Å; I410-A413 PolarHBondContact O-N 2.81Å; I410-L414 HydrophobicContact CG2-CD1 4.17Å; I410-L414 WeakPolarHBondContact O-CG 3.37Å; I410-L414 PolarHBondContact O-N 3.1Å; I410-V443 HydrophobicContact CB-CG1 4.1Å; I410-V443 HydrophobicContact CG2-CB 4.5Å; I410-V443 HydrophobicContact CG2-CG1 3.99Å; I410-V443 HydrophobicContact CG2-CG2 4.11Å; I410-C446 HydrophobicContact CD1-CB 3.86Å; I410-C446 HydrophobicContact CG2-CB 4.45Å; I410-F450 HydrophobicContact CD1-CB 4.43Å; I410-F450 HydrophobicContact CD1-CD2 4.15Å; I410-F450 HydrophobicContact CD1-CG 4.5Å; I410-W509 HydrophobicContact CG1-CH2 4.48Å; I410-W509 HydrophobicContact CG2-CH2 3.68Å; I410-W509 HydrophobicContact CG2-CZ2 4.48Å; I410-W509 HydrophobicContact CG2-CZ3 4.1Å
411	K	95.6	Very high	90.8	Very high	30 Å²	30	40.8 Å²	40.8	13%	0.13	20%	0.201	C	C	.	.	H	α-helix	trans	-58.9	-41.6	175.9	-77.1	171.8	179	175.8	0	111.5	Q407 D408 L414 R415 L423 D440 V443	Q407-K411 WeakPolarHBondContact O-CG 3.21Å; Q407-K411 PolarHBondContact O-N 3.3Å; D408-K411 PolarHBondContact O-N 3.32Å; K411-L414 PolarHBondContact O-N 3.19Å; K411-R415 WeakPolarHBondContact O-CG 3.07Å; K411-R415 PolarHBondContact O-N 2.93Å; K411-L423 HydrophobicContact CB-CD1 4.41Å; K411-D440 WeakPolarHBondContact CE-OD1 3.37Å; K411-D440 IonicContact NZ-OD1 2.7Å; K411-D440 PolarHBondContact NZ-OD1 2.8Å; K411-V443 HydrophobicContact CG-CG1 4.15Å; K411-V443 HydrophobicContact CG-CG2 3.94Å
412	D	94.5	Very high	91.1	Very high	69 Å²	69	40.1 Å²	40.1	37%	0.369	20%	0.199	S	C	.	.	H	α-helix	trans	-64.9	-45.3	175.4	-74.5	-17.1	0	0	0	111.4	D408 M409 I410 L414 R415 Y416	D408-D412 PolarHBondContact O-N 2.83Å; M409-D412 PolarHBondContact O-N 2.88Å; I410-D412 VanDerWaalsContact C-N 3.28Å; I410-D412 PolarHBondContact O-N 2.95Å; D412-L414 VanDerWaalsContact C-N 3.3Å; D412-L414 PolarHBondContact O-N 3.06Å; D412-R415 WeakPolarHBondContact O-CB 3.43Å; D412-R415 PolarHBondContact O-N 2.94Å; D412-R415 VanDerWaalsContact O-N 3.14Å; D412-R415 IonicContact OD1-CZ 3.99Å; D412-R415 IonicContact OD1-NH1 2.74Å; D412-R415 PolarHBondContact OD1-NH1 3.45Å; D412-Y416 HydrophobicContact CB-CD2 4.25Å; D412-Y416 HydrophobicContact CB-CE2 4.08Å; D412-Y416 WeakPolarHBondContact O-CD2 3.22Å; D412-Y416 PolarHBondContact O-N 2.84Å
413	A	94.9	Very high	91.7	Very high	4 Å²	4	40.2 Å²	40.2	3%	0.033	20%	0.196	C	C	.	.	H	α-helix	trans	-57.1	-42.3	174.8	0	0	0	0	0	112.4	L366 M409 I410 Y416 F417 W509	L366-A413 HydrophobicContact CB-CB 3.8Å; L366-A413 HydrophobicContact CD2-CB 4.06Å; M409-A413 WeakPolarHBondContact O-CB 3.28Å; M409-A413 PolarHBondContact O-N 3.27Å; I410-A413 WeakPolarHBondContact O-CB 3.22Å; I410-A413 PolarHBondContact O-N 2.81Å; A413-Y416 PolarHBondContact O-N 2.75Å; A413-F417 WeakPolarHBondContact O-CB 3.43Å; A413-F417 PolarHBondContact O-N 2.71Å; A413-W509 HydrophobicContact CB-CZ2 4.07Å
414	L	95.2	Very high	92	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-47.2	174.5	-75.8	169.4	0	0	0	111.9	I410 K411 D412 Y416 F417 V418 S419 P420 L423 I439 V443 L506 W509	I410-L414 HydrophobicContact CG2-CD1 4.17Å; I410-L414 WeakPolarHBondContact O-CG 3.37Å; I410-L414 PolarHBondContact O-N 3.1Å; K411-L414 PolarHBondContact O-N 3.19Å; D412-L414 VanDerWaalsContact C-N 3.3Å; D412-L414 PolarHBondContact O-N 3.06Å; L414-Y416 VanDerWaalsContact C-N 3.31Å; L414-Y416 PolarHBondContact O-N 3.39Å; L414-F417 PolarHBondContact O-N 2.66Å; L414-V418 HydrophobicContact CD2-CG2 3.96Å; L414-V418 WeakPolarHBondContact O-CG2 3.28Å; L414-V418 PolarHBondContact O-N 3.35Å; L414-S419 PolarHBondContact O-N 3.15Å; L414-P420 HydrophobicContact CB-CG 4.28Å; L414-P420 VanDerWaalsContact O-CD 3.32Å; L414-P420 WeakPolarHBondContact O-CD 3.32Å; L414-L423 HydrophobicContact CB-CD1 3.91Å; L414-L423 HydrophobicContact CD1-CD1 4.43Å; L414-I439 HydrophobicContact CD1-CD1 4.32Å; L414-V443 HydrophobicContact CD1-CG2 4.12Å; L414-L506 HydrophobicContact CD1-CD2 4.04Å; L414-L506 HydrophobicContact CD2-CD2 3.78Å; L414-W509 HydrophobicContact CD2-CB 3.87Å; L414-W509 HydrophobicContact CD2-CD2 3.41Å; L414-W509 VanDerWaalsContact CD2-CD2 3.41Å; L414-W509 HydrophobicContact CD2-CE3 3.53Å; L414-W509 HydrophobicContact CD2-CG 3.58Å; L414-W509 HydrophobicContact CD2-CZ3 4.23Å; L414-W509 HydrophobicContact CG-CD2 4.17Å; L414-W509 HydrophobicContact CG-CE3 4.22Å; L414-W509 HydrophobicContact CG-CZ3 4.47Å
415	R	92.3	Very high	92	Very high	90 Å²	90	38.7 Å²	38.7	34%	0.34	18%	0.179	S	C	.	.	H	α-helix	trans	-57.2	-45.5	176.3	-72.5	174.3	-174.4	117	4.6	111.5	K411 D412 S419 L423	K411-R415 WeakPolarHBondContact O-CG 3.07Å; K411-R415 PolarHBondContact O-N 2.93Å; D412-R415 WeakPolarHBondContact O-CB 3.43Å; D412-R415 PolarHBondContact O-N 2.94Å; D412-R415 VanDerWaalsContact O-N 3.14Å; D412-R415 IonicContact OD1-CZ 3.99Å; D412-R415 IonicContact OD1-NH1 2.74Å; D412-R415 PolarHBondContact OD1-NH1 3.45Å; R415-S419 WeakPolarHBondContact O-CA 3.31Å; R415-S419 PolarHBondContact O-N 2.96Å; R415-S419 PolarHBondContact O-OG 3.26Å; R415-L423 HydrophobicContact CG-CB 3.87Å; R415-L423 HydrophobicContact CG-CD1 3.91Å
416	Y	89.9	Confident	91.6	Very high	162 Å²	162	37.5 Å²	37.5	64%	0.635	17%	0.17	S	C	*	.	H	α-helix	trans	-79.1	-15.8	-176.1	-71.4	-60.6	0	0	0	114.9	D412 A413 L414 Q562	D412-Y416 HydrophobicContact CB-CD2 4.25Å; D412-Y416 HydrophobicContact CB-CE2 4.08Å; D412-Y416 WeakPolarHBondContact O-CD2 3.22Å; D412-Y416 PolarHBondContact O-N 2.84Å; A413-Y416 PolarHBondContact O-N 2.75Å; L414-Y416 VanDerWaalsContact C-N 3.31Å; L414-Y416 PolarHBondContact O-N 3.39Å; Y416-Q562 PolarHBondContact O-NE2 2.83Å
417	F	91.8	Very high	91.2	Very high	3 Å²	3	37.6 Å²	37.6	1%	0.013	17%	0.171	C	C	.	.	H	α-helix	trans	-108.3	-46.8	-176.8	-169.7	-90.6	0	0	0	112.7	H367 A413 L414 W509 Y512 L555 A558 Q562 L590	H367-F417 AromaticContact CE1-CD2 3.4Å; H367-F417 WeakPolarHBondContact CE1-CD2 3.27Å; H367-F417 AromaticContact CE1-CG 3.76Å; A413-F417 WeakPolarHBondContact O-CB 3.43Å; A413-F417 PolarHBondContact O-N 2.71Å; L414-F417 PolarHBondContact O-N 2.66Å; F417-W509 AromaticContact CD1-CD1 3.52Å; F417-W509 HydrophobicContact CD1-CG 4.44Å; F417-W509 AromaticContact CG-CD1 3.85Å; F417-Y512 HydrophobicContact CE1-CD1 4.46Å; F417-Y512 HydrophobicContact CE1-CG 4.11Å; F417-Y512 HydrophobicContact CE2-CD1 4.27Å; F417-Y512 HydrophobicContact CE2-CD2 4.23Å; F417-Y512 HydrophobicContact CE2-CE1 4.24Å; F417-Y512 HydrophobicContact CE2-CE2 4.19Å; F417-Y512 HydrophobicContact CE2-CG 4.25Å; F417-Y512 AromaticContact CZ-CD1 3.93Å; F417-Y512 HydrophobicContact CZ-CD1 3.93Å; F417-Y512 AromaticContact CZ-CD2 3.63Å; F417-Y512 HydrophobicContact CZ-CD2 3.63Å; F417-Y512 HydrophobicContact CZ-CE1 4.34Å; F417-Y512 HydrophobicContact CZ-CE2 4.05Å; F417-Y512 AromaticContact CZ-CG 3.55Å; F417-Y512 HydrophobicContact CZ-CG 3.55Å; F417-L555 HydrophobicContact CE2-CD2 4.3Å; F417-L555 HydrophobicContact CZ-CD2 4.03Å; F417-A558 HydrophobicContact CD1-CB 4.01Å; F417-A558 HydrophobicContact CE1-CB 3.62Å; F417-A558 HydrophobicContact CZ-CB 4.13Å; F417-Q562 WeakPolarHBondContact O-CG 3.13Å; F417-Q562 PolarHBondContact O-NE2 2.9Å; F417-L590 HydrophobicContact CD2-CD1 4.5Å; F417-L590 HydrophobicContact CD2-CD2 3.55Å; F417-L590 HydrophobicContact CE2-CD1 4.19Å; F417-L590 HydrophobicContact CE2-CD2 3.48Å; F417-L590 VanDerWaalsContact CE2-CD2 3.48Å; F417-L590 HydrophobicContact CE2-CG 4.5Å; F417-L590 HydrophobicContact CZ-CD1 4.39Å; F417-L590 HydrophobicContact CZ-CD2 4.42Å
418	V	91.8	Very high	90.9	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-9.1	-175.2	-83.9	0	0	0	0	114	L414 C505 T508 W509 A558	L414-V418 HydrophobicContact CD2-CG2 3.96Å; L414-V418 WeakPolarHBondContact O-CG2 3.28Å; L414-V418 PolarHBondContact O-N 3.35Å; V418-C505 HydrophobicContact CB-CB 4.12Å; V418-C505 HydrophobicContact CG2-CB 4.33Å; V418-T508 HydrophobicContact CG1-CG2 4.12Å; V418-W509 HydrophobicContact CG1-CB 4.44Å; V418-W509 HydrophobicContact CG2-CB 3.97Å; V418-W509 HydrophobicContact CG2-CG 4.42Å; V418-A558 HydrophobicContact CG1-CB 4.03Å
419	S	90.4	Very high	90.6	Very high	29 Å²	29	33.4 Å²	33.4	20%	0.203	15%	0.154	C	C	.	.			trans	47.8	56.1	176.3	-56.5	0	0	0	0	113.7	L414 R415	L414-S419 PolarHBondContact O-N 3.15Å; R415-S419 WeakPolarHBondContact O-CA 3.31Å; R415-S419 PolarHBondContact O-N 2.96Å; R415-S419 PolarHBondContact O-OG 3.26Å
420	P	91.3	Very high	90.4	Very high	1 Å²	1	36 Å²	36	1%	0.006	17%	0.165	C	C	.	.			trans	-65.3	137.2	-172.7	28.6	-34.5	0	0	0	111	L414 V422 L423 C505	L414-P420 HydrophobicContact CB-CG 4.28Å; L414-P420 VanDerWaalsContact O-CD 3.32Å; L414-P420 WeakPolarHBondContact O-CD 3.32Å; P420-V422 HydrophobicContact CB-CG1 4.34Å; P420-V422 PolarHBondContact O-N 3.3Å; P420-V422 VanDerWaalsContact O-N 3.12Å; P420-L423 HydrophobicContact CG-CB 4.12Å; P420-L423 HydrophobicContact CG-CD1 3.7Å; P420-L423 HydrophobicContact CG-CG 3.89Å; P420-L423 PolarHBondContact O-N 3.39Å; P420-C505 HydrophobicContact CB-CB 3.82Å
421	P	88.9	Confident	90	Very high	5 Å²	5	42 Å²	42	3%	0.032	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-53.2	-36.5	-177	-29.7	35	0	0	0	114.4	L423 S424 C427 L493 H502	P421-L423 PolarHBondContact O-N 3.48Å; P421-S424 WeakPolarHBondContact O-CB 3.39Å; P421-S424 PolarHBondContact O-N 2.93Å; P421-C427 HydrophobicContact CB-CB 4.46Å; P421-C427 WeakPolarHBondContact O-CB 3.31Å; P421-L493 HydrophobicContact CG-CD2 4.44Å; P421-H502 WeakPolarHBondContact CD-ND1 3.5Å
422	V	90.9	Very high	89.9	Confident	6 Å²	6	42.5 Å²	42.5	4%	0.036	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-60.3	-25.5	178.5	69.3	0	0	0	0	113.6	P420 L429 A435 I439 L489	P420-V422 HydrophobicContact CB-CG1 4.34Å; P420-V422 PolarHBondContact O-N 3.3Å; P420-V422 VanDerWaalsContact O-N 3.12Å; V422-L429 HydrophobicContact CB-CB 4.34Å; V422-L429 HydrophobicContact CB-CD1 4.47Å; V422-L429 HydrophobicContact CG2-CB 4.35Å; V422-A435 HydrophobicContact CG2-CB 3.86Å; V422-I439 HydrophobicContact CG1-CB 4.17Å; V422-I439 HydrophobicContact CG1-CD1 4.24Å; V422-I439 HydrophobicContact CG1-CG1 4.07Å; V422-I439 HydrophobicContact CG2-CB 4.32Å; V422-I439 HydrophobicContact CG2-CG2 4.05Å; V422-L489 HydrophobicContact CB-CD1 4.18Å; V422-L489 HydrophobicContact CB-CD2 4.22Å; V422-L489 HydrophobicContact CG1-CD1 3.9Å; V422-L489 HydrophobicContact CG2-CD2 4.02Å
423	L	91.6	Very high	89.9	Confident	17 Å²	17	45.8 Å²	45.8	9%	0.089	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-96.3	-1	177.2	-61.9	-177	0	0	0	113.3	K411 L414 R415 P420 P421 I439	K411-L423 HydrophobicContact CB-CD1 4.41Å; L414-L423 HydrophobicContact CB-CD1 3.91Å; L414-L423 HydrophobicContact CD1-CD1 4.43Å; R415-L423 HydrophobicContact CG-CB 3.87Å; R415-L423 HydrophobicContact CG-CD1 3.91Å; P420-L423 HydrophobicContact CG-CB 4.12Å; P420-L423 HydrophobicContact CG-CD1 3.7Å; P420-L423 HydrophobicContact CG-CG 3.89Å; P420-L423 PolarHBondContact O-N 3.39Å; P421-L423 PolarHBondContact O-N 3.48Å; L423-I439 HydrophobicContact CD2-CG1 3.99Å; L423-I439 HydrophobicContact CG-CG1 4.44Å
424	S	88.4	Confident	89.9	Confident	14 Å²	14	49.9 Å²	49.9	10%	0.098	23%	0.232	C	C	.	.			trans	-89.1	115.9	179.5	-178.6	0	0	0	0	110.5	P421 K426 C427 F430 E565	P421-S424 WeakPolarHBondContact O-CB 3.39Å; P421-S424 PolarHBondContact O-N 2.93Å; S424-K426 PolarHBondContact O-N 3.46Å; S424-C427 WeakPolarHBondContact O-CB 3.28Å; S424-C427 PolarHBondContact O-N 2.73Å; S424-F430 VanDerWaalsContact O-CB 3.26Å; S424-F430 WeakPolarHBondContact O-CB 3.43Å; S424-E565 VanDerWaalsContact CB-OE1 3.28Å; S424-E565 WeakPolarHBondContact CB-OE1 3.28Å; S424-E565 PolarHBondContact OG-OE1 3.41Å
425	Y	85.2	Confident	89.8	Confident	155 Å²	155	49.9 Å²	49.9	61%	0.608	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-13.2	-179.7	65.6	-89.4	0	0	0	114.7
426	K	81.8	Confident	89.9	Confident	55 Å²	55	49.4 Å²	49.4	24%	0.239	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-2	177.3	-57.7	-157.6	-173.8	173.1	0	114.2	S424 L569	S424-K426 PolarHBondContact O-N 3.46Å; K426-L569 HydrophobicContact CD-CD1 3.63Å; K426-L569 HydrophobicContact CG-CD1 4.4Å
427	C	84.9	Confident	90.2	Very high	5 Å²	5	45.5 Å²	45.5	3%	0.034	22%	0.223	C	C	.	.	S	Bend	trans	-91.3	141.1	174.8	-171.4	0	0	0	0	110.6	P421 S424 L429 F430 R500	P421-C427 HydrophobicContact CB-CB 4.46Å; P421-C427 WeakPolarHBondContact O-CB 3.31Å; S424-C427 WeakPolarHBondContact O-CB 3.28Å; S424-C427 PolarHBondContact O-N 2.73Å; C427-L429 PolarHBondContact O-N 2.96Å; C427-L429 VanDerWaalsContact O-N 3.15Å; C427-L429 PolarHBondContact SG-N 3.14Å; C427-F430 VanDerWaalsContact O-CB 3.31Å; C427-F430 WeakPolarHBondContact O-CB 3.42Å; C427-F430 PolarHBondContact O-N 3.33Å; C427-R500 VanDerWaalsContact CA-NH1 3.27Å
428	C	86.2	Confident	90.4	Very high	43 Å²	43	49.3 Å²	49.3	29%	0.291	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-53.2	-30.9	170.4	59.4	0	0	0	0	113.5	F430 N431 L496 E497	C428-F430 PolarHBondContact O-N 3.31Å; C428-N431 PolarHBondContact O-N 3.2Å; C428-L496 HydrophobicContact CB-CB 4.31Å; C428-L496 HydrophobicContact CB-CD1 4.4Å; C428-L496 WeakPolarHBondContact SG-CB 3.36Å; C428-E497 HydrophobicContact CB-CG 4.47Å; C428-E497 VanDerWaalsContact CB-OE1 3.28Å; C428-E497 WeakPolarHBondContact CB-OE1 3.39Å; C428-E497 PolarHBondContact N-OE1 2.99Å; C428-E497 VanDerWaalsContact SG-CD 3.52Å; C428-E497 PolarHBondContact SG-OE1 3.48Å
429	L	88.3	Confident	90.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-64.9	-26.6	178.1	-65.4	-174.7	0	0	0	113.1	V422 C427 N431 N432 A435 L492 L493 L496	V422-L429 HydrophobicContact CB-CB 4.34Å; V422-L429 HydrophobicContact CB-CD1 4.47Å; V422-L429 HydrophobicContact CG2-CB 4.35Å; C427-L429 PolarHBondContact O-N 2.96Å; C427-L429 VanDerWaalsContact O-N 3.15Å; C427-L429 PolarHBondContact SG-N 3.14Å; L429-N431 PolarHBondContact O-N 3.21Å; L429-N432 WeakPolarHBondContact O-CB 3.35Å; L429-N432 PolarHBondContact O-N 3.16Å; L429-N432 VanDerWaalsContact O-N 3.09Å; L429-A435 HydrophobicContact CB-CB 4.21Å; L429-A435 HydrophobicContact CD2-CB 4.16Å; L429-L492 HydrophobicContact CD2-CB 3.88Å; L429-L493 HydrophobicContact CD1-CB 4.08Å; L429-L493 HydrophobicContact CD1-CD1 3.97Å; L429-L493 HydrophobicContact CG-CD1 4Å; L429-L496 HydrophobicContact CD2-CD1 4.03Å
430	F	88.4	Confident	90.9	Very high	69 Å²	69	51 Å²	51	30%	0.303	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-62.7	-28.1	-177.5	-177.7	-95.1	0	0	0	113.3	S424 C427 C428 K436	S424-F430 VanDerWaalsContact O-CB 3.26Å; S424-F430 WeakPolarHBondContact O-CB 3.43Å; C427-F430 VanDerWaalsContact O-CB 3.31Å; C427-F430 WeakPolarHBondContact O-CB 3.42Å; C427-F430 PolarHBondContact O-N 3.33Å; C428-F430 PolarHBondContact O-N 3.31Å; F430-K436 WeakPolarHBondContact O-CE 3.15Å; F430-K436 PolarHBondContact O-NZ 3.03Å
431	N	88.6	Confident	91.2	Very high	124 Å²	124	53.6 Å²	53.6	66%	0.663	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-104.9	0.2	176.9	-70.4	-41.1	0	0	0	113.1	C428 L429	C428-N431 PolarHBondContact O-N 3.2Å; L429-N431 PolarHBondContact O-N 3.21Å
432	N	93.1	Very high	91.6	Very high	41 Å²	41	53.4 Å²	53.4	22%	0.219	26%	0.261	C	S	.	.			trans	-78.4	122.2	178.8	-177.2	-66.1	0	0	0	110.2	L429 Q434 A435 K436	L429-N432 WeakPolarHBondContact O-CB 3.35Å; L429-N432 PolarHBondContact O-N 3.16Å; L429-N432 VanDerWaalsContact O-N 3.09Å; N432-Q434 PolarHBondContact O-N 3.5Å; N432-Q434 WeakPolarHBondContact OD1-CB 3.47Å; N432-Q434 PolarHBondContact OD1-N 3.18Å; N432-A435 HydrophobicContact CB-CB 3.92Å; N432-A435 PolarHBondContact O-N 3.32Å; N432-A435 PolarHBondContact OD1-N 3.23Å; N432-K436 WeakPolarHBondContact O-CG 3.39Å; N432-K436 PolarHBondContact O-N 3.24Å
433	H	93.7	Very high	91.9	Very high	138 Å²	138	53.1 Å²	53.1	64%	0.639	26%	0.259	S	S	*	.	H	α-helix	trans	-61.5	-45.5	-176	-174.2	26.5	0	0	0	112.6	A435 K436 D437	H433-A435 PolarHBondContact O-N 2.89Å; H433-K436 WeakPolarHBondContact O-CB 3.19Å; H433-K436 PolarHBondContact O-N 3.41Å; H433-D437 IonicContact CE1-OD1 3.93Å; H433-D437 PolarHBondContact CE1-OD1 3.19Å; H433-D437 VanDerWaalsContact CE1-OD1 3.27Å; H433-D437 IonicContact CE1-OD2 2.76Å; H433-D437 PolarHBondContact CE1-OD2 2.87Å; H433-D437 IonicContact ND1-OD1 3.39Å; H433-D437 PolarHBondContact ND1-OD1 3Å; H433-D437 IonicContact ND1-OD2 2.91Å; H433-D437 IonicContact NE2-OD2 3.88Å; H433-D437 VanDerWaalsContact O-CG 3.24Å; H433-D437 PolarHBondContact O-N 2.96Å
434	Q	94.8	Very high	92.1	Very high	91 Å²	91	55.3 Å²	55.3	43%	0.425	27%	0.274	S	S	.	.	H	α-helix	trans	-63.1	-41.1	179.1	-175.2	-178.6	4.5	0	0	111.9	N432 K436 D437 Y438 L492	N432-Q434 PolarHBondContact O-N 3.5Å; N432-Q434 WeakPolarHBondContact OD1-CB 3.47Å; N432-Q434 PolarHBondContact OD1-N 3.18Å; Q434-K436 VanDerWaalsContact C-N 3.34Å; Q434-D437 PolarHBondContact O-N 3.41Å; Q434-Y438 HydrophobicContact CG-CD2 4.29Å; Q434-Y438 HydrophobicContact CG-CE2 3.63Å; Q434-Y438 PolarHBondContact NE2-OH 3.15Å; Q434-Y438 WeakPolarHBondContact O-CD2 3.39Å; Q434-Y438 PolarHBondContact O-N 3.16Å; Q434-Y438 VanDerWaalsContact O-N 3.1Å; Q434-L492 HydrophobicContact CG-CD1 4.25Å
435	A	93.6	Very high	92.5	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.7	-37.1	176.5	0	0	0	0	0	112.2	V422 L429 N432 H433 I439 L489 L492	V422-A435 HydrophobicContact CG2-CB 3.86Å; L429-A435 HydrophobicContact CB-CB 4.21Å; L429-A435 HydrophobicContact CD2-CB 4.16Å; N432-A435 HydrophobicContact CB-CB 3.92Å; N432-A435 PolarHBondContact O-N 3.32Å; N432-A435 PolarHBondContact OD1-N 3.23Å; H433-A435 PolarHBondContact O-N 2.89Å; A435-I439 WeakPolarHBondContact O-CG2 3.11Å; A435-I439 PolarHBondContact O-N 3.41Å; A435-L489 HydrophobicContact CB-CD2 3.78Å; A435-L492 HydrophobicContact CB-CD1 4.35Å
436	K	94.3	Very high	93.1	Very high	79 Å²	79	51.7 Å²	51.7	34%	0.343	26%	0.26	S	S	.	.	H	α-helix	trans	-62.7	-46.7	172.8	-74.1	-176.9	-176.2	-179.2	0	111.8	F430 N432 H433 Q434 Y438 I439 D440	F430-K436 WeakPolarHBondContact O-CE 3.15Å; F430-K436 PolarHBondContact O-NZ 3.03Å; N432-K436 WeakPolarHBondContact O-CG 3.39Å; N432-K436 PolarHBondContact O-N 3.24Å; H433-K436 WeakPolarHBondContact O-CB 3.19Å; H433-K436 PolarHBondContact O-N 3.41Å; Q434-K436 VanDerWaalsContact C-N 3.34Å; K436-Y438 VanDerWaalsContact C-N 3.29Å; K436-Y438 PolarHBondContact O-N 3.03Å; K436-I439 VanDerWaalsContact O-CG2 3.24Å; K436-I439 WeakPolarHBondContact O-CG2 3.48Å; K436-I439 PolarHBondContact O-N 3.37Å; K436-D440 VanDerWaalsContact O-CB 3.28Å; K436-D440 WeakPolarHBondContact O-CB 3.5Å; K436-D440 VanDerWaalsContact O-CG 3.26Å; K436-D440 PolarHBondContact O-N 3.19Å
437	D	96.3	Very high	93.6	Very high	81 Å²	81	50 Å²	50	43%	0.433	26%	0.255	S	S	.	.	H	α-helix	trans	-61.6	-40.1	-179.2	-63.3	-13.9	0	0	0	111.2	H433 Q434 S441	H433-D437 IonicContact CE1-OD1 3.93Å; H433-D437 PolarHBondContact CE1-OD1 3.19Å; H433-D437 VanDerWaalsContact CE1-OD1 3.27Å; H433-D437 IonicContact CE1-OD2 2.76Å; H433-D437 PolarHBondContact CE1-OD2 2.87Å; H433-D437 IonicContact ND1-OD1 3.39Å; H433-D437 PolarHBondContact ND1-OD1 3Å; H433-D437 IonicContact ND1-OD2 2.91Å; H433-D437 IonicContact NE2-OD2 3.88Å; H433-D437 VanDerWaalsContact O-CG 3.24Å; H433-D437 PolarHBondContact O-N 2.96Å; Q434-D437 PolarHBondContact O-N 3.41Å; D437-S441 VanDerWaalsContact O-CB 3.27Å; D437-S441 WeakPolarHBondContact O-CB 3.23Å; D437-S441 PolarHBondContact O-N 3.37Å
438	Y	96.3	Very high	94.1	Very high	83 Å²	83	57.5 Å²	57.5	33%	0.325	28%	0.283	S	S	.	.	H	α-helix	trans	-61.4	-49.6	174.8	-67.8	-31.3	0	0	0	113	Q434 K436 F442 A488 L489 L492	Q434-Y438 HydrophobicContact CG-CD2 4.29Å; Q434-Y438 HydrophobicContact CG-CE2 3.63Å; Q434-Y438 PolarHBondContact NE2-OH 3.15Å; Q434-Y438 WeakPolarHBondContact O-CD2 3.39Å; Q434-Y438 PolarHBondContact O-N 3.16Å; Q434-Y438 VanDerWaalsContact O-N 3.1Å; K436-Y438 VanDerWaalsContact C-N 3.29Å; K436-Y438 PolarHBondContact O-N 3.03Å; Y438-F442 WeakPolarHBondContact O-CB 3.46Å; Y438-F442 PolarHBondContact O-N 3.38Å; Y438-F442 VanDerWaalsContact O-N 3.09Å; Y438-A488 HydrophobicContact CD2-CB 4.18Å; Y438-A488 HydrophobicContact CE2-CB 3.86Å; Y438-L489 HydrophobicContact CD2-CD2 4.33Å; Y438-L492 HydrophobicContact CD2-CD1 4.27Å; Y438-L492 HydrophobicContact CE2-CD1 3.98Å
439	I	95.9	Very high	94.5	Very high	4 Å²	4	55.8 Å²	55.8	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-70.6	-35.9	-178.7	-169.3	61.5	0	0	0	112.1	L414 V422 L423 A435 K436 F442 V443 L506	L414-I439 HydrophobicContact CD1-CD1 4.32Å; V422-I439 HydrophobicContact CG1-CB 4.17Å; V422-I439 HydrophobicContact CG1-CD1 4.24Å; V422-I439 HydrophobicContact CG1-CG1 4.07Å; V422-I439 HydrophobicContact CG2-CB 4.32Å; V422-I439 HydrophobicContact CG2-CG2 4.05Å; L423-I439 HydrophobicContact CD2-CG1 3.99Å; L423-I439 HydrophobicContact CG-CG1 4.44Å; A435-I439 WeakPolarHBondContact O-CG2 3.11Å; A435-I439 PolarHBondContact O-N 3.41Å; K436-I439 VanDerWaalsContact O-CG2 3.24Å; K436-I439 WeakPolarHBondContact O-CG2 3.48Å; K436-I439 PolarHBondContact O-N 3.37Å; I439-F442 HydrophobicContact CD1-CD1 4.23Å; I439-F442 PolarHBondContact O-N 3.42Å; I439-V443 HydrophobicContact CD1-CG2 4.2Å; I439-V443 HydrophobicContact CG1-CG2 4.28Å; I439-V443 WeakPolarHBondContact O-CB 3.43Å; I439-V443 WeakPolarHBondContact O-CG2 3.26Å; I439-V443 PolarHBondContact O-N 3.47Å; I439-L506 HydrophobicContact CD1-CD1 4.08Å; I439-L506 HydrophobicContact CD1-CD2 3.91Å
440	D	96.1	Very high	94.9	Very high	61 Å²	61	55.8 Å²	55.8	33%	0.326	27%	0.271	S	S	.	.	H	α-helix	trans	-69.6	-39.9	179.7	-72.9	-15.3	0	0	0	111.6	K411 K436 T444	K411-D440 WeakPolarHBondContact CE-OD1 3.37Å; K411-D440 IonicContact NZ-OD1 2.7Å; K411-D440 PolarHBondContact NZ-OD1 2.8Å; K436-D440 VanDerWaalsContact O-CB 3.28Å; K436-D440 WeakPolarHBondContact O-CB 3.5Å; K436-D440 VanDerWaalsContact O-CG 3.26Å; K436-D440 PolarHBondContact O-N 3.19Å; D440-T444 WeakPolarHBondContact O-CB 3.2Å; D440-T444 PolarHBondContact O-N 2.99Å; D440-T444 PolarHBondContact O-OG1 3.37Å
441	S	97.6	Very high	95.1	Very high	55 Å²	55	53 Å²	53	39%	0.385	26%	0.26	S	S	.	.	H	α-helix	trans	-62.3	-49.7	172.6	-171.8	0	0	0	0	111.2	D437 V443 T444 H445	D437-S441 VanDerWaalsContact O-CB 3.27Å; D437-S441 WeakPolarHBondContact O-CB 3.23Å; D437-S441 PolarHBondContact O-N 3.37Å; S441-V443 PolarHBondContact O-N 3.35Å; S441-T444 WeakPolarHBondContact O-CB 3.4Å; S441-T444 PolarHBondContact O-N 2.94Å; S441-T444 VanDerWaalsContact O-N 3.14Å; S441-H445 PolarHBondContact O-N 3.08Å
442	F	98.1	Very high	95.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59	-47	-180	174.8	-108.6	0	0	0	112.5	Y438 I439 T444 H445 C446 E481 A482 V485 L506 I510	Y438-F442 WeakPolarHBondContact O-CB 3.46Å; Y438-F442 PolarHBondContact O-N 3.38Å; Y438-F442 VanDerWaalsContact O-N 3.09Å; I439-F442 HydrophobicContact CD1-CD1 4.23Å; I439-F442 PolarHBondContact O-N 3.42Å; F442-T444 VanDerWaalsContact C-N 3.28Å; F442-T444 PolarHBondContact O-N 3.09Å; F442-H445 PolarHBondContact O-N 3.35Å; F442-C446 VanDerWaalsContact CZ-SG 3.55Å; F442-C446 PolarHBondContact O-N 3.17Å; F442-C446 PolarHBondContact O-SG 3.21Å; F442-E481 HydrophobicContact CD2-CB 4.5Å; F442-E481 HydrophobicContact CD2-CG 4.02Å; F442-A482 HydrophobicContact CE2-CB 3.66Å; F442-A482 HydrophobicContact CZ-CB 3.72Å; F442-V485 HydrophobicContact CB-CG2 4.29Å; F442-L506 HydrophobicContact CD1-CD1 3.96Å; F442-L506 HydrophobicContact CD1-CD2 4.38Å; F442-L506 HydrophobicContact CE1-CB 4.15Å; F442-L506 HydrophobicContact CE1-CD1 4.1Å; F442-L506 HydrophobicContact CE1-CD2 4.07Å; F442-L506 HydrophobicContact CE1-CG 4.33Å; F442-L506 HydrophobicContact CG-CD1 4.44Å; F442-L506 HydrophobicContact CZ-CB 4.3Å; F442-I510 HydrophobicContact CZ-CD1 4.02Å; F442-I510 HydrophobicContact CZ-CG1 3.81Å
443	V	96.9	Very high	95.5	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65.4	-34.3	178.1	169.4	0	0	0	0	111.5	Q407 I410 K411 L414 I439 S441 C446 S447	Q407-V443 VanDerWaalsContact CA-CG1 3.43Å; Q407-V443 HydrophobicContact CB-CG1 3.57Å; Q407-V443 HydrophobicContact CG-CG1 3.97Å; Q407-V443 VanDerWaalsContact O-CG1 3.28Å; Q407-V443 WeakPolarHBondContact O-CG1 3.32Å; I410-V443 HydrophobicContact CB-CG1 4.1Å; I410-V443 HydrophobicContact CG2-CB 4.5Å; I410-V443 HydrophobicContact CG2-CG1 3.99Å; I410-V443 HydrophobicContact CG2-CG2 4.11Å; K411-V443 HydrophobicContact CG-CG1 4.15Å; K411-V443 HydrophobicContact CG-CG2 3.94Å; L414-V443 HydrophobicContact CD1-CG2 4.12Å; I439-V443 HydrophobicContact CD1-CG2 4.2Å; I439-V443 HydrophobicContact CG1-CG2 4.28Å; I439-V443 WeakPolarHBondContact O-CB 3.43Å; I439-V443 WeakPolarHBondContact O-CG2 3.26Å; I439-V443 PolarHBondContact O-N 3.47Å; S441-V443 PolarHBondContact O-N 3.35Å; V443-C446 PolarHBondContact O-N 2.98Å; V443-S447 PolarHBondContact O-N 2.62Å; V443-S447 PolarHBondContact O-OG 3.09Å
444	T	96	Very high	95.5	Very high	64 Å²	64	41 Å²	41	39%	0.393	20%	0.2	S	C	.	.	H	α-helix	trans	-62	-46	173.3	-63.1	0	0	0	0	110.9	Q407 D440 S441 F442 C446 S447	Q407-T444 PolarHBondContact NE2-OG1 2.78Å; D440-T444 WeakPolarHBondContact O-CB 3.2Å; D440-T444 PolarHBondContact O-N 2.99Å; D440-T444 PolarHBondContact O-OG1 3.37Å; S441-T444 WeakPolarHBondContact O-CB 3.4Å; S441-T444 PolarHBondContact O-N 2.94Å; S441-T444 VanDerWaalsContact O-N 3.14Å; F442-T444 VanDerWaalsContact C-N 3.28Å; F442-T444 PolarHBondContact O-N 3.09Å; T444-C446 PolarHBondContact O-N 2.87Å; T444-S447 WeakPolarHBondContact O-CB 3.38Å; T444-S447 PolarHBondContact O-N 3.36Å; T444-S447 PolarHBondContact O-OG 3.41Å
445	H	96.5	Very high	95.4	Very high	93 Å²	93	38.7 Å²	38.7	43%	0.431	19%	0.19	S	C	.	.	H	α-helix	trans	-65.8	-35.3	176.6	-64.6	166.3	0	0	0	112.9	S441 F442 S447 P449 L478 E481	S441-H445 PolarHBondContact O-N 3.08Å; F442-H445 PolarHBondContact O-N 3.35Å; H445-S447 PolarHBondContact O-N 3.43Å; H445-P449 WeakPolarHBondContact O-CD 3.35Å; H445-L478 HydrophobicContact CB-CD2 4.27Å; H445-E481 IonicContact CE1-OE1 3.01Å; H445-E481 IonicContact CG-OE1 3.33Å; H445-E481 IonicContact CG-OE2 3.27Å; H445-E481 VanDerWaalsContact ND1-CD 3.27Å; H445-E481 IonicContact ND1-OE1 2.69Å; H445-E481 PolarHBondContact ND1-OE1 3.43Å; H445-E481 IonicContact ND1-OE2 3.58Å; H445-E481 PolarHBondContact ND1-OE2 3.45Å
446	C	96.9	Very high	95.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.3	-28.7	174.2	-69.3	0	0	0	0	113.1	I410 F442 V443 T444 R448 P449 F450	I410-C446 HydrophobicContact CD1-CB 3.86Å; I410-C446 HydrophobicContact CG2-CB 4.45Å; F442-C446 VanDerWaalsContact CZ-SG 3.55Å; F442-C446 PolarHBondContact O-N 3.17Å; F442-C446 PolarHBondContact O-SG 3.21Å; V443-C446 PolarHBondContact O-N 2.98Å; T444-C446 PolarHBondContact O-N 2.87Å; C446-R448 PolarHBondContact O-N 3.4Å; C446-P449 VanDerWaalsContact O-CD 3.32Å; C446-P449 WeakPolarHBondContact O-CD 3.25Å; C446-F450 HydrophobicContact CB-CD2 3.98Å; C446-F450 HydrophobicContact CB-CE2 4.16Å; C446-F450 VanDerWaalsContact O-CD2 3.28Å; C446-F450 WeakPolarHBondContact O-CD2 3.12Å; C446-F450 PolarHBondContact O-N 3.25Å; C446-F450 VanDerWaalsContact O-N 3.12Å
447	S	94	Very high	95.4	Very high	18 Å²	18	35.7 Å²	35.7	13%	0.126	18%	0.177	C	C	.	.	H	α-helix	trans	-58.2	-43.4	-169.1	-65.5	0	0	0	0	113.4	Q407 V443 T444 H445 C451	Q407-S447 WeakPolarHBondContact CG-OG 3.42Å; V443-S447 PolarHBondContact O-N 2.62Å; V443-S447 PolarHBondContact O-OG 3.09Å; T444-S447 WeakPolarHBondContact O-CB 3.38Å; T444-S447 PolarHBondContact O-N 3.36Å; T444-S447 PolarHBondContact O-OG 3.41Å; H445-S447 PolarHBondContact O-N 3.43Å; S447-C451 WeakPolarHBondContact O-CB 3.45Å; S447-C451 PolarHBondContact O-N 3.22Å; S447-C451 VanDerWaalsContact O-N 3.09Å; S447-C451 PolarHBondContact O-SG 3.28Å
448	R	93.8	Very high	95.1	Very high	164 Å²	164	32 Å²	32	62%	0.619	16%	0.158	S	C	*	.	H	α-helix	trans	-70.7	-51	-178.9	-177.1	-172.1	104.9	150.1	6.1	112.3	C446 F450 C451 N452 E474	C446-R448 PolarHBondContact O-N 3.4Å; R448-F450 VanDerWaalsContact C-N 3.29Å; R448-F450 PolarHBondContact O-N 3.37Å; R448-C451 PolarHBondContact O-N 3.12Å; R448-C451 VanDerWaalsContact O-N 3.16Å; R448-N452 PolarHBondContact O-N 3.28Å; R448-N452 PolarHBondContact O-OD1 3.16Å; R448-E474 IonicContact CZ-OE2 3.52Å; R448-E474 IonicContact NE-OE2 3.36Å; R448-E474 PolarHBondContact NE-OE2 3.09Å; R448-E474 IonicContact NH2-OE1 2.8Å; R448-E474 IonicContact NH2-OE2 2.81Å; R448-E474 PolarHBondContact NH2-OE2 3.33Å
449	P	95.9	Very high	94.9	Very high	7 Å²	7	28.2 Å²	28.2	5%	0.045	14%	0.144	C	C	.	.	H	α-helix	trans	-56.9	-38.3	177	-30.2	39.2	0	0	0	113.7	H445 C446 N452 L453 E474 F475 L478	H445-P449 WeakPolarHBondContact O-CD 3.35Å; C446-P449 VanDerWaalsContact O-CD 3.32Å; C446-P449 WeakPolarHBondContact O-CD 3.25Å; P449-N452 PolarHBondContact O-N 3.34Å; P449-L453 WeakPolarHBondContact O-CB 3.43Å; P449-L453 PolarHBondContact O-N 3.23Å; P449-E474 HydrophobicContact CB-CB 4.41Å; P449-E474 HydrophobicContact CG-CB 4.26Å; P449-F475 HydrophobicContact CB-CD2 4.16Å; P449-F475 HydrophobicContact CB-CE2 3.74Å; P449-F475 HydrophobicContact CB-CZ 4.35Å; P449-L478 HydrophobicContact CB-CD1 3.8Å; P449-L478 HydrophobicContact CG-CD1 3.85Å; P449-L478 HydrophobicContact CG-CG 4.35Å
450	F	95.9	Very high	94.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-70.2	-38.6	175.6	-82.4	-79.5	0	0	0	113.3	L366 I410 C446 R448 N452 L453 I454 F475 W509 I510 H513	L366-F450 HydrophobicContact CD2-CD1 3.92Å; L366-F450 HydrophobicContact CD2-CE1 4.11Å; L366-F450 HydrophobicContact CD2-CG 4.41Å; I410-F450 HydrophobicContact CD1-CB 4.43Å; I410-F450 HydrophobicContact CD1-CD2 4.15Å; I410-F450 HydrophobicContact CD1-CG 4.5Å; C446-F450 HydrophobicContact CB-CD2 3.98Å; C446-F450 HydrophobicContact CB-CE2 4.16Å; C446-F450 VanDerWaalsContact O-CD2 3.28Å; C446-F450 WeakPolarHBondContact O-CD2 3.12Å; C446-F450 PolarHBondContact O-N 3.25Å; C446-F450 VanDerWaalsContact O-N 3.12Å; R448-F450 VanDerWaalsContact C-N 3.29Å; R448-F450 PolarHBondContact O-N 3.37Å; F450-N452 VanDerWaalsContact C-N 3.32Å; F450-N452 PolarHBondContact O-N 2.93Å; F450-L453 PolarHBondContact O-N 3.5Å; F450-I454 WeakPolarHBondContact O-CG1 3.22Å; F450-I454 PolarHBondContact O-N 3.02Å; F450-I454 VanDerWaalsContact O-N 3.09Å; F450-F475 HydrophobicContact CD1-CZ 4.32Å; F450-F475 HydrophobicContact CD2-CZ 4.44Å; F450-F475 HydrophobicContact CE1-CE1 4.14Å; F450-F475 HydrophobicContact CE1-CZ 4.13Å; F450-F475 HydrophobicContact CE2-CE1 4.11Å; F450-F475 HydrophobicContact CE2-CZ 4.25Å; F450-F475 HydrophobicContact CG-CZ 4.47Å; F450-F475 AromaticContact CZ-CE1 3.78Å; F450-F475 HydrophobicContact CZ-CE1 3.78Å; F450-F475 HydrophobicContact CZ-CZ 4.09Å; F450-W509 HydrophobicContact CD2-CH2 4.17Å; F450-W509 HydrophobicContact CE1-CH2 4.02Å; F450-W509 HydrophobicContact CE1-CZ2 4.29Å; F450-W509 AromaticContact CE2-CH2 3.32Å; F450-W509 HydrophobicContact CE2-CH2 3.32Å; F450-W509 HydrophobicContact CE2-CZ2 4.32Å; F450-W509 AromaticContact CE2-CZ3 3.53Å; F450-W509 HydrophobicContact CE2-CZ3 3.53Å; F450-W509 HydrophobicContact CZ-CE3 4.47Å; F450-W509 AromaticContact CZ-CH2 3.22Å; F450-W509 HydrophobicContact CZ-CH2 3.22Å; F450-W509 AromaticContact CZ-CZ2 3.81Å; F450-W509 HydrophobicContact CZ-CZ2 3.81Å; F450-W509 AromaticContact CZ-CZ3 3.63Å; F450-W509 HydrophobicContact CZ-CZ3 3.63Å; F450-I510 HydrophobicContact CE2-CD1 4.26Å; F450-H513 AromaticContact CE1-CD2 3.77Å; F450-H513 AromaticContact CE1-CE1 3.62Å; F450-H513 AromaticContact CE1-CG 3.91Å; F450-H513 AromaticContact CE1-ND1 3.84Å; F450-H513 AromaticContact CE1-NE2 3.57Å; F450-H513 AromaticContact CZ-CD2 3.47Å; F450-H513 VanDerWaalsContact CZ-CD2 3.47Å; F450-H513 WeakPolarHBondContact CZ-CD2 3.31Å; F450-H513 AromaticContact CZ-CG 3.92Å; F450-H513 AromaticContact CZ-NE2 3.59Å
451	C	93.8	Very high	94.6	Very high	9 Å²	9	27.7 Å²	27.7	6%	0.061	14%	0.139	C	C	.	.	H	α-helix	trans	-59.6	-44.5	170.3	-74.2	0	0	0	0	111.3	L394 S447 R448 I454 Q455	L394-C451 HydrophobicContact CD1-CB 4.27Å; S447-C451 WeakPolarHBondContact O-CB 3.45Å; S447-C451 PolarHBondContact O-N 3.22Å; S447-C451 VanDerWaalsContact O-N 3.09Å; S447-C451 PolarHBondContact O-SG 3.28Å; R448-C451 PolarHBondContact O-N 3.12Å; R448-C451 VanDerWaalsContact O-N 3.16Å; C451-I454 PolarHBondContact O-N 2.8Å; C451-Q455 WeakPolarHBondContact O-CB 3.4Å; C451-Q455 PolarHBondContact O-N 3.21Å
452	N	94.1	Very high	94.4	Very high	45 Å²	45	27.6 Å²	27.6	24%	0.241	14%	0.141	C	C	.	.	H	α-helix	trans	-62	-43.5	177.2	-70.7	-3.3	0	0	0	111.2	R448 P449 F450 I454 Q455 I456 I471 E474	R448-N452 PolarHBondContact O-N 3.28Å; R448-N452 PolarHBondContact O-OD1 3.16Å; P449-N452 PolarHBondContact O-N 3.34Å; F450-N452 VanDerWaalsContact C-N 3.32Å; F450-N452 PolarHBondContact O-N 2.93Å; N452-I454 VanDerWaalsContact C-N 3.33Å; N452-I454 PolarHBondContact O-N 3.18Å; N452-Q455 CarbonylContact O-C 3.55Å; N452-Q455 WeakPolarHBondContact O-CB 3.44Å; N452-Q455 PolarHBondContact O-N 3.36Å; N452-Q455 VanDerWaalsContact O-N 3.17Å; N452-I456 VanDerWaalsContact O-CG1 3.27Å; N452-I456 WeakPolarHBondContact O-CG1 3.41Å; N452-I456 PolarHBondContact O-N 3.07Å; N452-I471 HydrophobicContact CB-CD1 3.9Å; N452-E474 PolarHBondContact ND2-OE1 3.39Å
453	L	95.4	Very high	94.1	Very high	6 Å²	6	31.2 Å²	31.2	3%	0.031	16%	0.155	C	C	.	.	H	α-helix	trans	-60.1	-43.1	178	-177.6	60.9	0	0	0	111.9	L370 P449 F450 Q455 I456 H457 L468 I471 F475 I517	L370-L453 HydrophobicContact CD2-CD2 3.84Å; L370-L453 HydrophobicContact CD2-CG 3.98Å; P449-L453 WeakPolarHBondContact O-CB 3.43Å; P449-L453 PolarHBondContact O-N 3.23Å; F450-L453 PolarHBondContact O-N 3.5Å; L453-Q455 VanDerWaalsContact C-N 3.35Å; L453-I456 WeakPolarHBondContact O-CB 3.39Å; L453-I456 PolarHBondContact O-N 2.94Å; L453-H457 PolarHBondContact O-CD2 3.36Å; L453-H457 PolarHBondContact O-N 3.2Å; L453-L468 HydrophobicContact CD1-CD2 4.21Å; L453-I471 HydrophobicContact CB-CD1 3.79Å; L453-I471 HydrophobicContact CD1-CD1 4.31Å; L453-F475 HydrophobicContact CB-CE2 4.45Å; L453-F475 HydrophobicContact CB-CZ 4.47Å; L453-F475 HydrophobicContact CD2-CE2 4.47Å; L453-F475 HydrophobicContact CD2-CZ 3.9Å; L453-I517 HydrophobicContact CD1-CD1 4.1Å; L453-I517 HydrophobicContact CD1-CG1 3.99Å; L453-I517 HydrophobicContact CD2-CD1 4.24Å; L453-I517 HydrophobicContact CD2-CG1 4.5Å
454	I	93.6	Very high	94.1	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-65.2	-41.3	176	-66.3	168.7	0	0	0	110.8	L366 I369 L370 F373 F393 L394 M406 F450 C451 N452 I456 H457	L366-I454 HydrophobicContact CD1-CD1 4.06Å; I369-I454 HydrophobicContact CG2-CD1 4.05Å; L370-I454 HydrophobicContact CD2-CD1 4.45Å; L370-I454 HydrophobicContact CD2-CG1 3.64Å; F373-I454 HydrophobicContact CD1-CG2 3.82Å; F373-I454 WeakPolarHBondContact CD1-O 3.32Å; F373-I454 HydrophobicContact CD2-CG2 4.05Å; F373-I454 HydrophobicContact CE1-CG2 3.55Å; F373-I454 HydrophobicContact CE2-CG2 3.79Å; F373-I454 HydrophobicContact CG-CG2 4.05Å; F373-I454 HydrophobicContact CZ-CG2 3.52Å; F393-I454 HydrophobicContact CD1-CD1 4.37Å; F393-I454 HydrophobicContact CD1-CG2 3.77Å; F393-I454 HydrophobicContact CE1-CD1 3.46Å; F393-I454 VanDerWaalsContact CE1-CD1 3.46Å; F393-I454 HydrophobicContact CE1-CG2 3.96Å; F393-I454 HydrophobicContact CZ-CD1 4.05Å; L394-I454 HydrophobicContact CD1-CB 4.36Å; L394-I454 HydrophobicContact CD1-CG2 4.16Å; M406-I454 HydrophobicContact CE-CD1 4.08Å; F450-I454 WeakPolarHBondContact O-CG1 3.22Å; F450-I454 PolarHBondContact O-N 3.02Å; F450-I454 VanDerWaalsContact O-N 3.09Å; C451-I454 PolarHBondContact O-N 2.8Å; N452-I454 VanDerWaalsContact C-N 3.33Å; N452-I454 PolarHBondContact O-N 3.18Å; I454-I456 VanDerWaalsContact C-N 3.33Å; I454-I456 PolarHBondContact O-N 3.2Å; I454-H457 PolarHBondContact O-N 3.39Å
455	Q	92.5	Very high	94	Very high	43 Å²	43	30.2 Å²	30.2	20%	0.201	14%	0.144	C	C	.	.	H	α-helix	trans	-62	-40	175.6	-164.6	-177.3	9.7	0	0	111.9	A185 Q390 C451 N452 L453 H457 G458 H459	A185-Q455 PolarHBondContact O-NE2 3.23Å; Q390-Q455 VanDerWaalsContact OE1-CG 3.23Å; Q390-Q455 PolarHBondContact OE1-O 3.4Å; C451-Q455 WeakPolarHBondContact O-CB 3.4Å; C451-Q455 PolarHBondContact O-N 3.21Å; N452-Q455 CarbonylContact O-C 3.55Å; N452-Q455 WeakPolarHBondContact O-CB 3.44Å; N452-Q455 PolarHBondContact O-N 3.36Å; N452-Q455 VanDerWaalsContact O-N 3.17Å; L453-Q455 VanDerWaalsContact C-N 3.35Å; Q455-H457 VanDerWaalsContact C-N 3.28Å; Q455-H457 PolarHBondContact O-N 3.48Å; Q455-G458 WeakPolarHBondContact O-CA 3.26Å; Q455-G458 PolarHBondContact O-N 3.19Å; Q455-H459 PolarHBondContact O-CD2 2.97Å
456	I	94.3	Very high	93.9	Very high	10 Å²	10	29.1 Å²	29.1	5%	0.051	14%	0.141	C	C	.	.	H	α-helix	trans	-50.1	-50.9	176.5	-74.7	172.3	0	0	0	110.1	N452 L453 I454 G458 H459 Q464 K467 L468 I471	N452-I456 VanDerWaalsContact O-CG1 3.27Å; N452-I456 WeakPolarHBondContact O-CG1 3.41Å; N452-I456 PolarHBondContact O-N 3.07Å; L453-I456 WeakPolarHBondContact O-CB 3.39Å; L453-I456 PolarHBondContact O-N 2.94Å; I454-I456 VanDerWaalsContact C-N 3.33Å; I454-I456 PolarHBondContact O-N 3.2Å; I456-G458 PolarHBondContact O-N 3.38Å; I456-H459 WeakPolarHBondContact O-CB 3.28Å; I456-H459 PolarHBondContact O-CD2 3.48Å; I456-H459 PolarHBondContact O-N 3.42Å; I456-Q464 HydrophobicContact CG2-CB 4.38Å; I456-Q464 HydrophobicContact CG2-CG 4.1Å; I456-Q464 WeakPolarHBondContact O-CG 3.46Å; I456-K467 HydrophobicContact CD1-CB 3.73Å; I456-K467 HydrophobicContact CG1-CB 3.67Å; I456-K467 HydrophobicContact CG1-CD 3.98Å; I456-K467 HydrophobicContact CG1-CG 4.47Å; I456-K467 HydrophobicContact CG2-CB 4.21Å; I456-L468 HydrophobicContact CG2-CD2 4.06Å; I456-L468 HydrophobicContact CG2-CG 4Å; I456-I471 HydrophobicContact CD1-CB 3.8Å; I456-I471 HydrophobicContact CD1-CD1 3.5Å; I456-I471 HydrophobicContact CD1-CG1 4.22Å; I456-I471 HydrophobicContact CD1-CG2 3.85Å
457	H	93.1	Very high	93.9	Very high	5 Å²	5	32.2 Å²	32.2	2%	0.023	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-12.3	-179.8	-61.6	-47.2	0	0	0	114.7	F373 S377 L453 I454 Q455 Q464 Q520	F373-H457 HydrophobicContact CB-CB 3.85Å; F373-H457 HydrophobicContact CD1-CB 4.3Å; S377-H457 WeakPolarHBondContact CB-O 3.35Å; S377-H457 PolarHBondContact OG-O 3.45Å; L453-H457 PolarHBondContact O-CD2 3.36Å; L453-H457 PolarHBondContact O-N 3.2Å; I454-H457 PolarHBondContact O-N 3.39Å; Q455-H457 VanDerWaalsContact C-N 3.28Å; Q455-H457 PolarHBondContact O-N 3.48Å; H457-Q464 PolarHBondContact O-NE2 3.44Å; H457-Q520 PolarHBondContact CE1-NE2 3.22Å; H457-Q520 PolarHBondContact CE1-OE1 3.43Å; H457-Q520 PolarHBondContact ND1-NE2 3.05Å
458	G	91.4	Very high	94	Very high	4 Å²	4	31.4 Å²	31.4	4%	0.041	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-11.1	172.3	0	0	0	0	0	115.3	R386 Q390 Q455 I456	R386-G458 WeakPolarHBondContact CD-O 3.41Å; R386-G458 PolarHBondContact NH1-O 3.31Å; Q390-G458 VanDerWaalsContact NE2-CA 3.33Å; Q390-G458 PolarHBondContact NE2-O 2.99Å; Q455-G458 WeakPolarHBondContact O-CA 3.26Å; Q455-G458 PolarHBondContact O-N 3.19Å; I456-G458 PolarHBondContact O-N 3.38Å
459	H	91.9	Very high	94.1	Very high	4 Å²	4	24 Å²	24	2%	0.019	12%	0.124	C	C	.	.	S	Bend	trans	-80.4	173.1	174.5	-65.6	-84.5	0	0	0	112.2	A186 F188 R386 Q455 I456 R463 Q464 K467	A186-H459 PolarHBondContact O-CE1 3.09Å; F188-H459 AromaticContact CD2-ND1 3.47Å; F188-H459 WeakPolarHBondContact CD2-ND1 3.35Å; F188-H459 AromaticContact CE2-CE1 3.62Å; F188-H459 AromaticContact CE2-ND1 3.34Å; F188-H459 VanDerWaalsContact CE2-ND1 3.34Å; F188-H459 WeakPolarHBondContact CE2-ND1 3.34Å; R386-H459 VanDerWaalsContact NH1-C 3.29Å; Q455-H459 PolarHBondContact O-CD2 2.97Å; I456-H459 WeakPolarHBondContact O-CB 3.28Å; I456-H459 PolarHBondContact O-CD2 3.48Å; I456-H459 PolarHBondContact O-N 3.42Å; H459-R463 HydrophobicContact CB-CB 3.98Å; H459-Q464 HydrophobicContact CB-CG 4.42Å; H459-Q464 PolarHBondContact O-NE2 3.3Å; H459-K467 WeakPolarHBondContact NE2-CE 3.3Å
460	N	92	Very high	94.1	Very high	25 Å²	25	29 Å²	29	13%	0.134	15%	0.146	C	C	.	.			trans	-64.8	163.5	169.4	72.3	56.7	0	0	0	111.5	E191 D192 A462 R463 Q464	E191-N460 PolarHBondContact OE1-ND2 3.14Å; D192-N460 WeakPolarHBondContact OD1-CB 3.08Å; D192-N460 PolarHBondContact OD1-ND2 2.99Å; N460-A462 VanDerWaalsContact C-N 3.33Å; N460-A462 PolarHBondContact O-N 3.19Å; N460-A462 PolarHBondContact OD1-N 3.24Å; N460-A462 VanDerWaalsContact OD1-N 3.1Å; N460-R463 WeakPolarHBondContact ND2-CG 3.27Å; N460-R463 PolarHBondContact O-N 3.36Å; N460-R463 WeakPolarHBondContact OD1-CG 3.28Å; N460-R463 PolarHBondContact OD1-N 2.74Å; N460-Q464 WeakPolarHBondContact O-CG 3.45Å; N460-Q464 PolarHBondContact O-N 2.8Å
461	R	92.8	Very high	94.2	Very high	29 Å²	29	29.1 Å²	29.1	11%	0.109	15%	0.147	C	C	.	.	H	α-helix	trans	-62.9	-35.9	-172.9	-60.3	-58.5	-66.6	176	-4.2	113.3	S377 Q464 R465 E527 L528	S377-R461 PolarHBondContact OG-NH1 3Å; S377-R461 VanDerWaalsContact OG-NH1 3.15Å; R461-Q464 WeakPolarHBondContact O-CB 3.13Å; R461-Q464 PolarHBondContact O-N 3.06Å; R461-R465 PolarHBondContact O-N 3.27Å; R461-E527 IonicContact CZ-OE1 2.62Å; R461-E527 IonicContact CZ-OE2 3.27Å; R461-E527 IonicContact NE-OE1 2.75Å; R461-E527 PolarHBondContact NE-OE1 3.37Å; R461-E527 IonicContact NE-OE2 2.84Å; R461-E527 PolarHBondContact NE-OE2 3.21Å; R461-E527 IonicContact NH2-OE1 2.71Å; R461-E527 IonicContact NH2-OE2 2.81Å; R461-E527 PolarHBondContact NH2-OE2 3.44Å; R461-L528 HydrophobicContact CB-CD2 4.03Å
462	A	92.8	Very high	94.3	Very high	52 Å²	52	28.7 Å²	28.7	43%	0.43	14%	0.144	S	C	.	.	H	α-helix	trans	-66.4	-47.4	178	0	0	0	0	0	111.3	N460 Q464 R465 D466	N460-A462 VanDerWaalsContact C-N 3.33Å; N460-A462 PolarHBondContact O-N 3.19Å; N460-A462 PolarHBondContact OD1-N 3.24Å; N460-A462 VanDerWaalsContact OD1-N 3.1Å; A462-Q464 VanDerWaalsContact C-N 3.31Å; A462-Q464 PolarHBondContact O-N 3.13Å; A462-R465 PolarHBondContact O-N 3.28Å; A462-D466 PolarHBondContact O-N 3.25Å
463	R	93.3	Very high	94.4	Very high	77 Å²	77	32.1 Å²	32.1	29%	0.291	16%	0.158	S	C	.	.	H	α-helix	trans	-67.4	-30.3	176.7	-69.9	-63.3	-175.2	-179.8	2.7	113.6	F188 E191 H459 N460 D466 K467	F188-R463 HydrophobicContact CD2-CB 4.25Å; F188-R463 HydrophobicContact CD2-CG 3.74Å; F188-R463 HydrophobicContact CE2-CB 3.92Å; F188-R463 HydrophobicContact CE2-CG 3.74Å; E191-R463 WeakPolarHBondContact OE1-CG 3.2Å; E191-R463 IonicContact OE1-NE 2.77Å; E191-R463 PolarHBondContact OE1-NE 3.49Å; E191-R463 IonicContact OE2-CZ 3.57Å; E191-R463 IonicContact OE2-NE 3.22Å; E191-R463 PolarHBondContact OE2-NE 3.01Å; E191-R463 IonicContact OE2-NH2 3.52Å; E191-R463 PolarHBondContact OE2-NH2 3.09Å; H459-R463 HydrophobicContact CB-CB 3.98Å; N460-R463 WeakPolarHBondContact ND2-CG 3.27Å; N460-R463 PolarHBondContact O-N 3.36Å; N460-R463 WeakPolarHBondContact OD1-CG 3.28Å; N460-R463 PolarHBondContact OD1-N 2.74Å; R463-D466 IonicContact NH1-OD2 3.38Å; R463-K467 WeakPolarHBondContact O-CB 3.41Å; R463-K467 WeakPolarHBondContact O-CG 3.38Å; R463-K467 PolarHBondContact O-N 2.81Å
464	Q	94.9	Very high	94.5	Very high	3 Å²	3	34.3 Å²	34.3	1%	0.014	17%	0.168	C	C	.	.	H	α-helix	trans	-58.3	-52.4	170.2	-83.1	-179.8	49.1	0	0	111.3	S377 I456 H457 H459 N460 R461 A462 D466 K467 L468	S377-Q464 PolarHBondContact OG-NE2 2.96Å; I456-Q464 HydrophobicContact CG2-CB 4.38Å; I456-Q464 HydrophobicContact CG2-CG 4.1Å; I456-Q464 WeakPolarHBondContact O-CG 3.46Å; H457-Q464 PolarHBondContact O-NE2 3.44Å; H459-Q464 HydrophobicContact CB-CG 4.42Å; H459-Q464 PolarHBondContact O-NE2 3.3Å; N460-Q464 WeakPolarHBondContact O-CG 3.45Å; N460-Q464 PolarHBondContact O-N 2.8Å; R461-Q464 WeakPolarHBondContact O-CB 3.13Å; R461-Q464 PolarHBondContact O-N 3.06Å; A462-Q464 VanDerWaalsContact C-N 3.31Å; A462-Q464 PolarHBondContact O-N 3.13Å; Q464-D466 VanDerWaalsContact C-N 3.3Å; Q464-D466 PolarHBondContact O-N 3.19Å; Q464-K467 PolarHBondContact O-N 3.09Å; Q464-L468 WeakPolarHBondContact O-CB 3.45Å; Q464-L468 WeakPolarHBondContact O-CG 3.42Å; Q464-L468 PolarHBondContact O-N 2.97Å
465	R	95.4	Very high	94.7	Very high	40 Å²	40	34.2 Å²	34.2	15%	0.151	17%	0.168	C	C	.	.	H	α-helix	trans	-56.7	-46	179.6	180	175	-178.9	-78.5	-1.5	112.2	R461 A462 L468 G469 Y521 S524 L528 L530	R461-R465 PolarHBondContact O-N 3.27Å; A462-R465 PolarHBondContact O-N 3.28Å; R465-L468 PolarHBondContact O-N 3.12Å; R465-G469 PolarHBondContact O-N 3.37Å; R465-Y521 HydrophobicContact CG-CD2 4.1Å; R465-Y521 HydrophobicContact CG-CE2 3.92Å; R465-Y521 PolarHBondContact NH2-OH 2.98Å; R465-Y521 WeakPolarHBondContact O-CD2 3.46Å; R465-Y521 WeakPolarHBondContact O-CE2 3.4Å; R465-S524 WeakPolarHBondContact CB-OG 3.2Å; R465-S524 VanDerWaalsContact CD-OG 3.29Å; R465-S524 WeakPolarHBondContact CD-OG 3.5Å; R465-S524 WeakPolarHBondContact CG-OG 3.28Å; R465-L528 HydrophobicContact CB-CD1 3.86Å; R465-L528 HydrophobicContact CG-CD1 4.46Å; R465-L530 VanDerWaalsContact CZ-CD1 3.43Å
466	D	94	Very high	94.8	Very high	70 Å²	70	33 Å²	33	37%	0.374	17%	0.165	S	C	.	.	H	α-helix	trans	-57.9	-54.1	178.4	-171	34	0	0	0	111.5	A462 R463 Q464 L468 G469 H470	A462-D466 PolarHBondContact O-N 3.25Å; R463-D466 IonicContact NH1-OD2 3.38Å; Q464-D466 VanDerWaalsContact C-N 3.3Å; Q464-D466 PolarHBondContact O-N 3.19Å; D466-L468 PolarHBondContact O-N 2.82Å; D466-G469 PolarHBondContact O-N 3.4Å; D466-G469 VanDerWaalsContact O-N 3.14Å; D466-H470 PolarHBondContact O-CD2 2.82Å; D466-H470 PolarHBondContact O-N 2.58Å; D466-H470 IonicContact OD1-NE2 2.73Å
467	K	95.9	Very high	95	Very high	65 Å²	65	36.9 Å²	36.9	28%	0.283	19%	0.189	S	C	.	.	H	α-helix	trans	-67.8	-31	-179.6	-68.3	178.6	175.7	-74.7	0	114.1	I456 H459 R463 Q464 G469 H470 I471	I456-K467 HydrophobicContact CD1-CB 3.73Å; I456-K467 HydrophobicContact CG1-CB 3.67Å; I456-K467 HydrophobicContact CG1-CD 3.98Å; I456-K467 HydrophobicContact CG1-CG 4.47Å; I456-K467 HydrophobicContact CG2-CB 4.21Å; H459-K467 WeakPolarHBondContact NE2-CE 3.3Å; R463-K467 WeakPolarHBondContact O-CB 3.41Å; R463-K467 WeakPolarHBondContact O-CG 3.38Å; R463-K467 PolarHBondContact O-N 2.81Å; Q464-K467 PolarHBondContact O-N 3.09Å; K467-G469 PolarHBondContact O-N 2.86Å; K467-H470 PolarHBondContact O-N 3.2Å; K467-I471 PolarHBondContact O-N 3.43Å
468	L	97	Very high	95.2	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-62.1	-33.8	174	-74.8	169	0	0	0	111.3	L453 I456 Q464 R465 D466 I471 L472 I517 Q520 Y521	L453-L468 HydrophobicContact CD1-CD2 4.21Å; I456-L468 HydrophobicContact CG2-CD2 4.06Å; I456-L468 HydrophobicContact CG2-CG 4Å; Q464-L468 WeakPolarHBondContact O-CB 3.45Å; Q464-L468 WeakPolarHBondContact O-CG 3.42Å; Q464-L468 PolarHBondContact O-N 2.97Å; R465-L468 PolarHBondContact O-N 3.12Å; D466-L468 PolarHBondContact O-N 2.82Å; L468-I471 WeakPolarHBondContact O-CG2 3.38Å; L468-L472 WeakPolarHBondContact O-CG 3.2Å; L468-I517 HydrophobicContact CB-CG2 4.37Å; L468-I517 HydrophobicContact CD2-CG2 3.97Å; L468-Q520 HydrophobicContact CD1-CB 4.24Å; L468-Q520 HydrophobicContact CD1-CG 3.72Å; L468-Y521 HydrophobicContact CB-CD2 4.31Å
469	G	95.3	Very high	95.5	Very high	9 Å²	9	37.2 Å²	37.2	9%	0.093	19%	0.19	C	C	.	.	H	α-helix	trans	-64.8	-44.7	173.1	0	0	0	0	0	112.1	R465 D466 K467	R465-G469 PolarHBondContact O-N 3.37Å; D466-G469 PolarHBondContact O-N 3.4Å; D466-G469 VanDerWaalsContact O-N 3.14Å; K467-G469 PolarHBondContact O-N 2.86Å
470	H	96.1	Very high	95.6	Very high	110 Å²	110	40.8 Å²	40.8	51%	0.509	21%	0.209	S	C	.	.	H	α-helix	trans	-71.6	-39.4	-178.8	-69.7	-60.2	0	0	0	114	D466 K467 L472 E473	D466-H470 PolarHBondContact O-CD2 2.82Å; D466-H470 PolarHBondContact O-N 2.58Å; D466-H470 IonicContact OD1-NE2 2.73Å; K467-H470 PolarHBondContact O-N 3.2Å; H470-L472 PolarHBondContact O-N 2.95Å; H470-L472 VanDerWaalsContact O-N 3.16Å; H470-E473 WeakPolarHBondContact O-CB 3.31Å; H470-E473 PolarHBondContact O-N 3.21Å; H470-E473 VanDerWaalsContact O-N 3.1Å
471	I	97.4	Very high	95.9	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-66.5	-19	-176.7	-160.2	167.9	0	0	0	112.8	N452 L453 I456 K467 L468 E473 E474 F475 I517	N452-I471 HydrophobicContact CB-CD1 3.9Å; L453-I471 HydrophobicContact CB-CD1 3.79Å; L453-I471 HydrophobicContact CD1-CD1 4.31Å; I456-I471 HydrophobicContact CD1-CB 3.8Å; I456-I471 HydrophobicContact CD1-CD1 3.5Å; I456-I471 HydrophobicContact CD1-CG1 4.22Å; I456-I471 HydrophobicContact CD1-CG2 3.85Å; K467-I471 PolarHBondContact O-N 3.43Å; L468-I471 WeakPolarHBondContact O-CG2 3.38Å; I471-E473 PolarHBondContact O-N 3.34Å; I471-E474 PolarHBondContact O-N 3.49Å; I471-E474 VanDerWaalsContact O-N 3.14Å; I471-F475 HydrophobicContact CD1-CD2 4.4Å; I471-F475 HydrophobicContact CD1-CE2 3.93Å; I471-F475 HydrophobicContact CG1-CD2 3.88Å; I471-F475 HydrophobicContact CG1-CE2 3.92Å; I471-F475 PolarHBondContact O-N 3.38Å; I471-I517 HydrophobicContact CG2-CD1 4.34Å; I471-I517 HydrophobicContact CG2-CG2 4.06Å
472	L	96.9	Very high	96.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60	-29.9	173	-73.9	170.2	0	0	0	112.5	L468 H470 F475 A476 I517 M518 P640 F641 V644	L468-L472 WeakPolarHBondContact O-CG 3.2Å; H470-L472 PolarHBondContact O-N 2.95Å; H470-L472 VanDerWaalsContact O-N 3.16Å; L472-F475 PolarHBondContact O-N 2.73Å; L472-A476 VanDerWaalsContact O-CB 3.22Å; L472-A476 WeakPolarHBondContact O-CB 3.41Å; L472-A476 PolarHBondContact O-N 2.9Å; L472-I517 HydrophobicContact CD1-CG2 4.38Å; L472-I517 HydrophobicContact CD2-CB 3.92Å; L472-I517 HydrophobicContact CD2-CG2 3.51Å; L472-I517 HydrophobicContact CG-CG2 3.72Å; L472-M518 HydrophobicContact CD1-CG 4.2Å; L472-M518 HydrophobicContact CD2-CG 3.86Å; L472-P640 HydrophobicContact CD1-CB 4.44Å; L472-F641 HydrophobicContact CD1-CD1 3.71Å; L472-F641 HydrophobicContact CD1-CE1 3.91Å; L472-V644 HydrophobicContact CB-CG2 4.17Å; L472-V644 HydrophobicContact CD2-CG2 4.12Å
473	E	96	Very high	96.2	Very high	116 Å²	116	41.6 Å²	41.6	54%	0.542	21%	0.205	S	C	.	.	H	α-helix	trans	-65.4	-41.9	174.6	-64.3	174.5	-159.1	0	0	111.6	H470 I471 T477	H470-E473 WeakPolarHBondContact O-CB 3.31Å; H470-E473 PolarHBondContact O-N 3.21Å; H470-E473 VanDerWaalsContact O-N 3.1Å; I471-E473 PolarHBondContact O-N 3.34Å; E473-T477 PolarHBondContact O-N 3.37Å; E473-T477 PolarHBondContact O-OG1 3.01Å; E473-T477 VanDerWaalsContact O-OG1 3.07Å
474	E	96.8	Very high	96.3	Very high	52 Å²	52	44 Å²	44	24%	0.243	22%	0.218	C	C	.	.	H	α-helix	trans	-66.1	-43.2	175.6	-65.5	-169.8	-104.9	0	0	110.7	R448 P449 N452 I471 T477 L478	R448-E474 IonicContact CZ-OE2 3.52Å; R448-E474 IonicContact NE-OE2 3.36Å; R448-E474 PolarHBondContact NE-OE2 3.09Å; R448-E474 IonicContact NH2-OE1 2.8Å; R448-E474 IonicContact NH2-OE2 2.81Å; R448-E474 PolarHBondContact NH2-OE2 3.33Å; P449-E474 HydrophobicContact CB-CB 4.41Å; P449-E474 HydrophobicContact CG-CB 4.26Å; N452-E474 PolarHBondContact ND2-OE1 3.39Å; I471-E474 PolarHBondContact O-N 3.49Å; I471-E474 VanDerWaalsContact O-N 3.14Å; E474-T477 WeakPolarHBondContact O-CB 3.41Å; E474-T477 PolarHBondContact O-N 3.22Å; E474-L478 PolarHBondContact O-N 3.41Å; E474-L478 VanDerWaalsContact O-N 3.09Å
475	F	97.9	Very high	96.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-73.8	-26.3	179	-85.7	-106.5	0	0	0	113.9	P449 F450 L453 I471 L472 T477 L478 Q479 I510 H513 N514 I517	P449-F475 HydrophobicContact CB-CD2 4.16Å; P449-F475 HydrophobicContact CB-CE2 3.74Å; P449-F475 HydrophobicContact CB-CZ 4.35Å; F450-F475 HydrophobicContact CD1-CZ 4.32Å; F450-F475 HydrophobicContact CD2-CZ 4.44Å; F450-F475 HydrophobicContact CE1-CE1 4.14Å; F450-F475 HydrophobicContact CE1-CZ 4.13Å; F450-F475 HydrophobicContact CE2-CE1 4.11Å; F450-F475 HydrophobicContact CE2-CZ 4.25Å; F450-F475 HydrophobicContact CG-CZ 4.47Å; F450-F475 AromaticContact CZ-CE1 3.78Å; F450-F475 HydrophobicContact CZ-CE1 3.78Å; F450-F475 HydrophobicContact CZ-CZ 4.09Å; L453-F475 HydrophobicContact CB-CE2 4.45Å; L453-F475 HydrophobicContact CB-CZ 4.47Å; L453-F475 HydrophobicContact CD2-CE2 4.47Å; L453-F475 HydrophobicContact CD2-CZ 3.9Å; I471-F475 HydrophobicContact CD1-CD2 4.4Å; I471-F475 HydrophobicContact CD1-CE2 3.93Å; I471-F475 HydrophobicContact CG1-CD2 3.88Å; I471-F475 HydrophobicContact CG1-CE2 3.92Å; I471-F475 PolarHBondContact O-N 3.38Å; L472-F475 PolarHBondContact O-N 2.73Å; F475-T477 VanDerWaalsContact C-N 3.34Å; F475-L478 PolarHBondContact O-N 2.91Å; F475-Q479 PolarHBondContact O-N 3.44Å; F475-I510 HydrophobicContact CD1-CG2 4.44Å; F475-H513 HydrophobicContact CD1-CB 4.04Å; F475-H513 HydrophobicContact CE1-CB 3.65Å; F475-N514 WeakPolarHBondContact CB-OD1 3.48Å; F475-N514 PolarHBondContact O-ND2 3.38Å; F475-I517 HydrophobicContact CD1-CD1 4.06Å; F475-I517 HydrophobicContact CD2-CD1 3.98Å; F475-I517 HydrophobicContact CE1-CD1 4.15Å; F475-I517 HydrophobicContact CE2-CD1 4.06Å; F475-I517 HydrophobicContact CG-CD1 3.98Å; F475-I517 HydrophobicContact CZ-CD1 4.15Å
476	A	96.3	Very high	96.4	Very high	16 Å²	16	43 Å²	43	13%	0.132	22%	0.216	C	C	.	.	H	α-helix	trans	-65.7	-40.1	170.6	0	0	0	0	0	111.1	L472 Q479 D480 S643 V644	L472-A476 VanDerWaalsContact O-CB 3.22Å; L472-A476 WeakPolarHBondContact O-CB 3.41Å; L472-A476 PolarHBondContact O-N 2.9Å; A476-Q479 WeakPolarHBondContact O-CB 3.3Å; A476-Q479 PolarHBondContact O-N 2.81Å; A476-D480 PolarHBondContact O-N 3.4Å; A476-S643 WeakPolarHBondContact CB-O 3.49Å; A476-V644 HydrophobicContact CB-CG2 4.39Å
477	T	96.8	Very high	96.4	Very high	92 Å²	92	42.3 Å²	42.3	56%	0.564	22%	0.219	S	C	*	.	H	α-helix	trans	-63	-43.5	173.2	-54.2	0	0	0	0	111	E473 E474 F475 Q479 D480 E481	E473-T477 PolarHBondContact O-N 3.37Å; E473-T477 PolarHBondContact O-OG1 3.01Å; E473-T477 VanDerWaalsContact O-OG1 3.07Å; E474-T477 WeakPolarHBondContact O-CB 3.41Å; E474-T477 PolarHBondContact O-N 3.22Å; F475-T477 VanDerWaalsContact C-N 3.34Å; T477-Q479 VanDerWaalsContact C-N 3.27Å; T477-Q479 PolarHBondContact O-N 3.12Å; T477-D480 PolarHBondContact O-N 3.5Å; T477-E481 PolarHBondContact O-N 3.4Å; T477-E481 VanDerWaalsContact O-N 3.09Å
478	L	97.7	Very high	96.3	Very high	6 Å²	6	40.5 Å²	40.5	3%	0.031	22%	0.217	C	C	.	.	H	α-helix	trans	-63	-32.1	175	-70	-176.4	0	0	0	113	H445 P449 E474 F475 A482 I510	H445-L478 HydrophobicContact CB-CD2 4.27Å; P449-L478 HydrophobicContact CB-CD1 3.8Å; P449-L478 HydrophobicContact CG-CD1 3.85Å; P449-L478 HydrophobicContact CG-CG 4.35Å; E474-L478 PolarHBondContact O-N 3.41Å; E474-L478 VanDerWaalsContact O-N 3.09Å; F475-L478 PolarHBondContact O-N 2.91Å; L478-A482 VanDerWaalsContact O-CB 3.23Å; L478-A482 WeakPolarHBondContact O-CB 3.29Å; L478-A482 PolarHBondContact O-N 2.85Å; L478-I510 HydrophobicContact CB-CD1 4.3Å; L478-I510 HydrophobicContact CB-CG2 4.09Å; L478-I510 HydrophobicContact CD1-CD1 4.36Å
479	Q	97.3	Very high	96.2	Very high	10 Å²	10	40.5 Å²	40.5	5%	0.047	22%	0.217	C	C	.	.	H	α-helix	trans	-65	-48.4	177.9	-177.8	65.5	42.8	0	0	111.1	F475 A476 T477 E481 A482 E483 G507 I510 L511	F475-Q479 PolarHBondContact O-N 3.44Å; A476-Q479 WeakPolarHBondContact O-CB 3.3Å; A476-Q479 PolarHBondContact O-N 2.81Å; T477-Q479 VanDerWaalsContact C-N 3.27Å; T477-Q479 PolarHBondContact O-N 3.12Å; Q479-E481 PolarHBondContact O-N 3.29Å; Q479-A482 PolarHBondContact O-N 2.92Å; Q479-E483 PolarHBondContact NE2-OE1 3.19Å; Q479-E483 WeakPolarHBondContact O-CG 3.49Å; Q479-E483 PolarHBondContact O-N 2.91Å; Q479-G507 PolarHBondContact NE2-O 3.46Å; Q479-G507 PolarHBondContact OE1-O 3.44Å; Q479-I510 HydrophobicContact CB-CG2 4.01Å; Q479-L511 VanDerWaalsContact OE1-CA 3.3Å
480	D	96.1	Very high	96	Very high	79 Å²	79	43.5 Å²	43.5	42%	0.422	23%	0.228	S	C	.	.	H	α-helix	trans	-62.1	-41.9	176.4	172.1	64.1	0	0	0	111.6	A476 T477 E483 K484	A476-D480 PolarHBondContact O-N 3.4Å; T477-D480 PolarHBondContact O-N 3.5Å; D480-E483 PolarHBondContact O-N 3.04Å; D480-K484 WeakPolarHBondContact O-CG 3.49Å; D480-K484 PolarHBondContact O-N 2.99Å; D480-K484 VanDerWaalsContact O-N 3.14Å; D480-K484 VanDerWaalsContact OD1-CE 3.26Å; D480-K484 WeakPolarHBondContact OD1-CE 3.39Å; D480-K484 IonicContact OD1-NZ 2.97Å; D480-K484 PolarHBondContact OD1-NZ 3.34Å; D480-K484 WeakPolarHBondContact OD2-CE 3.36Å; D480-K484 IonicContact OD2-NZ 2.9Å; D480-K484 PolarHBondContact OD2-NZ 2.93Å
481	E	97.3	Very high	95.8	Very high	40 Å²	40	41.3 Å²	41.3	19%	0.187	23%	0.226	C	C	.	.	H	α-helix	trans	-62.2	-45.2	174.4	-169.6	-179.4	159.8	0	0	111.9	F442 H445 T477 Q479 E483 K484 V485	F442-E481 HydrophobicContact CD2-CB 4.5Å; F442-E481 HydrophobicContact CD2-CG 4.02Å; H445-E481 IonicContact CE1-OE1 3.01Å; H445-E481 IonicContact CG-OE1 3.33Å; H445-E481 IonicContact CG-OE2 3.27Å; H445-E481 VanDerWaalsContact ND1-CD 3.27Å; H445-E481 IonicContact ND1-OE1 2.69Å; H445-E481 PolarHBondContact ND1-OE1 3.43Å; H445-E481 IonicContact ND1-OE2 3.58Å; H445-E481 PolarHBondContact ND1-OE2 3.45Å; T477-E481 PolarHBondContact O-N 3.4Å; T477-E481 VanDerWaalsContact O-N 3.09Å; Q479-E481 PolarHBondContact O-N 3.29Å; E481-E483 VanDerWaalsContact C-N 3.31Å; E481-E483 PolarHBondContact O-N 3.41Å; E481-K484 PolarHBondContact O-N 3.2Å; E481-V485 HydrophobicContact CG-CG2 4.36Å; E481-V485 VanDerWaalsContact O-CG2 3.31Å; E481-V485 WeakPolarHBondContact O-CG2 3.39Å; E481-V485 PolarHBondContact O-N 3.46Å
482	A	97.1	Very high	95.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.8	-41.6	179.7	0	0	0	0	0	112	F442 L478 Q479 V485 D486 L506 I510	F442-A482 HydrophobicContact CE2-CB 3.66Å; F442-A482 HydrophobicContact CZ-CB 3.72Å; L478-A482 VanDerWaalsContact O-CB 3.23Å; L478-A482 WeakPolarHBondContact O-CB 3.29Å; L478-A482 PolarHBondContact O-N 2.85Å; Q479-A482 PolarHBondContact O-N 2.92Å; A482-V485 PolarHBondContact O-N 2.91Å; A482-D486 WeakPolarHBondContact O-CB 3.5Å; A482-D486 PolarHBondContact O-N 3.24Å; A482-L506 HydrophobicContact CB-CB 3.95Å; A482-I510 HydrophobicContact CB-CB 4.49Å; A482-I510 HydrophobicContact CB-CG1 3.96Å
483	E	94.9	Very high	95.1	Very high	84 Å²	84	42.2 Å²	42.2	39%	0.393	23%	0.23	S	C	.	.	H	α-helix	trans	-65.4	-41.5	177.5	-72.3	174.2	-165.6	0	0	112.1	Q479 D480 E481 D486 A487	Q479-E483 PolarHBondContact NE2-OE1 3.19Å; Q479-E483 WeakPolarHBondContact O-CG 3.49Å; Q479-E483 PolarHBondContact O-N 2.91Å; D480-E483 PolarHBondContact O-N 3.04Å; E481-E483 VanDerWaalsContact C-N 3.31Å; E481-E483 PolarHBondContact O-N 3.41Å; E483-D486 PolarHBondContact O-N 3.49Å; E483-A487 WeakPolarHBondContact O-CB 3.22Å; E483-A487 PolarHBondContact O-N 2.93Å
484	K	95.5	Very high	94.8	Very high	128 Å²	128	39.7 Å²	39.7	56%	0.557	22%	0.219	S	C	*	.	H	α-helix	trans	-63.4	-44.2	174.7	-72.2	167.8	-179.5	166.4	0	111.9	D480 E481 A487 A488	D480-K484 WeakPolarHBondContact O-CG 3.49Å; D480-K484 PolarHBondContact O-N 2.99Å; D480-K484 VanDerWaalsContact O-N 3.14Å; D480-K484 VanDerWaalsContact OD1-CE 3.26Å; D480-K484 WeakPolarHBondContact OD1-CE 3.39Å; D480-K484 IonicContact OD1-NZ 2.97Å; D480-K484 PolarHBondContact OD1-NZ 3.34Å; D480-K484 WeakPolarHBondContact OD2-CE 3.36Å; D480-K484 IonicContact OD2-NZ 2.9Å; D480-K484 PolarHBondContact OD2-NZ 2.93Å; E481-K484 PolarHBondContact O-N 3.2Å; K484-A487 PolarHBondContact O-N 3.45Å; K484-A488 PolarHBondContact O-N 2.88Å
485	V	96.5	Very high	94.4	Very high	15 Å²	15	45.3 Å²	45.3	9%	0.091	24%	0.243	C	C	.	.	H	α-helix	trans	-65.7	-42.9	177.8	175.7	0	0	0	0	110.5	F442 E481 A482 A487 A488 L489 L506	F442-V485 HydrophobicContact CB-CG2 4.29Å; E481-V485 HydrophobicContact CG-CG2 4.36Å; E481-V485 VanDerWaalsContact O-CG2 3.31Å; E481-V485 WeakPolarHBondContact O-CG2 3.39Å; E481-V485 PolarHBondContact O-N 3.46Å; A482-V485 PolarHBondContact O-N 2.91Å; V485-A487 VanDerWaalsContact C-N 3.34Å; V485-A487 PolarHBondContact O-N 3.44Å; V485-A488 PolarHBondContact O-N 3.41Å; V485-L489 HydrophobicContact CG1-CD1 3.83Å; V485-L489 HydrophobicContact CG1-CG 4.19Å; V485-L489 WeakPolarHBondContact O-CB 3.45Å; V485-L489 VanDerWaalsContact O-CG 3.3Å; V485-L489 WeakPolarHBondContact O-CG 3.41Å; V485-L489 PolarHBondContact O-N 2.93Å; V485-L506 HydrophobicContact CB-CD1 3.96Å; V485-L506 HydrophobicContact CG1-CD1 3.42Å; V485-L506 VanDerWaalsContact CG1-CD1 3.42Å
486	D	95.3	Very high	93.9	Very high	6 Å²	6	49.5 Å²	49.5	3%	0.032	27%	0.265	C	S	.	.	H	α-helix	trans	-59.7	-42.8	174.9	-88.2	-33.1	0	0	0	112	A482 E483 L489 H490 H502 A504 C505 L506 G507	A482-D486 WeakPolarHBondContact O-CB 3.5Å; A482-D486 PolarHBondContact O-N 3.24Å; E483-D486 PolarHBondContact O-N 3.49Å; D486-L489 PolarHBondContact O-N 2.94Å; D486-H490 VanDerWaalsContact O-CB 3.23Å; D486-H490 WeakPolarHBondContact O-CB 3.22Å; D486-H490 PolarHBondContact O-N 3.29Å; D486-H502 PolarHBondContact O-CD2 2.82Å; D486-H502 IonicContact OD1-CD2 3.74Å; D486-H502 IonicContact OD1-CE1 2.71Å; D486-H502 PolarHBondContact OD1-CE1 3.4Å; D486-H502 IonicContact OD1-NE2 3.62Å; D486-H502 PolarHBondContact OD1-NE2 2.91Å; D486-A504 VanDerWaalsContact OD2-CA 3.23Å; D486-A504 WeakPolarHBondContact OD2-CA 3.2Å; D486-C505 PolarHBondContact OD1-N 3.34Å; D486-C505 PolarHBondContact OD2-N 3.03Å; D486-L506 PolarHBondContact OD1-N 3.3Å; D486-L506 PolarHBondContact OD2-N 2.84Å; D486-G507 PolarHBondContact OD2-N 3.29Å
487	A	94.4	Very high	93.4	Very high	55 Å²	55	51.3 Å²	51.3	46%	0.455	27%	0.27	S	S	.	.	H	α-helix	trans	-64.3	-40.6	177.1	0	0	0	0	0	112.5	E483 K484 V485 S491	E483-A487 WeakPolarHBondContact O-CB 3.22Å; E483-A487 PolarHBondContact O-N 2.93Å; K484-A487 PolarHBondContact O-N 3.45Å; V485-A487 VanDerWaalsContact C-N 3.34Å; V485-A487 PolarHBondContact O-N 3.44Å; A487-S491 WeakPolarHBondContact O-CB 3.23Å; A487-S491 PolarHBondContact O-N 2.92Å; A487-S491 PolarHBondContact O-OG 2.86Å
488	A	94.4	Very high	92.6	Very high	28 Å²	28	51.3 Å²	51.3	23%	0.231	27%	0.272	C	S	.	.	H	α-helix	trans	-65.8	-46.7	176.2	0	0	0	0	0	111.8	Y438 K484 V485 S491 L492	Y438-A488 HydrophobicContact CD2-CB 4.18Å; Y438-A488 HydrophobicContact CE2-CB 3.86Å; K484-A488 PolarHBondContact O-N 2.88Å; V485-A488 PolarHBondContact O-N 3.41Å; A488-S491 PolarHBondContact O-N 3.24Å; A488-L492 WeakPolarHBondContact O-CG 3.2Å; A488-L492 PolarHBondContact O-N 2.9Å
489	L	93.4	Very high	91.6	Very high	1 Å²	1	60.5 Å²	60.5	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-64.2	-40.1	177	-69.9	175.9	0	0	0	111.8	V422 A435 Y438 V485 D486 L492 L493 L506	V422-L489 HydrophobicContact CB-CD1 4.18Å; V422-L489 HydrophobicContact CB-CD2 4.22Å; V422-L489 HydrophobicContact CG1-CD1 3.9Å; V422-L489 HydrophobicContact CG2-CD2 4.02Å; A435-L489 HydrophobicContact CB-CD2 3.78Å; Y438-L489 HydrophobicContact CD2-CD2 4.33Å; V485-L489 HydrophobicContact CG1-CD1 3.83Å; V485-L489 HydrophobicContact CG1-CG 4.19Å; V485-L489 WeakPolarHBondContact O-CB 3.45Å; V485-L489 VanDerWaalsContact O-CG 3.3Å; V485-L489 WeakPolarHBondContact O-CG 3.41Å; V485-L489 PolarHBondContact O-N 2.93Å; D486-L489 PolarHBondContact O-N 2.94Å; L489-L492 PolarHBondContact O-N 3.21Å; L489-L493 WeakPolarHBondContact O-CB 3.28Å; L489-L493 PolarHBondContact O-N 3.12Å; L489-L506 HydrophobicContact CD1-CD1 4.32Å
490	H	91.7	Very high	90.7	Very high	71 Å²	71	60.6 Å²	60.6	33%	0.329	32%	0.315	S	S	.	.	H	α-helix	trans	-60	-46.3	173.9	-176.8	84.3	0	0	0	111.3	D486 L492 L493 M494 H502	D486-H490 VanDerWaalsContact O-CB 3.23Å; D486-H490 WeakPolarHBondContact O-CB 3.22Å; D486-H490 PolarHBondContact O-N 3.29Å; H490-L492 VanDerWaalsContact C-N 3.3Å; H490-L492 PolarHBondContact O-N 3.38Å; H490-L493 PolarHBondContact O-N 3.41Å; H490-L493 VanDerWaalsContact O-N 3.16Å; H490-M494 WeakPolarHBondContact NE2-CG 3.17Å; H490-M494 WeakPolarHBondContact O-CG 3.33Å; H490-M494 PolarHBondContact O-N 2.87Å; H490-H502 HydrophobicContact CB-CB 4.27Å; H490-H502 PolarHBondContact ND1-O 3.16Å
491	S	91.6	Very high	89.4	Confident	65 Å²	65	63.9 Å²	63.9	46%	0.455	33%	0.328	S	S	.	.	H	α-helix	trans	-62	-36.8	178.8	-60.9	0	0	0	0	112.5	A487 A488 K495	A487-S491 WeakPolarHBondContact O-CB 3.23Å; A487-S491 PolarHBondContact O-N 2.92Å; A487-S491 PolarHBondContact O-OG 2.86Å; A488-S491 PolarHBondContact O-N 3.24Å; S491-K495 WeakPolarHBondContact O-CG 3.46Å
492	L	91.6	Very high	88.2	Confident	22 Å²	22	62.7 Å²	62.7	12%	0.115	32%	0.322	C	S	.	.	H	α-helix	trans	-69.9	-43.5	172.9	-71.3	173.6	0	0	0	111.7	L429 Q434 A435 Y438 A488 L489 H490 M494 K495 L496	L429-L492 HydrophobicContact CD2-CB 3.88Å; Q434-L492 HydrophobicContact CG-CD1 4.25Å; A435-L492 HydrophobicContact CB-CD1 4.35Å; Y438-L492 HydrophobicContact CD2-CD1 4.27Å; Y438-L492 HydrophobicContact CE2-CD1 3.98Å; A488-L492 WeakPolarHBondContact O-CG 3.2Å; A488-L492 PolarHBondContact O-N 2.9Å; L489-L492 PolarHBondContact O-N 3.21Å; H490-L492 VanDerWaalsContact C-N 3.3Å; H490-L492 PolarHBondContact O-N 3.38Å; L492-M494 PolarHBondContact O-N 3.46Å; L492-K495 PolarHBondContact O-N 3.11Å; L492-L496 WeakPolarHBondContact O-CG 3.42Å; L492-L496 PolarHBondContact O-N 3.38Å
493	L	89.7	Confident	86.9	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-62.5	-44.4	180	-169.9	65	0	0	0	111.4	P421 L429 L489 H490 K495 L496 E497 R500 H502	P421-L493 HydrophobicContact CG-CD2 4.44Å; L429-L493 HydrophobicContact CD1-CB 4.08Å; L429-L493 HydrophobicContact CD1-CD1 3.97Å; L429-L493 HydrophobicContact CG-CD1 4Å; L489-L493 WeakPolarHBondContact O-CB 3.28Å; L489-L493 PolarHBondContact O-N 3.12Å; H490-L493 PolarHBondContact O-N 3.41Å; H490-L493 VanDerWaalsContact O-N 3.16Å; L493-K495 PolarHBondContact O-N 3.06Å; L493-K495 VanDerWaalsContact O-N 3.17Å; L493-L496 PolarHBondContact O-N 3.28Å; L493-E497 HydrophobicContact CD1-CB 4.01Å; L493-E497 CarbonylContact O-C 3.55Å; L493-E497 PolarHBondContact O-N 3.5Å; L493-R500 HydrophobicContact CD2-CB 4.19Å; L493-R500 HydrophobicContact CD2-CG 4.16Å; L493-R500 VanDerWaalsContact CD2-O 3.29Å; L493-R500 WeakPolarHBondContact CD2-O 3.23Å; L493-H502 HydrophobicContact CD2-CB 3.74Å
494	M	88.9	Confident	86.4	Confident	64 Å²	64	64.6 Å²	64.6	32%	0.315	34%	0.341	S	S	.	.	H	α-helix	trans	-61.4	-25.2	179	-71.4	-62.2	99.4	0	0	113.3	H490 L492 P498 R500	H490-M494 WeakPolarHBondContact NE2-CG 3.17Å; H490-M494 WeakPolarHBondContact O-CG 3.33Å; H490-M494 PolarHBondContact O-N 2.87Å; L492-M494 PolarHBondContact O-N 3.46Å; M494-P498 WeakPolarHBondContact O-CG 3.36Å; M494-R500 WeakPolarHBondContact CE-O 3.45Å
495	K	88.5	Confident	86.3	Confident	169 Å²	169	58.7 Å²	58.7	74%	0.735	32%	0.316	S	S	*	.	H	α-helix	trans	-78.9	-31.2	174.3	-68.6	175.4	-175.8	179.6	0	113	S491 L492 L493	S491-K495 WeakPolarHBondContact O-CG 3.46Å; L492-K495 PolarHBondContact O-N 3.11Å; L493-K495 PolarHBondContact O-N 3.06Å; L493-K495 VanDerWaalsContact O-N 3.17Å
496	L	87	Confident	86.2	Confident	89 Å²	89	58 Å²	58	47%	0.466	31%	0.311	S	S	.	.	H	α-helix	trans	-102.1	-41.5	-170.8	-63	172.4	0	0	0	113.1	C428 L429 L492 L493	C428-L496 HydrophobicContact CB-CB 4.31Å; C428-L496 HydrophobicContact CB-CD1 4.4Å; C428-L496 WeakPolarHBondContact SG-CB 3.36Å; L429-L496 HydrophobicContact CD2-CD1 4.03Å; L492-L496 WeakPolarHBondContact O-CG 3.42Å; L492-L496 PolarHBondContact O-N 3.38Å; L493-L496 PolarHBondContact O-N 3.28Å
497	E	85.1	Confident	86.3	Confident	53 Å²	53	57.9 Å²	57.9	25%	0.248	31%	0.312	C	S	.	.			trans	-136.8	74.8	179.7	-74.8	175.3	-151.6	0	0	110.2	C428 L493 Q499 R500	C428-E497 HydrophobicContact CB-CG 4.47Å; C428-E497 VanDerWaalsContact CB-OE1 3.28Å; C428-E497 WeakPolarHBondContact CB-OE1 3.39Å; C428-E497 PolarHBondContact N-OE1 2.99Å; C428-E497 VanDerWaalsContact SG-CD 3.52Å; C428-E497 PolarHBondContact SG-OE1 3.48Å; L493-E497 HydrophobicContact CD1-CB 4.01Å; L493-E497 CarbonylContact O-C 3.55Å; L493-E497 PolarHBondContact O-N 3.5Å; E497-Q499 PolarHBondContact O-N 3.18Å; E497-R500 HydrophobicContact CB-CB 4.1Å; E497-R500 PolarHBondContact O-N 3.02Å; E497-R500 WeakPolarHBondContact OE2-CD 3.47Å; E497-R500 IonicContact OE2-NH1 3.5Å; E497-R500 PolarHBondContact OE2-NH1 3.48Å
498	P	80.1	Confident	86.3	Confident	92 Å²	92	55.3 Å²	55.3	60%	0.597	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-23.1	-175.4	-19.4	27.2	0	0	0	114.6	M494 R500	M494-P498 WeakPolarHBondContact O-CG 3.36Å; P498-R500 VanDerWaalsContact C-N 3.33Å
499	Q	78.1	Confident	86.5	Confident	199 Å²	199	54 Å²	54	93%	0.93	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-10.8	-179.3	-59.6	-166.6	6.7	0	0	113.3	E497	E497-Q499 PolarHBondContact O-N 3.18Å
500	R	78.1	Confident	86.7	Confident	13 Å²	13	53.9 Å²	53.9	5%	0.049	28%	0.279	C	S	.	.	S	Bend	trans	-97.6	119.7	-178.8	-169.5	172.5	-173.9	166	-1.8	110.4	C427 L493 M494 E497 P498 E565 I568	C427-R500 VanDerWaalsContact CA-NH1 3.27Å; L493-R500 HydrophobicContact CD2-CB 4.19Å; L493-R500 HydrophobicContact CD2-CG 4.16Å; L493-R500 VanDerWaalsContact CD2-O 3.29Å; L493-R500 WeakPolarHBondContact CD2-O 3.23Å; M494-R500 WeakPolarHBondContact CE-O 3.45Å; E497-R500 HydrophobicContact CB-CB 4.1Å; E497-R500 PolarHBondContact O-N 3.02Å; E497-R500 WeakPolarHBondContact OE2-CD 3.47Å; E497-R500 IonicContact OE2-NH1 3.5Å; E497-R500 PolarHBondContact OE2-NH1 3.48Å; P498-R500 VanDerWaalsContact C-N 3.33Å; R500-E565 IonicContact CZ-OE1 2.81Å; R500-E565 IonicContact CZ-OE2 3.47Å; R500-E565 IonicContact NE-OE2 3.8Å; R500-E565 IonicContact NH2-OE1 3Å; R500-E565 PolarHBondContact NH2-OE1 2.97Å; R500-E565 IonicContact NH2-OE2 3.78Å; R500-E565 PolarHBondContact NH2-OE2 2.79Å; R500-I568 HydrophobicContact CG-CD1 4.27Å
501	Q	69.4	Low	86.9	Confident	148 Å²	148	50.6 Å²	50.6	69%	0.692	26%	0.264	S	S	*	.			trans	-78.1	134.8	178.3	-67.2	179.7	-10.3	0	0	111.1	L503	Q501-L503 HydrophobicContact CB-CD2 4.45Å; Q501-L503 HydrophobicContact CB-CG 4.39Å
502	H	71.4	Confident	87.2	Confident	14 Å²	14	47.6 Å²	47.6	7%	0.065	24%	0.242	C	C	.	.			trans	-107.6	119.5	166.3	-177.2	76.3	0	0	0	108.7	P421 D486 H490 L493	P421-H502 WeakPolarHBondContact CD-ND1 3.5Å; D486-H502 PolarHBondContact O-CD2 2.82Å; D486-H502 IonicContact OD1-CD2 3.74Å; D486-H502 IonicContact OD1-CE1 2.71Å; D486-H502 PolarHBondContact OD1-CE1 3.4Å; D486-H502 IonicContact OD1-NE2 3.62Å; D486-H502 PolarHBondContact OD1-NE2 2.91Å; H490-H502 HydrophobicContact CB-CB 4.27Å; H490-H502 PolarHBondContact ND1-O 3.16Å; L493-H502 HydrophobicContact CD2-CB 3.74Å
503	L	68.4	Low	87.5	Confident	80 Å²	80	46.7 Å²	46.7	42%	0.419	24%	0.237	S	C	.	.			trans	-112.8	53.1	-164.7	-66.2	170.6	0	0	0	112.9	Q501 C505	Q501-L503 HydrophobicContact CB-CD2 4.45Å; Q501-L503 HydrophobicContact CB-CG 4.39Å; L503-C505 VanDerWaalsContact C-N 3.29Å; L503-C505 PolarHBondContact O-N 3.17Å
504	A	85.7	Confident	87.9	Confident	45 Å²	45	46.7 Å²	46.7	37%	0.372	24%	0.237	S	C	.	.			trans	47.5	50.8	177.2	0	0	0	0	0	112.9	D486 T508	D486-A504 VanDerWaalsContact OD2-CA 3.23Å; D486-A504 WeakPolarHBondContact OD2-CA 3.2Å; A504-T508 VanDerWaalsContact O-CB 3.29Å; A504-T508 WeakPolarHBondContact O-CB 3.43Å; A504-T508 PolarHBondContact O-N 3.03Å; A504-T508 PolarHBondContact O-OG1 3.14Å
505	C	92.4	Very high	88.4	Confident	4 Å²	4	43.6 Å²	43.6	3%	0.027	22%	0.222	C	C	.	.	H	α-helix	trans	-64	-47.1	-170.6	-63	0	0	0	0	112	V418 P420 D486 L503 T508 W509	V418-C505 HydrophobicContact CB-CB 4.12Å; V418-C505 HydrophobicContact CG2-CB 4.33Å; P420-C505 HydrophobicContact CB-CB 3.82Å; D486-C505 PolarHBondContact OD1-N 3.34Å; D486-C505 PolarHBondContact OD2-N 3.03Å; L503-C505 VanDerWaalsContact C-N 3.29Å; L503-C505 PolarHBondContact O-N 3.17Å; C505-T508 PolarHBondContact O-N 3.41Å; C505-W509 PolarHBondContact O-N 3.24Å; C505-W509 VanDerWaalsContact O-N 3.13Å
506	L	95.8	Very high	88.8	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-70.1	-44.6	-177	-55.6	-179.4	0	0	0	110.6	L414 I439 F442 A482 V485 D486 L489 T508 W509 I510	L414-L506 HydrophobicContact CD1-CD2 4.04Å; L414-L506 HydrophobicContact CD2-CD2 3.78Å; I439-L506 HydrophobicContact CD1-CD1 4.08Å; I439-L506 HydrophobicContact CD1-CD2 3.91Å; F442-L506 HydrophobicContact CD1-CD1 3.96Å; F442-L506 HydrophobicContact CD1-CD2 4.38Å; F442-L506 HydrophobicContact CE1-CB 4.15Å; F442-L506 HydrophobicContact CE1-CD1 4.1Å; F442-L506 HydrophobicContact CE1-CD2 4.07Å; F442-L506 HydrophobicContact CE1-CG 4.33Å; F442-L506 HydrophobicContact CG-CD1 4.44Å; F442-L506 HydrophobicContact CZ-CB 4.3Å; A482-L506 HydrophobicContact CB-CB 3.95Å; V485-L506 HydrophobicContact CB-CD1 3.96Å; V485-L506 HydrophobicContact CG1-CD1 3.42Å; V485-L506 VanDerWaalsContact CG1-CD1 3.42Å; D486-L506 PolarHBondContact OD1-N 3.3Å; D486-L506 PolarHBondContact OD2-N 2.84Å; L489-L506 HydrophobicContact CD1-CD1 4.32Å; L506-T508 VanDerWaalsContact C-N 3.29Å; L506-T508 PolarHBondContact O-N 3.01Å; L506-W509 PolarHBondContact O-N 3.45Å; L506-W509 VanDerWaalsContact O-N 3.08Å; L506-I510 PolarHBondContact O-N 3.38Å
507	G	95.9	Very high	89.4	Confident	4 Å²	4	33.7 Å²	33.7	4%	0.041	17%	0.174	C	C	.	.	H	α-helix	trans	-61.1	-37.2	176.3	0	0	0	0	0	112.3	Q479 D486 L511	Q479-G507 PolarHBondContact NE2-O 3.46Å; Q479-G507 PolarHBondContact OE1-O 3.44Å; D486-G507 PolarHBondContact OD2-N 3.29Å; G507-L511 WeakPolarHBondContact O-CB 3.35Å; G507-L511 PolarHBondContact O-N 2.93Å
508	T	96.1	Very high	90	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-65	-38.5	173.6	-61.3	0	0	0	0	111.7	V418 A504 C505 L506 Y512 T554 R557 A558	V418-T508 HydrophobicContact CG1-CG2 4.12Å; A504-T508 VanDerWaalsContact O-CB 3.29Å; A504-T508 WeakPolarHBondContact O-CB 3.43Å; A504-T508 PolarHBondContact O-N 3.03Å; A504-T508 PolarHBondContact O-OG1 3.14Å; C505-T508 PolarHBondContact O-N 3.41Å; L506-T508 VanDerWaalsContact C-N 3.29Å; L506-T508 PolarHBondContact O-N 3.01Å; T508-Y512 PolarHBondContact O-N 3.19Å; T508-Y512 VanDerWaalsContact O-N 3.13Å; T508-T554 HydrophobicContact CG2-CG2 3.81Å; T508-T554 VanDerWaalsContact O-CG2 3.3Å; T508-T554 WeakPolarHBondContact O-CG2 3.4Å; T508-R557 HydrophobicContact CG2-CB 4.13Å; T508-A558 HydrophobicContact CG2-CB 4.34Å
509	W	96.8	Very high	90.9	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-71.6	-43.4	180	-175.3	71.9	0	0	0	112.9	L366 H367 I410 A413 L414 F417 V418 F450 C505 L506 Y512 H513	L366-W509 HydrophobicContact CD2-CH2 4.3Å; L366-W509 HydrophobicContact CD2-CZ2 3.97Å; H367-W509 AromaticContact CE1-NE1 3.58Å; H367-W509 AromaticContact NE2-NE1 3.59Å; I410-W509 HydrophobicContact CG1-CH2 4.48Å; I410-W509 HydrophobicContact CG2-CH2 3.68Å; I410-W509 HydrophobicContact CG2-CZ2 4.48Å; I410-W509 HydrophobicContact CG2-CZ3 4.1Å; A413-W509 HydrophobicContact CB-CZ2 4.07Å; L414-W509 HydrophobicContact CD2-CB 3.87Å; L414-W509 HydrophobicContact CD2-CD2 3.41Å; L414-W509 VanDerWaalsContact CD2-CD2 3.41Å; L414-W509 HydrophobicContact CD2-CE3 3.53Å; L414-W509 HydrophobicContact CD2-CG 3.58Å; L414-W509 HydrophobicContact CD2-CZ3 4.23Å; L414-W509 HydrophobicContact CG-CD2 4.17Å; L414-W509 HydrophobicContact CG-CE3 4.22Å; L414-W509 HydrophobicContact CG-CZ3 4.47Å; F417-W509 AromaticContact CD1-CD1 3.52Å; F417-W509 HydrophobicContact CD1-CG 4.44Å; F417-W509 AromaticContact CG-CD1 3.85Å; V418-W509 HydrophobicContact CG1-CB 4.44Å; V418-W509 HydrophobicContact CG2-CB 3.97Å; V418-W509 HydrophobicContact CG2-CG 4.42Å; F450-W509 HydrophobicContact CD2-CH2 4.17Å; F450-W509 HydrophobicContact CE1-CH2 4.02Å; F450-W509 HydrophobicContact CE1-CZ2 4.29Å; F450-W509 AromaticContact CE2-CH2 3.32Å; F450-W509 HydrophobicContact CE2-CH2 3.32Å; F450-W509 HydrophobicContact CE2-CZ2 4.32Å; F450-W509 AromaticContact CE2-CZ3 3.53Å; F450-W509 HydrophobicContact CE2-CZ3 3.53Å; F450-W509 HydrophobicContact CZ-CE3 4.47Å; F450-W509 AromaticContact CZ-CH2 3.22Å; F450-W509 HydrophobicContact CZ-CH2 3.22Å; F450-W509 AromaticContact CZ-CZ2 3.81Å; F450-W509 HydrophobicContact CZ-CZ2 3.81Å; F450-W509 AromaticContact CZ-CZ3 3.63Å; F450-W509 HydrophobicContact CZ-CZ3 3.63Å; C505-W509 PolarHBondContact O-N 3.24Å; C505-W509 VanDerWaalsContact O-N 3.13Å; L506-W509 PolarHBondContact O-N 3.45Å; L506-W509 VanDerWaalsContact O-N 3.08Å; W509-Y512 WeakPolarHBondContact O-CB 3.39Å; W509-Y512 PolarHBondContact O-N 3.38Å; W509-H513 AromaticContact CD2-NE2 3.95Å; W509-H513 AromaticContact CE2-CD2 3.91Å; W509-H513 AromaticContact CE2-NE2 3.32Å; W509-H513 VanDerWaalsContact CE2-NE2 3.32Å; W509-H513 AromaticContact CZ2-NE2 3.45Å; W509-H513 WeakPolarHBondContact CZ2-NE2 3.36Å; W509-H513 AromaticContact NE1-NE2 3.46Å; W509-H513 PolarHBondContact NE1-NE2 3.01Å; W509-H513 PolarHBondContact O-CD2 2.94Å; W509-H513 PolarHBondContact O-N 2.94Å
510	I	97.9	Very high	91.8	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-67.3	-40.5	175.7	-62.5	-61.7	0	0	0	111	F442 F450 F475 L478 Q479 A482 L506 Y512 H513 N514	F442-I510 HydrophobicContact CZ-CD1 4.02Å; F442-I510 HydrophobicContact CZ-CG1 3.81Å; F450-I510 HydrophobicContact CE2-CD1 4.26Å; F475-I510 HydrophobicContact CD1-CG2 4.44Å; L478-I510 HydrophobicContact CB-CD1 4.3Å; L478-I510 HydrophobicContact CB-CG2 4.09Å; L478-I510 HydrophobicContact CD1-CD1 4.36Å; Q479-I510 HydrophobicContact CB-CG2 4.01Å; A482-I510 HydrophobicContact CB-CB 4.49Å; A482-I510 HydrophobicContact CB-CG1 3.96Å; L506-I510 PolarHBondContact O-N 3.38Å; I510-Y512 VanDerWaalsContact C-N 3.25Å; I510-Y512 PolarHBondContact O-N 2.86Å; I510-H513 PolarHBondContact O-N 3.42Å; I510-N514 PolarHBondContact O-N 3.36Å
511	L	97.6	Very high	92.7	Very high	2 Å²	2	19.4 Å²	19.4	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-59.8	-38.7	177.6	178.1	61.9	0	0	0	111.9	Q479 G507 H513 N514 L515 W550 T554 T646	Q479-L511 VanDerWaalsContact OE1-CA 3.3Å; G507-L511 WeakPolarHBondContact O-CB 3.35Å; G507-L511 PolarHBondContact O-N 2.93Å; L511-H513 VanDerWaalsContact C-N 3.31Å; L511-H513 PolarHBondContact O-N 2.89Å; L511-N514 PolarHBondContact O-N 3.25Å; L511-L515 HydrophobicContact CD1-CD1 4.08Å; L511-L515 HydrophobicContact CD1-CG 4.09Å; L511-L515 HydrophobicContact CG-CD1 3.88Å; L511-L515 HydrophobicContact CG-CG 4.35Å; L511-L515 WeakPolarHBondContact O-CB 3.47Å; L511-L515 VanDerWaalsContact O-CG 3.25Å; L511-L515 WeakPolarHBondContact O-CG 3.44Å; L511-L515 PolarHBondContact O-N 3.1Å; L511-W550 HydrophobicContact CD2-CE3 4.41Å; L511-T554 HydrophobicContact CB-CG2 4.47Å; L511-T554 HydrophobicContact CD2-CG2 4.36Å; L511-T554 WeakPolarHBondContact CD2-OG1 3.29Å; L511-T554 HydrophobicContact CG-CG2 4.36Å; L511-T646 HydrophobicContact CD1-CG2 4.03Å; L511-T646 WeakPolarHBondContact CD1-O 3.28Å; L511-T646 HydrophobicContact CD2-CG2 4.25Å
512	Y	97.5	Very high	94.1	Very high	1 Å²	1	12.3 Å²	12.3	0%	0.004	7%	0.067	C	C	.	.	H	α-helix	trans	-55.9	-46.1	173.8	162.1	-96.6	0	0	0	112	H367 F417 T508 W509 I510 L515 R516 L551 L555 E593	H367-Y512 AromaticContact CD2-CE1 3.81Å; H367-Y512 AromaticContact NE2-CE1 3.56Å; F417-Y512 HydrophobicContact CE1-CD1 4.46Å; F417-Y512 HydrophobicContact CE1-CG 4.11Å; F417-Y512 HydrophobicContact CE2-CD1 4.27Å; F417-Y512 HydrophobicContact CE2-CD2 4.23Å; F417-Y512 HydrophobicContact CE2-CE1 4.24Å; F417-Y512 HydrophobicContact CE2-CE2 4.19Å; F417-Y512 HydrophobicContact CE2-CG 4.25Å; F417-Y512 AromaticContact CZ-CD1 3.93Å; F417-Y512 HydrophobicContact CZ-CD1 3.93Å; F417-Y512 AromaticContact CZ-CD2 3.63Å; F417-Y512 HydrophobicContact CZ-CD2 3.63Å; F417-Y512 HydrophobicContact CZ-CE1 4.34Å; F417-Y512 HydrophobicContact CZ-CE2 4.05Å; F417-Y512 AromaticContact CZ-CG 3.55Å; F417-Y512 HydrophobicContact CZ-CG 3.55Å; T508-Y512 PolarHBondContact O-N 3.19Å; T508-Y512 VanDerWaalsContact O-N 3.13Å; W509-Y512 WeakPolarHBondContact O-CB 3.39Å; W509-Y512 PolarHBondContact O-N 3.38Å; I510-Y512 VanDerWaalsContact C-N 3.25Å; I510-Y512 PolarHBondContact O-N 2.86Å; Y512-L515 PolarHBondContact O-N 3.36Å; Y512-R516 HydrophobicContact CD2-CG 4.41Å; Y512-R516 HydrophobicContact CE1-CG 4.14Å; Y512-R516 HydrophobicContact CE2-CG 3.93Å; Y512-R516 VanDerWaalsContact O-CG 3.27Å; Y512-R516 WeakPolarHBondContact O-CG 3.39Å; Y512-R516 PolarHBondContact O-N 2.85Å; Y512-R516 PolarHBondContact OH-NH1 2.62Å; Y512-L551 HydrophobicContact CD2-CD1 3.71Å; Y512-L551 HydrophobicContact CE2-CD1 4.06Å; Y512-L555 HydrophobicContact CD2-CD2 4.04Å; Y512-L555 HydrophobicContact CE2-CD2 3.98Å; Y512-E593 VanDerWaalsContact CE2-CD 3.5Å; Y512-E593 WeakPolarHBondContact CE2-OE1 3.36Å; Y512-E593 PolarHBondContact OH-OE1 3.42Å; Y512-E593 PolarHBondContact OH-OE2 3.39Å
513	H	97.9	Very high	95.4	Very high	3 Å²	3	12.2 Å²	12.2	1%	0.014	7%	0.066	C	C	.	.	H	α-helix	trans	-70.6	-39.4	178.2	-67.2	-71.2	0	0	0	112.5	H367 F450 F475 W509 I510 L511 L515 R516 I517	H367-H513 AromaticContact CD2-CE1 3.55Å; H367-H513 AromaticContact NE2-CE1 3.38Å; H367-H513 PolarHBondContact NE2-CE1 3.48Å; H367-H513 AromaticContact NE2-NE2 3.51Å; F450-H513 AromaticContact CE1-CD2 3.77Å; F450-H513 AromaticContact CE1-CE1 3.62Å; F450-H513 AromaticContact CE1-CG 3.91Å; F450-H513 AromaticContact CE1-ND1 3.84Å; F450-H513 AromaticContact CE1-NE2 3.57Å; F450-H513 AromaticContact CZ-CD2 3.47Å; F450-H513 VanDerWaalsContact CZ-CD2 3.47Å; F450-H513 WeakPolarHBondContact CZ-CD2 3.31Å; F450-H513 AromaticContact CZ-CG 3.92Å; F450-H513 AromaticContact CZ-NE2 3.59Å; F475-H513 HydrophobicContact CD1-CB 4.04Å; F475-H513 HydrophobicContact CE1-CB 3.65Å; W509-H513 AromaticContact CD2-NE2 3.95Å; W509-H513 AromaticContact CE2-CD2 3.91Å; W509-H513 AromaticContact CE2-NE2 3.32Å; W509-H513 VanDerWaalsContact CE2-NE2 3.32Å; W509-H513 AromaticContact CZ2-NE2 3.45Å; W509-H513 WeakPolarHBondContact CZ2-NE2 3.36Å; W509-H513 AromaticContact NE1-NE2 3.46Å; W509-H513 PolarHBondContact NE1-NE2 3.01Å; W509-H513 PolarHBondContact O-CD2 2.94Å; W509-H513 PolarHBondContact O-N 2.94Å; I510-H513 PolarHBondContact O-N 3.42Å; L511-H513 VanDerWaalsContact C-N 3.31Å; L511-H513 PolarHBondContact O-N 2.89Å; H513-L515 VanDerWaalsContact C-N 3.34Å; H513-L515 PolarHBondContact O-N 3.37Å; H513-R516 WeakPolarHBondContact O-CB 3.45Å; H513-R516 PolarHBondContact O-N 3.25Å; H513-I517 WeakPolarHBondContact O-CD1 3.36Å; H513-I517 VanDerWaalsContact O-CG1 3.23Å; H513-I517 WeakPolarHBondContact O-CG1 3.21Å; H513-I517 PolarHBondContact O-N 2.97Å
514	N	98	Very high	96.7	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-54.5	-50.5	171.9	-89.6	-42.2	0	0	0	111.1	F475 I510 L511 R516 I517 M518	F475-N514 WeakPolarHBondContact CB-OD1 3.48Å; F475-N514 PolarHBondContact O-ND2 3.38Å; I510-N514 PolarHBondContact O-N 3.36Å; L511-N514 PolarHBondContact O-N 3.25Å; N514-R516 PolarHBondContact O-N 2.94Å; N514-I517 PolarHBondContact O-N 2.94Å; N514-M518 VanDerWaalsContact O-CG 3.22Å; N514-M518 WeakPolarHBondContact O-CG 3.28Å; N514-M518 PolarHBondContact O-N 2.86Å
515	L	98.3	Very high	97.3	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-62.6	-42.5	179.3	-69.3	166.3	0	0	0	112.1	L511 Y512 H513 I517 M518 I519 L547 W550 L551 P647	L511-L515 HydrophobicContact CD1-CD1 4.08Å; L511-L515 HydrophobicContact CD1-CG 4.09Å; L511-L515 HydrophobicContact CG-CD1 3.88Å; L511-L515 HydrophobicContact CG-CG 4.35Å; L511-L515 WeakPolarHBondContact O-CB 3.47Å; L511-L515 VanDerWaalsContact O-CG 3.25Å; L511-L515 WeakPolarHBondContact O-CG 3.44Å; L511-L515 PolarHBondContact O-N 3.1Å; Y512-L515 PolarHBondContact O-N 3.36Å; H513-L515 VanDerWaalsContact C-N 3.34Å; H513-L515 PolarHBondContact O-N 3.37Å; L515-I517 PolarHBondContact O-N 3.35Å; L515-M518 PolarHBondContact O-N 3.06Å; L515-I519 WeakPolarHBondContact O-CB 3.41Å; L515-I519 WeakPolarHBondContact O-CD1 3.48Å; L515-I519 WeakPolarHBondContact O-CG1 3.34Å; L515-I519 PolarHBondContact O-N 3.48Å; L515-L547 HydrophobicContact CD2-CD2 3.98Å; L515-W550 HydrophobicContact CD1-CB 3.94Å; L515-W550 HydrophobicContact CD2-CB 3.72Å; L515-L551 HydrophobicContact CB-CD1 4.26Å; L515-L551 HydrophobicContact CD1-CB 4.3Å; L515-L551 HydrophobicContact CD1-CD1 4.47Å; L515-P647 HydrophobicContact CD2-CG 3.93Å
516	R	97.7	Very high	97.5	Very high	46 Å²	46	6.8 Å²	6.8	17%	0.174	3%	0.031	C	C	.	.	H	α-helix	trans	-56.7	-47.8	173.7	-76.8	-98.6	-49.9	-127.1	10.1	111.7	D371 Y512 H513 N514 I519 Q520 E593	D371-R516 IonicContact OD1-CZ 3.33Å; D371-R516 IonicContact OD1-NH1 2.69Å; D371-R516 PolarHBondContact OD1-NH1 3.17Å; D371-R516 IonicContact OD1-NH2 2.82Å; D371-R516 PolarHBondContact OD1-NH2 3.44Å; Y512-R516 HydrophobicContact CD2-CG 4.41Å; Y512-R516 HydrophobicContact CE1-CG 4.14Å; Y512-R516 HydrophobicContact CE2-CG 3.93Å; Y512-R516 VanDerWaalsContact O-CG 3.27Å; Y512-R516 WeakPolarHBondContact O-CG 3.39Å; Y512-R516 PolarHBondContact O-N 2.85Å; Y512-R516 PolarHBondContact OH-NH1 2.62Å; H513-R516 WeakPolarHBondContact O-CB 3.45Å; H513-R516 PolarHBondContact O-N 3.25Å; N514-R516 PolarHBondContact O-N 2.94Å; R516-I519 PolarHBondContact O-N 2.96Å; R516-Q520 WeakPolarHBondContact O-CB 3.15Å; R516-Q520 PolarHBondContact O-N 3.03Å; R516-E593 IonicContact NH1-OE1 3.19Å
517	I	98.4	Very high	97.5	Very high	3 Å²	3	8.7 Å²	8.7	2%	0.015	4%	0.04	C	C	.	.	H	α-helix	trans	-64.3	-46.3	180	-66.5	162	0	0	0	110.4	L453 L468 I471 L472 F475 H513 N514 L515 I519 Q520 Y521	L453-I517 HydrophobicContact CD1-CD1 4.1Å; L453-I517 HydrophobicContact CD1-CG1 3.99Å; L453-I517 HydrophobicContact CD2-CD1 4.24Å; L453-I517 HydrophobicContact CD2-CG1 4.5Å; L468-I517 HydrophobicContact CB-CG2 4.37Å; L468-I517 HydrophobicContact CD2-CG2 3.97Å; I471-I517 HydrophobicContact CG2-CD1 4.34Å; I471-I517 HydrophobicContact CG2-CG2 4.06Å; L472-I517 HydrophobicContact CD1-CG2 4.38Å; L472-I517 HydrophobicContact CD2-CB 3.92Å; L472-I517 HydrophobicContact CD2-CG2 3.51Å; L472-I517 HydrophobicContact CG-CG2 3.72Å; F475-I517 HydrophobicContact CD1-CD1 4.06Å; F475-I517 HydrophobicContact CD2-CD1 3.98Å; F475-I517 HydrophobicContact CE1-CD1 4.15Å; F475-I517 HydrophobicContact CE2-CD1 4.06Å; F475-I517 HydrophobicContact CG-CD1 3.98Å; F475-I517 HydrophobicContact CZ-CD1 4.15Å; H513-I517 WeakPolarHBondContact O-CD1 3.36Å; H513-I517 VanDerWaalsContact O-CG1 3.23Å; H513-I517 WeakPolarHBondContact O-CG1 3.21Å; H513-I517 PolarHBondContact O-N 2.97Å; N514-I517 PolarHBondContact O-N 2.94Å; L515-I517 PolarHBondContact O-N 3.35Å; I517-I519 PolarHBondContact O-N 3.19Å; I517-Q520 PolarHBondContact O-N 3.41Å; I517-Y521 WeakPolarHBondContact O-CB 3.41Å; I517-Y521 PolarHBondContact O-N 2.81Å
518	M	98.5	Very high	97.5	Very high	1 Å²	1	11 Å²	11	1%	0.005	5%	0.052	C	C	.	.	H	α-helix	trans	-60.2	-44.5	177.4	-66.9	170.8	86.7	0	0	112	L472 N514 L515 Y521 L522 L547 F641	L472-M518 HydrophobicContact CD1-CG 4.2Å; L472-M518 HydrophobicContact CD2-CG 3.86Å; N514-M518 VanDerWaalsContact O-CG 3.22Å; N514-M518 WeakPolarHBondContact O-CG 3.28Å; N514-M518 PolarHBondContact O-N 2.86Å; L515-M518 PolarHBondContact O-N 3.06Å; M518-Y521 PolarHBondContact O-N 2.71Å; M518-L522 PolarHBondContact O-N 2.75Å; M518-L522 VanDerWaalsContact O-N 3.12Å; M518-L547 HydrophobicContact CB-CD1 4.02Å; M518-L547 HydrophobicContact CB-CD2 4.08Å; M518-L547 HydrophobicContact CE-CD2 3.74Å; M518-L547 HydrophobicContact SD-CD2 3.93Å; M518-F641 HydrophobicContact CB-CD1 4.41Å; M518-F641 HydrophobicContact CB-CE1 3.81Å; M518-F641 HydrophobicContact CB-CE2 4.44Å; M518-F641 HydrophobicContact CB-CZ 3.81Å; M518-F641 HydrophobicContact CE-CB 3.76Å; M518-F641 HydrophobicContact CE-CD1 3.81Å; M518-F641 HydrophobicContact CE-CD2 3.56Å; M518-F641 HydrophobicContact CE-CE1 4.28Å; M518-F641 HydrophobicContact CE-CE2 4.01Å; M518-F641 HydrophobicContact CE-CG 3.43Å; M518-F641 VanDerWaalsContact CE-CG 3.43Å; M518-F641 HydrophobicContact CE-CZ 4.36Å; M518-F641 HydrophobicContact CG-CD1 3.92Å; M518-F641 HydrophobicContact CG-CE1 3.79Å; M518-F641 HydrophobicContact CG-CG 4.5Å; M518-F641 HydrophobicContact CG-CZ 4.22Å
519	I	98.4	Very high	97.5	Very high	11 Å²	11	19.5 Å²	19.5	6%	0.056	9%	0.091	C	C	.	.	H	α-helix	trans	-62.1	-48.6	176.7	-72.5	165.7	0	0	0	110	L515 R516 I517 Y521 L522 L523 L543 L547 Y548 L551	L515-I519 WeakPolarHBondContact O-CB 3.41Å; L515-I519 WeakPolarHBondContact O-CD1 3.48Å; L515-I519 WeakPolarHBondContact O-CG1 3.34Å; L515-I519 PolarHBondContact O-N 3.48Å; R516-I519 PolarHBondContact O-N 2.96Å; I517-I519 PolarHBondContact O-N 3.19Å; I519-Y521 VanDerWaalsContact C-N 3.32Å; I519-Y521 PolarHBondContact O-N 2.97Å; I519-L522 PolarHBondContact O-N 2.98Å; I519-L523 HydrophobicContact CG2-CD1 3.6Å; I519-L523 HydrophobicContact CG2-CG 4.15Å; I519-L523 WeakPolarHBondContact O-CB 3.44Å; I519-L523 VanDerWaalsContact O-CG 3.29Å; I519-L523 WeakPolarHBondContact O-CG 3.45Å; I519-L523 PolarHBondContact O-N 2.75Å; I519-L543 HydrophobicContact CB-CD2 4.49Å; I519-L543 HydrophobicContact CG1-CD2 4.3Å; I519-L543 HydrophobicContact CG2-CD2 4.26Å; I519-L547 HydrophobicContact CD1-CB 4.19Å; I519-L547 HydrophobicContact CG1-CB 3.76Å; I519-L547 HydrophobicContact CG1-CD1 3.93Å; I519-L547 HydrophobicContact CG1-CG 4.44Å; I519-Y548 HydrophobicContact CD1-CD1 4.09Å; I519-Y548 HydrophobicContact CD1-CE1 3.9Å; I519-Y548 HydrophobicContact CG2-CE1 4.48Å; I519-Y548 HydrophobicContact CG2-CE2 4.38Å; I519-Y548 WeakPolarHBondContact CG2-OH 3.24Å; I519-L551 HydrophobicContact CD1-CB 4.45Å; I519-L551 HydrophobicContact CD1-CD2 3.74Å
520	Q	97.4	Very high	97.5	Very high	28 Å²	28	22.5 Å²	22.5	13%	0.131	11%	0.107	C	C	.	.	H	α-helix	trans	-62	-39.3	179.2	-171.4	174	7	0	0	112.3	H457 L468 R516 I517 L522 L523 S524	H457-Q520 PolarHBondContact CE1-NE2 3.22Å; H457-Q520 PolarHBondContact CE1-OE1 3.43Å; H457-Q520 PolarHBondContact ND1-NE2 3.05Å; L468-Q520 HydrophobicContact CD1-CB 4.24Å; L468-Q520 HydrophobicContact CD1-CG 3.72Å; R516-Q520 WeakPolarHBondContact O-CB 3.15Å; R516-Q520 PolarHBondContact O-N 3.03Å; I517-Q520 PolarHBondContact O-N 3.41Å; Q520-L522 PolarHBondContact O-N 3.46Å; Q520-L523 PolarHBondContact O-N 2.9Å; Q520-S524 VanDerWaalsContact O-CB 3.31Å; Q520-S524 WeakPolarHBondContact O-CB 2.96Å; Q520-S524 PolarHBondContact O-N 3.38Å; Q520-S524 PolarHBondContact O-OG 3.13Å
521	Y	98.1	Very high	97.4	Very high	17 Å²	17	23 Å²	23	7%	0.067	11%	0.109	C	C	.	.	H	α-helix	trans	-57.3	-49.2	174.1	179.1	-91	0	0	0	111.3	R465 L468 I517 M518 I519 S524 P640 F641	R465-Y521 HydrophobicContact CG-CD2 4.1Å; R465-Y521 HydrophobicContact CG-CE2 3.92Å; R465-Y521 PolarHBondContact NH2-OH 2.98Å; R465-Y521 WeakPolarHBondContact O-CD2 3.46Å; R465-Y521 WeakPolarHBondContact O-CE2 3.4Å; L468-Y521 HydrophobicContact CB-CD2 4.31Å; I517-Y521 WeakPolarHBondContact O-CB 3.41Å; I517-Y521 PolarHBondContact O-N 2.81Å; M518-Y521 PolarHBondContact O-N 2.71Å; I519-Y521 VanDerWaalsContact C-N 3.32Å; I519-Y521 PolarHBondContact O-N 2.97Å; Y521-S524 PolarHBondContact O-OG 3.37Å; Y521-P640 HydrophobicContact CE1-CG 3.97Å; Y521-P640 HydrophobicContact CE2-CG 4.07Å; Y521-P640 WeakPolarHBondContact OH-CG 3.42Å; Y521-F641 AromaticContact CD1-CE1 3.94Å; Y521-F641 HydrophobicContact CD1-CE1 3.94Å; Y521-F641 HydrophobicContact CD1-CZ 4.02Å; Y521-F641 HydrophobicContact CG-CE1 4.36Å
522	L	98.3	Very high	97.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.4	-46.3	178.5	-66.9	-178.8	0	0	0	112.2	M518 I519 Q520 S524 G525 Y531 I539 Y542 L543 L547 F638 F641	M518-L522 PolarHBondContact O-N 2.75Å; M518-L522 VanDerWaalsContact O-N 3.12Å; I519-L522 PolarHBondContact O-N 2.98Å; Q520-L522 PolarHBondContact O-N 3.46Å; L522-S524 VanDerWaalsContact C-N 3.3Å; L522-S524 PolarHBondContact O-N 2.86Å; L522-G525 PolarHBondContact O-N 3.5Å; L522-Y531 WeakPolarHBondContact CA-OH 3.47Å; L522-Y531 WeakPolarHBondContact O-CE2 3.44Å; L522-Y531 PolarHBondContact O-OH 3.48Å; L522-I539 HydrophobicContact CD2-CD1 4.48Å; L522-Y542 HydrophobicContact CD1-CD1 3.94Å; L522-L543 HydrophobicContact CB-CD1 4.44Å; L522-L543 HydrophobicContact CB-CD2 4.07Å; L522-L543 HydrophobicContact CB-CG 4.38Å; L522-L543 HydrophobicContact CD1-CD2 3.88Å; L522-L543 HydrophobicContact CD1-CG 3.92Å; L522-L547 HydrophobicContact CD1-CD1 3.66Å; L522-F638 HydrophobicContact CD1-CE1 3.86Å; L522-F638 HydrophobicContact CD2-CD1 4.07Å; L522-F638 HydrophobicContact CD2-CE1 3.75Å; L522-F638 HydrophobicContact CG-CE1 4.47Å; L522-F641 HydrophobicContact CD1-CE2 4.08Å; L522-F641 HydrophobicContact CD1-CZ 4.25Å; L522-F641 HydrophobicContact CD2-CE2 4.1Å; L522-F641 HydrophobicContact CD2-CZ 3.96Å; L522-F641 HydrophobicContact CG-CE2 4.09Å; L522-F641 HydrophobicContact CG-CZ 3.82Å
523	L	97.6	Very high	97	Very high	11 Å²	11	27.3 Å²	27.3	6%	0.058	14%	0.136	C	C	.	.	H	α-helix	trans	-62.7	-36.5	-178.8	-66.9	176.8	0	0	0	112.2	I519 Q520 G525 F526 E527 L543 Y600 Y736	I519-L523 HydrophobicContact CG2-CD1 3.6Å; I519-L523 HydrophobicContact CG2-CG 4.15Å; I519-L523 WeakPolarHBondContact O-CB 3.44Å; I519-L523 VanDerWaalsContact O-CG 3.29Å; I519-L523 WeakPolarHBondContact O-CG 3.45Å; I519-L523 PolarHBondContact O-N 2.75Å; Q520-L523 PolarHBondContact O-N 2.9Å; L523-G525 PolarHBondContact O-N 2.88Å; L523-F526 PolarHBondContact O-N 2.6Å; L523-E527 PolarHBondContact O-N 2.95Å; L523-L543 HydrophobicContact CD2-CD1 3.87Å; L523-L543 HydrophobicContact CD2-CD2 4.5Å; L523-Y600 HydrophobicContact CD1-CE1 4.39Å; L523-Y736 HydrophobicContact CB-CD1 3.84Å; L523-Y736 HydrophobicContact CB-CD2 4.27Å; L523-Y736 HydrophobicContact CB-CE1 3.94Å; L523-Y736 HydrophobicContact CB-CE2 4.39Å; L523-Y736 HydrophobicContact CB-CG 4.03Å; L523-Y736 HydrophobicContact CD1-CD2 3.95Å; L523-Y736 HydrophobicContact CD1-CE2 4.08Å; L523-Y736 HydrophobicContact CD1-CG 4.43Å; L523-Y736 HydrophobicContact CD2-CD1 4.46Å; L523-Y736 HydrophobicContact CD2-CD2 4.1Å; L523-Y736 HydrophobicContact CD2-CG 3.87Å; L523-Y736 HydrophobicContact CG-CD2 4.34Å; L523-Y736 HydrophobicContact CG-CG 4.33Å; L523-Y736 WeakPolarHBondContact O-CD1 3.39Å
524	S	97	Very high	96.8	Very high	6 Å²	6	28 Å²	28	4%	0.042	14%	0.139	C	C	.	.	H	α-helix	trans	-60.7	-25.5	175.2	74	0	0	0	0	113.1	R465 Q520 Y521 L522 F526 E527 L528	R465-S524 WeakPolarHBondContact CB-OG 3.2Å; R465-S524 VanDerWaalsContact CD-OG 3.29Å; R465-S524 WeakPolarHBondContact CD-OG 3.5Å; R465-S524 WeakPolarHBondContact CG-OG 3.28Å; Q520-S524 VanDerWaalsContact O-CB 3.31Å; Q520-S524 WeakPolarHBondContact O-CB 2.96Å; Q520-S524 PolarHBondContact O-N 3.38Å; Q520-S524 PolarHBondContact O-OG 3.13Å; Y521-S524 PolarHBondContact O-OG 3.37Å; L522-S524 VanDerWaalsContact C-N 3.3Å; L522-S524 PolarHBondContact O-N 2.86Å; S524-F526 VanDerWaalsContact C-N 3.32Å; S524-F526 PolarHBondContact O-N 2.89Å; S524-E527 PolarHBondContact O-N 3.4Å; S524-L528 VanDerWaalsContact O-CB 3.31Å; S524-L528 WeakPolarHBondContact O-CB 3.46Å; S524-L528 VanDerWaalsContact O-CG 3.28Å; S524-L528 WeakPolarHBondContact O-CG 3.46Å; S524-L528 PolarHBondContact O-N 2.68Å
525	G	97.4	Very high	96.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-70.7	-24.8	174.4	0	0	0	0	0	114	L522 L523 E529 L530 Y531	L522-G525 PolarHBondContact O-N 3.5Å; L523-G525 PolarHBondContact O-N 2.88Å; G525-E529 PolarHBondContact O-N 2.96Å; G525-L530 PolarHBondContact O-N 2.91Å; G525-Y531 VanDerWaalsContact CA-CE2 3.5Å
526	F	97.4	Very high	96.7	Very high	10 Å²	10	29.5 Å²	29.5	4%	0.044	15%	0.145	C	C	.	.	H	α-helix	trans	-74.4	-45.3	168.7	-71.8	-74.4	0	0	0	111.1	L523 S524 L528 E529 Y531 Y536 I539 Y540 L543 F731	L523-F526 PolarHBondContact O-N 2.6Å; S524-F526 VanDerWaalsContact C-N 3.32Å; S524-F526 PolarHBondContact O-N 2.89Å; F526-L528 VanDerWaalsContact C-N 3.26Å; F526-L528 PolarHBondContact O-N 2.91Å; F526-E529 PolarHBondContact O-N 2.86Å; F526-E529 VanDerWaalsContact O-N 3.1Å; F526-Y531 AromaticContact CD1-CD2 3.87Å; F526-Y531 HydrophobicContact CD1-CD2 3.87Å; F526-Y531 HydrophobicContact CD2-CD2 4.02Å; F526-Y531 AromaticContact CD2-CE2 3.87Å; F526-Y531 HydrophobicContact CD2-CE2 3.87Å; F526-Y531 AromaticContact CE1-CD2 3.89Å; F526-Y531 HydrophobicContact CE1-CD2 3.89Å; F526-Y531 HydrophobicContact CE2-CD2 4.05Å; F526-Y531 AromaticContact CE2-CE2 3.98Å; F526-Y531 HydrophobicContact CE2-CE2 3.98Å; F526-Y531 AromaticContact CG-CD2 3.93Å; F526-Y531 HydrophobicContact CG-CD2 3.93Å; F526-Y531 HydrophobicContact CG-CE2 4.15Å; F526-Y531 AromaticContact CZ-CD2 3.97Å; F526-Y531 HydrophobicContact CZ-CD2 3.97Å; F526-Y531 HydrophobicContact CZ-CE2 4.35Å; F526-Y536 HydrophobicContact CD1-CD1 4.48Å; F526-Y536 HydrophobicContact CD1-CE1 4.18Å; F526-Y536 AromaticContact CE1-CD1 3.62Å; F526-Y536 HydrophobicContact CE1-CD1 3.62Å; F526-Y536 AromaticContact CE1-CE1 3.75Å; F526-Y536 HydrophobicContact CE1-CE1 3.75Å; F526-Y536 HydrophobicContact CE1-CG 4.06Å; F526-Y536 HydrophobicContact CZ-CD1 4.4Å; F526-I539 HydrophobicContact CE2-CB 4.46Å; F526-I539 HydrophobicContact CE2-CG2 3.54Å; F526-I539 HydrophobicContact CZ-CB 4.22Å; F526-I539 HydrophobicContact CZ-CG2 3.78Å; F526-Y540 HydrophobicContact CE1-CE1 4.38Å; F526-Y540 AromaticContact CE1-CE2 3.79Å; F526-Y540 HydrophobicContact CE1-CE2 3.79Å; F526-Y540 AromaticContact CE1-CZ 3.64Å; F526-Y540 WeakPolarHBondContact CE1-OH 3.41Å; F526-Y540 HydrophobicContact CE2-CD1 4.28Å; F526-Y540 AromaticContact CE2-CE1 3.76Å; F526-Y540 HydrophobicContact CE2-CE1 3.76Å; F526-Y540 HydrophobicContact CE2-CE2 4.46Å; F526-Y540 AromaticContact CE2-CZ 3.87Å; F526-Y540 HydrophobicContact CZ-CD1 4.15Å; F526-Y540 HydrophobicContact CZ-CD2 4.04Å; F526-Y540 AromaticContact CZ-CE1 3.64Å; F526-Y540 HydrophobicContact CZ-CE1 3.64Å; F526-Y540 AromaticContact CZ-CE2 3.53Å; F526-Y540 HydrophobicContact CZ-CE2 3.53Å; F526-Y540 HydrophobicContact CZ-CG 4.32Å; F526-Y540 AromaticContact CZ-CZ 3.3Å; F526-L543 HydrophobicContact CE2-CD1 4.42Å; F526-F731 HydrophobicContact CD1-CE1 4.05Å; F526-F731 HydrophobicContact CD1-CZ 4.05Å
527	E	95.1	Very high	96.6	Very high	40 Å²	40	28.8 Å²	28.8	19%	0.187	14%	0.143	C	C	.	.	H	α-helix	trans	-60.3	-36.5	178.9	-178.7	-179.7	-154.3	0	0	112.5	R461 L523 S524 E529 K735 Y736	R461-E527 IonicContact CZ-OE1 2.62Å; R461-E527 IonicContact CZ-OE2 3.27Å; R461-E527 IonicContact NE-OE1 2.75Å; R461-E527 PolarHBondContact NE-OE1 3.37Å; R461-E527 IonicContact NE-OE2 2.84Å; R461-E527 PolarHBondContact NE-OE2 3.21Å; R461-E527 IonicContact NH2-OE1 2.71Å; R461-E527 IonicContact NH2-OE2 2.81Å; R461-E527 PolarHBondContact NH2-OE2 3.44Å; L523-E527 PolarHBondContact O-N 2.95Å; S524-E527 PolarHBondContact O-N 3.4Å; E527-E529 VanDerWaalsContact C-N 3.35Å; E527-K735 HydrophobicContact CB-CB 4.48Å; E527-K735 HydrophobicContact CG-CD 4.17Å; E527-K735 IonicContact OE1-NZ 2.75Å; E527-K735 PolarHBondContact OE1-NZ 3.02Å; E527-Y736 HydrophobicContact CB-CE1 4.31Å
528	L	95.9	Very high	96.6	Very high	53 Å²	53	28.6 Å²	28.6	28%	0.277	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	8.1	179.6	-63	171.9	0	0	0	113.2	R461 R465 S524 F526 L530	R461-L528 HydrophobicContact CB-CD2 4.03Å; R465-L528 HydrophobicContact CB-CD1 3.86Å; R465-L528 HydrophobicContact CG-CD1 4.46Å; S524-L528 VanDerWaalsContact O-CB 3.31Å; S524-L528 WeakPolarHBondContact O-CB 3.46Å; S524-L528 VanDerWaalsContact O-CG 3.28Å; S524-L528 WeakPolarHBondContact O-CG 3.46Å; S524-L528 PolarHBondContact O-N 2.68Å; F526-L528 VanDerWaalsContact C-N 3.26Å; F526-L528 PolarHBondContact O-N 2.91Å; L528-L530 VanDerWaalsContact C-N 3.26Å; L528-L530 HydrophobicContact CB-CD1 3.95Å; L528-L530 HydrophobicContact CB-CD2 4.3Å; L528-L530 HydrophobicContact CB-CG 3.75Å; L528-L530 HydrophobicContact CD1-CD1 4.22Å; L528-L530 PolarHBondContact O-N 3.26Å
529	E	96.1	Very high	96.6	Very high	177 Å²	177	28.6 Å²	28.6	83%	0.827	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.6	37.1	178.3	-57.1	-176.6	177.8	0	0	114.2	G525 F526 E527	G525-E529 PolarHBondContact O-N 2.96Å; F526-E529 PolarHBondContact O-N 2.86Å; F526-E529 VanDerWaalsContact O-N 3.1Å; E527-E529 VanDerWaalsContact C-N 3.35Å
530	L	96.7	Very high	96.6	Very high	63 Å²	63	28 Å²	28	33%	0.33	14%	0.139	S	C	.	.			trans	-86.3	-10.1	-175.6	-58.7	179.5	0	0	0	113.9	R465 G525 L528 R637	R465-L530 VanDerWaalsContact CZ-CD1 3.43Å; G525-L530 PolarHBondContact O-N 2.91Å; L528-L530 VanDerWaalsContact C-N 3.26Å; L528-L530 HydrophobicContact CB-CD1 3.95Å; L528-L530 HydrophobicContact CB-CD2 4.3Å; L528-L530 HydrophobicContact CB-CG 3.75Å; L528-L530 HydrophobicContact CD1-CD1 4.22Å; L528-L530 PolarHBondContact O-N 3.26Å; L530-R637 PolarHBondContact O-NH2 3.02Å
531	Y	96.4	Very high	96.6	Very high	10 Å²	10	27.1 Å²	27.1	4%	0.039	13%	0.134	C	C	.	.	S	Bend	trans	-107.8	131	179.7	-51.2	-44.3	0	0	0	110.8	L522 G525 F526 Y536 I539	L522-Y531 WeakPolarHBondContact CA-OH 3.47Å; L522-Y531 WeakPolarHBondContact O-CE2 3.44Å; L522-Y531 PolarHBondContact O-OH 3.48Å; G525-Y531 VanDerWaalsContact CA-CE2 3.5Å; F526-Y531 AromaticContact CD1-CD2 3.87Å; F526-Y531 HydrophobicContact CD1-CD2 3.87Å; F526-Y531 HydrophobicContact CD2-CD2 4.02Å; F526-Y531 AromaticContact CD2-CE2 3.87Å; F526-Y531 HydrophobicContact CD2-CE2 3.87Å; F526-Y531 AromaticContact CE1-CD2 3.89Å; F526-Y531 HydrophobicContact CE1-CD2 3.89Å; F526-Y531 HydrophobicContact CE2-CD2 4.05Å; F526-Y531 AromaticContact CE2-CE2 3.98Å; F526-Y531 HydrophobicContact CE2-CE2 3.98Å; F526-Y531 AromaticContact CG-CD2 3.93Å; F526-Y531 HydrophobicContact CG-CD2 3.93Å; F526-Y531 HydrophobicContact CG-CE2 4.15Å; F526-Y531 AromaticContact CZ-CD2 3.97Å; F526-Y531 HydrophobicContact CZ-CD2 3.97Å; F526-Y531 HydrophobicContact CZ-CE2 4.35Å; Y531-Y536 WeakPolarHBondContact O-CE1 3.33Å; Y531-I539 HydrophobicContact CD1-CD1 4.32Å; Y531-I539 HydrophobicContact CD1-CG1 4.3Å; Y531-I539 HydrophobicContact CD2-CG1 4.33Å; Y531-I539 HydrophobicContact CD2-CG2 4.36Å; Y531-I539 HydrophobicContact CE1-CD1 3.98Å; Y531-I539 HydrophobicContact CE1-CG1 4.35Å; Y531-I539 HydrophobicContact CE2-CG1 4.37Å; Y531-I539 HydrophobicContact CE2-CG2 3.92Å; Y531-I539 HydrophobicContact CG-CG1 4.31Å
532	S	93.6	Very high	96.6	Very high	60 Å²	60	26.3 Å²	26.3	42%	0.42	13%	0.131	S	C	.	.			trans	-76.6	155.8	166.9	-67.4	0	0	0	0	111.1	H534 E535 Y536	S532-H534 VanDerWaalsContact C-N 3.25Å; S532-H534 WeakPolarHBondContact CB-CE1 3.34Å; S532-H534 PolarHBondContact O-N 2.63Å; S532-H534 VanDerWaalsContact O-N 3.12Å; S532-E535 PolarHBondContact N-OE2 3.44Å; S532-E535 WeakPolarHBondContact O-CA 3.41Å; S532-E535 VanDerWaalsContact O-CB 3.28Å; S532-E535 WeakPolarHBondContact O-CB 3.3Å; S532-E535 PolarHBondContact O-N 3.17Å; S532-Y536 VanDerWaalsContact O-CD1 3.31Å; S532-Y536 WeakPolarHBondContact O-CD1 3.32Å
533	M	93.4	Very high	96.7	Very high	35 Å²	35	26.3 Å²	26.3	17%	0.172	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-49.8	-42.2	-179.4	178.6	-173.7	171.5	0	0	113.7	E535 Y536 M611 K619 V620 P727 F729	M533-E535 PolarHBondContact O-N 2.89Å; M533-Y536 WeakPolarHBondContact O-CB 3.14Å; M533-Y536 PolarHBondContact O-N 2.97Å; M533-M611 HydrophobicContact CE-CE 4.01Å; M533-M611 HydrophobicContact CG-CE 3.68Å; M533-M611 WeakPolarHBondContact O-CE 3.43Å; M533-K619 WeakPolarHBondContact CE-O 3.23Å; M533-V620 HydrophobicContact CE-CB 4.22Å; M533-V620 HydrophobicContact CE-CG1 4.35Å; M533-V620 HydrophobicContact CE-CG2 3.91Å; M533-V620 HydrophobicContact CG-CG1 4.48Å; M533-P727 HydrophobicContact CE-CG 3.88Å; M533-F729 HydrophobicContact CE-CE2 3.4Å; M533-F729 VanDerWaalsContact CE-CE2 3.4Å; M533-F729 HydrophobicContact CE-CZ 3.88Å; M533-F729 HydrophobicContact CG-CD2 4.44Å; M533-F729 HydrophobicContact CG-CE2 3.95Å; M533-F729 HydrophobicContact SD-CD2 4.41Å; M533-F729 HydrophobicContact SD-CE2 3.79Å
534	H	93.5	Very high	96.7	Very high	17 Å²	17	25.8 Å²	25.8	8%	0.079	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-70.5	-9.2	-179.3	64.1	-92.9	0	0	0	113.9	S532 Y537 V620 K622 F625	S532-H534 VanDerWaalsContact C-N 3.25Å; S532-H534 WeakPolarHBondContact CB-CE1 3.34Å; S532-H534 PolarHBondContact O-N 2.63Å; S532-H534 VanDerWaalsContact O-N 3.12Å; H534-Y537 VanDerWaalsContact O-CD1 3.3Å; H534-Y537 WeakPolarHBondContact O-CD1 3.45Å; H534-Y537 WeakPolarHBondContact O-CE1 3.28Å; H534-V620 HydrophobicContact CB-CG1 3.76Å; H534-K622 HydrophobicContact CB-CG 4.12Å; H534-F625 AromaticContact NE2-CZ 3.75Å
535	E	95.8	Very high	96.6	Very high	3 Å²	3	30 Å²	30	1%	0.014	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-93	-19.5	177.1	-54.3	-171.5	77.3	0	0	112.2	S532 M533 Y537 Y538 I539 R637	S532-E535 PolarHBondContact N-OE2 3.44Å; S532-E535 WeakPolarHBondContact O-CA 3.41Å; S532-E535 VanDerWaalsContact O-CB 3.28Å; S532-E535 WeakPolarHBondContact O-CB 3.3Å; S532-E535 PolarHBondContact O-N 3.17Å; M533-E535 PolarHBondContact O-N 2.89Å; E535-Y537 PolarHBondContact O-N 3.23Å; E535-Y537 VanDerWaalsContact O-N 3.09Å; E535-Y538 HydrophobicContact CB-CE1 4.06Å; E535-Y538 HydrophobicContact CB-CE2 3.96Å; E535-Y538 VanDerWaalsContact CB-CZ 3.48Å; E535-Y538 WeakPolarHBondContact CB-OH 3.16Å; E535-Y538 VanDerWaalsContact CD-OH 3.31Å; E535-Y538 HydrophobicContact CG-CE1 4.41Å; E535-Y538 WeakPolarHBondContact CG-OH 3.44Å; E535-Y538 WeakPolarHBondContact O-CD2 3.11Å; E535-Y538 WeakPolarHBondContact O-CE2 3.44Å; E535-Y538 PolarHBondContact O-N 3.05Å; E535-Y538 PolarHBondContact OE1-OH 3.39Å; E535-I539 WeakPolarHBondContact O-CG1 3.36Å; E535-I539 PolarHBondContact O-N 3.15Å; E535-R637 VanDerWaalsContact CD-NH2 3.35Å; E535-R637 IonicContact OE1-CZ 3.44Å; E535-R637 IonicContact OE1-NE 3.3Å; E535-R637 PolarHBondContact OE1-NE 3.18Å; E535-R637 IonicContact OE1-NH2 3.48Å; E535-R637 PolarHBondContact OE1-NH2 3.15Å; E535-R637 IonicContact OE2-CZ 3.81Å; E535-R637 IonicContact OE2-NE 3.62Å; E535-R637 IonicContact OE2-NH2 3.81Å; E535-R637 PolarHBondContact OE2-NH2 2.93Å
536	Y	97.1	Very high	96.6	Very high	28 Å²	28	31.1 Å²	31.1	11%	0.11	15%	0.152	C	C	.	.	H	α-helix	trans	-55.6	-36.2	-172.1	-71.6	0.1	0	0	0	113	F526 Y531 S532 M533 I539 Y540 M611 F729 F731	F526-Y536 HydrophobicContact CD1-CD1 4.48Å; F526-Y536 HydrophobicContact CD1-CE1 4.18Å; F526-Y536 AromaticContact CE1-CD1 3.62Å; F526-Y536 HydrophobicContact CE1-CD1 3.62Å; F526-Y536 AromaticContact CE1-CE1 3.75Å; F526-Y536 HydrophobicContact CE1-CE1 3.75Å; F526-Y536 HydrophobicContact CE1-CG 4.06Å; F526-Y536 HydrophobicContact CZ-CD1 4.4Å; Y531-Y536 WeakPolarHBondContact O-CE1 3.33Å; S532-Y536 VanDerWaalsContact O-CD1 3.31Å; S532-Y536 WeakPolarHBondContact O-CD1 3.32Å; M533-Y536 WeakPolarHBondContact O-CB 3.14Å; M533-Y536 PolarHBondContact O-N 2.97Å; Y536-I539 PolarHBondContact O-N 2.92Å; Y536-Y540 HydrophobicContact CD2-CE2 4.49Å; Y536-Y540 HydrophobicContact CG-CE2 4.35Å; Y536-Y540 WeakPolarHBondContact O-CB 3.32Å; Y536-Y540 WeakPolarHBondContact O-CD2 3.41Å; Y536-Y540 PolarHBondContact O-N 3.4Å; Y536-M611 HydrophobicContact CD2-CE 4.08Å; Y536-M611 HydrophobicContact CD2-SD 4.17Å; Y536-M611 HydrophobicContact CG-CE 4.42Å; Y536-F729 HydrophobicContact CE2-CG 4.29Å; Y536-F731 HydrophobicContact CE2-CE2 4.31Å; Y536-F731 HydrophobicContact CE2-CZ 4.11Å
537	Y	96.6	Very high	96.6	Very high	31 Å²	31	30.7 Å²	30.7	12%	0.122	15%	0.15	C	C	.	.	H	α-helix	trans	-65.1	-44.8	-172.7	84.5	-82.7	0	0	0	112.5	H534 E535 W541 Y608 V612 E630 F655	H534-Y537 VanDerWaalsContact O-CD1 3.3Å; H534-Y537 WeakPolarHBondContact O-CD1 3.45Å; H534-Y537 WeakPolarHBondContact O-CE1 3.28Å; E535-Y537 PolarHBondContact O-N 3.23Å; E535-Y537 VanDerWaalsContact O-N 3.09Å; Y537-W541 WeakPolarHBondContact O-CB 3.42Å; Y537-W541 PolarHBondContact O-N 2.88Å; Y537-Y608 HydrophobicContact CD2-CE2 4.32Å; Y537-Y608 WeakPolarHBondContact O-CD2 3.15Å; Y537-V612 HydrophobicContact CD2-CG2 4.32Å; Y537-E630 PolarHBondContact OH-OE1 3.21Å; Y537-E630 PolarHBondContact OH-OE2 2.99Å; Y537-F655 HydrophobicContact CD2-CZ 4.04Å; Y537-F655 AromaticContact CE2-CE1 3.9Å; Y537-F655 HydrophobicContact CE2-CE1 3.9Å; Y537-F655 AromaticContact CE2-CZ 3.44Å; Y537-F655 HydrophobicContact CE2-CZ 3.44Å; Y537-F655 VanDerWaalsContact CE2-CZ 3.44Å
538	Y	97.6	Very high	96.8	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-75.8	-28.5	178.5	56.2	-113.6	0	0	0	112.5	E535 Y542 E630 Y634 R637 F638 F655	E535-Y538 HydrophobicContact CB-CE1 4.06Å; E535-Y538 HydrophobicContact CB-CE2 3.96Å; E535-Y538 VanDerWaalsContact CB-CZ 3.48Å; E535-Y538 WeakPolarHBondContact CB-OH 3.16Å; E535-Y538 VanDerWaalsContact CD-OH 3.31Å; E535-Y538 HydrophobicContact CG-CE1 4.41Å; E535-Y538 WeakPolarHBondContact CG-OH 3.44Å; E535-Y538 WeakPolarHBondContact O-CD2 3.11Å; E535-Y538 WeakPolarHBondContact O-CE2 3.44Å; E535-Y538 PolarHBondContact O-N 3.05Å; E535-Y538 PolarHBondContact OE1-OH 3.39Å; Y538-Y542 VanDerWaalsContact O-CB 3.28Å; Y538-Y542 WeakPolarHBondContact O-CB 3.33Å; Y538-Y542 PolarHBondContact O-N 3Å; Y538-E630 HydrophobicContact CE1-CG 4.41Å; Y538-Y634 HydrophobicContact CD2-CD2 4.16Å; Y538-Y634 HydrophobicContact CG-CD2 4.08Å; Y538-R637 HydrophobicContact CE2-CG 4.06Å; Y538-F638 AromaticContact CD2-CE2 3.97Å; Y538-F638 HydrophobicContact CD2-CE2 3.97Å; Y538-F638 HydrophobicContact CD2-CZ 4.28Å; Y538-F655 VanDerWaalsContact CB-CZ 3.41Å
539	I	98.5	Very high	96.8	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-66.5	-51.5	173.4	-58	-62.9	0	0	0	110.2	L522 F526 Y531 E535 Y536 W541 Y542 L543 R637 F638	L522-I539 HydrophobicContact CD2-CD1 4.48Å; F526-I539 HydrophobicContact CE2-CB 4.46Å; F526-I539 HydrophobicContact CE2-CG2 3.54Å; F526-I539 HydrophobicContact CZ-CB 4.22Å; F526-I539 HydrophobicContact CZ-CG2 3.78Å; Y531-I539 HydrophobicContact CD1-CD1 4.32Å; Y531-I539 HydrophobicContact CD1-CG1 4.3Å; Y531-I539 HydrophobicContact CD2-CG1 4.33Å; Y531-I539 HydrophobicContact CD2-CG2 4.36Å; Y531-I539 HydrophobicContact CE1-CD1 3.98Å; Y531-I539 HydrophobicContact CE1-CG1 4.35Å; Y531-I539 HydrophobicContact CE2-CG1 4.37Å; Y531-I539 HydrophobicContact CE2-CG2 3.92Å; Y531-I539 HydrophobicContact CG-CG1 4.31Å; E535-I539 WeakPolarHBondContact O-CG1 3.36Å; E535-I539 PolarHBondContact O-N 3.15Å; Y536-I539 PolarHBondContact O-N 2.92Å; I539-W541 VanDerWaalsContact C-N 3.34Å; I539-W541 PolarHBondContact O-N 2.97Å; I539-Y542 PolarHBondContact O-N 3.23Å; I539-L543 HydrophobicContact CG2-CD1 4.15Å; I539-L543 WeakPolarHBondContact O-CG 3.31Å; I539-L543 PolarHBondContact O-N 3.01Å; I539-R637 HydrophobicContact CD1-CB 4.04Å; I539-R637 HydrophobicContact CD1-CG 4.15Å; I539-F638 HydrophobicContact CD1-CE1 4.42Å; I539-F638 HydrophobicContact CD1-CE2 4.44Å; I539-F638 HydrophobicContact CD1-CZ 3.88Å
540	Y	98.6	Very high	96.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-66.6	-35.1	178.5	-75.3	-56.3	0	0	0	112.6	F526 Y536 L543 S544 C604 M607 Y736 F737 P738	F526-Y540 HydrophobicContact CE1-CE1 4.38Å; F526-Y540 AromaticContact CE1-CE2 3.79Å; F526-Y540 HydrophobicContact CE1-CE2 3.79Å; F526-Y540 AromaticContact CE1-CZ 3.64Å; F526-Y540 WeakPolarHBondContact CE1-OH 3.41Å; F526-Y540 HydrophobicContact CE2-CD1 4.28Å; F526-Y540 AromaticContact CE2-CE1 3.76Å; F526-Y540 HydrophobicContact CE2-CE1 3.76Å; F526-Y540 HydrophobicContact CE2-CE2 4.46Å; F526-Y540 AromaticContact CE2-CZ 3.87Å; F526-Y540 HydrophobicContact CZ-CD1 4.15Å; F526-Y540 HydrophobicContact CZ-CD2 4.04Å; F526-Y540 AromaticContact CZ-CE1 3.64Å; F526-Y540 HydrophobicContact CZ-CE1 3.64Å; F526-Y540 AromaticContact CZ-CE2 3.53Å; F526-Y540 HydrophobicContact CZ-CE2 3.53Å; F526-Y540 HydrophobicContact CZ-CG 4.32Å; F526-Y540 AromaticContact CZ-CZ 3.3Å; Y536-Y540 HydrophobicContact CD2-CE2 4.49Å; Y536-Y540 HydrophobicContact CG-CE2 4.35Å; Y536-Y540 WeakPolarHBondContact O-CB 3.32Å; Y536-Y540 WeakPolarHBondContact O-CD2 3.41Å; Y536-Y540 PolarHBondContact O-N 3.4Å; Y540-L543 HydrophobicContact CD1-CD1 4.34Å; Y540-L543 PolarHBondContact O-N 3.28Å; Y540-S544 WeakPolarHBondContact O-CB 3.42Å; Y540-S544 PolarHBondContact O-N 3.32Å; Y540-S544 PolarHBondContact O-OG 3.12Å; Y540-S544 VanDerWaalsContact O-OG 3.12Å; Y540-C604 HydrophobicContact CD1-CB 4.22Å; Y540-M607 HydrophobicContact CD1-CB 4Å; Y540-M607 HydrophobicContact CD2-CB 3.49Å; Y540-M607 VanDerWaalsContact CD2-CB 3.49Å; Y540-M607 HydrophobicContact CD2-CG 4.4Å; Y540-M607 HydrophobicContact CE1-CB 4.16Å; Y540-M607 HydrophobicContact CE1-CG 4.3Å; Y540-M607 HydrophobicContact CE2-CB 3.65Å; Y540-M607 HydrophobicContact CE2-CE 4.07Å; Y540-M607 HydrophobicContact CE2-CG 4.08Å; Y540-M607 HydrophobicContact CG-CB 3.68Å; Y540-Y736 PolarHBondContact OH-O 3.22Å; Y540-F737 HydrophobicContact CD1-CE1 4.33Å; Y540-F737 AromaticContact CE1-CD1 3.84Å; Y540-F737 HydrophobicContact CE1-CD1 3.84Å; Y540-F737 AromaticContact CE1-CE1 3.77Å; Y540-F737 HydrophobicContact CE1-CE1 3.77Å; Y540-P738 WeakPolarHBondContact OH-CD 3.34Å
541	W	98.4	Very high	96.9	Very high	8 Å²	8	21.1 Å²	21.1	3%	0.03	11%	0.105	C	C	.	.	H	α-helix	trans	-60.3	-48.8	172.5	177.4	84.8	0	0	0	111.5	Y537 I539 L543 S544 E545 Y608 V650 F655 M658	Y537-W541 WeakPolarHBondContact O-CB 3.42Å; Y537-W541 PolarHBondContact O-N 2.88Å; I539-W541 VanDerWaalsContact C-N 3.34Å; I539-W541 PolarHBondContact O-N 2.97Å; W541-L543 VanDerWaalsContact C-N 3.28Å; W541-L543 PolarHBondContact O-N 3.13Å; W541-S544 PolarHBondContact O-N 3.43Å; W541-S544 PolarHBondContact O-OG 3.45Å; W541-E545 HydrophobicContact CD2-CB 4.5Å; W541-E545 HydrophobicContact CG-CG 4.29Å; W541-E545 HydrophobicContact CZ2-CB 4.33Å; W541-E545 WeakPolarHBondContact O-CB 3.42Å; W541-E545 PolarHBondContact O-N 2.89Å; W541-Y608 HydrophobicContact CB-CD1 4.48Å; W541-Y608 HydrophobicContact CB-CD2 3.65Å; W541-Y608 HydrophobicContact CB-CE2 3.86Å; W541-Y608 HydrophobicContact CB-CG 3.98Å; W541-Y608 AromaticContact CD1-CD1 3.99Å; W541-Y608 AromaticContact CD1-CE1 3.54Å; W541-Y608 AromaticContact CD1-CE2 3.75Å; W541-Y608 AromaticContact CD1-CZ 3.4Å; W541-Y608 VanDerWaalsContact CD1-CZ 3.4Å; W541-Y608 HydrophobicContact CG-CD2 4.33Å; W541-Y608 HydrophobicContact CG-CE1 4.49Å; W541-Y608 HydrophobicContact CG-CE2 4.1Å; W541-V650 HydrophobicContact CH2-CG1 3.98Å; W541-V650 HydrophobicContact CZ3-CG1 4.15Å; W541-F655 HydrophobicContact CB-CE2 4.11Å; W541-F655 AromaticContact CD2-CD2 3.46Å; W541-F655 HydrophobicContact CD2-CD2 3.46Å; W541-F655 VanDerWaalsContact CD2-CD2 3.46Å; W541-F655 AromaticContact CD2-CE2 3.41Å; W541-F655 HydrophobicContact CD2-CE2 3.41Å; W541-F655 VanDerWaalsContact CD2-CE2 3.41Å; W541-F655 AromaticContact CE2-CD2 3.83Å; W541-F655 AromaticContact CE3-CD2 3.21Å; W541-F655 HydrophobicContact CE3-CD2 3.21Å; W541-F655 AromaticContact CE3-CE2 3.51Å; W541-F655 HydrophobicContact CE3-CE2 3.51Å; W541-F655 HydrophobicContact CE3-CG 4.31Å; W541-F655 HydrophobicContact CG-CD2 4.23Å; W541-F655 AromaticContact CG-CE2 3.67Å; W541-F655 HydrophobicContact CG-CE2 3.67Å; W541-F655 HydrophobicContact CH2-CB 4.48Å; W541-F655 AromaticContact CH2-CD2 3.87Å; W541-F655 HydrophobicContact CH2-CD2 3.87Å; W541-F655 HydrophobicContact CZ2-CD2 4.04Å; W541-F655 HydrophobicContact CZ3-CB 4.26Å; W541-F655 AromaticContact CZ3-CD2 3.44Å; W541-F655 HydrophobicContact CZ3-CD2 3.44Å; W541-F655 VanDerWaalsContact CZ3-CD2 3.44Å; W541-F655 HydrophobicContact CZ3-CE2 4.21Å; W541-F655 HydrophobicContact CZ3-CG 4.26Å; W541-M658 HydrophobicContact CH2-CB 4.38Å; W541-M658 HydrophobicContact CH2-CE 3.59Å; W541-M658 HydrophobicContact CH2-SD 4.24Å; W541-M658 HydrophobicContact CZ2-CB 3.69Å; W541-M658 HydrophobicContact CZ2-CE 4.05Å; W541-M658 HydrophobicContact CZ2-SD 4.19Å
542	Y	98.6	Very high	96.9	Very high	1 Å²	1	22.3 Å²	22.3	0%	0.004	11%	0.111	C	C	.	.	I	π-helix	trans	-64.1	-37.7	-179.4	-161.1	-80.1	0	0	0	111	L522 Y538 I539 F546 L547 F638 F641 V650	L522-Y542 HydrophobicContact CD1-CD1 3.94Å; Y538-Y542 VanDerWaalsContact O-CB 3.28Å; Y538-Y542 WeakPolarHBondContact O-CB 3.33Å; Y538-Y542 PolarHBondContact O-N 3Å; I539-Y542 PolarHBondContact O-N 3.23Å; Y542-F546 HydrophobicContact CD1-CD1 4.1Å; Y542-F546 AromaticContact CE1-CD1 3.49Å; Y542-F546 HydrophobicContact CE1-CD1 3.49Å; Y542-F546 VanDerWaalsContact CE1-CD1 3.49Å; Y542-F546 HydrophobicContact CE1-CE1 4.01Å; Y542-F546 HydrophobicContact CE2-CD1 4.19Å; Y542-F546 AromaticContact CZ-CD1 3.53Å; Y542-F546 AromaticContact CZ-CE1 3.75Å; Y542-F546 VanDerWaalsContact O-CB 3.31Å; Y542-F546 WeakPolarHBondContact O-CB 3.45Å; Y542-F546 PolarHBondContact O-N 3.01Å; Y542-F546 WeakPolarHBondContact OH-CE1 3.27Å; Y542-L547 HydrophobicContact CD1-CD1 3.78Å; Y542-L547 HydrophobicContact CD1-CD2 4.41Å; Y542-L547 HydrophobicContact CD1-CG 3.69Å; Y542-L547 HydrophobicContact CE1-CD1 3.87Å; Y542-L547 HydrophobicContact CE1-CD2 3.85Å; Y542-L547 HydrophobicContact CE1-CG 3.64Å; Y542-L547 PolarHBondContact O-N 2.69Å; Y542-F638 HydrophobicContact CD1-CD1 4.1Å; Y542-F638 AromaticContact CD1-CE1 3.63Å; Y542-F638 HydrophobicContact CD1-CE1 3.63Å; Y542-F638 HydrophobicContact CD1-CZ 4.42Å; Y542-F638 AromaticContact CD2-CD1 3.94Å; Y542-F638 HydrophobicContact CD2-CD1 3.94Å; Y542-F638 AromaticContact CD2-CE1 3.57Å; Y542-F638 HydrophobicContact CD2-CE1 3.57Å; Y542-F638 HydrophobicContact CD2-CE2 4.23Å; Y542-F638 HydrophobicContact CD2-CG 4.4Å; Y542-F638 AromaticContact CD2-CZ 3.74Å; Y542-F638 HydrophobicContact CD2-CZ 3.74Å; Y542-F638 HydrophobicContact CE1-CD1 4.14Å; Y542-F638 HydrophobicContact CE1-CE1 4.15Å; Y542-F638 AromaticContact CE2-CD1 3.97Å; Y542-F638 HydrophobicContact CE2-CD1 3.97Å; Y542-F638 HydrophobicContact CE2-CE1 4.09Å; Y542-F638 HydrophobicContact CE2-CG 4.29Å; Y542-F638 HydrophobicContact CG-CD1 4.02Å; Y542-F638 AromaticContact CG-CE1 3.33Å; Y542-F638 HydrophobicContact CG-CE1 3.33Å; Y542-F638 AromaticContact CG-CZ 3.68Å; Y542-F638 HydrophobicContact CG-CZ 3.68Å; Y542-F641 HydrophobicContact CD1-CE2 4.36Å; Y542-F641 AromaticContact CE1-CD2 3.86Å; Y542-F641 HydrophobicContact CE1-CD2 3.86Å; Y542-F641 AromaticContact CE1-CE2 3.74Å; Y542-F641 HydrophobicContact CE1-CE2 3.74Å; Y542-F641 AromaticContact CZ-CD2 3.97Å; Y542-V650 HydrophobicContact CE2-CB 3.87Å; Y542-V650 HydrophobicContact CE2-CG2 4.21Å
543	L	98.5	Very high	96.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.111	C	C	.	.	I	π-helix	trans	-62.9	-50.6	171.6	-73.5	165	0	0	0	111.6	I519 L522 L523 F526 I539 Y540 W541 L547 Y548 C604	I519-L543 HydrophobicContact CB-CD2 4.49Å; I519-L543 HydrophobicContact CG1-CD2 4.3Å; I519-L543 HydrophobicContact CG2-CD2 4.26Å; L522-L543 HydrophobicContact CB-CD1 4.44Å; L522-L543 HydrophobicContact CB-CD2 4.07Å; L522-L543 HydrophobicContact CB-CG 4.38Å; L522-L543 HydrophobicContact CD1-CD2 3.88Å; L522-L543 HydrophobicContact CD1-CG 3.92Å; L523-L543 HydrophobicContact CD2-CD1 3.87Å; L523-L543 HydrophobicContact CD2-CD2 4.5Å; F526-L543 HydrophobicContact CE2-CD1 4.42Å; I539-L543 HydrophobicContact CG2-CD1 4.15Å; I539-L543 WeakPolarHBondContact O-CG 3.31Å; I539-L543 PolarHBondContact O-N 3.01Å; Y540-L543 HydrophobicContact CD1-CD1 4.34Å; Y540-L543 PolarHBondContact O-N 3.28Å; W541-L543 VanDerWaalsContact C-N 3.28Å; W541-L543 PolarHBondContact O-N 3.13Å; L543-L547 HydrophobicContact CD2-CD1 4.23Å; L543-Y548 HydrophobicContact CB-CD2 4.28Å; L543-Y548 HydrophobicContact CB-CE2 4.36Å; L543-Y548 HydrophobicContact CD2-CE2 4.27Å; L543-Y548 WeakPolarHBondContact O-CB 3.49Å; L543-Y548 WeakPolarHBondContact O-CD2 3.33Å; L543-Y548 PolarHBondContact O-N 3.42Å; L543-C604 HydrophobicContact CB-CB 4.13Å
544	S	97.9	Very high	97	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.103	C	C	.	.	I	π-helix	trans	-76.5	-52.1	-171.3	64.6	0	0	0	0	114.7	Y540 W541 Q601	Y540-S544 WeakPolarHBondContact O-CB 3.42Å; Y540-S544 PolarHBondContact O-N 3.32Å; Y540-S544 PolarHBondContact O-OG 3.12Å; Y540-S544 VanDerWaalsContact O-OG 3.12Å; W541-S544 PolarHBondContact O-N 3.43Å; W541-S544 PolarHBondContact O-OG 3.45Å; S544-Q601 WeakPolarHBondContact O-CG 3.11Å; S544-Q601 PolarHBondContact O-NE2 3.01Å
545	E	95.9	Very high	97.1	Very high	95 Å²	95	19.9 Å²	19.9	44%	0.444	10%	0.1	S	C	.	.	I	π-helix	trans	-84.1	-23	-171.5	-60.1	-56	144.7	0	0	111.9	W541 A549	W541-E545 HydrophobicContact CD2-CB 4.5Å; W541-E545 HydrophobicContact CG-CG 4.29Å; W541-E545 HydrophobicContact CZ2-CB 4.33Å; W541-E545 WeakPolarHBondContact O-CB 3.42Å; W541-E545 PolarHBondContact O-N 2.89Å; E545-A549 WeakPolarHBondContact O-CB 3.35Å
546	F	96.9	Very high	96.9	Very high	23 Å²	23	22.9 Å²	22.9	10%	0.101	12%	0.121	C	C	.	.	I	π-helix	trans	-114	-73.5	-175.7	-169.4	-105.5	0	0	0	112.5	Y542 A549 W550 P647 P648 V650	Y542-F546 HydrophobicContact CD1-CD1 4.1Å; Y542-F546 AromaticContact CE1-CD1 3.49Å; Y542-F546 HydrophobicContact CE1-CD1 3.49Å; Y542-F546 VanDerWaalsContact CE1-CD1 3.49Å; Y542-F546 HydrophobicContact CE1-CE1 4.01Å; Y542-F546 HydrophobicContact CE2-CD1 4.19Å; Y542-F546 AromaticContact CZ-CD1 3.53Å; Y542-F546 AromaticContact CZ-CE1 3.75Å; Y542-F546 VanDerWaalsContact O-CB 3.31Å; Y542-F546 WeakPolarHBondContact O-CB 3.45Å; Y542-F546 PolarHBondContact O-N 3.01Å; Y542-F546 WeakPolarHBondContact OH-CE1 3.27Å; F546-A549 PolarHBondContact O-N 3.2Å; F546-W550 AromaticContact CD2-CD1 3.85Å; F546-W550 AromaticContact CD2-NE1 3.81Å; F546-W550 AromaticContact CE2-CD1 3.74Å; F546-W550 AromaticContact CE2-NE1 3.35Å; F546-W550 AromaticContact CZ-NE1 3.79Å; F546-W550 VanDerWaalsContact O-CD1 3.27Å; F546-W550 PolarHBondContact O-N 2.91Å; F546-P647 HydrophobicContact CE1-CB 4.01Å; F546-P647 HydrophobicContact CE1-CG 3.65Å; F546-P647 HydrophobicContact CE2-CB 4.31Å; F546-P647 HydrophobicContact CZ-CB 3.53Å; F546-P647 HydrophobicContact CZ-CG 3.72Å; F546-P648 WeakPolarHBondContact CZ-O 3.33Å; F546-V650 HydrophobicContact CD1-CG2 4.31Å; F546-V650 HydrophobicContact CD2-CG2 3.59Å; F546-V650 HydrophobicContact CE1-CG2 4.26Å; F546-V650 HydrophobicContact CE2-CG2 3.53Å; F546-V650 HydrophobicContact CG-CG2 3.98Å; F546-V650 HydrophobicContact CZ-CG2 3.89Å
547	L	98.2	Very high	96.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.132	C	C	.	.	I	π-helix	trans	-64.9	-49.1	-169.7	-67.6	179.9	0	0	0	113.7	L515 M518 I519 L522 Y542 L543 A549 W550 L551 F641	L515-L547 HydrophobicContact CD2-CD2 3.98Å; M518-L547 HydrophobicContact CB-CD1 4.02Å; M518-L547 HydrophobicContact CB-CD2 4.08Å; M518-L547 HydrophobicContact CE-CD2 3.74Å; M518-L547 HydrophobicContact SD-CD2 3.93Å; I519-L547 HydrophobicContact CD1-CB 4.19Å; I519-L547 HydrophobicContact CG1-CB 3.76Å; I519-L547 HydrophobicContact CG1-CD1 3.93Å; I519-L547 HydrophobicContact CG1-CG 4.44Å; L522-L547 HydrophobicContact CD1-CD1 3.66Å; Y542-L547 HydrophobicContact CD1-CD1 3.78Å; Y542-L547 HydrophobicContact CD1-CD2 4.41Å; Y542-L547 HydrophobicContact CD1-CG 3.69Å; Y542-L547 HydrophobicContact CE1-CD1 3.87Å; Y542-L547 HydrophobicContact CE1-CD2 3.85Å; Y542-L547 HydrophobicContact CE1-CG 3.64Å; Y542-L547 PolarHBondContact O-N 2.69Å; L543-L547 HydrophobicContact CD2-CD1 4.23Å; L547-A549 VanDerWaalsContact C-N 3.32Å; L547-A549 PolarHBondContact O-N 2.97Å; L547-W550 PolarHBondContact O-N 3.24Å; L547-L551 WeakPolarHBondContact O-CB 3.19Å; L547-L551 PolarHBondContact O-N 2.5Å; L547-F641 HydrophobicContact CD1-CE2 4.44Å
548	Y	98.3	Very high	96.4	Very high	11 Å²	11	24.4 Å²	24.4	4%	0.043	13%	0.126	C	C	.	.	H	α-helix	trans	-67.6	-33.8	177.3	-81.3	-65.1	0	0	0	112	I519 L543 L551 M552 Y600 Q601	I519-Y548 HydrophobicContact CD1-CD1 4.09Å; I519-Y548 HydrophobicContact CD1-CE1 3.9Å; I519-Y548 HydrophobicContact CG2-CE1 4.48Å; I519-Y548 HydrophobicContact CG2-CE2 4.38Å; I519-Y548 WeakPolarHBondContact CG2-OH 3.24Å; L543-Y548 HydrophobicContact CB-CD2 4.28Å; L543-Y548 HydrophobicContact CB-CE2 4.36Å; L543-Y548 HydrophobicContact CD2-CE2 4.27Å; L543-Y548 WeakPolarHBondContact O-CB 3.49Å; L543-Y548 WeakPolarHBondContact O-CD2 3.33Å; L543-Y548 PolarHBondContact O-N 3.42Å; Y548-L551 HydrophobicContact CD1-CD2 4.07Å; Y548-L551 HydrophobicContact CE1-CD2 4.18Å; Y548-L551 PolarHBondContact O-N 3.43Å; Y548-M552 WeakPolarHBondContact O-CB 3.35Å; Y548-M552 VanDerWaalsContact O-CG 3.24Å; Y548-M552 WeakPolarHBondContact O-CG 3.14Å; Y548-M552 PolarHBondContact O-N 2.88Å; Y548-Y600 AromaticContact CZ-CD1 3.98Å; Y548-Y600 WeakPolarHBondContact OH-CD1 3.25Å; Y548-Q601 HydrophobicContact CD2-CB 4.5Å; Y548-Q601 HydrophobicContact CG-CB 4.08Å
549	A	96.6	Very high	95.9	Very high	36 Å²	36	25.1 Å²	25.1	30%	0.298	13%	0.13	S	C	.	.	H	α-helix	trans	-61.7	-45.1	174.4	0	0	0	0	0	111.5	E545 F546 L547 M552 S553	E545-A549 WeakPolarHBondContact O-CB 3.35Å; F546-A549 PolarHBondContact O-N 3.2Å; L547-A549 VanDerWaalsContact C-N 3.32Å; L547-A549 PolarHBondContact O-N 2.97Å; A549-M552 PolarHBondContact O-N 3.47Å; A549-S553 PolarHBondContact O-N 3.08Å; A549-S553 VanDerWaalsContact O-N 3.07Å
550	W	97.6	Very high	95.4	Very high	81 Å²	81	28.1 Å²	28.1	31%	0.307	15%	0.151	S	C	.	.	H	α-helix	trans	-63.7	-40.4	173.2	-87.1	103.5	0	0	0	112.8	L511 L515 F546 L547 S553 T554 T646 P647	L511-W550 HydrophobicContact CD2-CE3 4.41Å; L515-W550 HydrophobicContact CD1-CB 3.94Å; L515-W550 HydrophobicContact CD2-CB 3.72Å; F546-W550 AromaticContact CD2-CD1 3.85Å; F546-W550 AromaticContact CD2-NE1 3.81Å; F546-W550 AromaticContact CE2-CD1 3.74Å; F546-W550 AromaticContact CE2-NE1 3.35Å; F546-W550 AromaticContact CZ-NE1 3.79Å; F546-W550 VanDerWaalsContact O-CD1 3.27Å; F546-W550 PolarHBondContact O-N 2.91Å; L547-W550 PolarHBondContact O-N 3.24Å; W550-S553 PolarHBondContact O-N 3.13Å; W550-T554 WeakPolarHBondContact O-CB 3.46Å; W550-T554 PolarHBondContact O-N 3.38Å; W550-T554 PolarHBondContact O-OG1 3.46Å; W550-T646 HydrophobicContact CZ3-CG2 4.5Å; W550-P647 HydrophobicContact CD2-CB 3.61Å; W550-P647 HydrophobicContact CD2-CG 4.46Å; W550-P647 HydrophobicContact CE3-CB 4.24Å; W550-P647 HydrophobicContact CG-CB 3.81Å; W550-P647 HydrophobicContact CG-CG 4.24Å; W550-P647 HydrophobicContact CH2-CB 4.44Å; W550-P647 HydrophobicContact CZ2-CB 3.85Å
551	L	97.8	Very high	94.7	Very high	4 Å²	4	28.6 Å²	28.6	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-63.8	-45.3	177.7	-177.9	61	0	0	0	110.9	Y512 L515 I519 L547 Y548 S553 T554 L555 S597	Y512-L551 HydrophobicContact CD2-CD1 3.71Å; Y512-L551 HydrophobicContact CE2-CD1 4.06Å; L515-L551 HydrophobicContact CB-CD1 4.26Å; L515-L551 HydrophobicContact CD1-CB 4.3Å; L515-L551 HydrophobicContact CD1-CD1 4.47Å; I519-L551 HydrophobicContact CD1-CB 4.45Å; I519-L551 HydrophobicContact CD1-CD2 3.74Å; L547-L551 WeakPolarHBondContact O-CB 3.19Å; L547-L551 PolarHBondContact O-N 2.5Å; Y548-L551 HydrophobicContact CD1-CD2 4.07Å; Y548-L551 HydrophobicContact CE1-CD2 4.18Å; Y548-L551 PolarHBondContact O-N 3.43Å; L551-S553 PolarHBondContact O-N 2.97Å; L551-T554 PolarHBondContact O-N 2.79Å; L551-L555 HydrophobicContact CD1-CD1 4.25Å; L551-L555 HydrophobicContact CD1-CG 4.27Å; L551-L555 HydrophobicContact CG-CD1 3.98Å; L551-L555 HydrophobicContact CG-CG 4.45Å; L551-L555 WeakPolarHBondContact O-CB 3.27Å; L551-L555 WeakPolarHBondContact O-CG 3.44Å; L551-L555 PolarHBondContact O-N 3.34Å; L551-S597 WeakPolarHBondContact CD2-OG 3.14Å
552	M	95.1	Very high	94.1	Very high	36 Å²	36	29.2 Å²	29.2	18%	0.177	16%	0.158	C	C	.	.	H	α-helix	trans	-60.4	-44.1	176.4	-71.2	-41.8	-59.8	0	0	112.1	Y548 A549 T554 L555 S556 I594 S597 Q598	Y548-M552 WeakPolarHBondContact O-CB 3.35Å; Y548-M552 VanDerWaalsContact O-CG 3.24Å; Y548-M552 WeakPolarHBondContact O-CG 3.14Å; Y548-M552 PolarHBondContact O-N 2.88Å; A549-M552 PolarHBondContact O-N 3.47Å; M552-T554 VanDerWaalsContact C-N 3.33Å; M552-T554 PolarHBondContact O-N 2.95Å; M552-L555 PolarHBondContact O-N 3.42Å; M552-L555 HydrophobicContact SD-CD1 4.45Å; M552-S556 WeakPolarHBondContact O-CB 3.05Å; M552-S556 PolarHBondContact O-N 2.83Å; M552-I594 HydrophobicContact CE-CB 4.2Å; M552-I594 HydrophobicContact CE-CG1 4.32Å; M552-I594 HydrophobicContact CE-CG2 3.73Å; M552-S597 WeakPolarHBondContact SD-CB 3.06Å; M552-Q598 HydrophobicContact CE-CB 4.39Å; M552-Q598 HydrophobicContact SD-CB 4.41Å
553	S	94.7	Very high	93.3	Very high	60 Å²	60	31.9 Å²	31.9	42%	0.42	17%	0.171	S	C	.	.	H	α-helix	trans	-61.8	-42	175.4	-178.1	0	0	0	0	111.8	A549 W550 L551 S556 R557	A549-S553 PolarHBondContact O-N 3.08Å; A549-S553 VanDerWaalsContact O-N 3.07Å; W550-S553 PolarHBondContact O-N 3.13Å; L551-S553 PolarHBondContact O-N 2.97Å; S553-S556 PolarHBondContact O-N 3.27Å; S553-R557 WeakPolarHBondContact O-CG 3.41Å; S553-R557 PolarHBondContact O-N 3.4Å
554	T	95.7	Very high	92.6	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.4	-44.8	178.8	-60.1	0	0	0	0	111.9	T508 L511 W550 L551 M552 S556 R557 A558	T508-T554 HydrophobicContact CG2-CG2 3.81Å; T508-T554 VanDerWaalsContact O-CG2 3.3Å; T508-T554 WeakPolarHBondContact O-CG2 3.4Å; L511-T554 HydrophobicContact CB-CG2 4.47Å; L511-T554 HydrophobicContact CD2-CG2 4.36Å; L511-T554 WeakPolarHBondContact CD2-OG1 3.29Å; L511-T554 HydrophobicContact CG-CG2 4.36Å; W550-T554 WeakPolarHBondContact O-CB 3.46Å; W550-T554 PolarHBondContact O-N 3.38Å; W550-T554 PolarHBondContact O-OG1 3.46Å; L551-T554 PolarHBondContact O-N 2.79Å; M552-T554 VanDerWaalsContact C-N 3.33Å; M552-T554 PolarHBondContact O-N 2.95Å; T554-S556 VanDerWaalsContact C-N 3.33Å; T554-S556 PolarHBondContact O-N 3.21Å; T554-R557 PolarHBondContact O-N 2.93Å; T554-R557 PolarHBondContact OG1-NH2 3.14Å; T554-A558 PolarHBondContact O-N 3.37Å
555	L	94.6	Very high	91.7	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.3	-39.6	174	-70.6	168.3	0	0	0	111.9	F417 Y512 L551 M552 R557 A558 D559 L590 E593 I594	F417-L555 HydrophobicContact CE2-CD2 4.3Å; F417-L555 HydrophobicContact CZ-CD2 4.03Å; Y512-L555 HydrophobicContact CD2-CD2 4.04Å; Y512-L555 HydrophobicContact CE2-CD2 3.98Å; L551-L555 HydrophobicContact CD1-CD1 4.25Å; L551-L555 HydrophobicContact CD1-CG 4.27Å; L551-L555 HydrophobicContact CG-CD1 3.98Å; L551-L555 HydrophobicContact CG-CG 4.45Å; L551-L555 WeakPolarHBondContact O-CB 3.27Å; L551-L555 WeakPolarHBondContact O-CG 3.44Å; L551-L555 PolarHBondContact O-N 3.34Å; M552-L555 PolarHBondContact O-N 3.42Å; M552-L555 HydrophobicContact SD-CD1 4.45Å; L555-R557 VanDerWaalsContact C-N 3.35Å; L555-R557 PolarHBondContact O-N 2.94Å; L555-A558 PolarHBondContact O-N 2.76Å; L555-D559 PolarHBondContact O-N 3.39Å; L555-L590 HydrophobicContact CD2-CD1 4.33Å; L555-E593 HydrophobicContact CD1-CG 3.98Å; L555-E593 HydrophobicContact CD2-CG 4.12Å; L555-I594 HydrophobicContact CB-CD1 4.32Å; L555-I594 HydrophobicContact CB-CG1 3.83Å; L555-I594 HydrophobicContact CD1-CG1 3.99Å; L555-I594 HydrophobicContact CG-CG1 4.42Å
556	S	91.6	Very high	91	Very high	66 Å²	66	34 Å²	34	46%	0.462	19%	0.187	S	C	.	.	H	α-helix	trans	-64.4	-38.1	175.8	-172.6	0	0	0	0	112.4	M552 S553 T554 S560	M552-S556 WeakPolarHBondContact O-CB 3.05Å; M552-S556 PolarHBondContact O-N 2.83Å; S553-S556 PolarHBondContact O-N 3.27Å; T554-S556 VanDerWaalsContact C-N 3.33Å; T554-S556 PolarHBondContact O-N 3.21Å; S556-S560 WeakPolarHBondContact O-CB 3.49Å; S556-S560 PolarHBondContact O-N 3Å; S556-S560 PolarHBondContact O-OG 3.33Å
557	R	91	Very high	90.3	Very high	92 Å²	92	40.4 Å²	40.4	35%	0.347	21%	0.211	S	C	.	.	H	α-helix	trans	-66.3	-41.5	174.1	-74.2	-173.6	-65.2	165.8	-0.8	111.8	T508 S553 T554 L555 S560 S561	T508-R557 HydrophobicContact CG2-CB 4.13Å; S553-R557 WeakPolarHBondContact O-CG 3.41Å; S553-R557 PolarHBondContact O-N 3.4Å; T554-R557 PolarHBondContact O-N 2.93Å; T554-R557 PolarHBondContact OG1-NH2 3.14Å; L555-R557 VanDerWaalsContact C-N 3.35Å; L555-R557 PolarHBondContact O-N 2.94Å; R557-S560 PolarHBondContact O-N 3.43Å; R557-S561 WeakPolarHBondContact O-CB 3.46Å; R557-S561 PolarHBondContact O-N 3.36Å; R557-S561 PolarHBondContact O-OG 2.92Å
558	A	91.8	Very high	89.4	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.3	-50.4	175.5	0	0	0	0	0	111.6	F417 V418 T508 T554 L555 S560 S561 Q562 L590	F417-A558 HydrophobicContact CD1-CB 4.01Å; F417-A558 HydrophobicContact CE1-CB 3.62Å; F417-A558 HydrophobicContact CZ-CB 4.13Å; V418-A558 HydrophobicContact CG1-CB 4.03Å; T508-A558 HydrophobicContact CG2-CB 4.34Å; T554-A558 PolarHBondContact O-N 3.37Å; L555-A558 PolarHBondContact O-N 2.76Å; A558-S560 VanDerWaalsContact C-N 3.3Å; A558-S560 PolarHBondContact O-N 3.48Å; A558-S561 WeakPolarHBondContact O-CB 3.23Å; A558-S561 PolarHBondContact O-N 2.83Å; A558-S561 VanDerWaalsContact O-N 3.12Å; A558-Q562 WeakPolarHBondContact O-CG 3.45Å; A558-Q562 PolarHBondContact O-N 2.84Å; A558-L590 HydrophobicContact CB-CD1 3.63Å
559	D	88.7	Confident	88.2	Confident	14 Å²	14	44.7 Å²	44.7	8%	0.075	23%	0.234	C	C	.	.	H	α-helix	trans	-58.3	-41.4	176.8	-167.5	55	0	0	0	111.4	L555 S561 Q562 M563 R588	L555-D559 PolarHBondContact O-N 3.39Å; D559-S561 PolarHBondContact O-N 3.46Å; D559-Q562 PolarHBondContact O-N 2.88Å; D559-M563 WeakPolarHBondContact O-CG 2.98Å; D559-M563 PolarHBondContact O-N 3.28Å; D559-R588 IonicContact OD2-CZ 2.65Å; D559-R588 IonicContact OD2-NE 2.66Å
560	S	86.9	Confident	87.4	Confident	63 Å²	63	45.3 Å²	45.3	44%	0.441	23%	0.231	S	C	.	.	H	α-helix	trans	-63.9	-40.7	176.8	-59.5	0	0	0	0	112.6	S556 R557 A558 M563 A564	S556-S560 WeakPolarHBondContact O-CB 3.49Å; S556-S560 PolarHBondContact O-N 3Å; S556-S560 PolarHBondContact O-OG 3.33Å; R557-S560 PolarHBondContact O-N 3.43Å; A558-S560 VanDerWaalsContact C-N 3.3Å; A558-S560 PolarHBondContact O-N 3.48Å; S560-M563 PolarHBondContact O-N 3Å; S560-A564 WeakPolarHBondContact O-CB 3.3Å; S560-A564 PolarHBondContact O-N 3.09Å
561	S	84.8	Confident	86.3	Confident	10 Å²	10	47.8 Å²	47.8	7%	0.07	25%	0.246	C	C	.	.	H	α-helix	trans	-64.6	-43.6	178.1	-58.9	0	0	0	0	111.4	R557 A558 D559 M563 A564 E565	R557-S561 WeakPolarHBondContact O-CB 3.46Å; R557-S561 PolarHBondContact O-N 3.36Å; R557-S561 PolarHBondContact O-OG 2.92Å; A558-S561 WeakPolarHBondContact O-CB 3.23Å; A558-S561 PolarHBondContact O-N 2.83Å; A558-S561 VanDerWaalsContact O-N 3.12Å; D559-S561 PolarHBondContact O-N 3.46Å; S561-M563 PolarHBondContact O-N 2.7Å; S561-A564 PolarHBondContact O-N 3.04Å; S561-E565 PolarHBondContact O-N 3.37Å; S561-E565 VanDerWaalsContact O-N 3.11Å
562	Q	84.4	Confident	85	Confident	22 Å²	22	52.2 Å²	52.2	10%	0.103	27%	0.266	C	S	.	.	H	α-helix	trans	-60.6	-45.8	174.4	-67.1	-172.8	-36.3	0	0	112.3	Y416 F417 A558 D559 A564 E565 E566	Y416-Q562 PolarHBondContact O-NE2 2.83Å; F417-Q562 WeakPolarHBondContact O-CG 3.13Å; F417-Q562 PolarHBondContact O-NE2 2.9Å; A558-Q562 WeakPolarHBondContact O-CG 3.45Å; A558-Q562 PolarHBondContact O-N 2.84Å; D559-Q562 PolarHBondContact O-N 2.88Å; Q562-A564 VanDerWaalsContact C-N 3.33Å; Q562-A564 PolarHBondContact O-N 3.2Å; Q562-E565 PolarHBondContact O-N 3.32Å; Q562-E566 WeakPolarHBondContact O-CB 3.44Å; Q562-E566 PolarHBondContact O-N 3.28Å
563	M	83.4	Confident	83.6	Confident	56 Å²	56	55.5 Å²	55.5	28%	0.276	28%	0.284	S	S	.	.	H	α-helix	trans	-64.3	-37.3	179.1	-74.2	-164.6	175.7	0	0	112.6	D559 S560 S561 R567 R588	D559-M563 WeakPolarHBondContact O-CG 2.98Å; D559-M563 PolarHBondContact O-N 3.28Å; S560-M563 PolarHBondContact O-N 3Å; S561-M563 PolarHBondContact O-N 2.7Å; M563-R567 VanDerWaalsContact O-CG 3.28Å; M563-R567 WeakPolarHBondContact O-CG 3.23Å; M563-R567 PolarHBondContact O-N 3.18Å; M563-R588 HydrophobicContact CE-CG 4.43Å
564	A	82.8	Confident	81.9	Confident	40 Å²	40	59.9 Å²	59.9	33%	0.331	30%	0.295	S	S	.	.	H	α-helix	trans	-63.9	-47.4	176.8	0	0	0	0	0	111.1	S560 S561 Q562 E566 R567 I568	S560-A564 WeakPolarHBondContact O-CB 3.3Å; S560-A564 PolarHBondContact O-N 3.09Å; S561-A564 PolarHBondContact O-N 3.04Å; Q562-A564 VanDerWaalsContact C-N 3.33Å; Q562-A564 PolarHBondContact O-N 3.2Å; A564-E566 PolarHBondContact O-N 3.47Å; A564-R567 PolarHBondContact O-N 3.44Å; A564-I568 WeakPolarHBondContact O-CG1 3.42Å; A564-I568 PolarHBondContact O-N 3.4Å; A564-I568 VanDerWaalsContact O-N 3.11Å
565	E	79.5	Confident	79.9	Confident	27 Å²	27	63.1 Å²	63.1	13%	0.126	33%	0.329	C	S	.	.	H	α-helix	trans	-64.1	-40.2	177.9	-173.9	65.4	-168.9	0	0	111.8	S424 R500 S561 Q562 R567 I568 L569	S424-E565 VanDerWaalsContact CB-OE1 3.28Å; S424-E565 WeakPolarHBondContact CB-OE1 3.28Å; S424-E565 PolarHBondContact OG-OE1 3.41Å; R500-E565 IonicContact CZ-OE1 2.81Å; R500-E565 IonicContact CZ-OE2 3.47Å; R500-E565 IonicContact NE-OE2 3.8Å; R500-E565 IonicContact NH2-OE1 3Å; R500-E565 PolarHBondContact NH2-OE1 2.97Å; R500-E565 IonicContact NH2-OE2 3.78Å; R500-E565 PolarHBondContact NH2-OE2 2.79Å; S561-E565 PolarHBondContact O-N 3.37Å; S561-E565 VanDerWaalsContact O-N 3.11Å; Q562-E565 PolarHBondContact O-N 3.32Å; E565-R567 VanDerWaalsContact C-N 3.35Å; E565-R567 PolarHBondContact O-N 3.44Å; E565-I568 PolarHBondContact O-N 3.23Å; E565-L569 WeakPolarHBondContact O-CB 3.35Å; E565-L569 PolarHBondContact O-N 3.36Å
566	E	80.8	Confident	78	Confident	72 Å²	72	74.5 Å²	74.5	34%	0.336	37%	0.372	S	S	.	.	H	α-helix	trans	-62.4	-40.8	175.6	-173	176.5	-160.9	0	0	111.8	Q562 A564 L569 E570 K586	Q562-E566 WeakPolarHBondContact O-CB 3.44Å; Q562-E566 PolarHBondContact O-N 3.28Å; A564-E566 PolarHBondContact O-N 3.47Å; E566-L569 WeakPolarHBondContact O-CB 3.5Å; E566-L569 PolarHBondContact O-N 2.66Å; E566-E570 HydrophobicContact CG-CG 4.49Å; E566-E570 WeakPolarHBondContact O-CG 3.49Å; E566-E570 PolarHBondContact O-N 2.78Å; E566-K586 WeakPolarHBondContact OE1-CD 3.27Å; E566-K586 IonicContact OE1-NZ 3.93Å; E566-K586 PolarHBondContact OE1-NZ 2.88Å
567	R	81.6	Confident	75.8	Confident	159 Å²	159	76.1 Å²	76.1	60%	0.6	38%	0.383	S	S	*	.	H	α-helix	trans	-62.4	-45.5	176.7	-73.9	175.2	-164.3	-169.6	7.1	111.8	M563 A564 E565 L569 E570 E571	M563-R567 VanDerWaalsContact O-CG 3.28Å; M563-R567 WeakPolarHBondContact O-CG 3.23Å; M563-R567 PolarHBondContact O-N 3.18Å; A564-R567 PolarHBondContact O-N 3.44Å; E565-R567 VanDerWaalsContact C-N 3.35Å; E565-R567 PolarHBondContact O-N 3.44Å; R567-L569 VanDerWaalsContact C-N 3.27Å; R567-L569 PolarHBondContact O-N 2.99Å; R567-E570 PolarHBondContact O-N 3.43Å; R567-E571 WeakPolarHBondContact O-CG 3.33Å; R567-E571 PolarHBondContact O-N 2.93Å
568	I	79.1	Confident	73.6	Confident	48 Å²	48	77.7 Å²	77.7	25%	0.246	41%	0.408	C	S	.	.	H	α-helix	trans	-59	-43.5	175.9	-66.2	167	0	0	0	109.8	R500 A564 E565 E570 E571 Q572	R500-I568 HydrophobicContact CG-CD1 4.27Å; A564-I568 WeakPolarHBondContact O-CG1 3.42Å; A564-I568 PolarHBondContact O-N 3.4Å; A564-I568 VanDerWaalsContact O-N 3.11Å; E565-I568 PolarHBondContact O-N 3.23Å; I568-E570 PolarHBondContact O-N 3.31Å; I568-E571 PolarHBondContact O-N 3.09Å; I568-Q572 WeakPolarHBondContact O-CG 2.71Å; I568-Q572 PolarHBondContact O-N 3.36Å; I568-Q572 VanDerWaalsContact O-N 3.16Å
569	L	74.5	Confident	71.5	Confident	53 Å²	53	86.6 Å²	86.6	28%	0.277	45%	0.447	S	S	.	.	H	α-helix	trans	-62.2	-43	177.9	-166.6	77.8	0	0	0	112.4	K426 E565 E566 R567 L573	K426-L569 HydrophobicContact CD-CD1 3.63Å; K426-L569 HydrophobicContact CG-CD1 4.4Å; E565-L569 WeakPolarHBondContact O-CB 3.35Å; E565-L569 PolarHBondContact O-N 3.36Å; E566-L569 WeakPolarHBondContact O-CB 3.5Å; E566-L569 PolarHBondContact O-N 2.66Å; R567-L569 VanDerWaalsContact C-N 3.27Å; R567-L569 PolarHBondContact O-N 2.99Å; L569-L573 HydrophobicContact CG-CD1 4.37Å; L569-L573 WeakPolarHBondContact O-CD1 3.45Å; L569-L573 VanDerWaalsContact O-CG 3.27Å; L569-L573 WeakPolarHBondContact O-CG 3.31Å; L569-L573 PolarHBondContact O-N 3.5Å
570	E	78.4	Confident	69.5	Low	49 Å²	49	96.5 Å²	96.5	23%	0.229	49%	0.489	C	S	.	.	H	α-helix	trans	-67.9	-40.8	178.6	-75.2	-170.3	167.8	0	0	112.9	E566 R567 I568 Q572 L573 K574 K583	E566-E570 HydrophobicContact CG-CG 4.49Å; E566-E570 WeakPolarHBondContact O-CG 3.49Å; E566-E570 PolarHBondContact O-N 2.78Å; R567-E570 PolarHBondContact O-N 3.43Å; I568-E570 PolarHBondContact O-N 3.31Å; E570-Q572 VanDerWaalsContact C-N 3.34Å; E570-L573 PolarHBondContact O-N 2.69Å; E570-K574 WeakPolarHBondContact O-CG 3.38Å; E570-K574 PolarHBondContact O-N 3.23Å; E570-K583 IonicContact OE1-NZ 2.72Å; E570-K583 PolarHBondContact OE1-NZ 2.93Å; E570-K583 IonicContact OE2-NZ 2.64Å; E570-K583 PolarHBondContact OE2-NZ 3.45Å
571	E	76.4	Confident	67.5	Low	133 Å²	133	99.4 Å²	99.4	62%	0.621	51%	0.505	S	S	*	.	H	α-helix	trans	-63.8	-40.7	178	-75.5	175.8	178.4	0	0	111.6	R567 I568 L573 K574	R567-E571 WeakPolarHBondContact O-CG 3.33Å; R567-E571 PolarHBondContact O-N 2.93Å; I568-E571 PolarHBondContact O-N 3.09Å; E571-L573 VanDerWaalsContact C-N 3.32Å; E571-L573 PolarHBondContact O-N 2.98Å; E571-K574 PolarHBondContact O-N 2.92Å
572	Q	68.6	Low	65.5	Low	96 Å²	96	108.9 Å²	108.9	45%	0.449	54%	0.544	S	S	.	.	H	α-helix	trans	-68.4	-28.7	174.7	-68.6	177.3	-6.7	0	0	113.1	I568 E570	I568-Q572 WeakPolarHBondContact O-CG 2.71Å; I568-Q572 PolarHBondContact O-N 3.36Å; I568-Q572 VanDerWaalsContact O-N 3.16Å; E570-Q572 VanDerWaalsContact C-N 3.34Å
573	L	66.2	Low	63.8	Low	105 Å²	105	115.2 Å²	115.2	55%	0.55	57%	0.572	S	S	.	*	H	α-helix	trans	-77.7	-30.4	176.7	-74.8	167.3	0	0	0	113.1	L569 E570 E571 G575 R576	L569-L573 HydrophobicContact CG-CD1 4.37Å; L569-L573 WeakPolarHBondContact O-CD1 3.45Å; L569-L573 VanDerWaalsContact O-CG 3.27Å; L569-L573 WeakPolarHBondContact O-CG 3.31Å; L569-L573 PolarHBondContact O-N 3.5Å; E570-L573 PolarHBondContact O-N 2.69Å; E571-L573 VanDerWaalsContact C-N 3.32Å; E571-L573 PolarHBondContact O-N 2.98Å; L573-G575 PolarHBondContact O-N 3.38Å; L573-R576 PolarHBondContact O-N 3.03Å; L573-R576 VanDerWaalsContact O-N 3.16Å
574	K	58.9	Low	62	Low	152 Å²	152	121.6 Å²	121.6	66%	0.661	60%	0.598	S	S	*	*	H	α-helix	trans	-62.7	-18.4	175.2	-77	173.8	-175.4	166.9	0	113.3	E570 E571 R576	E570-K574 WeakPolarHBondContact O-CG 3.38Å; E570-K574 PolarHBondContact O-N 3.23Å; E571-K574 PolarHBondContact O-N 2.92Å; K574-R576 PolarHBondContact O-N 3.17Å
575	G	54.8	Low	60.4	Low	68 Å²	68	129.9 Å²	129.9	70%	0.701	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-6.3	173.1	0	0	0	0	0	115.6	L573	L573-G575 PolarHBondContact O-N 3.38Å
576	R	53.8	Low	59.3	Low	239 Å²	239	135.7 Å²	135.7	90%	0.902	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129	-8.2	-173.1	-82.6	-173.6	171.1	179.7	-2.2	119.3	L573 K574	L573-R576 PolarHBondContact O-N 3.03Å; L573-R576 VanDerWaalsContact O-N 3.16Å; K574-R576 PolarHBondContact O-N 3.17Å
577	S	46.4	Very low	58.2	Low	100 Å²	100	138.8 Å²	138.8	70%	0.699	68%	0.675	S	S	*	*			trans	-169.8	139.8	158	63.3	0	0	0	0	113.3	K579	S577-K579 PolarHBondContact O-N 2.93Å
578	S	43.9	Very low	57.6	Low	125 Å²	125	138.3 Å²	138.3	87%	0.874	67%	0.673	S	S	*	*			trans	-90	86.6	176.4	56.4	0	0	0	0	111.6
579	K	46.7	Very low	57	Low	188 Å²	188	140.2 Å²	140.2	82%	0.817	69%	0.689	S	S	*	*			trans	-139.7	106.2	157.4	-106.5	174	-176	172.6	0	110.2	S577 T581	S577-K579 PolarHBondContact O-N 2.93Å; K579-T581 PolarHBondContact O-N 3.29Å
580	K	47.7	Very low	57.4	Low	221 Å²	221	138.3 Å²	138.3	96%	0.961	68%	0.678	S	S	*	*			trans	-70.7	90.1	174.9	-78.9	-179.6	176.8	174.6	0	109.6
581	T	43.9	Very low	57.7	Low	125 Å²	125	137 Å²	137	77%	0.767	68%	0.678	S	S	*	*			trans	-80	132.8	164.6	-23.7	0	0	0	0	108.7	K579 K583	K579-T581 PolarHBondContact O-N 3.29Å; T581-K583 PolarHBondContact O-N 3.11Å; T581-K583 VanDerWaalsContact O-N 3.07Å
582	K	43.8	Very low	58.2	Low	208 Å²	208	136.6 Å²	136.6	90%	0.904	67%	0.674	S	S	*	*			trans	-49.7	114.4	179.2	-87.4	177.6	173.4	175.1	0	110.2	K584	K582-K584 PolarHBondContact O-N 3.43Å; K582-K584 VanDerWaalsContact O-N 3.07Å
583	K	48.7	Very low	59.2	Low	155 Å²	155	134 Å²	134	67%	0.674	66%	0.662	S	S	*	*			trans	-61.4	109.9	176.1	-73.5	-168.2	178.4	-162.9	0	109.1	E570 T581 K585	E570-K583 IonicContact OE1-NZ 2.72Å; E570-K583 PolarHBondContact OE1-NZ 2.93Å; E570-K583 IonicContact OE2-NZ 2.64Å; E570-K583 PolarHBondContact OE2-NZ 3.45Å; T581-K583 PolarHBondContact O-N 3.11Å; T581-K583 VanDerWaalsContact O-N 3.07Å; K583-K585 PolarHBondContact O-N 3.17Å
584	K	45.7	Very low	60.4	Low	190 Å²	190	130.7 Å²	130.7	83%	0.826	65%	0.645	S	S	*	*			trans	-57.5	133.6	161.1	-80.2	-176.7	174.8	-179.8	0	107.4	K582 K586	K582-K584 PolarHBondContact O-N 3.43Å; K582-K584 VanDerWaalsContact O-N 3.07Å; K584-K586 PolarHBondContact O-N 3.39Å
585	K	48.4	Very low	62	Low	214 Å²	214	125.2 Å²	125.2	93%	0.93	62%	0.624	S	S	*	*			trans	-59.5	103.5	174	-144.1	179.8	-173.3	-176.6	0	106.7	K583	K583-K585 PolarHBondContact O-N 3.17Å
586	K	57.2	Low	63.9	Low	150 Å²	150	123.4 Å²	123.4	65%	0.652	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-69.4	141.4	-178.2	-72.9	-176.9	-176.4	174.9	0	109.3	E566 K584 R588	E566-K586 WeakPolarHBondContact OE1-CD 3.27Å; E566-K586 IonicContact OE1-NZ 3.93Å; E566-K586 PolarHBondContact OE1-NZ 2.88Å; K584-K586 PolarHBondContact O-N 3.39Å; K586-R588 PolarHBondContact O-N 2.89Å
587	V	57.8	Low	65.9	Low	137 Å²	137	112.5 Å²	112.5	83%	0.83	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-66.6	128.9	177.8	-179	0	0	0	0	108	P589	V587-P589 WeakPolarHBondContact O-CD 3.43Å
588	R	67.6	Low	68.3	Low	148 Å²	148	111.3 Å²	111.3	56%	0.558	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-69.6	119.4	172.7	-82.7	-173.3	175.8	179.9	-7	109.1	D559 M563 K586 L590 G591	D559-R588 IonicContact OD2-CZ 2.65Å; D559-R588 IonicContact OD2-NE 2.66Å; M563-R588 HydrophobicContact CE-CG 4.43Å; K586-R588 PolarHBondContact O-N 2.89Å; R588-L590 VanDerWaalsContact C-N 3.29Å; R588-L590 PolarHBondContact O-N 2.68Å; R588-G591 PolarHBondContact O-N 2.95Å; R588-G591 VanDerWaalsContact O-N 3.09Å
589	P	67.8	Low	70.9	Confident	89 Å²	89	105.3 Å²	105.3	58%	0.578	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-39.7	-174.3	-24.2	33.3	0	0	0	113.5	V587	V587-P589 WeakPolarHBondContact O-CD 3.43Å
590	L	83	Confident	73.3	Confident	12 Å²	12	97.4 Å²	97.4	6%	0.063	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	4.9	-177.8	-54.8	-179.7	0	0	0	113.7	F417 L555 A558 R588 K592 E593 I594	F417-L590 HydrophobicContact CD2-CD1 4.5Å; F417-L590 HydrophobicContact CD2-CD2 3.55Å; F417-L590 HydrophobicContact CE2-CD1 4.19Å; F417-L590 HydrophobicContact CE2-CD2 3.48Å; F417-L590 VanDerWaalsContact CE2-CD2 3.48Å; F417-L590 HydrophobicContact CE2-CG 4.5Å; F417-L590 HydrophobicContact CZ-CD1 4.39Å; F417-L590 HydrophobicContact CZ-CD2 4.42Å; L555-L590 HydrophobicContact CD2-CD1 4.33Å; A558-L590 HydrophobicContact CB-CD1 3.63Å; R588-L590 VanDerWaalsContact C-N 3.29Å; R588-L590 PolarHBondContact O-N 2.68Å; L590-K592 PolarHBondContact O-N 3.2Å; L590-E593 PolarHBondContact O-N 2.64Å; L590-I594 HydrophobicContact CB-CD1 4.09Å; L590-I594 HydrophobicContact CB-CG1 4.48Å; L590-I594 WeakPolarHBondContact O-CB 3.45Å; L590-I594 WeakPolarHBondContact O-CG1 3.42Å; L590-I594 PolarHBondContact O-N 3.19Å
591	G	84.9	Confident	75.7	Confident	21 Å²	21	89 Å²	89	22%	0.216	43%	0.429	C	S	.	.	H	α-helix	trans	-61.5	-41.1	-172	0	0	0	0	0	113.8	R588 T595	R588-G591 PolarHBondContact O-N 2.95Å; R588-G591 VanDerWaalsContact O-N 3.09Å; G591-T595 WeakPolarHBondContact O-CB 3.37Å; G591-T595 PolarHBondContact O-N 2.97Å; G591-T595 VanDerWaalsContact O-N 3.08Å; G591-T595 PolarHBondContact O-OG1 2.91Å
592	K	86	Confident	78.3	Confident	126 Å²	126	83.9 Å²	83.9	55%	0.548	40%	0.397	S	S	.	.	H	α-helix	trans	-62.6	-48.7	177.5	-174.2	-176.5	-180	-174.8	0	110.6	L590 T595 M596 D695	L590-K592 PolarHBondContact O-N 3.2Å; K592-T595 WeakPolarHBondContact O-CB 3.38Å; K592-T595 PolarHBondContact O-N 3.41Å; K592-M596 WeakPolarHBondContact O-CG 3.29Å; K592-M596 PolarHBondContact O-N 2.89Å; K592-D695 IonicContact NZ-OD2 3.26Å; K592-D695 PolarHBondContact NZ-OD2 3.33Å
593	E	89.3	Confident	80.9	Confident	42 Å²	42	74 Å²	74	20%	0.196	35%	0.354	C	S	.	.	H	α-helix	trans	-66.2	-42	-177	-179.4	162.6	-142.1	0	0	113	Y512 R516 L555 L590 T595 M596 S597	Y512-E593 VanDerWaalsContact CE2-CD 3.5Å; Y512-E593 WeakPolarHBondContact CE2-OE1 3.36Å; Y512-E593 PolarHBondContact OH-OE1 3.42Å; Y512-E593 PolarHBondContact OH-OE2 3.39Å; R516-E593 IonicContact NH1-OE1 3.19Å; L555-E593 HydrophobicContact CD1-CG 3.98Å; L555-E593 HydrophobicContact CD2-CG 4.12Å; L590-E593 PolarHBondContact O-N 2.64Å; E593-T595 VanDerWaalsContact C-N 3.3Å; E593-T595 PolarHBondContact O-N 3.32Å; E593-M596 PolarHBondContact O-N 2.8Å; E593-S597 VanDerWaalsContact O-CB 3.23Å; E593-S597 WeakPolarHBondContact O-CB 3.34Å; E593-S597 PolarHBondContact O-N 3.33Å; E593-S597 PolarHBondContact O-OG 3.14Å
594	I	92.6	Very high	83.3	Confident	35 Å²	35	66.6 Å²	66.6	18%	0.179	32%	0.322	C	S	.	.	H	α-helix	trans	-56.4	-47.3	171.8	-77.1	170.2	0	0	0	110.4	M552 L555 L590 Q598	M552-I594 HydrophobicContact CE-CB 4.2Å; M552-I594 HydrophobicContact CE-CG1 4.32Å; M552-I594 HydrophobicContact CE-CG2 3.73Å; L555-I594 HydrophobicContact CB-CD1 4.32Å; L555-I594 HydrophobicContact CB-CG1 3.83Å; L555-I594 HydrophobicContact CD1-CG1 3.99Å; L555-I594 HydrophobicContact CG-CG1 4.42Å; L590-I594 HydrophobicContact CB-CD1 4.09Å; L590-I594 HydrophobicContact CB-CG1 4.48Å; L590-I594 WeakPolarHBondContact O-CB 3.45Å; L590-I594 WeakPolarHBondContact O-CG1 3.42Å; L590-I594 PolarHBondContact O-N 3.19Å; I594-Q598 VanDerWaalsContact O-CB 3.28Å; I594-Q598 WeakPolarHBondContact O-CB 3.44Å; I594-Q598 PolarHBondContact O-N 3.18Å
595	T	93	Very high	85.8	Confident	37 Å²	37	57.8 Å²	57.8	23%	0.227	28%	0.284	C	S	.	.	H	α-helix	trans	-63.5	-47	-178.3	-56.3	0	0	0	0	111.2	G591 K592 E593 Q598 A599 I687 V691	G591-T595 WeakPolarHBondContact O-CB 3.37Å; G591-T595 PolarHBondContact O-N 2.97Å; G591-T595 VanDerWaalsContact O-N 3.08Å; G591-T595 PolarHBondContact O-OG1 2.91Å; K592-T595 WeakPolarHBondContact O-CB 3.38Å; K592-T595 PolarHBondContact O-N 3.41Å; E593-T595 VanDerWaalsContact C-N 3.3Å; E593-T595 PolarHBondContact O-N 3.32Å; T595-Q598 PolarHBondContact O-N 3.46Å; T595-A599 PolarHBondContact O-N 2.85Å; T595-I687 HydrophobicContact CG2-CG2 3.51Å; T595-I687 WeakPolarHBondContact O-CG2 3.37Å; T595-V691 HydrophobicContact CG2-CG2 3.76Å
596	M	93.7	Very high	88.2	Confident	30 Å²	30	47.6 Å²	47.6	15%	0.148	24%	0.24	C	C	.	.	H	α-helix	trans	-66.3	-44.5	178.8	-71.5	-54.9	-63.1	0	0	112.3	K592 E593 Q598 A599 Y600 L688 E697 V698	K592-M596 WeakPolarHBondContact O-CG 3.29Å; K592-M596 PolarHBondContact O-N 2.89Å; E593-M596 PolarHBondContact O-N 2.8Å; M596-Q598 VanDerWaalsContact C-N 3.3Å; M596-Q598 PolarHBondContact O-N 3.38Å; M596-A599 PolarHBondContact O-N 3.35Å; M596-Y600 HydrophobicContact CE-CD2 4.35Å; M596-Y600 HydrophobicContact CE-CE2 3.95Å; M596-Y600 PolarHBondContact O-N 3.34Å; M596-L688 HydrophobicContact CE-CD2 4.32Å; M596-L688 HydrophobicContact SD-CD2 3.94Å; M596-E697 HydrophobicContact CE-CG 4.15Å; M596-V698 HydrophobicContact CE-CG2 4.23Å; M596-V698 HydrophobicContact SD-CG2 3.69Å
597	S	96.1	Very high	90.2	Very high	10 Å²	10	40.4 Å²	40.4	7%	0.07	21%	0.209	C	C	.	.	H	α-helix	trans	-60.8	-40.4	177.3	-61.4	0	0	0	0	111.5	L551 M552 E593 Y600 Q601	L551-S597 WeakPolarHBondContact CD2-OG 3.14Å; M552-S597 WeakPolarHBondContact SD-CB 3.06Å; E593-S597 VanDerWaalsContact O-CB 3.23Å; E593-S597 WeakPolarHBondContact O-CB 3.34Å; E593-S597 PolarHBondContact O-N 3.33Å; E593-S597 PolarHBondContact O-OG 3.14Å; S597-Y600 PolarHBondContact O-N 3.32Å; S597-Q601 WeakPolarHBondContact O-CB 3.02Å; S597-Q601 PolarHBondContact O-N 2.88Å
598	Q	96.6	Very high	92.1	Very high	74 Å²	74	34.9 Å²	34.9	35%	0.346	17%	0.173	S	C	.	.	H	α-helix	trans	-68.1	-37.6	176.3	-164.8	-178	4.6	0	0	112.5	M552 I594 T595 M596 N602 I687	M552-Q598 HydrophobicContact CE-CB 4.39Å; M552-Q598 HydrophobicContact SD-CB 4.41Å; I594-Q598 VanDerWaalsContact O-CB 3.28Å; I594-Q598 WeakPolarHBondContact O-CB 3.44Å; I594-Q598 PolarHBondContact O-N 3.18Å; T595-Q598 PolarHBondContact O-N 3.46Å; M596-Q598 VanDerWaalsContact C-N 3.3Å; M596-Q598 PolarHBondContact O-N 3.38Å; Q598-N602 PolarHBondContact O-N 3.43Å; Q598-N602 PolarHBondContact O-ND2 2.87Å; Q598-I687 HydrophobicContact CB-CD1 4.25Å; Q598-I687 HydrophobicContact CG-CD1 3.69Å
599	A	97.6	Very high	93.6	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.2	-47.7	174.3	0	0	0	0	0	111.1	T595 M596 Q601 N602 M603 I687 L688	T595-A599 PolarHBondContact O-N 2.85Å; M596-A599 PolarHBondContact O-N 3.35Å; A599-Q601 PolarHBondContact O-N 3.2Å; A599-N602 PolarHBondContact O-N 2.87Å; A599-M603 WeakPolarHBondContact O-CG 3.48Å; A599-M603 PolarHBondContact O-N 3.48Å; A599-I687 HydrophobicContact CB-CG2 4.1Å; A599-L688 HydrophobicContact CB-CD1 4.19Å; A599-L688 HydrophobicContact CB-CD2 3.63Å; A599-L688 HydrophobicContact CB-CG 3.73Å
600	Y	98.1	Very high	95	Very high	21 Å²	21	25.7 Å²	25.7	8%	0.082	13%	0.128	C	C	.	.	H	α-helix	trans	-63.3	-39.3	177.5	-92.7	-122.6	0	0	0	112.7	L523 Y548 M596 S597 N602 M603 C604 E697 H734 Y736 F737	L523-Y600 HydrophobicContact CD1-CE1 4.39Å; Y548-Y600 AromaticContact CZ-CD1 3.98Å; Y548-Y600 WeakPolarHBondContact OH-CD1 3.25Å; M596-Y600 HydrophobicContact CE-CD2 4.35Å; M596-Y600 HydrophobicContact CE-CE2 3.95Å; M596-Y600 PolarHBondContact O-N 3.34Å; S597-Y600 PolarHBondContact O-N 3.32Å; Y600-N602 VanDerWaalsContact C-N 3.3Å; Y600-N602 PolarHBondContact O-N 3.02Å; Y600-M603 PolarHBondContact O-N 3.18Å; Y600-C604 WeakPolarHBondContact O-CB 3.37Å; Y600-C604 PolarHBondContact O-N 3.24Å; Y600-C604 PolarHBondContact O-SG 2.55Å; Y600-E697 VanDerWaalsContact OH-CD 3.31Å; Y600-E697 PolarHBondContact OH-OE1 3.46Å; Y600-H734 PolarHBondContact OH-NE2 2.64Å; Y600-Y736 HydrophobicContact CE1-CD2 4.01Å; Y600-Y736 HydrophobicContact CE1-CE2 4.46Å; Y600-F737 AromaticContact CD1-CE2 3.76Å; Y600-F737 HydrophobicContact CD1-CE2 3.76Å; Y600-F737 AromaticContact CD1-CZ 3.91Å; Y600-F737 HydrophobicContact CD1-CZ 3.91Å; Y600-F737 HydrophobicContact CD2-CE2 4.41Å; Y600-F737 AromaticContact CE1-CE2 3.8Å; Y600-F737 HydrophobicContact CE1-CE2 3.8Å; Y600-F737 HydrophobicContact CE1-CZ 4.33Å; Y600-F737 HydrophobicContact CE2-CE2 4.38Å; Y600-F737 HydrophobicContact CG-CE2 4.11Å; Y600-F737 HydrophobicContact CG-CZ 4.3Å
601	Q	98.4	Very high	95.7	Very high	46 Å²	46	25.3 Å²	25.3	22%	0.215	13%	0.126	C	C	.	.	H	α-helix	trans	-56.4	-45.9	172.9	-170.6	179.1	28.9	0	0	111.3	S544 Y548 S597 A599 C604 A605	S544-Q601 WeakPolarHBondContact O-CG 3.11Å; S544-Q601 PolarHBondContact O-NE2 3.01Å; Y548-Q601 HydrophobicContact CD2-CB 4.5Å; Y548-Q601 HydrophobicContact CG-CB 4.08Å; S597-Q601 WeakPolarHBondContact O-CB 3.02Å; S597-Q601 PolarHBondContact O-N 2.88Å; A599-Q601 PolarHBondContact O-N 3.2Å; Q601-C604 PolarHBondContact O-N 3.09Å; Q601-A605 WeakPolarHBondContact O-CB 3.49Å; Q601-A605 PolarHBondContact O-N 2.96Å
602	N	98.6	Very high	96.3	Very high	17 Å²	17	25.4 Å²	25.4	9%	0.091	12%	0.122	C	C	.	.	H	α-helix	trans	-69.6	-37.4	178.1	-81.5	-77.7	0	0	0	112.4	Q598 A599 Y600 A605 G606 H680 A684	Q598-N602 PolarHBondContact O-N 3.43Å; Q598-N602 PolarHBondContact O-ND2 2.87Å; A599-N602 PolarHBondContact O-N 2.87Å; Y600-N602 VanDerWaalsContact C-N 3.3Å; Y600-N602 PolarHBondContact O-N 3.02Å; N602-A605 PolarHBondContact O-N 3.42Å; N602-G606 PolarHBondContact O-N 3.28Å; N602-H680 WeakPolarHBondContact O-CB 3.47Å; N602-H680 PolarHBondContact OD1-ND1 3.43Å; N602-A684 HydrophobicContact CB-CB 3.84Å
603	M	98.6	Very high	96.8	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-60.6	-46.1	172.6	-69.8	-63.4	-66.8	0	0	111.3	A599 Y600 G606 M607 F681 A684 T701 V704 A705 F737	A599-M603 WeakPolarHBondContact O-CG 3.48Å; A599-M603 PolarHBondContact O-N 3.48Å; Y600-M603 PolarHBondContact O-N 3.18Å; M603-G606 PolarHBondContact O-N 3.4Å; M603-M607 WeakPolarHBondContact O-CG 3.43Å; M603-M607 PolarHBondContact O-N 2.96Å; M603-F681 HydrophobicContact CE-CD1 4.19Å; M603-F681 HydrophobicContact CE-CE1 4.17Å; M603-F681 HydrophobicContact SD-CD1 3.76Å; M603-F681 HydrophobicContact SD-CE1 4.22Å; M603-A684 HydrophobicContact CG-CB 3.94Å; M603-A684 HydrophobicContact SD-CB 3.81Å; M603-T701 HydrophobicContact CE-CG2 4.16Å; M603-T701 HydrophobicContact CG-CG2 3.81Å; M603-T701 HydrophobicContact SD-CG2 4.07Å; M603-V704 HydrophobicContact CE-CB 4.18Å; M603-V704 HydrophobicContact CE-CG1 3.92Å; M603-A705 HydrophobicContact CE-CB 4.3Å; M603-A705 HydrophobicContact SD-CB 3.78Å; M603-F737 HydrophobicContact CB-CD1 4.01Å; M603-F737 HydrophobicContact CB-CD2 4.16Å; M603-F737 HydrophobicContact CB-CE1 3.62Å; M603-F737 HydrophobicContact CB-CE2 3.79Å; M603-F737 HydrophobicContact CB-CG 4.29Å; M603-F737 HydrophobicContact CB-CZ 3.51Å; M603-F737 HydrophobicContact CE-CB 4.04Å; M603-F737 HydrophobicContact CE-CD1 4.49Å; M603-F737 HydrophobicContact CE-CD2 4.16Å; M603-F737 HydrophobicContact CE-CG 3.99Å; M603-F737 HydrophobicContact CG-CD2 4.46Å; M603-F737 HydrophobicContact CG-CE2 4.28Å; M603-F737 HydrophobicContact CG-CZ 4.46Å
604	C	98.8	Very high	97.1	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-62.5	-46.2	175.9	-64.8	0	0	0	0	111.5	Y540 L543 Y600 Q601 G606 M607 Y608	Y540-C604 HydrophobicContact CD1-CB 4.22Å; L543-C604 HydrophobicContact CB-CB 4.13Å; Y600-C604 WeakPolarHBondContact O-CB 3.37Å; Y600-C604 PolarHBondContact O-N 3.24Å; Y600-C604 PolarHBondContact O-SG 2.55Å; Q601-C604 PolarHBondContact O-N 3.09Å; C604-G606 VanDerWaalsContact C-N 3.3Å; C604-G606 PolarHBondContact O-N 3.17Å; C604-M607 PolarHBondContact O-N 3.44Å; C604-Y608 WeakPolarHBondContact O-CB 3.44Å; C604-Y608 PolarHBondContact O-N 3.34Å
605	A	98.6	Very high	97.1	Very high	4 Å²	4	18.7 Å²	18.7	3%	0.033	9%	0.094	C	C	.	.	H	α-helix	trans	-62.2	-38.4	177.7	0	0	0	0	0	112.2	Q601 N602 K609 H680	Q601-A605 WeakPolarHBondContact O-CB 3.49Å; Q601-A605 PolarHBondContact O-N 2.96Å; N602-A605 PolarHBondContact O-N 3.42Å; A605-K609 WeakPolarHBondContact O-CG 3.2Å; A605-K609 PolarHBondContact O-N 3.28Å; A605-K609 VanDerWaalsContact O-N 3.11Å; A605-H680 HydrophobicContact CB-CB 4.42Å
606	G	98.6	Very high	97.2	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.5	-47.6	173.4	0	0	0	0	0	111.9	N602 M603 C604 T610 A677	N602-G606 PolarHBondContact O-N 3.28Å; M603-G606 PolarHBondContact O-N 3.4Å; C604-G606 VanDerWaalsContact C-N 3.3Å; C604-G606 PolarHBondContact O-N 3.17Å; G606-T610 WeakPolarHBondContact O-CB 3.34Å; G606-T610 PolarHBondContact O-N 2.88Å; G606-T610 PolarHBondContact O-OG1 2.94Å; G606-A677 WeakPolarHBondContact O-CB 3.48Å
607	M	98.5	Very high	97.1	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-66.6	-43.1	177.6	-72.6	-54.5	-54.8	0	0	112.8	Y540 M603 C604 K609 T610 M611 F681 F729 F737 P738 V740	Y540-M607 HydrophobicContact CD1-CB 4Å; Y540-M607 HydrophobicContact CD2-CB 3.49Å; Y540-M607 VanDerWaalsContact CD2-CB 3.49Å; Y540-M607 HydrophobicContact CD2-CG 4.4Å; Y540-M607 HydrophobicContact CE1-CB 4.16Å; Y540-M607 HydrophobicContact CE1-CG 4.3Å; Y540-M607 HydrophobicContact CE2-CB 3.65Å; Y540-M607 HydrophobicContact CE2-CE 4.07Å; Y540-M607 HydrophobicContact CE2-CG 4.08Å; Y540-M607 HydrophobicContact CG-CB 3.68Å; M603-M607 WeakPolarHBondContact O-CG 3.43Å; M603-M607 PolarHBondContact O-N 2.96Å; C604-M607 PolarHBondContact O-N 3.44Å; M607-K609 PolarHBondContact O-N 2.86Å; M607-T610 WeakPolarHBondContact O-CB 3.48Å; M607-T610 PolarHBondContact O-N 3.35Å; M607-M611 WeakPolarHBondContact O-CG 3.39Å; M607-M611 PolarHBondContact O-N 3.45Å; M607-F681 HydrophobicContact CG-CE1 4.22Å; M607-F681 HydrophobicContact CG-CZ 4.08Å; M607-F681 HydrophobicContact SD-CE1 4.25Å; M607-F681 HydrophobicContact SD-CZ 3.71Å; M607-F729 HydrophobicContact CE-CD1 4.19Å; M607-F729 HydrophobicContact CE-CE1 3.97Å; M607-F737 HydrophobicContact CG-CD1 4.25Å; M607-P738 HydrophobicContact CE-CG 3.61Å; M607-P738 HydrophobicContact SD-CG 4.3Å; M607-V740 HydrophobicContact CE-CG2 4.34Å; M607-V740 HydrophobicContact SD-CG2 4.43Å
608	Y	98.4	Very high	96.9	Very high	20 Å²	20	24.2 Å²	24.2	8%	0.078	14%	0.135	C	C	.	.	H	α-helix	trans	-52.8	-54	174.2	163.4	-125.8	0	0	0	111.1	Y537 W541 C604 T610 M611 V612 S659	Y537-Y608 HydrophobicContact CD2-CE2 4.32Å; Y537-Y608 WeakPolarHBondContact O-CD2 3.15Å; W541-Y608 HydrophobicContact CB-CD1 4.48Å; W541-Y608 HydrophobicContact CB-CD2 3.65Å; W541-Y608 HydrophobicContact CB-CE2 3.86Å; W541-Y608 HydrophobicContact CB-CG 3.98Å; W541-Y608 AromaticContact CD1-CD1 3.99Å; W541-Y608 AromaticContact CD1-CE1 3.54Å; W541-Y608 AromaticContact CD1-CE2 3.75Å; W541-Y608 AromaticContact CD1-CZ 3.4Å; W541-Y608 VanDerWaalsContact CD1-CZ 3.4Å; W541-Y608 HydrophobicContact CG-CD2 4.33Å; W541-Y608 HydrophobicContact CG-CE1 4.49Å; W541-Y608 HydrophobicContact CG-CE2 4.1Å; C604-Y608 WeakPolarHBondContact O-CB 3.44Å; C604-Y608 PolarHBondContact O-N 3.34Å; Y608-T610 VanDerWaalsContact C-N 3.31Å; Y608-T610 PolarHBondContact O-N 3.47Å; Y608-M611 PolarHBondContact O-N 3.48Å; Y608-V612 HydrophobicContact CD2-CG2 3.82Å; Y608-V612 HydrophobicContact CE2-CG2 3.37Å; Y608-V612 WeakPolarHBondContact O-CG2 3.39Å; Y608-V612 PolarHBondContact O-N 2.91Å; Y608-S659 WeakPolarHBondContact OH-CB 3.47Å
609	K	98.3	Very high	96.7	Very high	45 Å²	45	21.1 Å²	21.1	20%	0.196	12%	0.12	C	C	.	.	H	α-helix	trans	-64.6	-35.8	179.8	-68.8	178.9	-174.2	-174.9	0	112.6	A605 M607 A613 A676 A677 H680	A605-K609 WeakPolarHBondContact O-CG 3.2Å; A605-K609 PolarHBondContact O-N 3.28Å; A605-K609 VanDerWaalsContact O-N 3.11Å; M607-K609 PolarHBondContact O-N 2.86Å; K609-A613 VanDerWaalsContact O-CB 3.29Å; K609-A613 WeakPolarHBondContact O-CB 3.44Å; K609-A613 PolarHBondContact O-N 2.85Å; K609-A676 HydrophobicContact CD-CB 3.72Å; K609-A677 HydrophobicContact CB-CB 3.87Å; K609-H680 PolarHBondContact NZ-CD2 3.28Å; K609-H680 PolarHBondContact NZ-NE2 3.01Å
610	T	98	Very high	96.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-59.2	-48.1	173.3	-59	0	0	0	0	110.9	G606 M607 Y608 A613 L614 M712 V740	G606-T610 WeakPolarHBondContact O-CB 3.34Å; G606-T610 PolarHBondContact O-N 2.88Å; G606-T610 PolarHBondContact O-OG1 2.94Å; M607-T610 WeakPolarHBondContact O-CB 3.48Å; M607-T610 PolarHBondContact O-N 3.35Å; Y608-T610 VanDerWaalsContact C-N 3.31Å; Y608-T610 PolarHBondContact O-N 3.47Å; T610-A613 PolarHBondContact O-N 3.19Å; T610-L614 HydrophobicContact CG2-CD1 3.84Å; T610-L614 HydrophobicContact CG2-CG 4.42Å; T610-L614 WeakPolarHBondContact O-CB 3.24Å; T610-L614 VanDerWaalsContact O-CG 3.27Å; T610-L614 WeakPolarHBondContact O-CG 3.4Å; T610-L614 PolarHBondContact O-N 3.36Å; T610-M712 HydrophobicContact CG2-CE 3.55Å; T610-M712 HydrophobicContact CG2-SD 3.6Å; T610-M712 PolarHBondContact OG1-SD 2.63Å; T610-V740 HydrophobicContact CG2-CG2 4.28Å
611	M	97.4	Very high	95.9	Very high	4 Å²	4	29.9 Å²	29.9	2%	0.02	16%	0.155	C	C	.	.	H	α-helix	trans	-66.9	-40.9	-178.3	-67.4	-49.5	-66.4	0	0	112.5	M533 Y536 M607 Y608 L614 D615 V620 F729	M533-M611 HydrophobicContact CE-CE 4.01Å; M533-M611 HydrophobicContact CG-CE 3.68Å; M533-M611 WeakPolarHBondContact O-CE 3.43Å; Y536-M611 HydrophobicContact CD2-CE 4.08Å; Y536-M611 HydrophobicContact CD2-SD 4.17Å; Y536-M611 HydrophobicContact CG-CE 4.42Å; M607-M611 WeakPolarHBondContact O-CG 3.39Å; M607-M611 PolarHBondContact O-N 3.45Å; Y608-M611 PolarHBondContact O-N 3.48Å; M611-L614 PolarHBondContact O-N 3.22Å; M611-L614 HydrophobicContact SD-CD1 4.26Å; M611-D615 WeakPolarHBondContact O-CB 3.35Å; M611-D615 PolarHBondContact O-N 3.21Å; M611-V620 HydrophobicContact CE-CG2 4.25Å; M611-F729 HydrophobicContact CE-CZ 4.06Å; M611-F729 HydrophobicContact SD-CE1 3.66Å; M611-F729 HydrophobicContact SD-CE2 4.49Å; M611-F729 HydrophobicContact SD-CZ 3.47Å; M611-F729 WeakPolarHBondContact SD-CZ 3.49Å
612	V	96.9	Very high	95.4	Very high	22 Å²	22	32.8 Å²	32.8	13%	0.133	17%	0.166	C	C	.	.	H	α-helix	trans	-64.1	-43.7	175.7	179.1	0	0	0	0	110.9	Y537 Y608 D615 M616 L661 L673	Y537-V612 HydrophobicContact CD2-CG2 4.32Å; Y608-V612 HydrophobicContact CD2-CG2 3.82Å; Y608-V612 HydrophobicContact CE2-CG2 3.37Å; Y608-V612 WeakPolarHBondContact O-CG2 3.39Å; Y608-V612 PolarHBondContact O-N 2.91Å; V612-D615 PolarHBondContact O-N 2.84Å; V612-M616 HydrophobicContact CG1-SD 4.36Å; V612-M616 WeakPolarHBondContact O-CG 3.48Å; V612-M616 PolarHBondContact O-N 3.19Å; V612-L661 HydrophobicContact CG1-CD1 3.92Å; V612-L673 HydrophobicContact CB-CD1 4.22Å; V612-L673 HydrophobicContact CG1-CD1 3.67Å
613	A	96.2	Very high	94.7	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.4	-42.2	177.8	0	0	0	0	0	112.6	K609 T610 D615 M616 D617 L673 Y674	K609-A613 VanDerWaalsContact O-CB 3.29Å; K609-A613 WeakPolarHBondContact O-CB 3.44Å; K609-A613 PolarHBondContact O-N 2.85Å; T610-A613 PolarHBondContact O-N 3.19Å; A613-D615 VanDerWaalsContact C-N 3.32Å; A613-D615 PolarHBondContact O-N 3.4Å; A613-M616 PolarHBondContact O-N 3.39Å; A613-D617 PolarHBondContact O-N 2.92Å; A613-D617 VanDerWaalsContact O-N 3.09Å; A613-L673 HydrophobicContact CB-CB 3.75Å; A613-L673 HydrophobicContact CB-CD1 4.43Å; A613-Y674 HydrophobicContact CB-CD1 3.52Å; A613-Y674 HydrophobicContact CB-CD2 4.13Å; A613-Y674 HydrophobicContact CB-CE1 3.35Å; A613-Y674 HydrophobicContact CB-CE2 3.96Å; A613-Y674 HydrophobicContact CB-CG 3.91Å; A613-Y674 PolarHBondContact O-OH 2.99Å
614	L	95.4	Very high	93.9	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-63.6	-38.5	174.5	-73.7	169.6	0	0	0	111.7	T610 M611 D617 G618 K619 V620 Y674 P727 F729	T610-L614 HydrophobicContact CG2-CD1 3.84Å; T610-L614 HydrophobicContact CG2-CG 4.42Å; T610-L614 WeakPolarHBondContact O-CB 3.24Å; T610-L614 VanDerWaalsContact O-CG 3.27Å; T610-L614 WeakPolarHBondContact O-CG 3.4Å; T610-L614 PolarHBondContact O-N 3.36Å; M611-L614 PolarHBondContact O-N 3.22Å; M611-L614 HydrophobicContact SD-CD1 4.26Å; L614-D617 CarbonylContact O-C 3.34Å; L614-D617 PolarHBondContact O-N 3.07Å; L614-G618 PolarHBondContact O-N 3.41Å; L614-K619 HydrophobicContact CB-CB 4.29Å; L614-K619 HydrophobicContact CD2-CB 3.91Å; L614-K619 HydrophobicContact CD2-CD 3.99Å; L614-K619 WeakPolarHBondContact O-CA 3.35Å; L614-K619 WeakPolarHBondContact O-CB 3.47Å; L614-K619 PolarHBondContact O-N 3.44Å; L614-V620 HydrophobicContact CB-CG2 3.92Å; L614-Y674 HydrophobicContact CD2-CE1 4.29Å; L614-Y674 WeakPolarHBondContact CD2-OH 3.22Å; L614-Y674 HydrophobicContact CG-CE1 4.19Å; L614-P727 HydrophobicContact CD1-CG 3.91Å; L614-P727 HydrophobicContact CD2-CG 3.99Å; L614-F729 HydrophobicContact CD1-CZ 3.82Å
615	D	94.1	Very high	93.1	Very high	60 Å²	60	46.5 Å²	46.5	32%	0.321	24%	0.235	S	C	.	.	H	α-helix	trans	-65.1	-42.3	177.2	-164.8	45.6	0	0	0	111.4	M611 V612 A613 D617 G618 V620 K622	M611-D615 WeakPolarHBondContact O-CB 3.35Å; M611-D615 PolarHBondContact O-N 3.21Å; V612-D615 PolarHBondContact O-N 2.84Å; A613-D615 VanDerWaalsContact C-N 3.32Å; A613-D615 PolarHBondContact O-N 3.4Å; D615-D617 VanDerWaalsContact C-N 3.27Å; D615-D617 PolarHBondContact O-N 3.46Å; D615-G618 PolarHBondContact O-N 3.45Å; D615-V620 HydrophobicContact CB-CB 4.35Å; D615-V620 HydrophobicContact CB-CG2 3.84Å; D615-K622 WeakPolarHBondContact OD1-CE 3.39Å; D615-K622 IonicContact OD1-NZ 2.91Å; D615-K622 PolarHBondContact OD1-NZ 2.85Å; D615-K622 IonicContact OD2-NZ 3.71Å; D615-K622 PolarHBondContact OD2-NZ 3.24Å
616	M	93.5	Very high	92.5	Very high	91 Å²	91	54.3 Å²	54.3	45%	0.448	27%	0.271	S	S	.	.	H	α-helix	trans	-61.2	-34.9	174.9	-70.4	175.7	72.2	0	0	112.7	V612 A613 G618 L661 L673	V612-M616 HydrophobicContact CG1-SD 4.36Å; V612-M616 WeakPolarHBondContact O-CG 3.48Å; V612-M616 PolarHBondContact O-N 3.19Å; A613-M616 PolarHBondContact O-N 3.39Å; M616-G618 PolarHBondContact O-N 2.82Å; M616-L661 HydrophobicContact SD-CD1 3.95Å; M616-L673 HydrophobicContact SD-CD1 3.47Å; M616-L673 WeakPolarHBondContact SD-CD1 3.43Å
617	D	93	Very high	91.9	Very high	42 Å²	42	62.9 Å²	62.9	23%	0.225	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	2.9	175.1	-73.2	-13.3	0	0	0	113.1	A613 L614 D615 K619 S670 Y674	A613-D617 PolarHBondContact O-N 2.92Å; A613-D617 VanDerWaalsContact O-N 3.09Å; L614-D617 CarbonylContact O-C 3.34Å; L614-D617 PolarHBondContact O-N 3.07Å; D615-D617 VanDerWaalsContact C-N 3.27Å; D615-D617 PolarHBondContact O-N 3.46Å; D617-K619 VanDerWaalsContact C-N 3.28Å; D617-K619 HydrophobicContact CB-CD 4.14Å; D617-K619 HydrophobicContact CB-CG 4.19Å; D617-K619 PolarHBondContact O-N 2.82Å; D617-S670 WeakPolarHBondContact OD1-CB 3.48Å; D617-S670 PolarHBondContact OD1-OG 3.4Å; D617-Y674 WeakPolarHBondContact OD2-CE2 3.33Å; D617-Y674 PolarHBondContact OD2-OH 2.95Å
618	G	91.8	Very high	91.3	Very high	61 Å²	61	65.8 Å²	65.8	63%	0.629	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	22.1	-178.7	0	0	0	0	0	114.2	L614 D615 M616	L614-G618 PolarHBondContact O-N 3.41Å; D615-G618 PolarHBondContact O-N 3.45Å; M616-G618 PolarHBondContact O-N 2.82Å
619	K	92.2	Very high	90.9	Very high	8 Å²	8	67.1 Å²	67.1	4%	0.035	34%	0.343	C	S	.	.			trans	-99.4	15.6	-176.5	-66.6	178.9	177.3	173.3	0	113.5	M533 L614 D617 K720 P727	M533-K619 WeakPolarHBondContact CE-O 3.23Å; L614-K619 HydrophobicContact CB-CB 4.29Å; L614-K619 HydrophobicContact CD2-CB 3.91Å; L614-K619 HydrophobicContact CD2-CD 3.99Å; L614-K619 WeakPolarHBondContact O-CA 3.35Å; L614-K619 WeakPolarHBondContact O-CB 3.47Å; L614-K619 PolarHBondContact O-N 3.44Å; D617-K619 VanDerWaalsContact C-N 3.28Å; D617-K619 HydrophobicContact CB-CD 4.14Å; D617-K619 HydrophobicContact CB-CG 4.19Å; D617-K619 PolarHBondContact O-N 2.82Å; K619-K720 PolarHBondContact NZ-O 2.91Å; K619-P727 WeakPolarHBondContact O-CD 3.49Å
620	V	91.6	Very high	90.7	Very high	17 Å²	17	66.8 Å²	66.8	10%	0.103	34%	0.342	C	S	.	.	S	Bend	trans	-111.8	121.5	174	179.3	0	0	0	0	109.7	M533 H534 M611 L614 D615 K622	M533-V620 HydrophobicContact CE-CB 4.22Å; M533-V620 HydrophobicContact CE-CG1 4.35Å; M533-V620 HydrophobicContact CE-CG2 3.91Å; M533-V620 HydrophobicContact CG-CG1 4.48Å; H534-V620 HydrophobicContact CB-CG1 3.76Å; M611-V620 HydrophobicContact CE-CG2 4.25Å; L614-V620 HydrophobicContact CB-CG2 3.92Å; D615-V620 HydrophobicContact CB-CB 4.35Å; D615-V620 HydrophobicContact CB-CG2 3.84Å; V620-K622 PolarHBondContact O-N 3.2Å
621	R	87.4	Confident	90.6	Very high	189 Å²	189	70.5 Å²	70.5	71%	0.713	36%	0.36	S	S	*	.			trans	-73.3	116.2	176.6	-173.7	178.1	-179.7	-173.7	-0.5	110.1	L726	R621-L726 HydrophobicContact CB-CD1 4.03Å
622	K	86.9	Confident	90.4	Very high	106 Å²	106	73.3 Å²	73.3	46%	0.461	38%	0.377	S	S	.	.			trans	-109.9	124.6	173.3	-68.1	175.4	177.9	168.1	0	109.6	H534 D615 V620	H534-K622 HydrophobicContact CB-CG 4.12Å; D615-K622 WeakPolarHBondContact OD1-CE 3.39Å; D615-K622 IonicContact OD1-NZ 2.91Å; D615-K622 PolarHBondContact OD1-NZ 2.85Å; D615-K622 IonicContact OD2-NZ 3.71Å; D615-K622 PolarHBondContact OD2-NZ 3.24Å; V620-K622 PolarHBondContact O-N 3.2Å
623	P	83.9	Confident	90.3	Very high	63 Å²	63	73.6 Å²	73.6	41%	0.409	38%	0.375	S	S	.	.			trans	-57.3	154.9	167.5	-19.8	28.6	0	0	0	111.7	F625	P623-F625 HydrophobicContact CB-CD1 4.15Å; P623-F625 HydrophobicContact CB-CE1 3.68Å; P623-F625 HydrophobicContact CB-CE2 4.42Å; P623-F625 HydrophobicContact CB-CZ 3.85Å; P623-F625 VanDerWaalsContact CD-CZ 3.48Å; P623-F625 HydrophobicContact CG-CE1 3.76Å; P623-F625 HydrophobicContact CG-CZ 3.7Å; P623-F625 VanDerWaalsContact O-CD2 3.22Å; P623-F625 WeakPolarHBondContact O-CD2 3.48Å; P623-F625 VanDerWaalsContact O-CE2 3.28Å; P623-F625 WeakPolarHBondContact O-CE2 3.3Å; P623-F625 PolarHBondContact O-N 3.45Å
624	Q	83.4	Confident	90.3	Very high	172 Å²	172	73.8 Å²	73.8	80%	0.804	38%	0.376	S	S	*	.			trans	-78.5	114.2	166	-175.4	174.7	-6.8	0	0	107.8
625	F	80.9	Confident	90.3	Very high	71 Å²	71	78 Å²	78	31%	0.311	40%	0.395	S	S	.	.			trans	-99	112.9	-176.8	-55.2	-72.8	0	0	0	109.7	H534 P623 D628 R633	H534-F625 AromaticContact NE2-CZ 3.75Å; P623-F625 HydrophobicContact CB-CD1 4.15Å; P623-F625 HydrophobicContact CB-CE1 3.68Å; P623-F625 HydrophobicContact CB-CE2 4.42Å; P623-F625 HydrophobicContact CB-CZ 3.85Å; P623-F625 VanDerWaalsContact CD-CZ 3.48Å; P623-F625 HydrophobicContact CG-CE1 3.76Å; P623-F625 HydrophobicContact CG-CZ 3.7Å; P623-F625 VanDerWaalsContact O-CD2 3.22Å; P623-F625 WeakPolarHBondContact O-CD2 3.48Å; P623-F625 VanDerWaalsContact O-CE2 3.28Å; P623-F625 WeakPolarHBondContact O-CE2 3.3Å; P623-F625 PolarHBondContact O-N 3.45Å; F625-D628 HydrophobicContact CB-CB 4.16Å; F625-D628 WeakPolarHBondContact CB-O 3.29Å; F625-D628 HydrophobicContact CD1-CB 3.9Å; F625-D628 WeakPolarHBondContact CD1-OD2 3.21Å; F625-D628 WeakPolarHBondContact CE1-OD2 3.39Å; F625-D628 HydrophobicContact CG-CB 4.39Å; F625-R633 VanDerWaalsContact CD1-NH1 3.34Å; F625-R633 VanDerWaalsContact CZ-CZ 3.42Å; F625-R633 VanDerWaalsContact CZ-NH1 3.25Å
626	E	85.6	Confident	90.3	Very high	168 Å²	168	81.4 Å²	81.4	79%	0.785	41%	0.409	S	S	*	.	S	Bend	trans	-95.4	-36.4	174.1	-67	-176.1	176.8	0	0	112.4
627	L	86.6	Confident	90.5	Very high	180 Å²	180	80 Å²	80	94%	0.942	40%	0.399	S	S	*	.	S	Bend	trans	-118.6	11.4	-176.7	-60.4	177	0	0	0	113
628	D	86.3	Confident	90.7	Very high	61 Å²	61	78.5 Å²	78.5	33%	0.326	39%	0.391	S	S	.	.			trans	-133.4	153.9	-171.9	-176.3	20.9	0	0	0	110.8	F625 R633	F625-D628 HydrophobicContact CB-CB 4.16Å; F625-D628 WeakPolarHBondContact CB-O 3.29Å; F625-D628 HydrophobicContact CD1-CB 3.9Å; F625-D628 WeakPolarHBondContact CD1-OD2 3.21Å; F625-D628 WeakPolarHBondContact CE1-OD2 3.39Å; F625-D628 HydrophobicContact CG-CB 4.39Å; D628-R633 IonicContact OD1-NH1 2.62Å; D628-R633 PolarHBondContact OD1-NH1 2.85Å; D628-R633 WeakPolarHBondContact OD2-CD 3.43Å; D628-R633 IonicContact OD2-CZ 3.74Å; D628-R633 IonicContact OD2-NE 2.83Å; D628-R633 IonicContact OD2-NH1 3.26Å; D628-R633 PolarHBondContact OD2-NH1 2.98Å
629	S	90.5	Very high	90.9	Very high	47 Å²	47	77.5 Å²	77.5	33%	0.329	38%	0.376	S	S	.	.			trans	-141.8	155.7	176.1	72.5	0	0	0	0	111	Q631 V632 R633	S629-Q631 PolarHBondContact O-N 3.38Å; S629-V632 PolarHBondContact O-N 3.41Å; S629-V632 WeakPolarHBondContact OG-CG2 3.45Å; S629-V632 PolarHBondContact OG-N 2.61Å; S629-R633 PolarHBondContact O-N 2.8Å
630	E	93.3	Very high	91	Very high	38 Å²	38	78.6 Å²	78.6	18%	0.178	38%	0.384	C	S	.	.	H	α-helix	trans	-57	-34.5	175.9	-177.3	174.7	87.7	0	0	112.6	Y537 Y538 R633 Y634 Y652 K656	Y537-E630 PolarHBondContact OH-OE1 3.21Å; Y537-E630 PolarHBondContact OH-OE2 2.99Å; Y538-E630 HydrophobicContact CE1-CG 4.41Å; E630-R633 PolarHBondContact O-N 2.88Å; E630-Y634 VanDerWaalsContact O-CB 3.28Å; E630-Y634 WeakPolarHBondContact O-CB 3.32Å; E630-Y634 PolarHBondContact O-N 2.74Å; E630-Y652 HydrophobicContact CB-CE2 4.38Å; E630-Y652 HydrophobicContact CG-CE2 3.79Å; E630-Y652 PolarHBondContact OE1-OH 2.95Å; E630-K656 IonicContact OE1-NZ 3.86Å; E630-K656 PolarHBondContact OE1-NZ 3.44Å
631	Q	95.1	Very high	91.2	Very high	79 Å²	79	77.8 Å²	77.8	37%	0.369	38%	0.38	S	S	.	.	H	α-helix	trans	-60	-50.6	176.8	179.8	169.9	-3.3	0	0	111.8	S629 R633 Y634 E635 Y652	S629-Q631 PolarHBondContact O-N 3.38Å; Q631-R633 VanDerWaalsContact C-N 3.34Å; Q631-R633 PolarHBondContact O-N 3.49Å; Q631-Y634 PolarHBondContact O-N 3.02Å; Q631-E635 HydrophobicContact CG-CG 4.38Å; Q631-E635 VanDerWaalsContact CG-OE1 3.22Å; Q631-E635 WeakPolarHBondContact CG-OE1 3.4Å; Q631-E635 PolarHBondContact NE2-OE1 3.38Å; Q631-E635 WeakPolarHBondContact O-CB 3.43Å; Q631-E635 VanDerWaalsContact O-CG 3.32Å; Q631-E635 WeakPolarHBondContact O-CG 3.36Å; Q631-E635 PolarHBondContact O-N 3.27Å; Q631-Y652 HydrophobicContact CB-CD1 3.51Å; Q631-Y652 HydrophobicContact CB-CE1 3.62Å; Q631-Y652 HydrophobicContact CB-CG 3.97Å; Q631-Y652 HydrophobicContact CG-CD1 3.53Å; Q631-Y652 HydrophobicContact CG-CE1 4.16Å; Q631-Y652 HydrophobicContact CG-CG 3.86Å
632	V	93.7	Very high	91.5	Very high	62 Å²	62	73.8 Å²	73.8	38%	0.376	37%	0.372	S	S	.	.	H	α-helix	trans	-60.9	-45.9	-179.1	172.7	0	0	0	0	110.3	S629 Y634 E635 H636	S629-V632 PolarHBondContact O-N 3.41Å; S629-V632 WeakPolarHBondContact OG-CG2 3.45Å; S629-V632 PolarHBondContact OG-N 2.61Å; V632-Y634 PolarHBondContact O-N 3.12Å; V632-E635 PolarHBondContact O-N 2.96Å; V632-H636 WeakPolarHBondContact O-CB 3.11Å; V632-H636 PolarHBondContact O-CD2 3.32Å; V632-H636 VanDerWaalsContact O-CD2 3.25Å; V632-H636 PolarHBondContact O-N 2.89Å
633	R	94.1	Very high	91.7	Very high	29 Å²	29	70.7 Å²	70.7	11%	0.109	36%	0.364	C	S	.	.	H	α-helix	trans	-60.6	-47.9	176.8	-65.1	-171.9	-62.8	-89.2	4	112	F625 D628 S629 E630 Q631 E635 H636 R637	F625-R633 VanDerWaalsContact CD1-NH1 3.34Å; F625-R633 VanDerWaalsContact CZ-CZ 3.42Å; F625-R633 VanDerWaalsContact CZ-NH1 3.25Å; D628-R633 IonicContact OD1-NH1 2.62Å; D628-R633 PolarHBondContact OD1-NH1 2.85Å; D628-R633 WeakPolarHBondContact OD2-CD 3.43Å; D628-R633 IonicContact OD2-CZ 3.74Å; D628-R633 IonicContact OD2-NE 2.83Å; D628-R633 IonicContact OD2-NH1 3.26Å; D628-R633 PolarHBondContact OD2-NH1 2.98Å; S629-R633 PolarHBondContact O-N 2.8Å; E630-R633 PolarHBondContact O-N 2.88Å; Q631-R633 VanDerWaalsContact C-N 3.34Å; Q631-R633 PolarHBondContact O-N 3.49Å; R633-E635 PolarHBondContact O-N 2.89Å; R633-H636 PolarHBondContact O-N 3.31Å; R633-R637 VanDerWaalsContact O-CG 3.28Å; R633-R637 WeakPolarHBondContact O-CG 3.43Å; R633-R637 PolarHBondContact O-N 3.16Å
634	Y	96.7	Very high	92.2	Very high	4 Å²	4	67.8 Å²	67.8	2%	0.016	35%	0.345	C	S	.	.	H	α-helix	trans	-55.7	-52.8	177	178.7	-82.2	0	0	0	110.6	Y538 E630 Q631 V632 H636 R637 F638 V650 Y652 F655	Y538-Y634 HydrophobicContact CD2-CD2 4.16Å; Y538-Y634 HydrophobicContact CG-CD2 4.08Å; E630-Y634 VanDerWaalsContact O-CB 3.28Å; E630-Y634 WeakPolarHBondContact O-CB 3.32Å; E630-Y634 PolarHBondContact O-N 2.74Å; Q631-Y634 PolarHBondContact O-N 3.02Å; V632-Y634 PolarHBondContact O-N 3.12Å; Y634-H636 VanDerWaalsContact C-N 3.3Å; Y634-H636 PolarHBondContact O-N 3.22Å; Y634-R637 PolarHBondContact O-N 3.49Å; Y634-R637 VanDerWaalsContact O-N 3.08Å; Y634-F638 AromaticContact CD1-CD2 3.86Å; Y634-F638 HydrophobicContact CD1-CD2 3.86Å; Y634-F638 HydrophobicContact CD1-CE2 4.38Å; Y634-F638 AromaticContact CD2-CD2 3.8Å; Y634-F638 HydrophobicContact CD2-CD2 3.8Å; Y634-F638 AromaticContact CD2-CE2 3.46Å; Y634-F638 HydrophobicContact CD2-CE2 3.46Å; Y634-F638 VanDerWaalsContact CD2-CE2 3.46Å; Y634-F638 AromaticContact CE1-CD2 3.69Å; Y634-F638 HydrophobicContact CE1-CD2 3.69Å; Y634-F638 HydrophobicContact CE1-CE2 4.23Å; Y634-F638 AromaticContact CE2-CD2 3.65Å; Y634-F638 HydrophobicContact CE2-CD2 3.65Å; Y634-F638 AromaticContact CE2-CE2 3.29Å; Y634-F638 HydrophobicContact CE2-CE2 3.29Å; Y634-F638 HydrophobicContact CE2-CZ 4.25Å; Y634-F638 AromaticContact CG-CD2 3.89Å; Y634-F638 HydrophobicContact CG-CD2 3.89Å; Y634-F638 HydrophobicContact CG-CE2 4.01Å; Y634-F638 AromaticContact CZ-CD2 3.57Å; Y634-F638 AromaticContact CZ-CE2 3.69Å; Y634-F638 WeakPolarHBondContact O-CD2 3.38Å; Y634-F638 PolarHBondContact O-N 3Å; Y634-F638 VanDerWaalsContact O-N 3.14Å; Y634-V650 VanDerWaalsContact CE1-O 3.3Å; Y634-V650 WeakPolarHBondContact CE1-O 3.2Å; Y634-V650 PolarHBondContact OH-O 3.45Å; Y634-Y652 HydrophobicContact CD1-CD2 4.04Å; Y634-Y652 HydrophobicContact CD1-CG 4.39Å; Y634-Y652 HydrophobicContact CD2-CD2 4.11Å; Y634-Y652 AromaticContact CG-CD2 3.71Å; Y634-Y652 HydrophobicContact CG-CD2 3.71Å; Y634-Y652 HydrophobicContact CG-CG 4.48Å; Y634-F655 AromaticContact CD2-CD1 3.97Å; Y634-F655 HydrophobicContact CD2-CD1 3.97Å; Y634-F655 HydrophobicContact CD2-CE1 4.4Å; Y634-F655 HydrophobicContact CD2-CG 4.42Å; Y634-F655 HydrophobicContact CE2-CB 3.9Å; Y634-F655 AromaticContact CE2-CD1 3.74Å; Y634-F655 HydrophobicContact CE2-CD1 3.74Å; Y634-F655 HydrophobicContact CE2-CD2 4.38Å; Y634-F655 HydrophobicContact CE2-CE1 4.38Å; Y634-F655 AromaticContact CE2-CG 3.72Å; Y634-F655 HydrophobicContact CE2-CG 3.72Å
635	E	96.1	Very high	92.5	Very high	89 Å²	89	65.2 Å²	65.2	42%	0.416	34%	0.341	S	S	.	.	H	α-helix	trans	-58.7	-41.1	-180	-72.3	170.1	-179.9	0	0	111.6	Q631 V632 R633 F638 A639	Q631-E635 HydrophobicContact CG-CG 4.38Å; Q631-E635 VanDerWaalsContact CG-OE1 3.22Å; Q631-E635 WeakPolarHBondContact CG-OE1 3.4Å; Q631-E635 PolarHBondContact NE2-OE1 3.38Å; Q631-E635 WeakPolarHBondContact O-CB 3.43Å; Q631-E635 VanDerWaalsContact O-CG 3.32Å; Q631-E635 WeakPolarHBondContact O-CG 3.36Å; Q631-E635 PolarHBondContact O-N 3.27Å; V632-E635 PolarHBondContact O-N 2.96Å; R633-E635 PolarHBondContact O-N 2.89Å; E635-F638 PolarHBondContact O-N 3.44Å; E635-A639 WeakPolarHBondContact O-CA 3.43Å; E635-A639 VanDerWaalsContact O-CB 3.32Å; E635-A639 WeakPolarHBondContact O-CB 3.37Å; E635-A639 PolarHBondContact O-N 3.12Å
636	H	94.6	Very high	93	Very high	133 Å²	133	63.5 Å²	63.5	62%	0.616	34%	0.336	S	S	*	.	H	α-helix	trans	-65.8	-37.6	174.6	-88.6	-79	0	0	0	113.8	V632 R633 Y634 F638	V632-H636 WeakPolarHBondContact O-CB 3.11Å; V632-H636 PolarHBondContact O-CD2 3.32Å; V632-H636 VanDerWaalsContact O-CD2 3.25Å; V632-H636 PolarHBondContact O-N 2.89Å; R633-H636 PolarHBondContact O-N 3.31Å; Y634-H636 VanDerWaalsContact C-N 3.3Å; Y634-H636 PolarHBondContact O-N 3.22Å; H636-F638 VanDerWaalsContact C-N 3.3Å; H636-F638 PolarHBondContact O-N 3.16Å
637	R	96.3	Very high	93.4	Very high	61 Å²	61	55.6 Å²	55.6	23%	0.23	30%	0.299	C	S	.	.	H	α-helix	trans	-67.7	-32.6	179.5	-63.8	-33.8	-176.5	173.7	7.5	112.2	L530 E535 Y538 I539 R633 Y634	L530-R637 PolarHBondContact O-NH2 3.02Å; E535-R637 VanDerWaalsContact CD-NH2 3.35Å; E535-R637 IonicContact OE1-CZ 3.44Å; E535-R637 IonicContact OE1-NE 3.3Å; E535-R637 PolarHBondContact OE1-NE 3.18Å; E535-R637 IonicContact OE1-NH2 3.48Å; E535-R637 PolarHBondContact OE1-NH2 3.15Å; E535-R637 IonicContact OE2-CZ 3.81Å; E535-R637 IonicContact OE2-NE 3.62Å; E535-R637 IonicContact OE2-NH2 3.81Å; E535-R637 PolarHBondContact OE2-NH2 2.93Å; Y538-R637 HydrophobicContact CE2-CG 4.06Å; I539-R637 HydrophobicContact CD1-CB 4.04Å; I539-R637 HydrophobicContact CD1-CG 4.15Å; R633-R637 VanDerWaalsContact O-CG 3.28Å; R633-R637 WeakPolarHBondContact O-CG 3.43Å; R633-R637 PolarHBondContact O-N 3.16Å; Y634-R637 PolarHBondContact O-N 3.49Å; Y634-R637 VanDerWaalsContact O-N 3.08Å
638	F	97.4	Very high	93.6	Very high	10 Å²	10	50.5 Å²	50.5	4%	0.044	28%	0.277	C	S	.	.	H	α-helix	trans	-104.6	-0.2	-177.1	-58.9	-68.3	0	0	0	113.8	L522 Y538 I539 Y542 Y634 E635 H636 P640 F641	L522-F638 HydrophobicContact CD1-CE1 3.86Å; L522-F638 HydrophobicContact CD2-CD1 4.07Å; L522-F638 HydrophobicContact CD2-CE1 3.75Å; L522-F638 HydrophobicContact CG-CE1 4.47Å; Y538-F638 AromaticContact CD2-CE2 3.97Å; Y538-F638 HydrophobicContact CD2-CE2 3.97Å; Y538-F638 HydrophobicContact CD2-CZ 4.28Å; I539-F638 HydrophobicContact CD1-CE1 4.42Å; I539-F638 HydrophobicContact CD1-CE2 4.44Å; I539-F638 HydrophobicContact CD1-CZ 3.88Å; Y542-F638 HydrophobicContact CD1-CD1 4.1Å; Y542-F638 AromaticContact CD1-CE1 3.63Å; Y542-F638 HydrophobicContact CD1-CE1 3.63Å; Y542-F638 HydrophobicContact CD1-CZ 4.42Å; Y542-F638 AromaticContact CD2-CD1 3.94Å; Y542-F638 HydrophobicContact CD2-CD1 3.94Å; Y542-F638 AromaticContact CD2-CE1 3.57Å; Y542-F638 HydrophobicContact CD2-CE1 3.57Å; Y542-F638 HydrophobicContact CD2-CE2 4.23Å; Y542-F638 HydrophobicContact CD2-CG 4.4Å; Y542-F638 AromaticContact CD2-CZ 3.74Å; Y542-F638 HydrophobicContact CD2-CZ 3.74Å; Y542-F638 HydrophobicContact CE1-CD1 4.14Å; Y542-F638 HydrophobicContact CE1-CE1 4.15Å; Y542-F638 AromaticContact CE2-CD1 3.97Å; Y542-F638 HydrophobicContact CE2-CD1 3.97Å; Y542-F638 HydrophobicContact CE2-CE1 4.09Å; Y542-F638 HydrophobicContact CE2-CG 4.29Å; Y542-F638 HydrophobicContact CG-CD1 4.02Å; Y542-F638 AromaticContact CG-CE1 3.33Å; Y542-F638 HydrophobicContact CG-CE1 3.33Å; Y542-F638 AromaticContact CG-CZ 3.68Å; Y542-F638 HydrophobicContact CG-CZ 3.68Å; Y634-F638 AromaticContact CD1-CD2 3.86Å; Y634-F638 HydrophobicContact CD1-CD2 3.86Å; Y634-F638 HydrophobicContact CD1-CE2 4.38Å; Y634-F638 AromaticContact CD2-CD2 3.8Å; Y634-F638 HydrophobicContact CD2-CD2 3.8Å; Y634-F638 AromaticContact CD2-CE2 3.46Å; Y634-F638 HydrophobicContact CD2-CE2 3.46Å; Y634-F638 VanDerWaalsContact CD2-CE2 3.46Å; Y634-F638 AromaticContact CE1-CD2 3.69Å; Y634-F638 HydrophobicContact CE1-CD2 3.69Å; Y634-F638 HydrophobicContact CE1-CE2 4.23Å; Y634-F638 AromaticContact CE2-CD2 3.65Å; Y634-F638 HydrophobicContact CE2-CD2 3.65Å; Y634-F638 AromaticContact CE2-CE2 3.29Å; Y634-F638 HydrophobicContact CE2-CE2 3.29Å; Y634-F638 HydrophobicContact CE2-CZ 4.25Å; Y634-F638 AromaticContact CG-CD2 3.89Å; Y634-F638 HydrophobicContact CG-CD2 3.89Å; Y634-F638 HydrophobicContact CG-CE2 4.01Å; Y634-F638 AromaticContact CZ-CD2 3.57Å; Y634-F638 AromaticContact CZ-CE2 3.69Å; Y634-F638 WeakPolarHBondContact O-CD2 3.38Å; Y634-F638 PolarHBondContact O-N 3Å; Y634-F638 VanDerWaalsContact O-N 3.14Å; E635-F638 PolarHBondContact O-N 3.44Å; H636-F638 VanDerWaalsContact C-N 3.3Å; H636-F638 PolarHBondContact O-N 3.16Å; F638-P640 VanDerWaalsContact C-N 3.32Å; F638-F641 HydrophobicContact CB-CD2 4.21Å; F638-F641 AromaticContact CD1-CD2 3.83Å; F638-F641 HydrophobicContact CD1-CD2 3.83Å; F638-F641 AromaticContact CD1-CE2 3.64Å; F638-F641 HydrophobicContact CD1-CE2 3.64Å; F638-F641 HydrophobicContact CE1-CE2 4.31Å; F638-F641 VanDerWaalsContact O-CB 3.28Å; F638-F641 WeakPolarHBondContact O-CB 3.28Å; F638-F641 PolarHBondContact O-N 3.01Å
639	A	95.8	Very high	93.9	Very high	40 Å²	40	49.1 Å²	49.1	33%	0.331	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-50.3	-39.7	-178.6	0	0	0	0	0	114.9	E635 F641 N642	E635-A639 WeakPolarHBondContact O-CA 3.43Å; E635-A639 VanDerWaalsContact O-CB 3.32Å; E635-A639 WeakPolarHBondContact O-CB 3.37Å; E635-A639 PolarHBondContact O-N 3.12Å; A639-F641 PolarHBondContact O-N 3.15Å; A639-F641 VanDerWaalsContact O-N 3.08Å; A639-N642 WeakPolarHBondContact O-CB 3.26Å; A639-N642 PolarHBondContact O-N 3.26Å; A639-N642 VanDerWaalsContact O-N 3.14Å; A639-N642 PolarHBondContact O-ND2 3.47Å
640	P	95.2	Very high	94.1	Very high	31 Å²	31	47.4 Å²	47.4	20%	0.201	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-63.1	-14.9	177.4	-25	37.1	0	0	0	114.6	L472 Y521 F638 N642 S643	L472-P640 HydrophobicContact CD1-CB 4.44Å; Y521-P640 HydrophobicContact CE1-CG 3.97Å; Y521-P640 HydrophobicContact CE2-CG 4.07Å; Y521-P640 WeakPolarHBondContact OH-CG 3.42Å; F638-P640 VanDerWaalsContact C-N 3.32Å; P640-N642 VanDerWaalsContact C-N 3.34Å; P640-S643 PolarHBondContact O-OG 2.67Å
641	F	96.3	Very high	94.2	Very high	1 Å²	1	50.8 Å²	50.8	0%	0.004	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-85.5	-9.8	-179.8	-57.3	-14.7	0	0	0	112.7	L472 M518 Y521 L522 Y542 L547 F638 A639 S643 V644	L472-F641 HydrophobicContact CD1-CD1 3.71Å; L472-F641 HydrophobicContact CD1-CE1 3.91Å; M518-F641 HydrophobicContact CB-CD1 4.41Å; M518-F641 HydrophobicContact CB-CE1 3.81Å; M518-F641 HydrophobicContact CB-CE2 4.44Å; M518-F641 HydrophobicContact CB-CZ 3.81Å; M518-F641 HydrophobicContact CE-CB 3.76Å; M518-F641 HydrophobicContact CE-CD1 3.81Å; M518-F641 HydrophobicContact CE-CD2 3.56Å; M518-F641 HydrophobicContact CE-CE1 4.28Å; M518-F641 HydrophobicContact CE-CE2 4.01Å; M518-F641 HydrophobicContact CE-CG 3.43Å; M518-F641 VanDerWaalsContact CE-CG 3.43Å; M518-F641 HydrophobicContact CE-CZ 4.36Å; M518-F641 HydrophobicContact CG-CD1 3.92Å; M518-F641 HydrophobicContact CG-CE1 3.79Å; M518-F641 HydrophobicContact CG-CG 4.5Å; M518-F641 HydrophobicContact CG-CZ 4.22Å; Y521-F641 AromaticContact CD1-CE1 3.94Å; Y521-F641 HydrophobicContact CD1-CE1 3.94Å; Y521-F641 HydrophobicContact CD1-CZ 4.02Å; Y521-F641 HydrophobicContact CG-CE1 4.36Å; L522-F641 HydrophobicContact CD1-CE2 4.08Å; L522-F641 HydrophobicContact CD1-CZ 4.25Å; L522-F641 HydrophobicContact CD2-CE2 4.1Å; L522-F641 HydrophobicContact CD2-CZ 3.96Å; L522-F641 HydrophobicContact CG-CE2 4.09Å; L522-F641 HydrophobicContact CG-CZ 3.82Å; Y542-F641 HydrophobicContact CD1-CE2 4.36Å; Y542-F641 AromaticContact CE1-CD2 3.86Å; Y542-F641 HydrophobicContact CE1-CD2 3.86Å; Y542-F641 AromaticContact CE1-CE2 3.74Å; Y542-F641 HydrophobicContact CE1-CE2 3.74Å; Y542-F641 AromaticContact CZ-CD2 3.97Å; L547-F641 HydrophobicContact CD1-CE2 4.44Å; F638-F641 HydrophobicContact CB-CD2 4.21Å; F638-F641 AromaticContact CD1-CD2 3.83Å; F638-F641 HydrophobicContact CD1-CD2 3.83Å; F638-F641 AromaticContact CD1-CE2 3.64Å; F638-F641 HydrophobicContact CD1-CE2 3.64Å; F638-F641 HydrophobicContact CE1-CE2 4.31Å; F638-F641 VanDerWaalsContact O-CB 3.28Å; F638-F641 WeakPolarHBondContact O-CB 3.28Å; F638-F641 PolarHBondContact O-N 3.01Å; A639-F641 PolarHBondContact O-N 3.15Å; A639-F641 VanDerWaalsContact O-N 3.08Å; F641-S643 PolarHBondContact O-N 3.17Å; F641-V644 PolarHBondContact O-N 3.18Å
642	N	93.8	Very high	94.3	Very high	104 Å²	104	48.7 Å²	48.7	56%	0.556	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-64.9	-20.9	-178.8	-69.2	-21.9	0	0	0	113.5	A639 P640 V644	A639-N642 WeakPolarHBondContact O-CB 3.26Å; A639-N642 PolarHBondContact O-N 3.26Å; A639-N642 VanDerWaalsContact O-N 3.14Å; A639-N642 PolarHBondContact O-ND2 3.47Å; P640-N642 VanDerWaalsContact C-N 3.34Å; N642-V644 VanDerWaalsContact C-N 3.31Å
643	S	91.2	Very high	94.5	Very high	42 Å²	42	51 Å²	51	29%	0.294	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-76.2	-19.6	174.7	57.1	0	0	0	0	112.9	A476 P640 F641	A476-S643 WeakPolarHBondContact CB-O 3.49Å; P640-S643 PolarHBondContact O-OG 2.67Å; F641-S643 PolarHBondContact O-N 3.17Å
644	V	93.3	Very high	94.6	Very high	2 Å²	2	53.7 Å²	53.7	1%	0.012	29%	0.287	C	S	.	.			trans	-93.5	122.7	-176.6	-178.5	0	0	0	0	110.1	L472 A476 F641 N642 T646	L472-V644 HydrophobicContact CB-CG2 4.17Å; L472-V644 HydrophobicContact CD2-CG2 4.12Å; A476-V644 HydrophobicContact CB-CG2 4.39Å; F641-V644 PolarHBondContact O-N 3.18Å; N642-V644 VanDerWaalsContact C-N 3.31Å; V644-T646 WeakPolarHBondContact CG1-O 3.41Å
645	V	90.4	Very high	94.5	Very high	118 Å²	118	53.5 Å²	53.5	72%	0.715	29%	0.286	S	S	*	.			trans	-85.1	-35.2	178.7	-179.4	0	0	0	0	112.1	P647 P648	V645-P647 CarbonylContact O-C 3.58Å; V645-P647 VanDerWaalsContact O-C 3.29Å; V645-P648 VanDerWaalsContact O-CA 3.22Å; V645-P648 WeakPolarHBondContact O-CA 3.31Å; V645-P648 VanDerWaalsContact O-N 3.13Å
646	T	91.1	Very high	94.6	Very high	35 Å²	35	53.2 Å²	53.2	22%	0.215	28%	0.283	C	S	.	.	S	Bend	trans	-124.3	115.4	-179.5	-56.9	0	0	0	0	109.5	L511 W550 V644	L511-T646 HydrophobicContact CD1-CG2 4.03Å; L511-T646 WeakPolarHBondContact CD1-O 3.28Å; L511-T646 HydrophobicContact CD2-CG2 4.25Å; W550-T646 HydrophobicContact CZ3-CG2 4.5Å; V644-T646 WeakPolarHBondContact CG1-O 3.41Å
647	P	92.9	Very high	94.6	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.006	28%	0.278	C	S	.	.	S	Bend	cis	-74.8	152.6	-0	37.7	-39.1	0	0	0	111.8	L515 F546 W550 V645	L515-P647 HydrophobicContact CD2-CG 3.93Å; F546-P647 HydrophobicContact CE1-CB 4.01Å; F546-P647 HydrophobicContact CE1-CG 3.65Å; F546-P647 HydrophobicContact CE2-CB 4.31Å; F546-P647 HydrophobicContact CZ-CB 3.53Å; F546-P647 HydrophobicContact CZ-CG 3.72Å; W550-P647 HydrophobicContact CD2-CB 3.61Å; W550-P647 HydrophobicContact CD2-CG 4.46Å; W550-P647 HydrophobicContact CE3-CB 4.24Å; W550-P647 HydrophobicContact CG-CB 3.81Å; W550-P647 HydrophobicContact CG-CG 4.24Å; W550-P647 HydrophobicContact CH2-CB 4.44Å; W550-P647 HydrophobicContact CZ2-CB 3.85Å; V645-P647 CarbonylContact O-C 3.58Å; V645-P647 VanDerWaalsContact O-C 3.29Å
648	P	92.1	Very high	94.5	Very high	73 Å²	73	53.9 Å²	53.9	47%	0.474	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-66.4	135.3	-176.9	26	-34.2	0	0	0	111.1	F546 V645 V650	F546-P648 WeakPolarHBondContact CZ-O 3.33Å; V645-P648 VanDerWaalsContact O-CA 3.22Å; V645-P648 WeakPolarHBondContact O-CA 3.31Å; V645-P648 VanDerWaalsContact O-N 3.13Å; P648-V650 PolarHBondContact O-N 2.94Å
649	P	91.7	Very high	94.3	Very high	33 Å²	33	54.2 Å²	54.2	21%	0.214	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-60	135.3	-177.1	24.9	-34	0	0	0	111	H651	P649-H651 PolarHBondContact O-N 3.28Å
650	V	95.7	Very high	94.2	Very high	10 Å²	10	55.3 Å²	55.3	6%	0.061	29%	0.294	C	S	.	.			trans	-84.3	108.8	175.5	180	0	0	0	0	109	W541 Y542 F546 Y634 P648 Q654 F655 M658	W541-V650 HydrophobicContact CH2-CG1 3.98Å; W541-V650 HydrophobicContact CZ3-CG1 4.15Å; Y542-V650 HydrophobicContact CE2-CB 3.87Å; Y542-V650 HydrophobicContact CE2-CG2 4.21Å; F546-V650 HydrophobicContact CD1-CG2 4.31Å; F546-V650 HydrophobicContact CD2-CG2 3.59Å; F546-V650 HydrophobicContact CE1-CG2 4.26Å; F546-V650 HydrophobicContact CE2-CG2 3.53Å; F546-V650 HydrophobicContact CG-CG2 3.98Å; F546-V650 HydrophobicContact CZ-CG2 3.89Å; Y634-V650 VanDerWaalsContact CE1-O 3.3Å; Y634-V650 WeakPolarHBondContact CE1-O 3.2Å; Y634-V650 PolarHBondContact OH-O 3.45Å; P648-V650 PolarHBondContact O-N 2.94Å; V650-Q654 HydrophobicContact CG1-CB 3.97Å; V650-F655 HydrophobicContact CG1-CB 4.13Å; V650-M658 HydrophobicContact CB-CE 4.35Å; V650-M658 HydrophobicContact CG1-CE 3.27Å; V650-M658 HydrophobicContact CG2-CE 4.15Å
651	H	95.3	Very high	94	Very high	109 Å²	109	55.5 Å²	55.5	51%	0.505	29%	0.293	S	S	.	.			trans	-70.1	156.6	175.4	-63.7	-66.6	0	0	0	111.6	P649 I653 Q654 F655	P649-H651 PolarHBondContact O-N 3.28Å; H651-I653 VanDerWaalsContact C-N 3.29Å; H651-I653 PolarHBondContact O-N 3.43Å; H651-Q654 WeakPolarHBondContact O-CB 3.2Å; H651-Q654 PolarHBondContact O-N 2.99Å; H651-F655 PolarHBondContact O-N 3.37Å
652	Y	97.1	Very high	93.8	Very high	36 Å²	36	63.5 Å²	63.5	14%	0.141	33%	0.328	C	S	.	.	H	α-helix	trans	-55.1	-41.3	-174.7	177.1	-109.1	0	0	0	113.5	E630 Q631 Y634 Q654 F655 K656	E630-Y652 HydrophobicContact CB-CE2 4.38Å; E630-Y652 HydrophobicContact CG-CE2 3.79Å; E630-Y652 PolarHBondContact OE1-OH 2.95Å; Q631-Y652 HydrophobicContact CB-CD1 3.51Å; Q631-Y652 HydrophobicContact CB-CE1 3.62Å; Q631-Y652 HydrophobicContact CB-CG 3.97Å; Q631-Y652 HydrophobicContact CG-CD1 3.53Å; Q631-Y652 HydrophobicContact CG-CE1 4.16Å; Q631-Y652 HydrophobicContact CG-CG 3.86Å; Y634-Y652 HydrophobicContact CD1-CD2 4.04Å; Y634-Y652 HydrophobicContact CD1-CG 4.39Å; Y634-Y652 HydrophobicContact CD2-CD2 4.11Å; Y634-Y652 AromaticContact CG-CD2 3.71Å; Y634-Y652 HydrophobicContact CG-CD2 3.71Å; Y634-Y652 HydrophobicContact CG-CG 4.48Å; Y652-Q654 VanDerWaalsContact C-N 3.35Å; Y652-Q654 PolarHBondContact O-N 3.46Å; Y652-F655 HydrophobicContact CD2-CD1 4.11Å; Y652-F655 HydrophobicContact CE2-CD1 4.22Å; Y652-F655 WeakPolarHBondContact O-CB 3.06Å; Y652-F655 PolarHBondContact O-N 3.26Å; Y652-K656 HydrophobicContact CD1-CG 4.39Å; Y652-K656 HydrophobicContact CD2-CG 4.41Å; Y652-K656 HydrophobicContact CE1-CD 4.41Å; Y652-K656 HydrophobicContact CE1-CG 3.94Å; Y652-K656 HydrophobicContact CE2-CD 3.74Å; Y652-K656 HydrophobicContact CE2-CG 3.95Å; Y652-K656 WeakPolarHBondContact O-CG 3.49Å; Y652-K656 PolarHBondContact O-N 3.4Å
653	I	96.8	Very high	93.7	Very high	110 Å²	110	64.9 Å²	64.9	56%	0.564	33%	0.329	S	S	*	.	H	α-helix	trans	-59.9	-46.1	177.5	-63	172	0	0	0	110.9	H651 F655 K656 E657	H651-I653 VanDerWaalsContact C-N 3.29Å; H651-I653 PolarHBondContact O-N 3.43Å; I653-F655 VanDerWaalsContact C-N 3.32Å; I653-F655 PolarHBondContact O-N 2.95Å; I653-K656 PolarHBondContact O-N 3.49Å; I653-E657 WeakPolarHBondContact O-CG 3.32Å; I653-E657 PolarHBondContact O-N 3.28Å
654	Q	96	Very high	93.6	Very high	86 Å²	86	69.9 Å²	69.9	40%	0.402	34%	0.343	S	S	.	.	H	α-helix	trans	-64.7	-38.5	178.4	-62.1	173.1	-36.7	0	0	111.2	V650 H651 Y652 E657 M658	V650-Q654 HydrophobicContact CG1-CB 3.97Å; H651-Q654 WeakPolarHBondContact O-CB 3.2Å; H651-Q654 PolarHBondContact O-N 2.99Å; Y652-Q654 VanDerWaalsContact C-N 3.35Å; Y652-Q654 PolarHBondContact O-N 3.46Å; Q654-E657 PolarHBondContact O-N 2.79Å; Q654-M658 HydrophobicContact CB-CE 3.96Å; Q654-M658 WeakPolarHBondContact O-CB 3.31Å; Q654-M658 VanDerWaalsContact O-CE 3.32Å; Q654-M658 WeakPolarHBondContact O-CE 3.29Å; Q654-M658 WeakPolarHBondContact O-CG 3.47Å; Q654-M658 PolarHBondContact O-N 3.26Å
655	F	96.6	Very high	93.3	Very high	0 Å²	0	77.5 Å²	77.5	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-58.6	-49.2	172.4	162.9	-115.3	0	0	0	111.7	Y537 Y538 W541 Y634 V650 H651 Y652 I653 E657 M658 S659	Y537-F655 HydrophobicContact CD2-CZ 4.04Å; Y537-F655 AromaticContact CE2-CE1 3.9Å; Y537-F655 HydrophobicContact CE2-CE1 3.9Å; Y537-F655 AromaticContact CE2-CZ 3.44Å; Y537-F655 HydrophobicContact CE2-CZ 3.44Å; Y537-F655 VanDerWaalsContact CE2-CZ 3.44Å; Y538-F655 VanDerWaalsContact CB-CZ 3.41Å; W541-F655 HydrophobicContact CB-CE2 4.11Å; W541-F655 AromaticContact CD2-CD2 3.46Å; W541-F655 HydrophobicContact CD2-CD2 3.46Å; W541-F655 VanDerWaalsContact CD2-CD2 3.46Å; W541-F655 AromaticContact CD2-CE2 3.41Å; W541-F655 HydrophobicContact CD2-CE2 3.41Å; W541-F655 VanDerWaalsContact CD2-CE2 3.41Å; W541-F655 AromaticContact CE2-CD2 3.83Å; W541-F655 AromaticContact CE3-CD2 3.21Å; W541-F655 HydrophobicContact CE3-CD2 3.21Å; W541-F655 AromaticContact CE3-CE2 3.51Å; W541-F655 HydrophobicContact CE3-CE2 3.51Å; W541-F655 HydrophobicContact CE3-CG 4.31Å; W541-F655 HydrophobicContact CG-CD2 4.23Å; W541-F655 AromaticContact CG-CE2 3.67Å; W541-F655 HydrophobicContact CG-CE2 3.67Å; W541-F655 HydrophobicContact CH2-CB 4.48Å; W541-F655 AromaticContact CH2-CD2 3.87Å; W541-F655 HydrophobicContact CH2-CD2 3.87Å; W541-F655 HydrophobicContact CZ2-CD2 4.04Å; W541-F655 HydrophobicContact CZ3-CB 4.26Å; W541-F655 AromaticContact CZ3-CD2 3.44Å; W541-F655 HydrophobicContact CZ3-CD2 3.44Å; W541-F655 VanDerWaalsContact CZ3-CD2 3.44Å; W541-F655 HydrophobicContact CZ3-CE2 4.21Å; W541-F655 HydrophobicContact CZ3-CG 4.26Å; Y634-F655 AromaticContact CD2-CD1 3.97Å; Y634-F655 HydrophobicContact CD2-CD1 3.97Å; Y634-F655 HydrophobicContact CD2-CE1 4.4Å; Y634-F655 HydrophobicContact CD2-CG 4.42Å; Y634-F655 HydrophobicContact CE2-CB 3.9Å; Y634-F655 AromaticContact CE2-CD1 3.74Å; Y634-F655 HydrophobicContact CE2-CD1 3.74Å; Y634-F655 HydrophobicContact CE2-CD2 4.38Å; Y634-F655 HydrophobicContact CE2-CE1 4.38Å; Y634-F655 AromaticContact CE2-CG 3.72Å; Y634-F655 HydrophobicContact CE2-CG 3.72Å; V650-F655 HydrophobicContact CG1-CB 4.13Å; H651-F655 PolarHBondContact O-N 3.37Å; Y652-F655 HydrophobicContact CD2-CD1 4.11Å; Y652-F655 HydrophobicContact CE2-CD1 4.22Å; Y652-F655 WeakPolarHBondContact O-CB 3.06Å; Y652-F655 PolarHBondContact O-N 3.26Å; I653-F655 VanDerWaalsContact C-N 3.32Å; I653-F655 PolarHBondContact O-N 2.95Å; F655-E657 VanDerWaalsContact C-N 3.3Å; F655-E657 PolarHBondContact O-N 3.36Å; F655-M658 PolarHBondContact O-N 3.26Å; F655-S659 WeakPolarHBondContact O-CB 3.5Å; F655-S659 PolarHBondContact O-N 3.2Å; F655-S659 PolarHBondContact O-OG 3Å
656	K	96.9	Very high	93.2	Very high	82 Å²	82	77 Å²	77	36%	0.357	38%	0.382	S	S	.	.	H	α-helix	trans	-61.4	-39.9	178.1	-63.3	-56.4	-72.3	-163.7	0	111.8	E630 Y652 I653 S659 D660	E630-K656 IonicContact OE1-NZ 3.86Å; E630-K656 PolarHBondContact OE1-NZ 3.44Å; Y652-K656 HydrophobicContact CD1-CG 4.39Å; Y652-K656 HydrophobicContact CD2-CG 4.41Å; Y652-K656 HydrophobicContact CE1-CD 4.41Å; Y652-K656 HydrophobicContact CE1-CG 3.94Å; Y652-K656 HydrophobicContact CE2-CD 3.74Å; Y652-K656 HydrophobicContact CE2-CG 3.95Å; Y652-K656 WeakPolarHBondContact O-CG 3.49Å; Y652-K656 PolarHBondContact O-N 3.4Å; I653-K656 PolarHBondContact O-N 3.49Å; K656-S659 PolarHBondContact O-OG 3.37Å; K656-D660 WeakPolarHBondContact O-CB 3.33Å; K656-D660 PolarHBondContact O-N 3.29Å; K656-D660 VanDerWaalsContact O-N 3.13Å
657	E	95.4	Very high	93.2	Very high	110 Å²	110	78.8 Å²	78.8	51%	0.514	40%	0.395	S	S	.	.	H	α-helix	trans	-62.9	-51.3	174.2	-71.9	175.7	-176.9	0	0	111.2	I653 Q654 F655 S659 D660 K663	I653-E657 WeakPolarHBondContact O-CG 3.32Å; I653-E657 PolarHBondContact O-N 3.28Å; Q654-E657 PolarHBondContact O-N 2.79Å; F655-E657 VanDerWaalsContact C-N 3.3Å; F655-E657 PolarHBondContact O-N 3.36Å; E657-S659 VanDerWaalsContact C-N 3.26Å; E657-S659 PolarHBondContact O-N 3.14Å; E657-D660 PolarHBondContact O-N 3.27Å; E657-K663 VanDerWaalsContact C-NZ 3.28Å; E657-K663 WeakPolarHBondContact O-CE 3.36Å; E657-K663 PolarHBondContact O-NZ 2.77Å
658	M	93.8	Very high	93.3	Very high	98 Å²	98	80.1 Å²	80.1	48%	0.483	40%	0.403	S	S	.	.	H	α-helix	trans	-67.1	-25.4	-177	-71.8	-174	-80.7	0	0	113.6	W541 V650 Q654 F655	W541-M658 HydrophobicContact CH2-CB 4.38Å; W541-M658 HydrophobicContact CH2-CE 3.59Å; W541-M658 HydrophobicContact CH2-SD 4.24Å; W541-M658 HydrophobicContact CZ2-CB 3.69Å; W541-M658 HydrophobicContact CZ2-CE 4.05Å; W541-M658 HydrophobicContact CZ2-SD 4.19Å; V650-M658 HydrophobicContact CB-CE 4.35Å; V650-M658 HydrophobicContact CG1-CE 3.27Å; V650-M658 HydrophobicContact CG2-CE 4.15Å; Q654-M658 HydrophobicContact CB-CE 3.96Å; Q654-M658 WeakPolarHBondContact O-CB 3.31Å; Q654-M658 VanDerWaalsContact O-CE 3.32Å; Q654-M658 WeakPolarHBondContact O-CE 3.29Å; Q654-M658 WeakPolarHBondContact O-CG 3.47Å; Q654-M658 PolarHBondContact O-N 3.26Å; F655-M658 PolarHBondContact O-N 3.26Å
659	S	93.3	Very high	93.5	Very high	18 Å²	18	78 Å²	78	13%	0.126	40%	0.395	C	S	.	.	H	α-helix	trans	-95.7	-0	178.2	59.2	0	0	0	0	114.3	Y608 F655 K656 E657 L661	Y608-S659 WeakPolarHBondContact OH-CB 3.47Å; F655-S659 WeakPolarHBondContact O-CB 3.5Å; F655-S659 PolarHBondContact O-N 3.2Å; F655-S659 PolarHBondContact O-OG 3Å; K656-S659 PolarHBondContact O-OG 3.37Å; E657-S659 VanDerWaalsContact C-N 3.26Å; E657-S659 PolarHBondContact O-N 3.14Å; S659-L661 PolarHBondContact O-N 3Å
660	D	93.2	Very high	93.6	Very high	63 Å²	63	77.3 Å²	77.3	34%	0.337	39%	0.391	S	S	.	.			trans	-70.5	111.3	-177.5	-172.9	7.3	0	0	0	112.5	K656 E657 K662 K663	K656-D660 WeakPolarHBondContact O-CB 3.33Å; K656-D660 PolarHBondContact O-N 3.29Å; K656-D660 VanDerWaalsContact O-N 3.13Å; E657-D660 PolarHBondContact O-N 3.27Å; D660-K662 PolarHBondContact O-N 3.34Å; D660-K662 VanDerWaalsContact OD1-CB 3.31Å; D660-K662 WeakPolarHBondContact OD1-CB 3.46Å; D660-K662 WeakPolarHBondContact OD1-CG 3.48Å; D660-K662 PolarHBondContact OD1-N 3.45Å; D660-K663 HydrophobicContact CB-CD 4.37Å; D660-K663 HydrophobicContact CB-CG 4.3Å; D660-K663 WeakPolarHBondContact O-CB 3.47Å; D660-K663 WeakPolarHBondContact O-CG 3.39Å; D660-K663 PolarHBondContact O-N 3.28Å
661	L	92.3	Very high	93.6	Very high	35 Å²	35	78.8 Å²	78.8	18%	0.183	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-67.8	-18.7	178.1	-59.1	180	0	0	0	113.3	V612 M616 S659 K663 Y664 P668 L673	V612-L661 HydrophobicContact CG1-CD1 3.92Å; M616-L661 HydrophobicContact SD-CD1 3.95Å; S659-L661 PolarHBondContact O-N 3Å; L661-K663 PolarHBondContact O-N 3.35Å; L661-Y664 WeakPolarHBondContact O-CD2 3.19Å; L661-Y664 PolarHBondContact O-N 3.37Å; L661-P668 HydrophobicContact CB-CG 4.2Å; L661-P668 HydrophobicContact CD1-CG 4.44Å; L661-P668 HydrophobicContact CD2-CG 3.97Å; L661-P668 HydrophobicContact CG-CG 4.43Å; L661-L673 HydrophobicContact CD1-CD1 3.87Å; L661-L673 HydrophobicContact CD2-CD2 4.43Å
662	K	91.3	Very high	93.7	Very high	168 Å²	168	78.1 Å²	78.1	73%	0.73	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-68.6	-12.5	178.6	-63	174.6	-178	175.2	0	113.1	D660 Y664	D660-K662 PolarHBondContact O-N 3.34Å; D660-K662 VanDerWaalsContact OD1-CB 3.31Å; D660-K662 WeakPolarHBondContact OD1-CB 3.46Å; D660-K662 WeakPolarHBondContact OD1-CG 3.48Å; D660-K662 PolarHBondContact OD1-N 3.45Å; K662-Y664 PolarHBondContact O-N 2.97Å
663	K	90.9	Very high	93.8	Very high	133 Å²	133	77.1 Å²	77.1	58%	0.578	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-68.9	-17.6	175.1	-65.1	-179	171.1	-172.6	0	113.1	E657 D660 L661	E657-K663 VanDerWaalsContact C-NZ 3.28Å; E657-K663 WeakPolarHBondContact O-CE 3.36Å; E657-K663 PolarHBondContact O-NZ 2.77Å; D660-K663 HydrophobicContact CB-CD 4.37Å; D660-K663 HydrophobicContact CB-CG 4.3Å; D660-K663 WeakPolarHBondContact O-CB 3.47Å; D660-K663 WeakPolarHBondContact O-CG 3.39Å; D660-K663 PolarHBondContact O-N 3.28Å; L661-K663 PolarHBondContact O-N 3.35Å
664	Y	89.2	Confident	93.8	Very high	148 Å²	148	71.9 Å²	71.9	58%	0.58	37%	0.374	S	S	*	.	S	Bend	trans	-93.8	145.9	176.6	-58.5	-78.6	0	0	0	111.1	L661 K662 P666 P667 P668	L661-Y664 WeakPolarHBondContact O-CD2 3.19Å; L661-Y664 PolarHBondContact O-N 3.37Å; K662-Y664 PolarHBondContact O-N 2.97Å; Y664-P666 CarbonylContact C-O 3.58Å; Y664-P666 CarbonylContact O-C 3.26Å; Y664-P666 VanDerWaalsContact O-C 3.26Å; Y664-P667 WeakPolarHBondContact O-CA 3.47Å; Y664-P667 WeakPolarHBondContact O-CD 3.18Å; Y664-P667 VanDerWaalsContact O-N 3.12Å; Y664-P668 HydrophobicContact CD2-CG 4.37Å
665	N	87.4	Confident	93.9	Very high	162 Å²	162	71.4 Å²	71.4	87%	0.866	37%	0.374	S	S	*	.	S	Bend	trans	-126.1	110.8	179.1	-168.4	20.9	0	0	0	111.8
666	P	88.5	Confident	94	Very high	107 Å²	107	72.5 Å²	72.5	70%	0.695	38%	0.383	S	S	*	.	S	Bend	cis	-69.5	158.2	-6.6	30.9	-35.3	0	0	0	112.2	Y664	Y664-P666 CarbonylContact C-O 3.58Å; Y664-P666 CarbonylContact O-C 3.26Å; Y664-P666 VanDerWaalsContact O-C 3.26Å
667	P	91.9	Very high	94.1	Very high	73 Å²	73	68.6 Å²	68.6	47%	0.474	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-60.4	137	173.2	-23.7	34.2	0	0	0	111.1	Y664	Y664-P667 WeakPolarHBondContact O-CA 3.47Å; Y664-P667 WeakPolarHBondContact O-CD 3.18Å; Y664-P667 VanDerWaalsContact O-N 3.12Å
668	P	94.3	Very high	94.2	Very high	29 Å²	29	63.4 Å²	63.4	19%	0.188	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-65.1	137.9	-179.5	27	-35.3	0	0	0	111.4	L661 Y664 D672	L661-P668 HydrophobicContact CB-CG 4.2Å; L661-P668 HydrophobicContact CD1-CG 4.44Å; L661-P668 HydrophobicContact CD2-CG 3.97Å; L661-P668 HydrophobicContact CG-CG 4.43Å; Y664-P668 HydrophobicContact CD2-CG 4.37Å; P668-D672 HydrophobicContact CB-CB 4.05Å
669	G	95.2	Very high	94.5	Very high	29 Å²	29	65.3 Å²	65.3	30%	0.299	35%	0.348	S	S	.	.			trans	-81.9	174.2	172.4	0	0	0	0	0	112.8	A671 D672 L673	G669-A671 VanDerWaalsContact C-N 3.28Å; G669-A671 PolarHBondContact O-N 3.01Å; G669-D672 PolarHBondContact N-OD2 2.9Å; G669-D672 PolarHBondContact O-N 2.87Å; G669-L673 PolarHBondContact O-N 3.16Å; G669-L673 VanDerWaalsContact O-N 3.17Å
670	S	95.4	Very high	94.7	Very high	17 Å²	17	66.6 Å²	66.6	12%	0.119	35%	0.352	C	S	.	.	H	α-helix	trans	-59.9	-37.9	176.7	57.1	0	0	0	0	112.4	D617 D672 L673 Y674	D617-S670 WeakPolarHBondContact OD1-CB 3.48Å; D617-S670 PolarHBondContact OD1-OG 3.4Å; S670-D672 PolarHBondContact O-N 2.94Å; S670-L673 PolarHBondContact O-N 3.45Å; S670-Y674 WeakPolarHBondContact O-CD2 3.4Å; S670-Y674 PolarHBondContact O-N 3.01Å
671	A	96.1	Very high	95	Very high	42 Å²	42	63.6 Å²	63.6	35%	0.347	34%	0.336	S	S	.	.	H	α-helix	trans	-61.4	-40.9	175.5	0	0	0	0	0	113.3	G669 L673 Y674 L675	G669-A671 VanDerWaalsContact C-N 3.28Å; G669-A671 PolarHBondContact O-N 3.01Å; A671-L673 VanDerWaalsContact C-N 3.33Å; A671-Y674 PolarHBondContact O-N 3.44Å; A671-L675 PolarHBondContact O-N 2.85Å
672	D	97	Very high	95.3	Very high	94 Å²	94	64.8 Å²	64.8	50%	0.503	34%	0.34	S	S	.	.	H	α-helix	trans	-65.1	-40.4	177.4	-60.3	-50.3	0	0	0	111	P668 G669 S670 L675 A676	P668-D672 HydrophobicContact CB-CB 4.05Å; G669-D672 PolarHBondContact N-OD2 2.9Å; G669-D672 PolarHBondContact O-N 2.87Å; S670-D672 PolarHBondContact O-N 2.94Å; D672-L675 PolarHBondContact O-N 3.17Å; D672-A676 WeakPolarHBondContact O-CB 3.24Å; D672-A676 PolarHBondContact O-N 3.19Å
673	L	97.6	Very high	95.6	Very high	15 Å²	15	60.7 Å²	60.7	8%	0.079	32%	0.324	C	S	.	.	H	α-helix	trans	-68.5	-40.7	177.9	-70.3	176.1	0	0	0	112.5	V612 A613 M616 L661 G669 S670 A671 L675 A676 A677	V612-L673 HydrophobicContact CB-CD1 4.22Å; V612-L673 HydrophobicContact CG1-CD1 3.67Å; A613-L673 HydrophobicContact CB-CB 3.75Å; A613-L673 HydrophobicContact CB-CD1 4.43Å; M616-L673 HydrophobicContact SD-CD1 3.47Å; M616-L673 WeakPolarHBondContact SD-CD1 3.43Å; L661-L673 HydrophobicContact CD1-CD1 3.87Å; L661-L673 HydrophobicContact CD2-CD2 4.43Å; G669-L673 PolarHBondContact O-N 3.16Å; G669-L673 VanDerWaalsContact O-N 3.17Å; S670-L673 PolarHBondContact O-N 3.45Å; A671-L673 VanDerWaalsContact C-N 3.33Å; L673-L675 VanDerWaalsContact C-N 3.34Å; L673-L675 PolarHBondContact O-N 3.29Å; L673-A676 PolarHBondContact O-N 2.95Å; L673-A677 WeakPolarHBondContact O-CB 3.39Å; L673-A677 PolarHBondContact O-N 3.13Å
674	Y	98.3	Very high	96	Very high	1 Å²	1	54.4 Å²	54.4	0%	0.004	30%	0.296	C	S	.	.	H	α-helix	trans	-61.3	-43	171.9	-69.6	-52.7	0	0	0	111.5	A613 L614 D617 S670 A671 A676 A677 S678 M712 L715	A613-Y674 HydrophobicContact CB-CD1 3.52Å; A613-Y674 HydrophobicContact CB-CD2 4.13Å; A613-Y674 HydrophobicContact CB-CE1 3.35Å; A613-Y674 HydrophobicContact CB-CE2 3.96Å; A613-Y674 HydrophobicContact CB-CG 3.91Å; A613-Y674 PolarHBondContact O-OH 2.99Å; L614-Y674 HydrophobicContact CD2-CE1 4.29Å; L614-Y674 WeakPolarHBondContact CD2-OH 3.22Å; L614-Y674 HydrophobicContact CG-CE1 4.19Å; D617-Y674 WeakPolarHBondContact OD2-CE2 3.33Å; D617-Y674 PolarHBondContact OD2-OH 2.95Å; S670-Y674 WeakPolarHBondContact O-CD2 3.4Å; S670-Y674 PolarHBondContact O-N 3.01Å; A671-Y674 PolarHBondContact O-N 3.44Å; Y674-A676 VanDerWaalsContact C-N 3.33Å; Y674-A676 PolarHBondContact O-N 3.2Å; Y674-A677 WeakPolarHBondContact O-CB 3.28Å; Y674-A677 PolarHBondContact O-N 3.49Å; Y674-S678 PolarHBondContact O-N 2.96Å; Y674-M712 WeakPolarHBondContact CB-O 3.38Å; Y674-M712 HydrophobicContact CD1-SD 3.67Å; Y674-M712 HydrophobicContact CE1-SD 4.34Å; Y674-M712 WeakPolarHBondContact O-CB 3.16Å; Y674-L715 HydrophobicContact CD1-CB 3.9Å; Y674-L715 HydrophobicContact CD1-CD1 4Å; Y674-L715 HydrophobicContact CD2-CB 3.69Å; Y674-L715 HydrophobicContact CE1-CB 3.97Å; Y674-L715 HydrophobicContact CE1-CD1 3.6Å; Y674-L715 HydrophobicContact CE1-CG 4.34Å; Y674-L715 HydrophobicContact CE2-CB 3.79Å; Y674-L715 HydrophobicContact CG-CB 3.76Å
675	L	98.1	Very high	96.4	Very high	75 Å²	75	49.7 Å²	49.7	39%	0.393	28%	0.279	S	S	.	.	H	α-helix	trans	-63.6	-41.1	176.3	-176.2	62.5	0	0	0	111.4	A671 D672 L673 S678 K679 A716	A671-L675 PolarHBondContact O-N 2.85Å; D672-L675 PolarHBondContact O-N 3.17Å; L673-L675 VanDerWaalsContact C-N 3.34Å; L673-L675 PolarHBondContact O-N 3.29Å; L675-S678 WeakPolarHBondContact O-CB 3.4Å; L675-S678 PolarHBondContact O-N 2.68Å; L675-K679 WeakPolarHBondContact O-CG 3.38Å; L675-K679 PolarHBondContact O-N 2.92Å; L675-A716 HydrophobicContact CB-CB 4.43Å
676	A	98	Very high	96.9	Very high	23 Å²	23	46.1 Å²	46.1	19%	0.19	26%	0.259	C	S	.	.	H	α-helix	trans	-64.5	-40.1	175	0	0	0	0	0	112.1	K609 D672 L673 Y674 K679 H680	K609-A676 HydrophobicContact CD-CB 3.72Å; D672-A676 WeakPolarHBondContact O-CB 3.24Å; D672-A676 PolarHBondContact O-N 3.19Å; L673-A676 PolarHBondContact O-N 2.95Å; Y674-A676 VanDerWaalsContact C-N 3.33Å; Y674-A676 PolarHBondContact O-N 3.2Å; A676-K679 WeakPolarHBondContact O-CB 3.46Å; A676-K679 PolarHBondContact O-N 3.31Å; A676-H680 PolarHBondContact O-CD2 3.49Å; A676-H680 PolarHBondContact O-N 2.94Å; A676-H680 VanDerWaalsContact O-N 3.12Å
677	A	98.4	Very high	97.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.9	-46.4	173	0	0	0	0	0	111.3	G606 K609 L673 Y674 K679 H680 F681 M712	G606-A677 WeakPolarHBondContact O-CB 3.48Å; K609-A677 HydrophobicContact CB-CB 3.87Å; L673-A677 WeakPolarHBondContact O-CB 3.39Å; L673-A677 PolarHBondContact O-N 3.13Å; Y674-A677 WeakPolarHBondContact O-CB 3.28Å; Y674-A677 PolarHBondContact O-N 3.49Å; A677-K679 VanDerWaalsContact C-N 3.3Å; A677-K679 PolarHBondContact O-N 2.94Å; A677-H680 PolarHBondContact O-N 3.08Å; A677-H680 VanDerWaalsContact O-N 3.14Å; A677-F681 HydrophobicContact CB-CE2 4.32Å; A677-F681 WeakPolarHBondContact O-CD2 3.46Å; A677-F681 PolarHBondContact O-N 3.23Å; A677-M712 HydrophobicContact CB-CG 3.97Å; A677-M712 HydrophobicContact CB-SD 4.19Å
678	S	98.6	Very high	97.5	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.014	21%	0.207	C	C	.	.	H	α-helix	trans	-57.8	-41.3	175.6	-170.3	0	0	0	0	112.3	Y674 L675 H680 F681 Q682 I709 K713	Y674-S678 PolarHBondContact O-N 2.96Å; L675-S678 WeakPolarHBondContact O-CB 3.4Å; L675-S678 PolarHBondContact O-N 2.68Å; S678-H680 PolarHBondContact O-N 2.98Å; S678-F681 PolarHBondContact O-N 3.49Å; S678-Q682 VanDerWaalsContact O-CB 3.3Å; S678-Q682 WeakPolarHBondContact O-CB 3.38Å; S678-Q682 PolarHBondContact O-N 3.35Å; S678-I709 PolarHBondContact OG-O 3.43Å; S678-I709 VanDerWaalsContact OG-O 3.09Å; S678-K713 WeakPolarHBondContact OG-CE 3.38Å; S678-K713 WeakPolarHBondContact OG-CG 3.26Å
679	K	98.6	Very high	97.6	Very high	138 Å²	138	41.2 Å²	41.2	60%	0.6	22%	0.219	S	C	*	.	H	α-helix	trans	-61.8	-41.6	175.8	-72.5	175	-177.4	176.7	0	112	L675 A676 A677 Q682 Q683	L675-K679 WeakPolarHBondContact O-CG 3.38Å; L675-K679 PolarHBondContact O-N 2.92Å; A676-K679 WeakPolarHBondContact O-CB 3.46Å; A676-K679 PolarHBondContact O-N 3.31Å; A677-K679 VanDerWaalsContact C-N 3.3Å; A677-K679 PolarHBondContact O-N 2.94Å; K679-Q682 PolarHBondContact O-N 3.29Å; K679-Q683 PolarHBondContact O-N 3.09Å
680	H	98.7	Very high	97.6	Very high	44 Å²	44	43.9 Å²	43.9	20%	0.204	23%	0.233	C	C	.	.	H	α-helix	trans	-66.3	-45.4	176.2	-78.7	-67.9	0	0	0	112.6	N602 A605 K609 A676 A677 S678 Q682 Q683 A684	N602-H680 WeakPolarHBondContact O-CB 3.47Å; N602-H680 PolarHBondContact OD1-ND1 3.43Å; A605-H680 HydrophobicContact CB-CB 4.42Å; K609-H680 PolarHBondContact NZ-CD2 3.28Å; K609-H680 PolarHBondContact NZ-NE2 3.01Å; A676-H680 PolarHBondContact O-CD2 3.49Å; A676-H680 PolarHBondContact O-N 2.94Å; A676-H680 VanDerWaalsContact O-N 3.12Å; A677-H680 PolarHBondContact O-N 3.08Å; A677-H680 VanDerWaalsContact O-N 3.14Å; S678-H680 PolarHBondContact O-N 2.98Å; H680-Q682 VanDerWaalsContact C-N 3.26Å; H680-Q682 PolarHBondContact O-N 2.97Å; H680-Q683 WeakPolarHBondContact O-CB 3.41Å; H680-Q683 PolarHBondContact O-N 3.12Å; H680-Q683 VanDerWaalsContact O-N 3.11Å; H680-A684 PolarHBondContact O-N 3.38Å
681	F	98.8	Very high	97.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.8	-36.6	174.7	-65.1	-53.6	0	0	0	112.1	M603 M607 A677 S678 A684 K685 N708 I709 M712	M603-F681 HydrophobicContact CE-CD1 4.19Å; M603-F681 HydrophobicContact CE-CE1 4.17Å; M603-F681 HydrophobicContact SD-CD1 3.76Å; M603-F681 HydrophobicContact SD-CE1 4.22Å; M607-F681 HydrophobicContact CG-CE1 4.22Å; M607-F681 HydrophobicContact CG-CZ 4.08Å; M607-F681 HydrophobicContact SD-CE1 4.25Å; M607-F681 HydrophobicContact SD-CZ 3.71Å; A677-F681 HydrophobicContact CB-CE2 4.32Å; A677-F681 WeakPolarHBondContact O-CD2 3.46Å; A677-F681 PolarHBondContact O-N 3.23Å; S678-F681 PolarHBondContact O-N 3.49Å; F681-A684 PolarHBondContact O-N 3.33Å; F681-K685 WeakPolarHBondContact O-CB 3.42Å; F681-K685 PolarHBondContact O-N 2.84Å; F681-N708 HydrophobicContact CD1-CB 4.42Å; F681-N708 HydrophobicContact CD2-CB 3.82Å; F681-N708 HydrophobicContact CE1-CB 4.39Å; F681-N708 HydrophobicContact CE2-CB 3.79Å; F681-N708 HydrophobicContact CG-CB 4.15Å; F681-N708 HydrophobicContact CZ-CB 4.08Å; F681-I709 HydrophobicContact CB-CD1 4.35Å; F681-I709 HydrophobicContact CB-CG1 3.52Å; F681-M712 HydrophobicContact CD2-CG 4.1Å; F681-M712 HydrophobicContact CE2-CG 3.89Å
682	Q	98.6	Very high	96.8	Very high	61 Å²	61	47.5 Å²	47.5	29%	0.285	25%	0.252	S	S	.	.	H	α-helix	trans	-64.1	-41.8	173.5	-178.9	65.1	41	0	0	111.5	S678 K679 H680 K685 L686 I709	S678-Q682 VanDerWaalsContact O-CB 3.3Å; S678-Q682 WeakPolarHBondContact O-CB 3.38Å; S678-Q682 PolarHBondContact O-N 3.35Å; K679-Q682 PolarHBondContact O-N 3.29Å; H680-Q682 VanDerWaalsContact C-N 3.26Å; H680-Q682 PolarHBondContact O-N 2.97Å; Q682-K685 WeakPolarHBondContact O-CB 3.34Å; Q682-K685 PolarHBondContact O-N 2.74Å; Q682-L686 HydrophobicContact CG-CD1 4.44Å; Q682-L686 WeakPolarHBondContact O-CG 3.49Å; Q682-L686 PolarHBondContact O-N 3.03Å; Q682-I709 HydrophobicContact CB-CD1 4.31Å; Q682-I709 HydrophobicContact CB-CG1 4.46Å
683	Q	98.4	Very high	96.4	Very high	82 Å²	82	50.4 Å²	50.4	38%	0.383	27%	0.267	S	S	.	.	H	α-helix	trans	-64.6	-44.9	176.4	-172.6	62.5	23.2	0	0	111.3	K679 H680 K685 L686 I687	K679-Q683 PolarHBondContact O-N 3.09Å; H680-Q683 WeakPolarHBondContact O-CB 3.41Å; H680-Q683 PolarHBondContact O-N 3.12Å; H680-Q683 VanDerWaalsContact O-N 3.11Å; Q683-K685 VanDerWaalsContact C-N 3.32Å; Q683-K685 PolarHBondContact O-N 3.27Å; Q683-L686 PolarHBondContact O-N 3.34Å; Q683-I687 HydrophobicContact CG-CD1 4Å; Q683-I687 VanDerWaalsContact O-CG1 3.26Å; Q683-I687 WeakPolarHBondContact O-CG1 3.35Å; Q683-I687 PolarHBondContact O-N 3.11Å
684	A	98.3	Very high	95.9	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-57.1	-46.3	174	0	0	0	0	0	111.2	N602 M603 H680 F681 L686 I687 L688	N602-A684 HydrophobicContact CB-CB 3.84Å; M603-A684 HydrophobicContact CG-CB 3.94Å; M603-A684 HydrophobicContact SD-CB 3.81Å; H680-A684 PolarHBondContact O-N 3.38Å; F681-A684 PolarHBondContact O-N 3.33Å; A684-L686 PolarHBondContact O-N 3.03Å; A684-I687 PolarHBondContact O-N 3.01Å; A684-L688 WeakPolarHBondContact O-CB 3.4Å; A684-L688 WeakPolarHBondContact O-CG 3.12Å; A684-L688 PolarHBondContact O-N 3.49Å
685	K	98.3	Very high	95.5	Very high	49 Å²	49	55 Å²	55	21%	0.213	30%	0.295	C	S	.	.	H	α-helix	trans	-56.7	-49.8	175.4	177.3	-168.1	167.4	-173.3	0	111.9	F681 Q682 Q683 I687 L688 E689 L702 K706 I709	F681-K685 WeakPolarHBondContact O-CB 3.42Å; F681-K685 PolarHBondContact O-N 2.84Å; Q682-K685 WeakPolarHBondContact O-CB 3.34Å; Q682-K685 PolarHBondContact O-N 2.74Å; Q683-K685 VanDerWaalsContact C-N 3.32Å; Q683-K685 PolarHBondContact O-N 3.27Å; K685-I687 VanDerWaalsContact C-N 3.33Å; K685-I687 PolarHBondContact O-N 2.75Å; K685-L688 PolarHBondContact O-N 2.71Å; K685-E689 WeakPolarHBondContact CE-OE1 3.43Å; K685-E689 WeakPolarHBondContact CE-OE2 3.29Å; K685-E689 HydrophobicContact CG-CG 4.3Å; K685-E689 IonicContact NZ-OE1 3.98Å; K685-E689 WeakPolarHBondContact O-CB 3.44Å; K685-E689 WeakPolarHBondContact O-CG 3.47Å; K685-E689 PolarHBondContact O-N 3.03Å; K685-L702 HydrophobicContact CB-CD2 4.34Å; K685-L702 HydrophobicContact CG-CD2 3.96Å; K685-K706 HydrophobicContact CD-CG 4.21Å; K685-I709 HydrophobicContact CB-CD1 4.16Å; K685-I709 HydrophobicContact CD-CD1 3.86Å
686	L	98.1	Very high	95.2	Very high	87 Å²	87	54.3 Å²	54.3	46%	0.455	30%	0.301	S	S	.	.	H	α-helix	trans	-61.7	-41.1	-179.1	-71.3	173.4	0	0	0	112	Q682 Q683 A684 S690	Q682-L686 HydrophobicContact CG-CD1 4.44Å; Q682-L686 WeakPolarHBondContact O-CG 3.49Å; Q682-L686 PolarHBondContact O-N 3.03Å; Q683-L686 PolarHBondContact O-N 3.34Å; A684-L686 PolarHBondContact O-N 3.03Å; L686-S690 PolarHBondContact O-N 3.17Å
687	I	97.1	Very high	94.9	Very high	13 Å²	13	54.9 Å²	54.9	7%	0.067	30%	0.299	C	S	.	.	H	α-helix	trans	-61.8	-49.7	176	-68	165.6	0	0	0	109.9	T595 Q598 A599 Q683 A684 K685 S690	T595-I687 HydrophobicContact CG2-CG2 3.51Å; T595-I687 WeakPolarHBondContact O-CG2 3.37Å; Q598-I687 HydrophobicContact CB-CD1 4.25Å; Q598-I687 HydrophobicContact CG-CD1 3.69Å; A599-I687 HydrophobicContact CB-CG2 4.1Å; Q683-I687 HydrophobicContact CG-CD1 4Å; Q683-I687 VanDerWaalsContact O-CG1 3.26Å; Q683-I687 WeakPolarHBondContact O-CG1 3.35Å; Q683-I687 PolarHBondContact O-N 3.11Å; A684-I687 PolarHBondContact O-N 3.01Å; K685-I687 VanDerWaalsContact C-N 3.33Å; K685-I687 PolarHBondContact O-N 2.75Å; I687-S690 WeakPolarHBondContact O-CB 3.01Å; I687-S690 PolarHBondContact O-N 2.74Å; I687-S690 VanDerWaalsContact O-N 3.17Å; I687-S690 PolarHBondContact O-OG 2.65Å
688	L	96.3	Very high	94.7	Very high	1 Å²	1	55 Å²	55	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-68	-37.6	-176.8	-69.7	169.5	0	0	0	113.1	M596 A599 A684 K685 S690 V691 V698 T701 L702	M596-L688 HydrophobicContact CE-CD2 4.32Å; M596-L688 HydrophobicContact SD-CD2 3.94Å; A599-L688 HydrophobicContact CB-CD1 4.19Å; A599-L688 HydrophobicContact CB-CD2 3.63Å; A599-L688 HydrophobicContact CB-CG 3.73Å; A684-L688 WeakPolarHBondContact O-CB 3.4Å; A684-L688 WeakPolarHBondContact O-CG 3.12Å; A684-L688 PolarHBondContact O-N 3.49Å; K685-L688 PolarHBondContact O-N 2.71Å; L688-S690 PolarHBondContact O-N 3.26Å; L688-V691 WeakPolarHBondContact O-CB 3.45Å; L688-V691 PolarHBondContact O-N 2.98Å; L688-V698 HydrophobicContact CB-CG1 4.11Å; L688-V698 HydrophobicContact CD2-CB 4.47Å; L688-V698 HydrophobicContact CD2-CG1 4.1Å; L688-V698 HydrophobicContact CD2-CG2 4.17Å; L688-T701 HydrophobicContact CD1-CG2 3.45Å; L688-T701 VanDerWaalsContact CD1-CG2 3.45Å; L688-L702 HydrophobicContact CB-CD1 4.27Å; L688-L702 HydrophobicContact CB-CD2 3.76Å; L688-L702 HydrophobicContact CB-CG 3.88Å; L688-L702 HydrophobicContact CD1-CD2 4.23Å; L688-L702 HydrophobicContact CD1-CG 4.18Å
689	E	96	Very high	94.6	Very high	92 Å²	92	58.7 Å²	58.7	43%	0.43	32%	0.319	S	S	.	.	H	α-helix	trans	-68.3	-17.6	175.1	-74	178	165.9	0	0	112.6	K685 V691 L702 K706	K685-E689 WeakPolarHBondContact CE-OE1 3.43Å; K685-E689 WeakPolarHBondContact CE-OE2 3.29Å; K685-E689 HydrophobicContact CG-CG 4.3Å; K685-E689 IonicContact NZ-OE1 3.98Å; K685-E689 WeakPolarHBondContact O-CB 3.44Å; K685-E689 WeakPolarHBondContact O-CG 3.47Å; K685-E689 PolarHBondContact O-N 3.03Å; E689-V691 VanDerWaalsContact C-N 3.35Å; E689-L702 HydrophobicContact CG-CD1 4.34Å; E689-L702 HydrophobicContact CG-CD2 3.98Å; E689-K706 WeakPolarHBondContact OE1-CE 3.47Å; E689-K706 IonicContact OE1-NZ 3.33Å; E689-K706 PolarHBondContact OE1-NZ 3.35Å
690	S	94.2	Very high	94.5	Very high	85 Å²	85	56.6 Å²	56.6	59%	0.594	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-10.1	174.5	80.9	0	0	0	0	114	L686 I687 L688 P692	L686-S690 PolarHBondContact O-N 3.17Å; I687-S690 WeakPolarHBondContact O-CB 3.01Å; I687-S690 PolarHBondContact O-N 2.74Å; I687-S690 VanDerWaalsContact O-N 3.17Å; I687-S690 PolarHBondContact O-OG 2.65Å; L688-S690 PolarHBondContact O-N 3.26Å; S690-P692 WeakPolarHBondContact O-CD 3.14Å
691	V	91.5	Very high	94.4	Very high	27 Å²	27	54.5 Å²	54.5	16%	0.164	30%	0.298	C	S	.	.	S	Bend	trans	-72.6	121	-179.3	179.2	0	0	0	0	110	T595 L688 E689 N693 V698	T595-V691 HydrophobicContact CG2-CG2 3.76Å; L688-V691 WeakPolarHBondContact O-CB 3.45Å; L688-V691 PolarHBondContact O-N 2.98Å; E689-V691 VanDerWaalsContact C-N 3.35Å; V691-N693 PolarHBondContact O-N 3.33Å; V691-V698 HydrophobicContact CG1-CG2 4.42Å
692	P	85	Confident	94.3	Very high	109 Å²	109	55.2 Å²	55.2	71%	0.708	30%	0.302	S	S	*	.	S	Bend	trans	-70.9	131.8	175.3	29.8	-32.7	0	0	0	109.7	S690	S690-P692 WeakPolarHBondContact O-CD 3.14Å
693	N	86.9	Confident	94.3	Very high	155 Å²	155	58.6 Å²	58.6	83%	0.829	32%	0.315	S	S	*	.	S	Bend	trans	55.6	71.3	-176.9	-56.3	-30.9	0	0	0	112.7	V691 D695	V691-N693 PolarHBondContact O-N 3.33Å; N693-D695 PolarHBondContact O-N 3.32Å
694	P	88.1	Confident	94.3	Very high	61 Å²	61	54.7 Å²	54.7	40%	0.396	30%	0.297	S	S	.	.			trans	-62.4	125.7	-176.6	27.1	-35.1	0	0	0	111.2	V698 N699	P694-V698 HydrophobicContact CB-CB 3.87Å; P694-V698 HydrophobicContact CB-CG1 3.48Å; P694-V698 VanDerWaalsContact CB-CG1 3.48Å; P694-N699 PolarHBondContact O-ND2 3.37Å
695	D	89.9	Confident	94.3	Very high	51 Å²	51	54.7 Å²	54.7	27%	0.273	30%	0.297	S	S	.	.			trans	-75.3	177.6	175.1	59	31.2	0	0	0	111.8	K592 N693 E697 V698 N699	K592-D695 IonicContact NZ-OD2 3.26Å; K592-D695 PolarHBondContact NZ-OD2 3.33Å; N693-D695 PolarHBondContact O-N 3.32Å; D695-E697 PolarHBondContact O-N 3.16Å; D695-E697 PolarHBondContact OD1-N 3.02Å; D695-V698 PolarHBondContact O-N 2.99Å; D695-V698 WeakPolarHBondContact OD1-CG2 3.44Å; D695-V698 PolarHBondContact OD1-N 3.24Å; D695-N699 PolarHBondContact O-N 2.91Å; D695-N699 VanDerWaalsContact O-N 3.13Å; D695-N699 PolarHBondContact O-ND2 2.99Å
696	A	91.1	Very high	94.3	Very high	61 Å²	61	56.8 Å²	56.8	50%	0.504	31%	0.307	S	S	.	.	H	α-helix	trans	-58.9	-31.9	-178.3	0	0	0	0	0	112.1	N699 R700	A696-N699 PolarHBondContact O-N 3.33Å; A696-R700 WeakPolarHBondContact O-CG 3.49Å; A696-R700 PolarHBondContact O-N 3.02Å
697	E	91.9	Very high	94.2	Very high	35 Å²	35	54.8 Å²	54.8	16%	0.164	30%	0.299	C	S	.	.	H	α-helix	trans	-73	-44.9	-178.2	-178.3	43.9	-135	0	0	112	M596 Y600 D695 N699 R700 T701 H734	M596-E697 HydrophobicContact CE-CG 4.15Å; Y600-E697 VanDerWaalsContact OH-CD 3.31Å; Y600-E697 PolarHBondContact OH-OE1 3.46Å; D695-E697 PolarHBondContact O-N 3.16Å; D695-E697 PolarHBondContact OD1-N 3.02Å; E697-N699 VanDerWaalsContact C-N 3.27Å; E697-N699 PolarHBondContact O-N 2.94Å; E697-R700 PolarHBondContact O-N 3.5Å; E697-R700 IonicContact OE2-CZ 2.7Å; E697-R700 VanDerWaalsContact OE2-CZ 3.27Å; E697-R700 IonicContact OE2-NE 3.53Å; E697-R700 PolarHBondContact OE2-NE 3.09Å; E697-R700 IonicContact OE2-NH2 2.83Å; E697-R700 PolarHBondContact OE2-NH2 3.4Å; E697-T701 PolarHBondContact O-N 3.46Å; E697-T701 PolarHBondContact O-OG1 3.35Å; E697-T701 PolarHBondContact OE1-OG1 2.91Å; E697-T701 VanDerWaalsContact OE1-OG1 3.09Å; E697-H734 IonicContact OE1-CD2 3.38Å; E697-H734 IonicContact OE1-NE2 3.45Å; E697-H734 PolarHBondContact OE1-NE2 2.72Å
698	V	95	Very high	94.3	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-55.7	-45.1	171.1	172.3	0	0	0	0	111	M596 L688 V691 P694 D695 T701 L702	M596-V698 HydrophobicContact CE-CG2 4.23Å; M596-V698 HydrophobicContact SD-CG2 3.69Å; L688-V698 HydrophobicContact CB-CG1 4.11Å; L688-V698 HydrophobicContact CD2-CB 4.47Å; L688-V698 HydrophobicContact CD2-CG1 4.1Å; L688-V698 HydrophobicContact CD2-CG2 4.17Å; V691-V698 HydrophobicContact CG1-CG2 4.42Å; P694-V698 HydrophobicContact CB-CB 3.87Å; P694-V698 HydrophobicContact CB-CG1 3.48Å; P694-V698 VanDerWaalsContact CB-CG1 3.48Å; D695-V698 PolarHBondContact O-N 2.99Å; D695-V698 WeakPolarHBondContact OD1-CG2 3.44Å; D695-V698 PolarHBondContact OD1-N 3.24Å; V698-T701 PolarHBondContact O-N 3.27Å; V698-L702 HydrophobicContact CG1-CD1 3.99Å; V698-L702 WeakPolarHBondContact O-CB 3.34Å; V698-L702 WeakPolarHBondContact O-CG 3.39Å; V698-L702 PolarHBondContact O-N 3.12Å
699	N	95.9	Very high	94.4	Very high	80 Å²	80	54.7 Å²	54.7	43%	0.428	30%	0.298	S	S	.	.	H	α-helix	trans	-66.7	-41	-179.3	-73	-57	0	0	0	112.8	P694 D695 A696 E697 L702 K703	P694-N699 PolarHBondContact O-ND2 3.37Å; D695-N699 PolarHBondContact O-N 2.91Å; D695-N699 VanDerWaalsContact O-N 3.13Å; D695-N699 PolarHBondContact O-ND2 2.99Å; A696-N699 PolarHBondContact O-N 3.33Å; E697-N699 VanDerWaalsContact C-N 3.27Å; E697-N699 PolarHBondContact O-N 2.94Å; N699-L702 PolarHBondContact O-N 2.86Å; N699-K703 WeakPolarHBondContact O-CB 3.4Å; N699-K703 PolarHBondContact O-N 3.21Å
700	R	95.9	Very high	94.5	Very high	95 Å²	95	54.3 Å²	54.3	36%	0.358	30%	0.302	S	S	.	.	H	α-helix	trans	-61.7	-46.2	174.1	-76.6	-174.5	-63.5	-104	8	111.5	A696 E697 L702 K703 V704	A696-R700 WeakPolarHBondContact O-CG 3.49Å; A696-R700 PolarHBondContact O-N 3.02Å; E697-R700 PolarHBondContact O-N 3.5Å; E697-R700 IonicContact OE2-CZ 2.7Å; E697-R700 VanDerWaalsContact OE2-CZ 3.27Å; E697-R700 IonicContact OE2-NE 3.53Å; E697-R700 PolarHBondContact OE2-NE 3.09Å; E697-R700 IonicContact OE2-NH2 2.83Å; E697-R700 PolarHBondContact OE2-NH2 3.4Å; R700-L702 PolarHBondContact O-N 3.13Å; R700-K703 WeakPolarHBondContact O-CB 3.49Å; R700-K703 PolarHBondContact O-N 3.23Å; R700-V704 PolarHBondContact O-N 2.88Å
701	T	97.1	Very high	94.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.2	-42	178.7	-59.4	0	0	0	0	111.5	M603 L688 E697 V698 K703 V704 A705	M603-T701 HydrophobicContact CE-CG2 4.16Å; M603-T701 HydrophobicContact CG-CG2 3.81Å; M603-T701 HydrophobicContact SD-CG2 4.07Å; L688-T701 HydrophobicContact CD1-CG2 3.45Å; L688-T701 VanDerWaalsContact CD1-CG2 3.45Å; E697-T701 PolarHBondContact O-N 3.46Å; E697-T701 PolarHBondContact O-OG1 3.35Å; E697-T701 PolarHBondContact OE1-OG1 2.91Å; E697-T701 VanDerWaalsContact OE1-OG1 3.09Å; V698-T701 PolarHBondContact O-N 3.27Å; T701-K703 VanDerWaalsContact C-N 3.31Å; T701-K703 PolarHBondContact O-N 3.02Å; T701-V704 PolarHBondContact O-N 3.41Å; T701-V704 VanDerWaalsContact O-N 3.14Å; T701-A705 PolarHBondContact O-N 3.37Å
702	L	97.6	Very high	94.9	Very high	14 Å²	14	50 Å²	50	7%	0.073	27%	0.272	C	S	.	.	H	α-helix	trans	-61.8	-36.5	174.6	-78.9	171.2	0	0	0	113	K685 L688 E689 V698 N699 R700 V704 A705 K706	K685-L702 HydrophobicContact CB-CD2 4.34Å; K685-L702 HydrophobicContact CG-CD2 3.96Å; L688-L702 HydrophobicContact CB-CD1 4.27Å; L688-L702 HydrophobicContact CB-CD2 3.76Å; L688-L702 HydrophobicContact CB-CG 3.88Å; L688-L702 HydrophobicContact CD1-CD2 4.23Å; L688-L702 HydrophobicContact CD1-CG 4.18Å; E689-L702 HydrophobicContact CG-CD1 4.34Å; E689-L702 HydrophobicContact CG-CD2 3.98Å; V698-L702 HydrophobicContact CG1-CD1 3.99Å; V698-L702 WeakPolarHBondContact O-CB 3.34Å; V698-L702 WeakPolarHBondContact O-CG 3.39Å; V698-L702 PolarHBondContact O-N 3.12Å; N699-L702 PolarHBondContact O-N 2.86Å; R700-L702 PolarHBondContact O-N 3.13Å; L702-V704 PolarHBondContact O-N 3.49Å; L702-A705 PolarHBondContact O-N 3.11Å; L702-K706 WeakPolarHBondContact O-CG 3.38Å; L702-K706 PolarHBondContact O-N 2.96Å; L702-K706 VanDerWaalsContact O-N 3.16Å
703	K	97.5	Very high	95.5	Very high	132 Å²	132	50.4 Å²	50.4	57%	0.574	26%	0.263	S	S	*	.	H	α-helix	trans	-62.8	-27	176.7	-169.8	177.7	177.7	-174.2	0	112.2	N699 R700 T701 P707 A733	N699-K703 WeakPolarHBondContact O-CB 3.4Å; N699-K703 PolarHBondContact O-N 3.21Å; R700-K703 WeakPolarHBondContact O-CB 3.49Å; R700-K703 PolarHBondContact O-N 3.23Å; T701-K703 VanDerWaalsContact C-N 3.31Å; T701-K703 PolarHBondContact O-N 3.02Å; K703-P707 WeakPolarHBondContact O-CD 3.47Å; K703-P707 WeakPolarHBondContact O-CG 3.42Å; K703-A733 HydrophobicContact CD-CB 4.11Å; K703-A733 HydrophobicContact CG-CB 4.37Å
704	V	98.1	Very high	95.9	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-88.1	-45.3	175	-179.4	0	0	0	0	112.2	M603 R700 T701 L702 K706 P707 N708 A733 H734 F737 P738 I739	M603-V704 HydrophobicContact CE-CB 4.18Å; M603-V704 HydrophobicContact CE-CG1 3.92Å; R700-V704 PolarHBondContact O-N 2.88Å; T701-V704 PolarHBondContact O-N 3.41Å; T701-V704 VanDerWaalsContact O-N 3.14Å; L702-V704 PolarHBondContact O-N 3.49Å; V704-K706 VanDerWaalsContact C-N 3.35Å; V704-K706 PolarHBondContact O-N 2.89Å; V704-P707 WeakPolarHBondContact O-CD 3.41Å; V704-N708 PolarHBondContact O-N 2.92Å; V704-A733 HydrophobicContact CG2-CB 3.98Å; V704-H734 HydrophobicContact CG2-CB 3.65Å; V704-F737 HydrophobicContact CG1-CB 4Å; V704-P738 VanDerWaalsContact CG1-O 3.29Å; V704-P738 WeakPolarHBondContact CG1-O 3.48Å; V704-I739 HydrophobicContact CB-CG1 4.37Å; V704-I739 HydrophobicContact CG1-CG1 4.26Å; V704-I739 HydrophobicContact CG2-CG1 4.14Å
705	A	98.3	Very high	96.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.6	-43.4	-176.7	0	0	0	0	0	112.3	M603 T701 L702 N708 I709	M603-A705 HydrophobicContact CE-CB 4.3Å; M603-A705 HydrophobicContact SD-CB 3.78Å; T701-A705 PolarHBondContact O-N 3.37Å; L702-A705 PolarHBondContact O-N 3.11Å; A705-N708 PolarHBondContact O-N 2.88Å; A705-I709 WeakPolarHBondContact O-CD1 3.34Å; A705-I709 VanDerWaalsContact O-CG1 3.24Å; A705-I709 WeakPolarHBondContact O-CG1 3.3Å; A705-I709 PolarHBondContact O-N 3Å
706	K	97.9	Very high	96.4	Very high	94 Å²	94	43.3 Å²	43.3	41%	0.409	23%	0.225	S	C	.	.	H	α-helix	trans	-61.3	-53.4	-175	-73.4	173.5	-177.2	-179.3	0	113.2	K685 E689 L702 V704 I709	K685-K706 HydrophobicContact CD-CG 4.21Å; E689-K706 WeakPolarHBondContact OE1-CE 3.47Å; E689-K706 IonicContact OE1-NZ 3.33Å; E689-K706 PolarHBondContact OE1-NZ 3.35Å; L702-K706 WeakPolarHBondContact O-CG 3.38Å; L702-K706 PolarHBondContact O-N 2.96Å; L702-K706 VanDerWaalsContact O-N 3.16Å; V704-K706 VanDerWaalsContact C-N 3.35Å; V704-K706 PolarHBondContact O-N 2.89Å; K706-I709 PolarHBondContact O-N 3.25Å
707	P	97.8	Very high	96.5	Very high	45 Å²	45	43.9 Å²	43.9	29%	0.292	24%	0.236	S	C	.	.	H	α-helix	trans	-58.4	-45.8	173	-26.2	34.6	0	0	0	112.9	K703 V704 I709 V710 V711 I739	K703-P707 WeakPolarHBondContact O-CD 3.47Å; K703-P707 WeakPolarHBondContact O-CG 3.42Å; V704-P707 WeakPolarHBondContact O-CD 3.41Å; P707-I709 VanDerWaalsContact C-N 3.28Å; P707-I709 PolarHBondContact O-N 3.35Å; P707-V710 WeakPolarHBondContact O-CB 3.4Å; P707-V710 PolarHBondContact O-N 3.45Å; P707-V711 VanDerWaalsContact O-CG2 3.32Å; P707-V711 WeakPolarHBondContact O-CG2 3.5Å; P707-V711 PolarHBondContact O-N 3.44Å; P707-I739 HydrophobicContact CB-CG2 3.98Å; P707-I739 HydrophobicContact CG-CD1 4.45Å; P707-I739 HydrophobicContact CG-CG2 4.49Å
708	N	98.3	Very high	96.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.8	-33.1	-176.3	-71.9	-4.8	0	0	0	112.2	F681 V704 A705 V710 V711 M712 P738 V740	F681-N708 HydrophobicContact CD1-CB 4.42Å; F681-N708 HydrophobicContact CD2-CB 3.82Å; F681-N708 HydrophobicContact CE1-CB 4.39Å; F681-N708 HydrophobicContact CE2-CB 3.79Å; F681-N708 HydrophobicContact CG-CB 4.15Å; F681-N708 HydrophobicContact CZ-CB 4.08Å; V704-N708 PolarHBondContact O-N 2.92Å; A705-N708 PolarHBondContact O-N 2.88Å; N708-V710 VanDerWaalsContact C-N 3.32Å; N708-V710 PolarHBondContact O-N 2.87Å; N708-V711 PolarHBondContact O-N 3.34Å; N708-M712 WeakPolarHBondContact O-CB 2.92Å; N708-M712 WeakPolarHBondContact O-CG 3.34Å; N708-M712 PolarHBondContact O-N 3.28Å; N708-P738 PolarHBondContact ND2-O 3.47Å; N708-V740 PolarHBondContact OD1-N 3.07Å
709	I	98.4	Very high	96	Very high	11 Å²	11	47.9 Å²	47.9	6%	0.056	26%	0.264	C	S	.	.	H	α-helix	trans	-56.1	-47.1	171.5	-68.9	159.5	0	0	0	111.4	S678 F681 Q682 K685 A705 K706 P707 K713	S678-I709 PolarHBondContact OG-O 3.43Å; S678-I709 VanDerWaalsContact OG-O 3.09Å; F681-I709 HydrophobicContact CB-CD1 4.35Å; F681-I709 HydrophobicContact CB-CG1 3.52Å; Q682-I709 HydrophobicContact CB-CD1 4.31Å; Q682-I709 HydrophobicContact CB-CG1 4.46Å; K685-I709 HydrophobicContact CB-CD1 4.16Å; K685-I709 HydrophobicContact CD-CD1 3.86Å; A705-I709 WeakPolarHBondContact O-CD1 3.34Å; A705-I709 VanDerWaalsContact O-CG1 3.24Å; A705-I709 WeakPolarHBondContact O-CG1 3.3Å; A705-I709 PolarHBondContact O-N 3Å; K706-I709 PolarHBondContact O-N 3.25Å; P707-I709 VanDerWaalsContact C-N 3.28Å; P707-I709 PolarHBondContact O-N 3.35Å; I709-K713 HydrophobicContact CG2-CD 4.47Å; I709-K713 WeakPolarHBondContact O-CG 3.4Å; I709-K713 PolarHBondContact O-N 3.17Å
710	V	97.7	Very high	95.3	Very high	84 Å²	84	47.3 Å²	47.3	51%	0.509	26%	0.258	S	S	.	.	H	α-helix	trans	-68.9	-49.2	-177.2	179.4	0	0	0	0	110.1	P707 N708 M712 K713 L714	P707-V710 WeakPolarHBondContact O-CB 3.4Å; P707-V710 PolarHBondContact O-N 3.45Å; N708-V710 VanDerWaalsContact C-N 3.32Å; N708-V710 PolarHBondContact O-N 2.87Å; V710-M712 VanDerWaalsContact C-N 3.33Å; V710-M712 PolarHBondContact O-N 2.95Å; V710-K713 PolarHBondContact O-N 3.29Å; V710-K713 VanDerWaalsContact O-N 3.13Å; V710-L714 HydrophobicContact CG1-CD1 4.16Å; V710-L714 HydrophobicContact CG1-CG 4.5Å; V710-L714 WeakPolarHBondContact O-CG 3.41Å; V710-L714 PolarHBondContact O-N 3.3Å
711	V	96.9	Very high	94.7	Very high	22 Å²	22	49 Å²	49	13%	0.133	27%	0.267	C	S	.	.	H	α-helix	trans	-58.6	-45.6	-179.1	176.7	0	0	0	0	110.8	P707 N708 K713 L714 L715 V740 I742	P707-V711 VanDerWaalsContact O-CG2 3.32Å; P707-V711 WeakPolarHBondContact O-CG2 3.5Å; P707-V711 PolarHBondContact O-N 3.44Å; N708-V711 PolarHBondContact O-N 3.34Å; V711-K713 PolarHBondContact O-N 3.47Å; V711-L714 PolarHBondContact O-N 3.48Å; V711-L715 HydrophobicContact CG1-CD1 4.24Å; V711-L715 PolarHBondContact O-N 3.18Å; V711-V740 HydrophobicContact CG1-CB 4.28Å; V711-V740 HydrophobicContact CG1-CG1 4.19Å; V711-V740 WeakPolarHBondContact CG2-O 3.4Å; V711-I742 HydrophobicContact CG1-CD1 3.51Å; V711-I742 HydrophobicContact CG1-CG1 3.73Å
712	M	97.9	Very high	94	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-64.2	-37.5	177.8	-68.9	-49.8	107.1	0	0	112.5	T610 Y674 A677 F681 N708 V710 L715 A716 V740	T610-M712 HydrophobicContact CG2-CE 3.55Å; T610-M712 HydrophobicContact CG2-SD 3.6Å; T610-M712 PolarHBondContact OG1-SD 2.63Å; Y674-M712 WeakPolarHBondContact CB-O 3.38Å; Y674-M712 HydrophobicContact CD1-SD 3.67Å; Y674-M712 HydrophobicContact CE1-SD 4.34Å; Y674-M712 WeakPolarHBondContact O-CB 3.16Å; A677-M712 HydrophobicContact CB-CG 3.97Å; A677-M712 HydrophobicContact CB-SD 4.19Å; F681-M712 HydrophobicContact CD2-CG 4.1Å; F681-M712 HydrophobicContact CE2-CG 3.89Å; N708-M712 WeakPolarHBondContact O-CB 2.92Å; N708-M712 WeakPolarHBondContact O-CG 3.34Å; N708-M712 PolarHBondContact O-N 3.28Å; V710-M712 VanDerWaalsContact C-N 3.33Å; V710-M712 PolarHBondContact O-N 2.95Å; M712-L715 HydrophobicContact CE-CD1 3.87Å; M712-L715 PolarHBondContact O-N 3.01Å; M712-L715 HydrophobicContact SD-CD1 4.41Å; M712-A716 WeakPolarHBondContact O-CB 3.44Å; M712-A716 PolarHBondContact O-N 3.41Å; M712-V740 HydrophobicContact CE-CB 4.2Å; M712-V740 HydrophobicContact CE-CG1 4.11Å; M712-V740 HydrophobicContact CE-CG2 4.32Å
713	K	97.1	Very high	93.4	Very high	117 Å²	117	59.4 Å²	59.4	51%	0.509	32%	0.318	S	S	.	.	H	α-helix	trans	-66	-38.6	174.7	-74.7	177.3	-179	-178.4	0	112.4	S678 I709 V710 V711 A716 G717	S678-K713 WeakPolarHBondContact OG-CE 3.38Å; S678-K713 WeakPolarHBondContact OG-CG 3.26Å; I709-K713 HydrophobicContact CG2-CD 4.47Å; I709-K713 WeakPolarHBondContact O-CG 3.4Å; I709-K713 PolarHBondContact O-N 3.17Å; V710-K713 PolarHBondContact O-N 3.29Å; V710-K713 VanDerWaalsContact O-N 3.13Å; V711-K713 PolarHBondContact O-N 3.47Å; K713-A716 PolarHBondContact O-N 3.48Å; K713-G717 PolarHBondContact O-N 3.48Å
714	L	95.4	Very high	92.7	Very high	81 Å²	81	62.6 Å²	62.6	42%	0.424	33%	0.332	S	S	.	.	H	α-helix	trans	-64	-45.7	176.3	-70.3	173.1	0	0	0	111.2	V710 V711 G717 G718 H719	V710-L714 HydrophobicContact CG1-CD1 4.16Å; V710-L714 HydrophobicContact CG1-CG 4.5Å; V710-L714 WeakPolarHBondContact O-CG 3.41Å; V710-L714 PolarHBondContact O-N 3.3Å; V711-L714 PolarHBondContact O-N 3.48Å; L714-G717 CarbonylContact O-C 3.53Å; L714-G717 PolarHBondContact O-N 2.96Å; L714-G717 VanDerWaalsContact O-N 3.16Å; L714-G718 PolarHBondContact O-N 3.37Å; L714-H719 HydrophobicContact CB-CB 3.94Å; L714-H719 WeakPolarHBondContact O-CB 3.41Å; L714-H719 PolarHBondContact O-N 3.39Å
715	L	94.6	Very high	92.1	Very high	10 Å²	10	65.7 Å²	65.7	5%	0.052	35%	0.351	C	S	.	.	H	α-helix	trans	-63.1	-41.9	176.3	-72.1	169.3	0	0	0	112.1	Y674 V711 M712 G717 G718 I742	Y674-L715 HydrophobicContact CD1-CB 3.9Å; Y674-L715 HydrophobicContact CD1-CD1 4Å; Y674-L715 HydrophobicContact CD2-CB 3.69Å; Y674-L715 HydrophobicContact CE1-CB 3.97Å; Y674-L715 HydrophobicContact CE1-CD1 3.6Å; Y674-L715 HydrophobicContact CE1-CG 4.34Å; Y674-L715 HydrophobicContact CE2-CB 3.79Å; Y674-L715 HydrophobicContact CG-CB 3.76Å; V711-L715 HydrophobicContact CG1-CD1 4.24Å; V711-L715 PolarHBondContact O-N 3.18Å; M712-L715 HydrophobicContact CE-CD1 3.87Å; M712-L715 PolarHBondContact O-N 3.01Å; M712-L715 HydrophobicContact SD-CD1 4.41Å; L715-G717 PolarHBondContact O-N 3.46Å; L715-G718 PolarHBondContact O-N 3.06Å; L715-I742 HydrophobicContact CD1-CD1 3.8Å; L715-I742 HydrophobicContact CD1-CG1 4.37Å; L715-I742 HydrophobicContact CD2-CD1 3.53Å; L715-I742 HydrophobicContact CD2-CG1 4.34Å; L715-I742 HydrophobicContact CG-CD1 3.48Å; L715-I742 VanDerWaalsContact CG-CD1 3.48Å; L715-I742 HydrophobicContact CG-CG1 4.47Å
716	A	94.9	Very high	91.6	Very high	28 Å²	28	69.1 Å²	69.1	23%	0.231	37%	0.369	C	S	.	.	H	α-helix	trans	-59.3	-36.4	173.7	0	0	0	0	0	112.3	L675 M712 K713 G718	L675-A716 HydrophobicContact CB-CB 4.43Å; M712-A716 WeakPolarHBondContact O-CB 3.44Å; M712-A716 PolarHBondContact O-N 3.41Å; K713-A716 PolarHBondContact O-N 3.48Å; A716-G718 PolarHBondContact O-N 2.95Å
717	G	92.2	Very high	91.3	Very high	72 Å²	72	65.2 Å²	65.2	74%	0.742	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	3.1	174.5	0	0	0	0	0	115.1	K713 L714 L715	K713-G717 PolarHBondContact O-N 3.48Å; L714-G717 CarbonylContact O-C 3.53Å; L714-G717 PolarHBondContact O-N 2.96Å; L714-G717 VanDerWaalsContact O-N 3.16Å; L715-G717 PolarHBondContact O-N 3.46Å
718	G	88.4	Confident	91.1	Very high	33 Å²	33	67 Å²	67	34%	0.34	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	9.5	179.1	0	0	0	0	0	115	L714 L715 A716 K720 K721	L714-G718 PolarHBondContact O-N 3.37Å; L715-G718 PolarHBondContact O-N 3.06Å; A716-G718 PolarHBondContact O-N 2.95Å; G718-K720 PolarHBondContact O-N 3.11Å; G718-K721 WeakPolarHBondContact O-CB 3.47Å; G718-K721 PolarHBondContact O-N 3.48Å; G718-K721 VanDerWaalsContact O-N 3.12Å
719	H	87.8	Confident	91	Very high	88 Å²	88	68.4 Å²	68.4	41%	0.407	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	127	177	-173.8	72.3	0	0	0	110.6	L714 K721	L714-H719 HydrophobicContact CB-CB 3.94Å; L714-H719 WeakPolarHBondContact O-CB 3.41Å; L714-H719 PolarHBondContact O-N 3.39Å; H719-K721 PolarHBondContact O-N 3.35Å; H719-K721 VanDerWaalsContact O-N 3.15Å
720	K	82.6	Confident	90.9	Very high	68 Å²	68	69.5 Å²	69.5	30%	0.296	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	32.9	-177.5	-67.6	178.7	178	-170.3	0	112.9	K619 G718 E722 T723 I742 I743	K619-K720 PolarHBondContact NZ-O 2.91Å; G718-K720 PolarHBondContact O-N 3.11Å; K720-E722 VanDerWaalsContact C-N 3.3Å; K720-E722 PolarHBondContact O-N 3.45Å; K720-T723 HydrophobicContact CB-CG2 3.77Å; K720-T723 VanDerWaalsContact O-CG2 3.31Å; K720-T723 WeakPolarHBondContact O-CG2 3.34Å; K720-T723 PolarHBondContact O-N 2.9Å; K720-I742 HydrophobicContact CB-CG2 4.11Å; K720-I742 HydrophobicContact CD-CB 4.3Å; K720-I742 HydrophobicContact CD-CG2 3.42Å; K720-I742 VanDerWaalsContact CD-CG2 3.42Å; K720-I742 HydrophobicContact CG-CG2 4.4Å; K720-I742 PolarHBondContact NZ-O 3.26Å; K720-I743 PolarHBondContact NZ-O 3.3Å; K720-I743 PolarHBondContact NZ-OXT 3.42Å
721	K	82.1	Confident	90.8	Very high	130 Å²	130	68.1 Å²	68.1	57%	0.565	36%	0.357	S	S	*	.	S	Bend	trans	-62.2	-39.8	176.9	-170.8	174.2	-177.3	179.3	0	112.1	G718 H719	G718-K721 WeakPolarHBondContact O-CB 3.47Å; G718-K721 PolarHBondContact O-N 3.48Å; G718-K721 VanDerWaalsContact O-N 3.12Å; H719-K721 PolarHBondContact O-N 3.35Å; H719-K721 VanDerWaalsContact O-N 3.15Å
722	E	83.3	Confident	90.7	Very high	190 Å²	190	72 Å²	72	89%	0.888	39%	0.385	S	S	*	.	S	Bend	trans	-83.5	-8.4	-177.7	-59.2	-176.1	174.6	0	0	114	K720	K720-E722 VanDerWaalsContact C-N 3.3Å; K720-E722 PolarHBondContact O-N 3.45Å
723	T	85.3	Confident	90.6	Very high	42 Å²	42	72.4 Å²	72.4	26%	0.258	39%	0.389	S	S	.	.			trans	-70.9	138	178.9	-160.3	0	0	0	0	110.8	K720 V725	K720-T723 HydrophobicContact CB-CG2 3.77Å; K720-T723 VanDerWaalsContact O-CG2 3.31Å; K720-T723 WeakPolarHBondContact O-CG2 3.34Å; K720-T723 PolarHBondContact O-N 2.9Å; T723-V725 VanDerWaalsContact C-N 3.32Å; T723-V725 HydrophobicContact CG2-CB 4.23Å; T723-V725 WeakPolarHBondContact OG1-CG2 3.46Å; T723-V725 PolarHBondContact OG1-N 3.25Å
724	K	80.9	Confident	90.5	Very high	200 Å²	200	67.1 Å²	67.1	87%	0.87	37%	0.366	S	S	*	.			trans	-88.6	-2.6	170.6	-64.4	-173.7	178.5	-178.4	0	112.9	L726	K724-L726 PolarHBondContact O-N 2.95Å
725	V	85.8	Confident	90.4	Very high	65 Å²	65	66.6 Å²	66.6	39%	0.394	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-68	127.3	177.5	-176.9	0	0	0	0	109.2	T723 I743	T723-V725 VanDerWaalsContact C-N 3.32Å; T723-V725 HydrophobicContact CG2-CB 4.23Å; T723-V725 WeakPolarHBondContact OG1-CG2 3.46Å; T723-V725 PolarHBondContact OG1-N 3.25Å; V725-I743 HydrophobicContact CG1-CB 3.7Å; V725-I743 HydrophobicContact CG1-CG2 3.98Å
726	L	88.6	Confident	90.5	Very high	71 Å²	71	66.9 Å²	66.9	37%	0.372	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-74.6	146.9	-179.9	-60.4	177.2	0	0	0	110.6	R621 K724	R621-L726 HydrophobicContact CB-CD1 4.03Å; K724-L726 PolarHBondContact O-N 2.95Å
727	P	91.9	Very high	90.6	Very high	13 Å²	13	65.5 Å²	65.5	8%	0.084	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-68.4	147.7	172.9	30.4	-35.5	0	0	0	111.2	M533 L614 K619 F729 V740 K741	M533-P727 HydrophobicContact CE-CG 3.88Å; L614-P727 HydrophobicContact CD1-CG 3.91Å; L614-P727 HydrophobicContact CD2-CG 3.99Å; K619-P727 WeakPolarHBondContact O-CD 3.49Å; P727-F729 HydrophobicContact CB-CE2 4.34Å; P727-F729 HydrophobicContact CG-CE2 3.94Å; P727-F729 HydrophobicContact CG-CZ 4.19Å; P727-V740 HydrophobicContact CB-CG1 4.26Å; P727-K741 WeakPolarHBondContact CA-O 3.28Å
728	E	94	Very high	90.9	Very high	82 Å²	82	62.1 Å²	62.1	38%	0.383	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	138.8	170.9	-178.8	-161.9	136.2	0	0	109.3	K741 I743	E728-K741 HydrophobicContact CB-CB 4.24Å; E728-K741 PolarHBondContact N-O 2.66Å; E728-K741 PolarHBondContact O-N 3.2Å; E728-K741 IonicContact OE1-NZ 3Å; E728-K741 PolarHBondContact OE1-NZ 3.07Å; E728-I743 HydrophobicContact CB-CD1 4.17Å
729	F	95.4	Very high	91.3	Very high	30 Å²	30	61.8 Å²	61.8	13%	0.132	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	106.6	177.3	-66.3	-88.7	0	0	0	109.3	M533 Y536 M607 M611 L614 P727 F731 P738 V740	M533-F729 HydrophobicContact CE-CE2 3.4Å; M533-F729 VanDerWaalsContact CE-CE2 3.4Å; M533-F729 HydrophobicContact CE-CZ 3.88Å; M533-F729 HydrophobicContact CG-CD2 4.44Å; M533-F729 HydrophobicContact CG-CE2 3.95Å; M533-F729 HydrophobicContact SD-CD2 4.41Å; M533-F729 HydrophobicContact SD-CE2 3.79Å; Y536-F729 HydrophobicContact CE2-CG 4.29Å; M607-F729 HydrophobicContact CE-CD1 4.19Å; M607-F729 HydrophobicContact CE-CE1 3.97Å; M611-F729 HydrophobicContact CE-CZ 4.06Å; M611-F729 HydrophobicContact SD-CE1 3.66Å; M611-F729 HydrophobicContact SD-CE2 4.49Å; M611-F729 HydrophobicContact SD-CZ 3.47Å; M611-F729 WeakPolarHBondContact SD-CZ 3.49Å; L614-F729 HydrophobicContact CD1-CZ 3.82Å; P727-F729 HydrophobicContact CB-CE2 4.34Å; P727-F729 HydrophobicContact CG-CE2 3.94Å; P727-F729 HydrophobicContact CG-CZ 4.19Å; F729-F731 HydrophobicContact CB-CE2 3.94Å; F729-P738 HydrophobicContact CB-CB 3.61Å; F729-P738 HydrophobicContact CB-CG 3.97Å; F729-P738 HydrophobicContact CD1-CB 3.98Å; F729-P738 HydrophobicContact CD1-CG 3.49Å; F729-P738 VanDerWaalsContact CD1-CG 3.49Å; F729-P738 HydrophobicContact CE1-CG 4.47Å; F729-P738 HydrophobicContact CG-CB 4.29Å; F729-P738 HydrophobicContact CG-CG 4.17Å; F729-V740 HydrophobicContact CD1-CG2 4.08Å; F729-V740 HydrophobicContact CE1-CG1 4.48Å; F729-V740 HydrophobicContact CE1-CG2 3.89Å
730	D	96.3	Very high	91.7	Very high	34 Å²	34	57.7 Å²	57.7	18%	0.182	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	106.2	-176.5	-179.1	-1.5	0	0	0	111.4	S732 P738 I739 K741	D730-S732 VanDerWaalsContact CG-OG 3.31Å; D730-S732 WeakPolarHBondContact OD1-CB 3.5Å; D730-S732 PolarHBondContact OD1-N 3.48Å; D730-S732 PolarHBondContact OD1-OG 3.16Å; D730-S732 PolarHBondContact OD2-OG 3.46Å; D730-P738 CarbonylContact O-C 3.3Å; D730-P738 VanDerWaalsContact O-CA 3.3Å; D730-P738 WeakPolarHBondContact O-CA 3.27Å; D730-I739 HydrophobicContact CB-CB 4.39Å; D730-I739 PolarHBondContact N-O 3.16Å; D730-I739 PolarHBondContact O-N 3.4Å; D730-K741 HydrophobicContact CB-CD 4.42Å; D730-K741 WeakPolarHBondContact OD2-CE 3.47Å; D730-K741 IonicContact OD2-NZ 3.4Å; D730-K741 PolarHBondContact OD2-NZ 3.03Å
731	F	96.1	Very high	92.3	Very high	54 Å²	54	58 Å²	58	24%	0.237	29%	0.287	C	S	.	.			trans	-87.7	3.4	178.2	-69.6	-90.5	0	0	0	113.9	F526 Y536 F729 A733 H734 P738	F526-F731 HydrophobicContact CD1-CE1 4.05Å; F526-F731 HydrophobicContact CD1-CZ 4.05Å; Y536-F731 HydrophobicContact CE2-CE2 4.31Å; Y536-F731 HydrophobicContact CE2-CZ 4.11Å; F729-F731 HydrophobicContact CB-CE2 3.94Å; F731-A733 PolarHBondContact O-N 2.93Å; F731-H734 CarbonylContact O-C 3.6Å; F731-H734 VanDerWaalsContact O-C 3.3Å; F731-H734 PolarHBondContact O-N 3.45Å; F731-H734 VanDerWaalsContact O-N 3.15Å; F731-P738 HydrophobicContact CD1-CB 4.09Å; F731-P738 HydrophobicContact CD2-CB 3.95Å; F731-P738 HydrophobicContact CE1-CB 3.92Å; F731-P738 VanDerWaalsContact CE1-CD 3.46Å; F731-P738 HydrophobicContact CE1-CG 3.91Å; F731-P738 HydrophobicContact CE2-CB 3.76Å; F731-P738 HydrophobicContact CE2-CG 4.1Å; F731-P738 HydrophobicContact CG-CB 4.11Å; F731-P738 HydrophobicContact CZ-CB 3.74Å; F731-P738 HydrophobicContact CZ-CG 3.65Å
732	S	94.6	Very high	92.5	Very high	103 Å²	103	53.6 Å²	53.6	72%	0.72	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-27.4	-177.4	65.5	0	0	0	0	113.8	D730	D730-S732 VanDerWaalsContact CG-OG 3.31Å; D730-S732 WeakPolarHBondContact OD1-CB 3.5Å; D730-S732 PolarHBondContact OD1-N 3.48Å; D730-S732 PolarHBondContact OD1-OG 3.16Å; D730-S732 PolarHBondContact OD2-OG 3.46Å
733	A	95.2	Very high	92	Very high	9 Å²	9	50.4 Å²	50.4	7%	0.074	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-28.7	177.7	0	0	0	0	0	113.3	K703 V704 F731 I739	K703-A733 HydrophobicContact CD-CB 4.11Å; K703-A733 HydrophobicContact CG-CB 4.37Å; V704-A733 HydrophobicContact CG2-CB 3.98Å; F731-A733 PolarHBondContact O-N 2.93Å; A733-I739 HydrophobicContact CB-CD1 3.93Å
734	H	96.1	Very high	92.3	Very high	7 Å²	7	50.8 Å²	50.8	3%	0.032	26%	0.257	C	S	.	.			trans	-159.4	132.8	-175.5	-172.4	-80.8	0	0	0	111.4	Y600 E697 V704 F731 Y736 F737	Y600-H734 PolarHBondContact OH-NE2 2.64Å; E697-H734 IonicContact OE1-CD2 3.38Å; E697-H734 IonicContact OE1-NE2 3.45Å; E697-H734 PolarHBondContact OE1-NE2 2.72Å; V704-H734 HydrophobicContact CG2-CB 3.65Å; F731-H734 CarbonylContact O-C 3.6Å; F731-H734 VanDerWaalsContact O-C 3.3Å; F731-H734 PolarHBondContact O-N 3.45Å; F731-H734 VanDerWaalsContact O-N 3.15Å; H734-Y736 VanDerWaalsContact C-N 3.3Å; H734-Y736 AromaticContact CE1-CD2 3.45Å; H734-Y736 VanDerWaalsContact CE1-CD2 3.45Å; H734-Y736 WeakPolarHBondContact CE1-CD2 3.43Å; H734-Y736 AromaticContact CE1-CG 3.82Å; H734-Y736 PolarHBondContact ND1-N 3.22Å; H734-Y736 PolarHBondContact O-N 3.05Å; H734-F737 AromaticContact CE1-CD2 3.27Å; H734-F737 WeakPolarHBondContact CE1-CD2 3.42Å; H734-F737 AromaticContact CE1-CE2 3.82Å; H734-F737 AromaticContact ND1-CD2 3.49Å; H734-F737 WeakPolarHBondContact ND1-CD2 3.39Å; H734-F737 AromaticContact ND1-CG 3.96Å; H734-F737 PolarHBondContact ND1-N 3.44Å; H734-F737 VanDerWaalsContact ND1-N 3.17Å; H734-F737 AromaticContact NE2-CD2 3.9Å
735	K	93.1	Very high	92.9	Very high	70 Å²	70	42.9 Å²	42.9	30%	0.304	22%	0.224	S	C	.	.	S	Bend	trans	-64.3	-29	-171.5	-60	179.7	175.3	-169.8	0	114.7	E378 E527	E378-K735 PolarHBondContact O-NZ 2.93Å; E527-K735 HydrophobicContact CB-CB 4.48Å; E527-K735 HydrophobicContact CG-CD 4.17Å; E527-K735 IonicContact OE1-NZ 2.75Å; E527-K735 PolarHBondContact OE1-NZ 3.02Å
736	Y	95.6	Very high	93.3	Very high	15 Å²	15	41.7 Å²	41.7	6%	0.059	22%	0.215	C	C	.	.	S	Bend	trans	-110	-13.1	-174.5	-38.8	-45.1	0	0	0	114.4	E378 L523 E527 Y540 Y600 H734	E378-Y736 PolarHBondContact OE1-OH 3.41Å; L523-Y736 HydrophobicContact CB-CD1 3.84Å; L523-Y736 HydrophobicContact CB-CD2 4.27Å; L523-Y736 HydrophobicContact CB-CE1 3.94Å; L523-Y736 HydrophobicContact CB-CE2 4.39Å; L523-Y736 HydrophobicContact CB-CG 4.03Å; L523-Y736 HydrophobicContact CD1-CD2 3.95Å; L523-Y736 HydrophobicContact CD1-CE2 4.08Å; L523-Y736 HydrophobicContact CD1-CG 4.43Å; L523-Y736 HydrophobicContact CD2-CD1 4.46Å; L523-Y736 HydrophobicContact CD2-CD2 4.1Å; L523-Y736 HydrophobicContact CD2-CG 3.87Å; L523-Y736 HydrophobicContact CG-CD2 4.34Å; L523-Y736 HydrophobicContact CG-CG 4.33Å; L523-Y736 WeakPolarHBondContact O-CD1 3.39Å; E527-Y736 HydrophobicContact CB-CE1 4.31Å; Y540-Y736 PolarHBondContact OH-O 3.22Å; Y600-Y736 HydrophobicContact CE1-CD2 4.01Å; Y600-Y736 HydrophobicContact CE1-CE2 4.46Å; H734-Y736 VanDerWaalsContact C-N 3.3Å; H734-Y736 AromaticContact CE1-CD2 3.45Å; H734-Y736 VanDerWaalsContact CE1-CD2 3.45Å; H734-Y736 WeakPolarHBondContact CE1-CD2 3.43Å; H734-Y736 AromaticContact CE1-CG 3.82Å; H734-Y736 PolarHBondContact ND1-N 3.22Å; H734-Y736 PolarHBondContact O-N 3.05Å
737	F	97.9	Very high	93.5	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.			trans	-135.1	116.8	-171.4	-62.9	-58.6	0	0	0	109.2	Y540 Y600 M603 M607 V704 H734	Y540-F737 HydrophobicContact CD1-CE1 4.33Å; Y540-F737 AromaticContact CE1-CD1 3.84Å; Y540-F737 HydrophobicContact CE1-CD1 3.84Å; Y540-F737 AromaticContact CE1-CE1 3.77Å; Y540-F737 HydrophobicContact CE1-CE1 3.77Å; Y600-F737 AromaticContact CD1-CE2 3.76Å; Y600-F737 HydrophobicContact CD1-CE2 3.76Å; Y600-F737 AromaticContact CD1-CZ 3.91Å; Y600-F737 HydrophobicContact CD1-CZ 3.91Å; Y600-F737 HydrophobicContact CD2-CE2 4.41Å; Y600-F737 AromaticContact CE1-CE2 3.8Å; Y600-F737 HydrophobicContact CE1-CE2 3.8Å; Y600-F737 HydrophobicContact CE1-CZ 4.33Å; Y600-F737 HydrophobicContact CE2-CE2 4.38Å; Y600-F737 HydrophobicContact CG-CE2 4.11Å; Y600-F737 HydrophobicContact CG-CZ 4.3Å; M603-F737 HydrophobicContact CB-CD1 4.01Å; M603-F737 HydrophobicContact CB-CD2 4.16Å; M603-F737 HydrophobicContact CB-CE1 3.62Å; M603-F737 HydrophobicContact CB-CE2 3.79Å; M603-F737 HydrophobicContact CB-CG 4.29Å; M603-F737 HydrophobicContact CB-CZ 3.51Å; M603-F737 HydrophobicContact CE-CB 4.04Å; M603-F737 HydrophobicContact CE-CD1 4.49Å; M603-F737 HydrophobicContact CE-CD2 4.16Å; M603-F737 HydrophobicContact CE-CG 3.99Å; M603-F737 HydrophobicContact CG-CD2 4.46Å; M603-F737 HydrophobicContact CG-CE2 4.28Å; M603-F737 HydrophobicContact CG-CZ 4.46Å; M607-F737 HydrophobicContact CG-CD1 4.25Å; V704-F737 HydrophobicContact CG1-CB 4Å; H734-F737 AromaticContact CE1-CD2 3.27Å; H734-F737 WeakPolarHBondContact CE1-CD2 3.42Å; H734-F737 AromaticContact CE1-CE2 3.82Å; H734-F737 AromaticContact ND1-CD2 3.49Å; H734-F737 WeakPolarHBondContact ND1-CD2 3.39Å; H734-F737 AromaticContact ND1-CG 3.96Å; H734-F737 PolarHBondContact ND1-N 3.44Å; H734-F737 VanDerWaalsContact ND1-N 3.17Å; H734-F737 AromaticContact NE2-CD2 3.9Å
738	P	97.4	Very high	93.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-85.7	151	-178.3	31.9	-33	0	0	0	112.2	Y540 M607 V704 N708 F729 D730 F731	Y540-P738 WeakPolarHBondContact OH-CD 3.34Å; M607-P738 HydrophobicContact CE-CG 3.61Å; M607-P738 HydrophobicContact SD-CG 4.3Å; V704-P738 VanDerWaalsContact CG1-O 3.29Å; V704-P738 WeakPolarHBondContact CG1-O 3.48Å; N708-P738 PolarHBondContact ND2-O 3.47Å; F729-P738 HydrophobicContact CB-CB 3.61Å; F729-P738 HydrophobicContact CB-CG 3.97Å; F729-P738 HydrophobicContact CD1-CB 3.98Å; F729-P738 HydrophobicContact CD1-CG 3.49Å; F729-P738 VanDerWaalsContact CD1-CG 3.49Å; F729-P738 HydrophobicContact CE1-CG 4.47Å; F729-P738 HydrophobicContact CG-CB 4.29Å; F729-P738 HydrophobicContact CG-CG 4.17Å; D730-P738 CarbonylContact O-C 3.3Å; D730-P738 VanDerWaalsContact O-CA 3.3Å; D730-P738 WeakPolarHBondContact O-CA 3.27Å; F731-P738 HydrophobicContact CD1-CB 4.09Å; F731-P738 HydrophobicContact CD2-CB 3.95Å; F731-P738 HydrophobicContact CE1-CB 3.92Å; F731-P738 VanDerWaalsContact CE1-CD 3.46Å; F731-P738 HydrophobicContact CE1-CG 3.91Å; F731-P738 HydrophobicContact CE2-CB 3.76Å; F731-P738 HydrophobicContact CE2-CG 4.1Å; F731-P738 HydrophobicContact CG-CB 4.11Å; F731-P738 HydrophobicContact CZ-CB 3.74Å; F731-P738 HydrophobicContact CZ-CG 3.65Å
739	I	98.1	Very high	93.6	Very high	27 Å²	27	39 Å²	39	14%	0.138	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	122	158.2	-63.9	172.3	0	0	0	107.4	V704 P707 D730 A733 K741	V704-I739 HydrophobicContact CB-CG1 4.37Å; V704-I739 HydrophobicContact CG1-CG1 4.26Å; V704-I739 HydrophobicContact CG2-CG1 4.14Å; P707-I739 HydrophobicContact CB-CG2 3.98Å; P707-I739 HydrophobicContact CG-CD1 4.45Å; P707-I739 HydrophobicContact CG-CG2 4.49Å; D730-I739 HydrophobicContact CB-CB 4.39Å; D730-I739 PolarHBondContact N-O 3.16Å; D730-I739 PolarHBondContact O-N 3.4Å; A733-I739 HydrophobicContact CB-CD1 3.93Å; I739-K741 HydrophobicContact CG2-CG 4.4Å; I739-K741 PolarHBondContact O-N 3.17Å
740	V	96.6	Very high	93.5	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.006	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	116	177.6	-175.8	0	0	0	0	108.7	M607 T610 N708 V711 M712 P727 F729	M607-V740 HydrophobicContact CE-CG2 4.34Å; M607-V740 HydrophobicContact SD-CG2 4.43Å; T610-V740 HydrophobicContact CG2-CG2 4.28Å; N708-V740 PolarHBondContact OD1-N 3.07Å; V711-V740 HydrophobicContact CG1-CB 4.28Å; V711-V740 HydrophobicContact CG1-CG1 4.19Å; V711-V740 WeakPolarHBondContact CG2-O 3.4Å; M712-V740 HydrophobicContact CE-CB 4.2Å; M712-V740 HydrophobicContact CE-CG1 4.11Å; M712-V740 HydrophobicContact CE-CG2 4.32Å; P727-V740 HydrophobicContact CB-CG1 4.26Å; F729-V740 HydrophobicContact CD1-CG2 4.08Å; F729-V740 HydrophobicContact CE1-CG1 4.48Å; F729-V740 HydrophobicContact CE1-CG2 3.89Å
741	K	93.7	Very high	93.3	Very high	75 Å²	75	40.1 Å²	40.1	33%	0.326	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	133	176.2	-59.9	176.8	-170.3	158.6	0	110.1	P727 E728 D730 I739	P727-K741 WeakPolarHBondContact CA-O 3.28Å; E728-K741 HydrophobicContact CB-CB 4.24Å; E728-K741 PolarHBondContact N-O 2.66Å; E728-K741 PolarHBondContact O-N 3.2Å; E728-K741 IonicContact OE1-NZ 3Å; E728-K741 PolarHBondContact OE1-NZ 3.07Å; D730-K741 HydrophobicContact CB-CD 4.42Å; D730-K741 WeakPolarHBondContact OD2-CE 3.47Å; D730-K741 IonicContact OD2-NZ 3.4Å; D730-K741 PolarHBondContact OD2-NZ 3.03Å; I739-K741 HydrophobicContact CG2-CG 4.4Å; I739-K741 PolarHBondContact O-N 3.17Å
742	I	85.8	Confident	93.1	Very high	37 Å²	37	38.9 Å²	38.9	19%	0.19	21%	0.207	C	C	.	.			trans	-106	105.2	175	-45.9	163.5	0	0	0	108.1	V711 L715 K720	V711-I742 HydrophobicContact CG1-CD1 3.51Å; V711-I742 HydrophobicContact CG1-CG1 3.73Å; L715-I742 HydrophobicContact CD1-CD1 3.8Å; L715-I742 HydrophobicContact CD1-CG1 4.37Å; L715-I742 HydrophobicContact CD2-CD1 3.53Å; L715-I742 HydrophobicContact CD2-CG1 4.34Å; L715-I742 HydrophobicContact CG-CD1 3.48Å; L715-I742 VanDerWaalsContact CG-CD1 3.48Å; L715-I742 HydrophobicContact CG-CG1 4.47Å; K720-I742 HydrophobicContact CB-CG2 4.11Å; K720-I742 HydrophobicContact CD-CB 4.3Å; K720-I742 HydrophobicContact CD-CG2 3.42Å; K720-I742 VanDerWaalsContact CD-CG2 3.42Å; K720-I742 HydrophobicContact CG-CG2 4.4Å; K720-I742 PolarHBondContact NZ-O 3.26Å
743	I	72.8	Confident	92.9	Very high	123 Å²	123	33.1 Å²	33.1	63%	0.631	16%	0.16	S	C	*	.			trans	-73.6	0	-177.6	-61.1	170	0	0	0	111.7	K720 V725 E728	K720-I743 PolarHBondContact NZ-O 3.3Å; K720-I743 PolarHBondContact NZ-OXT 3.42Å; V725-I743 HydrophobicContact CG1-CB 3.7Å; V725-I743 HydrophobicContact CG1-CG2 3.98Å; E728-I743 HydrophobicContact CB-CD1 4.17Å

Retrieved 743 of 743 residues in 1230.1 ms (Link to these results)

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