A0A087YP17_POEFO Loading...

Plakophilin 3

AlphaFold DB , UniProt , Accession A0A087YP17, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 824 aa.

						>A0A087YP17_POEFO|A0A087YP17
MPHTLSTTYALPSDNQLGNGSAMSDDAVRARRVQEQIKMKMAEKSTLPRQNGKASQYAMSDYGGSSTMKYSTYSPSYSSKSSYMYSGSKTLGPRVSTRTDFSSRSAAPDITQFQRMSVGLGRGGGGGGGFYREEMHSGGFQGTIRQNQMDRDDMSVHSLQSPAWVIDNSDAGSMISERDAAYDQQYSQSGMNGFGTQLRQGGSTMTYQTYQTPEPALGTGRRSLSSTLSRGSGLGGGGTEIIQQQSFKGPAHRTINRIANRNRMSMTSMTGSRMTSSSGNIGAGGDRTDGGFLMSVKSGSHGNLLQQRQGGLSRSTSMRSVQSVGGGMDIFGQADLEDNPLFERLHSVDVPTAVSYLRMEDTGMQVLGSAYIQHICFNEERAKDEVRELHGTELLVTLFKSPDAEVRRFSTGAMRNMIYKNVENKQELIKQGGIGALNDALEQEDDELRKNITGILWNLSAKDGFKEQLKTILPRLTEKVVIPLTTKEAEKAEMIKQDKGIAPDCPSEAEILHNTLGYLRNLSSGSEKVRREVREAKGLVESLVGYLRSTLEVGKIEEKGAESVMCTLRNLSFKLFDELPPSIKTNLFEDGTTSSSTVGCFSPNSSKIKQHKACDQKGFSPNEVSKSPKGLEWLWHPKIVHLYNSVIKSCEINALTREAAIGALQNITGGQDPWAEKLSRYMVNDYKMLPNLLDHLRSERNNELRSLTGLLRNLSSHTDTSQALDAVVRRLPENNKDVPSPEALVNLCGVLNNMVARSFDIAKKLTEGSGLSRLMDMKSLVNDNLVYADASRSARVVLRNMYNYRKLHRIFRRKGYERRDFCDV
					

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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	33.2	Very low	33.4	Very low	230 Å²	230	154.8 Å²	154.8	100%	1.133	86%	0.859	S	S	*	*				0	114.6	0	-63.5	-51.7	-167.1	0	0	108.8
2	P	38.2	Very low	33.5	Very low	123 Å²	123	152 Å²	152	80%	0.799	85%	0.853	S	S	*	*			trans	-97	142.7	172.7	35.3	-29	0	0	0	111.4
3	H	32.5	Very low	34	Very low	190 Å²	190	148.4 Å²	148.4	88%	0.88	84%	0.843	S	S	*	*			trans	-117.7	146.8	160.5	-85.3	-77.1	0	0	0	110.5
4	T	34.2	Very low	34.7	Very low	133 Å²	133	147.9 Å²	147.9	82%	0.816	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-74.1	144.4	-160.5	44.3	0	0	0	0	114.6
5	L	30.7	Very low	35.3	Very low	170 Å²	170	147.7 Å²	147.7	89%	0.89	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-62.7	141.1	157	-71.2	165.8	0	0	0	109.9
6	S	27.9	Very low	36	Very low	119 Å²	119	150.4 Å²	150.4	83%	0.832	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-88.9	135	177.8	-170.1	0	0	0	0	111.1
7	T	33.3	Very low	36.3	Very low	125 Å²	125	150.4 Å²	150.4	77%	0.767	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-98.3	128.6	178.4	46.1	0	0	0	0	111.7	Y9	T7-Y9 PolarHBondContact O-N 2.85Å
8	T	36.5	Very low	36.5	Very low	133 Å²	133	146.1 Å²	146.1	82%	0.816	83%	0.829	S	S	*	*			trans	-74.5	94.5	-175.5	-52.2	0	0	0	0	112.8
9	Y	29.8	Very low	37.2	Very low	224 Å²	224	147.8 Å²	147.8	88%	0.878	84%	0.836	S	S	*	*			trans	-137.5	85.5	155.8	-85.5	-74.1	0	0	0	109.9	T7	T7-Y9 PolarHBondContact O-N 2.85Å
10	A	35.7	Very low	37.4	Very low	97 Å²	97	144.2 Å²	144.2	80%	0.802	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-75.4	140.7	174.7	0	0	0	0	0	111.2
11	L	34.9	Very low	37.6	Very low	159 Å²	159	142 Å²	142	83%	0.832	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-83.1	134.8	175.7	-67.4	165.8	0	0	0	110.8
12	P	35	Very low	38.5	Very low	121 Å²	121	135.1 Å²	135.1	79%	0.786	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-67.2	139.9	153.6	-13.6	29.6	0	0	0	109.7
13	S	39.5	Very low	39.1	Very low	105 Å²	105	137.3 Å²	137.3	73%	0.734	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-73.7	151.2	179.1	-44.6	0	0	0	0	112.3	N15	S13-N15 PolarHBondContact O-N 3.08Å
14	D	44.9	Very low	40.1	Very low	142 Å²	142	132.2 Å²	132.2	76%	0.759	79%	0.793	S	S	*	*	S	Bend	trans	-67	6	-177.4	-67.5	-54	0	0	0	115.6	Q16	D14-Q16 VanDerWaalsContact C-N 3.3Å; D14-Q16 PolarHBondContact O-N 2.94Å
15	N	43.8	Very low	41.2	Very low	145 Å²	145	129.7 Å²	129.7	78%	0.775	78%	0.775	S	S	*	*			trans	-83.6	54.6	-174.5	-75	-2.3	0	0	0	113.9	S13	S13-N15 PolarHBondContact O-N 3.08Å
16	Q	45.2	Very low	42.3	Very low	190 Å²	190	126.9 Å²	126.9	89%	0.888	76%	0.761	S	S	*	*			trans	-156.5	43.9	166.1	-134.8	159.2	99.1	0	0	116.1	D14	D14-Q16 VanDerWaalsContact C-N 3.3Å; D14-Q16 PolarHBondContact O-N 2.94Å
17	L	41.2	Very low	43.7	Very low	151 Å²	151	124.1 Å²	124.1	79%	0.791	75%	0.745	S	S	*	*			trans	-122.8	119.4	164.4	-72	174.1	0	0	0	110.3
18	G	40.2	Very low	44.9	Very low	72 Å²	72	121.3 Å²	121.3	74%	0.742	73%	0.727	S	S	*	*			trans	-93.2	136.5	174.1	0	0	0	0	0	111.8	G20	G18-G20 PolarHBondContact O-N 3.33Å
19	N	50.7	Low	46	Very low	179 Å²	179	122.4 Å²	122.4	96%	0.957	72%	0.717	S	S	*	*	S	Bend	trans	25.8	76.2	164.7	-65.3	1.5	0	0	0	116.9
20	G	40.1	Very low	47.5	Very low	75 Å²	75	114.3 Å²	114.3	77%	0.773	70%	0.696	S	S	*	*			trans	-127	155.4	164.9	0	0	0	0	0	110.8	G18	G18-G20 PolarHBondContact O-N 3.33Å
21	S	42.4	Very low	49	Very low	98 Å²	98	118.3 Å²	118.3	69%	0.685	69%	0.69	S	S	*	*			trans	-77.4	143.2	-175.4	54.1	0	0	0	0	113.2	M23 S24	S21-M23 PolarHBondContact O-N 2.65Å; S21-S24 PolarHBondContact O-N 3.03Å
22	A	52.4	Low	50.1	Low	87 Å²	87	117.7 Å²	117.7	72%	0.719	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	15.1	-169.8	0	0	0	0	0	116.5
23	M	50.9	Low	51.6	Low	168 Å²	168	115.3 Å²	115.3	83%	0.828	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	-3.8	173	-66.3	-86	80.9	0	0	113.1	S21	S21-M23 PolarHBondContact O-N 2.65Å
24	S	53.3	Low	52.9	Low	84 Å²	84	116.8 Å²	116.8	59%	0.587	66%	0.655	S	S	*	*	S	Bend	trans	-89.5	-26.9	179.1	-162.7	0	0	0	0	114	S21	S21-S24 PolarHBondContact O-N 3.03Å
25	D	56.8	Low	53.7	Low	79 Å²	79	115.7 Å²	115.7	42%	0.422	65%	0.646	S	S	.	*	H	α-helix	trans	-76.2	-41.4	-167.4	-92.3	-39.6	0	0	0	115.1	A27 V28 R29	D25-A27 VanDerWaalsContact C-N 3.27Å; D25-A27 PolarHBondContact O-N 3.11Å; D25-V28 PolarHBondContact O-N 3.26Å; D25-R29 WeakPolarHBondContact O-CB 3.33Å; D25-R29 PolarHBondContact O-N 3.47Å
26	D	53.7	Low	54.3	Low	112 Å²	112	114.5 Å²	114.5	60%	0.599	64%	0.635	S	S	*	*	H	α-helix	trans	-64.7	-32.1	-174.7	-89	-21.4	0	0	0	112.8	V28 R29 A30	D26-V28 VanDerWaalsContact C-N 3.3Å; D26-V28 PolarHBondContact O-N 2.77Å; D26-R29 PolarHBondContact O-N 3.42Å; D26-R29 IonicContact OD1-NE 3.89Å; D26-A30 VanDerWaalsContact O-CB 3.24Å; D26-A30 WeakPolarHBondContact O-CB 3.48Å; D26-A30 PolarHBondContact O-N 3.45Å
27	A	58.2	Low	55	Low	60 Å²	60	109.9 Å²	109.9	50%	0.496	62%	0.616	S	S	.	*	H	α-helix	trans	-66.3	-31.9	174.2	0	0	0	0	0	112.7	D25 R31	D25-A27 VanDerWaalsContact C-N 3.27Å; D25-A27 PolarHBondContact O-N 3.11Å; A27-R31 WeakPolarHBondContact O-CG 3.41Å; A27-R31 PolarHBondContact O-N 3.31Å
28	V	58.3	Low	55.8	Low	66 Å²	66	110.2 Å²	110.2	40%	0.4	61%	0.611	S	S	.	*	H	α-helix	trans	-78.1	-43.1	175.2	179.3	0	0	0	0	110.3	D25 D26 A30 R31 R32	D25-V28 PolarHBondContact O-N 3.26Å; D26-V28 VanDerWaalsContact C-N 3.3Å; D26-V28 PolarHBondContact O-N 2.77Å; V28-A30 PolarHBondContact O-N 3.19Å; V28-R31 PolarHBondContact O-N 3.27Å; V28-R32 PolarHBondContact O-N 3.39Å; V28-R32 VanDerWaalsContact O-N 3.12Å
29	R	58.3	Low	56.5	Low	157 Å²	157	112.8 Å²	112.8	59%	0.592	61%	0.605	S	S	*	*	H	α-helix	trans	-57.7	-47.5	175.9	-165.8	178.6	-65.6	-119.9	-3.7	111.3	D25 D26 R32 V33	D25-R29 WeakPolarHBondContact O-CB 3.33Å; D25-R29 PolarHBondContact O-N 3.47Å; D26-R29 PolarHBondContact O-N 3.42Å; D26-R29 IonicContact OD1-NE 3.89Å; R29-R32 PolarHBondContact O-N 2.77Å; R29-V33 WeakPolarHBondContact O-CG2 3.24Å; R29-V33 PolarHBondContact O-N 3.32Å; R29-V33 VanDerWaalsContact O-N 3.1Å
30	A	62.6	Low	56.5	Low	54 Å²	54	111.4 Å²	111.4	45%	0.446	59%	0.59	S	S	.	*	H	α-helix	trans	-62.6	-43	179	0	0	0	0	0	113.3	D26 V28 V33 Q34	D26-A30 VanDerWaalsContact O-CB 3.24Å; D26-A30 WeakPolarHBondContact O-CB 3.48Å; D26-A30 PolarHBondContact O-N 3.45Å; V28-A30 PolarHBondContact O-N 3.19Å; A30-V33 PolarHBondContact O-N 2.73Å; A30-Q34 PolarHBondContact O-N 3.42Å
31	R	66	Low	57	Low	181 Å²	181	114.3 Å²	114.3	68%	0.683	59%	0.586	S	S	*	*	H	α-helix	trans	-62.5	-44.6	176.2	-73	177.8	-173.1	-169.3	4.2	111.9	A27 V28 V33 Q34 E35	A27-R31 WeakPolarHBondContact O-CG 3.41Å; A27-R31 PolarHBondContact O-N 3.31Å; V28-R31 PolarHBondContact O-N 3.27Å; R31-V33 VanDerWaalsContact C-N 3.28Å; R31-V33 PolarHBondContact O-N 3.06Å; R31-Q34 WeakPolarHBondContact O-CB 3.44Å; R31-Q34 PolarHBondContact O-N 2.63Å; R31-Q34 VanDerWaalsContact O-N 3.1Å; R31-E35 PolarHBondContact O-N 2.81Å
32	R	57.7	Low	57.4	Low	146 Å²	146	112.8 Å²	112.8	55%	0.551	58%	0.579	S	S	*	*	H	α-helix	trans	-62.2	-35.4	179.3	-154.7	-178.9	-66.3	165.2	-0.5	111.8	V28 R29 Q36	V28-R32 PolarHBondContact O-N 3.39Å; V28-R32 VanDerWaalsContact O-N 3.12Å; R29-R32 PolarHBondContact O-N 2.77Å; R32-Q36 PolarHBondContact O-N 2.81Å
33	V	68.3	Low	57.2	Low	70 Å²	70	115.8 Å²	115.8	42%	0.424	58%	0.578	S	S	.	*	H	α-helix	trans	-70	-40.8	172.2	171.7	0	0	0	0	112.1	R29 A30 R31 E35 Q36 I37	R29-V33 WeakPolarHBondContact O-CG2 3.24Å; R29-V33 PolarHBondContact O-N 3.32Å; R29-V33 VanDerWaalsContact O-N 3.1Å; A30-V33 PolarHBondContact O-N 2.73Å; R31-V33 VanDerWaalsContact C-N 3.28Å; R31-V33 PolarHBondContact O-N 3.06Å; V33-E35 VanDerWaalsContact C-N 3.32Å; V33-E35 PolarHBondContact O-N 2.94Å; V33-Q36 PolarHBondContact O-N 3.1Å; V33-I37 HydrophobicContact CG1-CD1 3.91Å; V33-I37 HydrophobicContact CG1-CG1 4.47Å; V33-I37 WeakPolarHBondContact O-CG1 3.47Å; V33-I37 PolarHBondContact O-N 3.02Å
34	Q	64.9	Low	56.9	Low	136 Å²	136	116.7 Å²	116.7	64%	0.636	58%	0.577	S	S	*	*	H	α-helix	trans	-61.3	-38.3	175.4	-77	-176	-37.3	0	0	112.6	A30 R31 I37 K38	A30-Q34 PolarHBondContact O-N 3.42Å; R31-Q34 WeakPolarHBondContact O-CB 3.44Å; R31-Q34 PolarHBondContact O-N 2.63Å; R31-Q34 VanDerWaalsContact O-N 3.1Å; Q34-I37 PolarHBondContact O-N 2.66Å; Q34-K38 WeakPolarHBondContact O-CB 3.38Å; Q34-K38 PolarHBondContact O-N 2.87Å
35	E	63.7	Low	56.5	Low	120 Å²	120	117.3 Å²	117.3	56%	0.561	58%	0.581	S	S	*	*	H	α-helix	trans	-66.2	-40.7	175.1	-69.6	-177.2	131.4	0	0	112.3	R31 V33 I37 K38 M39	R31-E35 PolarHBondContact O-N 2.81Å; V33-E35 VanDerWaalsContact C-N 3.32Å; V33-E35 PolarHBondContact O-N 2.94Å; E35-I37 PolarHBondContact O-N 2.7Å; E35-K38 WeakPolarHBondContact O-CB 3.5Å; E35-K38 PolarHBondContact O-N 3.15Å; E35-M39 WeakPolarHBondContact O-CG 3.05Å; E35-M39 PolarHBondContact O-N 3.06Å
36	Q	55.9	Low	55.9	Low	119 Å²	119	118.8 Å²	118.8	56%	0.556	59%	0.594	S	S	*	*	H	α-helix	trans	-63.5	-38.9	173.4	-73.3	-177.2	-13.8	0	0	112.9	R32 V33 K38 M39 K40	R32-Q36 PolarHBondContact O-N 2.81Å; V33-Q36 PolarHBondContact O-N 3.1Å; Q36-K38 VanDerWaalsContact C-N 3.34Å; Q36-M39 PolarHBondContact O-N 3.43Å; Q36-K40 PolarHBondContact O-N 3.36Å
37	I	59.8	Low	54.8	Low	93 Å²	93	121.3 Å²	121.3	48%	0.477	61%	0.606	S	S	.	*	H	α-helix	trans	-63.9	-42.3	173.6	-68.5	167	0	0	0	110.2	V33 Q34 E35 M39 K40 M41	V33-I37 HydrophobicContact CG1-CD1 3.91Å; V33-I37 HydrophobicContact CG1-CG1 4.47Å; V33-I37 WeakPolarHBondContact O-CG1 3.47Å; V33-I37 PolarHBondContact O-N 3.02Å; Q34-I37 PolarHBondContact O-N 2.66Å; E35-I37 PolarHBondContact O-N 2.7Å; I37-M39 PolarHBondContact O-N 2.87Å; I37-K40 PolarHBondContact O-N 2.86Å; I37-M41 WeakPolarHBondContact O-CG 3.48Å; I37-M41 PolarHBondContact O-N 3.2Å
38	K	57.5	Low	53.7	Low	159 Å²	159	124.4 Å²	124.4	69%	0.691	62%	0.621	S	S	*	*	H	α-helix	trans	-62.4	-41.4	178.2	-167.2	177.3	-179.2	-177.1	0	112.2	Q34 E35 Q36 M41 A42	Q34-K38 WeakPolarHBondContact O-CB 3.38Å; Q34-K38 PolarHBondContact O-N 2.87Å; E35-K38 WeakPolarHBondContact O-CB 3.5Å; E35-K38 PolarHBondContact O-N 3.15Å; Q36-K38 VanDerWaalsContact C-N 3.34Å; K38-M41 PolarHBondContact O-N 3.19Å; K38-A42 PolarHBondContact O-N 3.48Å
39	M	56	Low	52.4	Low	126 Å²	126	133.2 Å²	133.2	62%	0.621	65%	0.647	S	S	*	*	H	α-helix	trans	-64.2	-47.4	172.9	-65.6	-177.9	-157.3	0	0	111.8	E35 Q36 I37 M41 A42 E43	E35-M39 WeakPolarHBondContact O-CG 3.05Å; E35-M39 PolarHBondContact O-N 3.06Å; Q36-M39 PolarHBondContact O-N 3.43Å; I37-M39 PolarHBondContact O-N 2.87Å; M39-M41 PolarHBondContact O-N 3.22Å; M39-A42 WeakPolarHBondContact O-CB 3.35Å; M39-A42 PolarHBondContact O-N 3.08Å; M39-E43 PolarHBondContact O-N 3.38Å; M39-E43 VanDerWaalsContact O-N 3.16Å
40	K	49.6	Very low	51.1	Low	150 Å²	150	134.1 Å²	134.1	65%	0.652	66%	0.658	S	S	*	*	H	α-helix	trans	-64.6	-20.1	178.2	-81.5	-173.5	171.9	178.4	0	114.8	Q36 I37	Q36-K40 PolarHBondContact O-N 3.36Å; I37-K40 PolarHBondContact O-N 2.86Å
41	M	50.5	Low	49.5	Very low	136 Å²	136	139.3 Å²	139.3	67%	0.67	68%	0.678	S	S	*	*	H	α-helix	trans	-82.7	-31.1	169.6	-68.4	-150.2	-63.4	0	0	112.8	I37 K38 M39 K44	I37-M41 WeakPolarHBondContact O-CG 3.48Å; I37-M41 PolarHBondContact O-N 3.2Å; K38-M41 PolarHBondContact O-N 3.19Å; M39-M41 PolarHBondContact O-N 3.22Å; M41-K44 PolarHBondContact O-N 2.9Å
42	A	51.8	Low	47.6	Very low	65 Å²	65	133.9 Å²	133.9	54%	0.537	68%	0.679	S	S	.	*	H	α-helix	trans	-65.3	-45.6	175	0	0	0	0	0	112	K38 M39 K44 S45	K38-A42 PolarHBondContact O-N 3.48Å; M39-A42 WeakPolarHBondContact O-CB 3.35Å; M39-A42 PolarHBondContact O-N 3.08Å; A42-K44 PolarHBondContact O-N 3.3Å; A42-S45 PolarHBondContact O-N 2.89Å; A42-S45 PolarHBondContact O-OG 3.06Å
43	E	47.7	Very low	46.2	Very low	150 Å²	150	134.1 Å²	134.1	70%	0.701	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-65	-19.6	-179.9	-66.3	-178	134.4	0	0	114.1	M39 S45	M39-E43 PolarHBondContact O-N 3.38Å; M39-E43 VanDerWaalsContact O-N 3.16Å; E43-S45 VanDerWaalsContact C-N 3.33Å; E43-S45 PolarHBondContact O-N 3.14Å
44	K	44.9	Very low	44.2	Very low	187 Å²	187	135.4 Å²	135.4	81%	0.813	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-84.1	-0.4	-177.5	-92.6	-172.5	172.6	-175.1	0	115.1	M41 A42	M41-K44 PolarHBondContact O-N 2.9Å; A42-K44 PolarHBondContact O-N 3.3Å
45	S	44.8	Very low	42.7	Very low	97 Å²	97	134.2 Å²	134.2	68%	0.678	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-83.2	-12.7	-176.6	59.6	0	0	0	0	114.9	A42 E43	A42-S45 PolarHBondContact O-N 2.89Å; A42-S45 PolarHBondContact O-OG 3.06Å; E43-S45 VanDerWaalsContact C-N 3.33Å; E43-S45 PolarHBondContact O-N 3.14Å
46	T	43.1	Very low	41	Very low	111 Å²	111	138 Å²	138	68%	0.681	73%	0.727	S	S	*	*	S	Bend	trans	-130.9	78.5	-169.8	55.8	0	0	0	0	114
47	L	32.3	Very low	39.6	Very low	165 Å²	165	143.6 Å²	143.6	86%	0.864	74%	0.744	S	S	*	*			trans	-167.4	126.7	156.9	-106.2	174.3	0	0	0	110
48	P	33.6	Very low	38	Very low	124 Å²	124	143.7 Å²	143.7	81%	0.805	76%	0.759	S	S	*	*			trans	-77.7	149.5	176	32.3	-34.2	0	0	0	111.5
49	R	31.1	Very low	36.4	Very low	251 Å²	251	144.6 Å²	144.6	95%	0.947	77%	0.768	S	S	*	*			trans	-132.5	137.3	175.5	-128.4	177.1	-179.5	-171.7	-2	111.8
50	Q	30.9	Very low	34.9	Very low	177 Å²	177	143.5 Å²	143.5	83%	0.827	77%	0.773	S	S	*	*			trans	-90.9	177.4	-171.4	-63.4	172.1	-55.7	0	0	113.2
51	N	29	Very low	33.6	Very low	162 Å²	162	142.7 Å²	142.7	87%	0.866	78%	0.776	S	S	*	*			trans	91.9	131.9	168.1	-50.8	-19.2	0	0	0	115.6
52	G	27.4	Very low	32.5	Very low	68 Å²	68	147.2 Å²	147.2	70%	0.701	79%	0.787	S	S	*	*			cis	148	142.4	-14.8	0	0	0	0	0	115.1
53	K	27.8	Very low	31.3	Very low	150 Å²	150	147.8 Å²	147.8	65%	0.652	80%	0.798	S	S	*	*			trans	63.6	153.3	177.6	-64.3	-172.3	-179.7	-173.3	0	114.7	D286	K53-D286 IonicContact NZ-OD1 3.86Å; K53-D286 PolarHBondContact NZ-OD1 3.02Å
54	A	26.9	Very low	30.3	Very low	98 Å²	98	144.6 Å²	144.6	81%	0.81	81%	0.806	S	S	*	*			cis	-160	165	-23.5	0	0	0	0	0	108.8
55	S	32.9	Very low	29.5	Very low	111 Å²	111	141.4 Å²	141.4	78%	0.776	81%	0.807	S	S	*	*			trans	-101.5	148.5	175.7	50.9	0	0	0	0	112.2
56	Q	27.7	Very low	28.8	Very low	200 Å²	200	141.9 Å²	141.9	94%	0.935	81%	0.81	S	S	*	*			trans	-161.3	152.8	148.4	-118.3	164.8	3.7	0	0	113.7
57	Y	26.9	Very low	28	Very low	235 Å²	235	142.7 Å²	142.7	92%	0.922	82%	0.815	S	S	*	*			trans	-103.5	151.1	177.7	-95.2	-106.9	0	0	0	110.8
58	A	24.7	Very low	27.8	Very low	95 Å²	95	143.8 Å²	143.8	79%	0.785	82%	0.818	S	S	*	*			trans	-155.9	116	149.7	0	0	0	0	0	107.1
59	M	23.8	Very low	27.5	Very low	178 Å²	178	146.1 Å²	146.1	88%	0.877	82%	0.816	S	S	*	*				90.4	98	66	-94	-68.7	-171	0	0	113.6
60	S	25.8	Very low	27.3	Very low	104 Å²	104	144.5 Å²	144.5	73%	0.727	81%	0.811	S	S	*	*			trans	-173.7	156.2	144.7	57.6	0	0	0	0	108.6
61	D	22.9	Very low	27	Very low	133 Å²	133	140.5 Å²	140.5	71%	0.711	80%	0.803	S	S	*	*			cis	-158.7	161.4	-32.2	-103.2	-45.4	0	0	0	108.5
62	Y	27.4	Very low	26.9	Very low	231 Å²	231	138.6 Å²	138.6	91%	0.906	80%	0.798	S	S	*	*			trans	62.7	145.6	-178.3	-61.8	-92.2	0	0	0	116.3
63	G	25.8	Very low	26.8	Very low	76 Å²	76	146 Å²	146	78%	0.784	81%	0.806	S	S	*	*			cis	147	114.2	-6.9	0	0	0	0	0	112
64	G	27.5	Very low	27	Very low	83 Å²	83	143.5 Å²	143.5	86%	0.856	81%	0.808	S	S	*	*			trans	169.8	100	177.1	0	0	0	0	0	114.3
65	S	26.9	Very low	27.5	Very low	120 Å²	120	144.4 Å²	144.4	84%	0.839	81%	0.805	S	S	*	*			trans	-94.7	139.6	174	-65.7	0	0	0	0	112
66	S	29.8	Very low	27.2	Very low	107 Å²	107	144.4 Å²	144.4	75%	0.748	81%	0.805	S	S	*	*			trans	175.6	109.2	137.4	33.1	0	0	0	0	109.5
67	T	26.4	Very low	27.3	Very low	128 Å²	128	146 Å²	146	79%	0.785	80%	0.804	S	S	*	*				63.4	106.5	72.3	65.8	0	0	0	0	115.9
68	M	29.4	Very low	27.4	Very low	188 Å²	188	139.9 Å²	139.9	93%	0.926	80%	0.795	S	S	*	*				-155.1	165.1	122.8	-100.1	-80.2	173	0	0	109.2
69	K	26.6	Very low	27.8	Very low	174 Å²	174	140.2 Å²	140.2	76%	0.757	79%	0.792	S	S	*	*			trans	-137.8	177.5	-173.8	-83.5	-173.5	175.1	-178.6	0	110.4
70	Y	27.8	Very low	28.1	Very low	216 Å²	216	141 Å²	141	85%	0.847	79%	0.79	S	S	*	*			trans	80.9	150.6	169.7	-57.3	-72.2	0	0	0	116.3
71	S	24.8	Very low	28.6	Very low	93 Å²	93	141.6 Å²	141.6	65%	0.65	80%	0.795	S	S	*	*			cis	-167.6	150.2	-38.4	-126.6	0	0	0	0	111.2
72	T	26.7	Very low	28.9	Very low	123 Å²	123	141 Å²	141	76%	0.755	80%	0.801	S	S	*	*			trans	37.6	105.6	141.6	-39.9	0	0	0	0	119.2
73	Y	23.9	Very low	29.1	Very low	222 Å²	222	140.6 Å²	140.6	87%	0.871	80%	0.8	S	S	*	*				-154.7	149.4	129.8	-135.3	-92.8	0	0	0	112.2
74	S	32.9	Very low	29.4	Very low	99 Å²	99	144.9 Å²	144.9	69%	0.692	80%	0.801	S	S	*	*			trans	-145.8	146.8	170.8	57.7	0	0	0	0	109.8
75	P	36.3	Very low	29.5	Very low	117 Å²	117	151.3 Å²	151.3	76%	0.76	80%	0.801	S	S	*	*			trans	-135.2	149.5	147.9	35.5	-22.9	0	0	0	112.8
76	S	27.9	Very low	29.7	Very low	111 Å²	111	150.2 Å²	150.2	78%	0.776	79%	0.793	S	S	*	*			trans	-103.6	158.3	172.2	46.4	0	0	0	0	111
77	Y	30.3	Very low	29.5	Very low	234 Å²	234	148.5 Å²	148.5	92%	0.918	79%	0.793	S	S	*	*			trans	-145.2	163.5	169.9	-107.1	-79.3	0	0	0	112.7
78	S	28	Very low	29.9	Very low	105 Å²	105	147.6 Å²	147.6	73%	0.734	79%	0.792	S	S	*	*			trans	-158.9	170.9	-167.3	-173.5	0	0	0	0	112.6
79	S	33	Very low	30.1	Very low	102 Å²	102	148 Å²	148	71%	0.713	79%	0.789	S	S	*	*			trans	89.6	105.2	159.5	-59.8	0	0	0	0	122
80	K	31	Very low	30.4	Very low	194 Å²	194	145.2 Å²	145.2	84%	0.843	79%	0.786	S	S	*	*				47.1	126.4	120.5	-69.3	-174.8	174.5	-179.4	0	123.5
81	S	34.9	Very low	30.5	Very low	117 Å²	117	143.1 Å²	143.1	82%	0.818	79%	0.788	S	S	*	*				78.1	137.3	125.1	69.9	0	0	0	0	123.8
82	S	30.2	Very low	30.7	Very low	122 Å²	122	141.9 Å²	141.9	85%	0.853	79%	0.79	S	S	*	*			trans	-161.6	-177.1	150.1	59.6	0	0	0	0	110.6
83	Y	30.6	Very low	31.9	Very low	222 Å²	222	141.8 Å²	141.8	87%	0.871	79%	0.792	S	S	*	*			trans	-147.9	169.8	-159.5	-131	-94.3	0	0	0	113.9
84	M	32.3	Very low	32.2	Very low	165 Å²	165	142.2 Å²	142.2	81%	0.813	79%	0.792	S	S	*	*			trans	77	159.5	172.5	-49.5	-157.4	-170	0	0	116.7
85	Y	29	Very low	32	Very low	219 Å²	219	143.7 Å²	143.7	86%	0.859	80%	0.797	S	S	*	*			cis	-140.9	-171.5	12	-165.4	-104	0	0	0	112.9
86	S	31.3	Very low	31.9	Very low	96 Å²	96	143 Å²	143	67%	0.671	80%	0.795	S	S	*	*			trans	-116.3	165.8	-165.8	-173.2	0	0	0	0	116
87	G	26.2	Very low	32.1	Very low	71 Å²	71	144.8 Å²	144.8	73%	0.732	80%	0.801	S	S	*	*			trans	-164.8	151.9	171.9	0	0	0	0	0	113
88	S	34	Very low	32.2	Very low	110 Å²	110	144.4 Å²	144.4	77%	0.769	80%	0.798	S	S	*	*			trans	-149.5	177.1	-169.8	-52	0	0	0	0	114.2
89	K	34.7	Very low	32.3	Very low	197 Å²	197	146 Å²	146	86%	0.857	80%	0.804	S	S	*	*			trans	101.8	151.8	171.1	-59.6	174.8	-179.8	178	0	115.5
90	T	33.2	Very low	32	Very low	114 Å²	114	146.5 Å²	146.5	70%	0.699	80%	0.798	S	S	*	*			cis	-171.6	156.5	-25	34.7	0	0	0	0	111.2
91	L	29.8	Very low	31.9	Very low	172 Å²	172	146.5 Å²	146.5	90%	0.901	80%	0.799	S	S	*	*			trans	72	152.1	152.1	-72.2	156.6	0	0	0	121
92	G	28.3	Very low	31.5	Very low	67 Å²	67	145.9 Å²	145.9	69%	0.691	79%	0.794	S	S	*	*			trans	-109.7	-142.6	170.1	0	0	0	0	0	111.7
93	P	51.4	Low	31.6	Very low	121 Å²	121	145.5 Å²	145.5	79%	0.786	79%	0.792	S	S	*	*			cis	-140.5	-151	3.4	41.7	-19.6	0	0	0	114.2
94	R	30.2	Very low	31.8	Very low	231 Å²	231	146.3 Å²	146.3	87%	0.872	79%	0.793	S	S	*	*			trans	88	154.9	170.8	-59	-172.7	173.4	-179.3	-1.6	117
95	V	29.2	Very low	31.9	Very low	131 Å²	131	143.4 Å²	143.4	79%	0.794	79%	0.789	S	S	*	*			cis	-156.6	162.4	-19.7	131.7	0	0	0	0	108.8
96	S	34.4	Very low	31.9	Very low	103 Å²	103	138 Å²	138	72%	0.72	79%	0.79	S	S	*	*			trans	-82.4	155.3	-177.7	57.8	0	0	0	0	117
97	T	33.2	Very low	31.8	Very low	148 Å²	148	138 Å²	138	91%	0.908	80%	0.795	S	S	*	*			trans	-132.1	159.5	152.4	47	0	0	0	0	111.1
98	R	31.9	Very low	32.9	Very low	225 Å²	225	139.9 Å²	139.9	85%	0.849	80%	0.795	S	S	*	*			trans	-116.2	152.1	-179.4	-77.7	-178.7	169	-167.2	-0.8	111.4
99	T	30.6	Very low	32.8	Very low	140 Å²	140	141 Å²	141	86%	0.859	79%	0.792	S	S	*	*			trans	177.6	166.4	136.5	32.8	0	0	0	0	108.3
100	D	26.4	Very low	32.7	Very low	112 Å²	112	137.8 Å²	137.8	60%	0.599	78%	0.783	S	S	*	*				-166.7	147.9	-64	-109.6	-53.5	0	0	0	106.7
101	F	28.7	Very low	32.6	Very low	194 Å²	194	137.9 Å²	137.9	85%	0.851	78%	0.784	S	S	*	*			trans	28.2	139.6	165.1	-75.4	-95.3	0	0	0	121.5
102	S	26.1	Very low	32.9	Very low	103 Å²	103	136.8 Å²	136.8	72%	0.72	77%	0.774	S	S	*	*				-176.1	164.2	65	-169.5	0	0	0	0	113.5
103	S	32.8	Very low	33	Very low	115 Å²	115	141 Å²	141	80%	0.804	77%	0.773	S	S	*	*			trans	-150.9	126.2	170.5	-64.2	0	0	0	0	111.9
104	R	34	Very low	32.1	Very low	238 Å²	238	142.6 Å²	142.6	90%	0.898	77%	0.77	S	S	*	*			trans	-161.8	156.1	172.1	-81.6	-157.7	164.3	-161.6	-6	109.9
105	S	35.1	Very low	32.1	Very low	105 Å²	105	140.9 Å²	140.9	73%	0.734	76%	0.764	S	S	*	*			cis	-173	146.4	-21.4	-90.3	0	0	0	0	108.7
106	A	29.2	Very low	32.1	Very low	105 Å²	105	142 Å²	142	87%	0.868	76%	0.762	S	S	*	*			trans	-152.3	120.7	160.5	0	0	0	0	0	110.3
107	A	27.7	Very low	31.9	Very low	95 Å²	95	141.6 Å²	141.6	79%	0.785	76%	0.759	S	S	*	*			trans	-176.1	178.6	-170.6	0	0	0	0	0	107.8
108	P	50.8	Low	31.8	Very low	112 Å²	112	141.5 Å²	141.5	73%	0.727	76%	0.758	S	S	*	*			cis	-103.1	-142.8	-4.9	30.8	-9.6	0	0	0	109.4
109	D	31.1	Very low	31.7	Very low	134 Å²	134	134.2 Å²	134.2	72%	0.717	75%	0.754	S	S	*	*			cis	-161	-179.7	5.4	-140.9	-7.1	0	0	0	107
110	I	33.3	Very low	31.6	Very low	129 Å²	129	135.9 Å²	135.9	66%	0.662	76%	0.756	S	S	*	*			cis	-154.2	150.1	5.9	-168.5	154.1	0	0	0	106
111	T	31.4	Very low	31.6	Very low	116 Å²	116	133.9 Å²	133.9	71%	0.712	76%	0.762	S	S	*	*				-170.8	-158.4	69.4	-31.1	0	0	0	0	112.2
112	Q	35.8	Very low	31.7	Very low	148 Å²	148	136.6 Å²	136.6	69%	0.692	77%	0.767	S	S	*	*			trans	-97.1	169.9	-176.1	-63.1	156.4	-18.2	0	0	110.3
113	F	30.2	Very low	31.8	Very low	156 Å²	156	135.6 Å²	135.6	68%	0.684	77%	0.773	S	S	*	*			cis	-156.4	146.3	39.3	-95.6	-89.8	0	0	0	113.9
114	Q	31.4	Very low	31.6	Very low	155 Å²	155	134 Å²	134	72%	0.724	77%	0.774	S	S	*	*			trans	47.2	152.6	137.5	-75.7	-177.4	12.9	0	0	123
115	R	29.8	Very low	31.3	Very low	195 Å²	195	126.9 Å²	126.9	74%	0.736	78%	0.775	S	S	*	*			cis	-174.7	149.9	-22.9	-140.5	-172.1	178.6	170.5	-2.4	109.3
116	M	30.1	Very low	31	Very low	153 Å²	153	125.9 Å²	125.9	75%	0.754	78%	0.782	S	S	*	*			trans	66.6	156.5	158	-61.7	-166	-55.1	0	0	118.7
117	S	30.5	Very low	30.9	Very low	95 Å²	95	125 Å²	125	66%	0.664	78%	0.783	S	S	*	*			cis	-166.9	146.3	-20.8	-96.9	0	0	0	0	113.2
118	V	31.3	Very low	30.9	Very low	146 Å²	146	124.7 Å²	124.7	89%	0.885	79%	0.789	S	S	*	*			trans	57.8	122.7	146.7	-178	0	0	0	0	120.9
119	G	28.3	Very low	29.8	Very low	73 Å²	73	123 Å²	123	75%	0.753	79%	0.792	S	S	*	*			trans	-160.7	148.5	159.7	0	0	0	0	0	110.6
120	L	28.6	Very low	29.6	Very low	174 Å²	174	126.3 Å²	126.3	91%	0.911	80%	0.8	S	S	*	*			trans	-158.5	120.8	-166.3	-159.6	167.4	0	0	0	115.4
121	G	27.9	Very low	29.2	Very low	71 Å²	71	130.1 Å²	130.1	73%	0.732	81%	0.808	S	S	*	*			trans	114.1	171.1	150.9	0	0	0	0	0	117.8
122	R	30.6	Very low	29	Very low	250 Å²	250	133.2 Å²	133.2	94%	0.943	81%	0.806	S	S	*	*			cis	-173.3	122.5	-31.5	177.9	-178.6	-179	-140.3	0.9	109.4
123	G	27.8	Very low	28.6	Very low	83 Å²	83	132.4 Å²	132.4	86%	0.856	80%	0.803	S	S	*	*			trans	78	166.1	170.3	0	0	0	0	0	115.2
124	G	28.5	Very low	28.5	Very low	80 Å²	80	131.6 Å²	131.6	83%	0.825	80%	0.801	S	S	*	*			cis	161.9	162	-7	0	0	0	0	0	113.1
125	G	28	Very low	28.3	Very low	89 Å²	89	130.9 Å²	130.9	92%	0.918	80%	0.799	S	S	*	*			trans	93.1	152	173.4	0	0	0	0	0	115.2
126	G	27.7	Very low	28.1	Very low	85 Å²	85	129.5 Å²	129.5	88%	0.876	80%	0.801	S	S	*	*			trans	-147.2	174	172.4	0	0	0	0	0	109.9
127	G	27.3	Very low	28	Very low	87 Å²	87	127.7 Å²	127.7	90%	0.897	80%	0.803	S	S	*	*			trans	-171.7	144.6	178.3	0	0	0	0	0	111.1
128	G	28.2	Very low	27.8	Very low	88 Å²	88	127.3 Å²	127.3	91%	0.907	81%	0.814	S	S	*	*			trans	-125.3	161.8	174.8	0	0	0	0	0	111.1
129	G	27.3	Very low	27.6	Very low	76 Å²	76	123.6 Å²	123.6	78%	0.784	81%	0.806	S	S	*	*			trans	-164.4	141.3	178.2	0	0	0	0	0	110.6
130	F	27.6	Very low	27.6	Very low	203 Å²	203	130.7 Å²	130.7	89%	0.89	82%	0.816	S	S	*	*			trans	-112.9	-171	-176.1	-96.7	-92.1	0	0	0	111.1
131	Y	25.8	Very low	27.6	Very low	209 Å²	209	131 Å²	131	82%	0.82	81%	0.813	S	S	*	*			trans	96.6	145.1	168.9	-69.1	-101.5	0	0	0	117
132	R	26.1	Very low	27.6	Very low	181 Å²	181	131.1 Å²	131.1	68%	0.683	81%	0.814	S	S	*	*			cis	178.5	132	-24.1	164.6	165.9	-173.5	-164.5	-3.1	109.7
133	E	27.3	Very low	27.4	Very low	132 Å²	132	125 Å²	125	62%	0.617	80%	0.804	S	S	*	*			trans	47.1	166.9	152.2	-70.1	169.9	-177.7	0	0	120
134	E	28.1	Very low	27.4	Very low	139 Å²	139	127.8 Å²	127.8	65%	0.65	80%	0.798	S	S	*	*			cis	-155.4	154.4	-1.2	-134.9	-178.6	169.3	0	0	113.9
135	M	27	Very low	27.4	Very low	139 Å²	139	134 Å²	134	69%	0.685	80%	0.797	S	S	*	*			trans	55.1	162.6	140	-91.3	-166.4	-154.8	0	0	126.4
136	H	26	Very low	27.3	Very low	167 Å²	167	137.4 Å²	137.4	77%	0.773	79%	0.789	S	S	*	*			trans	85.3	141	169.5	-54.6	93.6	0	0	0	117.8
137	S	27.3	Very low	27.3	Very low	115 Å²	115	141.5 Å²	141.5	80%	0.804	79%	0.79	S	S	*	*			cis	154	124.9	-32.4	-89.9	0	0	0	0	107.6
138	G	27.5	Very low	27.3	Very low	87 Å²	87	145.4 Å²	145.4	90%	0.897	79%	0.785	S	S	*	*			trans	156.5	130.7	173.6	0	0	0	0	0	112.8
139	G	26.6	Very low	27.3	Very low	68 Å²	68	150.3 Å²	150.3	70%	0.701	79%	0.787	S	S	*	*			trans	-150.2	162.4	173.6	0	0	0	0	0	110.1
140	F	27.5	Very low	27.3	Very low	222 Å²	222	153.6 Å²	153.6	97%	0.974	79%	0.787	S	S	*	*			trans	-149.6	162.3	171.8	-120.5	-84.1	0	0	0	112
141	Q	29.4	Very low	27.3	Very low	181 Å²	181	154.9 Å²	154.9	85%	0.846	79%	0.785	S	S	*	*			trans	-116	143.9	-168.9	-178.4	179.1	-2.2	0	0	110.5
142	G	27.1	Very low	27.3	Very low	72 Å²	72	151.7 Å²	151.7	74%	0.742	78%	0.783	S	S	*	*			trans	-161.1	152.9	179	0	0	0	0	0	112.6
143	T	26.6	Very low	27.4	Very low	121 Å²	121	150.7 Å²	150.7	74%	0.742	79%	0.791	S	S	*	*			trans	-148.6	163.8	-161.1	-15.6	0	0	0	0	113.1
144	I	28.2	Very low	27.5	Very low	142 Å²	142	152.5 Å²	152.5	73%	0.728	80%	0.801	S	S	*	*			trans	90.4	122.3	149.9	-75.8	166.8	0	0	0	120.3
145	R	27.8	Very low	27.4	Very low	212 Å²	212	151.3 Å²	151.3	80%	0.8	81%	0.808	S	S	*	*			trans	87	116.7	148.6	-82.9	170.7	-166.9	-166.5	2.7	124.4
146	Q	27.4	Very low	27.7	Very low	160 Å²	160	151.1 Å²	151.1	75%	0.748	82%	0.815	S	S	*	*				51.3	119.9	126.6	-67.6	176.1	-76.5	0	0	120.9
147	N	26.6	Very low	27.8	Very low	170 Å²	170	151.8 Å²	151.8	91%	0.909	82%	0.818	S	S	*	*				-152.4	175.9	104.4	-122.1	-20.6	0	0	0	112.6
148	Q	27.9	Very low	27.8	Very low	170 Å²	170	152.1 Å²	152.1	79%	0.794	82%	0.82	S	S	*	*			trans	-126.6	133.5	-163.5	172.6	-173.8	6.4	0	0	112.4
149	M	28.2	Very low	27.8	Very low	190 Å²	190	156.5 Å²	156.5	94%	0.936	82%	0.822	S	S	*	*			trans	-171.8	147.5	148.9	-110.5	173.8	-173	0	0	112.1
150	D	26.7	Very low	27.7	Very low	146 Å²	146	162.6 Å²	162.6	78%	0.781	83%	0.832	S	S	*	*			trans	-90.2	142.5	178.7	-54.3	-85.1	0	0	0	112.6
151	R	27.6	Very low	27.8	Very low	229 Å²	229	157.5 Å²	157.5	86%	0.864	82%	0.824	S	S	*	*				-171.8	159.2	116.5	-114.2	-175.7	161.8	150.2	-1.3	116.5
152	D	27.3	Very low	27.7	Very low	143 Å²	143	154.1 Å²	154.1	77%	0.765	82%	0.818	S	S	*	*			trans	-51.4	128.9	176.3	-43.1	-84.6	0	0	0	114.4
153	D	26.6	Very low	27.6	Very low	159 Å²	159	154.9 Å²	154.9	85%	0.85	82%	0.818	S	S	*	*				-164.2	143.3	102.1	-142.4	-20.4	0	0	0	110.9
154	M	29.9	Very low	27.7	Very low	171 Å²	171	161 Å²	161	84%	0.842	83%	0.827	S	S	*	*			trans	-143.4	102.1	-178.3	-99.3	-73.1	-88.8	0	0	112.2
155	S	25.7	Very low	27.5	Very low	113 Å²	113	159.7 Å²	159.7	79%	0.79	83%	0.826	S	S	*	*			trans	-72.2	131	-177.5	56.5	0	0	0	0	113.4	H157	S155-H157 PolarHBondContact O-N 3.37Å
156	V	34.1	Very low	27.6	Very low	135 Å²	135	156.7 Å²	156.7	82%	0.818	82%	0.824	S	S	*	*			trans	-87.6	73.4	-176.7	-76.2	0	0	0	0	114.1
157	H	28.3	Very low	27.3	Very low	181 Å²	181	156.3 Å²	156.3	84%	0.838	83%	0.827	S	S	*	*			trans	-148.8	92.6	164.7	-83.2	-57.8	0	0	0	113	S155	S155-H157 PolarHBondContact O-N 3.37Å
158	S	26	Very low	27.4	Very low	123 Å²	123	155.2 Å²	155.2	86%	0.86	82%	0.821	S	S	*	*			trans	-165.9	86.5	160.4	-82.1	0	0	0	0	111.8
159	L	28.6	Very low	27.1	Very low	179 Å²	179	151.5 Å²	151.5	94%	0.937	81%	0.814	S	S	*	*			trans	-143.7	88.8	157.7	-80.9	-177.7	0	0	0	108.4
160	Q	25.2	Very low	26.8	Very low	195 Å²	195	149.6 Å²	149.6	91%	0.911	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-80	133.9	160	-73.9	177.9	-56.9	0	0	108.4
161	S	28.7	Very low	26.8	Very low	116 Å²	116	147.8 Å²	147.8	81%	0.811	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-69.8	132.1	169.9	-55.5	0	0	0	0	110
162	P	28.2	Very low	26.6	Very low	110 Å²	110	140.3 Å²	140.3	71%	0.714	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-69.6	130.8	165.4	29.5	-32.3	0	0	0	109.4
163	A	23.3	Very low	26.4	Very low	88 Å²	88	138.8 Å²	138.8	73%	0.727	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-76.2	142.4	168.3	0	0	0	0	0	109.8
164	W	29.9	Very low	26.4	Very low	248 Å²	248	139.9 Å²	139.9	94%	0.939	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-93.5	123.7	170.7	-73	84.1	0	0	0	109.3
165	V	24.7	Very low	26.1	Very low	116 Å²	116	139.2 Å²	139.2	70%	0.703	81%	0.808	S	S	*	*			trans	-126.4	114.6	-178.4	176.4	0	0	0	0	108.7
166	I	28.3	Very low	26	Very low	148 Å²	148	137.8 Å²	137.8	76%	0.759	80%	0.798	S	S	*	*			trans	43.3	117.6	148.3	-54	168.4	0	0	0	117.7	N168	I166-N168 HydrophobicContact CG2-CB 4.48Å
167	D	22.5	Very low	25.4	Very low	152 Å²	152	141.2 Å²	141.2	81%	0.813	81%	0.805	S	S	*	*				-136.6	158	117.7	-151.7	-9.2	0	0	0	109.8
168	N	28	Very low	25.2	Very low	148 Å²	148	142.4 Å²	142.4	79%	0.791	80%	0.802	S	S	*	*			trans	-149.7	79.2	-159.3	-173	54.2	0	0	0	112.1	I166	I166-N168 HydrophobicContact CG2-CB 4.48Å
169	S	21.8	Very low	25.1	Very low	91 Å²	91	143.3 Å²	143.3	64%	0.636	80%	0.797	S	S	*	*			trans	-144.8	146.2	-179.6	51.9	0	0	0	0	113.1
170	D	22.4	Very low	24.8	Very low	151 Å²	151	139.6 Å²	139.6	81%	0.807	79%	0.792	S	S	*	*			trans	47.8	111.9	164	-51.5	-24.5	0	0	0	118.9
171	A	26.3	Very low	24.8	Very low	108 Å²	108	135 Å²	135	89%	0.893	79%	0.788	S	S	*	*				63.5	71.2	51.9	0	0	0	0	0	113.9
172	G	21.9	Very low	24.7	Very low	72 Å²	72	141 Å²	141	74%	0.742	80%	0.795	S	S	*	*			trans	-155.7	128	175.4	0	0	0	0	0	114.8
173	S	23.3	Very low	24.4	Very low	111 Å²	111	141.7 Å²	141.7	78%	0.776	79%	0.792	S	S	*	*			trans	53.3	88.9	160.9	-150.8	0	0	0	0	119.1
174	M	27.6	Very low	24.4	Very low	182 Å²	182	146.2 Å²	146.2	90%	0.897	80%	0.799	S	S	*	*				-81.7	131.7	128.2	-65.1	-169.1	-59.1	0	0	107.7
175	I	23.5	Very low	24.1	Very low	156 Å²	156	142.1 Å²	142.1	80%	0.8	79%	0.79	S	S	*	*			trans	-166.4	130.9	149.4	-106.1	152.2	0	0	0	110.7
176	S	23.6	Very low	24.1	Very low	83 Å²	83	147.6 Å²	147.6	58%	0.58	80%	0.8	S	S	*	*			trans	26.1	113	152.6	-172.8	0	0	0	0	120.4
177	E	22	Very low	23.8	Very low	208 Å²	208	146 Å²	146	97%	0.972	80%	0.801	S	S	*	*				-105.3	134.2	115.9	-75.6	-169.6	151.5	0	0	108.1
178	R	22.8	Very low	23.9	Very low	206 Å²	206	147 Å²	147	78%	0.777	80%	0.801	S	S	*	*			trans	-126.7	145.4	-174.5	-138.4	-170.8	171.4	147.1	-1.8	107.9
179	D	23.6	Very low	23.6	Very low	141 Å²	141	145.5 Å²	145.5	75%	0.754	80%	0.803	S	S	*	*			trans	52.7	71.9	155.5	-47.8	-30.8	0	0	0	116.9
180	A	24.1	Very low	23.6	Very low	101 Å²	101	144.5 Å²	144.5	84%	0.835	81%	0.807	S	S	*	*			trans	-94	119.2	150.7	0	0	0	0	0	108.4
181	A	23.8	Very low	23.6	Very low	100 Å²	100	145.5 Å²	145.5	83%	0.826	81%	0.808	S	S	*	*			trans	-69.5	147.1	-170.6	0	0	0	0	0	113.4	D183	A181-D183 PolarHBondContact O-N 3.07Å
182	Y	27.1	Very low	23.5	Very low	240 Å²	240	147.6 Å²	147.6	94%	0.941	80%	0.804	S	S	*	*			trans	-71.1	113.9	161	-93.9	-101.7	0	0	0	109.3
183	D	21.6	Very low	23.5	Very low	125 Å²	125	147.1 Å²	147.1	67%	0.668	80%	0.8	S	S	*	*			trans	-139.6	107.3	149	-171.1	5.2	0	0	0	110.7	A181 Q185	A181-D183 PolarHBondContact O-N 3.07Å; D183-Q185 WeakPolarHBondContact OD1-CG 3.31Å; D183-Q185 PolarHBondContact OD1-N 3.06Å; D183-Q185 VanDerWaalsContact OD1-N 3.1Å
184	Q	24.6	Very low	23.5	Very low	184 Å²	184	151.8 Å²	151.8	86%	0.86	81%	0.806	S	S	*	*			trans	-147.5	75.5	144	-152.3	168	31	0	0	110.2
185	Q	22.8	Very low	23.3	Very low	162 Å²	162	146.5 Å²	146.5	76%	0.757	80%	0.798	S	S	*	*			trans	29.9	106.3	145	-60.6	-179.4	-14.7	0	0	118.1	D183	D183-Q185 WeakPolarHBondContact OD1-CG 3.31Å; D183-Q185 PolarHBondContact OD1-N 3.06Å; D183-Q185 VanDerWaalsContact OD1-N 3.1Å
186	Y	25.1	Very low	23.3	Very low	231 Å²	231	145.2 Å²	145.2	91%	0.906	80%	0.798	S	S	*	*			trans	-118.3	108.8	158.2	-126.1	-85	0	0	0	109.3
187	S	22	Very low	23.3	Very low	113 Å²	113	150.1 Å²	150.1	79%	0.79	81%	0.811	S	S	*	*			trans	-114.8	107.7	169.4	54.1	0	0	0	0	107.7
188	Q	23.1	Very low	23.3	Very low	173 Å²	173	147.2 Å²	147.2	81%	0.808	80%	0.802	S	S	*	*			cis	76.7	141.1	41.6	-154.5	-164.6	65.2	0	0	113.2
189	S	21.8	Very low	23.4	Very low	118 Å²	118	148.3 Å²	148.3	83%	0.825	81%	0.806	S	S	*	*			trans	80.1	143.7	-175.6	-42.8	0	0	0	0	114.3
190	G	22	Very low	23.4	Very low	70 Å²	70	150.4 Å²	150.4	72%	0.722	81%	0.811	S	S	*	*			cis	-175	142.5	-10.3	0	0	0	0	0	107.9
191	M	22.8	Very low	23.4	Very low	171 Å²	171	149.5 Å²	149.5	84%	0.842	81%	0.812	S	S	*	*				102.2	128.7	50.5	-166.9	99.1	94.8	0	0	110.8
192	N	24.1	Very low	23.3	Very low	152 Å²	152	148 Å²	148	81%	0.813	81%	0.806	S	S	*	*			trans	70.8	148.4	171.1	-59.6	-25	0	0	0	118.7
193	G	22.8	Very low	23.1	Very low	62 Å²	62	142.4 Å²	142.4	64%	0.639	80%	0.802	S	S	*	*			cis	167.3	176.6	-9.6	0	0	0	0	0	115.3
194	F	22.8	Very low	23.3	Very low	210 Å²	210	142.9 Å²	142.9	92%	0.921	81%	0.81	S	S	*	*			trans	67.6	151.5	171	-63.2	-85.6	0	0	0	118.3
195	G	22.3	Very low	23.3	Very low	70 Å²	70	140.9 Å²	140.9	72%	0.722	80%	0.802	S	S	*	*			cis	-163.5	-177.1	4.4	0	0	0	0	0	115.4
196	T	24.3	Very low	23.4	Very low	129 Å²	129	140.1 Å²	140.1	79%	0.791	81%	0.809	S	S	*	*			trans	-85.6	161.3	-169.6	47.3	0	0	0	0	115.3
197	Q	23.8	Very low	23.4	Very low	186 Å²	186	137.4 Å²	137.4	87%	0.869	80%	0.798	S	S	*	*			trans	-149.3	153.5	156.9	-93.2	-60.6	-13.9	0	0	111.1
198	L	22.7	Very low	23.5	Very low	148 Å²	148	141.4 Å²	141.4	78%	0.775	80%	0.804	S	S	*	*			trans	-111.2	149.1	-172.5	-80.3	73.9	0	0	0	114.1
199	R	23.6	Very low	23.5	Very low	229 Å²	229	137.2 Å²	137.2	86%	0.864	79%	0.791	S	S	*	*			trans	-174.3	126	141.2	-108.8	174.6	165.2	-147.9	-6.9	108.8
200	Q	23.5	Very low	23.7	Very low	184 Å²	184	140.5 Å²	140.5	86%	0.86	79%	0.786	S	S	*	*			cis	89.7	115.4	34.8	-166.7	-169.9	50.2	0	0	114.2
201	G	24.7	Very low	23.9	Very low	82 Å²	82	145.3 Å²	145.3	85%	0.845	79%	0.79	S	S	*	*			trans	111	133.7	172.3	0	0	0	0	0	113.9
202	G	22.6	Very low	24.3	Very low	68 Å²	68	143.5 Å²	143.5	70%	0.701	79%	0.789	S	S	*	*			cis	162.1	133.4	-10.1	0	0	0	0	0	113.6
203	S	22.9	Very low	25	Very low	123 Å²	123	142.2 Å²	142.2	86%	0.86	79%	0.788	S	S	*	*			trans	67.5	158.4	173	-50	0	0	0	0	115.6
204	T	25.1	Very low	25.2	Very low	136 Å²	136	147.7 Å²	147.7	83%	0.834	80%	0.797	S	S	*	*			cis	-145.5	160.6	12.7	-33.9	0	0	0	0	112.1
205	M	24.5	Very low	26.3	Very low	141 Å²	141	142.9 Å²	142.9	70%	0.695	79%	0.787	S	S	*	*			trans	-62.5	150.4	177.8	-67.6	-81.6	-167.6	0	0	115.5	Y207	M205-Y207 HydrophobicContact CE-CE2 4.06Å; M205-Y207 HydrophobicContact SD-CD2 3.99Å; M205-Y207 HydrophobicContact SD-CE2 3.72Å
206	T	25.2	Very low	26.7	Very low	146 Å²	146	144 Å²	144	90%	0.896	79%	0.79	S	S	*	*				-146.3	131.3	123.7	-10	0	0	0	0	111.7
207	Y	24	Very low	27.1	Very low	174 Å²	174	146 Å²	146	68%	0.682	80%	0.795	S	S	*	*			trans	-85.3	151.9	171.3	-88.8	-107.7	0	0	0	111.2	M205	M205-Y207 HydrophobicContact CE-CE2 4.06Å; M205-Y207 HydrophobicContact SD-CD2 3.99Å; M205-Y207 HydrophobicContact SD-CE2 3.72Å
208	Q	24.3	Very low	27.3	Very low	198 Å²	198	141 Å²	141	93%	0.925	79%	0.793	S	S	*	*				-159.1	166.8	120.6	-112.1	172.2	7.6	0	0	112.1
209	T	23	Very low	27.8	Very low	85 Å²	85	140.8 Å²	140.8	52%	0.521	80%	0.798	S	S	.	*			trans	-141.6	150.1	-150.2	-42.8	0	0	0	0	111.4
210	Y	27	Very low	28	Very low	187 Å²	187	133.8 Å²	133.8	73%	0.733	80%	0.797	S	S	*	*			trans	135.9	131.8	135.2	-75.1	-64.3	0	0	0	117.4
211	Q	26.6	Very low	28.4	Very low	171 Å²	171	135 Å²	135	80%	0.799	79%	0.794	S	S	*	*			trans	73.5	117.6	137.7	-72.5	159.6	0.5	0	0	121.5
212	T	30.9	Very low	28.7	Very low	133 Å²	133	140.3 Å²	140.3	82%	0.816	79%	0.788	S	S	*	*			trans	-61.8	156.3	149.1	53.3	0	0	0	0	111.2
213	P	38.7	Very low	29	Very low	124 Å²	124	142.2 Å²	142.2	81%	0.805	79%	0.791	S	S	*	*				-146.8	170.4	89	40	-23.9	0	0	0	116.4
214	E	26.3	Very low	29.3	Very low	177 Å²	177	143.3 Å²	143.3	83%	0.827	79%	0.786	S	S	*	*			trans	-68.1	-177.1	157.7	-103.5	-157.8	174.4	0	0	112.1
215	P	47.1	Very low	29.6	Very low	110 Å²	110	141.2 Å²	141.2	71%	0.714	78%	0.777	S	S	*	*			cis	-141.8	-169.7	14.7	37.5	-14.9	0	0	0	117.4
216	A	30.7	Very low	29.8	Very low	93 Å²	93	139.4 Å²	139.4	77%	0.769	78%	0.778	S	S	*	*			trans	105.2	152.6	134.9	0	0	0	0	0	122
217	L	31.5	Very low	30.1	Very low	171 Å²	171	138.1 Å²	138.1	90%	0.895	77%	0.77	S	S	*	*			trans	-85.8	161.5	-172.3	-67.6	83.7	0	0	0	114.2
218	G	29	Very low	30.4	Very low	81 Å²	81	137.2 Å²	137.2	84%	0.835	78%	0.777	S	S	*	*			trans	-153.4	121.2	160	0	0	0	0	0	113.5
219	T	32.3	Very low	30.7	Very low	144 Å²	144	133.9 Å²	133.9	88%	0.883	78%	0.775	S	S	*	*			trans	-104.8	133.9	176.1	55.7	0	0	0	0	112.1
220	G	28.8	Very low	31.1	Very low	81 Å²	81	141.9 Å²	141.9	84%	0.835	80%	0.796	S	S	*	*			trans	-128.5	153.9	176.8	0	0	0	0	0	113.6
221	R	30.8	Very low	31.1	Very low	210 Å²	210	136.8 Å²	136.8	79%	0.792	80%	0.8	S	S	*	*			trans	-125.9	139.1	-171.8	-98.3	-173.2	168.5	-160.6	2.3	114
222	R	31.4	Very low	31.2	Very low	193 Å²	193	135 Å²	135	73%	0.728	81%	0.807	S	S	*	*			trans	51.3	127.4	139.8	-61.8	-179.5	174.6	-159.4	-3.2	121.5
223	S	28.7	Very low	31.1	Very low	109 Å²	109	132.5 Å²	132.5	76%	0.762	81%	0.806	S	S	*	*				-165	138.3	118.2	-77	0	0	0	0	107.7
224	L	30.2	Very low	30.6	Very low	146 Å²	146	135.5 Å²	135.5	76%	0.764	82%	0.815	S	S	*	*				66.4	125.7	53.2	-58.4	-177	0	0	0	112.3
225	S	30.7	Very low	30.7	Very low	91 Å²	91	130.8 Å²	130.8	64%	0.636	81%	0.814	S	S	*	*			cis	-165	167.1	-2.6	-83.2	0	0	0	0	112.2
226	S	28.4	Very low	29.7	Very low	104 Å²	104	129.8 Å²	129.8	73%	0.727	82%	0.823	S	S	*	*			trans	61.7	147.9	140	55.5	0	0	0	0	122.4
227	T	32.5	Very low	29.5	Very low	118 Å²	118	129.5 Å²	129.5	72%	0.724	83%	0.829	S	S	*	*			cis	-166.6	145.3	-16.4	23.5	0	0	0	0	111.8
228	L	30.2	Very low	29.3	Very low	156 Å²	156	124.8 Å²	124.8	82%	0.817	82%	0.822	S	S	*	*			trans	48.6	133.6	139.3	-61.4	169	0	0	0	123.1
229	S	28.7	Very low	29.4	Very low	127 Å²	127	127.1 Å²	127.1	89%	0.888	82%	0.821	S	S	*	*				-155.8	158.7	124.3	-87.1	0	0	0	0	112.5
230	R	31.8	Very low	29.1	Very low	254 Å²	254	128.1 Å²	128.1	96%	0.958	82%	0.815	S	S	*	*			trans	-107.4	159.7	178.2	-75.7	171.4	155.5	-172.7	-5.7	110.5
231	G	26.7	Very low	29.2	Very low	79 Å²	79	132.5 Å²	132.5	81%	0.814	82%	0.818	S	S	*	*			trans	179.1	136.7	161.1	0	0	0	0	0	113.8
232	S	29.2	Very low	28.9	Very low	135 Å²	135	128.8 Å²	128.8	94%	0.944	81%	0.812	S	S	*	*			trans	-121	150.2	174	-53.7	0	0	0	0	109.7
233	G	28.6	Very low	28.8	Very low	79 Å²	79	127.9 Å²	127.9	81%	0.814	82%	0.816	S	S	*	*			trans	-173.3	155.3	177.1	0	0	0	0	0	113.7
234	L	29.2	Very low	28.7	Very low	187 Å²	187	131.1 Å²	131.1	98%	0.979	82%	0.819	S	S	*	*			trans	-131.2	151.7	-176.7	-80.7	155.1	0	0	0	110.5
235	G	27.7	Very low	28.6	Very low	79 Å²	79	132.6 Å²	132.6	81%	0.814	82%	0.822	S	S	*	*			trans	119.6	124.2	144.3	0	0	0	0	0	118.5
236	G	27.4	Very low	28.5	Very low	88 Å²	88	133.5 Å²	133.5	91%	0.907	83%	0.829	S	S	*	*			trans	79.1	149.4	163.4	0	0	0	0	0	116.6
237	G	26.3	Very low	28.5	Very low	87 Å²	87	137.9 Å²	137.9	90%	0.897	84%	0.835	S	S	*	*			cis	145.9	98.4	-11.2	0	0	0	0	0	113.9
238	G	27.3	Very low	28.6	Very low	72 Å²	72	140.2 Å²	140.2	74%	0.742	84%	0.835	S	S	*	*			trans	164.6	119.7	172.2	0	0	0	0	0	115.8
239	T	30.3	Very low	28.8	Very low	131 Å²	131	134.6 Å²	134.6	80%	0.804	81%	0.814	S	S	*	*			trans	16.7	108.1	153.7	54.1	0	0	0	0	118.7
240	E	26.3	Very low	29.1	Very low	164 Å²	164	133.8 Å²	133.8	77%	0.766	81%	0.807	S	S	*	*				71.2	107.2	79.5	-74.9	-160	149.9	0	0	116.7
241	I	30	Very low	29.3	Very low	174 Å²	174	125.7 Å²	125.7	89%	0.892	79%	0.794	S	S	*	*			trans	-134.9	136.8	138.8	-64.3	-174.5	0	0	0	107.2
242	I	25.7	Very low	30.1	Very low	131 Å²	131	128.3 Å²	128.3	67%	0.672	79%	0.785	S	S	*	*			trans	-96.2	130.7	-172.2	-63.2	168.3	0	0	0	111.2	Q244	I242-Q244 HydrophobicContact CG2-CG 4.33Å
243	Q	28.1	Very low	31	Very low	175 Å²	175	131.9 Å²	131.9	82%	0.818	78%	0.777	S	S	*	*			trans	-138.7	117.6	156.7	-162.1	174.4	34.6	0	0	110.2	Q245	Q243-Q245 PolarHBondContact O-N 3.39Å
244	Q	26.9	Very low	31.5	Very low	177 Å²	177	132.7 Å²	132.7	83%	0.827	77%	0.767	S	S	*	*			trans	-76.5	123.1	-175.7	-66	179.2	-7.3	0	0	111.3	I242	I242-Q244 HydrophobicContact CG2-CG 4.33Å
245	Q	27.8	Very low	32.1	Very low	176 Å²	176	129.2 Å²	129.2	82%	0.822	75%	0.748	S	S	*	*			trans	-114.9	117.6	164.2	-69.2	-165.2	2.9	0	0	110.2	Q243 F247	Q243-Q245 PolarHBondContact O-N 3.39Å; Q245-F247 PolarHBondContact O-N 2.92Å; Q245-F247 VanDerWaalsContact O-N 3.1Å
246	S	29	Very low	32.6	Very low	111 Å²	111	131.9 Å²	131.9	78%	0.776	74%	0.743	S	S	*	*			trans	-73.5	101.9	-178.6	-60	0	0	0	0	111.9	K248	S246-K248 PolarHBondContact O-N 2.92Å
247	F	27.9	Very low	33.2	Very low	196 Å²	196	138.3 Å²	138.3	86%	0.86	74%	0.74	S	S	*	*			trans	-57.3	121.8	178	-172.2	-97.5	0	0	0	112.1	Q245	Q245-F247 PolarHBondContact O-N 2.92Å; Q245-F247 VanDerWaalsContact O-N 3.1Å
248	K	35.4	Very low	34	Very low	167 Å²	167	140.8 Å²	140.8	73%	0.726	73%	0.731	S	S	*	*			trans	-117.8	126.6	172.3	-73.8	-173.3	176.4	-178.1	0	110.4	S246	S246-K248 PolarHBondContact O-N 2.92Å
249	G	34.9	Very low	34.5	Very low	37 Å²	37	141.2 Å²	141.2	38%	0.381	73%	0.728	S	S	.	*			trans	-74.2	174.3	-167.3	0	0	0	0	0	116.5	A251 H252	G249-A251 VanDerWaalsContact C-N 3.33Å; G249-A251 PolarHBondContact O-N 3.16Å; G249-H252 PolarHBondContact O-N 3.01Å
250	P	35.2	Very low	35	Very low	111 Å²	111	142.1 Å²	142.1	72%	0.721	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-58	-34.1	-166.8	-28.2	36.3	0	0	0	116.1	H252 R253	P250-H252 PolarHBondContact O-N 3.35Å; P250-R253 PolarHBondContact O-N 3.18Å
251	A	35.2	Very low	35.5	Very low	83 Å²	83	145.1 Å²	145.1	69%	0.686	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-54.1	-27.5	-174.5	0	0	0	0	0	114.2	G249 R253	G249-A251 VanDerWaalsContact C-N 3.33Å; G249-A251 PolarHBondContact O-N 3.16Å; A251-R253 VanDerWaalsContact C-N 3.33Å; A251-R253 PolarHBondContact O-N 3.38Å
252	H	43.2	Very low	35.7	Very low	135 Å²	135	144.3 Å²	144.3	63%	0.625	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-77.7	-11.3	-174.7	-127.9	-57	0	0	0	115	G249 P250	G249-H252 PolarHBondContact O-N 3.01Å; P250-H252 PolarHBondContact O-N 3.35Å
253	R	48.7	Very low	36.1	Very low	210 Å²	210	149.6 Å²	149.6	79%	0.792	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-86.7	-19.4	178.8	-77.6	-172.1	-120.9	-166.5	-0.2	114.4	P250 A251	P250-R253 PolarHBondContact O-N 3.18Å; A251-R253 VanDerWaalsContact C-N 3.33Å; A251-R253 PolarHBondContact O-N 3.38Å
254	T	39.7	Very low	36.1	Very low	96 Å²	96	150 Å²	150	59%	0.589	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-37.2	-174.8	-49.9	0	0	0	0	112.7	N256 R257	T254-N256 PolarHBondContact O-N 2.94Å; T254-R257 PolarHBondContact O-N 2.9Å
255	I	41.3	Very low	36.1	Very low	114 Å²	114	147.6 Å²	147.6	59%	0.585	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-63.4	-37.8	-170.6	-62.4	174.5	0	0	0	112.3	R257 I258	I255-R257 PolarHBondContact O-N 3.36Å; I255-R257 VanDerWaalsContact O-N 3.14Å; I255-I258 PolarHBondContact O-N 3.16Å
256	N	37.2	Very low	36	Very low	135 Å²	135	148.1 Å²	148.1	72%	0.722	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-68.4	-10.5	-178.2	-82	11.2	0	0	0	114.8	T254	T254-N256 PolarHBondContact O-N 2.94Å
257	R	40.7	Very low	35.9	Very low	223 Å²	223	150 Å²	150	84%	0.842	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-87.1	-17.9	176.8	-72.6	-176.6	174.8	167.5	-2.2	113.9	T254 I255	T254-R257 PolarHBondContact O-N 2.9Å; I255-R257 PolarHBondContact O-N 3.36Å; I255-R257 VanDerWaalsContact O-N 3.14Å
258	I	42.6	Very low	35.8	Very low	138 Å²	138	145.1 Å²	145.1	71%	0.708	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-28.4	-174.7	-60.8	177	0	0	0	111.7	I255 N260	I255-I258 PolarHBondContact O-N 3.16Å; I258-N260 PolarHBondContact O-N 3.1Å
259	A	37.9	Very low	35.4	Very low	82 Å²	82	146 Å²	146	68%	0.678	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-23.4	-173.2	0	0	0	0	0	115.6
260	N	40.7	Very low	34.9	Very low	150 Å²	150	150.6 Å²	150.6	80%	0.802	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	11.5	-164.1	-86.1	10.1	0	0	0	116.1	I258	I258-N260 PolarHBondContact O-N 3.1Å
261	R	37.1	Very low	34.4	Very low	226 Å²	226	148.3 Å²	148.3	85%	0.853	78%	0.777	S	S	*	*	S	Bend	trans	-100.6	-12.6	-176.6	-141.1	169	-172.6	159.7	1.5	116.1
262	N	35	Very low	34	Very low	158 Å²	158	150 Å²	150	85%	0.845	78%	0.784	S	S	*	*	S	Bend	trans	-114.1	56.4	-176.2	-71.3	14.2	0	0	0	113.2
263	R	33.2	Very low	33.1	Very low	241 Å²	241	153.5 Å²	153.5	91%	0.909	79%	0.791	S	S	*	*			trans	-148.9	79.7	170.6	-93.3	-163.5	170.4	-158.9	-2.1	112.8
264	M	27.8	Very low	32	Very low	185 Å²	185	150.2 Å²	150.2	91%	0.911	79%	0.787	S	S	*	*			trans	-149.5	167.2	150.2	-83.3	-145.9	156.7	0	0	109.9
265	S	27.8	Very low	31.3	Very low	126 Å²	126	151.6 Å²	151.6	88%	0.881	80%	0.795	S	S	*	*			trans	51.3	88.4	-176	63	0	0	0	0	116.6
266	M	26.3	Very low	30.6	Very low	186 Å²	186	151.2 Å²	151.2	92%	0.916	80%	0.803	S	S	*	*			trans	-97.4	141.4	147.8	-68.2	179.2	173.5	0	0	109
267	T	26.7	Very low	30	Very low	150 Å²	150	149.9 Å²	149.9	92%	0.92	80%	0.804	S	S	*	*			trans	-156.8	159.5	132.3	-1	0	0	0	0	111.9
268	S	26	Very low	29.4	Very low	94 Å²	94	145.1 Å²	145.1	66%	0.657	81%	0.805	S	S	*	*			trans	-107.4	156.5	-176.2	53.5	0	0	0	0	112.8
269	M	26	Very low	28.6	Very low	185 Å²	185	141.8 Å²	141.8	91%	0.911	80%	0.804	S	S	*	*			trans	-154.7	166.3	139.6	-101.2	-50.7	153.2	0	0	111.4
270	T	24.7	Very low	28.1	Very low	134 Å²	134	145.3 Å²	145.3	82%	0.822	81%	0.812	S	S	*	*			trans	-140.6	132.8	-155.3	-43	0	0	0	0	114.9
271	G	25.1	Very low	27.5	Very low	64 Å²	64	145.3 Å²	145.3	66%	0.66	81%	0.81	S	S	*	*			trans	110.3	158.3	137.6	0	0	0	0	0	119.8
272	S	26.5	Very low	27	Very low	118 Å²	118	137.7 Å²	137.7	83%	0.825	80%	0.801	S	S	*	*			trans	72.5	146.6	164.9	-67	0	0	0	0	119.2
273	R	24.7	Very low	26.7	Very low	209 Å²	209	135.7 Å²	135.7	79%	0.789	81%	0.807	S	S	*	*			cis	-170.6	167	-27.3	-145.7	170	-175.7	-179.5	1.9	109.7
274	M	25.3	Very low	26.4	Very low	141 Å²	141	127.8 Å²	127.8	70%	0.695	80%	0.8	S	S	*	*			trans	78.6	126.9	161.8	-57.2	-55.1	-168.9	0	0	120.8
275	T	25.3	Very low	26.4	Very low	125 Å²	125	121.6 Å²	121.6	77%	0.767	78%	0.784	S	S	*	*			trans	52.7	140.6	132.3	61.2	0	0	0	0	122
276	S	26.4	Very low	26.4	Very low	106 Å²	106	120.7 Å²	120.7	74%	0.741	77%	0.77	S	S	*	*			cis	-167.4	-163.2	-9	47.2	0	0	0	0	107.9
277	S	25.4	Very low	26.5	Very low	107 Å²	107	121.9 Å²	121.9	75%	0.748	76%	0.764	S	S	*	*			cis	-159.4	-169.8	20	-45	0	0	0	0	112.6
278	S	26.4	Very low	26.6	Very low	123 Å²	123	120.1 Å²	120.1	86%	0.86	75%	0.753	S	S	*	*			trans	-67.9	169	166.7	48	0	0	0	0	115.2
279	G	26.1	Very low	26.5	Very low	67 Å²	67	123.4 Å²	123.4	69%	0.691	76%	0.763	S	S	*	*			cis	-175.2	158.8	3.5	0	0	0	0	0	109.9
280	N	27.8	Very low	26.5	Very low	157 Å²	157	118.5 Å²	118.5	84%	0.84	76%	0.76	S	S	*	*				65.1	127.7	69.4	-149.3	30.5	0	0	0	112.4
281	I	28.3	Very low	26.4	Very low	150 Å²	150	115.6 Å²	115.6	77%	0.769	76%	0.757	S	S	*	*			cis	-147.8	165.6	24	-59.6	163.9	0	0	0	107.7
282	G	26.9	Very low	26.3	Very low	65 Å²	65	122 Å²	122	67%	0.67	77%	0.767	S	S	*	*			cis	138.5	150.7	-5.3	0	0	0	0	0	114.7
283	A	28.7	Very low	26.3	Very low	116 Å²	116	124.6 Å²	124.6	96%	0.959	77%	0.771	S	S	*	*			trans	72.3	157.5	175.9	0	0	0	0	0	118.8
284	G	27	Very low	26.3	Very low	75 Å²	75	122.4 Å²	122.4	77%	0.773	77%	0.771	S	S	*	*			cis	172.6	164.7	-8.9	0	0	0	0	0	115.6
285	G	27.5	Very low	26.2	Very low	56 Å²	56	121.5 Å²	121.5	58%	0.577	78%	0.779	S	S	*	*			trans	85.5	174.6	168.4	0	0	0	0	0	118.8
286	D	27.2	Very low	26.1	Very low	107 Å²	107	121.2 Å²	121.2	57%	0.572	78%	0.776	S	S	*	*				-157.8	154.1	-63.3	-137.4	29.9	0	0	0	115.1	K53	K53-D286 IonicContact NZ-OD1 3.86Å; K53-D286 PolarHBondContact NZ-OD1 3.02Å
287	R	29.5	Very low	26.1	Very low	211 Å²	211	126.1 Å²	126.1	80%	0.796	79%	0.785	S	S	*	*			trans	66.3	161.1	158.5	-67	170.9	-156.1	-138.1	-2.9	118.8
288	T	27.5	Very low	26	Very low	113 Å²	113	127 Å²	127	69%	0.693	79%	0.791	S	S	*	*			cis	-157.3	155.7	-6.4	7.4	0	0	0	0	112.4
289	D	25.1	Very low	25.8	Very low	162 Å²	162	124.2 Å²	124.2	87%	0.866	78%	0.782	S	S	*	*			trans	24.5	149	146.2	-55.5	-25.5	0	0	0	125.4
290	G	25.6	Very low	25.8	Very low	83 Å²	83	125.4 Å²	125.4	86%	0.856	78%	0.779	S	S	*	*			trans	158.9	140.6	158.8	0	0	0	0	0	114.2
291	G	23	Very low	25.7	Very low	72 Å²	72	126.8 Å²	126.8	74%	0.742	78%	0.78	S	S	*	*			trans	-168.2	-172.7	-179.8	0	0	0	0	0	116.3
292	F	22	Very low	25.6	Very low	200 Å²	200	123.3 Å²	123.3	88%	0.877	78%	0.781	S	S	*	*			trans	68	127.7	-178.3	-81.4	-94.3	0	0	0	118.5
293	L	25.8	Very low	25.5	Very low	172 Å²	172	127.6 Å²	127.6	90%	0.901	79%	0.789	S	S	*	*				-168.7	165.6	101.8	-102.3	172.4	0	0	0	113.4
294	M	24.5	Very low	25.4	Very low	162 Å²	162	130.4 Å²	130.4	80%	0.798	79%	0.787	S	S	*	*			trans	-106.1	162.8	-178.2	-86	-83.7	-157.8	0	0	112.2
295	S	24.8	Very low	25.4	Very low	122 Å²	122	134.5 Å²	134.5	85%	0.853	79%	0.79	S	S	*	*			trans	-150.4	148.8	156.5	-166.9	0	0	0	0	111.5
296	V	23.5	Very low	25.5	Very low	119 Å²	119	141 Å²	141	72%	0.721	81%	0.806	S	S	*	*			trans	-145.2	147.2	-164.4	-179.4	0	0	0	0	111.6
297	K	24.7	Very low	25.5	Very low	210 Å²	210	144.2 Å²	144.2	91%	0.913	82%	0.817	S	S	*	*			trans	-152.9	176.3	160.6	-116.3	162.3	-173.4	173.7	0	111.8
298	S	23.3	Very low	25.3	Very low	125 Å²	125	144.4 Å²	144.4	87%	0.874	82%	0.817	S	S	*	*			trans	-150.8	171.7	-163.4	-167.1	0	0	0	0	113.9
299	G	23.8	Very low	25.4	Very low	65 Å²	65	148.1 Å²	148.1	67%	0.67	83%	0.827	S	S	*	*			trans	102.4	108.3	-174.1	0	0	0	0	0	111.4
300	S	25.4	Very low	25.4	Very low	92 Å²	92	143.1 Å²	143.1	64%	0.643	81%	0.814	S	S	*	*			cis	72.8	135.5	23.7	-148	0	0	0	0	113.3
301	H	26.6	Very low	25.5	Very low	186 Å²	186	142.4 Å²	142.4	86%	0.861	81%	0.806	S	S	*	*			cis	-139	162.1	17.8	-64.7	-110.7	0	0	0	112.9
302	G	24.5	Very low	25.8	Very low	76 Å²	76	146.8 Å²	146.8	78%	0.784	81%	0.812	S	S	*	*			trans	155.1	120.7	159.6	0	0	0	0	0	116.1
303	N	26	Very low	26	Very low	156 Å²	156	142.6 Å²	142.6	83%	0.834	81%	0.807	S	S	*	*			trans	-102.7	142.1	179	-83.8	-15.4	0	0	0	112.9
304	L	26.4	Very low	26.3	Very low	175 Å²	175	145 Å²	145	92%	0.916	81%	0.805	S	S	*	*			trans	-150.9	133.8	141.2	-152.3	75.5	0	0	0	110.4
305	L	27.3	Very low	26.4	Very low	160 Å²	160	139.3 Å²	139.3	84%	0.838	78%	0.781	S	S	*	*			trans	-83.4	134.6	179.1	-76.9	77.9	0	0	0	110.7
306	Q	29	Very low	26.7	Very low	194 Å²	194	138.1 Å²	138.1	91%	0.907	77%	0.768	S	S	*	*			trans	-127.3	121.2	161.2	-157.4	176.6	52.6	0	0	110.3	R308	Q306-R308 PolarHBondContact O-N 3.16Å
307	Q	27.5	Very low	27.1	Very low	173 Å²	173	134.2 Å²	134.2	81%	0.808	75%	0.747	S	S	*	*			trans	-86.1	93.9	-165.9	-169	176.8	28.7	0	0	111.2	Q309	Q307-Q309 PolarHBondContact O-N 3.06Å
308	R	25.4	Very low	27.4	Very low	215 Å²	215	132.8 Å²	132.8	81%	0.811	75%	0.745	S	S	*	*			trans	-55.9	114.4	173.2	-78.7	-170.9	173.4	-159.4	-1.2	111	Q306 R792	Q306-R308 PolarHBondContact O-N 3.16Å; R308-R792 PolarHBondContact O-NH1 3.33Å
309	Q	29.2	Very low	27.8	Very low	191 Å²	191	135.6 Å²	135.6	89%	0.893	74%	0.736	S	S	*	*			trans	-66.6	135.3	161.2	-65.6	-171.1	7.3	0	0	108.8	Q307 G311	Q307-Q309 PolarHBondContact O-N 3.06Å; Q309-G311 PolarHBondContact O-N 2.88Å
310	G	26.1	Very low	28.2	Very low	58 Å²	58	135.8 Å²	135.8	60%	0.598	73%	0.728	S	S	*	*			trans	-72.8	109.5	-179.2	0	0	0	0	0	110.8
311	G	26.2	Very low	28.6	Very low	67 Å²	67	137.1 Å²	137.1	69%	0.691	73%	0.732	S	S	*	*			trans	-62.8	141.6	171.1	0	0	0	0	0	111.1	Q309 S313	Q309-G311 PolarHBondContact O-N 2.88Å; G311-S313 VanDerWaalsContact C-N 3.34Å; G311-S313 PolarHBondContact O-N 3.14Å
312	L	30.1	Very low	28.8	Very low	165 Å²	165	133.8 Å²	133.8	86%	0.864	72%	0.717	S	S	*	*			trans	-71.1	89.7	174.2	-73.2	170.2	0	0	0	110	R314	L312-R314 PolarHBondContact O-N 3.24Å; L312-R314 VanDerWaalsContact O-N 3.14Å
313	S	26.6	Very low	29.4	Very low	111 Å²	111	131.7 Å²	131.7	78%	0.776	69%	0.69	S	S	*	*			trans	-51.3	118.6	171	-69.2	0	0	0	0	110	G311 S315	G311-S313 VanDerWaalsContact C-N 3.34Å; G311-S313 PolarHBondContact O-N 3.14Å; S313-S315 PolarHBondContact O-N 3.14Å; S313-S315 VanDerWaalsContact O-N 3.1Å
314	R	31.3	Very low	30.2	Very low	223 Å²	223	126.2 Å²	126.2	84%	0.842	66%	0.662	S	S	*	*			trans	-65.4	111.8	-171	-63.2	179.2	-178.1	-178.1	1.4	110.1	L312 T316	L312-R314 PolarHBondContact O-N 3.24Å; L312-R314 VanDerWaalsContact O-N 3.14Å; R314-T316 HydrophobicContact CB-CG2 4.45Å; R314-T316 PolarHBondContact O-N 3.01Å; R314-T316 PolarHBondContact O-OG1 2.81Å
315	S	27.1	Very low	31	Very low	42 Å²	42	120.1 Å²	120.1	29%	0.294	64%	0.641	S	S	.	*			trans	-80.2	58.5	161.3	-160.6	0	0	0	0	110.8	S313 S317 R569 R705	S313-S315 PolarHBondContact O-N 3.14Å; S313-S315 VanDerWaalsContact O-N 3.1Å; S315-S317 PolarHBondContact O-N 3.34Å; S315-R569 PolarHBondContact O-NH2 2.91Å; S315-R705 PolarHBondContact OG-NE 3Å; S315-R705 VanDerWaalsContact OG-NE 3.15Å; S315-R705 PolarHBondContact OG-NH2 3.29Å
316	T	30.5	Very low	31.9	Very low	97 Å²	97	113 Å²	113	60%	0.595	61%	0.607	S	S	*	*			trans	-58.8	124.7	147.3	39.1	0	0	0	0	106.9	R314 M318	R314-T316 HydrophobicContact CB-CG2 4.45Å; R314-T316 PolarHBondContact O-N 3.01Å; R314-T316 PolarHBondContact O-OG1 2.81Å; T316-M318 PolarHBondContact O-N 3.36Å
317	S	31.7	Very low	32.6	Very low	38 Å²	38	103.9 Å²	103.9	27%	0.266	57%	0.565	S	S	.	*			trans	-64	112.2	178.5	-176.6	0	0	0	0	109.2	S315 R319 S320	S315-S317 PolarHBondContact O-N 3.34Å; S317-R319 PolarHBondContact O-N 3.49Å; S317-S320 PolarHBondContact O-N 3.1Å
318	M	31	Very low	33.7	Very low	179 Å²	179	98.5 Å²	98.5	88%	0.882	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	28.4	-179.1	-64.6	-179.9	68.8	0	0	113.5	T316	T316-M318 PolarHBondContact O-N 3.36Å
319	R	32	Very low	34.8	Very low	184 Å²	184	89.9 Å²	89.9	69%	0.694	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.2	23.5	171.6	-65.1	-169.6	173.8	-150.5	-2.5	111.8	S317 V321	S317-R319 PolarHBondContact O-N 3.49Å; R319-V321 PolarHBondContact O-N 3.44Å
320	S	31.8	Very low	35.7	Very low	70 Å²	70	82.8 Å²	82.8	49%	0.49	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	20.6	173.8	60.6	0	0	0	0	114.7	S317	S317-S320 PolarHBondContact O-N 3.1Å
321	V	33.5	Very low	36.5	Very low	120 Å²	120	83.4 Å²	83.4	73%	0.727	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.6	17.4	-175.8	-65.5	0	0	0	0	112.8	R319 S323	R319-V321 PolarHBondContact O-N 3.44Å; V321-S323 PolarHBondContact O-N 3.22Å
322	Q	32	Very low	37.2	Very low	116 Å²	116	81.5 Å²	81.5	54%	0.542	45%	0.445	S	S	.	.			trans	-73.3	68.7	158.5	-69.6	-166.8	-49.4	0	0	109.8
323	S	36.3	Very low	37.5	Very low	31 Å²	31	80.2 Å²	80.2	22%	0.217	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-65.5	134.7	153.4	-137.2	0	0	0	0	106.5	V321 N458	V321-S323 PolarHBondContact O-N 3.22Å; S323-N458 PolarHBondContact OG-OD1 2.93Å
324	V	43.3	Very low	38	Very low	41 Å²	41	78.5 Å²	78.5	25%	0.248	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-55.8	165.7	168.4	-87.1	0	0	0	0	111.1	Y419 W457	V324-Y419 WeakPolarHBondContact O-CE2 3.4Å; V324-Y419 PolarHBondContact O-OH 3.11Å; V324-W457 HydrophobicContact CB-CH2 4.49Å; V324-W457 HydrophobicContact CB-CZ3 4.1Å; V324-W457 HydrophobicContact CG1-CE3 4.23Å; V324-W457 HydrophobicContact CG1-CH2 3.56Å; V324-W457 HydrophobicContact CG1-CZ3 3.34Å; V324-W457 HydrophobicContact CG2-CD2 4.4Å; V324-W457 HydrophobicContact CG2-CE3 3.65Å; V324-W457 HydrophobicContact CG2-CH2 4.39Å; V324-W457 HydrophobicContact CG2-CZ3 3.66Å
325	G	44	Very low	38.5	Very low	47 Å²	47	72.5 Å²	72.5	49%	0.485	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-56.3	165.9	166.8	0	0	0	0	0	111.3
326	G	46.2	Very low	39.3	Very low	11 Å²	11	71.8 Å²	71.8	11%	0.113	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-54.9	145.8	163.9	0	0	0	0	0	109.4	M328 F377	G326-M328 PolarHBondContact O-N 3.12Å; G326-F377 VanDerWaalsContact O-CE2 3.31Å; G326-F377 WeakPolarHBondContact O-CE2 3.28Å
327	G	43.6	Very low	39.9	Very low	2 Å²	2	74.1 Å²	74.1	2%	0.021	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-69.7	118.5	-177.6	0	0	0	0	0	111.5	D329 N416	G327-D329 WeakPolarHBondContact CA-OD1 3.3Å; G327-D329 WeakPolarHBondContact CA-OD2 3.45Å; G327-D329 PolarHBondContact O-N 2.94Å; G327-N416 PolarHBondContact N-OD1 3.37Å; G327-N416 PolarHBondContact O-ND2 3.41Å; G327-N416 PolarHBondContact O-OD1 2.93Å
328	M	50	Low	40.5	Very low	60 Å²	60	79.9 Å²	79.9	30%	0.296	44%	0.436	S	S	.	.			trans	-97.1	34.7	172.1	-161.4	73.4	176.1	0	0	109	G326 I330 F331 Q333 L336 F377	G326-M328 PolarHBondContact O-N 3.12Å; M328-I330 PolarHBondContact O-N 3.07Å; M328-F331 VanDerWaalsContact O-O 3.07Å; M328-Q333 HydrophobicContact CE-CB 3.81Å; M328-Q333 HydrophobicContact CE-CG 4.44Å; M328-L336 HydrophobicContact CE-CD1 3.83Å; M328-F377 HydrophobicContact SD-CD1 4.23Å; M328-F377 HydrophobicContact SD-CE1 3.99Å; M328-F377 HydrophobicContact SD-CZ 4.24Å
329	D	49.3	Very low	41.5	Very low	34 Å²	34	72.8 Å²	72.8	18%	0.182	40%	0.402	C	S	.	.			trans	-106	22.7	-145.4	-41.9	-35.4	0	0	0	113.2	G327 R415 K450	G327-D329 WeakPolarHBondContact CA-OD1 3.3Å; G327-D329 WeakPolarHBondContact CA-OD2 3.45Å; G327-D329 PolarHBondContact O-N 2.94Å; D329-R415 IonicContact OD2-CZ 3.09Å; D329-R415 IonicContact OD2-NE 3.26Å; D329-R415 PolarHBondContact OD2-NE 3.3Å; D329-R415 IonicContact OD2-NH1 2.58Å; D329-R415 PolarHBondContact OD2-NH1 3.15Å; D329-R415 IonicContact OD2-NH2 3.37Å; D329-R415 PolarHBondContact OD2-NH2 3.49Å; D329-K450 HydrophobicContact CB-CD 4.43Å; D329-K450 WeakPolarHBondContact O-CE 3.33Å; D329-K450 PolarHBondContact O-NZ 3.39Å
330	I	47	Very low	42.4	Very low	42 Å²	42	68.5 Å²	68.5	22%	0.215	40%	0.398	C	S	.	.	S	Bend	trans	-115.4	-31.4	168.1	-57.9	-173.8	0	0	0	110.6	M328 Q373 F409	M328-I330 PolarHBondContact O-N 3.07Å; I330-Q373 VanDerWaalsContact CD1-OE1 3.22Å; I330-F409 HydrophobicContact CD1-CD1 3.48Å; I330-F409 VanDerWaalsContact CD1-CD1 3.48Å; I330-F409 HydrophobicContact CD1-CE1 3.67Å; I330-F409 HydrophobicContact CD1-CG 3.97Å; I330-F409 HydrophobicContact CD1-CZ 4.28Å; I330-F409 HydrophobicContact CG2-CE1 3.82Å; I330-F409 HydrophobicContact CG2-CZ 3.8Å
331	F	43.6	Very low	43.6	Very low	72 Å²	72	67.8 Å²	67.8	32%	0.316	39%	0.388	S	S	.	.	S	Bend	trans	-153.7	140.7	174.4	-70.4	-69.8	0	0	0	109.2	M328 D335 L336 N339	M328-F331 VanDerWaalsContact O-O 3.07Å; F331-D335 HydrophobicContact CB-CB 4.01Å; F331-D335 HydrophobicContact CD1-CB 3.76Å; F331-D335 HydrophobicContact CG-CB 4.33Å; F331-L336 HydrophobicContact CB-CD1 4.45Å; F331-L336 HydrophobicContact CB-CD2 3.58Å; F331-L336 HydrophobicContact CB-CG 3.56Å; F331-L336 HydrophobicContact CD2-CD2 3.8Å; F331-L336 HydrophobicContact CG-CD2 4.02Å; F331-L336 HydrophobicContact CG-CG 4.42Å; F331-N339 WeakPolarHBondContact CE2-ND2 3.35Å; F331-N339 WeakPolarHBondContact CZ-ND2 3.38Å
332	G	39.7	Very low	44.7	Very low	27 Å²	27	63.5 Å²	63.5	28%	0.278	36%	0.36	S	S	.	.			trans	-67.4	165.3	166.1	0	0	0	0	0	110.8	A334 D335 L336	G332-A334 PolarHBondContact O-N 3.31Å; G332-A334 VanDerWaalsContact O-N 3.13Å; G332-D335 WeakPolarHBondContact CA-OD2 3.48Å; G332-D335 PolarHBondContact N-OD2 3.2Å; G332-D335 PolarHBondContact O-N 2.96Å; G332-L336 PolarHBondContact O-N 3.07Å; G332-L336 VanDerWaalsContact O-N 3.16Å
333	Q	37.9	Very low	45.7	Very low	138 Å²	138	65.7 Å²	65.7	65%	0.645	37%	0.37	S	S	*	.	H	α-helix	trans	-57.5	-32.7	-179.8	-168.3	169.2	-9.6	0	0	112.6	M328	M328-Q333 HydrophobicContact CE-CB 3.81Å; M328-Q333 HydrophobicContact CE-CG 4.44Å
334	A	36.9	Very low	46.8	Very low	75 Å²	75	71.8 Å²	71.8	62%	0.62	39%	0.388	S	S	*	.	H	α-helix	trans	-74.7	-24.7	174.9	0	0	0	0	0	114.2	G332	G332-A334 PolarHBondContact O-N 3.31Å; G332-A334 VanDerWaalsContact O-N 3.13Å
335	D	40.9	Very low	47.7	Very low	96 Å²	96	70.6 Å²	70.6	51%	0.513	38%	0.381	S	S	.	.	H	α-helix	trans	-90.1	-10.6	-179.6	-41.7	-66.9	0	0	0	112.3	F331 G332	F331-D335 HydrophobicContact CB-CB 4.01Å; F331-D335 HydrophobicContact CD1-CB 3.76Å; F331-D335 HydrophobicContact CG-CB 4.33Å; G332-D335 WeakPolarHBondContact CA-OD2 3.48Å; G332-D335 PolarHBondContact N-OD2 3.2Å; G332-D335 PolarHBondContact O-N 2.96Å
336	L	44	Very low	48.4	Very low	27 Å²	27	75.9 Å²	75.9	14%	0.141	39%	0.392	C	S	.	.	H	α-helix	trans	-81.4	-38.2	173.6	-72.7	165	0	0	0	112.2	M328 F331 G332 D338 N339 F342	M328-L336 HydrophobicContact CE-CD1 3.83Å; F331-L336 HydrophobicContact CB-CD1 4.45Å; F331-L336 HydrophobicContact CB-CD2 3.58Å; F331-L336 HydrophobicContact CB-CG 3.56Å; F331-L336 HydrophobicContact CD2-CD2 3.8Å; F331-L336 HydrophobicContact CG-CD2 4.02Å; F331-L336 HydrophobicContact CG-CG 4.42Å; G332-L336 PolarHBondContact O-N 3.07Å; G332-L336 VanDerWaalsContact O-N 3.16Å; L336-D338 VanDerWaalsContact C-N 3.33Å; L336-D338 PolarHBondContact O-N 3.37Å; L336-N339 PolarHBondContact O-N 2.94Å; L336-F342 HydrophobicContact CB-CD2 4.03Å; L336-F342 HydrophobicContact CB-CE2 4.15Å; L336-F342 HydrophobicContact CB-CG 4.4Å; L336-F342 HydrophobicContact CD1-CE2 4.31Å; L336-F342 HydrophobicContact CD2-CD2 3.76Å; L336-F342 HydrophobicContact CD2-CE2 3.76Å; L336-F342 HydrophobicContact CG-CD2 4.41Å; L336-F342 HydrophobicContact CG-CE2 4.28Å; L336-F342 VanDerWaalsContact O-CB 3.22Å; L336-F342 WeakPolarHBondContact O-CB 3.48Å
337	E	43.8	Very low	49.4	Very low	147 Å²	147	80.4 Å²	80.4	69%	0.687	42%	0.422	S	S	*	.	H	α-helix	trans	-68.5	-28.4	-173.5	-69.3	177.8	-177.4	0	0	113
338	D	43.4	Very low	51.2	Low	158 Å²	158	81 Å²	81	85%	0.845	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	1.4	175.1	-87.5	-22.5	0	0	0	114	L336	L336-D338 VanDerWaalsContact C-N 3.33Å; L336-D338 PolarHBondContact O-N 3.37Å
339	N	51.5	Low	53.2	Low	30 Å²	30	81.9 Å²	81.9	16%	0.16	43%	0.431	C	S	.	.			trans	-94.9	124.5	-173.5	-170.9	-26.5	0	0	0	112.3	F331 L336 L341 F342	F331-N339 WeakPolarHBondContact CE2-ND2 3.35Å; F331-N339 WeakPolarHBondContact CZ-ND2 3.38Å; L336-N339 PolarHBondContact O-N 2.94Å; N339-L341 PolarHBondContact O-N 3.32Å; N339-L341 WeakPolarHBondContact OD1-CB 3.47Å; N339-L341 PolarHBondContact OD1-N 3.41Å; N339-F342 WeakPolarHBondContact O-CB 3.49Å; N339-F342 PolarHBondContact O-N 2.97Å
340	P	52.6	Low	55.4	Low	95 Å²	95	80.6 Å²	80.6	62%	0.617	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-6.4	-179.5	27.2	-36.3	0	0	0	115.4	F342	P340-F342 VanDerWaalsContact C-N 3.32Å
341	L	56.8	Low	57.7	Low	55 Å²	55	81.2 Å²	81.2	29%	0.288	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-31.4	162.9	-96.7	152.5	0	0	0	112.1	N339 R344 L345 L367	N339-L341 PolarHBondContact O-N 3.32Å; N339-L341 WeakPolarHBondContact OD1-CB 3.47Å; N339-L341 PolarHBondContact OD1-N 3.41Å; L341-R344 PolarHBondContact O-N 3.39Å; L341-L345 WeakPolarHBondContact O-CG 3.33Å; L341-L345 PolarHBondContact O-N 3.42Å; L341-L367 HydrophobicContact CD2-CB 4.49Å; L341-L367 HydrophobicContact CD2-CD1 3.83Å
342	F	55.4	Low	60.2	Low	29 Å²	29	79.9 Å²	79.9	13%	0.127	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-34	-170.1	-137.5	-97.4	0	0	0	113.8	L336 N339 P340 R344 L345 H346 H374	L336-F342 HydrophobicContact CB-CD2 4.03Å; L336-F342 HydrophobicContact CB-CE2 4.15Å; L336-F342 HydrophobicContact CB-CG 4.4Å; L336-F342 HydrophobicContact CD1-CE2 4.31Å; L336-F342 HydrophobicContact CD2-CD2 3.76Å; L336-F342 HydrophobicContact CD2-CE2 3.76Å; L336-F342 HydrophobicContact CG-CD2 4.41Å; L336-F342 HydrophobicContact CG-CE2 4.28Å; L336-F342 VanDerWaalsContact O-CB 3.22Å; L336-F342 WeakPolarHBondContact O-CB 3.48Å; N339-F342 WeakPolarHBondContact O-CB 3.49Å; N339-F342 PolarHBondContact O-N 2.97Å; P340-F342 VanDerWaalsContact C-N 3.32Å; F342-R344 PolarHBondContact O-N 3.3Å; F342-R344 VanDerWaalsContact O-N 3.17Å; F342-L345 HydrophobicContact CD2-CD1 3.51Å; F342-L345 HydrophobicContact CE2-CD1 3.64Å; F342-L345 HydrophobicContact CG-CD1 4.26Å; F342-L345 PolarHBondContact O-N 2.84Å; F342-H346 AromaticContact CD1-NE2 3.89Å; F342-H346 PolarHBondContact O-CD2 3.18Å; F342-H374 AromaticContact CZ-CE1 3.65Å; F342-H374 AromaticContact CZ-ND1 3.74Å
343	E	54.3	Low	62.9	Low	162 Å²	162	78.6 Å²	78.6	76%	0.757	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-31.9	169.2	-69.2	-167.3	127.8	0	0	112.3
344	R	57.7	Low	65.7	Low	160 Å²	160	72.2 Å²	72.2	60%	0.604	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-19.7	176.8	-57	-173.9	-172.8	-172.5	2.6	113.8	L341 F342 S347 V348 L367	L341-R344 PolarHBondContact O-N 3.39Å; F342-R344 PolarHBondContact O-N 3.3Å; F342-R344 VanDerWaalsContact O-N 3.17Å; R344-S347 PolarHBondContact O-OG 3.05Å; R344-V348 WeakPolarHBondContact O-CG2 3.47Å; R344-L367 HydrophobicContact CB-CD1 4.25Å
345	L	62.5	Low	68.5	Low	16 Å²	16	71.1 Å²	71.1	8%	0.084	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-78.5	-23.5	-178.8	-70.3	170.2	0	0	0	112.1	L341 F342 S347 V348 L367 Y371	L341-L345 WeakPolarHBondContact O-CG 3.33Å; L341-L345 PolarHBondContact O-N 3.42Å; F342-L345 HydrophobicContact CD2-CD1 3.51Å; F342-L345 HydrophobicContact CE2-CD1 3.64Å; F342-L345 HydrophobicContact CG-CD1 4.26Å; F342-L345 PolarHBondContact O-N 2.84Å; L345-S347 PolarHBondContact O-N 3.16Å; L345-V348 PolarHBondContact O-N 2.89Å; L345-L367 HydrophobicContact CD2-CD1 3.64Å; L345-L367 HydrophobicContact CG-CD1 4.08Å; L345-Y371 HydrophobicContact CB-CD2 4.4Å; L345-Y371 HydrophobicContact CD2-CD2 3.72Å; L345-Y371 HydrophobicContact CD2-CG 4.12Å
346	H	58.9	Low	71.2	Confident	157 Å²	157	69.1 Å²	69.1	73%	0.727	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-69.2	-10.5	177.9	-74.8	-67	0	0	0	115.5	F342	F342-H346 AromaticContact CD1-NE2 3.89Å; F342-H346 PolarHBondContact O-CD2 3.18Å
347	S	67.1	Low	73.7	Confident	106 Å²	106	68.1 Å²	68.1	74%	0.741	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-112.1	4.8	177	58.6	0	0	0	0	114.3	R344 L345	R344-S347 PolarHBondContact O-OG 3.05Å; L345-S347 PolarHBondContact O-N 3.16Å
348	V	82.7	Confident	76.2	Confident	15 Å²	15	68 Å²	68	9%	0.091	35%	0.348	C	S	.	.			trans	-100.7	143	-179.2	173.9	0	0	0	0	109.8	R344 L345 T352 A353 Y356 Y371	R344-V348 WeakPolarHBondContact O-CG2 3.47Å; L345-V348 PolarHBondContact O-N 2.89Å; V348-T352 HydrophobicContact CG1-CG2 4.27Å; V348-A353 HydrophobicContact CG1-CB 3.83Å; V348-Y356 HydrophobicContact CG2-CE2 4.1Å; V348-Y371 HydrophobicContact CB-CD2 3.72Å; V348-Y371 HydrophobicContact CB-CE2 3.8Å; V348-Y371 HydrophobicContact CB-CG 4.43Å; V348-Y371 HydrophobicContact CG1-CD1 4.26Å; V348-Y371 HydrophobicContact CG1-CD2 3.59Å; V348-Y371 HydrophobicContact CG1-CE1 4.49Å; V348-Y371 HydrophobicContact CG1-CE2 3.86Å; V348-Y371 HydrophobicContact CG1-CG 3.81Å; V348-Y371 WeakPolarHBondContact O-CE2 3.39Å; V348-Y371 PolarHBondContact O-OH 2.6Å
349	D	91.4	Very high	78.6	Confident	78 Å²	78	64.1 Å²	64.1	42%	0.417	33%	0.325	S	S	.	.			trans	-110.8	169.4	168	68.4	1.7	0	0	0	111.3	T352 A353 Y371	D349-T352 PolarHBondContact O-N 3.34Å; D349-T352 WeakPolarHBondContact OD1-CA 3.01Å; D349-T352 WeakPolarHBondContact OD1-CB 3.43Å; D349-T352 PolarHBondContact OD1-N 3.22Å; D349-T352 PolarHBondContact OD1-OG1 2.87Å; D349-A353 WeakPolarHBondContact O-CB 3.38Å; D349-A353 PolarHBondContact O-N 3.43Å; D349-Y371 WeakPolarHBondContact CA-OH 3.27Å
350	V	94.6	Very high	80.6	Confident	8 Å²	8	71.7 Å²	71.7	5%	0.048	36%	0.36	C	S	.	.	H	α-helix	trans	-57.4	-45.9	180	171.4	0	0	0	0	112.2	T352 A353 V354 Y371 I375 A382 E385 V386 L389	V350-T352 PolarHBondContact O-N 3.2Å; V350-A353 PolarHBondContact O-N 3.34Å; V350-V354 HydrophobicContact CG1-CG2 4.46Å; V350-V354 WeakPolarHBondContact O-CG2 3.42Å; V350-V354 PolarHBondContact O-N 3Å; V350-Y371 HydrophobicContact CG2-CE1 3.87Å; V350-I375 HydrophobicContact CG2-CG1 4.33Å; V350-I375 HydrophobicContact CG2-CG2 4.08Å; V350-A382 HydrophobicContact CG2-CB 4.16Å; V350-E385 HydrophobicContact CB-CG 4.33Å; V350-E385 HydrophobicContact CG1-CB 4.16Å; V350-E385 HydrophobicContact CG1-CG 3.72Å; V350-V386 HydrophobicContact CG1-CG2 3.53Å; V350-L389 HydrophobicContact CG1-CD1 3.85Å
351	P	96.5	Very high	82.6	Confident	54 Å²	54	71.3 Å²	71.3	35%	0.351	35%	0.353	S	S	.	.	H	α-helix	trans	-54.5	-46.1	171.8	-28.7	36	0	0	0	114.4	V354 S355 L389	P351-V354 PolarHBondContact O-N 3.48Å; P351-S355 PolarHBondContact O-N 3.36Å; P351-L389 HydrophobicContact CB-CD1 4.45Å; P351-L389 HydrophobicContact CG-CD1 4.17Å
352	T	95.1	Very high	84.5	Confident	45 Å²	45	71.5 Å²	71.5	28%	0.276	36%	0.356	S	S	.	.	H	α-helix	trans	-66.1	-44.3	179.5	-60.3	0	0	0	0	111	V348 D349 V350 V354 S355 Y356	V348-T352 HydrophobicContact CG1-CG2 4.27Å; D349-T352 PolarHBondContact O-N 3.34Å; D349-T352 WeakPolarHBondContact OD1-CA 3.01Å; D349-T352 WeakPolarHBondContact OD1-CB 3.43Å; D349-T352 PolarHBondContact OD1-N 3.22Å; D349-T352 PolarHBondContact OD1-OG1 2.87Å; V350-T352 PolarHBondContact O-N 3.2Å; T352-V354 PolarHBondContact O-N 3.45Å; T352-S355 WeakPolarHBondContact O-CA 3.39Å; T352-S355 WeakPolarHBondContact O-CB 3.16Å; T352-S355 PolarHBondContact O-N 3.5Å; T352-S355 VanDerWaalsContact O-N 3.08Å; T352-S355 PolarHBondContact O-OG 3Å; T352-Y356 HydrophobicContact CG2-CD1 4.27Å; T352-Y356 HydrophobicContact CG2-CE1 3.58Å; T352-Y356 HydrophobicContact CG2-CE2 3.97Å; T352-Y356 VanDerWaalsContact CG2-CZ 3.41Å; T352-Y356 WeakPolarHBondContact CG2-OH 3.38Å; T352-Y356 WeakPolarHBondContact O-CD1 3.47Å; T352-Y356 PolarHBondContact O-N 3.47Å
353	A	95.8	Very high	86.3	Confident	0 Å²	0	72 Å²	72	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-60.7	-42.3	176.4	0	0	0	0	0	112.5	V348 D349 V350 S355 Y356 L357 Y371 I372	V348-A353 HydrophobicContact CG1-CB 3.83Å; D349-A353 WeakPolarHBondContact O-CB 3.38Å; D349-A353 PolarHBondContact O-N 3.43Å; V350-A353 PolarHBondContact O-N 3.34Å; A353-S355 VanDerWaalsContact C-N 3.31Å; A353-S355 PolarHBondContact O-N 3.31Å; A353-Y356 PolarHBondContact O-N 3.31Å; A353-L357 PolarHBondContact O-N 3.14Å; A353-Y371 HydrophobicContact CB-CD1 3.41Å; A353-Y371 VanDerWaalsContact CB-CD1 3.41Å; A353-Y371 HydrophobicContact CB-CE1 4.21Å; A353-Y371 HydrophobicContact CB-CG 3.8Å; A353-I372 HydrophobicContact CB-CD1 4.29Å; A353-I372 HydrophobicContact CB-CG1 4.02Å
354	V	97.2	Very high	88.2	Confident	4 Å²	4	67.3 Å²	67.3	2%	0.024	35%	0.349	C	S	.	.	H	α-helix	trans	-68.2	-31	174.6	175.6	0	0	0	0	111.6	V350 P351 T352 L357 I372 V386 L389 L394	V350-V354 HydrophobicContact CG1-CG2 4.46Å; V350-V354 WeakPolarHBondContact O-CG2 3.42Å; V350-V354 PolarHBondContact O-N 3Å; P351-V354 PolarHBondContact O-N 3.48Å; T352-V354 PolarHBondContact O-N 3.45Å; V354-L357 PolarHBondContact O-N 2.87Å; V354-I372 HydrophobicContact CG2-CD1 3.87Å; V354-V386 HydrophobicContact CG2-CG1 4.25Å; V354-V386 HydrophobicContact CG2-CG2 4.32Å; V354-L389 HydrophobicContact CB-CB 4.34Å; V354-L389 HydrophobicContact CG1-CB 3.9Å; V354-L389 HydrophobicContact CG2-CB 4.29Å; V354-L389 HydrophobicContact CG2-CD1 4.29Å; V354-L394 HydrophobicContact CG1-CD1 3.95Å
355	S	96.8	Very high	90	Very high	51 Å²	51	60.7 Å²	60.7	36%	0.357	32%	0.324	S	S	.	.	H	α-helix	trans	-65.5	-38.5	172.1	86.8	0	0	0	0	112.2	P351 T352 A353 L357 R358	P351-S355 PolarHBondContact O-N 3.36Å; T352-S355 WeakPolarHBondContact O-CA 3.39Å; T352-S355 WeakPolarHBondContact O-CB 3.16Å; T352-S355 PolarHBondContact O-N 3.5Å; T352-S355 VanDerWaalsContact O-N 3.08Å; T352-S355 PolarHBondContact O-OG 3Å; A353-S355 VanDerWaalsContact C-N 3.31Å; A353-S355 PolarHBondContact O-N 3.31Å; S355-L357 VanDerWaalsContact C-N 3.29Å; S355-L357 PolarHBondContact O-N 3.22Å; S355-R358 WeakPolarHBondContact O-CB 3.21Å; S355-R358 PolarHBondContact O-N 2.84Å
356	Y	96.9	Very high	91.6	Very high	54 Å²	54	60.3 Å²	60.3	21%	0.212	32%	0.323	C	S	.	.	H	α-helix	trans	-65.4	-31.6	179.3	-65.5	-11.9	0	0	0	112.6	V348 T352 A353 R358 M359 M364 L367	V348-Y356 HydrophobicContact CG2-CE2 4.1Å; T352-Y356 HydrophobicContact CG2-CD1 4.27Å; T352-Y356 HydrophobicContact CG2-CE1 3.58Å; T352-Y356 HydrophobicContact CG2-CE2 3.97Å; T352-Y356 VanDerWaalsContact CG2-CZ 3.41Å; T352-Y356 WeakPolarHBondContact CG2-OH 3.38Å; T352-Y356 WeakPolarHBondContact O-CD1 3.47Å; T352-Y356 PolarHBondContact O-N 3.47Å; A353-Y356 PolarHBondContact O-N 3.31Å; Y356-R358 PolarHBondContact O-N 3.19Å; Y356-R358 VanDerWaalsContact O-N 3.16Å; Y356-M359 HydrophobicContact CD1-CE 3.67Å; Y356-M359 HydrophobicContact CE1-CE 4.27Å; Y356-M359 HydrophobicContact CG-CE 4.26Å; Y356-M359 PolarHBondContact O-N 3.48Å; Y356-M364 WeakPolarHBondContact CB-O 2.95Å; Y356-M364 HydrophobicContact CD2-SD 4.38Å; Y356-M364 HydrophobicContact CE1-SD 4.49Å; Y356-M364 HydrophobicContact CE2-SD 4.32Å; Y356-M364 HydrophobicContact CG-SD 4.5Å; Y356-L367 HydrophobicContact CD2-CD2 4.03Å; Y356-L367 HydrophobicContact CD2-CG 4.22Å; Y356-L367 HydrophobicContact CE2-CD2 3.64Å; Y356-L367 HydrophobicContact CE2-CG 4.2Å
357	L	97	Very high	93.2	Very high	6 Å²	6	53.4 Å²	53.4	3%	0.031	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-18	172.7	-56.3	-172	0	0	0	113.8	A353 V354 S355 S369 I372 L394 L395 L398	A353-L357 PolarHBondContact O-N 3.14Å; V354-L357 PolarHBondContact O-N 2.87Å; S355-L357 VanDerWaalsContact C-N 3.29Å; S355-L357 PolarHBondContact O-N 3.22Å; L357-S369 VanDerWaalsContact CD2-OG 3.28Å; L357-S369 WeakPolarHBondContact CD2-OG 3.19Å; L357-I372 HydrophobicContact CD1-CD1 3.66Å; L357-I372 HydrophobicContact CD2-CD1 4.42Å; L357-I372 HydrophobicContact CG-CD1 4.11Å; L357-L394 HydrophobicContact CB-CB 4Å; L357-L394 HydrophobicContact CB-CD1 3.95Å; L357-L394 HydrophobicContact CD1-CB 4.03Å; L357-L394 HydrophobicContact CD1-CD1 4.44Å; L357-L395 HydrophobicContact CD1-CD2 3.7Å; L357-L395 HydrophobicContact CD1-CG 3.78Å; L357-L395 HydrophobicContact CD2-CD2 4.26Å; L357-L398 HydrophobicContact CB-CD1 4.15Å; L357-L398 HydrophobicContact CD2-CD1 3.82Å; L357-L398 HydrophobicContact CG-CD1 4.44Å
358	R	95.8	Very high	94.6	Very high	146 Å²	146	48.3 Å²	48.3	55%	0.551	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-10.3	179.7	-56.2	179.3	180	-90.9	-1.9	113.2	S355 Y356 L389 L394	S355-R358 WeakPolarHBondContact O-CB 3.21Å; S355-R358 PolarHBondContact O-N 2.84Å; Y356-R358 PolarHBondContact O-N 3.19Å; Y356-R358 VanDerWaalsContact O-N 3.16Å; R358-L389 PolarHBondContact NH2-O 3.01Å; R358-L394 HydrophobicContact CG-CD1 3.55Å; R358-L394 HydrophobicContact CG-CD2 3.95Å; R358-L394 HydrophobicContact CG-CG 4.42Å
359	M	94.6	Very high	95.3	Very high	75 Å²	75	47.6 Å²	47.6	37%	0.369	25%	0.252	S	S	.	.	S	Bend	trans	-86.1	151.7	-178.7	-55.2	-160.5	-56.8	0	0	110.5	Y356 D361 M364 Q365	Y356-M359 HydrophobicContact CD1-CE 3.67Å; Y356-M359 HydrophobicContact CE1-CE 4.27Å; Y356-M359 HydrophobicContact CG-CE 4.26Å; Y356-M359 PolarHBondContact O-N 3.48Å; M359-D361 VanDerWaalsContact C-N 3.29Å; M359-D361 PolarHBondContact O-N 3.4Å; M359-M364 HydrophobicContact CE-CB 3.41Å; M359-M364 VanDerWaalsContact CE-CB 3.41Å; M359-M364 HydrophobicContact CE-CG 3.43Å; M359-M364 VanDerWaalsContact CE-CG 3.43Å; M359-M364 HydrophobicContact CE-SD 3.94Å; M359-Q365 WeakPolarHBondContact O-CG 3.39Å; M359-Q365 PolarHBondContact O-NE2 2.95Å
360	E	93.1	Very high	95.4	Very high	189 Å²	189	44.6 Å²	44.6	88%	0.883	24%	0.237	S	C	*	.	S	Bend	trans	-75.5	-17.4	-179.7	-62.6	-175.4	164.2	0	0	113.3	T362	E360-T362 PolarHBondContact O-N 2.96Å
361	D	95	Very high	95.4	Very high	87 Å²	87	45.7 Å²	45.7	47%	0.465	24%	0.241	S	C	.	.			trans	-70.5	121.3	179	-178.9	78.7	0	0	0	112.2	M359 G363 M364 Q365	M359-D361 VanDerWaalsContact C-N 3.29Å; M359-D361 PolarHBondContact O-N 3.4Å; D361-G363 VanDerWaalsContact C-N 3.34Å; D361-G363 PolarHBondContact O-N 3.01Å; D361-G363 WeakPolarHBondContact OD2-CA 3.29Å; D361-G363 PolarHBondContact OD2-N 3.24Å; D361-G363 VanDerWaalsContact OD2-N 3.1Å; D361-M364 HydrophobicContact CB-CB 4.25Å; D361-M364 HydrophobicContact CB-CG 4.23Å; D361-M364 PolarHBondContact O-N 2.98Å; D361-M364 VanDerWaalsContact OD2-CG 3.29Å; D361-M364 WeakPolarHBondContact OD2-CG 3.38Å; D361-M364 PolarHBondContact OD2-N 3.37Å; D361-Q365 WeakPolarHBondContact O-CG 3.38Å; D361-Q365 PolarHBondContact O-N 3.36Å
362	T	95.3	Very high	95.4	Very high	60 Å²	60	43.1 Å²	43.1	37%	0.368	22%	0.224	S	C	.	.	H	α-helix	trans	-67.6	-33	-176.9	54.3	0	0	0	0	112.7	E360 M364 Q365 V366 D403 V406	E360-T362 PolarHBondContact O-N 2.96Å; T362-M364 VanDerWaalsContact C-N 3.34Å; T362-M364 PolarHBondContact O-N 3.34Å; T362-Q365 PolarHBondContact O-N 3.22Å; T362-V366 WeakPolarHBondContact O-CB 3.4Å; T362-V366 WeakPolarHBondContact O-CG2 3.49Å; T362-V366 PolarHBondContact O-N 3.13Å; T362-D403 HydrophobicContact CG2-CB 3.92Å; T362-V406 HydrophobicContact CG2-CG2 4.06Å
363	G	93.2	Very high	95.4	Very high	40 Å²	40	41.7 Å²	41.7	41%	0.412	21%	0.214	S	C	.	.	H	α-helix	trans	-64.5	-38.9	176.7	0	0	0	0	0	112.4	D361 L367	D361-G363 VanDerWaalsContact C-N 3.34Å; D361-G363 PolarHBondContact O-N 3.01Å; D361-G363 WeakPolarHBondContact OD2-CA 3.29Å; D361-G363 PolarHBondContact OD2-N 3.24Å; D361-G363 VanDerWaalsContact OD2-N 3.1Å; G363-L367 WeakPolarHBondContact O-CB 3.09Å; G363-L367 PolarHBondContact O-N 3.21Å
364	M	94.4	Very high	95.3	Very high	63 Å²	63	44.7 Å²	44.7	31%	0.31	23%	0.228	S	C	.	.	H	α-helix	trans	-72.8	-40.3	174.2	-67	-72.8	179	0	0	112.1	Y356 M359 D361 T362 V366 L367 G368	Y356-M364 WeakPolarHBondContact CB-O 2.95Å; Y356-M364 HydrophobicContact CD2-SD 4.38Å; Y356-M364 HydrophobicContact CE1-SD 4.49Å; Y356-M364 HydrophobicContact CE2-SD 4.32Å; Y356-M364 HydrophobicContact CG-SD 4.5Å; M359-M364 HydrophobicContact CE-CB 3.41Å; M359-M364 VanDerWaalsContact CE-CB 3.41Å; M359-M364 HydrophobicContact CE-CG 3.43Å; M359-M364 VanDerWaalsContact CE-CG 3.43Å; M359-M364 HydrophobicContact CE-SD 3.94Å; D361-M364 HydrophobicContact CB-CB 4.25Å; D361-M364 HydrophobicContact CB-CG 4.23Å; D361-M364 PolarHBondContact O-N 2.98Å; D361-M364 VanDerWaalsContact OD2-CG 3.29Å; D361-M364 WeakPolarHBondContact OD2-CG 3.38Å; D361-M364 PolarHBondContact OD2-N 3.37Å; T362-M364 VanDerWaalsContact C-N 3.34Å; T362-M364 PolarHBondContact O-N 3.34Å; M364-V366 VanDerWaalsContact C-N 3.29Å; M364-V366 PolarHBondContact O-N 2.96Å; M364-L367 PolarHBondContact O-N 2.93Å; M364-L367 HydrophobicContact SD-CD2 4.17Å; M364-G368 PolarHBondContact O-N 3.27Å
365	Q	96.7	Very high	95.1	Very high	20 Å²	20	45.4 Å²	45.4	9%	0.093	23%	0.232	C	C	.	.	H	α-helix	trans	-58.5	-40.8	171.7	-71	171.6	5.4	0	0	111.8	M359 D361 T362 S369 L398 V406	M359-Q365 WeakPolarHBondContact O-CG 3.39Å; M359-Q365 PolarHBondContact O-NE2 2.95Å; D361-Q365 WeakPolarHBondContact O-CG 3.38Å; D361-Q365 PolarHBondContact O-N 3.36Å; T362-Q365 PolarHBondContact O-N 3.22Å; Q365-S369 VanDerWaalsContact O-CB 3.23Å; Q365-S369 WeakPolarHBondContact O-CB 3.38Å; Q365-S369 PolarHBondContact O-N 2.8Å; Q365-S369 PolarHBondContact O-OG 3.08Å; Q365-L398 HydrophobicContact CB-CD1 4.38Å; Q365-L398 HydrophobicContact CG-CD1 4.44Å; Q365-L398 HydrophobicContact CG-CD2 4.11Å; Q365-V406 HydrophobicContact CB-CG1 4.28Å; Q365-V406 HydrophobicContact CB-CG2 3.98Å
366	V	95.3	Very high	95	Very high	9 Å²	9	43 Å²	43	6%	0.055	22%	0.215	C	C	.	.	H	α-helix	trans	-63.9	-50.5	172.6	162.9	0	0	0	0	111.1	T362 M364 G368 S369 A370 E405 V406 F409	T362-V366 WeakPolarHBondContact O-CB 3.4Å; T362-V366 WeakPolarHBondContact O-CG2 3.49Å; T362-V366 PolarHBondContact O-N 3.13Å; M364-V366 VanDerWaalsContact C-N 3.29Å; M364-V366 PolarHBondContact O-N 2.96Å; V366-G368 PolarHBondContact O-N 3.5Å; V366-S369 PolarHBondContact O-N 3.5Å; V366-A370 VanDerWaalsContact O-CB 3.3Å; V366-A370 WeakPolarHBondContact O-CB 3.42Å; V366-A370 PolarHBondContact O-N 3.31Å; V366-E405 HydrophobicContact CG2-CB 3.83Å; V366-V406 HydrophobicContact CG2-CG2 3.9Å; V366-F409 HydrophobicContact CB-CD2 4.35Å; V366-F409 HydrophobicContact CG1-CD2 3.62Å; V366-F409 HydrophobicContact CG1-CE2 3.65Å; V366-F409 HydrophobicContact CG1-CG 4.15Å; V366-F409 HydrophobicContact CG1-CZ 4.2Å; V366-F409 HydrophobicContact CG2-CD2 4.06Å
367	L	93.4	Very high	94.7	Very high	11 Å²	11	44.4 Å²	44.4	6%	0.058	22%	0.222	C	C	.	.	H	α-helix	trans	-58.2	-47.2	179.5	178.2	65.5	0	0	0	112.2	L341 R344 L345 Y356 G363 M364 A370 Y371	L341-L367 HydrophobicContact CD2-CB 4.49Å; L341-L367 HydrophobicContact CD2-CD1 3.83Å; R344-L367 HydrophobicContact CB-CD1 4.25Å; L345-L367 HydrophobicContact CD2-CD1 3.64Å; L345-L367 HydrophobicContact CG-CD1 4.08Å; Y356-L367 HydrophobicContact CD2-CD2 4.03Å; Y356-L367 HydrophobicContact CD2-CG 4.22Å; Y356-L367 HydrophobicContact CE2-CD2 3.64Å; Y356-L367 HydrophobicContact CE2-CG 4.2Å; G363-L367 WeakPolarHBondContact O-CB 3.09Å; G363-L367 PolarHBondContact O-N 3.21Å; M364-L367 PolarHBondContact O-N 2.93Å; M364-L367 HydrophobicContact SD-CD2 4.17Å; L367-A370 PolarHBondContact O-N 2.91Å; L367-Y371 PolarHBondContact O-N 3.42Å
368	G	95.6	Very high	94.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64	-41.4	176.6	0	0	0	0	0	112.5	M364 V366 Y371 I372	M364-G368 PolarHBondContact O-N 3.27Å; V366-G368 PolarHBondContact O-N 3.5Å; G368-Y371 PolarHBondContact O-N 2.91Å; G368-I372 WeakPolarHBondContact O-CB 3.34Å; G368-I372 WeakPolarHBondContact O-CD1 3.38Å; G368-I372 VanDerWaalsContact O-CG1 3.26Å; G368-I372 WeakPolarHBondContact O-CG1 3.46Å; G368-I372 PolarHBondContact O-N 2.8Å
369	S	96.9	Very high	94.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.2	-42.5	176.3	-62.5	0	0	0	0	112.1	L357 Q365 V366 I372 Q373 A413	L357-S369 VanDerWaalsContact CD2-OG 3.28Å; L357-S369 WeakPolarHBondContact CD2-OG 3.19Å; Q365-S369 VanDerWaalsContact O-CB 3.23Å; Q365-S369 WeakPolarHBondContact O-CB 3.38Å; Q365-S369 PolarHBondContact O-N 2.8Å; Q365-S369 PolarHBondContact O-OG 3.08Å; V366-S369 PolarHBondContact O-N 3.5Å; S369-I372 PolarHBondContact O-N 3.2Å; S369-Q373 WeakPolarHBondContact O-CB 3.46Å; S369-Q373 PolarHBondContact O-N 3.09Å; S369-A413 WeakPolarHBondContact O-CB 3.34Å
370	A	94.9	Very high	94	Very high	14 Å²	14	47 Å²	47	12%	0.116	24%	0.242	C	C	.	.	H	α-helix	trans	-62.3	-43.1	176.4	0	0	0	0	0	111.8	V366 L367 Q373 H374 F409	V366-A370 VanDerWaalsContact O-CB 3.3Å; V366-A370 WeakPolarHBondContact O-CB 3.42Å; V366-A370 PolarHBondContact O-N 3.31Å; L367-A370 PolarHBondContact O-N 2.91Å; A370-Q373 PolarHBondContact O-N 2.55Å; A370-H374 PolarHBondContact O-N 2.97Å; A370-F409 HydrophobicContact CB-CD1 3.67Å; A370-F409 HydrophobicContact CB-CE1 3.73Å
371	Y	94.9	Very high	94.1	Very high	31 Å²	31	48 Å²	48	12%	0.122	24%	0.238	C	C	.	.	H	α-helix	trans	-57.4	-52.9	172.5	-173.2	-87.1	0	0	0	111.2	L345 V348 D349 V350 A353 L367 G368 Q373 H374 I375	L345-Y371 HydrophobicContact CB-CD2 4.4Å; L345-Y371 HydrophobicContact CD2-CD2 3.72Å; L345-Y371 HydrophobicContact CD2-CG 4.12Å; V348-Y371 HydrophobicContact CB-CD2 3.72Å; V348-Y371 HydrophobicContact CB-CE2 3.8Å; V348-Y371 HydrophobicContact CB-CG 4.43Å; V348-Y371 HydrophobicContact CG1-CD1 4.26Å; V348-Y371 HydrophobicContact CG1-CD2 3.59Å; V348-Y371 HydrophobicContact CG1-CE1 4.49Å; V348-Y371 HydrophobicContact CG1-CE2 3.86Å; V348-Y371 HydrophobicContact CG1-CG 3.81Å; V348-Y371 WeakPolarHBondContact O-CE2 3.39Å; V348-Y371 PolarHBondContact O-OH 2.6Å; D349-Y371 WeakPolarHBondContact CA-OH 3.27Å; V350-Y371 HydrophobicContact CG2-CE1 3.87Å; A353-Y371 HydrophobicContact CB-CD1 3.41Å; A353-Y371 VanDerWaalsContact CB-CD1 3.41Å; A353-Y371 HydrophobicContact CB-CE1 4.21Å; A353-Y371 HydrophobicContact CB-CG 3.8Å; L367-Y371 PolarHBondContact O-N 3.42Å; G368-Y371 PolarHBondContact O-N 2.91Å; Y371-Q373 VanDerWaalsContact C-N 3.29Å; Y371-Q373 PolarHBondContact O-N 3.42Å; Y371-H374 PolarHBondContact O-N 2.67Å; Y371-H374 VanDerWaalsContact O-N 3.14Å; Y371-I375 HydrophobicContact CD1-CB 4.46Å; Y371-I375 HydrophobicContact CD1-CG2 4Å; Y371-I375 HydrophobicContact CE1-CB 4.06Å; Y371-I375 HydrophobicContact CE1-CG1 4.42Å; Y371-I375 HydrophobicContact CE1-CG2 3.83Å; Y371-I375 WeakPolarHBondContact O-CG2 3.43Å; Y371-I375 PolarHBondContact O-N 3.48Å
372	I	96.3	Very high	94.1	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.3	-40.3	-178.6	-69.9	164.7	0	0	0	110.8	A353 V354 L357 G368 S369 H374 C376 V386 L395 A413	A353-I372 HydrophobicContact CB-CD1 4.29Å; A353-I372 HydrophobicContact CB-CG1 4.02Å; V354-I372 HydrophobicContact CG2-CD1 3.87Å; L357-I372 HydrophobicContact CD1-CD1 3.66Å; L357-I372 HydrophobicContact CD2-CD1 4.42Å; L357-I372 HydrophobicContact CG-CD1 4.11Å; G368-I372 WeakPolarHBondContact O-CB 3.34Å; G368-I372 WeakPolarHBondContact O-CD1 3.38Å; G368-I372 VanDerWaalsContact O-CG1 3.26Å; G368-I372 WeakPolarHBondContact O-CG1 3.46Å; G368-I372 PolarHBondContact O-N 2.8Å; S369-I372 PolarHBondContact O-N 3.2Å; I372-H374 PolarHBondContact O-N 3.44Å; I372-C376 WeakPolarHBondContact O-CB 3.29Å; I372-C376 PolarHBondContact O-N 2.67Å; I372-C376 PolarHBondContact O-SG 3.49Å; I372-V386 HydrophobicContact CD1-CG1 4.35Å; I372-V386 HydrophobicContact CG1-CG2 4.13Å; I372-V386 HydrophobicContact CG2-CG1 3.95Å; I372-V386 HydrophobicContact CG2-CG2 4.06Å; I372-L395 HydrophobicContact CG2-CD1 4.34Å; I372-A413 HydrophobicContact CB-CB 4.27Å; I372-A413 HydrophobicContact CG2-CB 3.96Å
373	Q	95.2	Very high	94.2	Very high	15 Å²	15	41.3 Å²	41.3	7%	0.07	20%	0.2	C	C	.	.	H	α-helix	trans	-62	-41.5	176	-175.1	172.7	-8.1	0	0	113.1	I330 S369 A370 Y371 F377 G412 A413 N416	I330-Q373 VanDerWaalsContact CD1-OE1 3.22Å; S369-Q373 WeakPolarHBondContact O-CB 3.46Å; S369-Q373 PolarHBondContact O-N 3.09Å; A370-Q373 PolarHBondContact O-N 2.55Å; Y371-Q373 VanDerWaalsContact C-N 3.29Å; Y371-Q373 PolarHBondContact O-N 3.42Å; Q373-F377 PolarHBondContact O-N 3.27Å; Q373-G412 VanDerWaalsContact CD-C 3.47Å; Q373-A413 HydrophobicContact CB-CB 4.13Å; Q373-N416 WeakPolarHBondContact CG-ND2 3.19Å; Q373-N416 PolarHBondContact O-ND2 3.16Å
374	H	92.3	Very high	94.4	Very high	63 Å²	63	41.6 Å²	41.6	29%	0.292	19%	0.192	S	C	.	.	H	α-helix	trans	-71.1	-51.8	178.5	177.4	81.4	0	0	0	111.7	F342 A370 Y371 I372 C376 F377 N378	F342-H374 AromaticContact CZ-CE1 3.65Å; F342-H374 AromaticContact CZ-ND1 3.74Å; A370-H374 PolarHBondContact O-N 2.97Å; Y371-H374 PolarHBondContact O-N 2.67Å; Y371-H374 VanDerWaalsContact O-N 3.14Å; I372-H374 PolarHBondContact O-N 3.44Å; H374-C376 PolarHBondContact O-N 2.92Å; H374-F377 WeakPolarHBondContact O-CB 3.36Å; H374-F377 PolarHBondContact O-N 2.98Å; H374-F377 VanDerWaalsContact O-N 3.08Å; H374-N378 PolarHBondContact CE1-ND2 2.76Å; H374-N378 PolarHBondContact NE2-ND2 3.13Å; H374-N378 VanDerWaalsContact NE2-ND2 3.14Å; H374-N378 PolarHBondContact O-N 2.92Å; H374-N378 PolarHBondContact O-ND2 2.88Å
375	I	93.4	Very high	94.5	Very high	20 Å²	20	42.3 Å²	42.3	10%	0.103	20%	0.195	C	C	.	.	H	α-helix	trans	-67.3	-37.3	-176.7	-160.5	68.7	0	0	0	111.5	V350 Y371 F377 N378 E379 A382	V350-I375 HydrophobicContact CG2-CG1 4.33Å; V350-I375 HydrophobicContact CG2-CG2 4.08Å; Y371-I375 HydrophobicContact CD1-CB 4.46Å; Y371-I375 HydrophobicContact CD1-CG2 4Å; Y371-I375 HydrophobicContact CE1-CB 4.06Å; Y371-I375 HydrophobicContact CE1-CG1 4.42Å; Y371-I375 HydrophobicContact CE1-CG2 3.83Å; Y371-I375 WeakPolarHBondContact O-CG2 3.43Å; Y371-I375 PolarHBondContact O-N 3.48Å; I375-F377 PolarHBondContact O-N 2.73Å; I375-N378 PolarHBondContact O-N 3.05Å; I375-E379 HydrophobicContact CD1-CG 4.25Å; I375-E379 PolarHBondContact O-N 3.26Å; I375-A382 HydrophobicContact CB-CB 4.3Å; I375-A382 HydrophobicContact CG1-CB 3.62Å; I375-A382 HydrophobicContact CG2-CB 3.93Å
376	C	94.9	Very high	94.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-71.5	-12.8	173.7	-67.3	0	0	0	0	113.9	I372 H374 K383 N416	I372-C376 WeakPolarHBondContact O-CB 3.29Å; I372-C376 PolarHBondContact O-N 2.67Å; I372-C376 PolarHBondContact O-SG 3.49Å; H374-C376 PolarHBondContact O-N 2.92Å; C376-K383 HydrophobicContact CB-CG 3.85Å; C376-K383 WeakPolarHBondContact O-CE 3.43Å; C376-N416 HydrophobicContact CB-CB 4.12Å
377	F	91.1	Very high	94.7	Very high	83 Å²	83	43.3 Å²	43.3	36%	0.364	20%	0.197	S	C	.	.	H	α-helix	trans	-78.1	-43.5	169.6	177.5	-101.8	0	0	0	111	G326 M328 Q373 H374 I375	G326-F377 VanDerWaalsContact O-CE2 3.31Å; G326-F377 WeakPolarHBondContact O-CE2 3.28Å; M328-F377 HydrophobicContact SD-CD1 4.23Å; M328-F377 HydrophobicContact SD-CE1 3.99Å; M328-F377 HydrophobicContact SD-CZ 4.24Å; Q373-F377 PolarHBondContact O-N 3.27Å; H374-F377 WeakPolarHBondContact O-CB 3.36Å; H374-F377 PolarHBondContact O-N 2.98Å; H374-F377 VanDerWaalsContact O-N 3.08Å; I375-F377 PolarHBondContact O-N 2.73Å
378	N	88.9	Confident	94.9	Very high	92 Å²	92	48.9 Å²	48.9	49%	0.492	22%	0.222	S	C	.	.	H	α-helix	trans	-84.4	-36.9	-174.5	-67.8	-43.9	0	0	0	113.7	H374 I375	H374-N378 PolarHBondContact CE1-ND2 2.76Å; H374-N378 PolarHBondContact NE2-ND2 3.13Å; H374-N378 VanDerWaalsContact NE2-ND2 3.14Å; H374-N378 PolarHBondContact O-N 2.92Å; H374-N378 PolarHBondContact O-ND2 2.88Å; I375-N378 PolarHBondContact O-N 3.05Å
379	E	91.6	Very high	95	Very high	102 Å²	102	51.7 Å²	51.7	48%	0.477	24%	0.237	S	C	.	.			trans	-123.3	125.3	-169.2	-62.8	-163.6	-152.9	0	0	112.7	I375 A382	I375-E379 HydrophobicContact CD1-CG 4.25Å; I375-E379 PolarHBondContact O-N 3.26Å; E379-A382 HydrophobicContact CB-CB 4.04Å
380	E	92.1	Very high	95	Very high	88 Å²	88	57 Å²	57	41%	0.411	26%	0.262	S	S	.	.	H	α-helix	trans	-69.5	-37.3	176.2	-157.8	69	-140.1	0	0	111.5	A382 K383	E380-A382 PolarHBondContact O-N 2.85Å; E380-K383 VanDerWaalsContact O-CB 3.28Å; E380-K383 WeakPolarHBondContact O-CB 3.48Å; E380-K383 PolarHBondContact O-N 3.41Å; E380-K383 WeakPolarHBondContact OE1-CD 3.39Å; E380-K383 IonicContact OE1-NZ 3.41Å; E380-K383 PolarHBondContact OE1-NZ 3.06Å; E380-K383 IonicContact OE2-NZ 3.06Å; E380-K383 PolarHBondContact OE2-NZ 3.31Å
381	R	95.2	Very high	95.1	Very high	210 Å²	210	56.3 Å²	56.3	79%	0.792	26%	0.256	S	S	*	.	H	α-helix	trans	-63	-40.1	179.9	-72.1	-178.2	177.3	166.2	-1.5	112.9	K383 D384 E385	R381-K383 PolarHBondContact O-N 2.92Å; R381-D384 WeakPolarHBondContact O-CB 3.32Å; R381-D384 PolarHBondContact O-N 3.09Å; R381-E385 PolarHBondContact O-N 2.94Å
382	A	95.1	Very high	95.3	Very high	2 Å²	2	54.9 Å²	54.9	2%	0.017	25%	0.251	C	S	.	.	H	α-helix	trans	-61.2	-28.9	178.3	0	0	0	0	0	112.1	V350 I375 E379 E380 D384 E385 V386	V350-A382 HydrophobicContact CG2-CB 4.16Å; I375-A382 HydrophobicContact CB-CB 4.3Å; I375-A382 HydrophobicContact CG1-CB 3.62Å; I375-A382 HydrophobicContact CG2-CB 3.93Å; E379-A382 HydrophobicContact CB-CB 4.04Å; E380-A382 PolarHBondContact O-N 2.85Å; A382-D384 VanDerWaalsContact C-N 3.34Å; A382-E385 PolarHBondContact O-N 3.17Å; A382-V386 WeakPolarHBondContact O-CB 3.46Å; A382-V386 WeakPolarHBondContact O-CG2 3.42Å; A382-V386 PolarHBondContact O-N 3.48Å
383	K	96.9	Very high	95.3	Very high	4 Å²	4	59 Å²	59	2%	0.017	27%	0.27	C	S	.	.	H	α-helix	trans	-65.5	-38.2	173.5	-53.7	174.1	-175.5	169.2	0	112.1	C376 E380 R381 R387 Y419 N421 N424	C376-K383 HydrophobicContact CB-CG 3.85Å; C376-K383 WeakPolarHBondContact O-CE 3.43Å; E380-K383 VanDerWaalsContact O-CB 3.28Å; E380-K383 WeakPolarHBondContact O-CB 3.48Å; E380-K383 PolarHBondContact O-N 3.41Å; E380-K383 WeakPolarHBondContact OE1-CD 3.39Å; E380-K383 IonicContact OE1-NZ 3.41Å; E380-K383 PolarHBondContact OE1-NZ 3.06Å; E380-K383 IonicContact OE2-NZ 3.06Å; E380-K383 PolarHBondContact OE2-NZ 3.31Å; R381-K383 PolarHBondContact O-N 2.92Å; K383-R387 PolarHBondContact O-N 3.27Å; K383-Y419 PolarHBondContact NZ-O 3.49Å; K383-N421 HydrophobicContact CD-CB 4.32Å; K383-N424 WeakPolarHBondContact CB-ND2 3.39Å; K383-N424 PolarHBondContact O-ND2 3.43Å
384	D	97	Very high	95.5	Very high	46 Å²	46	59.6 Å²	59.6	25%	0.246	27%	0.273	C	S	.	.	H	α-helix	trans	-72.5	-42.9	177.4	-68.1	-48.1	0	0	0	110.7	R381 A382 R387 E388 N421	R381-D384 WeakPolarHBondContact O-CB 3.32Å; R381-D384 PolarHBondContact O-N 3.09Å; A382-D384 VanDerWaalsContact C-N 3.34Å; D384-R387 VanDerWaalsContact CB-NH2 3.32Å; D384-R387 WeakPolarHBondContact O-CB 3.45Å; D384-R387 PolarHBondContact O-N 3.29Å; D384-R387 VanDerWaalsContact O-N 3.17Å; D384-R387 IonicContact OD1-CZ 3.31Å; D384-R387 VanDerWaalsContact OD1-CZ 3.26Å; D384-R387 IonicContact OD1-NH1 3.22Å; D384-R387 PolarHBondContact OD1-NH1 3.33Å; D384-R387 IonicContact OD1-NH2 3.13Å; D384-R387 PolarHBondContact OD1-NH2 2.82Å; D384-E388 WeakPolarHBondContact O-CG 3.32Å; D384-E388 PolarHBondContact O-N 3.27Å; D384-N421 PolarHBondContact OD1-ND2 3.33Å
385	E	97.5	Very high	95.8	Very high	78 Å²	78	56.6 Å²	56.6	36%	0.364	26%	0.259	S	S	.	.	H	α-helix	trans	-61.5	-45.9	176.3	-171.1	-178.6	-178.6	0	0	112.5	V350 R381 A382 R387 E388 L389	V350-E385 HydrophobicContact CB-CG 4.33Å; V350-E385 HydrophobicContact CG1-CB 4.16Å; V350-E385 HydrophobicContact CG1-CG 3.72Å; R381-E385 PolarHBondContact O-N 2.94Å; A382-E385 PolarHBondContact O-N 3.17Å; E385-R387 PolarHBondContact O-N 3.12Å; E385-E388 PolarHBondContact O-N 2.75Å; E385-E388 VanDerWaalsContact O-N 3.13Å; E385-L389 HydrophobicContact CG-CD1 3.96Å; E385-L389 WeakPolarHBondContact O-CG 3.43Å; E385-L389 PolarHBondContact O-N 3.23Å
386	V	97.9	Very high	96	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.1	-33.4	175.4	173.8	0	0	0	0	111.4	V350 V354 I372 A382 G391 M417	V350-V386 HydrophobicContact CG1-CG2 3.53Å; V354-V386 HydrophobicContact CG2-CG1 4.25Å; V354-V386 HydrophobicContact CG2-CG2 4.32Å; I372-V386 HydrophobicContact CD1-CG1 4.35Å; I372-V386 HydrophobicContact CG1-CG2 4.13Å; I372-V386 HydrophobicContact CG2-CG1 3.95Å; I372-V386 HydrophobicContact CG2-CG2 4.06Å; A382-V386 WeakPolarHBondContact O-CB 3.46Å; A382-V386 WeakPolarHBondContact O-CG2 3.42Å; A382-V386 PolarHBondContact O-N 3.48Å; V386-G391 VanDerWaalsContact O-CA 3.28Å; V386-G391 WeakPolarHBondContact O-CA 3.35Å; V386-G391 PolarHBondContact O-N 2.88Å; V386-M417 HydrophobicContact CB-CE 3.94Å; V386-M417 HydrophobicContact CB-SD 4.4Å; V386-M417 HydrophobicContact CG1-CE 3.62Å; V386-M417 HydrophobicContact CG1-SD 3.68Å
387	R	97.7	Very high	96.1	Very high	50 Å²	50	60.7 Å²	60.7	19%	0.189	29%	0.286	C	S	.	.	H	α-helix	trans	-68.2	-47.1	173.3	173.6	-162.9	57	-118.2	-0.4	110.8	K383 D384 E385 L389 H390 M417 N424 E427	K383-R387 PolarHBondContact O-N 3.27Å; D384-R387 VanDerWaalsContact CB-NH2 3.32Å; D384-R387 WeakPolarHBondContact O-CB 3.45Å; D384-R387 PolarHBondContact O-N 3.29Å; D384-R387 VanDerWaalsContact O-N 3.17Å; D384-R387 IonicContact OD1-CZ 3.31Å; D384-R387 VanDerWaalsContact OD1-CZ 3.26Å; D384-R387 IonicContact OD1-NH1 3.22Å; D384-R387 PolarHBondContact OD1-NH1 3.33Å; D384-R387 IonicContact OD1-NH2 3.13Å; D384-R387 PolarHBondContact OD1-NH2 2.82Å; E385-R387 PolarHBondContact O-N 3.12Å; R387-L389 VanDerWaalsContact C-N 3.26Å; R387-L389 PolarHBondContact O-N 3.04Å; R387-H390 WeakPolarHBondContact O-CA 3.3Å; R387-H390 PolarHBondContact O-N 2.64Å; R387-M417 HydrophobicContact CB-CE 3.73Å; R387-M417 VanDerWaalsContact N-CE 3.34Å; R387-N424 VanDerWaalsContact CB-OD1 3.3Å; R387-N424 WeakPolarHBondContact CB-OD1 3.25Å; R387-N424 VanDerWaalsContact CD-OD1 3.3Å; R387-N424 WeakPolarHBondContact CD-OD1 3.43Å; R387-N424 PolarHBondContact NH1-OD1 2.95Å; R387-E427 HydrophobicContact CG-CG 4.34Å
388	E	97.6	Very high	96.5	Very high	128 Å²	128	57.4 Å²	57.4	60%	0.598	27%	0.272	S	S	*	.	H	α-helix	trans	-65.8	-28.7	-176.5	-76	160.1	-148.8	0	0	112.6	D384 E385 H390	D384-E388 WeakPolarHBondContact O-CG 3.32Å; D384-E388 PolarHBondContact O-N 3.27Å; E385-E388 PolarHBondContact O-N 2.75Å; E385-E388 VanDerWaalsContact O-N 3.13Å; E388-H390 PolarHBondContact O-N 2.86Å
389	L	97.4	Very high	96.9	Very high	59 Å²	59	53.1 Å²	53.1	31%	0.309	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	10.2	171.2	-63.3	165.5	0	0	0	114.2	V350 P351 V354 R358 E385 R387 G391	V350-L389 HydrophobicContact CG1-CD1 3.85Å; P351-L389 HydrophobicContact CB-CD1 4.45Å; P351-L389 HydrophobicContact CG-CD1 4.17Å; V354-L389 HydrophobicContact CB-CB 4.34Å; V354-L389 HydrophobicContact CG1-CB 3.9Å; V354-L389 HydrophobicContact CG2-CB 4.29Å; V354-L389 HydrophobicContact CG2-CD1 4.29Å; R358-L389 PolarHBondContact NH2-O 3.01Å; E385-L389 HydrophobicContact CG-CD1 3.96Å; E385-L389 WeakPolarHBondContact O-CG 3.43Å; E385-L389 PolarHBondContact O-N 3.23Å; R387-L389 VanDerWaalsContact C-N 3.26Å; R387-L389 PolarHBondContact O-N 3.04Å; L389-G391 VanDerWaalsContact C-N 3.25Å; L389-G391 PolarHBondContact O-N 3.44Å
390	H	97.3	Very high	97.1	Very high	112 Å²	112	54.3 Å²	54.3	52%	0.519	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	20.5	-176.3	-58.7	-104.2	0	0	0	115.1	R387 E388 T392 E393	R387-H390 WeakPolarHBondContact O-CA 3.3Å; R387-H390 PolarHBondContact O-N 2.64Å; E388-H390 PolarHBondContact O-N 2.86Å; H390-T392 PolarHBondContact O-N 2.8Å; H390-E393 PolarHBondContact O-N 3.4Å
391	G	97.6	Very high	97.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-58.3	-30.1	179.3	0	0	0	0	0	113.9	V386 L389 E393 L394 L395	V386-G391 VanDerWaalsContact O-CA 3.28Å; V386-G391 WeakPolarHBondContact O-CA 3.35Å; V386-G391 PolarHBondContact O-N 2.88Å; L389-G391 VanDerWaalsContact C-N 3.25Å; L389-G391 PolarHBondContact O-N 3.44Å; G391-E393 VanDerWaalsContact C-N 3.32Å; G391-E393 PolarHBondContact O-N 3.24Å; G391-L394 PolarHBondContact O-N 2.91Å; G391-L395 WeakPolarHBondContact O-CB 3.46Å; G391-L395 VanDerWaalsContact O-CG 3.3Å; G391-L395 WeakPolarHBondContact O-CG 3.2Å; G391-L395 PolarHBondContact O-N 2.88Å
392	T	98	Very high	97.2	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-57.1	-43.3	176.8	-41.8	0	0	0	0	112.7	H390 V396 M414 M417 E427 L428	H390-T392 PolarHBondContact O-N 2.8Å; T392-V396 VanDerWaalsContact O-CG2 3.27Å; T392-V396 WeakPolarHBondContact O-CG2 3.28Å; T392-V396 PolarHBondContact O-N 3.27Å; T392-M414 HydrophobicContact CG2-CE 3.94Å; T392-M414 HydrophobicContact CG2-SD 4.34Å; T392-M417 WeakPolarHBondContact OG1-CE 3.43Å; T392-E427 HydrophobicContact CG2-CB 4.24Å; T392-E427 HydrophobicContact CG2-CG 3.94Å; T392-L428 HydrophobicContact CG2-CB 4.27Å
393	E	97.7	Very high	97.3	Very high	87 Å²	87	49.2 Å²	49.2	41%	0.407	25%	0.252	S	S	.	.	H	α-helix	trans	-70	-40.9	-177.4	-174	175.8	145.2	0	0	111.3	H390 G391 T397 Q431	H390-E393 PolarHBondContact O-N 3.4Å; G391-E393 VanDerWaalsContact C-N 3.32Å; G391-E393 PolarHBondContact O-N 3.24Å; E393-T397 PolarHBondContact O-N 3.17Å; E393-T397 PolarHBondContact O-OG1 3.47Å; E393-Q431 HydrophobicContact CB-CG 4.32Å; E393-Q431 PolarHBondContact OE2-NE2 2.91Å; E393-Q431 VanDerWaalsContact OE2-NE2 3.08Å
394	L	98.1	Very high	97.2	Very high	26 Å²	26	50.4 Å²	50.4	14%	0.136	26%	0.262	C	S	.	.	H	α-helix	trans	-64	-50.4	175.2	-57.1	174.6	0	0	0	110.8	V354 L357 R358 G391 V396 T397 L398	V354-L394 HydrophobicContact CG1-CD1 3.95Å; L357-L394 HydrophobicContact CB-CB 4Å; L357-L394 HydrophobicContact CB-CD1 3.95Å; L357-L394 HydrophobicContact CD1-CB 4.03Å; L357-L394 HydrophobicContact CD1-CD1 4.44Å; R358-L394 HydrophobicContact CG-CD1 3.55Å; R358-L394 HydrophobicContact CG-CD2 3.95Å; R358-L394 HydrophobicContact CG-CG 4.42Å; G391-L394 PolarHBondContact O-N 2.91Å; L394-V396 VanDerWaalsContact C-N 3.35Å; L394-V396 PolarHBondContact O-N 2.94Å; L394-T397 WeakPolarHBondContact O-CA 3.36Å; L394-T397 WeakPolarHBondContact O-CB 3.48Å; L394-T397 PolarHBondContact O-N 3.35Å; L394-L398 WeakPolarHBondContact O-CG 3.43Å; L394-L398 PolarHBondContact O-N 3.07Å
395	L	98.4	Very high	97.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.6	-44	178.3	-71.3	172.5	0	0	0	111.9	L357 I372 G391 T397 L398 F399 A413 M414 M417	L357-L395 HydrophobicContact CD1-CD2 3.7Å; L357-L395 HydrophobicContact CD1-CG 3.78Å; L357-L395 HydrophobicContact CD2-CD2 4.26Å; I372-L395 HydrophobicContact CG2-CD1 4.34Å; G391-L395 WeakPolarHBondContact O-CB 3.46Å; G391-L395 VanDerWaalsContact O-CG 3.3Å; G391-L395 WeakPolarHBondContact O-CG 3.2Å; G391-L395 PolarHBondContact O-N 2.88Å; L395-T397 VanDerWaalsContact C-N 3.27Å; L395-T397 PolarHBondContact O-N 2.92Å; L395-L398 PolarHBondContact O-N 3.03Å; L395-L398 VanDerWaalsContact O-N 3.14Å; L395-F399 HydrophobicContact CB-CE1 4.45Å; L395-F399 WeakPolarHBondContact O-CD1 3.45Å; L395-F399 WeakPolarHBondContact O-CE1 3.27Å; L395-F399 PolarHBondContact O-N 2.72Å; L395-F399 VanDerWaalsContact O-N 3.14Å; L395-A413 HydrophobicContact CD1-CB 4.14Å; L395-A413 HydrophobicContact CD2-CB 3.93Å; L395-M414 HydrophobicContact CB-CE 3.54Å; L395-M414 HydrophobicContact CD1-CE 3.89Å; L395-M414 HydrophobicContact CG-CE 4.38Å; L395-M417 HydrophobicContact CD1-SD 4.08Å
396	V	98.3	Very high	97.1	Very high	12 Å²	12	49.6 Å²	49.6	7%	0.073	26%	0.257	C	S	.	.	H	α-helix	trans	-62.5	-34.5	176	170.2	0	0	0	0	112.2	T392 L394 F399 M414 L428 Q431 A436	T392-V396 VanDerWaalsContact O-CG2 3.27Å; T392-V396 WeakPolarHBondContact O-CG2 3.28Å; T392-V396 PolarHBondContact O-N 3.27Å; L394-V396 VanDerWaalsContact C-N 3.35Å; L394-V396 PolarHBondContact O-N 2.94Å; V396-F399 HydrophobicContact CG2-CE2 4.01Å; V396-F399 HydrophobicContact CG2-CZ 4.25Å; V396-F399 WeakPolarHBondContact O-CB 3.48Å; V396-M414 HydrophobicContact CG2-CE 4.13Å; V396-L428 HydrophobicContact CG2-CD1 3.41Å; V396-L428 VanDerWaalsContact CG2-CD1 3.41Å; V396-Q431 HydrophobicContact CG2-CB 4.46Å; V396-A436 HydrophobicContact CG1-CB 3.97Å
397	T	97.8	Very high	97.1	Very high	95 Å²	95	50.7 Å²	50.7	58%	0.583	26%	0.261	S	S	*	.	H	α-helix	trans	-66.4	-43.6	173.3	-56.4	0	0	0	0	110.9	E393 L394 L395 F399 K400	E393-T397 PolarHBondContact O-N 3.17Å; E393-T397 PolarHBondContact O-OG1 3.47Å; L394-T397 WeakPolarHBondContact O-CA 3.36Å; L394-T397 WeakPolarHBondContact O-CB 3.48Å; L394-T397 PolarHBondContact O-N 3.35Å; L395-T397 VanDerWaalsContact C-N 3.27Å; L395-T397 PolarHBondContact O-N 2.92Å; T397-F399 VanDerWaalsContact C-N 3.25Å; T397-F399 PolarHBondContact O-N 3.49Å; T397-K400 PolarHBondContact O-N 3.07Å
398	L	97.8	Very high	97	Very high	13 Å²	13	52.2 Å²	52.2	7%	0.068	27%	0.267	C	S	.	.	H	α-helix	trans	-66.6	-19.2	179.2	-65.6	178.5	0	0	0	114	L357 Q365 L394 L395 K400 S401 V406	L357-L398 HydrophobicContact CB-CD1 4.15Å; L357-L398 HydrophobicContact CD2-CD1 3.82Å; L357-L398 HydrophobicContact CG-CD1 4.44Å; Q365-L398 HydrophobicContact CB-CD1 4.38Å; Q365-L398 HydrophobicContact CG-CD1 4.44Å; Q365-L398 HydrophobicContact CG-CD2 4.11Å; L394-L398 WeakPolarHBondContact O-CG 3.43Å; L394-L398 PolarHBondContact O-N 3.07Å; L395-L398 PolarHBondContact O-N 3.03Å; L395-L398 VanDerWaalsContact O-N 3.14Å; L398-K400 PolarHBondContact O-N 2.84Å; L398-K400 VanDerWaalsContact O-N 3.11Å; L398-S401 WeakPolarHBondContact O-CB 3.03Å; L398-S401 PolarHBondContact O-N 2.87Å; L398-V406 HydrophobicContact CB-CG1 3.92Å; L398-V406 HydrophobicContact CD1-CG1 4.41Å; L398-V406 HydrophobicContact CD2-CG1 3.86Å; L398-V406 HydrophobicContact CG-CG1 4.26Å
399	F	97.1	Very high	97	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.009	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-22.5	169	-60.5	-4.1	0	0	0	112.5	L395 V396 T397 R407 T411 M414 L428 A436 L437	L395-F399 HydrophobicContact CB-CE1 4.45Å; L395-F399 WeakPolarHBondContact O-CD1 3.45Å; L395-F399 WeakPolarHBondContact O-CE1 3.27Å; L395-F399 PolarHBondContact O-N 2.72Å; L395-F399 VanDerWaalsContact O-N 3.14Å; V396-F399 HydrophobicContact CG2-CE2 4.01Å; V396-F399 HydrophobicContact CG2-CZ 4.25Å; V396-F399 WeakPolarHBondContact O-CB 3.48Å; T397-F399 VanDerWaalsContact C-N 3.25Å; T397-F399 PolarHBondContact O-N 3.49Å; F399-R407 VanDerWaalsContact O-CD 3.29Å; F399-R407 WeakPolarHBondContact O-CD 3.44Å; F399-R407 WeakPolarHBondContact O-CG 3.44Å; F399-T411 HydrophobicContact CD1-CG2 3.43Å; F399-T411 VanDerWaalsContact CD1-CG2 3.43Å; F399-T411 HydrophobicContact CD2-CG2 4.4Å; F399-T411 HydrophobicContact CE1-CG2 3.62Å; F399-T411 HydrophobicContact CG-CG2 3.89Å; F399-T411 HydrophobicContact CZ-CG2 4.2Å; F399-M414 HydrophobicContact CE1-CB 4.12Å; F399-M414 HydrophobicContact CZ-CB 3.77Å; F399-M414 HydrophobicContact CZ-CE 4.08Å; F399-M414 HydrophobicContact CZ-CG 3.87Å; F399-L428 HydrophobicContact CE2-CD1 4.27Å; F399-L428 HydrophobicContact CZ-CD1 4.48Å; F399-A436 HydrophobicContact CB-CB 4.32Å; F399-A436 HydrophobicContact CD2-CB 3.88Å; F399-L437 HydrophobicContact CD2-CD2 3.97Å; F399-L437 HydrophobicContact CD2-CG 4.17Å; F399-L437 HydrophobicContact CE2-CD2 3.75Å; F399-L437 HydrophobicContact CE2-CG 3.97Å; F399-L437 HydrophobicContact CZ-CD2 4.49Å
400	K	95.8	Very high	97	Very high	128 Å²	128	44.4 Å²	44.4	56%	0.557	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.2	8.1	178.3	-58.9	-169.1	172.1	-164	0	113.4	T397 L398 D439	T397-K400 PolarHBondContact O-N 3.07Å; L398-K400 PolarHBondContact O-N 2.84Å; L398-K400 VanDerWaalsContact O-N 3.11Å; K400-D439 VanDerWaalsContact CE-OD2 3.24Å; K400-D439 WeakPolarHBondContact CE-OD2 3.44Å; K400-D439 IonicContact NZ-OD2 3.39Å; K400-D439 PolarHBondContact NZ-OD2 3.49Å
401	S	96.3	Very high	97	Very high	16 Å²	16	39 Å²	39	11%	0.112	20%	0.203	C	C	.	.			trans	-57	141.6	173.5	-178.4	0	0	0	0	110.8	L398 D403 V406 R407	L398-S401 WeakPolarHBondContact O-CB 3.03Å; L398-S401 PolarHBondContact O-N 2.87Å; S401-D403 PolarHBondContact O-N 2.9Å; S401-D403 PolarHBondContact OG-N 3.07Å; S401-V406 VanDerWaalsContact CB-CG1 3.48Å; S401-R407 WeakPolarHBondContact O-CD 3.48Å; S401-R407 WeakPolarHBondContact O-CG 3.48Å; S401-R407 PolarHBondContact O-NH1 2.98Å
402	P	94.9	Very high	97	Very high	126 Å²	126	39 Å²	39	82%	0.818	20%	0.203	S	C	*	.	S	Bend	trans	-64.4	-27	171.7	27.9	-35.3	0	0	0	112.1	R407	P402-R407 PolarHBondContact O-NH1 3.02Å
403	D	96.4	Very high	97	Very high	51 Å²	51	39 Å²	39	27%	0.273	20%	0.203	S	C	.	.	S	Bend	trans	-75.7	138	179.6	-176.3	-89.8	0	0	0	112.7	T362 S401 E405 V406 R407	T362-D403 HydrophobicContact CG2-CB 3.92Å; S401-D403 PolarHBondContact O-N 2.9Å; S401-D403 PolarHBondContact OG-N 3.07Å; D403-E405 WeakPolarHBondContact OD1-CA 3.47Å; D403-E405 PolarHBondContact OD1-N 2.94Å; D403-V406 HydrophobicContact CB-CB 4.08Å; D403-V406 HydrophobicContact CB-CG2 3.92Å; D403-V406 WeakPolarHBondContact OD1-CG2 3.3Å; D403-V406 PolarHBondContact OD1-N 3.44Å; D403-R407 WeakPolarHBondContact O-CG 3.28Å; D403-R407 PolarHBondContact O-N 3.02Å; D403-R407 PolarHBondContact O-NH1 3.03Å; D403-R407 VanDerWaalsContact O-NH1 3.16Å
404	A	95.4	Very high	97	Very high	29 Å²	29	34.9 Å²	34.9	24%	0.24	18%	0.184	C	C	.	.	H	α-helix	trans	-78.3	-36	-176.1	0	0	0	0	0	113.5	R407 R408	A404-R407 PolarHBondContact O-N 3.07Å; A404-R408 VanDerWaalsContact O-CG 3.3Å; A404-R408 WeakPolarHBondContact O-CG 3.36Å; A404-R408 PolarHBondContact O-N 3.42Å
405	E	95.3	Very high	97	Very high	106 Å²	106	34 Å²	34	50%	0.495	18%	0.179	S	C	.	.	H	α-helix	trans	-71.1	-43.4	179.5	-57.9	-160.3	142	0	0	110.3	V366 D403 R407 R408 F409	V366-E405 HydrophobicContact CG2-CB 3.83Å; D403-E405 WeakPolarHBondContact OD1-CA 3.47Å; D403-E405 PolarHBondContact OD1-N 2.94Å; E405-R407 VanDerWaalsContact C-N 3.28Å; E405-R407 PolarHBondContact O-N 3.19Å; E405-R408 PolarHBondContact O-N 3.05Å; E405-F409 HydrophobicContact CB-CD2 4.32Å; E405-F409 WeakPolarHBondContact O-CD2 3.44Å; E405-F409 PolarHBondContact O-N 2.89Å
406	V	97	Very high	97	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-53.5	-45.1	172.3	173.7	0	0	0	0	111.1	T362 Q365 V366 L398 S401 D403 S410	T362-V406 HydrophobicContact CG2-CG2 4.06Å; Q365-V406 HydrophobicContact CB-CG1 4.28Å; Q365-V406 HydrophobicContact CB-CG2 3.98Å; V366-V406 HydrophobicContact CG2-CG2 3.9Å; L398-V406 HydrophobicContact CB-CG1 3.92Å; L398-V406 HydrophobicContact CD1-CG1 4.41Å; L398-V406 HydrophobicContact CD2-CG1 3.86Å; L398-V406 HydrophobicContact CG-CG1 4.26Å; S401-V406 VanDerWaalsContact CB-CG1 3.48Å; D403-V406 HydrophobicContact CB-CB 4.08Å; D403-V406 HydrophobicContact CB-CG2 3.92Å; D403-V406 WeakPolarHBondContact OD1-CG2 3.3Å; D403-V406 PolarHBondContact OD1-N 3.44Å; V406-S410 WeakPolarHBondContact O-CB 3.12Å; V406-S410 PolarHBondContact O-N 3.33Å; V406-S410 PolarHBondContact O-OG 3.44Å
407	R	96.9	Very high	96.9	Very high	23 Å²	23	33.5 Å²	33.5	9%	0.087	18%	0.176	C	C	.	.	H	α-helix	trans	-64.1	-43.1	175.6	-71.2	-169.6	-54.1	-89.7	1.2	112.7	F399 S401 P402 D403 A404 E405 S410 T411 L448	F399-R407 VanDerWaalsContact O-CD 3.29Å; F399-R407 WeakPolarHBondContact O-CD 3.44Å; F399-R407 WeakPolarHBondContact O-CG 3.44Å; S401-R407 WeakPolarHBondContact O-CD 3.48Å; S401-R407 WeakPolarHBondContact O-CG 3.48Å; S401-R407 PolarHBondContact O-NH1 2.98Å; P402-R407 PolarHBondContact O-NH1 3.02Å; D403-R407 WeakPolarHBondContact O-CG 3.28Å; D403-R407 PolarHBondContact O-N 3.02Å; D403-R407 PolarHBondContact O-NH1 3.03Å; D403-R407 VanDerWaalsContact O-NH1 3.16Å; A404-R407 PolarHBondContact O-N 3.07Å; E405-R407 VanDerWaalsContact C-N 3.28Å; E405-R407 PolarHBondContact O-N 3.19Å; R407-S410 PolarHBondContact O-OG 2.91Å; R407-T411 WeakPolarHBondContact O-CB 3.01Å; R407-T411 WeakPolarHBondContact O-CG2 3.46Å; R407-T411 PolarHBondContact O-N 3.47Å; R407-T411 VanDerWaalsContact O-N 3.12Å; R407-T411 PolarHBondContact O-OG1 2.89Å; R407-L448 HydrophobicContact CB-CD1 4.08Å; R407-L448 HydrophobicContact CB-CD2 4.05Å
408	R	96.1	Very high	96.9	Very high	82 Å²	82	29 Å²	29	31%	0.309	15%	0.148	S	C	.	.	H	α-helix	trans	-64.2	-52.4	179.3	-71.5	169.9	-167.8	160.5	8.3	111.7	A404 E405 T411 G412 D445 E447 L448 N451	A404-R408 VanDerWaalsContact O-CG 3.3Å; A404-R408 WeakPolarHBondContact O-CG 3.36Å; A404-R408 PolarHBondContact O-N 3.42Å; E405-R408 PolarHBondContact O-N 3.05Å; R408-T411 PolarHBondContact O-OG1 3.25Å; R408-T411 VanDerWaalsContact O-OG1 3.07Å; R408-G412 PolarHBondContact O-N 3.25Å; R408-D445 IonicContact CZ-OD1 3.6Å; R408-D445 IonicContact CZ-OD2 2.81Å; R408-D445 VanDerWaalsContact CZ-OD2 3.22Å; R408-D445 IonicContact NE-OD1 2.64Å; R408-D445 PolarHBondContact NE-OD1 3.14Å; R408-D445 VanDerWaalsContact NE-OD1 3.09Å; R408-D445 IonicContact NE-OD2 3.09Å; R408-D445 PolarHBondContact NE-OD2 2.87Å; R408-D445 IonicContact NH2-OD1 3.68Å; R408-D445 IonicContact NH2-OD2 2.79Å; R408-D445 PolarHBondContact NH2-OD2 2.77Å; R408-E447 HydrophobicContact CG-CB 3.93Å; R408-L448 HydrophobicContact CG-CB 4.45Å; R408-N451 PolarHBondContact O-ND2 2.7Å
409	F	96.6	Very high	96.8	Very high	23 Å²	23	29.8 Å²	29.8	10%	0.101	15%	0.15	C	C	.	.	H	α-helix	trans	-68	-41.2	-178.9	-78.7	-81.5	0	0	0	112.1	I330 V366 A370 E405 T411 G412 A413	I330-F409 HydrophobicContact CD1-CD1 3.48Å; I330-F409 VanDerWaalsContact CD1-CD1 3.48Å; I330-F409 HydrophobicContact CD1-CE1 3.67Å; I330-F409 HydrophobicContact CD1-CG 3.97Å; I330-F409 HydrophobicContact CD1-CZ 4.28Å; I330-F409 HydrophobicContact CG2-CE1 3.82Å; I330-F409 HydrophobicContact CG2-CZ 3.8Å; V366-F409 HydrophobicContact CB-CD2 4.35Å; V366-F409 HydrophobicContact CG1-CD2 3.62Å; V366-F409 HydrophobicContact CG1-CE2 3.65Å; V366-F409 HydrophobicContact CG1-CG 4.15Å; V366-F409 HydrophobicContact CG1-CZ 4.2Å; V366-F409 HydrophobicContact CG2-CD2 4.06Å; A370-F409 HydrophobicContact CB-CD1 3.67Å; A370-F409 HydrophobicContact CB-CE1 3.73Å; E405-F409 HydrophobicContact CB-CD2 4.32Å; E405-F409 WeakPolarHBondContact O-CD2 3.44Å; E405-F409 PolarHBondContact O-N 2.89Å; F409-T411 PolarHBondContact O-N 2.73Å; F409-G412 PolarHBondContact O-N 3.03Å; F409-A413 WeakPolarHBondContact O-CB 3.42Å; F409-A413 PolarHBondContact O-N 3.01Å
410	S	98	Very high	96.6	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.4	-37.4	178.4	59.6	0	0	0	0	112.9	V406 R407 M414	V406-S410 WeakPolarHBondContact O-CB 3.12Å; V406-S410 PolarHBondContact O-N 3.33Å; V406-S410 PolarHBondContact O-OG 3.44Å; R407-S410 PolarHBondContact O-OG 2.91Å; S410-M414 PolarHBondContact O-N 2.93Å
411	T	97.8	Very high	96.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-72	-34.9	172.2	54.4	0	0	0	0	112.4	F399 R407 R408 F409 M414 R415 L437 L448 N451	F399-T411 HydrophobicContact CD1-CG2 3.43Å; F399-T411 VanDerWaalsContact CD1-CG2 3.43Å; F399-T411 HydrophobicContact CD2-CG2 4.4Å; F399-T411 HydrophobicContact CE1-CG2 3.62Å; F399-T411 HydrophobicContact CG-CG2 3.89Å; F399-T411 HydrophobicContact CZ-CG2 4.2Å; R407-T411 WeakPolarHBondContact O-CB 3.01Å; R407-T411 WeakPolarHBondContact O-CG2 3.46Å; R407-T411 PolarHBondContact O-N 3.47Å; R407-T411 VanDerWaalsContact O-N 3.12Å; R407-T411 PolarHBondContact O-OG1 2.89Å; R408-T411 PolarHBondContact O-OG1 3.25Å; R408-T411 VanDerWaalsContact O-OG1 3.07Å; F409-T411 PolarHBondContact O-N 2.73Å; T411-M414 PolarHBondContact O-N 2.84Å; T411-R415 WeakPolarHBondContact O-CB 3.21Å; T411-R415 PolarHBondContact O-N 3.47Å; T411-L437 HydrophobicContact CG2-CD2 4.44Å; T411-L448 HydrophobicContact CG2-CD1 3.67Å; T411-N451 WeakPolarHBondContact OG1-CB 3.34Å
412	G	97.3	Very high	96.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.8	-45.6	171.7	0	0	0	0	0	112.2	Q373 R408 F409 M414 R415 N416 N451	Q373-G412 VanDerWaalsContact CD-C 3.47Å; R408-G412 PolarHBondContact O-N 3.25Å; F409-G412 PolarHBondContact O-N 3.03Å; G412-M414 PolarHBondContact O-N 3.17Å; G412-R415 WeakPolarHBondContact O-CB 3.02Å; G412-R415 PolarHBondContact O-N 3.46Å; G412-N416 PolarHBondContact O-N 3.09Å; G412-N451 WeakPolarHBondContact CA-ND2 3.45Å; G412-N451 PolarHBondContact N-ND2 2.97Å
413	A	97.8	Very high	96.7	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-55.3	-49.9	172.1	0	0	0	0	0	111.6	S369 I372 Q373 L395 F409 R415 N416 M417	S369-A413 WeakPolarHBondContact O-CB 3.34Å; I372-A413 HydrophobicContact CB-CB 4.27Å; I372-A413 HydrophobicContact CG2-CB 3.96Å; Q373-A413 HydrophobicContact CB-CB 4.13Å; L395-A413 HydrophobicContact CD1-CB 4.14Å; L395-A413 HydrophobicContact CD2-CB 3.93Å; F409-A413 WeakPolarHBondContact O-CB 3.42Å; F409-A413 PolarHBondContact O-N 3.01Å; A413-R415 PolarHBondContact O-N 2.78Å; A413-N416 PolarHBondContact O-N 2.99Å; A413-M417 VanDerWaalsContact O-CB 3.3Å; A413-M417 WeakPolarHBondContact O-CB 3.32Å; A413-M417 PolarHBondContact O-N 3.36Å
414	M	98.6	Very high	96.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-61.7	-41.9	177.2	-170.1	65	59.8	0	0	112.7	T392 L395 V396 F399 S410 T411 G412 N416 M417 I418 L428 I455	T392-M414 HydrophobicContact CG2-CE 3.94Å; T392-M414 HydrophobicContact CG2-SD 4.34Å; L395-M414 HydrophobicContact CB-CE 3.54Å; L395-M414 HydrophobicContact CD1-CE 3.89Å; L395-M414 HydrophobicContact CG-CE 4.38Å; V396-M414 HydrophobicContact CG2-CE 4.13Å; F399-M414 HydrophobicContact CE1-CB 4.12Å; F399-M414 HydrophobicContact CZ-CB 3.77Å; F399-M414 HydrophobicContact CZ-CE 4.08Å; F399-M414 HydrophobicContact CZ-CG 3.87Å; S410-M414 PolarHBondContact O-N 2.93Å; T411-M414 PolarHBondContact O-N 2.84Å; G412-M414 PolarHBondContact O-N 3.17Å; M414-N416 PolarHBondContact O-N 3.03Å; M414-M417 PolarHBondContact O-N 3.43Å; M414-M417 HydrophobicContact SD-SD 4.29Å; M414-I418 HydrophobicContact CG-CG2 4.15Å; M414-I418 WeakPolarHBondContact O-CG1 3.23Å; M414-I418 PolarHBondContact O-N 2.84Å; M414-I418 HydrophobicContact SD-CG2 3.68Å; M414-L428 HydrophobicContact CE-CD1 4Å; M414-L428 HydrophobicContact CG-CD1 4Å; M414-L428 HydrophobicContact CG-CD2 3.74Å; M414-L428 HydrophobicContact CG-CG 4.45Å; M414-L428 HydrophobicContact SD-CB 4.18Å; M414-L428 HydrophobicContact SD-CD1 3.82Å; M414-L428 HydrophobicContact SD-CD2 3.93Å; M414-L428 HydrophobicContact SD-CG 4.19Å; M414-I455 HydrophobicContact CB-CD1 4.04Å; M414-I455 HydrophobicContact CG-CD1 4.17Å
415	R	97.8	Very high	96.9	Very high	8 Å²	8	26.7 Å²	26.7	3%	0.03	12%	0.119	C	C	.	.	H	α-helix	trans	-53.8	-39.1	179	-179.2	176.2	169.2	164.5	-5.6	111.7	D329 T411 G412 A413 K450 I455 N458 E510	D329-R415 IonicContact OD2-CZ 3.09Å; D329-R415 IonicContact OD2-NE 3.26Å; D329-R415 PolarHBondContact OD2-NE 3.3Å; D329-R415 IonicContact OD2-NH1 2.58Å; D329-R415 PolarHBondContact OD2-NH1 3.15Å; D329-R415 IonicContact OD2-NH2 3.37Å; D329-R415 PolarHBondContact OD2-NH2 3.49Å; T411-R415 WeakPolarHBondContact O-CB 3.21Å; T411-R415 PolarHBondContact O-N 3.47Å; G412-R415 WeakPolarHBondContact O-CB 3.02Å; G412-R415 PolarHBondContact O-N 3.46Å; A413-R415 PolarHBondContact O-N 2.78Å; R415-K450 PolarHBondContact NH1-O 3.22Å; R415-I455 HydrophobicContact CB-CG1 3.92Å; R415-N458 PolarHBondContact O-ND2 3.32Å; R415-N458 VanDerWaalsContact O-ND2 3.15Å; R415-E510 IonicContact CZ-OE1 3.71Å; R415-E510 VanDerWaalsContact CZ-OE1 3.31Å; R415-E510 IonicContact NH1-OE1 3.78Å; R415-E510 PolarHBondContact NH1-OE1 2.94Å; R415-E510 IonicContact NH2-OE1 2.99Å; R415-E510 PolarHBondContact NH2-OE1 2.94Å
416	N	97.3	Very high	97	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.011	12%	0.119	C	C	.	.	H	α-helix	trans	-84.6	-40.8	178.2	-69.5	-6.9	0	0	0	112.7	G327 Q373 C376 G412 A413 M414 I418 Y419	G327-N416 PolarHBondContact N-OD1 3.37Å; G327-N416 PolarHBondContact O-ND2 3.41Å; G327-N416 PolarHBondContact O-OD1 2.93Å; Q373-N416 WeakPolarHBondContact CG-ND2 3.19Å; Q373-N416 PolarHBondContact O-ND2 3.16Å; C376-N416 HydrophobicContact CB-CB 4.12Å; G412-N416 PolarHBondContact O-N 3.09Å; A413-N416 PolarHBondContact O-N 2.99Å; M414-N416 PolarHBondContact O-N 3.03Å; N416-I418 VanDerWaalsContact C-N 3.26Å; N416-I418 PolarHBondContact O-N 3.2Å; N416-Y419 VanDerWaalsContact O-CB 3.28Å; N416-Y419 WeakPolarHBondContact O-CB 3.3Å; N416-Y419 PolarHBondContact O-N 3.12Å
417	M	97.2	Very high	97.1	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-57.2	-36.2	176.8	-175.5	-176.2	-178.9	0	0	113	V386 R387 T392 L395 A413 M414 N424	V386-M417 HydrophobicContact CB-CE 3.94Å; V386-M417 HydrophobicContact CB-SD 4.4Å; V386-M417 HydrophobicContact CG1-CE 3.62Å; V386-M417 HydrophobicContact CG1-SD 3.68Å; R387-M417 HydrophobicContact CB-CE 3.73Å; R387-M417 VanDerWaalsContact N-CE 3.34Å; T392-M417 WeakPolarHBondContact OG1-CE 3.43Å; L395-M417 HydrophobicContact CD1-SD 4.08Å; A413-M417 VanDerWaalsContact O-CB 3.3Å; A413-M417 WeakPolarHBondContact O-CB 3.32Å; A413-M417 PolarHBondContact O-N 3.36Å; M414-M417 PolarHBondContact O-N 3.43Å; M414-M417 HydrophobicContact SD-SD 4.29Å; M417-N424 WeakPolarHBondContact CG-ND2 3.3Å; M417-N424 PolarHBondContact O-ND2 3.28Å
418	I	97.4	Very high	97.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	0.8	176.2	76.6	177.2	0	0	0	113.8	M414 N416 K420 N424 K425 L428 I455 N458 L459	M414-I418 HydrophobicContact CG-CG2 4.15Å; M414-I418 WeakPolarHBondContact O-CG1 3.23Å; M414-I418 PolarHBondContact O-N 2.84Å; M414-I418 HydrophobicContact SD-CG2 3.68Å; N416-I418 VanDerWaalsContact C-N 3.26Å; N416-I418 PolarHBondContact O-N 3.2Å; I418-K420 PolarHBondContact O-N 3.02Å; I418-N424 HydrophobicContact CG2-CB 4.24Å; I418-K425 HydrophobicContact CB-CG 3.87Å; I418-K425 WeakPolarHBondContact O-CE 3.35Å; I418-L428 HydrophobicContact CD1-CD2 3.84Å; I418-L428 HydrophobicContact CG2-CB 4.32Å; I418-L428 HydrophobicContact CG2-CD2 3.89Å; I418-I455 HydrophobicContact CD1-CB 4.3Å; I418-I455 HydrophobicContact CD1-CG1 4.37Å; I418-I455 HydrophobicContact CD1-CG2 3.77Å; I418-N458 HydrophobicContact CD1-CB 4.11Å; I418-N458 HydrophobicContact CG1-CB 4.15Å; I418-L459 HydrophobicContact CD1-CD2 4.07Å; I418-L459 HydrophobicContact CD1-CG 3.9Å
419	Y	95.6	Very high	97.2	Very high	29 Å²	29	24.6 Å²	24.6	11%	0.114	11%	0.114	C	C	.	.	S	Bend	trans	-70.9	122.5	-177.3	179.4	-123.3	0	0	0	110.2	V324 K383 N416 N421	V324-Y419 WeakPolarHBondContact O-CE2 3.4Å; V324-Y419 PolarHBondContact O-OH 3.11Å; K383-Y419 PolarHBondContact NZ-O 3.49Å; N416-Y419 VanDerWaalsContact O-CB 3.28Å; N416-Y419 WeakPolarHBondContact O-CB 3.3Å; N416-Y419 PolarHBondContact O-N 3.12Å; Y419-N421 PolarHBondContact O-N 3.01Å
420	K	93.3	Very high	97.3	Very high	132 Å²	132	30.2 Å²	30.2	57%	0.574	14%	0.139	S	C	*	.	S	Bend	trans	60.2	-33.7	-174.5	-71.4	169.2	174.3	159.4	0	117.2	I418	I418-K420 PolarHBondContact O-N 3.02Å
421	N	96.1	Very high	97.3	Very high	10 Å²	10	32.8 Å²	32.8	5%	0.053	15%	0.151	C	C	.	.			trans	-60.4	133.9	172.1	-167.4	-69.1	0	0	0	110.7	K383 D384 Y419 E423 N424 K425	K383-N421 HydrophobicContact CD-CB 4.32Å; D384-N421 PolarHBondContact OD1-ND2 3.33Å; Y419-N421 PolarHBondContact O-N 3.01Å; N421-E423 PolarHBondContact OD1-N 2.95Å; N421-N424 HydrophobicContact CB-CB 4.34Å; N421-N424 WeakPolarHBondContact OD1-CB 3.49Å; N421-N424 VanDerWaalsContact OD1-CG 3.24Å; N421-N424 PolarHBondContact OD1-N 2.99Å; N421-N424 PolarHBondContact OD1-OD1 2.58Å; N421-K425 WeakPolarHBondContact O-CD 3.47Å; N421-K425 WeakPolarHBondContact O-CE 3.36Å; N421-K425 WeakPolarHBondContact O-CG 3.08Å
422	V	96	Very high	97.3	Very high	36 Å²	36	34.7 Å²	34.7	22%	0.218	17%	0.171	C	C	.	.	S	Bend	trans	-98	-29.7	-175.9	172.2	0	0	0	0	111.2	K425 Q426	V422-K425 WeakPolarHBondContact O-CB 3.32Å; V422-K425 PolarHBondContact O-N 3.37Å; V422-Q426 WeakPolarHBondContact O-CG 3.5Å; V422-Q426 PolarHBondContact O-N 2.81Å; V422-Q426 VanDerWaalsContact O-N 3.08Å
423	E	97.1	Very high	97.3	Very high	98 Å²	98	34.7 Å²	34.7	46%	0.458	17%	0.171	S	C	.	.	H	α-helix	trans	-71.5	-43	-175.1	-65.5	53.2	-123.5	0	0	108.9	N421 K425 Q426 E427	N421-E423 PolarHBondContact OD1-N 2.95Å; E423-K425 VanDerWaalsContact C-N 3.3Å; E423-K425 PolarHBondContact O-N 2.97Å; E423-Q426 WeakPolarHBondContact O-CB 3.32Å; E423-Q426 PolarHBondContact O-N 3.3Å; E423-Q426 VanDerWaalsContact O-N 3.14Å; E423-E427 PolarHBondContact O-N 3.49Å
424	N	97.6	Very high	97.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.8	-29.8	172.3	-70	-0.2	0	0	0	113	K383 R387 M417 I418 N421 E427 L428	K383-N424 WeakPolarHBondContact CB-ND2 3.39Å; K383-N424 PolarHBondContact O-ND2 3.43Å; R387-N424 VanDerWaalsContact CB-OD1 3.3Å; R387-N424 WeakPolarHBondContact CB-OD1 3.25Å; R387-N424 VanDerWaalsContact CD-OD1 3.3Å; R387-N424 WeakPolarHBondContact CD-OD1 3.43Å; R387-N424 PolarHBondContact NH1-OD1 2.95Å; M417-N424 WeakPolarHBondContact CG-ND2 3.3Å; M417-N424 PolarHBondContact O-ND2 3.28Å; I418-N424 HydrophobicContact CG2-CB 4.24Å; N421-N424 HydrophobicContact CB-CB 4.34Å; N421-N424 WeakPolarHBondContact OD1-CB 3.49Å; N421-N424 VanDerWaalsContact OD1-CG 3.24Å; N421-N424 PolarHBondContact OD1-N 2.99Å; N421-N424 PolarHBondContact OD1-OD1 2.58Å; N424-E427 PolarHBondContact O-N 3.17Å; N424-L428 WeakPolarHBondContact O-CB 3.43Å; N424-L428 PolarHBondContact O-N 3.14Å
425	K	98.1	Very high	97.3	Very high	12 Å²	12	37 Å²	37	5%	0.052	19%	0.191	C	C	.	.	H	α-helix	trans	-69	-39.1	171.9	-64.7	175.1	-171.8	-174	0	111.4	I418 N421 V422 E423 I429 N458 L459 F465	I418-K425 HydrophobicContact CB-CG 3.87Å; I418-K425 WeakPolarHBondContact O-CE 3.35Å; N421-K425 WeakPolarHBondContact O-CD 3.47Å; N421-K425 WeakPolarHBondContact O-CE 3.36Å; N421-K425 WeakPolarHBondContact O-CG 3.08Å; V422-K425 WeakPolarHBondContact O-CB 3.32Å; V422-K425 PolarHBondContact O-N 3.37Å; E423-K425 VanDerWaalsContact C-N 3.3Å; E423-K425 PolarHBondContact O-N 2.97Å; K425-I429 WeakPolarHBondContact O-CB 3.25Å; K425-I429 WeakPolarHBondContact O-CD1 3.44Å; K425-I429 VanDerWaalsContact O-CG1 3.27Å; K425-I429 WeakPolarHBondContact O-CG1 3.4Å; K425-I429 PolarHBondContact O-N 2.67Å; K425-N458 WeakPolarHBondContact CE-O 3.49Å; K425-N458 PolarHBondContact NZ-O 3.43Å; K425-L459 HydrophobicContact CB-CD2 3.72Å; K425-L459 HydrophobicContact CD-CD2 4.38Å; K425-L459 HydrophobicContact CG-CD2 3.81Å; K425-F465 HydrophobicContact CB-CD2 4.33Å; K425-F465 HydrophobicContact CB-CE2 3.51Å; K425-F465 HydrophobicContact CB-CZ 4.02Å; K425-F465 HydrophobicContact CD-CE2 4.11Å; K425-F465 HydrophobicContact CG-CE2 4.42Å
426	Q	97.9	Very high	97.3	Very high	104 Å²	104	36.9 Å²	36.9	49%	0.486	19%	0.192	S	C	.	.	H	α-helix	trans	-65	-43.4	173.7	-65.8	179.3	37.1	0	0	111	V422 E423 I429 K430 F465	V422-Q426 WeakPolarHBondContact O-CG 3.5Å; V422-Q426 PolarHBondContact O-N 2.81Å; V422-Q426 VanDerWaalsContact O-N 3.08Å; E423-Q426 WeakPolarHBondContact O-CB 3.32Å; E423-Q426 PolarHBondContact O-N 3.3Å; E423-Q426 VanDerWaalsContact O-N 3.14Å; Q426-I429 PolarHBondContact O-N 2.96Å; Q426-K430 VanDerWaalsContact O-CB 3.31Å; Q426-K430 WeakPolarHBondContact O-CB 3.3Å; Q426-K430 PolarHBondContact O-N 2.85Å; Q426-F465 HydrophobicContact CG-CE1 3.94Å; Q426-F465 HydrophobicContact CG-CZ 3.72Å
427	E	98.2	Very high	97.3	Very high	36 Å²	36	36.8 Å²	36.8	17%	0.168	19%	0.191	C	C	.	.	H	α-helix	trans	-67.8	-43.6	-179.8	-168	57.7	-149.9	0	0	112.2	R387 T392 E423 N424 I429 K430 Q431	R387-E427 HydrophobicContact CG-CG 4.34Å; T392-E427 HydrophobicContact CG2-CB 4.24Å; T392-E427 HydrophobicContact CG2-CG 3.94Å; E423-E427 PolarHBondContact O-N 3.49Å; N424-E427 PolarHBondContact O-N 3.17Å; E427-I429 PolarHBondContact O-N 3.22Å; E427-K430 PolarHBondContact O-N 3.25Å; E427-K430 VanDerWaalsContact O-N 3.15Å; E427-K430 IonicContact OE1-NZ 3.42Å; E427-K430 PolarHBondContact OE1-NZ 2.83Å; E427-K430 WeakPolarHBondContact OE2-CD 3.36Å; E427-K430 IonicContact OE2-NZ 2.63Å; E427-K430 PolarHBondContact OE2-NZ 2.91Å; E427-Q431 HydrophobicContact CG-CG 4.29Å; E427-Q431 WeakPolarHBondContact O-CB 3.46Å; E427-Q431 VanDerWaalsContact O-CG 3.3Å; E427-Q431 WeakPolarHBondContact O-CG 3.2Å; E427-Q431 PolarHBondContact O-N 3.38Å; E427-Q431 WeakPolarHBondContact OE1-CG 3.07Å; E427-Q431 PolarHBondContact OE1-NE2 3.08Å
428	L	98.4	Very high	97.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-55.8	-39.9	173.1	171.9	60.3	0	0	0	111.9	T392 V396 F399 M414 I418 N424 G433 I455 L459	T392-L428 HydrophobicContact CG2-CB 4.27Å; V396-L428 HydrophobicContact CG2-CD1 3.41Å; V396-L428 VanDerWaalsContact CG2-CD1 3.41Å; F399-L428 HydrophobicContact CE2-CD1 4.27Å; F399-L428 HydrophobicContact CZ-CD1 4.48Å; M414-L428 HydrophobicContact CE-CD1 4Å; M414-L428 HydrophobicContact CG-CD1 4Å; M414-L428 HydrophobicContact CG-CD2 3.74Å; M414-L428 HydrophobicContact CG-CG 4.45Å; M414-L428 HydrophobicContact SD-CB 4.18Å; M414-L428 HydrophobicContact SD-CD1 3.82Å; M414-L428 HydrophobicContact SD-CD2 3.93Å; M414-L428 HydrophobicContact SD-CG 4.19Å; I418-L428 HydrophobicContact CD1-CD2 3.84Å; I418-L428 HydrophobicContact CG2-CB 4.32Å; I418-L428 HydrophobicContact CG2-CD2 3.89Å; N424-L428 WeakPolarHBondContact O-CB 3.43Å; N424-L428 PolarHBondContact O-N 3.14Å; L428-G433 WeakPolarHBondContact O-CA 3.38Å; L428-G433 PolarHBondContact O-N 2.77Å; L428-I455 HydrophobicContact CD2-CG2 3.98Å; L428-L459 HydrophobicContact CD2-CD1 4.08Å; L428-L459 HydrophobicContact CD2-CD2 4.29Å
429	I	97.8	Very high	97.3	Very high	26 Å²	26	42 Å²	42	13%	0.133	22%	0.219	C	C	.	.	H	α-helix	trans	-68.9	-46.1	176.6	-76.5	172.3	0	0	0	111.3	K425 Q426 E427 Q431 G432 I434 L459 F465	K425-I429 WeakPolarHBondContact O-CB 3.25Å; K425-I429 WeakPolarHBondContact O-CD1 3.44Å; K425-I429 VanDerWaalsContact O-CG1 3.27Å; K425-I429 WeakPolarHBondContact O-CG1 3.4Å; K425-I429 PolarHBondContact O-N 2.67Å; Q426-I429 PolarHBondContact O-N 2.96Å; E427-I429 PolarHBondContact O-N 3.22Å; I429-Q431 VanDerWaalsContact C-N 3.31Å; I429-Q431 PolarHBondContact O-N 3.25Å; I429-G432 PolarHBondContact O-N 3.39Å; I429-I434 HydrophobicContact CD1-CD1 4.31Å; I429-I434 HydrophobicContact CG1-CD1 3.89Å; I429-I434 HydrophobicContact CG1-CG1 4.28Å; I429-L459 HydrophobicContact CD1-CD2 4.24Å; I429-L459 HydrophobicContact CG1-CD2 4.46Å; I429-F465 HydrophobicContact CD1-CB 3.71Å; I429-F465 HydrophobicContact CD1-CD1 3.36Å; I429-F465 HydrophobicContact CD1-CD2 3.87Å; I429-F465 HydrophobicContact CD1-CE1 3.91Å; I429-F465 HydrophobicContact CD1-CE2 4.36Å; I429-F465 HydrophobicContact CD1-CG 3.36Å; I429-F465 HydrophobicContact CD1-CZ 4.39Å
430	K	97.6	Very high	97.3	Very high	142 Å²	142	40.9 Å²	40.9	62%	0.617	22%	0.216	S	C	*	.	H	α-helix	trans	-61	-37.5	178.9	164.9	167.9	157.9	-83.3	0	112.4	Q426 E427 G432	Q426-K430 VanDerWaalsContact O-CB 3.31Å; Q426-K430 WeakPolarHBondContact O-CB 3.3Å; Q426-K430 PolarHBondContact O-N 2.85Å; E427-K430 PolarHBondContact O-N 3.25Å; E427-K430 VanDerWaalsContact O-N 3.15Å; E427-K430 IonicContact OE1-NZ 3.42Å; E427-K430 PolarHBondContact OE1-NZ 2.83Å; E427-K430 WeakPolarHBondContact OE2-CD 3.36Å; E427-K430 IonicContact OE2-NZ 2.63Å; E427-K430 PolarHBondContact OE2-NZ 2.91Å; K430-G432 PolarHBondContact O-N 3.48Å
431	Q	97.9	Very high	97.4	Very high	53 Å²	53	34.6 Å²	34.6	25%	0.248	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	12.1	175.3	-62.7	-68.5	0.7	0	0	113.5	E393 V396 E427 I429 G433	E393-Q431 HydrophobicContact CB-CG 4.32Å; E393-Q431 PolarHBondContact OE2-NE2 2.91Å; E393-Q431 VanDerWaalsContact OE2-NE2 3.08Å; V396-Q431 HydrophobicContact CG2-CB 4.46Å; E427-Q431 HydrophobicContact CG-CG 4.29Å; E427-Q431 WeakPolarHBondContact O-CB 3.46Å; E427-Q431 VanDerWaalsContact O-CG 3.3Å; E427-Q431 WeakPolarHBondContact O-CG 3.2Å; E427-Q431 PolarHBondContact O-N 3.38Å; E427-Q431 WeakPolarHBondContact OE1-CG 3.07Å; E427-Q431 PolarHBondContact OE1-NE2 3.08Å; I429-Q431 VanDerWaalsContact C-N 3.31Å; I429-Q431 PolarHBondContact O-N 3.25Å; Q431-G433 VanDerWaalsContact C-N 3.3Å; Q431-G433 PolarHBondContact O-N 3.12Å
432	G	97.6	Very high	97.3	Very high	41 Å²	41	37.6 Å²	37.6	42%	0.423	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	13.4	176.1	0	0	0	0	0	114.9	I429 K430 I434 G435 A436	I429-G432 PolarHBondContact O-N 3.39Å; K430-G432 PolarHBondContact O-N 3.48Å; G432-I434 VanDerWaalsContact C-N 3.28Å; G432-I434 PolarHBondContact O-N 3.37Å; G432-I434 VanDerWaalsContact O-N 3.14Å; G432-G435 WeakPolarHBondContact O-CA 3.47Å; G432-G435 PolarHBondContact O-N 2.89Å; G432-A436 PolarHBondContact O-N 2.64Å
433	G	98.1	Very high	97.2	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-56.2	-33.2	-172.4	0	0	0	0	0	115.1	L428 Q431 G435 A436 L437	L428-G433 WeakPolarHBondContact O-CA 3.38Å; L428-G433 PolarHBondContact O-N 2.77Å; Q431-G433 VanDerWaalsContact C-N 3.3Å; Q431-G433 PolarHBondContact O-N 3.12Å; G433-G435 VanDerWaalsContact C-N 3.26Å; G433-G435 PolarHBondContact O-N 3.22Å; G433-A436 PolarHBondContact O-N 3.26Å; G433-L437 WeakPolarHBondContact O-CB 3.38Å; G433-L437 WeakPolarHBondContact O-CD1 3.23Å; G433-L437 WeakPolarHBondContact O-CG 3.38Å; G433-L437 PolarHBondContact O-N 3.25Å
434	I	97.9	Very high	97	Very high	14 Å²	14	43.4 Å²	43.4	7%	0.072	23%	0.227	C	C	.	.	H	α-helix	trans	-59.8	-37.7	174.6	-64.5	176.1	0	0	0	111.2	I429 G432 N438 Q468 L469	I429-I434 HydrophobicContact CD1-CD1 4.31Å; I429-I434 HydrophobicContact CG1-CD1 3.89Å; I429-I434 HydrophobicContact CG1-CG1 4.28Å; G432-I434 VanDerWaalsContact C-N 3.28Å; G432-I434 PolarHBondContact O-N 3.37Å; G432-I434 VanDerWaalsContact O-N 3.14Å; I434-N438 WeakPolarHBondContact O-CB 3.23Å; I434-N438 PolarHBondContact O-N 3.09Å; I434-Q468 HydrophobicContact CD1-CB 3.83Å; I434-L469 HydrophobicContact CD1-CD2 3.91Å; I434-L469 HydrophobicContact CD1-CG 4.24Å; I434-L469 HydrophobicContact CG1-CD2 4.27Å
435	G	97.9	Very high	96.7	Very high	35 Å²	35	44 Å²	44	36%	0.361	23%	0.231	S	C	.	.	H	α-helix	trans	-67.9	-48	174.7	0	0	0	0	0	111.9	G432 G433 L437 N438 D439	G432-G435 WeakPolarHBondContact O-CA 3.47Å; G432-G435 PolarHBondContact O-N 2.89Å; G433-G435 VanDerWaalsContact C-N 3.26Å; G433-G435 PolarHBondContact O-N 3.22Å; G435-L437 VanDerWaalsContact C-N 3.3Å; G435-L437 PolarHBondContact O-N 3.19Å; G435-N438 WeakPolarHBondContact O-CB 3.18Å; G435-N438 PolarHBondContact O-N 3.05Å; G435-N438 VanDerWaalsContact O-N 3.08Å; G435-D439 PolarHBondContact O-N 3Å
436	A	97.9	Very high	96.5	Very high	5 Å²	5	46 Å²	46	4%	0.041	24%	0.242	C	C	.	.	H	α-helix	trans	-60.1	-38.2	177.8	0	0	0	0	0	113	V396 F399 G432 G433 D439 A440	V396-A436 HydrophobicContact CG1-CB 3.97Å; F399-A436 HydrophobicContact CB-CB 4.32Å; F399-A436 HydrophobicContact CD2-CB 3.88Å; G432-A436 PolarHBondContact O-N 2.64Å; G433-A436 PolarHBondContact O-N 3.26Å; A436-D439 PolarHBondContact O-N 3.21Å; A436-A440 WeakPolarHBondContact O-CB 3.38Å; A436-A440 PolarHBondContact O-N 3.01Å
437	L	98.2	Very high	96.2	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-67.8	-37.4	173.9	-66.1	163.2	0	0	0	112.2	F399 T411 G433 G435 A440 L441 I452 I455 I472	F399-L437 HydrophobicContact CD2-CD2 3.97Å; F399-L437 HydrophobicContact CD2-CG 4.17Å; F399-L437 HydrophobicContact CE2-CD2 3.75Å; F399-L437 HydrophobicContact CE2-CG 3.97Å; F399-L437 HydrophobicContact CZ-CD2 4.49Å; T411-L437 HydrophobicContact CG2-CD2 4.44Å; G433-L437 WeakPolarHBondContact O-CB 3.38Å; G433-L437 WeakPolarHBondContact O-CD1 3.23Å; G433-L437 WeakPolarHBondContact O-CG 3.38Å; G433-L437 PolarHBondContact O-N 3.25Å; G435-L437 VanDerWaalsContact C-N 3.3Å; G435-L437 PolarHBondContact O-N 3.19Å; L437-A440 PolarHBondContact O-N 3.31Å; L437-L441 PolarHBondContact O-N 2.88Å; L437-I452 HydrophobicContact CB-CG2 4.29Å; L437-I452 HydrophobicContact CD2-CB 4.36Å; L437-I452 HydrophobicContact CD2-CG1 3.81Å; L437-I452 HydrophobicContact CD2-CG2 4.31Å; L437-I455 HydrophobicContact CD1-CG2 3.55Å; L437-I455 HydrophobicContact CD2-CD1 3.8Å; L437-I455 HydrophobicContact CD2-CG2 4.46Å; L437-I472 HydrophobicContact CB-CD1 4.07Å
438	N	97.4	Very high	96	Very high	36 Å²	36	42 Å²	42	19%	0.193	22%	0.223	C	C	.	.	H	α-helix	trans	-65.6	-38.6	175.3	172.8	85.3	0	0	0	112	I434 G435 I472 R475	I434-N438 WeakPolarHBondContact O-CB 3.23Å; I434-N438 PolarHBondContact O-N 3.09Å; G435-N438 WeakPolarHBondContact O-CB 3.18Å; G435-N438 PolarHBondContact O-N 3.05Å; G435-N438 VanDerWaalsContact O-N 3.08Å; N438-I472 VanDerWaalsContact CA-CD1 3.46Å; N438-I472 HydrophobicContact CB-CB 4.38Å; N438-I472 HydrophobicContact CB-CD1 3.76Å; N438-I472 HydrophobicContact CB-CG1 3.78Å; N438-R475 WeakPolarHBondContact OD1-CB 3.48Å
439	D	96.5	Very high	95.9	Very high	72 Å²	72	43.6 Å²	43.6	39%	0.385	23%	0.229	S	C	.	.	H	α-helix	trans	-69.6	-40.8	175.7	-57.3	-20.9	0	0	0	110.7	K400 G435 A436 L441 E442	K400-D439 VanDerWaalsContact CE-OD2 3.24Å; K400-D439 WeakPolarHBondContact CE-OD2 3.44Å; K400-D439 IonicContact NZ-OD2 3.39Å; K400-D439 PolarHBondContact NZ-OD2 3.49Å; G435-D439 PolarHBondContact O-N 3Å; A436-D439 PolarHBondContact O-N 3.21Å; D439-L441 VanDerWaalsContact C-N 3.27Å; D439-L441 PolarHBondContact O-N 3.2Å; D439-E442 WeakPolarHBondContact O-CB 3.2Å; D439-E442 PolarHBondContact O-N 2.96Å
440	A	96	Very high	95.8	Very high	6 Å²	6	43.2 Å²	43.2	5%	0.05	23%	0.226	C	C	.	.	H	α-helix	trans	-65.7	-23.9	178.7	0	0	0	0	0	113.9	A436 L437 E442 Q443 L448 I452	A436-A440 WeakPolarHBondContact O-CB 3.38Å; A436-A440 PolarHBondContact O-N 3.01Å; L437-A440 PolarHBondContact O-N 3.31Å; A440-E442 PolarHBondContact O-N 3.35Å; A440-Q443 WeakPolarHBondContact O-CB 3.4Å; A440-Q443 WeakPolarHBondContact O-CG 3.34Å; A440-Q443 PolarHBondContact O-N 3.46Å; A440-Q443 VanDerWaalsContact O-N 3.14Å; A440-L448 HydrophobicContact CB-CD2 4.48Å; A440-I452 HydrophobicContact CB-CD1 3.75Å
441	L	95.8	Very high	95.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-13.7	173.4	-77.9	177.4	0	0	0	114.3	L437 D439 Q443 R449 I452 I472 R475 L476 V480	L437-L441 PolarHBondContact O-N 2.88Å; D439-L441 VanDerWaalsContact C-N 3.27Å; D439-L441 PolarHBondContact O-N 3.2Å; L441-Q443 PolarHBondContact O-N 3.48Å; L441-R449 HydrophobicContact CD2-CG 4.45Å; L441-I452 HydrophobicContact CD2-CB 4.38Å; L441-I452 HydrophobicContact CD2-CD1 4.04Å; L441-I452 HydrophobicContact CD2-CG2 3.81Å; L441-I452 HydrophobicContact CG-CD1 4.29Å; L441-I452 HydrophobicContact CG-CG2 4.04Å; L441-I472 HydrophobicContact CD1-CD1 3.77Å; L441-I472 HydrophobicContact CD1-CG1 3.7Å; L441-R475 HydrophobicContact CB-CG 3.98Å; L441-R475 HydrophobicContact CD1-CB 4.47Å; L441-R475 HydrophobicContact CD1-CG 4.1Å; L441-L476 HydrophobicContact CD1-CB 4.21Å; L441-L476 HydrophobicContact CD1-CD1 4Å; L441-L476 HydrophobicContact CD2-CD1 4.26Å; L441-V480 HydrophobicContact CD2-CG2 4.27Å
442	E	94.3	Very high	95.8	Very high	74 Å²	74	33.9 Å²	33.9	35%	0.346	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-21.8	172	-71.5	-68.4	173.7	0	0	112.7	D439 A440 R475 K479	D439-E442 WeakPolarHBondContact O-CB 3.2Å; D439-E442 PolarHBondContact O-N 2.96Å; A440-E442 PolarHBondContact O-N 3.35Å; E442-R475 IonicContact OE1-CZ 2.65Å; E442-R475 IonicContact OE1-NE 3.06Å; E442-R475 PolarHBondContact OE1-NE 3.36Å; E442-R475 IonicContact OE1-NH1 3.32Å; E442-R475 PolarHBondContact OE1-NH1 3.48Å; E442-R475 IonicContact OE1-NH2 2.73Å; E442-R475 PolarHBondContact OE1-NH2 2.92Å; E442-K479 WeakPolarHBondContact OE2-CE 3.37Å; E442-K479 IonicContact OE2-NZ 3.14Å; E442-K479 PolarHBondContact OE2-NZ 3.33Å
443	Q	93.5	Very high	95.8	Very high	82 Å²	82	32 Å²	32	38%	0.383	17%	0.165	S	C	.	.	S	Bend	trans	-71.6	143.1	179.1	-56.4	-58.9	-55.5	0	0	111.7	A440 L441 D445 L448 R449	A440-Q443 WeakPolarHBondContact O-CB 3.4Å; A440-Q443 WeakPolarHBondContact O-CG 3.34Å; A440-Q443 PolarHBondContact O-N 3.46Å; A440-Q443 VanDerWaalsContact O-N 3.14Å; L441-Q443 PolarHBondContact O-N 3.48Å; Q443-D445 VanDerWaalsContact C-N 3.3Å; Q443-D445 HydrophobicContact CB-CB 4.39Å; Q443-D445 PolarHBondContact O-N 3.27Å; Q443-L448 HydrophobicContact CB-CD2 4.04Å; Q443-L448 HydrophobicContact CG-CD2 4.13Å; Q443-R449 VanDerWaalsContact O-CZ 3.29Å; Q443-R449 PolarHBondContact O-NE 3.01Å; Q443-R449 PolarHBondContact O-NH2 3.09Å
444	E	91.5	Very high	95.8	Very high	173 Å²	173	32 Å²	32	81%	0.808	17%	0.165	S	C	*	.			trans	-92.2	64.9	173	-55.4	-152.7	137.8	0	0	110.5
445	D	93	Very high	95.8	Very high	14 Å²	14	31.3 Å²	31.3	8%	0.075	16%	0.161	C	C	.	.			trans	-134.5	107.8	-175.5	-172.8	-47.6	0	0	0	109.5	R408 Q443 E447 L448 R449	R408-D445 IonicContact CZ-OD1 3.6Å; R408-D445 IonicContact CZ-OD2 2.81Å; R408-D445 VanDerWaalsContact CZ-OD2 3.22Å; R408-D445 IonicContact NE-OD1 2.64Å; R408-D445 PolarHBondContact NE-OD1 3.14Å; R408-D445 VanDerWaalsContact NE-OD1 3.09Å; R408-D445 IonicContact NE-OD2 3.09Å; R408-D445 PolarHBondContact NE-OD2 2.87Å; R408-D445 IonicContact NH2-OD1 3.68Å; R408-D445 IonicContact NH2-OD2 2.79Å; R408-D445 PolarHBondContact NH2-OD2 2.77Å; Q443-D445 VanDerWaalsContact C-N 3.3Å; Q443-D445 HydrophobicContact CB-CB 4.39Å; Q443-D445 PolarHBondContact O-N 3.27Å; D445-E447 PolarHBondContact OD1-N 3.37Å; D445-L448 HydrophobicContact CB-CB 3.83Å; D445-L448 HydrophobicContact CB-CD2 4.35Å; D445-L448 PolarHBondContact O-N 2.7Å; D445-L448 WeakPolarHBondContact OD1-CB 3.45Å; D445-L448 PolarHBondContact OD1-N 3.24Å; D445-R449 WeakPolarHBondContact O-CB 3.3Å; D445-R449 WeakPolarHBondContact O-CD 3.45Å; D445-R449 WeakPolarHBondContact O-CG 3.38Å; D445-R449 PolarHBondContact O-N 2.97Å
446	D	92.2	Very high	95.8	Very high	53 Å²	53	29.6 Å²	29.6	28%	0.283	14%	0.144	S	C	.	.	H	α-helix	trans	-72.2	-31.6	-173.1	-72.9	-19.1	0	0	0	112.8	R449 K450 I511	D446-R449 PolarHBondContact O-N 3.49Å; D446-R449 IonicContact OD1-NH1 3.16Å; D446-R449 PolarHBondContact OD1-NH1 2.95Å; D446-K450 VanDerWaalsContact O-CB 3.26Å; D446-K450 WeakPolarHBondContact O-CB 3.48Å; D446-K450 PolarHBondContact O-N 3.44Å; D446-I511 HydrophobicContact CB-CD1 3.78Å; D446-I511 VanDerWaalsContact O-CD1 3.31Å; D446-I511 WeakPolarHBondContact O-CD1 3.4Å
447	E	91.6	Very high	95.8	Very high	56 Å²	56	30.3 Å²	30.3	26%	0.262	15%	0.146	S	C	.	.	H	α-helix	trans	-68.2	-41.1	175.5	-72.8	-63.8	109.2	0	0	111.3	R408 D445 K450 N451	R408-E447 HydrophobicContact CG-CB 3.93Å; D445-E447 PolarHBondContact OD1-N 3.37Å; E447-K450 WeakPolarHBondContact O-CB 3.38Å; E447-K450 PolarHBondContact O-N 2.83Å; E447-K450 WeakPolarHBondContact OE1-CE 3.3Å; E447-K450 IonicContact OE1-NZ 2.64Å; E447-K450 PolarHBondContact OE1-NZ 2.88Å; E447-K450 WeakPolarHBondContact OE2-CE 3.48Å; E447-K450 IonicContact OE2-NZ 3.96Å; E447-K450 PolarHBondContact OE2-NZ 2.76Å; E447-N451 PolarHBondContact O-N 3.33Å; E447-N451 VanDerWaalsContact O-N 3.11Å
448	L	95.1	Very high	95.8	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-63.6	-44.3	171	179.9	54.8	0	0	0	111.5	R407 R408 T411 A440 Q443 D445 K450 N451 I452	R407-L448 HydrophobicContact CB-CD1 4.08Å; R407-L448 HydrophobicContact CB-CD2 4.05Å; R408-L448 HydrophobicContact CG-CB 4.45Å; T411-L448 HydrophobicContact CG2-CD1 3.67Å; A440-L448 HydrophobicContact CB-CD2 4.48Å; Q443-L448 HydrophobicContact CB-CD2 4.04Å; Q443-L448 HydrophobicContact CG-CD2 4.13Å; D445-L448 HydrophobicContact CB-CB 3.83Å; D445-L448 HydrophobicContact CB-CD2 4.35Å; D445-L448 PolarHBondContact O-N 2.7Å; D445-L448 WeakPolarHBondContact OD1-CB 3.45Å; D445-L448 PolarHBondContact OD1-N 3.24Å; L448-K450 VanDerWaalsContact C-N 3.33Å; L448-K450 PolarHBondContact O-N 3.46Å; L448-N451 PolarHBondContact O-N 3.39Å; L448-I452 HydrophobicContact CD1-CD1 4.01Å; L448-I452 HydrophobicContact CD1-CG1 4.26Å; L448-I452 HydrophobicContact CG-CD1 3.85Å; L448-I452 VanDerWaalsContact O-CG1 3.25Å; L448-I452 WeakPolarHBondContact O-CG1 3.15Å; L448-I452 PolarHBondContact O-N 3.4Å
449	R	96.3	Very high	95.8	Very high	33 Å²	33	28.6 Å²	28.6	13%	0.125	14%	0.137	C	C	.	.	H	α-helix	trans	-63	-36.8	175.9	-72.3	161.9	177.7	-174.8	-6.6	112.4	L441 Q443 D445 D446 I452 T453 I511	L441-R449 HydrophobicContact CD2-CG 4.45Å; Q443-R449 VanDerWaalsContact O-CZ 3.29Å; Q443-R449 PolarHBondContact O-NE 3.01Å; Q443-R449 PolarHBondContact O-NH2 3.09Å; D445-R449 WeakPolarHBondContact O-CB 3.3Å; D445-R449 WeakPolarHBondContact O-CD 3.45Å; D445-R449 WeakPolarHBondContact O-CG 3.38Å; D445-R449 PolarHBondContact O-N 2.97Å; D446-R449 PolarHBondContact O-N 3.49Å; D446-R449 IonicContact OD1-NH1 3.16Å; D446-R449 PolarHBondContact OD1-NH1 2.95Å; R449-I452 PolarHBondContact O-N 3.32Å; R449-T453 WeakPolarHBondContact O-CB 3.4Å; R449-T453 VanDerWaalsContact O-CG2 3.27Å; R449-T453 WeakPolarHBondContact O-CG2 3.48Å; R449-T453 PolarHBondContact O-N 3.43Å; R449-T453 PolarHBondContact O-OG1 3.19Å; R449-I511 HydrophobicContact CB-CD1 4.07Å; R449-I511 HydrophobicContact CB-CG1 4.31Å; R449-I511 HydrophobicContact CB-CG2 4.36Å
450	K	95.3	Very high	95.8	Very high	17 Å²	17	25.2 Å²	25.2	7%	0.074	12%	0.118	C	C	.	.	H	α-helix	trans	-61.1	-46.8	174.8	-174.1	-179.6	72.3	-177.5	0	110.5	D329 R415 D446 E447 L448 T453 G454 E510 I511	D329-K450 HydrophobicContact CB-CD 4.43Å; D329-K450 WeakPolarHBondContact O-CE 3.33Å; D329-K450 PolarHBondContact O-NZ 3.39Å; R415-K450 PolarHBondContact NH1-O 3.22Å; D446-K450 VanDerWaalsContact O-CB 3.26Å; D446-K450 WeakPolarHBondContact O-CB 3.48Å; D446-K450 PolarHBondContact O-N 3.44Å; E447-K450 WeakPolarHBondContact O-CB 3.38Å; E447-K450 PolarHBondContact O-N 2.83Å; E447-K450 WeakPolarHBondContact OE1-CE 3.3Å; E447-K450 IonicContact OE1-NZ 2.64Å; E447-K450 PolarHBondContact OE1-NZ 2.88Å; E447-K450 WeakPolarHBondContact OE2-CE 3.48Å; E447-K450 IonicContact OE2-NZ 3.96Å; E447-K450 PolarHBondContact OE2-NZ 2.76Å; L448-K450 VanDerWaalsContact C-N 3.33Å; L448-K450 PolarHBondContact O-N 3.46Å; K450-T453 PolarHBondContact O-OG1 2.9Å; K450-T453 VanDerWaalsContact O-OG1 3.05Å; K450-G454 PolarHBondContact O-N 2.96Å; K450-E510 WeakPolarHBondContact CD-OE2 3.45Å; K450-E510 HydrophobicContact CG-CB 4.45Å; K450-E510 HydrophobicContact CG-CG 4.48Å; K450-E510 WeakPolarHBondContact CG-OE1 3.33Å; K450-I511 HydrophobicContact CB-CG1 3.84Å
451	N	96.9	Very high	95.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-68.1	-43.3	176.4	-71.3	-20.2	0	0	0	113.1	R408 T411 G412 E447 L448 T453 G454 I455	R408-N451 PolarHBondContact O-ND2 2.7Å; T411-N451 WeakPolarHBondContact OG1-CB 3.34Å; G412-N451 WeakPolarHBondContact CA-ND2 3.45Å; G412-N451 PolarHBondContact N-ND2 2.97Å; E447-N451 PolarHBondContact O-N 3.33Å; E447-N451 VanDerWaalsContact O-N 3.11Å; L448-N451 PolarHBondContact O-N 3.39Å; N451-T453 PolarHBondContact O-N 2.93Å; N451-G454 PolarHBondContact O-N 3.45Å; N451-I455 VanDerWaalsContact O-CG1 3.3Å; N451-I455 WeakPolarHBondContact O-CG1 3.36Å; N451-I455 PolarHBondContact O-N 2.9Å
452	I	98.1	Very high	95.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.1	-47.9	175	-67.8	162.8	0	0	0	111	L437 A440 L441 L448 R449 I455 L456	L437-I452 HydrophobicContact CB-CG2 4.29Å; L437-I452 HydrophobicContact CD2-CB 4.36Å; L437-I452 HydrophobicContact CD2-CG1 3.81Å; L437-I452 HydrophobicContact CD2-CG2 4.31Å; A440-I452 HydrophobicContact CB-CD1 3.75Å; L441-I452 HydrophobicContact CD2-CB 4.38Å; L441-I452 HydrophobicContact CD2-CD1 4.04Å; L441-I452 HydrophobicContact CD2-CG2 3.81Å; L441-I452 HydrophobicContact CG-CD1 4.29Å; L441-I452 HydrophobicContact CG-CG2 4.04Å; L448-I452 HydrophobicContact CD1-CD1 4.01Å; L448-I452 HydrophobicContact CD1-CG1 4.26Å; L448-I452 HydrophobicContact CG-CD1 3.85Å; L448-I452 VanDerWaalsContact O-CG1 3.25Å; L448-I452 WeakPolarHBondContact O-CG1 3.15Å; L448-I452 PolarHBondContact O-N 3.4Å; R449-I452 PolarHBondContact O-N 3.32Å; I452-I455 WeakPolarHBondContact O-CB 3.48Å; I452-I455 PolarHBondContact O-N 3.47Å; I452-L456 HydrophobicContact CG2-CD1 3.95Å; I452-L456 HydrophobicContact CG2-CG 4.4Å; I452-L456 VanDerWaalsContact O-CG 3.3Å; I452-L456 WeakPolarHBondContact O-CG 3.3Å; I452-L456 PolarHBondContact O-N 3.31Å
453	T	98	Very high	95.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-68	-36.7	-178.8	52.9	0	0	0	0	112.3	R449 K450 N451 L456 W457 L476 I511 T515	R449-T453 WeakPolarHBondContact O-CB 3.4Å; R449-T453 VanDerWaalsContact O-CG2 3.27Å; R449-T453 WeakPolarHBondContact O-CG2 3.48Å; R449-T453 PolarHBondContact O-N 3.43Å; R449-T453 PolarHBondContact O-OG1 3.19Å; K450-T453 PolarHBondContact O-OG1 2.9Å; K450-T453 VanDerWaalsContact O-OG1 3.05Å; N451-T453 PolarHBondContact O-N 2.93Å; T453-L456 PolarHBondContact O-N 3.31Å; T453-W457 PolarHBondContact O-N 3.39Å; T453-L476 HydrophobicContact CG2-CD1 3.98Å; T453-I511 HydrophobicContact CG2-CG2 4.17Å; T453-T515 WeakPolarHBondContact CG2-OG1 3.45Å
454	G	97.6	Very high	95.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62	-43.6	170.3	0	0	0	0	0	113.2	K450 N451 W457 N458	K450-G454 PolarHBondContact O-N 2.96Å; N451-G454 PolarHBondContact O-N 3.45Å; G454-W457 PolarHBondContact O-N 2.97Å; G454-N458 WeakPolarHBondContact O-CB 3.44Å; G454-N458 PolarHBondContact O-N 3.24Å
455	I	98.4	Very high	95.9	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.2	-50	173.5	-73.1	163.8	0	0	0	110.8	M414 R415 I418 L428 L437 N451 I452 W457 N458 L459	M414-I455 HydrophobicContact CB-CD1 4.04Å; M414-I455 HydrophobicContact CG-CD1 4.17Å; R415-I455 HydrophobicContact CB-CG1 3.92Å; I418-I455 HydrophobicContact CD1-CB 4.3Å; I418-I455 HydrophobicContact CD1-CG1 4.37Å; I418-I455 HydrophobicContact CD1-CG2 3.77Å; L428-I455 HydrophobicContact CD2-CG2 3.98Å; L437-I455 HydrophobicContact CD1-CG2 3.55Å; L437-I455 HydrophobicContact CD2-CD1 3.8Å; L437-I455 HydrophobicContact CD2-CG2 4.46Å; N451-I455 VanDerWaalsContact O-CG1 3.3Å; N451-I455 WeakPolarHBondContact O-CG1 3.36Å; N451-I455 PolarHBondContact O-N 2.9Å; I452-I455 WeakPolarHBondContact O-CB 3.48Å; I452-I455 PolarHBondContact O-N 3.47Å; I455-W457 VanDerWaalsContact C-N 3.32Å; I455-W457 PolarHBondContact O-N 3.05Å; I455-N458 PolarHBondContact O-N 3.35Å; I455-L459 HydrophobicContact CG2-CD1 3.73Å; I455-L459 HydrophobicContact CG2-CG 4.31Å; I455-L459 WeakPolarHBondContact O-CG 3.26Å; I455-L459 PolarHBondContact O-N 2.86Å
456	L	98.5	Very high	96	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.4	-41.6	-179.7	-70.7	172.2	0	0	0	111.7	I452 T453 L459 S460 L469 I472 L476 Y518	I452-L456 HydrophobicContact CG2-CD1 3.95Å; I452-L456 HydrophobicContact CG2-CG 4.4Å; I452-L456 VanDerWaalsContact O-CG 3.3Å; I452-L456 WeakPolarHBondContact O-CG 3.3Å; I452-L456 PolarHBondContact O-N 3.31Å; T453-L456 PolarHBondContact O-N 3.31Å; L456-L459 PolarHBondContact O-N 3.46Å; L456-S460 VanDerWaalsContact O-CB 3.31Å; L456-S460 WeakPolarHBondContact O-CB 3.46Å; L456-S460 PolarHBondContact O-N 3.17Å; L456-S460 PolarHBondContact O-OG 2.87Å; L456-L469 HydrophobicContact CD2-CD2 3.82Å; L456-I472 HydrophobicContact CD1-CD1 4.03Å; L456-I472 HydrophobicContact CD1-CG2 4.13Å; L456-I472 HydrophobicContact CD2-CD1 4.17Å; L456-I472 HydrophobicContact CD2-CG2 3.73Å; L456-L476 HydrophobicContact CD1-CD1 4.3Å; L456-L476 HydrophobicContact CD1-CD2 4.04Å; L456-Y518 HydrophobicContact CB-CD2 3.72Å; L456-Y518 HydrophobicContact CB-CE2 4.01Å; L456-Y518 HydrophobicContact CB-CG 4.12Å; L456-Y518 HydrophobicContact CD2-CE2 4.43Å; L456-Y518 WeakPolarHBondContact O-CD2 3.39Å
457	W	97.8	Very high	96.2	Very high	19 Å²	19	25.4 Å²	25.4	7%	0.072	14%	0.141	C	C	.	.	H	α-helix	trans	-62.5	-48	174.4	-169.7	11.7	0	0	0	111.6	V324 T453 G454 I455 L459 S460 A461 H513 N514 G517	V324-W457 HydrophobicContact CB-CH2 4.49Å; V324-W457 HydrophobicContact CB-CZ3 4.1Å; V324-W457 HydrophobicContact CG1-CE3 4.23Å; V324-W457 HydrophobicContact CG1-CH2 3.56Å; V324-W457 HydrophobicContact CG1-CZ3 3.34Å; V324-W457 HydrophobicContact CG2-CD2 4.4Å; V324-W457 HydrophobicContact CG2-CE3 3.65Å; V324-W457 HydrophobicContact CG2-CH2 4.39Å; V324-W457 HydrophobicContact CG2-CZ3 3.66Å; T453-W457 PolarHBondContact O-N 3.39Å; G454-W457 PolarHBondContact O-N 2.97Å; I455-W457 VanDerWaalsContact C-N 3.32Å; I455-W457 PolarHBondContact O-N 3.05Å; W457-L459 VanDerWaalsContact C-N 3.31Å; W457-L459 PolarHBondContact O-N 2.78Å; W457-S460 WeakPolarHBondContact CA-OG 3.43Å; W457-S460 PolarHBondContact O-N 3.43Å; W457-S460 PolarHBondContact O-OG 3.29Å; W457-A461 PolarHBondContact O-N 2.89Å; W457-H513 AromaticContact CH2-CD2 3.8Å; W457-H513 AromaticContact CH2-NE2 3.52Å; W457-H513 AromaticContact CZ3-CD2 3.58Å; W457-H513 AromaticContact CZ3-NE2 3.79Å; W457-N514 HydrophobicContact CE3-CB 4.14Å; W457-N514 WeakPolarHBondContact CZ3-OD1 3.1Å; W457-G517 VanDerWaalsContact CD1-C 3.45Å
458	N	97.8	Very high	96.4	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-59	-37.8	176.4	-84.9	-15.7	0	0	0	112.9	S323 R415 I418 K425 G454 I455	S323-N458 PolarHBondContact OG-OD1 2.93Å; R415-N458 PolarHBondContact O-ND2 3.32Å; R415-N458 VanDerWaalsContact O-ND2 3.15Å; I418-N458 HydrophobicContact CD1-CB 4.11Å; I418-N458 HydrophobicContact CG1-CB 4.15Å; K425-N458 WeakPolarHBondContact CE-O 3.49Å; K425-N458 PolarHBondContact NZ-O 3.43Å; G454-N458 WeakPolarHBondContact O-CB 3.44Å; G454-N458 PolarHBondContact O-N 3.24Å; I455-N458 PolarHBondContact O-N 3.35Å
459	L	98.1	Very high	96.5	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-69.6	-45.4	175	-69.8	169.8	0	0	0	112.1	I418 K425 L428 I429 I455 L456 W457 A461 K462 L469	I418-L459 HydrophobicContact CD1-CD2 4.07Å; I418-L459 HydrophobicContact CD1-CG 3.9Å; K425-L459 HydrophobicContact CB-CD2 3.72Å; K425-L459 HydrophobicContact CD-CD2 4.38Å; K425-L459 HydrophobicContact CG-CD2 3.81Å; L428-L459 HydrophobicContact CD2-CD1 4.08Å; L428-L459 HydrophobicContact CD2-CD2 4.29Å; I429-L459 HydrophobicContact CD1-CD2 4.24Å; I429-L459 HydrophobicContact CG1-CD2 4.46Å; I455-L459 HydrophobicContact CG2-CD1 3.73Å; I455-L459 HydrophobicContact CG2-CG 4.31Å; I455-L459 WeakPolarHBondContact O-CG 3.26Å; I455-L459 PolarHBondContact O-N 2.86Å; L456-L459 PolarHBondContact O-N 3.46Å; W457-L459 VanDerWaalsContact C-N 3.31Å; W457-L459 PolarHBondContact O-N 2.78Å; L459-A461 PolarHBondContact O-N 3.45Å; L459-K462 PolarHBondContact O-N 2.94Å; L459-L469 HydrophobicContact CB-CD1 3.87Å; L459-L469 HydrophobicContact CB-CD2 3.75Å; L459-L469 HydrophobicContact CB-CG 4.38Å; L459-L469 HydrophobicContact CD1-CD2 3.85Å; L459-L469 HydrophobicContact CG-CD2 4.44Å
460	S	97.1	Very high	96.5	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.7	-18.2	-175.2	69.1	0	0	0	0	115.2	L456 W457 K462 K466 N521	L456-S460 VanDerWaalsContact O-CB 3.31Å; L456-S460 WeakPolarHBondContact O-CB 3.46Å; L456-S460 PolarHBondContact O-N 3.17Å; L456-S460 PolarHBondContact O-OG 2.87Å; W457-S460 WeakPolarHBondContact CA-OG 3.43Å; W457-S460 PolarHBondContact O-N 3.43Å; W457-S460 PolarHBondContact O-OG 3.29Å; S460-K462 PolarHBondContact O-N 3.35Å; S460-K466 WeakPolarHBondContact O-CE 3.39Å; S460-N521 WeakPolarHBondContact OG-CB 3.45Å; S460-N521 PolarHBondContact OG-ND2 3.16Å; S460-N521 VanDerWaalsContact OG-ND2 3.09Å
461	A	94.4	Very high	96.5	Very high	42 Å²	42	29.6 Å²	29.6	35%	0.347	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-14.2	176.2	0	0	0	0	0	114.1	W457 L459	W457-A461 PolarHBondContact O-N 2.89Å; L459-A461 PolarHBondContact O-N 3.45Å
462	K	94.6	Very high	96.6	Very high	102 Å²	102	29.6 Å²	29.6	44%	0.443	17%	0.169	S	C	.	.	S	Bend	trans	-110.7	122.3	176.6	-175	71.9	171.6	-171.7	0	110.7	L459 S460 G464 F465	L459-K462 PolarHBondContact O-N 2.94Å; S460-K462 PolarHBondContact O-N 3.35Å; K462-G464 VanDerWaalsContact C-N 3.3Å; K462-G464 PolarHBondContact O-N 3.45Å; K462-F465 HydrophobicContact CB-CD2 3.67Å; K462-F465 HydrophobicContact CB-CE2 3.69Å; K462-F465 HydrophobicContact CB-CG 4.5Å; K462-F465 HydrophobicContact CG-CD2 4.01Å; K462-F465 HydrophobicContact CG-CE2 3.72Å; K462-F465 HydrophobicContact CG-CZ 4.11Å; K462-F465 PolarHBondContact O-N 2.9Å
463	D	92.4	Very high	96.5	Very high	109 Å²	109	29.6 Å²	29.6	58%	0.583	17%	0.169	S	C	*	.	G	3₁₀ helix	trans	-55.9	-39.4	-174.9	-68.5	-52.2	0	0	0	114.4	F465 K466	D463-F465 PolarHBondContact O-N 2.99Å; D463-F465 VanDerWaalsContact O-N 3.09Å; D463-K466 WeakPolarHBondContact O-CB 3.28Å; D463-K466 PolarHBondContact O-N 3.11Å; D463-K466 VanDerWaalsContact O-N 3.12Å; D463-K466 WeakPolarHBondContact OD1-CE 3.39Å; D463-K466 IonicContact OD1-NZ 3.83Å; D463-K466 PolarHBondContact OD1-NZ 3.17Å
464	G	93.9	Very high	96.5	Very high	61 Å²	61	33.1 Å²	33.1	63%	0.629	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-60.3	-20.1	-177.3	0	0	0	0	0	115.1	K462	K462-G464 VanDerWaalsContact C-N 3.3Å; K462-G464 PolarHBondContact O-N 3.45Å
465	F	96.1	Very high	96.4	Very high	20 Å²	20	36.9 Å²	36.9	9%	0.088	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-95.5	-12.5	-179.3	-50.3	-34.9	0	0	0	113.1	K425 Q426 I429 K462 D463 E467 Q468 L469	K425-F465 HydrophobicContact CB-CD2 4.33Å; K425-F465 HydrophobicContact CB-CE2 3.51Å; K425-F465 HydrophobicContact CB-CZ 4.02Å; K425-F465 HydrophobicContact CD-CE2 4.11Å; K425-F465 HydrophobicContact CG-CE2 4.42Å; Q426-F465 HydrophobicContact CG-CE1 3.94Å; Q426-F465 HydrophobicContact CG-CZ 3.72Å; I429-F465 HydrophobicContact CD1-CB 3.71Å; I429-F465 HydrophobicContact CD1-CD1 3.36Å; I429-F465 HydrophobicContact CD1-CD2 3.87Å; I429-F465 HydrophobicContact CD1-CE1 3.91Å; I429-F465 HydrophobicContact CD1-CE2 4.36Å; I429-F465 HydrophobicContact CD1-CG 3.36Å; I429-F465 HydrophobicContact CD1-CZ 4.39Å; K462-F465 HydrophobicContact CB-CD2 3.67Å; K462-F465 HydrophobicContact CB-CE2 3.69Å; K462-F465 HydrophobicContact CB-CG 4.5Å; K462-F465 HydrophobicContact CG-CD2 4.01Å; K462-F465 HydrophobicContact CG-CE2 3.72Å; K462-F465 HydrophobicContact CG-CZ 4.11Å; K462-F465 PolarHBondContact O-N 2.9Å; D463-F465 PolarHBondContact O-N 2.99Å; D463-F465 VanDerWaalsContact O-N 3.09Å; F465-E467 VanDerWaalsContact C-N 3.31Å; F465-E467 PolarHBondContact O-N 3.03Å; F465-Q468 PolarHBondContact O-N 3.32Å; F465-L469 HydrophobicContact CB-CD1 3.98Å; F465-L469 HydrophobicContact CB-CG 4.36Å; F465-L469 WeakPolarHBondContact O-CG 3.46Å; F465-L469 PolarHBondContact O-N 3.28Å
466	K	96.8	Very high	96.4	Very high	8 Å²	8	36.9 Å²	36.9	4%	0.035	21%	0.206	C	C	.	.	H	α-helix	trans	-63.3	-31.5	-172.3	-66.6	178.6	-177.4	170.1	0	113.7	S460 D463 Q468 K470 N521 L522 S524 V529	S460-K466 WeakPolarHBondContact O-CE 3.39Å; D463-K466 WeakPolarHBondContact O-CB 3.28Å; D463-K466 PolarHBondContact O-N 3.11Å; D463-K466 VanDerWaalsContact O-N 3.12Å; D463-K466 WeakPolarHBondContact OD1-CE 3.39Å; D463-K466 IonicContact OD1-NZ 3.83Å; D463-K466 PolarHBondContact OD1-NZ 3.17Å; K466-Q468 VanDerWaalsContact C-N 3.31Å; K466-Q468 PolarHBondContact O-N 2.89Å; K466-K470 PolarHBondContact O-N 3.45Å; K466-N521 WeakPolarHBondContact CE-O 3.29Å; K466-N521 PolarHBondContact NZ-O 3.05Å; K466-N521 VanDerWaalsContact NZ-O 3.09Å; K466-L522 HydrophobicContact CB-CD1 4.18Å; K466-L522 HydrophobicContact CG-CD1 4.49Å; K466-S524 PolarHBondContact NZ-OG 3.3Å; K466-V529 HydrophobicContact CB-CG1 4.47Å; K466-V529 HydrophobicContact CB-CG2 4.1Å
467	E	96	Very high	96.4	Very high	64 Å²	64	37 Å²	37	30%	0.299	21%	0.207	S	C	.	.	H	α-helix	trans	-67.9	-27.4	174.8	-78.4	-70.9	169.8	0	0	113.7	F465 K470 S526 K528 V529	F465-E467 VanDerWaalsContact C-N 3.31Å; F465-E467 PolarHBondContact O-N 3.03Å; E467-K470 WeakPolarHBondContact O-CE 3.38Å; E467-K470 WeakPolarHBondContact O-CG 3.23Å; E467-K470 WeakPolarHBondContact OE2-CE 3.34Å; E467-K470 IonicContact OE2-NZ 3.77Å; E467-K470 PolarHBondContact OE2-NZ 3.05Å; E467-S526 WeakPolarHBondContact OE1-CB 3.31Å; E467-S526 PolarHBondContact OE1-OG 3.48Å; E467-K528 WeakPolarHBondContact OE1-CB 3.41Å; E467-K528 WeakPolarHBondContact OE2-CD 3.37Å; E467-K528 IonicContact OE2-NZ 2.66Å; E467-V529 HydrophobicContact CG-CG2 4.07Å
468	Q	96.2	Very high	96.3	Very high	92 Å²	92	41.3 Å²	41.3	43%	0.43	23%	0.228	S	C	.	.	H	α-helix	trans	-88.5	-44.7	176.1	-67.5	167.7	-31.6	0	0	110.6	I434 F465 K466 K470 T471	I434-Q468 HydrophobicContact CD1-CB 3.83Å; F465-Q468 PolarHBondContact O-N 3.32Å; K466-Q468 VanDerWaalsContact C-N 3.31Å; K466-Q468 PolarHBondContact O-N 2.89Å; Q468-K470 PolarHBondContact O-N 3.1Å; Q468-K470 VanDerWaalsContact O-N 3.16Å; Q468-T471 WeakPolarHBondContact O-CG2 3.48Å; Q468-T471 PolarHBondContact O-N 2.8Å; Q468-T471 VanDerWaalsContact O-N 3.1Å; Q468-T471 PolarHBondContact O-OG1 3.1Å
469	L	97.2	Very high	96.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-56.3	-34.5	-178.9	-73.2	166.7	0	0	0	113.2	I434 L456 L459 F465 T471 I472 Y518 L522	I434-L469 HydrophobicContact CD1-CD2 3.91Å; I434-L469 HydrophobicContact CD1-CG 4.24Å; I434-L469 HydrophobicContact CG1-CD2 4.27Å; L456-L469 HydrophobicContact CD2-CD2 3.82Å; L459-L469 HydrophobicContact CB-CD1 3.87Å; L459-L469 HydrophobicContact CB-CD2 3.75Å; L459-L469 HydrophobicContact CB-CG 4.38Å; L459-L469 HydrophobicContact CD1-CD2 3.85Å; L459-L469 HydrophobicContact CG-CD2 4.44Å; F465-L469 HydrophobicContact CB-CD1 3.98Å; F465-L469 HydrophobicContact CB-CG 4.36Å; F465-L469 WeakPolarHBondContact O-CG 3.46Å; F465-L469 PolarHBondContact O-N 3.28Å; L469-T471 PolarHBondContact O-N 2.66Å; L469-I472 WeakPolarHBondContact O-CG2 3.3Å; L469-I472 PolarHBondContact O-N 2.69Å; L469-Y518 HydrophobicContact CB-CE2 4.18Å; L469-Y518 HydrophobicContact CD1-CE2 4.48Å; L469-Y518 HydrophobicContact CD2-CE2 4.49Å; L469-Y518 PolarHBondContact O-OH 3Å; L469-L522 HydrophobicContact CB-CD1 4.11Å
470	K	95.3	Very high	96.2	Very high	11 Å²	11	43.8 Å²	43.8	5%	0.048	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-59.4	-18.2	179.6	80.3	-169.5	-169.5	173.7	0	114.2	K466 E467 Q468 I472 L473 L522 K528 V529 E532	K466-K470 PolarHBondContact O-N 3.45Å; E467-K470 WeakPolarHBondContact O-CE 3.38Å; E467-K470 WeakPolarHBondContact O-CG 3.23Å; E467-K470 WeakPolarHBondContact OE2-CE 3.34Å; E467-K470 IonicContact OE2-NZ 3.77Å; E467-K470 PolarHBondContact OE2-NZ 3.05Å; Q468-K470 PolarHBondContact O-N 3.1Å; Q468-K470 VanDerWaalsContact O-N 3.16Å; K470-I472 VanDerWaalsContact C-N 3.26Å; K470-I472 PolarHBondContact O-N 3.26Å; K470-L473 WeakPolarHBondContact O-CB 3.49Å; K470-L473 PolarHBondContact O-N 2.79Å; K470-L522 HydrophobicContact CB-CD1 4.27Å; K470-L522 HydrophobicContact CB-CD2 4.45Å; K470-K528 PolarHBondContact NZ-O 3.4Å; K470-V529 HydrophobicContact CD-CG2 4.16Å; K470-E532 HydrophobicContact CB-CG 4.13Å; K470-E532 HydrophobicContact CD-CB 4.03Å; K470-E532 HydrophobicContact CD-CG 3.94Å; K470-E532 WeakPolarHBondContact CE-OE2 3.36Å; K470-E532 HydrophobicContact CG-CG 4.02Å; K470-E532 IonicContact NZ-OE2 3.92Å; K470-E532 PolarHBondContact NZ-OE2 3.26Å; K470-E532 VanDerWaalsContact NZ-OE2 3.16Å
471	T	96.1	Very high	96.2	Very high	92 Å²	92	43.9 Å²	43.9	56%	0.564	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-65.8	-28.2	178.1	61.7	0	0	0	0	112.9	Q468 L469 L473 P474	Q468-T471 WeakPolarHBondContact O-CG2 3.48Å; Q468-T471 PolarHBondContact O-N 2.8Å; Q468-T471 VanDerWaalsContact O-N 3.1Å; Q468-T471 PolarHBondContact O-OG1 3.1Å; L469-T471 PolarHBondContact O-N 2.66Å; T471-L473 VanDerWaalsContact C-N 3.3Å; T471-P474 WeakPolarHBondContact O-CD 3.47Å
472	I	97.4	Very high	96.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-80.8	-10.3	174.5	-162.5	162	0	0	0	112.7	L437 N438 L441 L456 L469 K470 R475 L476	L437-I472 HydrophobicContact CB-CD1 4.07Å; N438-I472 VanDerWaalsContact CA-CD1 3.46Å; N438-I472 HydrophobicContact CB-CB 4.38Å; N438-I472 HydrophobicContact CB-CD1 3.76Å; N438-I472 HydrophobicContact CB-CG1 3.78Å; L441-I472 HydrophobicContact CD1-CD1 3.77Å; L441-I472 HydrophobicContact CD1-CG1 3.7Å; L456-I472 HydrophobicContact CD1-CD1 4.03Å; L456-I472 HydrophobicContact CD1-CG2 4.13Å; L456-I472 HydrophobicContact CD2-CD1 4.17Å; L456-I472 HydrophobicContact CD2-CG2 3.73Å; L469-I472 WeakPolarHBondContact O-CG2 3.3Å; L469-I472 PolarHBondContact O-N 2.69Å; K470-I472 VanDerWaalsContact C-N 3.26Å; K470-I472 PolarHBondContact O-N 3.26Å; I472-R475 PolarHBondContact O-N 2.74Å; I472-L476 WeakPolarHBondContact O-CB 3.44Å; I472-L476 PolarHBondContact O-N 3.12Å
473	L	97.7	Very high	96.5	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-60.4	-42.3	-172.9	-175.6	66.1	0	0	0	114.2	K470 T471 R475 L476 T477 Y518 L519 L522 V533 A536 L539	K470-L473 WeakPolarHBondContact O-CB 3.49Å; K470-L473 PolarHBondContact O-N 2.79Å; T471-L473 VanDerWaalsContact C-N 3.3Å; L473-R475 PolarHBondContact O-N 3.26Å; L473-L476 PolarHBondContact O-N 3.28Å; L473-T477 VanDerWaalsContact O-CB 3.3Å; L473-T477 WeakPolarHBondContact O-CB 3.29Å; L473-T477 PolarHBondContact O-N 2.96Å; L473-T477 PolarHBondContact O-OG1 3.28Å; L473-Y518 HydrophobicContact CD1-CE1 4.26Å; L473-L519 HydrophobicContact CD1-CD2 3.48Å; L473-L519 VanDerWaalsContact CD1-CD2 3.48Å; L473-L522 HydrophobicContact CD1-CD2 4.02Å; L473-L522 HydrophobicContact CD2-CD2 4.03Å; L473-L522 HydrophobicContact CG-CD2 4.43Å; L473-V533 HydrophobicContact CD2-CB 4.14Å; L473-V533 HydrophobicContact CD2-CG1 4.42Å; L473-V533 HydrophobicContact CD2-CG2 3.67Å; L473-A536 HydrophobicContact CD2-CB 3.92Å; L473-A536 HydrophobicContact CG-CB 4.22Å; L473-L539 HydrophobicContact CD1-CD2 3.99Å; L473-L539 HydrophobicContact CD2-CD2 4.19Å; L473-L539 HydrophobicContact CG-CD2 4.34Å
474	P	96.6	Very high	96.6	Very high	74 Å²	74	37.9 Å²	37.9	48%	0.481	21%	0.208	S	C	.	.	H	α-helix	trans	-61.9	-45.6	178.6	-22.5	34.9	0	0	0	111.5	T471 T477 E478	T471-P474 WeakPolarHBondContact O-CD 3.47Å; P474-T477 PolarHBondContact O-N 3.03Å; P474-E478 WeakPolarHBondContact O-CB 3.47Å; P474-E478 PolarHBondContact O-N 3.2Å
475	R	96.9	Very high	96.7	Very high	79 Å²	79	35.2 Å²	35.2	30%	0.298	18%	0.18	S	C	.	.	H	α-helix	trans	-63.4	-46.2	178.7	-170.4	68.1	67.1	179.8	22.5	112	N438 L441 E442 I472 L473 T477 E478 K479	N438-R475 WeakPolarHBondContact OD1-CB 3.48Å; L441-R475 HydrophobicContact CB-CG 3.98Å; L441-R475 HydrophobicContact CD1-CB 4.47Å; L441-R475 HydrophobicContact CD1-CG 4.1Å; E442-R475 IonicContact OE1-CZ 2.65Å; E442-R475 IonicContact OE1-NE 3.06Å; E442-R475 PolarHBondContact OE1-NE 3.36Å; E442-R475 IonicContact OE1-NH1 3.32Å; E442-R475 PolarHBondContact OE1-NH1 3.48Å; E442-R475 IonicContact OE1-NH2 2.73Å; E442-R475 PolarHBondContact OE1-NH2 2.92Å; I472-R475 PolarHBondContact O-N 2.74Å; L473-R475 PolarHBondContact O-N 3.26Å; R475-T477 VanDerWaalsContact C-N 3.31Å; R475-T477 PolarHBondContact O-N 3.13Å; R475-E478 IonicContact NH1-OE2 2.83Å; R475-E478 PolarHBondContact NH1-OE2 3Å; R475-E478 PolarHBondContact O-N 2.98Å; R475-K479 HydrophobicContact CG-CG 4.3Å; R475-K479 WeakPolarHBondContact O-CB 3.4Å; R475-K479 WeakPolarHBondContact O-CG 3.25Å; R475-K479 PolarHBondContact O-N 3.34Å
476	L	97.6	Very high	96.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.7	-36.1	177.8	-171.8	70.6	0	0	0	111.9	L441 T453 L456 I472 L473 V480 V481 T515 Y518	L441-L476 HydrophobicContact CD1-CB 4.21Å; L441-L476 HydrophobicContact CD1-CD1 4Å; L441-L476 HydrophobicContact CD2-CD1 4.26Å; T453-L476 HydrophobicContact CG2-CD1 3.98Å; L456-L476 HydrophobicContact CD1-CD1 4.3Å; L456-L476 HydrophobicContact CD1-CD2 4.04Å; I472-L476 WeakPolarHBondContact O-CB 3.44Å; I472-L476 PolarHBondContact O-N 3.12Å; L473-L476 PolarHBondContact O-N 3.28Å; L476-V480 HydrophobicContact CD1-CB 3.98Å; L476-V480 HydrophobicContact CD1-CG2 3.82Å; L476-V480 WeakPolarHBondContact O-CA 3.37Å; L476-V480 WeakPolarHBondContact O-CB 3.4Å; L476-V480 PolarHBondContact O-N 3.04Å; L476-V481 PolarHBondContact O-N 2.66Å; L476-T515 HydrophobicContact CD2-CG2 4.02Å; L476-T515 HydrophobicContact CG-CG2 4.16Å; L476-Y518 HydrophobicContact CD2-CD1 3.46Å; L476-Y518 VanDerWaalsContact CD2-CD1 3.46Å; L476-Y518 HydrophobicContact CD2-CE1 3.46Å; L476-Y518 VanDerWaalsContact CD2-CE1 3.46Å
477	T	97.8	Very high	96.4	Very high	3 Å²	3	41 Å²	41	2%	0.018	21%	0.21	C	C	.	.	I	π-helix	trans	-64.8	-48	175.6	-58.2	0	0	0	0	110.9	L473 P474 R475 V481 I482 L539	L473-T477 VanDerWaalsContact O-CB 3.3Å; L473-T477 WeakPolarHBondContact O-CB 3.29Å; L473-T477 PolarHBondContact O-N 2.96Å; L473-T477 PolarHBondContact O-OG1 3.28Å; P474-T477 PolarHBondContact O-N 3.03Å; R475-T477 VanDerWaalsContact C-N 3.31Å; R475-T477 PolarHBondContact O-N 3.13Å; T477-V481 PolarHBondContact O-N 3.29Å; T477-I482 HydrophobicContact CG2-CD1 3.99Å; T477-I482 HydrophobicContact CG2-CG1 4.19Å; T477-I482 WeakPolarHBondContact O-CG1 3.47Å; T477-I482 PolarHBondContact O-N 2.98Å; T477-L539 HydrophobicContact CG2-CB 3.78Å; T477-L539 HydrophobicContact CG2-CD1 4.26Å
478	E	97.1	Very high	96.2	Very high	109 Å²	109	39.7 Å²	39.7	51%	0.509	20%	0.204	S	C	.	.	I	π-helix	trans	-64.1	-50.3	178.7	176.7	177.7	-118.3	0	0	113.1	P474 R475 P483	P474-E478 WeakPolarHBondContact O-CB 3.47Å; P474-E478 PolarHBondContact O-N 3.2Å; R475-E478 IonicContact NH1-OE2 2.83Å; R475-E478 PolarHBondContact NH1-OE2 3Å; R475-E478 PolarHBondContact O-N 2.98Å; E478-P483 VanDerWaalsContact O-CD 3.32Å; E478-P483 WeakPolarHBondContact O-CD 3.4Å
479	K	96.8	Very high	95.9	Very high	51 Å²	51	36.7 Å²	36.7	22%	0.222	20%	0.195	C	C	.	.	I	π-helix	trans	-86.7	-23.8	-170.5	-66	-73.4	-171.7	159	0	114.4	E442 R475	E442-K479 WeakPolarHBondContact OE2-CE 3.37Å; E442-K479 IonicContact OE2-NZ 3.14Å; E442-K479 PolarHBondContact OE2-NZ 3.33Å; R475-K479 HydrophobicContact CG-CG 4.3Å; R475-K479 WeakPolarHBondContact O-CB 3.4Å; R475-K479 WeakPolarHBondContact O-CG 3.25Å; R475-K479 PolarHBondContact O-N 3.34Å
480	V	96.6	Very high	95.7	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.012	22%	0.221	C	C	.	.	I	π-helix	trans	-126.8	-55.2	-171.7	-176.9	0	0	0	0	112.5	L441 L476 L484 I511 T515	L441-V480 HydrophobicContact CD2-CG2 4.27Å; L476-V480 HydrophobicContact CD1-CB 3.98Å; L476-V480 HydrophobicContact CD1-CG2 3.82Å; L476-V480 WeakPolarHBondContact O-CA 3.37Å; L476-V480 WeakPolarHBondContact O-CB 3.4Å; L476-V480 PolarHBondContact O-N 3.04Å; V480-L484 HydrophobicContact CG1-CD1 3.79Å; V480-L484 WeakPolarHBondContact O-CB 3.44Å; V480-L484 WeakPolarHBondContact O-CG 3.43Å; V480-L484 PolarHBondContact O-N 3.13Å; V480-L484 VanDerWaalsContact O-N 3.16Å; V480-I511 HydrophobicContact CG1-CG2 3.48Å; V480-I511 VanDerWaalsContact CG1-CG2 3.48Å; V480-T515 HydrophobicContact CG1-CG2 4.36Å
481	V	97.6	Very high	95.4	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	23%	0.225	C	C	.	.	I	π-helix	trans	-65.7	-51.9	-172.9	-173.9	0	0	0	0	111.5	L476 T477 T485 T515 L519 L539	L476-V481 PolarHBondContact O-N 2.66Å; T477-V481 PolarHBondContact O-N 3.29Å; V481-T485 HydrophobicContact CG1-CG2 4.18Å; V481-T485 WeakPolarHBondContact O-CB 3.5Å; V481-T485 VanDerWaalsContact O-CG2 3.29Å; V481-T485 WeakPolarHBondContact O-CG2 3.15Å; V481-T485 PolarHBondContact O-N 3.25Å; V481-T485 PolarHBondContact O-OG1 2.94Å; V481-T515 HydrophobicContact CG2-CG2 3.54Å; V481-L519 HydrophobicContact CG2-CD1 4.03Å; V481-L539 HydrophobicContact CB-CD1 4.39Å; V481-L539 HydrophobicContact CG1-CD1 3.86Å; V481-L539 HydrophobicContact CG2-CD1 4.21Å
482	I	97.4	Very high	95	Very high	58 Å²	58	38.9 Å²	38.9	30%	0.297	20%	0.199	S	C	.	.	H	α-helix	trans	-61.8	-54.1	-177.5	-68.1	165.2	0	0	0	110.7	T477 L484 T485 T486 S542	T477-I482 HydrophobicContact CG2-CD1 3.99Å; T477-I482 HydrophobicContact CG2-CG1 4.19Å; T477-I482 WeakPolarHBondContact O-CG1 3.47Å; T477-I482 PolarHBondContact O-N 2.98Å; I482-L484 PolarHBondContact O-N 3.08Å; I482-T485 PolarHBondContact O-OG1 2.78Å; I482-T486 WeakPolarHBondContact O-CB 3.44Å; I482-T486 PolarHBondContact O-N 3.15Å; I482-T486 PolarHBondContact O-OG1 2.89Å; I482-S542 WeakPolarHBondContact CG1-OG 3.46Å
483	P	96.2	Very high	94.6	Very high	54 Å²	54	42.8 Å²	42.8	35%	0.351	22%	0.217	S	C	.	.	H	α-helix	trans	-60	-47.2	-178.3	-25.8	36.2	0	0	0	113.8	E478 T486 K487	E478-P483 VanDerWaalsContact O-CD 3.32Å; E478-P483 WeakPolarHBondContact O-CD 3.4Å; P483-T486 PolarHBondContact O-N 3.03Å; P483-K487 WeakPolarHBondContact O-CG 3.33Å; P483-K487 PolarHBondContact O-N 3.37Å
484	L	95.2	Very high	94.1	Very high	16 Å²	16	46.2 Å²	46.2	8%	0.084	23%	0.234	C	C	.	.	H	α-helix	trans	-72.2	-37.7	-175.4	-61.5	-176.2	0	0	0	112.2	V480 I482 T486 K487 E488 E508 I511 L512	V480-L484 HydrophobicContact CG1-CD1 3.79Å; V480-L484 WeakPolarHBondContact O-CB 3.44Å; V480-L484 WeakPolarHBondContact O-CG 3.43Å; V480-L484 PolarHBondContact O-N 3.13Å; V480-L484 VanDerWaalsContact O-N 3.16Å; I482-L484 PolarHBondContact O-N 3.08Å; L484-T486 VanDerWaalsContact C-N 3.33Å; L484-K487 HydrophobicContact CD2-CD 4.43Å; L484-K487 PolarHBondContact O-N 2.69Å; L484-E488 WeakPolarHBondContact O-CG 3.27Å; L484-E488 PolarHBondContact O-N 3.26Å; L484-E508 HydrophobicContact CD2-CB 4Å; L484-E508 HydrophobicContact CD2-CG 3.97Å; L484-E508 WeakPolarHBondContact CD2-OE1 3.26Å; L484-I511 HydrophobicContact CD1-CB 4.05Å; L484-I511 HydrophobicContact CD1-CG2 3.66Å; L484-L512 HydrophobicContact CB-CB 4.33Å; L484-L512 HydrophobicContact CB-CD1 4.19Å; L484-L512 HydrophobicContact CB-CD2 4.38Å; L484-L512 HydrophobicContact CD1-CB 3.98Å
485	T	95.3	Very high	93.6	Very high	4 Å²	4	46 Å²	46	3%	0.025	23%	0.228	C	C	.	.	H	α-helix	trans	-69.7	-30.3	174.2	58.5	0	0	0	0	112.8	V481 I482 A489 L512 S542 Y546	V481-T485 HydrophobicContact CG1-CG2 4.18Å; V481-T485 WeakPolarHBondContact O-CB 3.5Å; V481-T485 VanDerWaalsContact O-CG2 3.29Å; V481-T485 WeakPolarHBondContact O-CG2 3.15Å; V481-T485 PolarHBondContact O-N 3.25Å; V481-T485 PolarHBondContact O-OG1 2.94Å; I482-T485 PolarHBondContact O-OG1 2.78Å; T485-A489 PolarHBondContact O-N 2.91Å; T485-A489 VanDerWaalsContact O-N 3.15Å; T485-L512 HydrophobicContact CG2-CD1 4.03Å; T485-S542 VanDerWaalsContact OG1-CB 3.24Å; T485-S542 WeakPolarHBondContact OG1-CB 3.44Å; T485-S542 PolarHBondContact OG1-OG 3.45Å; T485-Y546 HydrophobicContact CG2-CD2 4.29Å; T485-Y546 HydrophobicContact CG2-CG 4.34Å
486	T	94.6	Very high	93	Very high	62 Å²	62	46.4 Å²	46.4	38%	0.38	23%	0.232	S	C	.	.	H	α-helix	trans	-67.5	-45.3	170.6	-63	0	0	0	0	111.5	I482 P483 L484 E488 A489 E490	I482-T486 WeakPolarHBondContact O-CB 3.44Å; I482-T486 PolarHBondContact O-N 3.15Å; I482-T486 PolarHBondContact O-OG1 2.89Å; P483-T486 PolarHBondContact O-N 3.03Å; L484-T486 VanDerWaalsContact C-N 3.33Å; T486-E488 VanDerWaalsContact C-N 3.33Å; T486-E488 PolarHBondContact O-N 3.22Å; T486-A489 WeakPolarHBondContact O-CA 3.27Å; T486-A489 WeakPolarHBondContact O-CB 3.44Å; T486-A489 PolarHBondContact O-N 3.39Å; T486-E490 HydrophobicContact CG2-CG 4.48Å; T486-E490 WeakPolarHBondContact O-CG 3.39Å; T486-E490 PolarHBondContact O-N 3.18Å
487	K	92.5	Very high	92.5	Very high	89 Å²	89	51 Å²	51	39%	0.387	25%	0.254	S	S	.	.	H	α-helix	trans	-57.5	-43.1	174.3	-74.4	-177	179.4	-171.7	0	112.4	P483 L484 A489 E490 K491 E508	P483-K487 WeakPolarHBondContact O-CG 3.33Å; P483-K487 PolarHBondContact O-N 3.37Å; L484-K487 HydrophobicContact CD2-CD 4.43Å; L484-K487 PolarHBondContact O-N 2.69Å; K487-A489 VanDerWaalsContact C-N 3.3Å; K487-A489 PolarHBondContact O-N 3.41Å; K487-E490 PolarHBondContact O-N 3.46Å; K487-K491 WeakPolarHBondContact O-CG 3.41Å; K487-K491 PolarHBondContact O-N 3.06Å; K487-E508 WeakPolarHBondContact CD-OE1 3.45Å; K487-E508 IonicContact NZ-OE1 2.88Å; K487-E508 PolarHBondContact NZ-OE1 2.91Å; K487-E508 IonicContact NZ-OE2 2.67Å
488	E	91.5	Very high	91.7	Very high	35 Å²	35	58.1 Å²	58.1	16%	0.164	29%	0.291	C	S	.	.	H	α-helix	trans	-63.6	-33.7	175.3	-71.8	-62	113.7	0	0	112.8	L484 T486 K491 A492 L512 Y546	L484-E488 WeakPolarHBondContact O-CG 3.27Å; L484-E488 PolarHBondContact O-N 3.26Å; T486-E488 VanDerWaalsContact C-N 3.33Å; T486-E488 PolarHBondContact O-N 3.22Å; E488-K491 WeakPolarHBondContact OE1-CD 3.26Å; E488-K491 WeakPolarHBondContact OE1-CE 3.38Å; E488-K491 IonicContact OE1-NZ 3.23Å; E488-K491 PolarHBondContact OE1-NZ 3Å; E488-A492 WeakPolarHBondContact O-CB 3.2Å; E488-A492 PolarHBondContact O-N 2.91Å; E488-L512 HydrophobicContact CG-CD2 3.87Å; E488-Y546 HydrophobicContact CB-CD2 4.05Å; E488-Y546 HydrophobicContact CB-CE2 4.31Å; E488-Y546 HydrophobicContact CG-CD2 4.22Å; E488-Y546 HydrophobicContact CG-CE2 4.08Å
489	A	91.7	Very high	90.8	Very high	30 Å²	30	59.6 Å²	59.6	25%	0.248	30%	0.296	C	S	.	.	H	α-helix	trans	-71.1	-38.4	173.6	0	0	0	0	0	112.8	T485 T486 K487 A492 E493 S549	T485-A489 PolarHBondContact O-N 2.91Å; T485-A489 VanDerWaalsContact O-N 3.15Å; T486-A489 WeakPolarHBondContact O-CA 3.27Å; T486-A489 WeakPolarHBondContact O-CB 3.44Å; T486-A489 PolarHBondContact O-N 3.39Å; K487-A489 VanDerWaalsContact C-N 3.3Å; K487-A489 PolarHBondContact O-N 3.41Å; A489-A492 WeakPolarHBondContact O-CB 3.42Å; A489-A492 PolarHBondContact O-N 3.09Å; A489-E493 PolarHBondContact O-N 2.84Å; A489-S549 VanDerWaalsContact CA-OG 3.32Å; A489-S549 WeakPolarHBondContact CA-OG 3.4Å; A489-S549 WeakPolarHBondContact CB-OG 3.34Å
490	E	91.4	Very high	89.5	Confident	117 Å²	117	59 Å²	59	55%	0.547	31%	0.305	S	S	.	.	H	α-helix	trans	-65.6	-43.7	174.4	-70.2	172.6	171.5	0	0	111.5	T486 K487 A492 E493 M494	T486-E490 HydrophobicContact CG2-CG 4.48Å; T486-E490 WeakPolarHBondContact O-CG 3.39Å; T486-E490 PolarHBondContact O-N 3.18Å; K487-E490 PolarHBondContact O-N 3.46Å; E490-A492 VanDerWaalsContact C-N 3.31Å; E490-A492 PolarHBondContact O-N 3.21Å; E490-E493 PolarHBondContact O-N 2.81Å; E490-M494 WeakPolarHBondContact O-CG 3.31Å; E490-M494 PolarHBondContact O-N 3.33Å
491	K	88.6	Confident	88.2	Confident	29 Å²	29	65 Å²	65	13%	0.126	34%	0.336	C	S	.	.	H	α-helix	trans	-56.1	-44.4	170.8	-72.3	177.5	-169.2	173.9	0	111.6	K487 E488 E493 M494 I495 D504	K487-K491 WeakPolarHBondContact O-CG 3.41Å; K487-K491 PolarHBondContact O-N 3.06Å; E488-K491 WeakPolarHBondContact OE1-CD 3.26Å; E488-K491 WeakPolarHBondContact OE1-CE 3.38Å; E488-K491 IonicContact OE1-NZ 3.23Å; E488-K491 PolarHBondContact OE1-NZ 3Å; K491-E493 VanDerWaalsContact C-N 3.35Å; K491-E493 PolarHBondContact O-N 2.97Å; K491-M494 PolarHBondContact O-N 3.44Å; K491-I495 VanDerWaalsContact O-CG1 3.29Å; K491-I495 WeakPolarHBondContact O-CG1 3.5Å; K491-I495 PolarHBondContact O-N 2.66Å; K491-D504 WeakPolarHBondContact CE-OD1 3.25Å; K491-D504 IonicContact NZ-OD1 2.68Å; K491-D504 PolarHBondContact NZ-OD1 3.24Å
492	A	88.6	Confident	86.8	Confident	2 Å²	2	66.8 Å²	66.8	2%	0.017	35%	0.35	C	S	.	.	H	α-helix	trans	-61	-41.1	177.6	0	0	0	0	0	112.5	E488 A489 E490 I495 K496 V553	E488-A492 WeakPolarHBondContact O-CB 3.2Å; E488-A492 PolarHBondContact O-N 2.91Å; A489-A492 WeakPolarHBondContact O-CB 3.42Å; A489-A492 PolarHBondContact O-N 3.09Å; E490-A492 VanDerWaalsContact C-N 3.31Å; E490-A492 PolarHBondContact O-N 3.21Å; A492-I495 PolarHBondContact O-N 2.77Å; A492-K496 WeakPolarHBondContact O-CG 3.11Å; A492-K496 PolarHBondContact O-N 3.28Å; A492-V553 HydrophobicContact CB-CG2 3.46Å; A492-V553 VanDerWaalsContact CB-CG2 3.46Å
493	E	88.9	Confident	85.2	Confident	82 Å²	82	69.9 Å²	69.9	38%	0.383	37%	0.374	S	S	.	.	H	α-helix	trans	-65.8	-38.7	173.3	-74.9	-59.1	143.3	0	0	113.2	A489 E490 K491 I495 K496 Q497	A489-E493 PolarHBondContact O-N 2.84Å; E490-E493 PolarHBondContact O-N 2.81Å; K491-E493 VanDerWaalsContact C-N 3.35Å; K491-E493 PolarHBondContact O-N 2.97Å; E493-I495 VanDerWaalsContact C-N 3.34Å; E493-I495 PolarHBondContact O-N 3.35Å; E493-K496 PolarHBondContact O-N 2.89Å; E493-K496 IonicContact OE1-NZ 3.73Å; E493-K496 PolarHBondContact OE1-NZ 3.14Å; E493-Q497 WeakPolarHBondContact O-CB 3.32Å; E493-Q497 VanDerWaalsContact O-CG 3.23Å; E493-Q497 WeakPolarHBondContact O-CG 3.29Å; E493-Q497 PolarHBondContact O-N 3.31Å; E493-Q497 VanDerWaalsContact O-N 3.14Å; E493-Q497 PolarHBondContact O-NE2 2.87Å; E493-Q497 PolarHBondContact OE2-NE2 3.08Å
494	M	87.4	Confident	83.8	Confident	73 Å²	73	71.3 Å²	71.3	36%	0.36	38%	0.379	S	S	.	.	H	α-helix	trans	-63.5	-40.1	174.9	-69.7	-177.1	68	0	0	112.2	E490 K491 Q497 D498 K499	E490-M494 WeakPolarHBondContact O-CG 3.31Å; E490-M494 PolarHBondContact O-N 3.33Å; K491-M494 PolarHBondContact O-N 3.44Å; M494-Q497 PolarHBondContact O-N 2.84Å; M494-D498 PolarHBondContact O-N 3.26Å; M494-K499 PolarHBondContact O-N 3.28Å; M494-K499 VanDerWaalsContact O-N 3.11Å
495	I	86.1	Confident	83	Confident	69 Å²	69	72.9 Å²	72.9	35%	0.354	39%	0.391	S	S	.	.	H	α-helix	trans	-64.3	-46	175.6	-68.1	164.4	0	0	0	111	K491 A492 E493 Q497 D498 I501 V553	K491-I495 VanDerWaalsContact O-CG1 3.29Å; K491-I495 WeakPolarHBondContact O-CG1 3.5Å; K491-I495 PolarHBondContact O-N 2.66Å; A492-I495 PolarHBondContact O-N 2.77Å; E493-I495 VanDerWaalsContact C-N 3.34Å; E493-I495 PolarHBondContact O-N 3.35Å; I495-Q497 PolarHBondContact O-N 3.34Å; I495-D498 PolarHBondContact O-N 3.24Å; I495-I501 HydrophobicContact CG1-CG1 4.23Å; I495-V553 HydrophobicContact CD1-CG1 3.91Å; I495-V553 HydrophobicContact CD1-CG2 4.28Å; I495-V553 HydrophobicContact CG2-CG1 4.36Å
496	K	83.8	Confident	82.3	Confident	89 Å²	89	77.8 Å²	77.8	39%	0.387	42%	0.423	S	S	.	.	H	α-helix	trans	-56.9	-33.3	174.9	-71.7	171.8	-165.6	173.7	0	112.9	A492 E493 E552	A492-K496 WeakPolarHBondContact O-CG 3.11Å; A492-K496 PolarHBondContact O-N 3.28Å; E493-K496 PolarHBondContact O-N 2.89Å; E493-K496 IonicContact OE1-NZ 3.73Å; E493-K496 PolarHBondContact OE1-NZ 3.14Å; K496-E552 WeakPolarHBondContact CE-OE2 3.46Å; K496-E552 IonicContact NZ-OE1 3.36Å; K496-E552 PolarHBondContact NZ-OE1 2.9Å; K496-E552 IonicContact NZ-OE2 3.44Å; K496-E552 PolarHBondContact NZ-OE2 3.37Å
497	Q	86.7	Confident	81.8	Confident	96 Å²	96	75.8 Å²	75.8	45%	0.449	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	4.3	-175	-65.2	173.7	39.8	0	0	113.3	E493 M494 I495 K499	E493-Q497 WeakPolarHBondContact O-CB 3.32Å; E493-Q497 VanDerWaalsContact O-CG 3.23Å; E493-Q497 WeakPolarHBondContact O-CG 3.29Å; E493-Q497 PolarHBondContact O-N 3.31Å; E493-Q497 VanDerWaalsContact O-N 3.14Å; E493-Q497 PolarHBondContact O-NE2 2.87Å; E493-Q497 PolarHBondContact OE2-NE2 3.08Å; M494-Q497 PolarHBondContact O-N 2.84Å; I495-Q497 PolarHBondContact O-N 3.34Å; Q497-K499 HydrophobicContact CB-CD 3.9Å; Q497-K499 HydrophobicContact CB-CG 4.01Å; Q497-K499 PolarHBondContact O-N 3.42Å
498	D	82.6	Confident	81.6	Confident	152 Å²	152	72.9 Å²	72.9	81%	0.813	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	29.9	-176.2	-156.5	26.1	0	0	0	113.7	M494 I495 G500	M494-D498 PolarHBondContact O-N 3.26Å; I495-D498 PolarHBondContact O-N 3.24Å; D498-G500 PolarHBondContact O-N 2.86Å
499	K	78	Confident	81.6	Confident	140 Å²	140	73.8 Å²	73.8	61%	0.609	41%	0.413	S	S	*	.			trans	-85	20.5	-175.8	-75.6	176.7	178.4	171	0	113.7	M494 Q497	M494-K499 PolarHBondContact O-N 3.28Å; M494-K499 VanDerWaalsContact O-N 3.11Å; Q497-K499 HydrophobicContact CB-CD 3.9Å; Q497-K499 HydrophobicContact CB-CG 4.01Å; Q497-K499 PolarHBondContact O-N 3.42Å
500	G	68.6	Low	81.6	Confident	40 Å²	40	74.6 Å²	74.6	41%	0.412	41%	0.411	S	S	.	.			trans	76.8	165	-169.7	0	0	0	0	0	113.1	D498	D498-G500 PolarHBondContact O-N 2.86Å
501	I	69.9	Low	81.9	Confident	127 Å²	127	69.1 Å²	69.1	65%	0.651	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-98.7	121.8	178	-57.7	176.2	0	0	0	107.3	I495	I495-I501 HydrophobicContact CG1-CG1 4.23Å
502	A	67.8	Low	82.2	Confident	38 Å²	38	68.2 Å²	68.2	31%	0.314	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-63.9	133.3	168.1	0	0	0	0	0	108.8	D504	A502-D504 PolarHBondContact O-N 3.12Å
503	P	63	Low	82.6	Confident	123 Å²	123	70.9 Å²	70.9	80%	0.799	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-59.6	127.8	-176	24.5	-33.7	0	0	0	110.7	C505	P503-C505 PolarHBondContact O-N 2.63Å
504	D	67.6	Low	83	Confident	85 Å²	85	67 Å²	67	46%	0.455	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-65.4	121	177.8	-78.9	-42.5	0	0	0	110.1	K491 A502 P506	K491-D504 WeakPolarHBondContact CE-OD1 3.25Å; K491-D504 IonicContact NZ-OD1 2.68Å; K491-D504 PolarHBondContact NZ-OD1 3.24Å; A502-D504 PolarHBondContact O-N 3.12Å; D504-P506 VanDerWaalsContact O-CD 3.31Å; D504-P506 WeakPolarHBondContact O-CD 3.39Å
505	C	78.6	Confident	83.5	Confident	49 Å²	49	63.6 Å²	63.6	33%	0.331	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-75.4	116	170.7	-166.4	0	0	0	0	108.8	P503 S507 E508 A509	P503-C505 PolarHBondContact O-N 2.63Å; C505-S507 VanDerWaalsContact C-N 3.31Å; C505-S507 PolarHBondContact O-N 3.09Å; C505-S507 PolarHBondContact SG-OG 2.98Å; C505-E508 HydrophobicContact CB-CB 4.11Å; C505-E508 HydrophobicContact CB-CG 3.86Å; C505-E508 PolarHBondContact O-N 3.15Å; C505-A509 PolarHBondContact O-N 2.74Å
506	P	79.6	Confident	84.1	Confident	107 Å²	107	60.4 Å²	60.4	70%	0.695	34%	0.343	S	S	*	.	H	α-helix	trans	-65.6	-33.3	-171.8	-24	35.8	0	0	0	113.4	D504 A509 E510	D504-P506 VanDerWaalsContact O-CD 3.31Å; D504-P506 WeakPolarHBondContact O-CD 3.39Å; P506-A509 PolarHBondContact O-N 3.48Å; P506-E510 PolarHBondContact O-N 3.01Å; P506-E510 VanDerWaalsContact O-N 3.09Å
507	S	83.9	Confident	84.7	Confident	20 Å²	20	56.2 Å²	56.2	14%	0.14	33%	0.325	C	S	.	.	H	α-helix	trans	-62.2	-49.5	174.7	51.8	0	0	0	0	111.2	C505 A509 E510 I511	C505-S507 VanDerWaalsContact C-N 3.31Å; C505-S507 PolarHBondContact O-N 3.09Å; C505-S507 PolarHBondContact SG-OG 2.98Å; S507-A509 VanDerWaalsContact C-N 3.27Å; S507-A509 PolarHBondContact O-N 3.45Å; S507-E510 PolarHBondContact O-N 2.7Å; S507-E510 VanDerWaalsContact O-N 3.13Å; S507-I511 WeakPolarHBondContact O-CB 3.24Å; S507-I511 WeakPolarHBondContact O-CD1 3.33Å; S507-I511 WeakPolarHBondContact O-CG1 3.29Å; S507-I511 PolarHBondContact O-N 3.45Å
508	E	90.3	Very high	85.3	Confident	28 Å²	28	51.6 Å²	51.6	13%	0.131	30%	0.303	C	S	.	.	H	α-helix	trans	-56.4	-40.8	176.6	-66.6	-163	124.7	0	0	112.5	L484 K487 C505 L512	L484-E508 HydrophobicContact CD2-CB 4Å; L484-E508 HydrophobicContact CD2-CG 3.97Å; L484-E508 WeakPolarHBondContact CD2-OE1 3.26Å; K487-E508 WeakPolarHBondContact CD-OE1 3.45Å; K487-E508 IonicContact NZ-OE1 2.88Å; K487-E508 PolarHBondContact NZ-OE1 2.91Å; K487-E508 IonicContact NZ-OE2 2.67Å; C505-E508 HydrophobicContact CB-CB 4.11Å; C505-E508 HydrophobicContact CB-CG 3.86Å; C505-E508 PolarHBondContact O-N 3.15Å; E508-L512 WeakPolarHBondContact O-CB 3.34Å; E508-L512 PolarHBondContact O-N 3.17Å
509	A	90.6	Very high	86	Confident	54 Å²	54	44.4 Å²	44.4	45%	0.446	27%	0.265	S	S	.	.	H	α-helix	trans	-64.5	-42.3	177.3	0	0	0	0	0	112.2	C505 P506 S507 H513	C505-A509 PolarHBondContact O-N 2.74Å; P506-A509 PolarHBondContact O-N 3.48Å; S507-A509 VanDerWaalsContact C-N 3.27Å; S507-A509 PolarHBondContact O-N 3.45Å; A509-H513 VanDerWaalsContact O-CB 3.27Å; A509-H513 WeakPolarHBondContact O-CB 3.13Å; A509-H513 PolarHBondContact O-N 3.34Å
510	E	92.3	Very high	87	Confident	47 Å²	47	39.4 Å²	39.4	22%	0.22	24%	0.242	C	C	.	.	H	α-helix	trans	-71.3	-42.4	175.9	-158.7	-157.8	126.1	0	0	112.2	R415 K450 P506 S507 L512 H513 N514	R415-E510 IonicContact CZ-OE1 3.71Å; R415-E510 VanDerWaalsContact CZ-OE1 3.31Å; R415-E510 IonicContact NH1-OE1 3.78Å; R415-E510 PolarHBondContact NH1-OE1 2.94Å; R415-E510 IonicContact NH2-OE1 2.99Å; R415-E510 PolarHBondContact NH2-OE1 2.94Å; K450-E510 WeakPolarHBondContact CD-OE2 3.45Å; K450-E510 HydrophobicContact CG-CB 4.45Å; K450-E510 HydrophobicContact CG-CG 4.48Å; K450-E510 WeakPolarHBondContact CG-OE1 3.33Å; P506-E510 PolarHBondContact O-N 3.01Å; P506-E510 VanDerWaalsContact O-N 3.09Å; S507-E510 PolarHBondContact O-N 2.7Å; S507-E510 VanDerWaalsContact O-N 3.13Å; E510-L512 VanDerWaalsContact C-N 3.3Å; E510-L512 PolarHBondContact O-N 2.94Å; E510-H513 WeakPolarHBondContact O-CB 3.43Å; E510-H513 PolarHBondContact O-N 3.37Å; E510-H513 VanDerWaalsContact O-N 3.12Å; E510-N514 WeakPolarHBondContact O-CB 3.27Å; E510-N514 VanDerWaalsContact O-CG 3.23Å; E510-N514 PolarHBondContact O-N 3.06Å; E510-N514 PolarHBondContact O-ND2 2.97Å; E510-N514 PolarHBondContact OE1-ND2 3.48Å
511	I	96.3	Very high	88.4	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-56	-47	176	-66.6	160	0	0	0	110	D446 R449 K450 T453 V480 L484 S507 T515	D446-I511 HydrophobicContact CB-CD1 3.78Å; D446-I511 VanDerWaalsContact O-CD1 3.31Å; D446-I511 WeakPolarHBondContact O-CD1 3.4Å; R449-I511 HydrophobicContact CB-CD1 4.07Å; R449-I511 HydrophobicContact CB-CG1 4.31Å; R449-I511 HydrophobicContact CB-CG2 4.36Å; K450-I511 HydrophobicContact CB-CG1 3.84Å; T453-I511 HydrophobicContact CG2-CG2 4.17Å; V480-I511 HydrophobicContact CG1-CG2 3.48Å; V480-I511 VanDerWaalsContact CG1-CG2 3.48Å; L484-I511 HydrophobicContact CD1-CB 4.05Å; L484-I511 HydrophobicContact CD1-CG2 3.66Å; S507-I511 WeakPolarHBondContact O-CB 3.24Å; S507-I511 WeakPolarHBondContact O-CD1 3.33Å; S507-I511 WeakPolarHBondContact O-CG1 3.29Å; S507-I511 PolarHBondContact O-N 3.45Å; I511-T515 VanDerWaalsContact O-CB 3.26Å; I511-T515 WeakPolarHBondContact O-CB 3.46Å; I511-T515 PolarHBondContact O-N 3.08Å; I511-T515 PolarHBondContact O-OG1 3.23Å
512	L	96.3	Very high	89.7	Confident	10 Å²	10	32.1 Å²	32.1	5%	0.052	20%	0.195	C	C	.	.	H	α-helix	trans	-64.8	-45.3	175.7	-178.3	58.3	0	0	0	111.2	L484 T485 E488 E508 E510 N514 T515 L516 Y546	L484-L512 HydrophobicContact CB-CB 4.33Å; L484-L512 HydrophobicContact CB-CD1 4.19Å; L484-L512 HydrophobicContact CB-CD2 4.38Å; L484-L512 HydrophobicContact CD1-CB 3.98Å; T485-L512 HydrophobicContact CG2-CD1 4.03Å; E488-L512 HydrophobicContact CG-CD2 3.87Å; E508-L512 WeakPolarHBondContact O-CB 3.34Å; E508-L512 PolarHBondContact O-N 3.17Å; E510-L512 VanDerWaalsContact C-N 3.3Å; E510-L512 PolarHBondContact O-N 2.94Å; L512-N514 PolarHBondContact O-N 2.98Å; L512-T515 PolarHBondContact O-N 3.4Å; L512-L516 HydrophobicContact CD1-CD1 4.09Å; L512-L516 HydrophobicContact CD1-CD2 4.42Å; L512-L516 HydrophobicContact CD1-CG 4Å; L512-L516 HydrophobicContact CG-CD1 4.02Å; L512-L516 HydrophobicContact CG-CG 4.33Å; L512-L516 WeakPolarHBondContact O-CB 3.46Å; L512-L516 VanDerWaalsContact O-CG 3.27Å; L512-L516 WeakPolarHBondContact O-CG 3.41Å; L512-L516 PolarHBondContact O-N 3.27Å; L512-Y546 HydrophobicContact CD2-CD2 4.21Å; L512-Y546 HydrophobicContact CD2-CE2 3.83Å
513	H	95.9	Very high	91.1	Very high	58 Å²	58	30.3 Å²	30.3	27%	0.269	18%	0.18	S	C	.	.	H	α-helix	trans	-57.4	-50.3	178.3	-175.7	87.6	0	0	0	112.5	W457 A509 E510 T515 L516 G517	W457-H513 AromaticContact CH2-CD2 3.8Å; W457-H513 AromaticContact CH2-NE2 3.52Å; W457-H513 AromaticContact CZ3-CD2 3.58Å; W457-H513 AromaticContact CZ3-NE2 3.79Å; A509-H513 VanDerWaalsContact O-CB 3.27Å; A509-H513 WeakPolarHBondContact O-CB 3.13Å; A509-H513 PolarHBondContact O-N 3.34Å; E510-H513 WeakPolarHBondContact O-CB 3.43Å; E510-H513 PolarHBondContact O-N 3.37Å; E510-H513 VanDerWaalsContact O-N 3.12Å; H513-T515 VanDerWaalsContact C-N 3.33Å; H513-T515 PolarHBondContact O-N 3.46Å; H513-L516 PolarHBondContact O-N 3.43Å; H513-G517 PolarHBondContact O-N 2.94Å
514	N	97.2	Very high	92.7	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-61.7	-41.4	177.9	-67.2	-17.9	0	0	0	111.2	W457 E510 L512 G517 Y518	W457-N514 HydrophobicContact CE3-CB 4.14Å; W457-N514 WeakPolarHBondContact CZ3-OD1 3.1Å; E510-N514 WeakPolarHBondContact O-CB 3.27Å; E510-N514 VanDerWaalsContact O-CG 3.23Å; E510-N514 PolarHBondContact O-N 3.06Å; E510-N514 PolarHBondContact O-ND2 2.97Å; E510-N514 PolarHBondContact OE1-ND2 3.48Å; L512-N514 PolarHBondContact O-N 2.98Å; N514-G517 PolarHBondContact O-N 3.05Å; N514-Y518 WeakPolarHBondContact O-CB 3.34Å; N514-Y518 PolarHBondContact O-N 3.24Å
515	T	98.4	Very high	94	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.1	-41.8	176	-59.2	0	0	0	0	112.3	T453 L476 V480 V481 I511 L512 H513 Y518 L519	T453-T515 WeakPolarHBondContact CG2-OG1 3.45Å; L476-T515 HydrophobicContact CD2-CG2 4.02Å; L476-T515 HydrophobicContact CG-CG2 4.16Å; V480-T515 HydrophobicContact CG1-CG2 4.36Å; V481-T515 HydrophobicContact CG2-CG2 3.54Å; I511-T515 VanDerWaalsContact O-CB 3.26Å; I511-T515 WeakPolarHBondContact O-CB 3.46Å; I511-T515 PolarHBondContact O-N 3.08Å; I511-T515 PolarHBondContact O-OG1 3.23Å; L512-T515 PolarHBondContact O-N 3.4Å; H513-T515 VanDerWaalsContact C-N 3.33Å; H513-T515 PolarHBondContact O-N 3.46Å; T515-Y518 WeakPolarHBondContact O-CB 3.33Å; T515-Y518 PolarHBondContact O-N 2.97Å; T515-L519 HydrophobicContact CG2-CD1 4.19Å; T515-L519 VanDerWaalsContact O-CG 3.27Å; T515-L519 WeakPolarHBondContact O-CG 3.44Å; T515-L519 PolarHBondContact O-N 3.37Å
516	L	97.9	Very high	94.7	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-68.5	-35.3	176.4	-68.2	177.7	0	0	0	112	L512 H513 L519 R520 L543 Y546 V564	L512-L516 HydrophobicContact CD1-CD1 4.09Å; L512-L516 HydrophobicContact CD1-CD2 4.42Å; L512-L516 HydrophobicContact CD1-CG 4Å; L512-L516 HydrophobicContact CG-CD1 4.02Å; L512-L516 HydrophobicContact CG-CG 4.33Å; L512-L516 WeakPolarHBondContact O-CB 3.46Å; L512-L516 VanDerWaalsContact O-CG 3.27Å; L512-L516 WeakPolarHBondContact O-CG 3.41Å; L512-L516 PolarHBondContact O-N 3.27Å; H513-L516 PolarHBondContact O-N 3.43Å; L516-L519 HydrophobicContact CD2-CD1 4.31Å; L516-R520 WeakPolarHBondContact O-CB 3.5Å; L516-R520 PolarHBondContact O-N 3.09Å; L516-L543 HydrophobicContact CD2-CD2 3.84Å; L516-Y546 HydrophobicContact CD1-CE1 4.21Å; L516-V564 HydrophobicContact CD1-CG2 3.95Å; L516-V564 HydrophobicContact CD2-CG2 3.53Å; L516-V564 HydrophobicContact CG-CG2 4.3Å
517	G	97.4	Very high	95.5	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-63	-44	170.7	0	0	0	0	0	112.8	W457 H513 N514 N521	W457-G517 VanDerWaalsContact CD1-C 3.45Å; H513-G517 PolarHBondContact O-N 2.94Å; N514-G517 PolarHBondContact O-N 3.05Å; G517-N521 PolarHBondContact O-N 3.06Å; G517-N521 VanDerWaalsContact O-N 3.16Å
518	Y	98.2	Very high	96	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-57.9	-51	172.2	167.6	-108.3	0	0	0	112.4	L456 L469 L473 L476 N514 T515 R520 N521 L522	L456-Y518 HydrophobicContact CB-CD2 3.72Å; L456-Y518 HydrophobicContact CB-CE2 4.01Å; L456-Y518 HydrophobicContact CB-CG 4.12Å; L456-Y518 HydrophobicContact CD2-CE2 4.43Å; L456-Y518 WeakPolarHBondContact O-CD2 3.39Å; L469-Y518 HydrophobicContact CB-CE2 4.18Å; L469-Y518 HydrophobicContact CD1-CE2 4.48Å; L469-Y518 HydrophobicContact CD2-CE2 4.49Å; L469-Y518 PolarHBondContact O-OH 3Å; L473-Y518 HydrophobicContact CD1-CE1 4.26Å; L476-Y518 HydrophobicContact CD2-CD1 3.46Å; L476-Y518 VanDerWaalsContact CD2-CD1 3.46Å; L476-Y518 HydrophobicContact CD2-CE1 3.46Å; L476-Y518 VanDerWaalsContact CD2-CE1 3.46Å; N514-Y518 WeakPolarHBondContact O-CB 3.34Å; N514-Y518 PolarHBondContact O-N 3.24Å; T515-Y518 WeakPolarHBondContact O-CB 3.33Å; T515-Y518 PolarHBondContact O-N 2.97Å; Y518-R520 PolarHBondContact O-N 2.89Å; Y518-N521 PolarHBondContact O-N 3.43Å; Y518-N521 VanDerWaalsContact O-N 3.17Å; Y518-L522 HydrophobicContact CE1-CD2 4.03Å; Y518-L522 WeakPolarHBondContact O-CB 3.45Å; Y518-L522 PolarHBondContact O-N 3.22Å
519	L	98.5	Very high	96.3	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.5	-40.2	-179	-71.2	170.1	0	0	0	112.8	L473 V481 T515 L516 N521 L522 S523 L539 L543 T567	L473-L519 HydrophobicContact CD1-CD2 3.48Å; L473-L519 VanDerWaalsContact CD1-CD2 3.48Å; V481-L519 HydrophobicContact CG2-CD1 4.03Å; T515-L519 HydrophobicContact CG2-CD1 4.19Å; T515-L519 VanDerWaalsContact O-CG 3.27Å; T515-L519 WeakPolarHBondContact O-CG 3.44Å; T515-L519 PolarHBondContact O-N 3.37Å; L516-L519 HydrophobicContact CD2-CD1 4.31Å; L519-N521 VanDerWaalsContact C-N 3.32Å; L519-N521 PolarHBondContact O-N 3.01Å; L519-L522 PolarHBondContact O-N 3.06Å; L519-S523 VanDerWaalsContact O-CB 3.29Å; L519-S523 WeakPolarHBondContact O-CB 3.19Å; L519-S523 PolarHBondContact O-N 2.89Å; L519-S523 PolarHBondContact O-OG 3.17Å; L519-L539 HydrophobicContact CD1-CD1 3.87Å; L519-L539 HydrophobicContact CD2-CD1 4.09Å; L519-L539 HydrophobicContact CD2-CD2 3.99Å; L519-L543 HydrophobicContact CD1-CD2 4.29Å; L519-T567 HydrophobicContact CB-CG2 4.27Å
520	R	98	Very high	96.6	Very high	36 Å²	36	24.5 Å²	24.5	14%	0.136	13%	0.125	C	C	.	.	H	α-helix	trans	-58.2	-44.3	173.4	174	-173	-174	153.1	2.4	112	L516 Y518 S523 E562 S563 C566 T567 N570	L516-R520 WeakPolarHBondContact O-CB 3.5Å; L516-R520 PolarHBondContact O-N 3.09Å; Y518-R520 PolarHBondContact O-N 2.89Å; R520-S523 PolarHBondContact O-OG 2.77Å; R520-S523 VanDerWaalsContact O-OG 3.06Å; R520-E562 IonicContact CZ-OE1 3.74Å; R520-E562 VanDerWaalsContact CZ-OE1 3.23Å; R520-E562 IonicContact NH1-OE1 3.23Å; R520-E562 PolarHBondContact NH1-OE1 3.4Å; R520-E562 IonicContact NH2-OE1 2.87Å; R520-E562 PolarHBondContact NH2-OE1 3.46Å; R520-S563 PolarHBondContact NH1-OG 3.42Å; R520-C566 HydrophobicContact CG-CB 3.85Å; R520-T567 VanDerWaalsContact CA-OG1 3.25Å; R520-T567 WeakPolarHBondContact CA-OG1 3.37Å; R520-T567 PolarHBondContact N-OG1 3.02Å; R520-N570 PolarHBondContact O-ND2 3.38Å; R520-N570 VanDerWaalsContact O-ND2 3.17Å
521	N	97.8	Very high	96.7	Very high	14 Å²	14	27.2 Å²	27.2	8%	0.075	13%	0.134	C	C	.	.	H	α-helix	trans	-71.5	-46.7	178.6	-79.1	-4.4	0	0	0	111.5	S460 K466 G517 Y518 L519 S523 S524	S460-N521 WeakPolarHBondContact OG-CB 3.45Å; S460-N521 PolarHBondContact OG-ND2 3.16Å; S460-N521 VanDerWaalsContact OG-ND2 3.09Å; K466-N521 WeakPolarHBondContact CE-O 3.29Å; K466-N521 PolarHBondContact NZ-O 3.05Å; K466-N521 VanDerWaalsContact NZ-O 3.09Å; G517-N521 PolarHBondContact O-N 3.06Å; G517-N521 VanDerWaalsContact O-N 3.16Å; Y518-N521 PolarHBondContact O-N 3.43Å; Y518-N521 VanDerWaalsContact O-N 3.17Å; L519-N521 VanDerWaalsContact C-N 3.32Å; L519-N521 PolarHBondContact O-N 3.01Å; N521-S523 PolarHBondContact O-N 3.34Å; N521-S524 PolarHBondContact O-N 2.77Å; N521-S524 PolarHBondContact O-OG 2.91Å
522	L	97.9	Very high	96.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-59.8	-47.8	-179.2	-172.1	71.8	0	0	0	112	K466 L469 K470 L473 Y518 L519 S524 G525 V529 V533	K466-L522 HydrophobicContact CB-CD1 4.18Å; K466-L522 HydrophobicContact CG-CD1 4.49Å; L469-L522 HydrophobicContact CB-CD1 4.11Å; K470-L522 HydrophobicContact CB-CD1 4.27Å; K470-L522 HydrophobicContact CB-CD2 4.45Å; L473-L522 HydrophobicContact CD1-CD2 4.02Å; L473-L522 HydrophobicContact CD2-CD2 4.03Å; L473-L522 HydrophobicContact CG-CD2 4.43Å; Y518-L522 HydrophobicContact CE1-CD2 4.03Å; Y518-L522 WeakPolarHBondContact O-CB 3.45Å; Y518-L522 PolarHBondContact O-N 3.22Å; L519-L522 PolarHBondContact O-N 3.06Å; L522-S524 PolarHBondContact O-N 3.35Å; L522-S524 VanDerWaalsContact O-N 3.09Å; L522-G525 PolarHBondContact O-N 3.04Å; L522-V529 HydrophobicContact CD1-CG1 3.77Å; L522-V529 HydrophobicContact CG-CG1 3.77Å; L522-V529 WeakPolarHBondContact O-CG1 3.28Å; L522-V533 HydrophobicContact CD2-CG2 3.71Å; L522-V533 HydrophobicContact CG-CG2 3.99Å
523	S	97.6	Very high	96.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.3	-20	179.6	56.6	0	0	0	0	114.6	L519 R520 N521 G525 R530 N570	L519-S523 VanDerWaalsContact O-CB 3.29Å; L519-S523 WeakPolarHBondContact O-CB 3.19Å; L519-S523 PolarHBondContact O-N 2.89Å; L519-S523 PolarHBondContact O-OG 3.17Å; R520-S523 PolarHBondContact O-OG 2.77Å; R520-S523 VanDerWaalsContact O-OG 3.06Å; N521-S523 PolarHBondContact O-N 3.34Å; S523-G525 VanDerWaalsContact C-N 3.28Å; S523-G525 PolarHBondContact O-N 3.3Å; S523-R530 VanDerWaalsContact O-CG 3.23Å; S523-R530 WeakPolarHBondContact O-CG 2.98Å; S523-N570 PolarHBondContact OG-ND2 3.39Å
524	S	96.4	Very high	96.7	Very high	51 Å²	51	27.8 Å²	27.8	36%	0.357	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	2.8	174.2	70	0	0	0	0	114.7	K466 N521 L522	K466-S524 PolarHBondContact NZ-OG 3.3Å; N521-S524 PolarHBondContact O-N 2.77Å; N521-S524 PolarHBondContact O-OG 2.91Å; L522-S524 PolarHBondContact O-N 3.35Å; L522-S524 VanDerWaalsContact O-N 3.09Å
525	G	94	Very high	96.5	Very high	14 Å²	14	32.6 Å²	32.6	14%	0.144	16%	0.158	C	C	.	.	S	Bend	trans	-74.3	-149.9	-177.2	0	0	0	0	0	115.7	L522 S523 R530	L522-G525 PolarHBondContact O-N 3.04Å; S523-G525 VanDerWaalsContact C-N 3.28Å; S523-G525 PolarHBondContact O-N 3.3Å; G525-R530 PolarHBondContact O-NH1 3.3Å
526	S	95.2	Very high	96.4	Very high	46 Å²	46	33.1 Å²	33.1	32%	0.322	16%	0.163	S	C	.	.			trans	-65.8	170.4	176.2	81.1	0	0	0	0	111.9	E467 K528 V529 R530	E467-S526 WeakPolarHBondContact OE1-CB 3.31Å; E467-S526 PolarHBondContact OE1-OG 3.48Å; S526-K528 VanDerWaalsContact C-N 3.3Å; S526-K528 PolarHBondContact O-N 3.37Å; S526-K528 PolarHBondContact OG-N 2.89Å; S526-K528 VanDerWaalsContact OG-N 3.09Å; S526-V529 PolarHBondContact O-N 3.46Å; S526-V529 WeakPolarHBondContact OG-CG2 3.39Å; S526-V529 PolarHBondContact OG-N 3.45Å; S526-R530 PolarHBondContact O-N 2.89Å
527	E	94.9	Very high	96.4	Very high	75 Å²	75	42.3 Å²	42.3	35%	0.35	20%	0.203	S	C	.	.	H	α-helix	trans	-56.2	-44.8	165.8	171.9	177.6	176.9	0	0	111.9	V529 R530 R531 E578	E527-V529 PolarHBondContact O-N 2.8Å; E527-R530 PolarHBondContact O-N 3.02Å; E527-R531 HydrophobicContact CG-CG 4.4Å; E527-R531 WeakPolarHBondContact O-CG 2.82Å; E527-R531 PolarHBondContact O-N 3.32Å; E527-R531 IonicContact OE1-CZ 3.59Å; E527-R531 VanDerWaalsContact OE1-CZ 3.31Å; E527-R531 IonicContact OE1-NE 2.77Å; E527-R531 PolarHBondContact OE1-NE 2.71Å; E527-R531 VanDerWaalsContact OE1-NE 3.13Å; E527-R531 IonicContact OE1-NH2 2.7Å; E527-R531 PolarHBondContact OE1-NH2 2.96Å; E527-E578 HydrophobicContact CG-CB 4.34Å; E527-E578 HydrophobicContact CG-CG 3.74Å
528	K	94.4	Very high	96.3	Very high	131 Å²	131	42.9 Å²	42.9	57%	0.57	21%	0.209	S	C	*	.	H	α-helix	trans	-69.5	-19.2	-179.3	-168.6	-161.3	169.4	-152.5	0	112.6	E467 K470 S526	E467-K528 WeakPolarHBondContact OE1-CB 3.41Å; E467-K528 WeakPolarHBondContact OE2-CD 3.37Å; E467-K528 IonicContact OE2-NZ 2.66Å; K470-K528 PolarHBondContact NZ-O 3.4Å; S526-K528 VanDerWaalsContact C-N 3.3Å; S526-K528 PolarHBondContact O-N 3.37Å; S526-K528 PolarHBondContact OG-N 2.89Å; S526-K528 VanDerWaalsContact OG-N 3.09Å
529	V	96.8	Very high	96.3	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-80.3	-45.8	164.9	178.9	0	0	0	0	110.3	K466 E467 K470 L522 S526 E527 R531 E532 V533	K466-V529 HydrophobicContact CB-CG1 4.47Å; K466-V529 HydrophobicContact CB-CG2 4.1Å; E467-V529 HydrophobicContact CG-CG2 4.07Å; K470-V529 HydrophobicContact CD-CG2 4.16Å; L522-V529 HydrophobicContact CD1-CG1 3.77Å; L522-V529 HydrophobicContact CG-CG1 3.77Å; L522-V529 WeakPolarHBondContact O-CG1 3.28Å; S526-V529 PolarHBondContact O-N 3.46Å; S526-V529 WeakPolarHBondContact OG-CG2 3.39Å; S526-V529 PolarHBondContact OG-N 3.45Å; E527-V529 PolarHBondContact O-N 2.8Å; V529-R531 PolarHBondContact O-N 2.95Å; V529-E532 WeakPolarHBondContact O-CB 3.28Å; V529-E532 PolarHBondContact O-N 2.7Å; V529-V533 HydrophobicContact CG1-CG2 4.34Å; V529-V533 WeakPolarHBondContact O-CG2 3.32Å; V529-V533 PolarHBondContact O-N 2.95Å; V529-V533 VanDerWaalsContact O-N 3.09Å
530	R	96.8	Very high	96.2	Very high	25 Å²	25	42.9 Å²	42.9	9%	0.094	21%	0.209	C	C	.	.	H	α-helix	trans	-57.9	-44.6	178	-86.5	-169.6	-61	-72	-2.5	113	S523 G525 S526 E527 E532 V533 R534 N570 E578	S523-R530 VanDerWaalsContact O-CG 3.23Å; S523-R530 WeakPolarHBondContact O-CG 2.98Å; G525-R530 PolarHBondContact O-NH1 3.3Å; S526-R530 PolarHBondContact O-N 2.89Å; E527-R530 PolarHBondContact O-N 3.02Å; R530-E532 PolarHBondContact O-N 3.44Å; R530-V533 PolarHBondContact O-N 2.86Å; R530-R534 WeakPolarHBondContact O-CG 3.13Å; R530-R534 PolarHBondContact O-N 3.48Å; R530-N570 VanDerWaalsContact CD-O 3.29Å; R530-N570 WeakPolarHBondContact CD-O 3.36Å; R530-E578 IonicContact CZ-OE1 3.89Å; R530-E578 IonicContact CZ-OE2 3.25Å; R530-E578 IonicContact NE-OE1 3.71Å; R530-E578 PolarHBondContact NE-OE1 3.2Å; R530-E578 IonicContact NE-OE2 3.72Å; R530-E578 PolarHBondContact NE-OE2 3.43Å; R530-E578 IonicContact NH2-OE1 3.96Å; R530-E578 PolarHBondContact NH2-OE1 2.87Å; R530-E578 IonicContact NH2-OE2 2.72Å
531	R	94.9	Very high	96.1	Very high	104 Å²	104	44.1 Å²	44.1	39%	0.392	22%	0.216	S	C	.	.	H	α-helix	trans	-57.9	-48.3	177.3	-65.1	-163	-139.8	150.1	-1.7	111.2	E527 V529 V533 R534 E535	E527-R531 HydrophobicContact CG-CG 4.4Å; E527-R531 WeakPolarHBondContact O-CG 2.82Å; E527-R531 PolarHBondContact O-N 3.32Å; E527-R531 IonicContact OE1-CZ 3.59Å; E527-R531 VanDerWaalsContact OE1-CZ 3.31Å; E527-R531 IonicContact OE1-NE 2.77Å; E527-R531 PolarHBondContact OE1-NE 2.71Å; E527-R531 VanDerWaalsContact OE1-NE 3.13Å; E527-R531 IonicContact OE1-NH2 2.7Å; E527-R531 PolarHBondContact OE1-NH2 2.96Å; V529-R531 PolarHBondContact O-N 2.95Å; R531-V533 VanDerWaalsContact C-N 3.29Å; R531-V533 PolarHBondContact O-N 2.87Å; R531-R534 WeakPolarHBondContact O-CB 3.41Å; R531-R534 PolarHBondContact O-N 3.49Å; R531-E535 WeakPolarHBondContact O-CB 3.03Å; R531-E535 WeakPolarHBondContact O-CG 3.33Å; R531-E535 PolarHBondContact O-N 3.12Å
532	E	95.6	Very high	96.1	Very high	78 Å²	78	44.1 Å²	44.1	36%	0.364	22%	0.217	S	C	.	.	H	α-helix	trans	-52.8	-44.4	174	-153.9	88.3	-131.2	0	0	112.4	K470 V529 R530 E535 A536	K470-E532 HydrophobicContact CB-CG 4.13Å; K470-E532 HydrophobicContact CD-CB 4.03Å; K470-E532 HydrophobicContact CD-CG 3.94Å; K470-E532 WeakPolarHBondContact CE-OE2 3.36Å; K470-E532 HydrophobicContact CG-CG 4.02Å; K470-E532 IonicContact NZ-OE2 3.92Å; K470-E532 PolarHBondContact NZ-OE2 3.26Å; K470-E532 VanDerWaalsContact NZ-OE2 3.16Å; V529-E532 WeakPolarHBondContact O-CB 3.28Å; V529-E532 PolarHBondContact O-N 2.7Å; R530-E532 PolarHBondContact O-N 3.44Å; E532-E535 PolarHBondContact O-N 2.74Å; E532-A536 WeakPolarHBondContact O-CB 2.9Å; E532-A536 PolarHBondContact O-N 2.94Å
533	V	96.9	Very high	96.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-73.9	-25	-179.8	-173.3	0	0	0	0	112.7	L473 L522 V529 R530 R531 L539 L571	L473-V533 HydrophobicContact CD2-CB 4.14Å; L473-V533 HydrophobicContact CD2-CG1 4.42Å; L473-V533 HydrophobicContact CD2-CG2 3.67Å; L522-V533 HydrophobicContact CD2-CG2 3.71Å; L522-V533 HydrophobicContact CG-CG2 3.99Å; V529-V533 HydrophobicContact CG1-CG2 4.34Å; V529-V533 WeakPolarHBondContact O-CG2 3.32Å; V529-V533 PolarHBondContact O-N 2.95Å; V529-V533 VanDerWaalsContact O-N 3.09Å; R530-V533 PolarHBondContact O-N 2.86Å; R531-V533 VanDerWaalsContact C-N 3.29Å; R531-V533 PolarHBondContact O-N 2.87Å; V533-L539 HydrophobicContact CG1-CD2 3.77Å; V533-L571 HydrophobicContact CB-CD2 3.75Å; V533-L571 HydrophobicContact CG1-CD1 4.03Å; V533-L571 HydrophobicContact CG1-CD2 3.62Å; V533-L571 HydrophobicContact CG1-CG 4.38Å
534	R	95.8	Very high	96.2	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.015	22%	0.217	C	C	.	.	H	α-helix	trans	-76.2	-35.8	170.2	-67.4	-176.5	-168.1	109.2	-0.1	112.2	R530 R531 L571 F573 E578 L631 L634	R530-R534 WeakPolarHBondContact O-CG 3.13Å; R530-R534 PolarHBondContact O-N 3.48Å; R531-R534 WeakPolarHBondContact O-CB 3.41Å; R531-R534 PolarHBondContact O-N 3.49Å; R534-L571 HydrophobicContact CG-CB 4.32Å; R534-L571 HydrophobicContact CG-CD2 4.12Å; R534-L571 VanDerWaalsContact CZ-O 3.31Å; R534-L571 PolarHBondContact NE-O 3.19Å; R534-L571 PolarHBondContact NH2-O 2.94Å; R534-F573 PolarHBondContact NH2-O 2.7Å; R534-E578 IonicContact CZ-OE2 2.78Å; R534-E578 VanDerWaalsContact CZ-OE2 3.23Å; R534-E578 VanDerWaalsContact NH1-CB 3.32Å; R534-E578 IonicContact NH1-OE2 2.99Å; R534-E578 PolarHBondContact NH1-OE2 3.08Å; R534-E578 IonicContact NH2-OE2 3.87Å; R534-E578 PolarHBondContact NH2-OE2 3.31Å; R534-L631 HydrophobicContact CB-CB 4.02Å; R534-L631 HydrophobicContact CB-CD1 4.35Å; R534-L634 HydrophobicContact CG-CD1 3.78Å
535	E	93.9	Very high	96.2	Very high	102 Å²	102	43 Å²	43	48%	0.477	21%	0.213	S	C	.	.	H	α-helix	trans	-89.2	-14.1	-173.4	-69.3	165.4	-150.1	0	0	112.8	R531 E532 K537	R531-E535 WeakPolarHBondContact O-CB 3.03Å; R531-E535 WeakPolarHBondContact O-CG 3.33Å; R531-E535 PolarHBondContact O-N 3.12Å; E532-E535 PolarHBondContact O-N 2.74Å; E535-K537 PolarHBondContact O-N 2.96Å
536	A	96.1	Very high	96.3	Very high	11 Å²	11	42.9 Å²	42.9	9%	0.091	21%	0.208	C	C	.	.	S	Bend	trans	-55.1	105.6	171.3	0	0	0	0	0	112.1	L473 E532 G538 L539	L473-A536 HydrophobicContact CD2-CB 3.92Å; L473-A536 HydrophobicContact CG-CB 4.22Å; E532-A536 WeakPolarHBondContact O-CB 2.9Å; E532-A536 PolarHBondContact O-N 2.94Å; A536-G538 PolarHBondContact O-N 2.8Å; A536-L539 HydrophobicContact CB-CB 3.86Å; A536-L539 HydrophobicContact CB-CD2 3.72Å; A536-L539 HydrophobicContact CB-CG 4.46Å; A536-L539 VanDerWaalsContact O-CB 3.25Å; A536-L539 WeakPolarHBondContact O-CB 3.17Å; A536-L539 PolarHBondContact O-N 3.12Å
537	K	96.2	Very high	96.4	Very high	196 Å²	196	40.7 Å²	40.7	85%	0.852	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	119.7	-174.2	-177.8	-173.9	175.2	-168.8	0	112.4	E535 L539	E535-K537 PolarHBondContact O-N 2.96Å; K537-L539 VanDerWaalsContact C-N 3.27Å; K537-L539 PolarHBondContact O-N 3.37Å
538	G	96.1	Very high	96.5	Very high	13 Å²	13	41.4 Å²	41.4	13%	0.134	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.4	-12	178	0	0	0	0	0	115	A536 E541 S542	A536-G538 PolarHBondContact O-N 2.8Å; G538-E541 VanDerWaalsContact C-OE2 3.3Å; G538-E541 WeakPolarHBondContact CA-OE2 3.47Å; G538-E541 PolarHBondContact N-OE2 3.45Å; G538-E541 PolarHBondContact O-N 2.84Å; G538-S542 WeakPolarHBondContact O-CB 3.49Å; G538-S542 PolarHBondContact O-N 2.83Å; G538-S542 PolarHBondContact O-OG 3.23Å
539	L	98.1	Very high	96.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.7	-48.4	-175.2	-179	55	0	0	0	112.1	L473 T477 V481 L519 V533 A536 K537 E541 S542 L543	L473-L539 HydrophobicContact CD1-CD2 3.99Å; L473-L539 HydrophobicContact CD2-CD2 4.19Å; L473-L539 HydrophobicContact CG-CD2 4.34Å; T477-L539 HydrophobicContact CG2-CB 3.78Å; T477-L539 HydrophobicContact CG2-CD1 4.26Å; V481-L539 HydrophobicContact CB-CD1 4.39Å; V481-L539 HydrophobicContact CG1-CD1 3.86Å; V481-L539 HydrophobicContact CG2-CD1 4.21Å; L519-L539 HydrophobicContact CD1-CD1 3.87Å; L519-L539 HydrophobicContact CD2-CD1 4.09Å; L519-L539 HydrophobicContact CD2-CD2 3.99Å; V533-L539 HydrophobicContact CG1-CD2 3.77Å; A536-L539 HydrophobicContact CB-CB 3.86Å; A536-L539 HydrophobicContact CB-CD2 3.72Å; A536-L539 HydrophobicContact CB-CG 4.46Å; A536-L539 VanDerWaalsContact O-CB 3.25Å; A536-L539 WeakPolarHBondContact O-CB 3.17Å; A536-L539 PolarHBondContact O-N 3.12Å; K537-L539 VanDerWaalsContact C-N 3.27Å; K537-L539 PolarHBondContact O-N 3.37Å; L539-E541 VanDerWaalsContact C-N 3.35Å; L539-S542 PolarHBondContact O-N 2.71Å; L539-L543 HydrophobicContact CD1-CD1 4.15Å; L539-L543 HydrophobicContact CD1-CG 4.28Å; L539-L543 HydrophobicContact CG-CD1 4.12Å; L539-L543 VanDerWaalsContact O-CG 3.25Å; L539-L543 WeakPolarHBondContact O-CG 3.45Å; L539-L543 PolarHBondContact O-N 3.07Å
540	V	97.6	Very high	96.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-67.5	-38.9	-178.1	-174.6	0	0	0	0	110.3	L543 V544 L571 W633 L634	V540-L543 PolarHBondContact O-N 2.75Å; V540-V544 WeakPolarHBondContact O-CB 3.48Å; V540-V544 VanDerWaalsContact O-CG2 3.29Å; V540-V544 WeakPolarHBondContact O-CG2 3.41Å; V540-V544 PolarHBondContact O-N 3.41Å; V540-L571 HydrophobicContact CG2-CD1 4.41Å; V540-W633 HydrophobicContact CG1-CB 3.78Å; V540-W633 HydrophobicContact CG1-CG 4.48Å; V540-L634 HydrophobicContact CG1-CD2 4.05Å; V540-L634 HydrophobicContact CG1-CG 4.17Å
541	E	95.9	Very high	96.3	Very high	61 Å²	61	36 Å²	36	29%	0.285	17%	0.173	S	C	.	.	H	α-helix	trans	-62.2	-44.8	174.1	-60.3	97.9	134.9	0	0	112.5	G538 L539 V544 G545 G630	G538-E541 VanDerWaalsContact C-OE2 3.3Å; G538-E541 WeakPolarHBondContact CA-OE2 3.47Å; G538-E541 PolarHBondContact N-OE2 3.45Å; G538-E541 PolarHBondContact O-N 2.84Å; L539-E541 VanDerWaalsContact C-N 3.35Å; E541-V544 PolarHBondContact O-N 3.1Å; E541-G545 PolarHBondContact O-N 3.08Å; E541-G630 WeakPolarHBondContact OE1-CA 3.44Å; E541-G630 PolarHBondContact OE1-N 3.22Å; E541-G630 WeakPolarHBondContact OE2-CA 3.4Å; E541-G630 PolarHBondContact OE2-N 3.19Å
542	S	97.9	Very high	96.2	Very high	14 Å²	14	36.2 Å²	36.2	10%	0.098	18%	0.178	C	C	.	.	H	α-helix	trans	-62.7	-44	176.9	-81.3	0	0	0	0	112.7	I482 T485 G538 L539 G545 Y546	I482-S542 WeakPolarHBondContact CG1-OG 3.46Å; T485-S542 VanDerWaalsContact OG1-CB 3.24Å; T485-S542 WeakPolarHBondContact OG1-CB 3.44Å; T485-S542 PolarHBondContact OG1-OG 3.45Å; G538-S542 WeakPolarHBondContact O-CB 3.49Å; G538-S542 PolarHBondContact O-N 2.83Å; G538-S542 PolarHBondContact O-OG 3.23Å; L539-S542 PolarHBondContact O-N 2.71Å; S542-G545 PolarHBondContact O-N 3.45Å; S542-Y546 WeakPolarHBondContact O-CB 3.4Å; S542-Y546 PolarHBondContact O-N 3.26Å
543	L	98.3	Very high	95.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.6	-43.2	175.1	-69.9	171.2	0	0	0	111.5	L516 L519 L539 V540 L547 V564 T567 L568	L516-L543 HydrophobicContact CD2-CD2 3.84Å; L519-L543 HydrophobicContact CD1-CD2 4.29Å; L539-L543 HydrophobicContact CD1-CD1 4.15Å; L539-L543 HydrophobicContact CD1-CG 4.28Å; L539-L543 HydrophobicContact CG-CD1 4.12Å; L539-L543 VanDerWaalsContact O-CG 3.25Å; L539-L543 WeakPolarHBondContact O-CG 3.45Å; L539-L543 PolarHBondContact O-N 3.07Å; V540-L543 PolarHBondContact O-N 2.75Å; L543-L547 WeakPolarHBondContact O-CB 2.9Å; L543-L547 PolarHBondContact O-N 3.22Å; L543-L547 VanDerWaalsContact O-N 3.16Å; L543-V564 HydrophobicContact CB-CG1 4.11Å; L543-V564 HydrophobicContact CD2-CB 4.4Å; L543-V564 HydrophobicContact CD2-CG1 4.15Å; L543-V564 HydrophobicContact CD2-CG2 3.8Å; L543-V564 WeakPolarHBondContact O-CG1 3.34Å; L543-T567 HydrophobicContact CD1-CG2 3.82Å; L543-L568 HydrophobicContact CB-CD2 4.2Å; L543-L568 HydrophobicContact CD1-CD2 4.46Å
544	V	97.7	Very high	95.7	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.012	20%	0.2	C	C	.	.	H	α-helix	trans	-66.9	-37.5	175.4	165.5	0	0	0	0	112.2	V540 E541 R548 L568 W633 I639 L642	V540-V544 WeakPolarHBondContact O-CB 3.48Å; V540-V544 VanDerWaalsContact O-CG2 3.29Å; V540-V544 WeakPolarHBondContact O-CG2 3.41Å; V540-V544 PolarHBondContact O-N 3.41Å; E541-V544 PolarHBondContact O-N 3.1Å; V544-R548 WeakPolarHBondContact O-CD 3.34Å; V544-R548 VanDerWaalsContact O-CG 3.28Å; V544-R548 WeakPolarHBondContact O-CG 3.22Å; V544-R548 PolarHBondContact O-N 3.04Å; V544-L568 HydrophobicContact CG2-CD2 4.5Å; V544-W633 HydrophobicContact CB-CD2 4.44Å; V544-W633 HydrophobicContact CG1-CD2 3.95Å; V544-W633 HydrophobicContact CG1-CE3 3.77Å; V544-W633 HydrophobicContact CG1-CH2 3.96Å; V544-W633 HydrophobicContact CG1-CZ2 4.14Å; V544-W633 HydrophobicContact CG1-CZ3 3.77Å; V544-W633 HydrophobicContact CG2-CB 4.27Å; V544-W633 HydrophobicContact CG2-CD2 4.24Å; V544-W633 HydrophobicContact CG2-CE3 4.35Å; V544-W633 HydrophobicContact CG2-CG 4.23Å; V544-I639 HydrophobicContact CG2-CD1 3.59Å; V544-L642 HydrophobicContact CG1-CD2 3.89Å; V544-L642 HydrophobicContact CG2-CD2 4.48Å
545	G	96.6	Very high	95.5	Very high	26 Å²	26	40 Å²	40	27%	0.268	21%	0.213	S	C	.	.	H	α-helix	trans	-63.2	-57.2	176.5	0	0	0	0	0	111.8	E541 S542 L547 R548 S549	E541-G545 PolarHBondContact O-N 3.08Å; S542-G545 PolarHBondContact O-N 3.45Å; G545-L547 VanDerWaalsContact C-N 3.25Å; G545-L547 PolarHBondContact O-N 3.4Å; G545-R548 WeakPolarHBondContact O-CA 3.47Å; G545-R548 WeakPolarHBondContact O-CB 3.37Å; G545-R548 PolarHBondContact O-N 3.1Å; G545-S549 PolarHBondContact O-N 3.01Å; G545-S549 PolarHBondContact O-OG 2.85Å
546	Y	97.4	Very high	95.5	Very high	11 Å²	11	35.3 Å²	35.3	4%	0.043	19%	0.191	C	C	.	.	H	α-helix	trans	-54.5	-40.5	176.8	175.5	-88.2	0	0	0	112.6	T485 E488 L512 L516 S542 R548 S549 T550 V564	T485-Y546 HydrophobicContact CG2-CD2 4.29Å; T485-Y546 HydrophobicContact CG2-CG 4.34Å; E488-Y546 HydrophobicContact CB-CD2 4.05Å; E488-Y546 HydrophobicContact CB-CE2 4.31Å; E488-Y546 HydrophobicContact CG-CD2 4.22Å; E488-Y546 HydrophobicContact CG-CE2 4.08Å; L512-Y546 HydrophobicContact CD2-CD2 4.21Å; L512-Y546 HydrophobicContact CD2-CE2 3.83Å; L516-Y546 HydrophobicContact CD1-CE1 4.21Å; S542-Y546 WeakPolarHBondContact O-CB 3.4Å; S542-Y546 PolarHBondContact O-N 3.26Å; Y546-R548 VanDerWaalsContact C-N 3.3Å; Y546-R548 PolarHBondContact O-N 3.27Å; Y546-S549 PolarHBondContact O-N 2.93Å; Y546-T550 HydrophobicContact CD1-CG2 4.19Å; Y546-T550 HydrophobicContact CE1-CG2 3.7Å; Y546-T550 HydrophobicContact CE2-CG2 4.1Å; Y546-T550 WeakPolarHBondContact O-CG2 3.25Å; Y546-T550 PolarHBondContact O-N 3.16Å; Y546-T550 PolarHBondContact O-OG1 3.09Å; Y546-V564 HydrophobicContact CD1-CB 4.45Å; Y546-V564 HydrophobicContact CD1-CG2 3.66Å; Y546-V564 HydrophobicContact CE1-CG2 3.96Å
547	L	97.3	Very high	95.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65.6	-31.1	177.5	-174.8	63.3	0	0	0	113.2	L543 G545 T550 L551 I556 V564 M565 L568 L642 V646	L543-L547 WeakPolarHBondContact O-CB 2.9Å; L543-L547 PolarHBondContact O-N 3.22Å; L543-L547 VanDerWaalsContact O-N 3.16Å; G545-L547 VanDerWaalsContact C-N 3.25Å; G545-L547 PolarHBondContact O-N 3.4Å; L547-T550 WeakPolarHBondContact CA-OG1 3.39Å; L547-T550 PolarHBondContact O-OG1 3.22Å; L547-L551 WeakPolarHBondContact O-CG 3.45Å; L547-L551 PolarHBondContact O-N 3.34Å; L547-I556 HydrophobicContact CD1-CD1 3.66Å; L547-V564 HydrophobicContact CB-CG1 4.12Å; L547-M565 HydrophobicContact CD1-CG 3.87Å; L547-M565 HydrophobicContact CD1-SD 3.9Å; L547-M565 HydrophobicContact CD2-CG 4.33Å; L547-M565 HydrophobicContact CD2-SD 3.3Å; L547-M565 WeakPolarHBondContact CD2-SD 3.4Å; L547-M565 HydrophobicContact CG-SD 4.24Å; L547-L568 HydrophobicContact CD2-CD1 3.86Å; L547-L642 HydrophobicContact CD2-CD1 4.39Å; L547-L642 HydrophobicContact CD2-CD2 3.75Å; L547-L642 HydrophobicContact CD2-CG 3.85Å; L547-L642 HydrophobicContact CG-CD1 4.33Å; L547-L642 HydrophobicContact CG-CD2 4.31Å; L547-L642 HydrophobicContact CG-CG 4.32Å; L547-V646 HydrophobicContact CD1-CG2 3.91Å; L547-V646 HydrophobicContact CD2-CG2 4.15Å; L547-V646 HydrophobicContact CG-CG2 4.14Å
548	R	96.2	Very high	95.2	Very high	90 Å²	90	31.5 Å²	31.5	34%	0.34	17%	0.174	S	C	.	.	H	α-helix	trans	-72.6	-48.5	173.4	-70.8	160.7	167.5	-137.1	-15.9	110.8	V544 G545 Y546 T550 L551 E552 L642	V544-R548 WeakPolarHBondContact O-CD 3.34Å; V544-R548 VanDerWaalsContact O-CG 3.28Å; V544-R548 WeakPolarHBondContact O-CG 3.22Å; V544-R548 PolarHBondContact O-N 3.04Å; G545-R548 WeakPolarHBondContact O-CA 3.47Å; G545-R548 WeakPolarHBondContact O-CB 3.37Å; G545-R548 PolarHBondContact O-N 3.1Å; Y546-R548 VanDerWaalsContact C-N 3.3Å; Y546-R548 PolarHBondContact O-N 3.27Å; R548-T550 VanDerWaalsContact C-N 3.3Å; R548-T550 PolarHBondContact O-N 3.25Å; R548-L551 WeakPolarHBondContact O-CB 3.35Å; R548-L551 PolarHBondContact O-N 2.96Å; R548-L551 VanDerWaalsContact O-N 3.09Å; R548-E552 WeakPolarHBondContact O-CB 3.35Å; R548-E552 VanDerWaalsContact O-CG 3.23Å; R548-E552 WeakPolarHBondContact O-CG 3.37Å; R548-E552 PolarHBondContact O-N 3.24Å; R548-L642 HydrophobicContact CG-CD1 3.63Å; R548-L642 HydrophobicContact CG-CD2 4.23Å
549	S	94.9	Very high	95.1	Very high	12 Å²	12	34.1 Å²	34.1	8%	0.084	18%	0.182	C	C	.	.	H	α-helix	trans	-60.2	-39.3	179	-54.7	0	0	0	0	112.1	A489 G545 Y546 E552 V553	A489-S549 VanDerWaalsContact CA-OG 3.32Å; A489-S549 WeakPolarHBondContact CA-OG 3.4Å; A489-S549 WeakPolarHBondContact CB-OG 3.34Å; G545-S549 PolarHBondContact O-N 3.01Å; G545-S549 PolarHBondContact O-OG 2.85Å; Y546-S549 PolarHBondContact O-N 2.93Å; S549-E552 PolarHBondContact O-N 2.83Å; S549-V553 WeakPolarHBondContact O-CG2 3.25Å; S549-V553 PolarHBondContact O-N 3.23Å; S549-V553 VanDerWaalsContact O-N 3.09Å
550	T	94.5	Very high	94.9	Very high	4 Å²	4	34.4 Å²	34.4	3%	0.025	19%	0.185	C	C	.	.	H	α-helix	trans	-68.4	-36	173.6	47.1	0	0	0	0	113.3	Y546 L547 R548 G554 K555 I556	Y546-T550 HydrophobicContact CD1-CG2 4.19Å; Y546-T550 HydrophobicContact CE1-CG2 3.7Å; Y546-T550 HydrophobicContact CE2-CG2 4.1Å; Y546-T550 WeakPolarHBondContact O-CG2 3.25Å; Y546-T550 PolarHBondContact O-N 3.16Å; Y546-T550 PolarHBondContact O-OG1 3.09Å; L547-T550 WeakPolarHBondContact CA-OG1 3.39Å; L547-T550 PolarHBondContact O-OG1 3.22Å; R548-T550 VanDerWaalsContact C-N 3.3Å; R548-T550 PolarHBondContact O-N 3.25Å; T550-G554 CarbonylContact O-C 3.53Å; T550-G554 PolarHBondContact O-N 3.15Å; T550-K555 HydrophobicContact CG2-CB 4.17Å; T550-K555 WeakPolarHBondContact O-CA 3.39Å; T550-K555 PolarHBondContact O-N 3.2Å; T550-I556 PolarHBondContact O-N 3.4Å
551	L	94.6	Very high	94.8	Very high	29 Å²	29	34.4 Å²	34.4	15%	0.152	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-45.3	169.8	-80.8	168.1	0	0	0	112.2	L547 R548 V553 G554 I556 L642 V646	L547-L551 WeakPolarHBondContact O-CG 3.45Å; L547-L551 PolarHBondContact O-N 3.34Å; R548-L551 WeakPolarHBondContact O-CB 3.35Å; R548-L551 PolarHBondContact O-N 2.96Å; R548-L551 VanDerWaalsContact O-N 3.09Å; L551-V553 VanDerWaalsContact C-N 3.34Å; L551-V553 PolarHBondContact O-N 3Å; L551-G554 PolarHBondContact O-N 2.7Å; L551-G554 VanDerWaalsContact O-N 3.11Å; L551-I556 HydrophobicContact CD2-CB 4Å; L551-I556 HydrophobicContact CD2-CD1 3.98Å; L551-I556 HydrophobicContact CD2-CG1 3.77Å; L551-I556 HydrophobicContact CD2-CG2 4.45Å; L551-I556 HydrophobicContact CG-CD1 4.09Å; L551-I556 HydrophobicContact CG-CG1 4.39Å; L551-L642 HydrophobicContact CD1-CD1 3.51Å; L551-V646 HydrophobicContact CD1-CG2 3.99Å; L551-V646 HydrophobicContact CD2-CG2 4.29Å; L551-V646 HydrophobicContact CG-CG2 4.36Å
552	E	91.7	Very high	94.8	Very high	107 Å²	107	31.8 Å²	31.8	50%	0.5	17%	0.173	S	C	.	.	H	α-helix	trans	-70.7	-27.8	-173.2	-69.8	171.5	137	0	0	113.5	K496 R548 S549	K496-E552 WeakPolarHBondContact CE-OE2 3.46Å; K496-E552 IonicContact NZ-OE1 3.36Å; K496-E552 PolarHBondContact NZ-OE1 2.9Å; K496-E552 IonicContact NZ-OE2 3.44Å; K496-E552 PolarHBondContact NZ-OE2 3.37Å; R548-E552 WeakPolarHBondContact O-CB 3.35Å; R548-E552 VanDerWaalsContact O-CG 3.23Å; R548-E552 WeakPolarHBondContact O-CG 3.37Å; R548-E552 PolarHBondContact O-N 3.24Å; S549-E552 PolarHBondContact O-N 2.83Å
553	V	91.3	Very high	94.8	Very high	44 Å²	44	31.3 Å²	31.3	27%	0.267	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-5.6	172.7	-175.9	0	0	0	0	111.9	A492 I495 S549 L551 K555	A492-V553 HydrophobicContact CB-CG2 3.46Å; A492-V553 VanDerWaalsContact CB-CG2 3.46Å; I495-V553 HydrophobicContact CD1-CG1 3.91Å; I495-V553 HydrophobicContact CD1-CG2 4.28Å; I495-V553 HydrophobicContact CG2-CG1 4.36Å; S549-V553 WeakPolarHBondContact O-CG2 3.25Å; S549-V553 PolarHBondContact O-N 3.23Å; S549-V553 VanDerWaalsContact O-N 3.09Å; L551-V553 VanDerWaalsContact C-N 3.34Å; L551-V553 PolarHBondContact O-N 3Å; V553-K555 VanDerWaalsContact C-N 3.32Å; V553-K555 HydrophobicContact CB-CG 4.38Å; V553-K555 HydrophobicContact CG1-CD 4.13Å; V553-K555 HydrophobicContact CG1-CG 4.03Å
554	G	91.1	Very high	94.8	Very high	55 Å²	55	31.3 Å²	31.3	57%	0.567	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.2	11.3	-176.8	0	0	0	0	0	114.9	T550 L551 I556	T550-G554 CarbonylContact O-C 3.53Å; T550-G554 PolarHBondContact O-N 3.15Å; L551-G554 PolarHBondContact O-N 2.7Å; L551-G554 VanDerWaalsContact O-N 3.11Å; G554-I556 VanDerWaalsContact C-N 3.27Å; G554-I556 PolarHBondContact O-N 2.98Å
555	K	91.7	Very high	94.8	Very high	63 Å²	63	31.2 Å²	31.2	27%	0.274	17%	0.169	S	C	.	.			trans	-81	11.8	179.4	-74	-173.9	155.4	-151	0	114.8	T550 V553 E557 E558	T550-K555 HydrophobicContact CG2-CB 4.17Å; T550-K555 WeakPolarHBondContact O-CA 3.39Å; T550-K555 PolarHBondContact O-N 3.2Å; V553-K555 VanDerWaalsContact C-N 3.32Å; V553-K555 HydrophobicContact CB-CG 4.38Å; V553-K555 HydrophobicContact CG1-CD 4.13Å; V553-K555 HydrophobicContact CG1-CG 4.03Å; K555-E557 PolarHBondContact O-N 2.75Å; K555-E558 HydrophobicContact CB-CG 4.2Å; K555-E558 WeakPolarHBondContact CD-OE1 3.45Å; K555-E558 WeakPolarHBondContact CE-OE1 3.27Å; K555-E558 VanDerWaalsContact CG-OE1 3.28Å; K555-E558 WeakPolarHBondContact CG-OE1 3.38Å; K555-E558 IonicContact NZ-OE1 3.38Å; K555-E558 PolarHBondContact NZ-OE1 3.27Å; K555-E558 IonicContact NZ-OE2 2.85Å; K555-E558 VanDerWaalsContact O-CB 3.32Å; K555-E558 WeakPolarHBondContact O-CB 3.38Å; K555-E558 WeakPolarHBondContact O-CG 3.46Å; K555-E558 PolarHBondContact O-N 3.31Å
556	I	95.1	Very high	94.9	Very high	3 Å²	3	30.9 Å²	30.9	2%	0.015	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-20.3	-173.1	-171	58.6	0	0	0	114.8	L547 T550 L551 G554 E558 A561 V646 S649 C650 T656	L547-I556 HydrophobicContact CD1-CD1 3.66Å; T550-I556 PolarHBondContact O-N 3.4Å; L551-I556 HydrophobicContact CD2-CB 4Å; L551-I556 HydrophobicContact CD2-CD1 3.98Å; L551-I556 HydrophobicContact CD2-CG1 3.77Å; L551-I556 HydrophobicContact CD2-CG2 4.45Å; L551-I556 HydrophobicContact CG-CD1 4.09Å; L551-I556 HydrophobicContact CG-CG1 4.39Å; G554-I556 VanDerWaalsContact C-N 3.27Å; G554-I556 PolarHBondContact O-N 2.98Å; I556-E558 VanDerWaalsContact C-N 3.31Å; I556-A561 HydrophobicContact CD1-CB 4.05Å; I556-A561 WeakPolarHBondContact O-CB 3.27Å; I556-V646 HydrophobicContact CD1-CB 4.38Å; I556-V646 HydrophobicContact CD1-CG1 4.01Å; I556-V646 HydrophobicContact CD1-CG2 3.8Å; I556-V646 HydrophobicContact CG1-CG1 4.18Å; I556-V646 HydrophobicContact CG1-CG2 4.48Å; I556-S649 VanDerWaalsContact CG2-O 3.29Å; I556-S649 WeakPolarHBondContact CG2-O 3.48Å; I556-C650 HydrophobicContact CG1-CB 4.18Å; I556-C650 HydrophobicContact CG2-CB 4.29Å; I556-T656 HydrophobicContact CD1-CG2 4.21Å; I556-T656 HydrophobicContact CG1-CG2 4.4Å
557	E	93.4	Very high	95	Very high	53 Å²	53	30.3 Å²	30.3	25%	0.248	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-17.1	176.9	-57.2	-69.1	-168.2	0	0	113.3	K555 C650 E651 I652 N653	K555-E557 PolarHBondContact O-N 2.75Å; E557-C650 PolarHBondContact OE2-SG 3.33Å; E557-E651 PolarHBondContact OE1-N 2.82Å; E557-I652 PolarHBondContact OE1-N 2.8Å; E557-N653 PolarHBondContact O-ND2 2.81Å; E557-N653 VanDerWaalsContact O-ND2 3.07Å; E557-N653 WeakPolarHBondContact OE2-CA 3.46Å; E557-N653 WeakPolarHBondContact OE2-CB 3.22Å; E557-N653 PolarHBondContact OE2-N 3.45Å
558	E	92.8	Very high	95	Very high	75 Å²	75	30.3 Å²	30.3	35%	0.35	16%	0.16	S	C	.	.	S	Bend	trans	-65.8	153.5	-174	-68.6	-177.3	179.2	0	0	113.7	K555 I556 G560 A561 E562	K555-E558 HydrophobicContact CB-CG 4.2Å; K555-E558 WeakPolarHBondContact CD-OE1 3.45Å; K555-E558 WeakPolarHBondContact CE-OE1 3.27Å; K555-E558 VanDerWaalsContact CG-OE1 3.28Å; K555-E558 WeakPolarHBondContact CG-OE1 3.38Å; K555-E558 IonicContact NZ-OE1 3.38Å; K555-E558 PolarHBondContact NZ-OE1 3.27Å; K555-E558 IonicContact NZ-OE2 2.85Å; K555-E558 VanDerWaalsContact O-CB 3.32Å; K555-E558 WeakPolarHBondContact O-CB 3.38Å; K555-E558 WeakPolarHBondContact O-CG 3.46Å; K555-E558 PolarHBondContact O-N 3.31Å; I556-E558 VanDerWaalsContact C-N 3.31Å; E558-G560 PolarHBondContact O-N 3.4Å; E558-A561 WeakPolarHBondContact O-CB 3.42Å; E558-A561 PolarHBondContact O-N 3.07Å; E558-A561 VanDerWaalsContact O-N 3.08Å; E558-E562 PolarHBondContact O-N 2.7Å; E558-E562 VanDerWaalsContact O-N 3.09Å
559	K	92.2	Very high	95.1	Very high	67 Å²	67	27.6 Å²	27.6	29%	0.291	15%	0.15	S	C	.	.	H	α-helix	trans	-65.7	-23.6	-175.7	-167.1	57.4	164.1	-172.2	0	114	E562 S563	K559-E562 HydrophobicContact CD-CB 4.3Å; K559-E562 WeakPolarHBondContact CD-OE2 3.19Å; K559-E562 IonicContact NZ-OE1 2.71Å; K559-E562 PolarHBondContact NZ-OE1 2.67Å; K559-E562 IonicContact NZ-OE2 2.74Å; K559-E562 PolarHBondContact NZ-OE2 3.06Å; K559-S563 WeakPolarHBondContact O-CB 3.47Å; K559-S563 PolarHBondContact O-N 3.4Å; K559-S563 VanDerWaalsContact O-N 3.15Å; K559-S563 PolarHBondContact O-OG 3.45Å
560	G	94.3	Very high	95.3	Very high	6 Å²	6	28.8 Å²	28.8	6%	0.062	16%	0.155	C	C	.	.	H	α-helix	trans	-64.5	-50.6	170	0	0	0	0	0	111.3	E558 E562 S563 V564	E558-G560 PolarHBondContact O-N 3.4Å; G560-E562 PolarHBondContact O-N 3.26Å; G560-S563 PolarHBondContact O-N 3.22Å; G560-S563 VanDerWaalsContact O-N 3.08Å; G560-V564 WeakPolarHBondContact O-CG2 3.46Å; G560-V564 PolarHBondContact O-N 3.2Å
561	A	96.3	Very high	95.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.6	-40.1	176.5	0	0	0	0	0	112.9	I556 E558 S563 V564 M565	I556-A561 HydrophobicContact CD1-CB 4.05Å; I556-A561 WeakPolarHBondContact O-CB 3.27Å; E558-A561 WeakPolarHBondContact O-CB 3.42Å; E558-A561 PolarHBondContact O-N 3.07Å; E558-A561 VanDerWaalsContact O-N 3.08Å; A561-S563 VanDerWaalsContact C-N 3.29Å; A561-S563 PolarHBondContact O-N 2.95Å; A561-V564 PolarHBondContact O-N 3.03Å; A561-M565 WeakPolarHBondContact O-CB 3.36Å; A561-M565 WeakPolarHBondContact O-CG 3.34Å; A561-M565 PolarHBondContact O-N 2.96Å
562	E	96.4	Very high	95.5	Very high	6 Å²	6	27.2 Å²	27.2	3%	0.028	15%	0.147	C	C	.	.	H	α-helix	trans	-56	-44.3	171.7	-169.7	-159.5	120.7	0	0	111.6	R520 E558 K559 G560 M565 C566 L655 T656	R520-E562 IonicContact CZ-OE1 3.74Å; R520-E562 VanDerWaalsContact CZ-OE1 3.23Å; R520-E562 IonicContact NH1-OE1 3.23Å; R520-E562 PolarHBondContact NH1-OE1 3.4Å; R520-E562 IonicContact NH2-OE1 2.87Å; R520-E562 PolarHBondContact NH2-OE1 3.46Å; E558-E562 PolarHBondContact O-N 2.7Å; E558-E562 VanDerWaalsContact O-N 3.09Å; K559-E562 HydrophobicContact CD-CB 4.3Å; K559-E562 WeakPolarHBondContact CD-OE2 3.19Å; K559-E562 IonicContact NZ-OE1 2.71Å; K559-E562 PolarHBondContact NZ-OE1 2.67Å; K559-E562 IonicContact NZ-OE2 2.74Å; K559-E562 PolarHBondContact NZ-OE2 3.06Å; G560-E562 PolarHBondContact O-N 3.26Å; E562-M565 PolarHBondContact O-N 3.49Å; E562-C566 WeakPolarHBondContact O-CB 3.35Å; E562-C566 PolarHBondContact O-N 3.26Å; E562-C566 PolarHBondContact O-SG 3.11Å; E562-C566 VanDerWaalsContact O-SG 3.35Å; E562-L655 HydrophobicContact CG-CB 3.76Å; E562-T656 VanDerWaalsContact CA-OG1 3.28Å; E562-T656 WeakPolarHBondContact CA-OG1 3.1Å; E562-T656 WeakPolarHBondContact CB-OG1 3.23Å
563	S	97.3	Very high	95.8	Very high	5 Å²	5	26.5 Å²	26.5	4%	0.035	14%	0.142	C	C	.	.	H	α-helix	trans	-74.7	-37.1	-175.4	-58	0	0	0	0	112.2	R520 K559 G560 A561 T567	R520-S563 PolarHBondContact NH1-OG 3.42Å; K559-S563 WeakPolarHBondContact O-CB 3.47Å; K559-S563 PolarHBondContact O-N 3.4Å; K559-S563 VanDerWaalsContact O-N 3.15Å; K559-S563 PolarHBondContact O-OG 3.45Å; G560-S563 PolarHBondContact O-N 3.22Å; G560-S563 VanDerWaalsContact O-N 3.08Å; A561-S563 VanDerWaalsContact C-N 3.29Å; A561-S563 PolarHBondContact O-N 2.95Å; S563-T567 WeakPolarHBondContact O-CB 3.28Å; S563-T567 PolarHBondContact O-N 3.14Å; S563-T567 PolarHBondContact O-OG1 3.14Å
564	V	98.4	Very high	95.9	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.6	-48	168.8	171.3	0	0	0	0	110.9	L516 L543 Y546 L547 G560 A561 C566 T567 L568	L516-V564 HydrophobicContact CD1-CG2 3.95Å; L516-V564 HydrophobicContact CD2-CG2 3.53Å; L516-V564 HydrophobicContact CG-CG2 4.3Å; L543-V564 HydrophobicContact CB-CG1 4.11Å; L543-V564 HydrophobicContact CD2-CB 4.4Å; L543-V564 HydrophobicContact CD2-CG1 4.15Å; L543-V564 HydrophobicContact CD2-CG2 3.8Å; L543-V564 WeakPolarHBondContact O-CG1 3.34Å; Y546-V564 HydrophobicContact CD1-CB 4.45Å; Y546-V564 HydrophobicContact CD1-CG2 3.66Å; Y546-V564 HydrophobicContact CE1-CG2 3.96Å; L547-V564 HydrophobicContact CB-CG1 4.12Å; G560-V564 WeakPolarHBondContact O-CG2 3.46Å; G560-V564 PolarHBondContact O-N 3.2Å; A561-V564 PolarHBondContact O-N 3.03Å; V564-C566 PolarHBondContact O-N 3.43Å; V564-T567 WeakPolarHBondContact O-CB 3.32Å; V564-T567 PolarHBondContact O-N 2.72Å; V564-T567 VanDerWaalsContact O-N 3.12Å; V564-L568 HydrophobicContact CG1-CD1 3.99Å; V564-L568 HydrophobicContact CG1-CG 4.39Å; V564-L568 WeakPolarHBondContact O-CG 3.49Å; V564-L568 PolarHBondContact O-N 3.37Å
565	M	98	Very high	96	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.6	-40	179.4	-81.7	-55.2	-38	0	0	113	L547 A561 E562 T567 L568 R569 Y643 V646 T656 A659 A660	L547-M565 HydrophobicContact CD1-CG 3.87Å; L547-M565 HydrophobicContact CD1-SD 3.9Å; L547-M565 HydrophobicContact CD2-CG 4.33Å; L547-M565 HydrophobicContact CD2-SD 3.3Å; L547-M565 WeakPolarHBondContact CD2-SD 3.4Å; L547-M565 HydrophobicContact CG-SD 4.24Å; A561-M565 WeakPolarHBondContact O-CB 3.36Å; A561-M565 WeakPolarHBondContact O-CG 3.34Å; A561-M565 PolarHBondContact O-N 2.96Å; E562-M565 PolarHBondContact O-N 3.49Å; M565-T567 VanDerWaalsContact C-N 3.35Å; M565-L568 PolarHBondContact O-N 2.95Å; M565-R569 WeakPolarHBondContact O-CB 3.37Å; M565-R569 PolarHBondContact O-N 2.95Å; M565-Y643 HydrophobicContact CE-CD1 3.67Å; M565-Y643 HydrophobicContact CE-CE1 3.72Å; M565-Y643 HydrophobicContact SD-CD1 4.07Å; M565-Y643 HydrophobicContact SD-CE1 4.18Å; M565-V646 HydrophobicContact CG-CG1 4.19Å; M565-V646 HydrophobicContact SD-CG1 4.25Å; M565-V646 HydrophobicContact SD-CG2 4.03Å; M565-T656 HydrophobicContact CB-CG2 4.26Å; M565-T656 HydrophobicContact CG-CG2 3.81Å; M565-A659 HydrophobicContact CB-CB 3.85Å; M565-A660 HydrophobicContact CE-CB 3.66Å
566	C	98.1	Very high	95.9	Very high	18 Å²	18	23.8 Å²	23.8	12%	0.122	11%	0.111	C	C	.	.	H	α-helix	trans	-62.8	-40.9	171.9	-76.4	0	0	0	0	112.1	R520 E562 V564 R569 N570	R520-C566 HydrophobicContact CG-CB 3.85Å; E562-C566 WeakPolarHBondContact O-CB 3.35Å; E562-C566 PolarHBondContact O-N 3.26Å; E562-C566 PolarHBondContact O-SG 3.11Å; E562-C566 VanDerWaalsContact O-SG 3.35Å; V564-C566 PolarHBondContact O-N 3.43Å; C566-R569 PolarHBondContact O-N 3.28Å; C566-N570 PolarHBondContact O-N 3.14Å; C566-N570 PolarHBondContact O-ND2 3.29Å; C566-N570 PolarHBondContact O-OD1 2.84Å
567	T	98.6	Very high	95.7	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.3	-50.7	175.8	-56	0	0	0	0	110.7	L519 R520 L543 S563 V564 M565 R569 N570 L571	L519-T567 HydrophobicContact CB-CG2 4.27Å; R520-T567 VanDerWaalsContact CA-OG1 3.25Å; R520-T567 WeakPolarHBondContact CA-OG1 3.37Å; R520-T567 PolarHBondContact N-OG1 3.02Å; L543-T567 HydrophobicContact CD1-CG2 3.82Å; S563-T567 WeakPolarHBondContact O-CB 3.28Å; S563-T567 PolarHBondContact O-N 3.14Å; S563-T567 PolarHBondContact O-OG1 3.14Å; V564-T567 WeakPolarHBondContact O-CB 3.32Å; V564-T567 PolarHBondContact O-N 2.72Å; V564-T567 VanDerWaalsContact O-N 3.12Å; M565-T567 VanDerWaalsContact C-N 3.35Å; T567-R569 PolarHBondContact O-N 2.93Å; T567-N570 WeakPolarHBondContact O-CB 3.5Å; T567-N570 PolarHBondContact O-N 3.21Å; T567-N570 VanDerWaalsContact O-N 3.09Å; T567-L571 HydrophobicContact CG2-CD1 4.31Å; T567-L571 WeakPolarHBondContact O-CG 3.37Å; T567-L571 PolarHBondContact O-N 3.15Å
568	L	98.6	Very high	95.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.7	-41.2	178.8	-67.9	175.5	0	0	0	112.1	L543 V544 L547 V564 M565 N570 L571 S572 L634 Y643	L543-L568 HydrophobicContact CB-CD2 4.2Å; L543-L568 HydrophobicContact CD1-CD2 4.46Å; V544-L568 HydrophobicContact CG2-CD2 4.5Å; L547-L568 HydrophobicContact CD2-CD1 3.86Å; V564-L568 HydrophobicContact CG1-CD1 3.99Å; V564-L568 HydrophobicContact CG1-CG 4.39Å; V564-L568 WeakPolarHBondContact O-CG 3.49Å; V564-L568 PolarHBondContact O-N 3.37Å; M565-L568 PolarHBondContact O-N 2.95Å; L568-N570 VanDerWaalsContact C-N 3.32Å; L568-N570 PolarHBondContact O-N 3.16Å; L568-L571 PolarHBondContact O-N 3.44Å; L568-S572 PolarHBondContact O-N 3.47Å; L568-S572 PolarHBondContact O-OG 3.35Å; L568-L634 HydrophobicContact CD2-CD2 4.16Å; L568-Y643 HydrophobicContact CB-CE1 4.31Å; L568-Y643 HydrophobicContact CD1-CE1 4.2Å
569	R	98.3	Very high	95.3	Very high	33 Å²	33	22 Å²	22	13%	0.125	11%	0.106	C	C	.	.	H	α-helix	trans	-56.1	-44.7	171.1	172.8	177.1	162	-169.7	-7.3	112.2	S315 M565 C566 T567 S572 F573 E658 A663 N666	S315-R569 PolarHBondContact O-NH2 2.91Å; M565-R569 WeakPolarHBondContact O-CB 3.37Å; M565-R569 PolarHBondContact O-N 2.95Å; C566-R569 PolarHBondContact O-N 3.28Å; T567-R569 PolarHBondContact O-N 2.93Å; R569-S572 PolarHBondContact O-N 3.44Å; R569-F573 PolarHBondContact O-N 2.84Å; R569-E658 IonicContact CZ-OE1 2.66Å; R569-E658 IonicContact NH1-OE1 2.86Å; R569-E658 PolarHBondContact NH1-OE1 3.25Å; R569-E658 IonicContact NH2-OE1 3.24Å; R569-A663 HydrophobicContact CB-CB 4.06Å; R569-N666 PolarHBondContact O-ND2 2.9Å
570	N	98.1	Very high	94.9	Very high	37 Å²	37	20.2 Å²	20.2	20%	0.198	10%	0.101	C	C	.	.	H	α-helix	trans	-65.5	-39.8	179.2	-68.3	-17.2	0	0	0	111.7	R520 S523 R530 C566 T567 L568 F573	R520-N570 PolarHBondContact O-ND2 3.38Å; R520-N570 VanDerWaalsContact O-ND2 3.17Å; S523-N570 PolarHBondContact OG-ND2 3.39Å; R530-N570 VanDerWaalsContact CD-O 3.29Å; R530-N570 WeakPolarHBondContact CD-O 3.36Å; C566-N570 PolarHBondContact O-N 3.14Å; C566-N570 PolarHBondContact O-ND2 3.29Å; C566-N570 PolarHBondContact O-OD1 2.84Å; T567-N570 WeakPolarHBondContact O-CB 3.5Å; T567-N570 PolarHBondContact O-N 3.21Å; T567-N570 VanDerWaalsContact O-N 3.09Å; L568-N570 VanDerWaalsContact C-N 3.32Å; L568-N570 PolarHBondContact O-N 3.16Å; N570-F573 WeakPolarHBondContact O-CB 3.37Å; N570-F573 PolarHBondContact O-N 3.32Å
571	L	97.8	Very high	94.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-71.4	-31.1	177.6	-60.1	-179.3	0	0	0	112.8	V533 R534 V540 T567 L568 F573 L634	V533-L571 HydrophobicContact CB-CD2 3.75Å; V533-L571 HydrophobicContact CG1-CD1 4.03Å; V533-L571 HydrophobicContact CG1-CD2 3.62Å; V533-L571 HydrophobicContact CG1-CG 4.38Å; R534-L571 HydrophobicContact CG-CB 4.32Å; R534-L571 HydrophobicContact CG-CD2 4.12Å; R534-L571 VanDerWaalsContact CZ-O 3.31Å; R534-L571 PolarHBondContact NE-O 3.19Å; R534-L571 PolarHBondContact NH2-O 2.94Å; V540-L571 HydrophobicContact CG2-CD1 4.41Å; T567-L571 HydrophobicContact CG2-CD1 4.31Å; T567-L571 WeakPolarHBondContact O-CG 3.37Å; T567-L571 PolarHBondContact O-N 3.15Å; L568-L571 PolarHBondContact O-N 3.44Å; L571-F573 VanDerWaalsContact C-N 3.28Å; L571-F573 PolarHBondContact O-N 3.25Å; L571-L634 HydrophobicContact CB-CD1 3.82Å; L571-L634 HydrophobicContact CB-CD2 4.02Å
572	S	97.1	Very high	93.5	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-69	-20.2	170.3	-70	0	0	0	0	113.8	L568 R569 K574 L575 N666 I667	L568-S572 PolarHBondContact O-N 3.47Å; L568-S572 PolarHBondContact O-OG 3.35Å; R569-S572 PolarHBondContact O-N 3.44Å; S572-K574 PolarHBondContact O-N 3.2Å; S572-L575 WeakPolarHBondContact O-CB 3.47Å; S572-L575 PolarHBondContact O-N 3.06Å; S572-N666 WeakPolarHBondContact O-CB 3.41Å; S572-I667 WeakPolarHBondContact OG-CG2 3.48Å
573	F	96.4	Very high	92.7	Very high	92 Å²	92	30.2 Å²	30.2	40%	0.404	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	131.2	179.8	178.4	-106.4	0	0	0	111.3	R534 R569 N570 L571 L575	R534-F573 PolarHBondContact NH2-O 2.7Å; R569-F573 PolarHBondContact O-N 2.84Å; N570-F573 WeakPolarHBondContact O-CB 3.37Å; N570-F573 PolarHBondContact O-N 3.32Å; L571-F573 VanDerWaalsContact C-N 3.28Å; L571-F573 PolarHBondContact O-N 3.25Å; F573-L575 PolarHBondContact O-N 3.4Å; F573-L575 VanDerWaalsContact O-N 3.12Å
574	K	93.4	Very high	91.8	Very high	97 Å²	97	33 Å²	33	42%	0.422	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	32.3	-177.4	-80.4	-174.3	147.5	-77.8	0	113.5	S572 F576 D577 E578	S572-K574 PolarHBondContact O-N 3.2Å; K574-F576 PolarHBondContact O-N 2.93Å; K574-D577 HydrophobicContact CB-CB 4.18Å; K574-D577 WeakPolarHBondContact CG-OD2 3.49Å; K574-D577 IonicContact NZ-OD2 2.73Å; K574-D577 PolarHBondContact NZ-OD2 3.19Å; K574-D577 WeakPolarHBondContact O-CB 3.47Å; K574-D577 PolarHBondContact O-N 3.08Å; K574-E578 HydrophobicContact CB-CG 3.95Å; K574-E578 WeakPolarHBondContact CB-OE1 3.31Å; K574-E578 WeakPolarHBondContact O-CB 3.34Å; K574-E578 VanDerWaalsContact O-CG 3.28Å; K574-E578 WeakPolarHBondContact O-CG 3.29Å; K574-E578 PolarHBondContact O-N 3.3Å
575	L	92.9	Very high	90.6	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-52.2	-57.3	-172.2	-177.8	58.3	0	0	0	112.5	S572 F573 D577 E578 L579 L634 W635 I667	S572-L575 WeakPolarHBondContact O-CB 3.47Å; S572-L575 PolarHBondContact O-N 3.06Å; F573-L575 PolarHBondContact O-N 3.4Å; F573-L575 VanDerWaalsContact O-N 3.12Å; L575-D577 PolarHBondContact O-N 2.91Å; L575-E578 PolarHBondContact O-N 2.74Å; L575-E578 VanDerWaalsContact O-N 3.14Å; L575-L579 HydrophobicContact CD1-CD2 4.11Å; L575-L579 WeakPolarHBondContact O-CG 3.45Å; L575-L579 PolarHBondContact O-N 2.82Å; L575-L634 HydrophobicContact CD1-CB 4.04Å; L575-L634 HydrophobicContact CD1-CD1 4.03Å; L575-L634 HydrophobicContact CD2-CB 3.75Å; L575-L634 WeakPolarHBondContact CD2-O 3.32Å; L575-W635 HydrophobicContact CD1-CE3 4.3Å; L575-W635 HydrophobicContact CD2-CB 3.98Å; L575-W635 HydrophobicContact CD2-CE3 4.17Å; L575-W635 HydrophobicContact CG-CE3 4.45Å; L575-I667 HydrophobicContact CD2-CG2 4.15Å
576	F	90.5	Very high	89.3	Confident	5 Å²	5	42.3 Å²	42.3	2%	0.022	23%	0.228	C	C	.	.	H	α-helix	trans	-70	-29.1	-176.3	-47.2	-60.8	0	0	0	113.8	K574 E578 L579 K584 W635 I667 D672 W674 A675 L678	K574-F576 PolarHBondContact O-N 2.93Å; F576-E578 VanDerWaalsContact C-N 3.34Å; F576-L579 HydrophobicContact CD1-CD1 4.21Å; F576-K584 WeakPolarHBondContact O-CE 3.45Å; F576-K584 PolarHBondContact O-NZ 3.45Å; F576-W635 HydrophobicContact CE1-CB 4.02Å; F576-W635 HydrophobicContact CZ-CB 4.43Å; F576-I667 WeakPolarHBondContact CE2-O 3.47Å; F576-D672 HydrophobicContact CB-CB 4.19Å; F576-D672 VanDerWaalsContact CB-OD1 3.25Å; F576-D672 WeakPolarHBondContact CB-OD1 3.33Å; F576-D672 HydrophobicContact CD2-CB 3.89Å; F576-D672 HydrophobicContact CG-CB 4.13Å; F576-W674 HydrophobicContact CD1-CB 4.35Å; F576-W674 HydrophobicContact CE1-CB 3.95Å; F576-W674 AromaticContact CE1-CD1 3.6Å; F576-W674 HydrophobicContact CE1-CG 4.02Å; F576-W674 HydrophobicContact CZ-CB 4.25Å; F576-W674 AromaticContact CZ-CD1 3.75Å; F576-W674 HydrophobicContact CZ-CG 4.38Å; F576-A675 HydrophobicContact CD2-CB 4.35Å; F576-A675 HydrophobicContact CE2-CB 3.89Å; F576-L678 HydrophobicContact CZ-CD1 4.39Å
577	D	90.1	Very high	88	Confident	85 Å²	85	42.6 Å²	42.6	46%	0.455	23%	0.228	S	C	.	.	H	α-helix	trans	-61.7	-42.1	169	-72.4	-38.7	0	0	0	111.3	K574 L575 K584	K574-D577 HydrophobicContact CB-CB 4.18Å; K574-D577 WeakPolarHBondContact CG-OD2 3.49Å; K574-D577 IonicContact NZ-OD2 2.73Å; K574-D577 PolarHBondContact NZ-OD2 3.19Å; K574-D577 WeakPolarHBondContact O-CB 3.47Å; K574-D577 PolarHBondContact O-N 3.08Å; L575-D577 PolarHBondContact O-N 2.91Å; D577-K584 VanDerWaalsContact C-NZ 3.32Å; D577-K584 PolarHBondContact O-NZ 2.9Å
578	E	91.6	Very high	86.5	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.019	24%	0.243	C	C	.	.	H	α-helix	trans	-99.5	1.3	-166.9	-60.5	178.5	178.7	0	0	114	E527 R530 R534 K574 L575 F576	E527-E578 HydrophobicContact CG-CB 4.34Å; E527-E578 HydrophobicContact CG-CG 3.74Å; R530-E578 IonicContact CZ-OE1 3.89Å; R530-E578 IonicContact CZ-OE2 3.25Å; R530-E578 IonicContact NE-OE1 3.71Å; R530-E578 PolarHBondContact NE-OE1 3.2Å; R530-E578 IonicContact NE-OE2 3.72Å; R530-E578 PolarHBondContact NE-OE2 3.43Å; R530-E578 IonicContact NH2-OE1 3.96Å; R530-E578 PolarHBondContact NH2-OE1 2.87Å; R530-E578 IonicContact NH2-OE2 2.72Å; R534-E578 IonicContact CZ-OE2 2.78Å; R534-E578 VanDerWaalsContact CZ-OE2 3.23Å; R534-E578 VanDerWaalsContact NH1-CB 3.32Å; R534-E578 IonicContact NH1-OE2 2.99Å; R534-E578 PolarHBondContact NH1-OE2 3.08Å; R534-E578 IonicContact NH2-OE2 3.87Å; R534-E578 PolarHBondContact NH2-OE2 3.31Å; K574-E578 HydrophobicContact CB-CG 3.95Å; K574-E578 WeakPolarHBondContact CB-OE1 3.31Å; K574-E578 WeakPolarHBondContact O-CB 3.34Å; K574-E578 VanDerWaalsContact O-CG 3.28Å; K574-E578 WeakPolarHBondContact O-CG 3.29Å; K574-E578 PolarHBondContact O-N 3.3Å; L575-E578 PolarHBondContact O-N 2.74Å; L575-E578 VanDerWaalsContact O-N 3.14Å; F576-E578 VanDerWaalsContact C-N 3.34Å
579	L	87.2	Confident	84.5	Confident	6 Å²	6	51.7 Å²	51.7	3%	0.031	27%	0.27	C	S	.	.	S	Bend	trans	-63.8	144.5	177	-78.7	-178.3	0	0	0	112.8	L575 F576 I583 K584 L587 L631 W635	L575-L579 HydrophobicContact CD1-CD2 4.11Å; L575-L579 WeakPolarHBondContact O-CG 3.45Å; L575-L579 PolarHBondContact O-N 2.82Å; F576-L579 HydrophobicContact CD1-CD1 4.21Å; L579-I583 HydrophobicContact CD1-CG2 4.1Å; L579-I583 HydrophobicContact CD2-CG2 4.32Å; L579-K584 HydrophobicContact CB-CD 4.46Å; L579-K584 HydrophobicContact CB-CG 3.74Å; L579-K584 WeakPolarHBondContact O-CE 2.87Å; L579-L587 HydrophobicContact CD1-CD1 3.59Å; L579-L631 HydrophobicContact CD2-CD1 3.87Å; L579-W635 HydrophobicContact CD2-CE3 4.13Å; L579-W635 HydrophobicContact CD2-CH2 3.9Å; L579-W635 HydrophobicContact CD2-CZ3 3.47Å; L579-W635 VanDerWaalsContact CD2-CZ3 3.47Å
580	P	84	Confident	82	Confident	29 Å²	29	55.1 Å²	55.1	19%	0.188	29%	0.291	C	S	.	.			trans	-53.3	138.8	167.3	-27.4	35.4	0	0	0	112.6	S582 I583 K584	P580-S582 VanDerWaalsContact C-N 3.29Å; P580-S582 PolarHBondContact O-N 2.91Å; P580-I583 HydrophobicContact CB-CD1 4.33Å; P580-I583 HydrophobicContact CB-CG1 4.35Å; P580-I583 HydrophobicContact CG-CD1 4.1Å; P580-I583 PolarHBondContact O-N 3.45Å; P580-K584 PolarHBondContact O-N 3.44Å; P580-K584 VanDerWaalsContact O-N 3.07Å
581	P	80.8	Confident	79.4	Confident	104 Å²	104	57.1 Å²	57.1	68%	0.675	32%	0.32	S	S	*	.	H	α-helix	trans	-55	-39.4	-176	-28.9	35.7	0	0	0	114.5	I583 K584 T585	P581-I583 VanDerWaalsContact C-N 3.26Å; P581-I583 PolarHBondContact O-N 3.39Å; P581-K584 WeakPolarHBondContact O-CB 3.23Å; P581-K584 PolarHBondContact O-N 2.89Å; P581-K584 VanDerWaalsContact O-N 3.12Å; P581-T585 PolarHBondContact O-N 3.37Å; P581-T585 PolarHBondContact O-OG1 3.09Å
582	S	79.8	Confident	76.6	Confident	79 Å²	79	63.3 Å²	63.3	55%	0.552	36%	0.358	S	S	*	.	H	α-helix	trans	-58.7	-35.3	175.9	48.8	0	0	0	0	113.4	P580 N586	P580-S582 VanDerWaalsContact C-N 3.29Å; P580-S582 PolarHBondContact O-N 2.91Å; S582-N586 VanDerWaalsContact O-CG 3.24Å; S582-N586 PolarHBondContact O-N 2.83Å; S582-N586 PolarHBondContact O-ND2 2.91Å
583	I	79.6	Confident	73.9	Confident	39 Å²	39	68.8 Å²	68.8	20%	0.2	39%	0.392	C	S	.	.	H	α-helix	trans	-78	-37.8	176.4	-59.6	179.9	0	0	0	110	L579 P580 P581 N586 L587 L631 W635	L579-I583 HydrophobicContact CD1-CG2 4.1Å; L579-I583 HydrophobicContact CD2-CG2 4.32Å; P580-I583 HydrophobicContact CB-CD1 4.33Å; P580-I583 HydrophobicContact CB-CG1 4.35Å; P580-I583 HydrophobicContact CG-CD1 4.1Å; P580-I583 PolarHBondContact O-N 3.45Å; P581-I583 VanDerWaalsContact C-N 3.26Å; P581-I583 PolarHBondContact O-N 3.39Å; I583-N586 PolarHBondContact O-N 2.9Å; I583-L587 HydrophobicContact CG2-CD1 3.82Å; I583-L587 HydrophobicContact CG2-CG 4.22Å; I583-L587 WeakPolarHBondContact O-CB 3.31Å; I583-L587 VanDerWaalsContact O-CG 3.32Å; I583-L587 WeakPolarHBondContact O-CG 3.43Å; I583-L587 PolarHBondContact O-N 3.13Å; I583-L631 HydrophobicContact CD1-CD1 4.01Å; I583-L631 HydrophobicContact CD1-CD2 4.1Å; I583-L631 HydrophobicContact CD1-CG 4.33Å; I583-W635 HydrophobicContact CD1-CH2 4.4Å; I583-W635 HydrophobicContact CG2-CH2 3.63Å; I583-W635 HydrophobicContact CG2-CZ2 3.65Å
584	K	78.1	Confident	71.4	Confident	64 Å²	64	70 Å²	70	28%	0.278	41%	0.412	S	S	.	.	H	α-helix	trans	-58.7	-49	174.1	-61.1	-160	-167.9	-155.1	0	111.6	F576 D577 L579 P580 P581 N586 L587 F588	F576-K584 WeakPolarHBondContact O-CE 3.45Å; F576-K584 PolarHBondContact O-NZ 3.45Å; D577-K584 VanDerWaalsContact C-NZ 3.32Å; D577-K584 PolarHBondContact O-NZ 2.9Å; L579-K584 HydrophobicContact CB-CD 4.46Å; L579-K584 HydrophobicContact CB-CG 3.74Å; L579-K584 WeakPolarHBondContact O-CE 2.87Å; P580-K584 PolarHBondContact O-N 3.44Å; P580-K584 VanDerWaalsContact O-N 3.07Å; P581-K584 WeakPolarHBondContact O-CB 3.23Å; P581-K584 PolarHBondContact O-N 2.89Å; P581-K584 VanDerWaalsContact O-N 3.12Å; K584-N586 PolarHBondContact O-N 3.16Å; K584-L587 PolarHBondContact O-N 3.19Å; K584-F588 HydrophobicContact CB-CD2 4.11Å; K584-F588 HydrophobicContact CB-CE2 4.22Å; K584-F588 WeakPolarHBondContact O-CB 3.4Å; K584-F588 WeakPolarHBondContact O-CD2 3.42Å; K584-F588 PolarHBondContact O-N 3.29Å
585	T	73.9	Confident	68.7	Low	65 Å²	65	70.3 Å²	70.3	40%	0.399	43%	0.426	S	S	.	.	H	α-helix	trans	-54.3	-52.3	176.2	-58.4	0	0	0	0	110.7	P581 L587 F588 E589	P581-T585 PolarHBondContact O-N 3.37Å; P581-T585 PolarHBondContact O-OG1 3.09Å; T585-L587 VanDerWaalsContact C-N 3.27Å; T585-L587 PolarHBondContact O-N 3.08Å; T585-F588 PolarHBondContact O-N 3.15Å; T585-E589 VanDerWaalsContact CG2-CD 3.42Å; T585-E589 HydrophobicContact CG2-CG 3.89Å; T585-E589 VanDerWaalsContact CG2-OE1 3.28Å; T585-E589 WeakPolarHBondContact CG2-OE1 3.44Å; T585-E589 WeakPolarHBondContact O-CB 3.43Å; T585-E589 WeakPolarHBondContact O-CG 3.42Å; T585-E589 PolarHBondContact O-N 3.43Å
586	N	71.3	Confident	65.9	Low	130 Å²	130	75.5 Å²	75.5	70%	0.695	46%	0.462	S	S	*	.	H	α-helix	trans	-64.7	-22.4	-179.1	-67.8	-12.9	0	0	0	115	S582 I583 K584	S582-N586 VanDerWaalsContact O-CG 3.24Å; S582-N586 PolarHBondContact O-N 2.83Å; S582-N586 PolarHBondContact O-ND2 2.91Å; I583-N586 PolarHBondContact O-N 2.9Å; K584-N586 PolarHBondContact O-N 3.16Å
587	L	70.9	Confident	63.4	Low	23 Å²	23	81 Å²	81	12%	0.12	50%	0.497	C	S	.	.	H	α-helix	trans	-92.1	-18.5	177.8	-69.7	175.8	0	0	0	114	L579 I583 K584 T585 W635 W674	L579-L587 HydrophobicContact CD1-CD1 3.59Å; I583-L587 HydrophobicContact CG2-CD1 3.82Å; I583-L587 HydrophobicContact CG2-CG 4.22Å; I583-L587 WeakPolarHBondContact O-CB 3.31Å; I583-L587 VanDerWaalsContact O-CG 3.32Å; I583-L587 WeakPolarHBondContact O-CG 3.43Å; I583-L587 PolarHBondContact O-N 3.13Å; K584-L587 PolarHBondContact O-N 3.19Å; T585-L587 VanDerWaalsContact C-N 3.27Å; T585-L587 PolarHBondContact O-N 3.08Å; L587-W635 HydrophobicContact CD1-CD2 4.41Å; L587-W635 HydrophobicContact CD1-CZ2 3.98Å; L587-W674 HydrophobicContact CB-CE3 4.46Å; L587-W674 HydrophobicContact CD2-CD2 4.42Å; L587-W674 HydrophobicContact CD2-CE3 4.11Å; L587-W674 HydrophobicContact CD2-CH2 4.2Å; L587-W674 HydrophobicContact CD2-CZ2 4.49Å; L587-W674 HydrophobicContact CD2-CZ3 4Å
588	F	65.6	Low	61.3	Low	69 Å²	69	84.1 Å²	84.1	30%	0.303	52%	0.518	S	S	.	.	H	α-helix	trans	-118.5	-12.6	-173.7	-58.9	-52.1	0	0	0	114.2	K584 T585 D590 P673 W674	K584-F588 HydrophobicContact CB-CD2 4.11Å; K584-F588 HydrophobicContact CB-CE2 4.22Å; K584-F588 WeakPolarHBondContact O-CB 3.4Å; K584-F588 WeakPolarHBondContact O-CD2 3.42Å; K584-F588 PolarHBondContact O-N 3.29Å; T585-F588 PolarHBondContact O-N 3.15Å; F588-D590 VanDerWaalsContact C-N 3.31Å; F588-D590 PolarHBondContact O-N 2.91Å; F588-P673 HydrophobicContact CD1-CB 4.12Å; F588-P673 HydrophobicContact CD1-CG 4.11Å; F588-P673 HydrophobicContact CE1-CB 4.22Å; F588-P673 HydrophobicContact CE1-CG 4.28Å; F588-W674 HydrophobicContact CE1-CB 3.95Å; F588-W674 HydrophobicContact CZ-CB 4.49Å
589	E	56.9	Low	58.8	Low	122 Å²	122	86.7 Å²	86.7	57%	0.57	55%	0.546	S	S	*	.			trans	-74.8	81.7	163.6	-72.8	-170.3	174.7	0	0	110.9	T585 G591	T585-E589 VanDerWaalsContact CG2-CD 3.42Å; T585-E589 HydrophobicContact CG2-CG 3.89Å; T585-E589 VanDerWaalsContact CG2-OE1 3.28Å; T585-E589 WeakPolarHBondContact CG2-OE1 3.44Å; T585-E589 WeakPolarHBondContact O-CB 3.43Å; T585-E589 WeakPolarHBondContact O-CG 3.42Å; T585-E589 PolarHBondContact O-N 3.43Å; E589-G591 PolarHBondContact O-N 3.33Å
590	D	45.8	Very low	56.9	Low	106 Å²	106	92.1 Å²	92.1	57%	0.567	58%	0.583	S	S	*	*			trans	-54.8	121.4	156.4	-94.7	6.2	0	0	0	107.5	F588 T592 K677	F588-D590 VanDerWaalsContact C-N 3.31Å; F588-D590 PolarHBondContact O-N 2.91Å; D590-T592 PolarHBondContact O-N 3.4Å; D590-T592 PolarHBondContact O-OG1 3.35Å; D590-T592 VanDerWaalsContact O-OG1 3.05Å; D590-K677 IonicContact OD1-NZ 2.93Å; D590-K677 PolarHBondContact OD1-NZ 3.49Å
591	G	44.5	Very low	54.9	Low	79 Å²	79	99.6 Å²	99.6	81%	0.814	61%	0.613	S	S	*	*	S	Bend	trans	-50.8	98.2	-161.8	0	0	0	0	0	115.7	E589	E589-G591 PolarHBondContact O-N 3.33Å
592	T	39.2	Very low	53.2	Low	129 Å²	129	99.9 Å²	99.9	79%	0.791	62%	0.617	S	S	*	*			trans	-112.1	14.2	-177.3	30.3	0	0	0	0	113	D590	D590-T592 PolarHBondContact O-N 3.4Å; D590-T592 PolarHBondContact O-OG1 3.35Å; D590-T592 VanDerWaalsContact O-OG1 3.05Å
593	T	39.3	Very low	51.4	Low	116 Å²	116	101.7 Å²	101.7	71%	0.712	63%	0.627	S	S	*	*	S	Bend	trans	-88	128.1	172.4	44.1	0	0	0	0	111.9
594	S	43.5	Very low	49.6	Very low	117 Å²	117	107.2 Å²	107.2	82%	0.818	66%	0.657	S	S	*	*	S	Bend	trans	60.5	69.4	167.7	58.6	0	0	0	0	119.1
595	S	37.3	Very low	48.1	Very low	104 Å²	104	109.5 Å²	109.5	73%	0.727	68%	0.681	S	S	*	*			trans	-152.7	55.7	135.2	-160.1	0	0	0	0	112.3	T597	S595-T597 PolarHBondContact O-N 3.47Å
596	S	34.6	Very low	46.6	Very low	110 Å²	110	109.7 Å²	109.7	77%	0.769	69%	0.685	S	S	*	*			trans	-79.1	64.7	167.6	57.5	0	0	0	0	110.2	V598	S596-V598 PolarHBondContact O-N 2.87Å; S596-V598 VanDerWaalsContact O-N 3.1Å
597	T	37.4	Very low	45.2	Very low	121 Å²	121	112 Å²	112	74%	0.742	69%	0.689	S	S	*	*			trans	-66	106.8	167.5	43	0	0	0	0	108.5	S595 G599	S595-T597 PolarHBondContact O-N 3.47Å; T597-G599 PolarHBondContact O-N 2.84Å
598	V	46.7	Very low	43.8	Very low	151 Å²	151	118.1 Å²	118.1	92%	0.915	72%	0.72	S	S	*	*			trans	-73.1	78.8	-178.6	-176.1	0	0	0	0	109.6	S596	S596-V598 PolarHBondContact O-N 2.87Å; S596-V598 VanDerWaalsContact O-N 3.1Å
599	G	37.7	Very low	42.3	Very low	57 Å²	57	123.4 Å²	123.4	59%	0.588	74%	0.743	S	S	*	*			trans	-91.5	125.3	174.2	0	0	0	0	0	111.3	T597 F601	T597-G599 PolarHBondContact O-N 2.84Å; G599-F601 PolarHBondContact O-N 3.18Å
600	C	47.8	Very low	41.4	Very low	121 Å²	121	124.1 Å²	124.1	82%	0.818	75%	0.747	S	S	*	*			trans	-78.8	40.8	-174.8	54.8	0	0	0	0	114.9
601	F	41.7	Very low	40.9	Very low	185 Å²	185	126.5 Å²	126.5	81%	0.811	75%	0.754	S	S	*	*	S	Bend	trans	-123.5	132.6	-176.8	-69.9	-80.2	0	0	0	113.1	G599	G599-F601 PolarHBondContact O-N 3.18Å
602	S	45.1	Very low	40.5	Very low	111 Å²	111	130.7 Å²	130.7	78%	0.776	75%	0.75	S	S	*	*			trans	-67.6	129.1	-168.7	-53.1	0	0	0	0	114.1	N604	S602-N604 VanDerWaalsContact C-N 3.3Å; S602-N604 PolarHBondContact O-N 3.08Å
603	P	42.1	Very low	40.4	Very low	116 Å²	116	127.4 Å²	127.4	75%	0.753	74%	0.736	S	S	*	*			trans	-84.2	48.1	-168.2	34.9	-38.5	0	0	0	115.3	S605	P603-S605 PolarHBondContact O-N 3.43Å
604	N	41.3	Very low	40.4	Very low	155 Å²	155	125.4 Å²	125.4	83%	0.829	73%	0.726	S	S	*	*			trans	-96.7	80.4	179.5	-82.1	-10.6	0	0	0	113	S602	S602-N604 VanDerWaalsContact C-N 3.3Å; S602-N604 PolarHBondContact O-N 3.08Å
605	S	46.9	Very low	40.3	Very low	113 Å²	113	125.7 Å²	125.7	79%	0.79	72%	0.718	S	S	*	*	S	Bend	trans	-179.7	-17.1	155.1	46.6	0	0	0	0	115.9	P603 K607	P603-S605 PolarHBondContact O-N 3.43Å; S605-K607 PolarHBondContact O-N 2.87Å
606	S	43.1	Very low	40.7	Very low	68 Å²	68	128.9 Å²	128.9	48%	0.476	72%	0.722	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.8	-24.8	-166.5	54.4	0	0	0	0	116.3	I608 K609	S606-I608 PolarHBondContact O-N 3.25Å; S606-K609 PolarHBondContact O-N 3.22Å; S606-K609 VanDerWaalsContact O-N 3.1Å
607	K	41.3	Very low	41.4	Very low	178 Å²	178	131.9 Å²	131.9	77%	0.774	72%	0.721	S	S	*	*	H	α-helix	trans	-59.1	-21.1	-169.6	-73.3	-173.8	174.7	-180	0	115.7	S605	S605-K607 PolarHBondContact O-N 2.87Å
608	I	41.1	Very low	42.1	Very low	153 Å²	153	128.1 Å²	128.1	79%	0.785	71%	0.706	S	S	*	*	H	α-helix	trans	-86.7	-20.2	-178.9	-65.2	175.9	0	0	0	112.8	S606	S606-I608 PolarHBondContact O-N 3.25Å
609	K	35.2	Very low	42.6	Very low	180 Å²	180	122.1 Å²	122.1	78%	0.783	67%	0.667	S	S	*	*	H	α-helix	trans	-90.7	-27.5	177.7	-75.6	-172.3	176.5	-179.9	0	114.1	S606 H611 K612 A613	S606-K609 PolarHBondContact O-N 3.22Å; S606-K609 VanDerWaalsContact O-N 3.1Å; K609-H611 PolarHBondContact O-N 3.18Å; K609-K612 PolarHBondContact O-N 2.87Å; K609-A613 PolarHBondContact O-N 2.94Å
610	Q	36.8	Very low	43.4	Very low	137 Å²	137	121.5 Å²	121.5	64%	0.64	65%	0.654	S	S	*	*	H	α-helix	trans	-62.5	-40.8	-179.8	-86.1	177.9	-40.8	0	0	113.3	K612 A613 C614	Q610-K612 VanDerWaalsContact C-N 3.27Å; Q610-K612 PolarHBondContact O-N 3.26Å; Q610-A613 PolarHBondContact O-N 2.94Å; Q610-C614 PolarHBondContact O-N 3.22Å
611	H	36.7	Very low	43.5	Very low	156 Å²	156	120.7 Å²	120.7	72%	0.722	65%	0.648	S	S	*	*	H	α-helix	trans	-62.2	-28.3	-177.6	-101.8	-74.8	0	0	0	114.5	K609	K609-H611 PolarHBondContact O-N 3.18Å
612	K	36.8	Very low	43.9	Very low	166 Å²	166	118.7 Å²	118.7	72%	0.722	65%	0.645	S	S	*	*	H	α-helix	trans	-94.6	-11.4	174.1	-73.5	-170	173.7	-174.8	0	114.4	K609 Q610	K609-K612 PolarHBondContact O-N 2.87Å; Q610-K612 VanDerWaalsContact C-N 3.27Å; Q610-K612 PolarHBondContact O-N 3.26Å
613	A	35.6	Very low	44.7	Very low	61 Å²	61	116.7 Å²	116.7	50%	0.504	62%	0.624	S	S	.	*	H	α-helix	trans	-82.1	-26.1	175	0	0	0	0	0	112.4	K609 Q610	K609-A613 PolarHBondContact O-N 2.94Å; Q610-A613 PolarHBondContact O-N 2.94Å
614	C	40.6	Very low	46.1	Very low	74 Å²	74	112.5 Å²	112.5	50%	0.5	60%	0.596	S	S	.	*	G	3₁₀ helix	trans	-68.7	-36.9	175.3	-168.3	0	0	0	0	112.4	Q610 Q616 K617	Q610-C614 PolarHBondContact O-N 3.22Å; C614-Q616 PolarHBondContact O-N 3.15Å; C614-Q616 VanDerWaalsContact O-N 3.1Å; C614-K617 PolarHBondContact O-N 3.09Å
615	D	41.4	Very low	47.7	Very low	122 Å²	122	107.5 Å²	107.5	65%	0.652	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-64	-14.2	-179.2	-67.2	-29.5	0	0	0	114.4
616	Q	44.4	Very low	49.3	Very low	172 Å²	172	110.5 Å²	110.5	80%	0.804	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-113.2	-3.3	-175.4	-65.9	-169.7	-11.4	0	0	114.8	C614 G618	C614-Q616 PolarHBondContact O-N 3.15Å; C614-Q616 VanDerWaalsContact O-N 3.1Å; Q616-G618 VanDerWaalsContact C-N 3.27Å; Q616-G618 PolarHBondContact O-N 3.38Å
617	K	49.7	Very low	51.3	Low	173 Å²	173	110.6 Å²	110.6	75%	0.752	57%	0.573	S	S	*	*			trans	-80.1	81.2	163.4	-77.8	-166.5	174.1	-172.6	0	109.4	C614	C614-K617 PolarHBondContact O-N 3.09Å
618	G	51.3	Low	53.6	Low	42 Å²	42	102.4 Å²	102.4	43%	0.433	54%	0.538	S	S	.	.			trans	-60.4	165.5	160.8	0	0	0	0	0	111	Q616 S620	Q616-G618 VanDerWaalsContact C-N 3.27Å; Q616-G618 PolarHBondContact O-N 3.38Å; G618-S620 PolarHBondContact O-N 3.19Å
619	F	57.1	Low	55.9	Low	24 Å²	24	101.8 Å²	101.8	11%	0.105	53%	0.529	C	S	.	.			trans	-63.4	107.2	-171.7	-171.5	-76.2	0	0	0	110.8	P621 V624 P637 W674 K677 L678 Y681	F619-P621 WeakPolarHBondContact O-CD 3.48Å; F619-V624 HydrophobicContact CE1-CG2 3.4Å; F619-V624 HydrophobicContact CZ-CG2 3.51Å; F619-P637 HydrophobicContact CD1-CG 4.08Å; F619-P637 HydrophobicContact CE1-CG 3.38Å; F619-P637 HydrophobicContact CE2-CG 4.32Å; F619-P637 HydrophobicContact CZ-CG 3.52Å; F619-W674 HydrophobicContact CE2-CH2 4.08Å; F619-W674 AromaticContact CE2-CZ2 3.79Å; F619-W674 HydrophobicContact CE2-CZ2 3.79Å; F619-W674 AromaticContact CZ-CH2 3.93Å; F619-W674 HydrophobicContact CZ-CH2 3.93Å; F619-W674 AromaticContact CZ-CZ2 3.68Å; F619-W674 HydrophobicContact CZ-CZ2 3.68Å; F619-K677 HydrophobicContact CD2-CB 4.07Å; F619-K677 HydrophobicContact CE2-CB 4.32Å; F619-L678 HydrophobicContact CE2-CD2 4.32Å; F619-Y681 HydrophobicContact CB-CD2 3.77Å; F619-Y681 HydrophobicContact CB-CG 4.22Å; F619-Y681 HydrophobicContact CD1-CD2 4.38Å; F619-Y681 HydrophobicContact CG-CD2 4.14Å; F619-Y681 HydrophobicContact CG-CG 4.38Å
620	S	54.5	Low	58.5	Low	44 Å²	44	94 Å²	94	31%	0.308	50%	0.5	S	S	.	.			trans	-75	126.1	-177.7	-174.6	0	0	0	0	110.3	G618 N622 E623	G618-S620 PolarHBondContact O-N 3.19Å; S620-N622 PolarHBondContact O-N 2.77Å; S620-E623 VanDerWaalsContact CB-OE1 3.27Å; S620-E623 WeakPolarHBondContact CB-OE1 3.43Å; S620-E623 WeakPolarHBondContact O-CB 3.42Å; S620-E623 PolarHBondContact O-N 3.39Å
621	P	50.4	Low	61	Low	105 Å²	105	88.6 Å²	88.6	68%	0.682	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-7.8	175.9	-25	35.8	0	0	0	114.9	F619	F619-P621 WeakPolarHBondContact O-CD 3.48Å
622	N	50.5	Low	63.6	Low	142 Å²	142	84.4 Å²	84.4	76%	0.759	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-11.1	173.4	-66.8	-12.2	0	0	0	113.4	S620 V624	S620-N622 PolarHBondContact O-N 2.77Å; N622-V624 PolarHBondContact O-N 3.35Å
623	E	62.3	Low	66.4	Low	69 Å²	69	77.7 Å²	77.7	32%	0.322	43%	0.426	S	S	.	.	S	Bend	trans	-79.9	5.1	175.6	-70.8	172.5	-123.8	0	0	112.9	S620 K677	S620-E623 VanDerWaalsContact CB-OE1 3.27Å; S620-E623 WeakPolarHBondContact CB-OE1 3.43Å; S620-E623 WeakPolarHBondContact O-CB 3.42Å; S620-E623 PolarHBondContact O-N 3.39Å; E623-K677 WeakPolarHBondContact OE2-CE 3.14Å; E623-K677 IonicContact OE2-NZ 2.89Å; E623-K677 PolarHBondContact OE2-NZ 2.91Å
624	V	71.5	Confident	69.2	Low	28 Å²	28	74.8 Å²	74.8	17%	0.17	40%	0.402	C	S	.	.	S	Bend	trans	-146.5	157.5	179.1	-120.5	0	0	0	0	111.8	F619 N622 K626 W674	F619-V624 HydrophobicContact CE1-CG2 3.4Å; F619-V624 HydrophobicContact CZ-CG2 3.51Å; N622-V624 PolarHBondContact O-N 3.35Å; V624-K626 PolarHBondContact O-N 3.09Å; V624-W674 HydrophobicContact CG1-CH2 4.23Å; V624-W674 HydrophobicContact CG1-CZ2 4.12Å
625	S	75.4	Confident	71.6	Confident	50 Å²	50	71.6 Å²	71.6	35%	0.35	38%	0.38	S	S	.	.			trans	-57.8	133	171.6	178.7	0	0	0	0	111.7	S627 H636	S625-S627 PolarHBondContact O-N 3.45Å; S625-S627 VanDerWaalsContact O-N 3.11Å; S625-S627 VanDerWaalsContact OG-C 3.27Å; S625-S627 PolarHBondContact OG-N 3.4Å; S625-S627 PolarHBondContact OG-O 3.49Å; S625-H636 PolarHBondContact O-CD2 3.36Å; S625-H636 PolarHBondContact O-NE2 2.91Å; S625-H636 VanDerWaalsContact O-NE2 3.12Å
626	K	80.3	Confident	74	Confident	176 Å²	176	66.4 Å²	66.4	77%	0.765	35%	0.352	S	S	*	.	S	Bend	trans	-57	-26.8	172.4	-67.1	179.7	-180	176.3	0	112.2	V624 K638	V624-K626 PolarHBondContact O-N 3.09Å; K626-K638 PolarHBondContact O-NZ 3.25Å
627	S	84.1	Confident	76.2	Confident	71 Å²	71	58.8 Å²	58.8	50%	0.497	32%	0.317	S	S	.	.	S	Bend	trans	-133.5	96	176.2	34.4	0	0	0	0	109.3	S625	S625-S627 PolarHBondContact O-N 3.45Å; S625-S627 VanDerWaalsContact O-N 3.11Å; S625-S627 VanDerWaalsContact OG-C 3.27Å; S625-S627 PolarHBondContact OG-N 3.4Å; S625-S627 PolarHBondContact OG-O 3.49Å
628	P	90.3	Very high	78.3	Confident	6 Å²	6	54.7 Å²	54.7	4%	0.039	30%	0.299	C	S	.	.			trans	-61.4	147.3	178.1	24.8	-35.1	0	0	0	112.1	E632 W633 H636	P628-E632 VanDerWaalsContact CA-OE2 3.23Å; P628-E632 WeakPolarHBondContact CA-OE2 3.35Å; P628-E632 HydrophobicContact CB-CB 3.93Å; P628-W633 HydrophobicContact CB-CD2 4.1Å; P628-W633 HydrophobicContact CB-CG 4.23Å; P628-W633 HydrophobicContact CG-CD2 3.66Å; P628-W633 HydrophobicContact CG-CE3 3.74Å; P628-W633 HydrophobicContact CG-CG 4.32Å; P628-W633 HydrophobicContact CG-CH2 3.92Å; P628-W633 HydrophobicContact CG-CZ2 3.83Å; P628-W633 HydrophobicContact CG-CZ3 3.88Å; P628-W633 PolarHBondContact O-NE1 3.19Å; P628-H636 HydrophobicContact CB-CB 3.88Å; P628-H636 HydrophobicContact CG-CB 4.08Å
629	K	89.1	Confident	80.5	Confident	140 Å²	140	52.7 Å²	52.7	61%	0.609	28%	0.279	S	S	*	.			trans	-134.2	154.1	179.6	-63.3	-178.6	-178	179	0	111.6	L631 E632	K629-L631 PolarHBondContact O-N 3.36Å; K629-E632 PolarHBondContact N-OE2 3.04Å; K629-E632 WeakPolarHBondContact O-CB 3.37Å; K629-E632 VanDerWaalsContact O-CG 3.23Å; K629-E632 WeakPolarHBondContact O-CG 3.16Å; K629-E632 PolarHBondContact O-N 3.21Å
630	G	89.2	Confident	82.3	Confident	16 Å²	16	51.6 Å²	51.6	17%	0.165	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	47.2	-134.7	-176.3	0	0	0	0	0	112.5	E541 E632 W633	E541-G630 WeakPolarHBondContact OE1-CA 3.44Å; E541-G630 PolarHBondContact OE1-N 3.22Å; E541-G630 WeakPolarHBondContact OE2-CA 3.4Å; E541-G630 PolarHBondContact OE2-N 3.19Å; G630-E632 PolarHBondContact O-N 2.9Å; G630-W633 PolarHBondContact O-N 3.18Å
631	L	90.6	Very high	84.3	Confident	23 Å²	23	52.6 Å²	52.6	12%	0.12	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-61.9	-16.3	177.3	69.5	164.8	0	0	0	115.9	R534 L579 I583 K629 W633 L634 W635	R534-L631 HydrophobicContact CB-CB 4.02Å; R534-L631 HydrophobicContact CB-CD1 4.35Å; L579-L631 HydrophobicContact CD2-CD1 3.87Å; I583-L631 HydrophobicContact CD1-CD1 4.01Å; I583-L631 HydrophobicContact CD1-CD2 4.1Å; I583-L631 HydrophobicContact CD1-CG 4.33Å; K629-L631 PolarHBondContact O-N 3.36Å; L631-W633 PolarHBondContact O-N 3.07Å; L631-W633 VanDerWaalsContact O-N 3.1Å; L631-L634 HydrophobicContact CB-CD1 4.29Å; L631-L634 WeakPolarHBondContact O-CB 3.48Å; L631-L634 WeakPolarHBondContact O-CG 3.29Å; L631-L634 PolarHBondContact O-N 2.95Å; L631-W635 VanDerWaalsContact C-CZ3 3.46Å; L631-W635 HydrophobicContact CB-CZ3 4.07Å; L631-W635 HydrophobicContact CD1-CH2 4.08Å; L631-W635 HydrophobicContact CD1-CZ3 3.9Å; L631-W635 HydrophobicContact CG-CH2 3.76Å; L631-W635 HydrophobicContact CG-CZ3 3.69Å; L631-W635 VanDerWaalsContact O-CE3 3.25Å; L631-W635 WeakPolarHBondContact O-CZ3 3.33Å
632	E	91.3	Very high	86.5	Confident	69 Å²	69	48 Å²	48	32%	0.322	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-55.7	-31.8	178.5	-63	176.2	162.3	0	0	112.2	P628 K629 G630 L634 W635 H636	P628-E632 VanDerWaalsContact CA-OE2 3.23Å; P628-E632 WeakPolarHBondContact CA-OE2 3.35Å; P628-E632 HydrophobicContact CB-CB 3.93Å; K629-E632 PolarHBondContact N-OE2 3.04Å; K629-E632 WeakPolarHBondContact O-CB 3.37Å; K629-E632 VanDerWaalsContact O-CG 3.23Å; K629-E632 WeakPolarHBondContact O-CG 3.16Å; K629-E632 PolarHBondContact O-N 3.21Å; G630-E632 PolarHBondContact O-N 2.9Å; E632-L634 PolarHBondContact O-N 3.1Å; E632-L634 VanDerWaalsContact O-N 3.13Å; E632-W635 HydrophobicContact CB-CH2 4.48Å; E632-W635 HydrophobicContact CB-CZ2 4.16Å; E632-W635 HydrophobicContact CG-CH2 4.3Å; E632-W635 HydrophobicContact CG-CZ2 3.97Å; E632-W635 PolarHBondContact O-N 3.17Å; E632-H636 WeakPolarHBondContact O-CB 3.46Å; E632-H636 PolarHBondContact O-N 2.98Å
633	W	95	Very high	88.8	Confident	25 Å²	25	41.3 Å²	41.3	10%	0.095	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-52.4	-32.6	173.7	-82	106.2	0	0	0	113.1	V540 V544 P628 G630 L631 W635 K638 I639	V540-W633 HydrophobicContact CG1-CB 3.78Å; V540-W633 HydrophobicContact CG1-CG 4.48Å; V544-W633 HydrophobicContact CB-CD2 4.44Å; V544-W633 HydrophobicContact CG1-CD2 3.95Å; V544-W633 HydrophobicContact CG1-CE3 3.77Å; V544-W633 HydrophobicContact CG1-CH2 3.96Å; V544-W633 HydrophobicContact CG1-CZ2 4.14Å; V544-W633 HydrophobicContact CG1-CZ3 3.77Å; V544-W633 HydrophobicContact CG2-CB 4.27Å; V544-W633 HydrophobicContact CG2-CD2 4.24Å; V544-W633 HydrophobicContact CG2-CE3 4.35Å; V544-W633 HydrophobicContact CG2-CG 4.23Å; P628-W633 HydrophobicContact CB-CD2 4.1Å; P628-W633 HydrophobicContact CB-CG 4.23Å; P628-W633 HydrophobicContact CG-CD2 3.66Å; P628-W633 HydrophobicContact CG-CE3 3.74Å; P628-W633 HydrophobicContact CG-CG 4.32Å; P628-W633 HydrophobicContact CG-CH2 3.92Å; P628-W633 HydrophobicContact CG-CZ2 3.83Å; P628-W633 HydrophobicContact CG-CZ3 3.88Å; P628-W633 PolarHBondContact O-NE1 3.19Å; G630-W633 PolarHBondContact O-N 3.18Å; L631-W633 PolarHBondContact O-N 3.07Å; L631-W633 VanDerWaalsContact O-N 3.1Å; W633-W635 PolarHBondContact O-N 3.41Å; W633-K638 HydrophobicContact CZ3-CB 3.83Å; W633-I639 HydrophobicContact CE3-CD1 4.26Å; W633-I639 WeakPolarHBondContact O-CB 3.28Å; W633-I639 WeakPolarHBondContact O-CG1 3.44Å; W633-I639 WeakPolarHBondContact O-CG2 3.32Å
634	L	94.6	Very high	90.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-70	-18.1	-174.7	-59.3	174.5	0	0	0	113.4	R534 V540 L568 L571 L575 L631 E632 I667	R534-L634 HydrophobicContact CG-CD1 3.78Å; V540-L634 HydrophobicContact CG1-CD2 4.05Å; V540-L634 HydrophobicContact CG1-CG 4.17Å; L568-L634 HydrophobicContact CD2-CD2 4.16Å; L571-L634 HydrophobicContact CB-CD1 3.82Å; L571-L634 HydrophobicContact CB-CD2 4.02Å; L575-L634 HydrophobicContact CD1-CB 4.04Å; L575-L634 HydrophobicContact CD1-CD1 4.03Å; L575-L634 HydrophobicContact CD2-CB 3.75Å; L575-L634 WeakPolarHBondContact CD2-O 3.32Å; L631-L634 HydrophobicContact CB-CD1 4.29Å; L631-L634 WeakPolarHBondContact O-CB 3.48Å; L631-L634 WeakPolarHBondContact O-CG 3.29Å; L631-L634 PolarHBondContact O-N 2.95Å; E632-L634 PolarHBondContact O-N 3.1Å; E632-L634 VanDerWaalsContact O-N 3.13Å; L634-I667 WeakPolarHBondContact O-CG2 3.49Å
635	W	90.1	Very high	91.6	Very high	7 Å²	7	39.2 Å²	39.2	3%	0.027	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.4	1	177.6	67.4	86	0	0	0	114.6	L575 F576 L579 I583 L587 L631 E632 W633 W674 L678	L575-W635 HydrophobicContact CD1-CE3 4.3Å; L575-W635 HydrophobicContact CD2-CB 3.98Å; L575-W635 HydrophobicContact CD2-CE3 4.17Å; L575-W635 HydrophobicContact CG-CE3 4.45Å; F576-W635 HydrophobicContact CE1-CB 4.02Å; F576-W635 HydrophobicContact CZ-CB 4.43Å; L579-W635 HydrophobicContact CD2-CE3 4.13Å; L579-W635 HydrophobicContact CD2-CH2 3.9Å; L579-W635 HydrophobicContact CD2-CZ3 3.47Å; L579-W635 VanDerWaalsContact CD2-CZ3 3.47Å; I583-W635 HydrophobicContact CD1-CH2 4.4Å; I583-W635 HydrophobicContact CG2-CH2 3.63Å; I583-W635 HydrophobicContact CG2-CZ2 3.65Å; L587-W635 HydrophobicContact CD1-CD2 4.41Å; L587-W635 HydrophobicContact CD1-CZ2 3.98Å; L631-W635 VanDerWaalsContact C-CZ3 3.46Å; L631-W635 HydrophobicContact CB-CZ3 4.07Å; L631-W635 HydrophobicContact CD1-CH2 4.08Å; L631-W635 HydrophobicContact CD1-CZ3 3.9Å; L631-W635 HydrophobicContact CG-CH2 3.76Å; L631-W635 HydrophobicContact CG-CZ3 3.69Å; L631-W635 VanDerWaalsContact O-CE3 3.25Å; L631-W635 WeakPolarHBondContact O-CZ3 3.33Å; E632-W635 HydrophobicContact CB-CH2 4.48Å; E632-W635 HydrophobicContact CB-CZ2 4.16Å; E632-W635 HydrophobicContact CG-CH2 4.3Å; E632-W635 HydrophobicContact CG-CZ2 3.97Å; E632-W635 PolarHBondContact O-N 3.17Å; W633-W635 PolarHBondContact O-N 3.41Å; W635-W674 AromaticContact CD1-CE2 3.7Å; W635-W674 AromaticContact CD1-CZ2 3.9Å; W635-W674 AromaticContact CD1-NE1 3.47Å; W635-W674 AromaticContact CG-NE1 3.94Å; W635-W674 PolarHBondContact O-NE1 3.38Å; W635-W674 VanDerWaalsContact O-NE1 3.12Å; W635-L678 HydrophobicContact CB-CD1 4.5Å
636	H	92	Very high	92.7	Very high	13 Å²	13	36.8 Å²	36.8	6%	0.06	18%	0.184	C	C	.	.	S	Bend	trans	-82.5	135.3	-179.6	177.6	-72.6	0	0	0	111.8	S625 P628 E632 K638 I639	S625-H636 PolarHBondContact O-CD2 3.36Å; S625-H636 PolarHBondContact O-NE2 2.91Å; S625-H636 VanDerWaalsContact O-NE2 3.12Å; P628-H636 HydrophobicContact CB-CB 3.88Å; P628-H636 HydrophobicContact CG-CB 4.08Å; E632-H636 WeakPolarHBondContact O-CB 3.46Å; E632-H636 PolarHBondContact O-N 2.98Å; H636-K638 VanDerWaalsContact C-N 3.26Å; H636-K638 WeakPolarHBondContact ND1-CB 3.31Å; H636-K638 PolarHBondContact ND1-N 3.14Å; H636-K638 PolarHBondContact O-N 3.06Å; H636-I639 WeakPolarHBondContact O-CG2 3.4Å; H636-I639 PolarHBondContact O-N 3.44Å
637	P	92	Very high	93.4	Very high	11 Å²	11	28.5 Å²	28.5	7%	0.071	15%	0.148	C	C	.	.	H	α-helix	trans	-46.1	-34.9	-175.8	-33.3	35.6	0	0	0	117.7	F619 I639 V640 H641 Y681	F619-P637 HydrophobicContact CD1-CG 4.08Å; F619-P637 HydrophobicContact CE1-CG 3.38Å; F619-P637 HydrophobicContact CE2-CG 4.32Å; F619-P637 HydrophobicContact CZ-CG 3.52Å; P637-I639 PolarHBondContact O-N 2.78Å; P637-I639 VanDerWaalsContact O-N 3.1Å; P637-V640 VanDerWaalsContact O-CB 3.31Å; P637-V640 WeakPolarHBondContact O-CB 3.5Å; P637-V640 PolarHBondContact O-N 2.85Å; P637-H641 PolarHBondContact O-CD2 3.15Å; P637-H641 VanDerWaalsContact O-CD2 3.27Å; P637-H641 PolarHBondContact O-N 3.05Å; P637-Y681 HydrophobicContact CB-CD1 4.3Å; P637-Y681 HydrophobicContact CB-CE1 3.73Å; P637-Y681 HydrophobicContact CG-CE1 4.49Å
638	K	93.9	Very high	93.9	Very high	88 Å²	88	30.1 Å²	30.1	38%	0.383	15%	0.146	S	C	.	.	H	α-helix	trans	-55.2	-22.8	173.2	-74.8	166.7	-178	178.2	0	114.4	K626 W633 H636 L642	K626-K638 PolarHBondContact O-NZ 3.25Å; W633-K638 HydrophobicContact CZ3-CB 3.83Å; H636-K638 VanDerWaalsContact C-N 3.26Å; H636-K638 WeakPolarHBondContact ND1-CB 3.31Å; H636-K638 PolarHBondContact ND1-N 3.14Å; H636-K638 PolarHBondContact O-N 3.06Å; K638-L642 PolarHBondContact O-N 3.48Å; K638-L642 VanDerWaalsContact O-N 3.15Å
639	I	95.8	Very high	94	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-78.3	-34.9	174.7	-149.7	74.7	0	0	0	112.1	V544 W633 H636 P637 H641 L642 Y643 I667	V544-I639 HydrophobicContact CG2-CD1 3.59Å; W633-I639 HydrophobicContact CE3-CD1 4.26Å; W633-I639 WeakPolarHBondContact O-CB 3.28Å; W633-I639 WeakPolarHBondContact O-CG1 3.44Å; W633-I639 WeakPolarHBondContact O-CG2 3.32Å; H636-I639 WeakPolarHBondContact O-CG2 3.4Å; H636-I639 PolarHBondContact O-N 3.44Å; P637-I639 PolarHBondContact O-N 2.78Å; P637-I639 VanDerWaalsContact O-N 3.1Å; I639-H641 VanDerWaalsContact C-N 3.27Å; I639-H641 PolarHBondContact O-N 3.2Å; I639-L642 HydrophobicContact CD1-CD2 4.04Å; I639-L642 PolarHBondContact O-N 3.48Å; I639-Y643 HydrophobicContact CB-CE2 4.44Å; I639-Y643 HydrophobicContact CD1-CE1 4.31Å; I639-Y643 HydrophobicContact CG1-CD1 4.43Å; I639-Y643 HydrophobicContact CG1-CD2 4.28Å; I639-Y643 HydrophobicContact CG1-CE1 3.84Å; I639-Y643 HydrophobicContact CG1-CE2 3.68Å; I639-Y643 VanDerWaalsContact CG1-CZ 3.43Å; I639-Y643 HydrophobicContact CG2-CD2 4.48Å; I639-Y643 HydrophobicContact CG2-CE2 4.07Å; I639-Y643 WeakPolarHBondContact O-CB 3.45Å; I639-Y643 WeakPolarHBondContact O-CD2 3.43Å; I639-Y643 VanDerWaalsContact O-CG 3.24Å; I639-Y643 PolarHBondContact O-N 2.77Å; I639-I667 HydrophobicContact CG2-CD1 4.23Å
640	V	96	Very high	94.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.1	-42.7	172.3	176.3	0	0	0	0	109.8	P637 N644 L664 I667 M682 Y686 M688	P637-V640 VanDerWaalsContact O-CB 3.31Å; P637-V640 WeakPolarHBondContact O-CB 3.5Å; P637-V640 PolarHBondContact O-N 2.85Å; V640-N644 WeakPolarHBondContact O-CB 3.41Å; V640-N644 PolarHBondContact O-N 3.23Å; V640-L664 HydrophobicContact CB-CD2 4.4Å; V640-L664 HydrophobicContact CG1-CD2 4.17Å; V640-L664 HydrophobicContact CG2-CD2 4.35Å; V640-I667 HydrophobicContact CG2-CD1 4.05Å; V640-M682 HydrophobicContact CG1-CE 4.47Å; V640-M682 HydrophobicContact CG1-CG 3.53Å; V640-M682 HydrophobicContact CG1-SD 4.13Å; V640-M682 HydrophobicContact CG2-CG 4.33Å; V640-M682 HydrophobicContact CG2-SD 4.42Å; V640-Y686 HydrophobicContact CG1-CD1 3.93Å; V640-Y686 HydrophobicContact CG1-CE1 4.14Å; V640-M688 HydrophobicContact CG1-SD 3.94Å
641	H	95.9	Very high	94	Very high	65 Å²	65	33 Å²	33	30%	0.301	16%	0.164	S	C	.	.	H	α-helix	trans	-62.9	-45.5	174.9	-72.2	-136.1	0	0	0	111.3	P637 I639 N644 S645 Y681 Y686	P637-H641 PolarHBondContact O-CD2 3.15Å; P637-H641 VanDerWaalsContact O-CD2 3.27Å; P637-H641 PolarHBondContact O-N 3.05Å; I639-H641 VanDerWaalsContact C-N 3.27Å; I639-H641 PolarHBondContact O-N 3.2Å; H641-N644 PolarHBondContact O-N 3.17Å; H641-S645 PolarHBondContact O-N 3.31Å; H641-S645 PolarHBondContact O-OG 3.37Å; H641-Y681 AromaticContact NE2-CE1 3.92Å; H641-Y681 AromaticContact NE2-CZ 3.81Å; H641-Y681 PolarHBondContact NE2-OH 3.04Å; H641-Y686 AromaticContact CD2-CD2 3.92Å; H641-Y686 AromaticContact CD2-CE1 3.92Å; H641-Y686 AromaticContact CD2-CE2 3.74Å; H641-Y686 AromaticContact CD2-CZ 3.74Å; H641-Y686 AromaticContact CE1-CD2 3.52Å; H641-Y686 AromaticContact CE1-CE2 3.35Å; H641-Y686 WeakPolarHBondContact CE1-CE2 3.49Å; H641-Y686 AromaticContact CG-CE2 3.76Å; H641-Y686 AromaticContact CG-CZ 3.68Å; H641-Y686 AromaticContact ND1-CE2 3.54Å; H641-Y686 AromaticContact ND1-CZ 3.92Å; H641-Y686 AromaticContact NE2-CD2 3.34Å; H641-Y686 VanDerWaalsContact NE2-CD2 3.34Å; H641-Y686 WeakPolarHBondContact NE2-CD2 3.48Å; H641-Y686 AromaticContact NE2-CE2 3.48Å; H641-Y686 WeakPolarHBondContact NE2-CE2 3.24Å; H641-Y686 AromaticContact NE2-CG 3.75Å; H641-Y686 AromaticContact NE2-CZ 3.98Å
642	L	97.3	Very high	93.9	Very high	10 Å²	10	37.9 Å²	37.9	5%	0.052	19%	0.19	C	C	.	.	H	α-helix	trans	-61	-49.1	178.7	-173.8	57.4	0	0	0	111.7	V544 L547 R548 L551 K638 I639 N644 S645 V646	V544-L642 HydrophobicContact CG1-CD2 3.89Å; V544-L642 HydrophobicContact CG2-CD2 4.48Å; L547-L642 HydrophobicContact CD2-CD1 4.39Å; L547-L642 HydrophobicContact CD2-CD2 3.75Å; L547-L642 HydrophobicContact CD2-CG 3.85Å; L547-L642 HydrophobicContact CG-CD1 4.33Å; L547-L642 HydrophobicContact CG-CD2 4.31Å; L547-L642 HydrophobicContact CG-CG 4.32Å; R548-L642 HydrophobicContact CG-CD1 3.63Å; R548-L642 HydrophobicContact CG-CD2 4.23Å; L551-L642 HydrophobicContact CD1-CD1 3.51Å; K638-L642 PolarHBondContact O-N 3.48Å; K638-L642 VanDerWaalsContact O-N 3.15Å; I639-L642 HydrophobicContact CD1-CD2 4.04Å; I639-L642 PolarHBondContact O-N 3.48Å; L642-N644 VanDerWaalsContact C-N 3.33Å; L642-N644 PolarHBondContact O-N 3.4Å; L642-S645 WeakPolarHBondContact O-CB 3.3Å; L642-S645 PolarHBondContact O-N 3.46Å; L642-V646 WeakPolarHBondContact O-CG2 3.35Å; L642-V646 PolarHBondContact O-N 2.94Å
643	Y	97.9	Very high	93.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.8	-36.2	176.6	-61.1	-26.7	0	0	0	112.3	M565 L568 I639 V646 I647 A663 L664	M565-Y643 HydrophobicContact CE-CD1 3.67Å; M565-Y643 HydrophobicContact CE-CE1 3.72Å; M565-Y643 HydrophobicContact SD-CD1 4.07Å; M565-Y643 HydrophobicContact SD-CE1 4.18Å; L568-Y643 HydrophobicContact CB-CE1 4.31Å; L568-Y643 HydrophobicContact CD1-CE1 4.2Å; I639-Y643 HydrophobicContact CB-CE2 4.44Å; I639-Y643 HydrophobicContact CD1-CE1 4.31Å; I639-Y643 HydrophobicContact CG1-CD1 4.43Å; I639-Y643 HydrophobicContact CG1-CD2 4.28Å; I639-Y643 HydrophobicContact CG1-CE1 3.84Å; I639-Y643 HydrophobicContact CG1-CE2 3.68Å; I639-Y643 VanDerWaalsContact CG1-CZ 3.43Å; I639-Y643 HydrophobicContact CG2-CD2 4.48Å; I639-Y643 HydrophobicContact CG2-CE2 4.07Å; I639-Y643 WeakPolarHBondContact O-CB 3.45Å; I639-Y643 WeakPolarHBondContact O-CD2 3.43Å; I639-Y643 VanDerWaalsContact O-CG 3.24Å; I639-Y643 PolarHBondContact O-N 2.77Å; Y643-V646 PolarHBondContact O-N 3.29Å; Y643-I647 WeakPolarHBondContact O-CB 3.35Å; Y643-I647 WeakPolarHBondContact O-CD1 3.39Å; Y643-I647 WeakPolarHBondContact O-CG1 3.5Å; Y643-I647 PolarHBondContact O-N 3.32Å; Y643-A663 HydrophobicContact CD2-CB 4.02Å; Y643-A663 HydrophobicContact CE1-CB 4.22Å; Y643-A663 HydrophobicContact CE2-CB 3.54Å; Y643-L664 HydrophobicContact CD2-CD2 3.76Å; Y643-L664 HydrophobicContact CD2-CG 3.86Å; Y643-L664 HydrophobicContact CG-CD2 4.43Å; Y643-L664 HydrophobicContact CG-CG 4.35Å
644	N	96.8	Very high	93.7	Very high	3 Å²	3	36 Å²	36	2%	0.016	19%	0.188	C	C	.	.	H	α-helix	trans	-64.9	-41.4	172.8	-166.9	25.1	0	0	0	112.1	V640 H641 L642 I647 K648 Y686 M688	V640-N644 WeakPolarHBondContact O-CB 3.41Å; V640-N644 PolarHBondContact O-N 3.23Å; H641-N644 PolarHBondContact O-N 3.17Å; L642-N644 VanDerWaalsContact C-N 3.33Å; L642-N644 PolarHBondContact O-N 3.4Å; N644-I647 PolarHBondContact O-N 2.9Å; N644-K648 WeakPolarHBondContact O-CG 3.49Å; N644-K648 PolarHBondContact O-N 3.34Å; N644-K648 WeakPolarHBondContact OD1-CE 3.34Å; N644-Y686 HydrophobicContact CB-CE1 3.92Å; N644-Y686 VanDerWaalsContact ND2-CE1 3.35Å; N644-Y686 WeakPolarHBondContact ND2-CE1 3.26Å; N644-Y686 VanDerWaalsContact ND2-CZ 3.35Å; N644-Y686 PolarHBondContact ND2-OH 3.47Å; N644-M688 HydrophobicContact CB-CE 3.48Å; N644-M688 VanDerWaalsContact CB-CE 3.48Å; N644-M688 HydrophobicContact CB-CG 4.48Å; N644-M688 HydrophobicContact CB-SD 3.83Å; N644-M688 WeakPolarHBondContact OD1-CE 3.26Å
645	S	97.1	Very high	93.6	Very high	50 Å²	50	38.2 Å²	38.2	35%	0.35	20%	0.199	S	C	.	.	H	α-helix	trans	-62.8	-42.7	173.9	-64	0	0	0	0	111.8	H641 L642 I647 K648 S649	H641-S645 PolarHBondContact O-N 3.31Å; H641-S645 PolarHBondContact O-OG 3.37Å; L642-S645 WeakPolarHBondContact O-CB 3.3Å; L642-S645 PolarHBondContact O-N 3.46Å; S645-I647 VanDerWaalsContact C-N 3.34Å; S645-I647 PolarHBondContact O-N 3.23Å; S645-K648 PolarHBondContact O-N 2.72Å; S645-S649 WeakPolarHBondContact O-CB 3.39Å; S645-S649 PolarHBondContact O-N 3.31Å; S645-S649 PolarHBondContact O-OG 3.46Å
646	V	96.8	Very high	93.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.9	-45.9	172.3	174.5	0	0	0	0	111.5	L547 L551 I556 M565 L642 Y643 K648 S649 C650 T656 A660	L547-V646 HydrophobicContact CD1-CG2 3.91Å; L547-V646 HydrophobicContact CD2-CG2 4.15Å; L547-V646 HydrophobicContact CG-CG2 4.14Å; L551-V646 HydrophobicContact CD1-CG2 3.99Å; L551-V646 HydrophobicContact CD2-CG2 4.29Å; L551-V646 HydrophobicContact CG-CG2 4.36Å; I556-V646 HydrophobicContact CD1-CB 4.38Å; I556-V646 HydrophobicContact CD1-CG1 4.01Å; I556-V646 HydrophobicContact CD1-CG2 3.8Å; I556-V646 HydrophobicContact CG1-CG1 4.18Å; I556-V646 HydrophobicContact CG1-CG2 4.48Å; M565-V646 HydrophobicContact CG-CG1 4.19Å; M565-V646 HydrophobicContact SD-CG1 4.25Å; M565-V646 HydrophobicContact SD-CG2 4.03Å; L642-V646 WeakPolarHBondContact O-CG2 3.35Å; L642-V646 PolarHBondContact O-N 2.94Å; Y643-V646 PolarHBondContact O-N 3.29Å; V646-K648 VanDerWaalsContact C-N 3.27Å; V646-K648 PolarHBondContact O-N 3.36Å; V646-S649 PolarHBondContact O-N 3.12Å; V646-C650 WeakPolarHBondContact O-CB 3.48Å; V646-C650 PolarHBondContact O-N 3.2Å; V646-T656 HydrophobicContact CG1-CG2 3.76Å; V646-A660 HydrophobicContact CB-CB 4.21Å; V646-A660 HydrophobicContact CG1-CB 3.87Å
647	I	95.6	Very high	94	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-61.3	-36	179.5	-72.9	164.1	0	0	0	112.1	Y643 N644 S645 R657 A660 I661 L664 M688 L692 H695	Y643-I647 WeakPolarHBondContact O-CB 3.35Å; Y643-I647 WeakPolarHBondContact O-CD1 3.39Å; Y643-I647 WeakPolarHBondContact O-CG1 3.5Å; Y643-I647 PolarHBondContact O-N 3.32Å; N644-I647 PolarHBondContact O-N 2.9Å; S645-I647 VanDerWaalsContact C-N 3.34Å; S645-I647 PolarHBondContact O-N 3.23Å; I647-R657 HydrophobicContact CG1-CG 4.26Å; I647-R657 HydrophobicContact CG2-CG 4.46Å; I647-R657 WeakPolarHBondContact O-CD 3.38Å; I647-A660 HydrophobicContact CD1-CB 4.06Å; I647-A660 HydrophobicContact CG1-CB 3.67Å; I647-I661 HydrophobicContact CD1-CG1 3.61Å; I647-I661 HydrophobicContact CG1-CG1 3.91Å; I647-L664 HydrophobicContact CD1-CD1 3.54Å; I647-M688 HydrophobicContact CD1-CE 4.02Å; I647-L692 HydrophobicContact CD1-CD2 4.27Å; I647-H695 WeakPolarHBondContact CG2-NE2 3.18Å
648	K	94.1	Very high	94.2	Very high	105 Å²	105	37.9 Å²	37.9	46%	0.457	20%	0.196	S	C	.	.	H	α-helix	trans	-80.4	-37.4	179.5	-71.7	177.2	175.2	-159.2	0	114.5	N644 S645 V646 N691	N644-K648 WeakPolarHBondContact O-CG 3.49Å; N644-K648 PolarHBondContact O-N 3.34Å; N644-K648 WeakPolarHBondContact OD1-CE 3.34Å; S645-K648 PolarHBondContact O-N 2.72Å; V646-K648 VanDerWaalsContact C-N 3.27Å; V646-K648 PolarHBondContact O-N 3.36Å; K648-N691 VanDerWaalsContact CE-CG 3.41Å; K648-N691 WeakPolarHBondContact CE-OD1 3.48Å; K648-N691 PolarHBondContact NZ-OD1 2.73Å
649	S	92.9	Very high	94.4	Very high	67 Å²	67	33.7 Å²	33.7	47%	0.469	18%	0.178	S	C	.	.	H	α-helix	trans	-92.3	-12.9	-173.8	-63	0	0	0	0	113.9	I556 S645 V646	I556-S649 VanDerWaalsContact CG2-O 3.29Å; I556-S649 WeakPolarHBondContact CG2-O 3.48Å; S645-S649 WeakPolarHBondContact O-CB 3.39Å; S645-S649 PolarHBondContact O-N 3.31Å; S645-S649 PolarHBondContact O-OG 3.46Å; V646-S649 PolarHBondContact O-N 3.12Å
650	C	91.8	Very high	94.5	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.007	18%	0.178	C	C	.	.			trans	-100.8	104.6	175.8	177.6	0	0	0	0	110	I556 E557 V646 N653 R657	I556-C650 HydrophobicContact CG1-CB 4.18Å; I556-C650 HydrophobicContact CG2-CB 4.29Å; E557-C650 PolarHBondContact OE2-SG 3.33Å; V646-C650 WeakPolarHBondContact O-CB 3.48Å; V646-C650 PolarHBondContact O-N 3.2Å; C650-N653 PolarHBondContact SG-O 2.77Å; C650-R657 PolarHBondContact O-NH1 3.38Å
651	E	86.7	Confident	94.6	Very high	154 Å²	154	33.7 Å²	33.7	72%	0.72	18%	0.178	S	C	*	.	S	Bend	trans	-93.7	-44.7	178.3	-63.8	-172.7	172.9	0	0	111	E557 R657	E557-E651 PolarHBondContact OE1-N 2.82Å; E651-R657 VanDerWaalsContact C-NH1 3.32Å; E651-R657 PolarHBondContact O-NH1 2.88Å
652	I	87.8	Confident	94.6	Very high	127 Å²	127	30.6 Å²	30.6	65%	0.651	16%	0.164	S	C	*	.	S	Bend	trans	-83.1	-57.7	-168.2	-55	178	0	0	0	110.4	E557 A654 R700	E557-I652 PolarHBondContact OE1-N 2.8Å; I652-A654 PolarHBondContact O-N 2.79Å; I652-R700 PolarHBondContact O-NH1 2.92Å; I652-R700 PolarHBondContact O-NH2 2.93Å; I652-R700 VanDerWaalsContact O-NH2 3.11Å
653	N	91.6	Very high	94.7	Very high	27 Å²	27	30.1 Å²	30.1	14%	0.144	16%	0.161	C	C	.	.			trans	-74.3	89.5	-169.2	-167.5	-24.3	0	0	0	112.3	E557 C650 L655 T656 R657	E557-N653 PolarHBondContact O-ND2 2.81Å; E557-N653 VanDerWaalsContact O-ND2 3.07Å; E557-N653 WeakPolarHBondContact OE2-CA 3.46Å; E557-N653 WeakPolarHBondContact OE2-CB 3.22Å; E557-N653 PolarHBondContact OE2-N 3.45Å; C650-N653 PolarHBondContact SG-O 2.77Å; N653-L655 PolarHBondContact O-N 3.37Å; N653-L655 WeakPolarHBondContact OD1-CB 3.15Å; N653-L655 PolarHBondContact OD1-N 2.95Å; N653-T656 VanDerWaalsContact CG-OG1 3.24Å; N653-T656 PolarHBondContact ND2-OG1 3.3Å; N653-T656 PolarHBondContact O-N 2.96Å; N653-T656 PolarHBondContact OD1-N 3.02Å; N653-R657 PolarHBondContact O-N 3.03Å
654	A	91.2	Very high	94.7	Very high	28 Å²	28	30.1 Å²	30.1	23%	0.231	16%	0.161	C	C	.	.	H	α-helix	trans	-46.6	-35.5	175	0	0	0	0	0	114	I652 E658	I652-A654 PolarHBondContact O-N 2.79Å; A654-E658 VanDerWaalsContact O-CB 3.23Å; A654-E658 WeakPolarHBondContact O-CB 3.49Å; A654-E658 PolarHBondContact O-N 2.85Å
655	L	92.1	Very high	94.7	Very high	45 Å²	45	32 Å²	32	24%	0.236	17%	0.17	C	C	.	.	H	α-helix	trans	-78.5	-40.1	-173.1	-58.3	175.9	0	0	0	111.4	E562 N653 A659	E562-L655 HydrophobicContact CG-CB 3.76Å; N653-L655 PolarHBondContact O-N 3.37Å; N653-L655 WeakPolarHBondContact OD1-CB 3.15Å; N653-L655 PolarHBondContact OD1-N 2.95Å; L655-A659 WeakPolarHBondContact O-CB 3.38Å; L655-A659 PolarHBondContact O-N 3.2Å
656	T	96	Very high	94.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61.6	-44.6	172.8	-54	0	0	0	0	110.8	I556 E562 M565 V646 N653 A659 A660	I556-T656 HydrophobicContact CD1-CG2 4.21Å; I556-T656 HydrophobicContact CG1-CG2 4.4Å; E562-T656 VanDerWaalsContact CA-OG1 3.28Å; E562-T656 WeakPolarHBondContact CA-OG1 3.1Å; E562-T656 WeakPolarHBondContact CB-OG1 3.23Å; M565-T656 HydrophobicContact CB-CG2 4.26Å; M565-T656 HydrophobicContact CG-CG2 3.81Å; V646-T656 HydrophobicContact CG1-CG2 3.76Å; N653-T656 VanDerWaalsContact CG-OG1 3.24Å; N653-T656 PolarHBondContact ND2-OG1 3.3Å; N653-T656 PolarHBondContact O-N 2.96Å; N653-T656 PolarHBondContact OD1-N 3.02Å; T656-A659 PolarHBondContact O-N 3.07Å; T656-A660 PolarHBondContact O-N 3.37Å
657	R	95.1	Very high	94.7	Very high	18 Å²	18	31.4 Å²	31.4	7%	0.068	16%	0.163	C	C	.	.	H	α-helix	trans	-71.6	-41.4	178.4	-167.1	167	67.1	-117.2	-0.1	113.3	I647 C650 E651 N653 A659 A660 I661 R700 E703	I647-R657 HydrophobicContact CG1-CG 4.26Å; I647-R657 HydrophobicContact CG2-CG 4.46Å; I647-R657 WeakPolarHBondContact O-CD 3.38Å; C650-R657 PolarHBondContact O-NH1 3.38Å; E651-R657 VanDerWaalsContact C-NH1 3.32Å; E651-R657 PolarHBondContact O-NH1 2.88Å; N653-R657 PolarHBondContact O-N 3.03Å; R657-A659 VanDerWaalsContact C-N 3.28Å; R657-A659 PolarHBondContact O-N 3.41Å; R657-A660 PolarHBondContact O-N 2.85Å; R657-I661 HydrophobicContact CG-CD1 4.1Å; R657-I661 WeakPolarHBondContact O-CG1 3.29Å; R657-I661 PolarHBondContact O-N 2.94Å; R657-R700 VanDerWaalsContact NH2-NH1 3.14Å; R657-E703 IonicContact CZ-OE1 2.8Å; R657-E703 VanDerWaalsContact CZ-OE1 3.25Å; R657-E703 IonicContact CZ-OE2 2.75Å; R657-E703 IonicContact NE-OE1 3.95Å; R657-E703 PolarHBondContact NE-OE1 3.22Å; R657-E703 IonicContact NE-OE2 3.93Å; R657-E703 VanDerWaalsContact NH2-CD 3.3Å; R657-E703 IonicContact NH2-OE1 3.7Å; R657-E703 PolarHBondContact NH2-OE1 3.26Å; R657-E703 IonicContact NH2-OE2 2.81Å; R657-E703 PolarHBondContact NH2-OE2 3.03Å
658	E	95.5	Very high	94.7	Very high	7 Å²	7	31.3 Å²	31.3	3%	0.033	16%	0.162	C	C	.	.	H	α-helix	trans	-58.5	-41.9	170.6	-171.3	-155.5	142.2	0	0	110.6	R569 A654 I661 G662 N702 R705 S706	R569-E658 IonicContact CZ-OE1 2.66Å; R569-E658 IonicContact NH1-OE1 2.86Å; R569-E658 PolarHBondContact NH1-OE1 3.25Å; R569-E658 IonicContact NH2-OE1 3.24Å; A654-E658 VanDerWaalsContact O-CB 3.23Å; A654-E658 WeakPolarHBondContact O-CB 3.49Å; A654-E658 PolarHBondContact O-N 2.85Å; E658-I661 PolarHBondContact O-N 3.21Å; E658-G662 PolarHBondContact O-N 3.25Å; E658-N702 HydrophobicContact CG-CB 4.4Å; E658-N702 WeakPolarHBondContact OE2-CB 3.35Å; E658-R705 IonicContact OE1-NH2 2.7Å; E658-R705 PolarHBondContact OE1-NH2 2.75Å; E658-R705 VanDerWaalsContact OE1-NH2 3.14Å; E658-S706 WeakPolarHBondContact CG-OG 3.45Å
659	A	97.5	Very high	94.6	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.2	-41	178.9	0	0	0	0	0	112.2	M565 L655 T656 R657 G662 A663	M565-A659 HydrophobicContact CB-CB 3.85Å; L655-A659 WeakPolarHBondContact O-CB 3.38Å; L655-A659 PolarHBondContact O-N 3.2Å; T656-A659 PolarHBondContact O-N 3.07Å; R657-A659 VanDerWaalsContact C-N 3.28Å; R657-A659 PolarHBondContact O-N 3.41Å; A659-G662 PolarHBondContact O-N 3.14Å; A659-A663 WeakPolarHBondContact O-CB 3.29Å; A659-A663 PolarHBondContact O-N 3.44Å
660	A	98.1	Very high	94.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65	-45.8	175.4	0	0	0	0	0	112.7	M565 V646 I647 T656 R657 G662 A663 L664	M565-A660 HydrophobicContact CE-CB 3.66Å; V646-A660 HydrophobicContact CB-CB 4.21Å; V646-A660 HydrophobicContact CG1-CB 3.87Å; I647-A660 HydrophobicContact CD1-CB 4.06Å; I647-A660 HydrophobicContact CG1-CB 3.67Å; T656-A660 PolarHBondContact O-N 3.37Å; R657-A660 PolarHBondContact O-N 2.85Å; A660-G662 VanDerWaalsContact C-N 3.32Å; A660-G662 PolarHBondContact O-N 3.34Å; A660-A663 PolarHBondContact O-N 3.42Å; A660-L664 WeakPolarHBondContact O-CG 3.47Å; A660-L664 PolarHBondContact O-N 3.29Å; A660-L664 VanDerWaalsContact O-N 3.08Å
661	I	97.9	Very high	93.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.8	-40.5	175.5	-65	169	0	0	0	110.6	I647 R657 E658 L664 Q665 E703 L707 L710	I647-I661 HydrophobicContact CD1-CG1 3.61Å; I647-I661 HydrophobicContact CG1-CG1 3.91Å; R657-I661 HydrophobicContact CG-CD1 4.1Å; R657-I661 WeakPolarHBondContact O-CG1 3.29Å; R657-I661 PolarHBondContact O-N 2.94Å; E658-I661 PolarHBondContact O-N 3.21Å; I661-L664 PolarHBondContact O-N 2.96Å; I661-Q665 WeakPolarHBondContact O-CB 3.46Å; I661-Q665 PolarHBondContact O-N 3.4Å; I661-E703 HydrophobicContact CD1-CG 4.05Å; I661-L707 VanDerWaalsContact CG2-CA 3.46Å; I661-L707 HydrophobicContact CG2-CB 3.99Å; I661-L707 HydrophobicContact CG2-CD1 4.33Å; I661-L710 HydrophobicContact CG2-CD2 4.33Å
662	G	97.6	Very high	93.8	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-70.3	-31.6	177	0	0	0	0	0	114	E658 A659 A660 Q665 N666	E658-G662 PolarHBondContact O-N 3.25Å; A659-G662 PolarHBondContact O-N 3.14Å; A660-G662 VanDerWaalsContact C-N 3.32Å; A660-G662 PolarHBondContact O-N 3.34Å; G662-Q665 PolarHBondContact O-N 3.28Å; G662-N666 WeakPolarHBondContact O-CB 3.4Å; G662-N666 PolarHBondContact O-N 3.34Å
663	A	98.4	Very high	93.8	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.4	-44.4	172.1	0	0	0	0	0	110.8	R569 Y643 A659 A660 N666 I667	R569-A663 HydrophobicContact CB-CB 4.06Å; Y643-A663 HydrophobicContact CD2-CB 4.02Å; Y643-A663 HydrophobicContact CE1-CB 4.22Å; Y643-A663 HydrophobicContact CE2-CB 3.54Å; A659-A663 WeakPolarHBondContact O-CB 3.29Å; A659-A663 PolarHBondContact O-N 3.44Å; A660-A663 PolarHBondContact O-N 3.42Å; A663-N666 PolarHBondContact O-N 3.06Å; A663-I667 PolarHBondContact O-N 3.02Å; A663-I667 VanDerWaalsContact O-N 3.08Å
664	L	98.1	Very high	93.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.8	-41.3	172.4	-69	167.2	0	0	0	112.2	V640 Y643 I647 A660 I661 N666 I667 T668 M682 M688 L710	V640-L664 HydrophobicContact CB-CD2 4.4Å; V640-L664 HydrophobicContact CG1-CD2 4.17Å; V640-L664 HydrophobicContact CG2-CD2 4.35Å; Y643-L664 HydrophobicContact CD2-CD2 3.76Å; Y643-L664 HydrophobicContact CD2-CG 3.86Å; Y643-L664 HydrophobicContact CG-CD2 4.43Å; Y643-L664 HydrophobicContact CG-CG 4.35Å; I647-L664 HydrophobicContact CD1-CD1 3.54Å; A660-L664 WeakPolarHBondContact O-CG 3.47Å; A660-L664 PolarHBondContact O-N 3.29Å; A660-L664 VanDerWaalsContact O-N 3.08Å; I661-L664 PolarHBondContact O-N 2.96Å; L664-N666 VanDerWaalsContact C-N 3.29Å; L664-N666 PolarHBondContact O-N 3.02Å; L664-I667 HydrophobicContact CD2-CD1 4.29Å; L664-I667 PolarHBondContact O-N 3.28Å; L664-T668 WeakPolarHBondContact O-CG2 3.43Å; L664-T668 PolarHBondContact O-N 2.88Å; L664-T668 PolarHBondContact O-OG1 3.24Å; L664-M682 HydrophobicContact CB-CE 4.37Å; L664-M682 HydrophobicContact CD1-CE 4.47Å; L664-M682 HydrophobicContact CD2-CE 3.84Å; L664-M682 HydrophobicContact CD2-SD 4.21Å; L664-M682 HydrophobicContact CG-CE 4.47Å; L664-M688 HydrophobicContact CD1-CE 3.35Å; L664-M688 HydrophobicContact CD1-SD 4.33Å; L664-L710 HydrophobicContact CB-CD1 4.02Å; L664-L710 HydrophobicContact CB-CD2 3.74Å; L664-L710 HydrophobicContact CD1-CD2 4.17Å
665	Q	97.5	Very high	93.5	Very high	43 Å²	43	23.1 Å²	23.1	20%	0.201	14%	0.135	C	C	.	.	H	α-helix	trans	-59.3	-43	173.6	-174.4	-174.8	2.5	0	0	110.7	I661 G662 T668 G669 S706 L710 N713	I661-Q665 WeakPolarHBondContact O-CB 3.46Å; I661-Q665 PolarHBondContact O-N 3.4Å; G662-Q665 PolarHBondContact O-N 3.28Å; Q665-T668 PolarHBondContact O-N 3.03Å; Q665-T668 PolarHBondContact O-OG1 3.46Å; Q665-G669 PolarHBondContact O-N 3.33Å; Q665-G669 VanDerWaalsContact O-N 3.15Å; Q665-S706 PolarHBondContact OE1-O 2.83Å; Q665-L710 HydrophobicContact CB-CB 4.16Å; Q665-N713 PolarHBondContact O-ND2 3.2Å
666	N	97.1	Very high	93.5	Very high	36 Å²	36	23.7 Å²	23.7	19%	0.193	14%	0.137	C	C	.	.	H	α-helix	trans	-66.6	-41.9	-178.4	-75.5	-12.3	0	0	0	112.7	R569 S572 G662 A663 L664 T668 G669	R569-N666 PolarHBondContact O-ND2 2.9Å; S572-N666 WeakPolarHBondContact O-CB 3.41Å; G662-N666 WeakPolarHBondContact O-CB 3.4Å; G662-N666 PolarHBondContact O-N 3.34Å; A663-N666 PolarHBondContact O-N 3.06Å; L664-N666 VanDerWaalsContact C-N 3.29Å; L664-N666 PolarHBondContact O-N 3.02Å; N666-T668 VanDerWaalsContact C-N 3.32Å; N666-T668 PolarHBondContact O-N 3.22Å; N666-G669 PolarHBondContact O-N 2.92Å
667	I	95.6	Very high	93.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-79.9	-8.9	-179.6	70.3	179.3	0	0	0	114.7	S572 L575 F576 L634 I639 V640 A663 L664 L678	S572-I667 WeakPolarHBondContact OG-CG2 3.48Å; L575-I667 HydrophobicContact CD2-CG2 4.15Å; F576-I667 WeakPolarHBondContact CE2-O 3.47Å; L634-I667 WeakPolarHBondContact O-CG2 3.49Å; I639-I667 HydrophobicContact CG2-CD1 4.23Å; V640-I667 HydrophobicContact CG2-CD1 4.05Å; A663-I667 PolarHBondContact O-N 3.02Å; A663-I667 VanDerWaalsContact O-N 3.08Å; L664-I667 HydrophobicContact CD2-CD1 4.29Å; L664-I667 PolarHBondContact O-N 3.28Å; I667-L678 HydrophobicContact CB-CD1 4.38Å; I667-L678 HydrophobicContact CD1-CD1 4.35Å; I667-L678 HydrophobicContact CG1-CD1 4.44Å
668	T	95.5	Very high	93	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	0.7	172.6	55.6	0	0	0	0	112.6	L664 Q665 N666 S679 M682 L710 N713 L714	L664-T668 WeakPolarHBondContact O-CG2 3.43Å; L664-T668 PolarHBondContact O-N 2.88Å; L664-T668 PolarHBondContact O-OG1 3.24Å; Q665-T668 PolarHBondContact O-N 3.03Å; Q665-T668 PolarHBondContact O-OG1 3.46Å; N666-T668 VanDerWaalsContact C-N 3.32Å; N666-T668 PolarHBondContact O-N 3.22Å; T668-S679 WeakPolarHBondContact CB-OG 3.32Å; T668-S679 WeakPolarHBondContact CG2-OG 3.38Å; T668-M682 HydrophobicContact CG2-SD 3.6Å; T668-L710 HydrophobicContact CG2-CD1 4.26Å; T668-L710 WeakPolarHBondContact OG1-CD1 3.45Å; T668-N713 WeakPolarHBondContact O-CB 3.23Å; T668-N713 PolarHBondContact OG1-ND2 3.01Å; T668-L714 HydrophobicContact CG2-CD2 4.04Å
669	G	92.1	Very high	93	Very high	19 Å²	19	24.7 Å²	24.7	20%	0.196	14%	0.141	C	C	.	.			trans	-79.6	158	179.7	0	0	0	0	0	113.3	Q665 N666 A675 N713	Q665-G669 PolarHBondContact O-N 3.33Å; Q665-G669 VanDerWaalsContact O-N 3.15Å; N666-G669 PolarHBondContact O-N 2.92Å; G669-A675 WeakPolarHBondContact O-CB 3.43Å; G669-N713 WeakPolarHBondContact CA-ND2 3.2Å; G669-N713 PolarHBondContact N-ND2 3.17Å
670	G	85.6	Confident	92.8	Very high	48 Å²	48	28 Å²	28	50%	0.495	15%	0.154	S	C	.	.	S	Bend	trans	98.8	-153.5	175.5	0	0	0	0	0	113.2
671	Q	84.4	Confident	92.5	Very high	154 Å²	154	29.8 Å²	29.8	72%	0.72	16%	0.161	S	C	*	.	S	Bend	trans	-130.4	17.1	169	-67.5	-68.9	-92.3	0	0	110.7
672	D	85.2	Confident	92.4	Very high	37 Å²	37	29.8 Å²	29.8	20%	0.198	16%	0.161	C	C	.	.			trans	-61.3	136.1	179.6	-61.5	-95.7	0	0	0	111.3	F576 W674 A675 E676	F576-D672 HydrophobicContact CB-CB 4.19Å; F576-D672 VanDerWaalsContact CB-OD1 3.25Å; F576-D672 WeakPolarHBondContact CB-OD1 3.33Å; F576-D672 HydrophobicContact CD2-CB 3.89Å; F576-D672 HydrophobicContact CG-CB 4.13Å; D672-W674 PolarHBondContact O-N 3.11Å; D672-A675 HydrophobicContact CB-CB 4.09Å; D672-A675 WeakPolarHBondContact O-CB 3.38Å; D672-A675 PolarHBondContact O-N 3.1Å; D672-E676 PolarHBondContact O-N 3.21Å
673	P	87	Confident	92.2	Very high	74 Å²	74	30 Å²	30	48%	0.481	16%	0.162	S	C	.	.	H	α-helix	trans	-54.4	-29.8	176.4	-28	34.8	0	0	0	113.4	F588 K677	F588-P673 HydrophobicContact CD1-CB 4.12Å; F588-P673 HydrophobicContact CD1-CG 4.11Å; F588-P673 HydrophobicContact CE1-CB 4.22Å; F588-P673 HydrophobicContact CE1-CG 4.28Å; P673-K677 WeakPolarHBondContact O-CB 3.4Å; P673-K677 WeakPolarHBondContact O-CG 3.16Å; P673-K677 PolarHBondContact O-N 3.41Å
674	W	86.9	Confident	91.9	Very high	5 Å²	5	33.6 Å²	33.6	2%	0.019	18%	0.181	C	C	.	.	H	α-helix	trans	-77.4	-35.2	177.2	-158.4	-88.5	0	0	0	113.2	F576 L587 F588 F619 V624 W635 D672 E676 K677 L678	F576-W674 HydrophobicContact CD1-CB 4.35Å; F576-W674 HydrophobicContact CE1-CB 3.95Å; F576-W674 AromaticContact CE1-CD1 3.6Å; F576-W674 HydrophobicContact CE1-CG 4.02Å; F576-W674 HydrophobicContact CZ-CB 4.25Å; F576-W674 AromaticContact CZ-CD1 3.75Å; F576-W674 HydrophobicContact CZ-CG 4.38Å; L587-W674 HydrophobicContact CB-CE3 4.46Å; L587-W674 HydrophobicContact CD2-CD2 4.42Å; L587-W674 HydrophobicContact CD2-CE3 4.11Å; L587-W674 HydrophobicContact CD2-CH2 4.2Å; L587-W674 HydrophobicContact CD2-CZ2 4.49Å; L587-W674 HydrophobicContact CD2-CZ3 4Å; F588-W674 HydrophobicContact CE1-CB 3.95Å; F588-W674 HydrophobicContact CZ-CB 4.49Å; F619-W674 HydrophobicContact CE2-CH2 4.08Å; F619-W674 AromaticContact CE2-CZ2 3.79Å; F619-W674 HydrophobicContact CE2-CZ2 3.79Å; F619-W674 AromaticContact CZ-CH2 3.93Å; F619-W674 HydrophobicContact CZ-CH2 3.93Å; F619-W674 AromaticContact CZ-CZ2 3.68Å; F619-W674 HydrophobicContact CZ-CZ2 3.68Å; V624-W674 HydrophobicContact CG1-CH2 4.23Å; V624-W674 HydrophobicContact CG1-CZ2 4.12Å; W635-W674 AromaticContact CD1-CE2 3.7Å; W635-W674 AromaticContact CD1-CZ2 3.9Å; W635-W674 AromaticContact CD1-NE1 3.47Å; W635-W674 AromaticContact CG-NE1 3.94Å; W635-W674 PolarHBondContact O-NE1 3.38Å; W635-W674 VanDerWaalsContact O-NE1 3.12Å; D672-W674 PolarHBondContact O-N 3.11Å; W674-E676 VanDerWaalsContact C-N 3.27Å; W674-E676 PolarHBondContact O-N 3.4Å; W674-K677 HydrophobicContact CE3-CD 4.2Å; W674-K677 HydrophobicContact CZ3-CD 4.35Å; W674-K677 PolarHBondContact O-N 3.05Å; W674-L678 WeakPolarHBondContact O-CB 3.49Å; W674-L678 WeakPolarHBondContact O-CG 3.28Å; W674-L678 PolarHBondContact O-N 2.64Å
675	A	90.8	Very high	91.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.1	-37.3	171.2	0	0	0	0	0	110.8	F576 G669 D672 S679	F576-A675 HydrophobicContact CD2-CB 4.35Å; F576-A675 HydrophobicContact CE2-CB 3.89Å; G669-A675 WeakPolarHBondContact O-CB 3.43Å; D672-A675 HydrophobicContact CB-CB 4.09Å; D672-A675 WeakPolarHBondContact O-CB 3.38Å; D672-A675 PolarHBondContact O-N 3.1Å; A675-S679 VanDerWaalsContact O-CB 3.25Å; A675-S679 WeakPolarHBondContact O-CB 3.4Å; A675-S679 PolarHBondContact O-N 2.8Å; A675-S679 PolarHBondContact O-OG 2.59Å
676	E	90.9	Very high	91.4	Very high	57 Å²	57	38 Å²	38	27%	0.266	20%	0.202	S	C	.	.	H	α-helix	trans	-66.6	-52.2	170.7	175.2	157.7	-141.3	0	0	112.6	D672 W674 L678 S679 R680 H717	D672-E676 PolarHBondContact O-N 3.21Å; W674-E676 VanDerWaalsContact C-N 3.27Å; W674-E676 PolarHBondContact O-N 3.4Å; E676-L678 VanDerWaalsContact C-N 3.28Å; E676-L678 PolarHBondContact O-N 2.9Å; E676-S679 PolarHBondContact O-N 3.45Å; E676-S679 VanDerWaalsContact O-N 3.08Å; E676-R680 HydrophobicContact CG-CG 4.28Å; E676-R680 WeakPolarHBondContact O-CG 3.2Å; E676-R680 PolarHBondContact O-N 3.39Å; E676-R680 IonicContact OE1-CZ 2.77Å; E676-R680 VanDerWaalsContact OE1-CZ 3.28Å; E676-R680 IonicContact OE1-NE 2.76Å; E676-R680 PolarHBondContact OE1-NE 3.44Å; E676-R680 IonicContact OE1-NH2 2.67Å; E676-R680 PolarHBondContact OE1-NH2 3.18Å; E676-R680 IonicContact OE2-NH2 2.97Å; E676-H717 HydrophobicContact CB-CB 4.4Å; E676-H717 HydrophobicContact CG-CB 4.15Å
677	K	90.4	Very high	91.2	Very high	46 Å²	46	43 Å²	43	20%	0.2	22%	0.223	C	C	.	.	H	α-helix	trans	-53.1	-45	177.6	-78.8	-176.5	-177.6	-172.8	0	110.8	D590 F619 E623 P673 W674 Y681	D590-K677 IonicContact OD1-NZ 2.93Å; D590-K677 PolarHBondContact OD1-NZ 3.49Å; F619-K677 HydrophobicContact CD2-CB 4.07Å; F619-K677 HydrophobicContact CE2-CB 4.32Å; E623-K677 WeakPolarHBondContact OE2-CE 3.14Å; E623-K677 IonicContact OE2-NZ 2.89Å; E623-K677 PolarHBondContact OE2-NZ 2.91Å; P673-K677 WeakPolarHBondContact O-CB 3.4Å; P673-K677 WeakPolarHBondContact O-CG 3.16Å; P673-K677 PolarHBondContact O-N 3.41Å; W674-K677 HydrophobicContact CE3-CD 4.2Å; W674-K677 HydrophobicContact CZ3-CD 4.35Å; W674-K677 PolarHBondContact O-N 3.05Å; K677-Y681 WeakPolarHBondContact O-CB 3.47Å; K677-Y681 PolarHBondContact O-N 3.08Å; K677-Y681 VanDerWaalsContact O-N 3.08Å
678	L	91.7	Very high	91.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66.9	-41.6	175	-74	177.9	0	0	0	113.5	F576 F619 W635 I667 W674 E676 R680 Y681 M682	F576-L678 HydrophobicContact CZ-CD1 4.39Å; F619-L678 HydrophobicContact CE2-CD2 4.32Å; W635-L678 HydrophobicContact CB-CD1 4.5Å; I667-L678 HydrophobicContact CB-CD1 4.38Å; I667-L678 HydrophobicContact CD1-CD1 4.35Å; I667-L678 HydrophobicContact CG1-CD1 4.44Å; W674-L678 WeakPolarHBondContact O-CB 3.49Å; W674-L678 WeakPolarHBondContact O-CG 3.28Å; W674-L678 PolarHBondContact O-N 2.64Å; E676-L678 VanDerWaalsContact C-N 3.28Å; E676-L678 PolarHBondContact O-N 2.9Å; L678-R680 PolarHBondContact O-N 3.31Å; L678-Y681 WeakPolarHBondContact O-CB 3.44Å; L678-Y681 PolarHBondContact O-N 3.21Å; L678-M682 WeakPolarHBondContact O-CB 3.49Å; L678-M682 WeakPolarHBondContact O-CG 3.36Å; L678-M682 PolarHBondContact O-N 2.93Å
679	S	94.9	Very high	91.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.9	-41.1	179	-65	0	0	0	0	112.2	T668 A675 E676 M682 V683 H717	T668-S679 WeakPolarHBondContact CB-OG 3.32Å; T668-S679 WeakPolarHBondContact CG2-OG 3.38Å; A675-S679 VanDerWaalsContact O-CB 3.25Å; A675-S679 WeakPolarHBondContact O-CB 3.4Å; A675-S679 PolarHBondContact O-N 2.8Å; A675-S679 PolarHBondContact O-OG 2.59Å; E676-S679 PolarHBondContact O-N 3.45Å; E676-S679 VanDerWaalsContact O-N 3.08Å; S679-M682 PolarHBondContact O-N 2.91Å; S679-V683 PolarHBondContact O-N 3.38Å; S679-H717 PolarHBondContact OG-CD2 2.96Å
680	R	93.1	Very high	91.2	Very high	68 Å²	68	45 Å²	45	26%	0.257	23%	0.232	S	C	.	.	H	α-helix	trans	-61.9	-48.2	172.7	-67.3	176.1	-176	-166.9	5.6	110.7	E676 L678 M682 V683 N684	E676-R680 HydrophobicContact CG-CG 4.28Å; E676-R680 WeakPolarHBondContact O-CG 3.2Å; E676-R680 PolarHBondContact O-N 3.39Å; E676-R680 IonicContact OE1-CZ 2.77Å; E676-R680 VanDerWaalsContact OE1-CZ 3.28Å; E676-R680 IonicContact OE1-NE 2.76Å; E676-R680 PolarHBondContact OE1-NE 3.44Å; E676-R680 IonicContact OE1-NH2 2.67Å; E676-R680 PolarHBondContact OE1-NH2 3.18Å; E676-R680 IonicContact OE2-NH2 2.97Å; L678-R680 PolarHBondContact O-N 3.31Å; R680-M682 PolarHBondContact O-N 2.98Å; R680-V683 PolarHBondContact O-N 3.48Å; R680-N684 VanDerWaalsContact O-CB 3.29Å; R680-N684 WeakPolarHBondContact O-CB 3.33Å; R680-N684 PolarHBondContact O-N 3.31Å
681	Y	92.7	Very high	91.4	Very high	38 Å²	38	44.8 Å²	44.8	15%	0.149	22%	0.219	C	C	.	.	I	π-helix	trans	-56.6	-45.4	176.4	177.8	-101.7	0	0	0	112.8	F619 P637 H641 K677 L678 V683 D685 Y686	F619-Y681 HydrophobicContact CB-CD2 3.77Å; F619-Y681 HydrophobicContact CB-CG 4.22Å; F619-Y681 HydrophobicContact CD1-CD2 4.38Å; F619-Y681 HydrophobicContact CG-CD2 4.14Å; F619-Y681 HydrophobicContact CG-CG 4.38Å; P637-Y681 HydrophobicContact CB-CD1 4.3Å; P637-Y681 HydrophobicContact CB-CE1 3.73Å; P637-Y681 HydrophobicContact CG-CE1 4.49Å; H641-Y681 AromaticContact NE2-CE1 3.92Å; H641-Y681 AromaticContact NE2-CZ 3.81Å; H641-Y681 PolarHBondContact NE2-OH 3.04Å; K677-Y681 WeakPolarHBondContact O-CB 3.47Å; K677-Y681 PolarHBondContact O-N 3.08Å; K677-Y681 VanDerWaalsContact O-N 3.08Å; L678-Y681 WeakPolarHBondContact O-CB 3.44Å; L678-Y681 PolarHBondContact O-N 3.21Å; Y681-V683 VanDerWaalsContact C-N 3.34Å; Y681-V683 PolarHBondContact O-N 3.34Å; Y681-D685 HydrophobicContact CD2-CB 3.59Å; Y681-D685 HydrophobicContact CE2-CB 3.87Å; Y681-D685 HydrophobicContact CG-CB 4.42Å; Y681-D685 PolarHBondContact O-N 3.36Å; Y681-Y686 HydrophobicContact CE1-CG 4.37Å; Y681-Y686 PolarHBondContact O-N 3.09Å
682	M	94.7	Very high	91.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.185	C	C	.	.	I	π-helix	trans	-59	-40.1	-179.4	-81.5	178.5	67	0	0	113.4	V640 L664 T668 L678 S679 R680 K687 M688 L710 L714	V640-M682 HydrophobicContact CG1-CE 4.47Å; V640-M682 HydrophobicContact CG1-CG 3.53Å; V640-M682 HydrophobicContact CG1-SD 4.13Å; V640-M682 HydrophobicContact CG2-CG 4.33Å; V640-M682 HydrophobicContact CG2-SD 4.42Å; L664-M682 HydrophobicContact CB-CE 4.37Å; L664-M682 HydrophobicContact CD1-CE 4.47Å; L664-M682 HydrophobicContact CD2-CE 3.84Å; L664-M682 HydrophobicContact CD2-SD 4.21Å; L664-M682 HydrophobicContact CG-CE 4.47Å; T668-M682 HydrophobicContact CG2-SD 3.6Å; L678-M682 WeakPolarHBondContact O-CB 3.49Å; L678-M682 WeakPolarHBondContact O-CG 3.36Å; L678-M682 PolarHBondContact O-N 2.93Å; S679-M682 PolarHBondContact O-N 2.91Å; R680-M682 PolarHBondContact O-N 2.98Å; M682-K687 PolarHBondContact O-N 3.17Å; M682-M688 HydrophobicContact CE-SD 3.9Å; M682-M688 VanDerWaalsContact O-CB 3.28Å; M682-M688 WeakPolarHBondContact O-CB 3.32Å; M682-M688 PolarHBondContact O-N 3.44Å; M682-L710 HydrophobicContact CE-CD1 4.07Å; M682-L714 HydrophobicContact CB-CD2 4.11Å; M682-L714 HydrophobicContact CE-CD1 4.33Å; M682-L714 HydrophobicContact CE-CD2 4.16Å; M682-L714 HydrophobicContact SD-CD2 4.13Å
683	V	94.5	Very high	92.3	Very high	5 Å²	5	36.7 Å²	36.7	3%	0.03	18%	0.181	C	C	.	.	I	π-helix	trans	-92.7	-41	-174.6	-177.8	0	0	0	0	112.3	S679 R680 Y681 K687 L689 L714 T718 D719 T720	S679-V683 PolarHBondContact O-N 3.38Å; R680-V683 PolarHBondContact O-N 3.48Å; Y681-V683 VanDerWaalsContact C-N 3.34Å; Y681-V683 PolarHBondContact O-N 3.34Å; V683-K687 WeakPolarHBondContact O-CA 3.29Å; V683-L689 HydrophobicContact CG1-CB 4.29Å; V683-L689 HydrophobicContact CG1-CD2 3.88Å; V683-L689 HydrophobicContact CG2-CB 4.48Å; V683-L689 HydrophobicContact CG2-CD2 4.44Å; V683-L714 HydrophobicContact CG2-CB 4.28Å; V683-L714 HydrophobicContact CG2-CD1 4.13Å; V683-L714 HydrophobicContact CG2-CD2 4.15Å; V683-L714 HydrophobicContact CG2-CG 4.42Å; V683-T718 HydrophobicContact CB-CG2 3.64Å; V683-T718 HydrophobicContact CG1-CG2 4.15Å; V683-T718 HydrophobicContact CG2-CG2 3.53Å; V683-D719 WeakPolarHBondContact CG1-O 3.38Å; V683-T720 HydrophobicContact CG2-CG2 4.38Å
684	N	92.1	Very high	92.5	Very high	76 Å²	76	37.4 Å²	37.4	41%	0.406	18%	0.18	S	C	.	.	I	π-helix	trans	-92.6	-50.6	-167.6	-54.3	-10.7	0	0	0	111.4	R680 K687 T718	R680-N684 VanDerWaalsContact O-CB 3.29Å; R680-N684 WeakPolarHBondContact O-CB 3.33Å; R680-N684 PolarHBondContact O-N 3.31Å; N684-K687 WeakPolarHBondContact O-CE 3.28Å; N684-K687 WeakPolarHBondContact O-CG 3.32Å; N684-T718 PolarHBondContact ND2-OG1 3.44Å; N684-T718 PolarHBondContact OD1-OG1 2.87Å
685	D	90.4	Very high	92.6	Very high	79 Å²	79	39.1 Å²	39.1	42%	0.422	19%	0.189	S	C	.	.	I	π-helix	trans	-86.7	-54.3	-172.7	-57.1	-39.3	0	0	0	111.1	Y681	Y681-D685 HydrophobicContact CD2-CB 3.59Å; Y681-D685 HydrophobicContact CE2-CB 3.87Å; Y681-D685 HydrophobicContact CG-CB 4.42Å; Y681-D685 PolarHBondContact O-N 3.36Å
686	Y	92.8	Very high	92.6	Very high	56 Å²	56	39.4 Å²	39.4	22%	0.22	19%	0.19	C	C	.	.	S	Bend	trans	-84.3	-15.1	-179.1	-174.8	-132.2	0	0	0	113.7	V640 H641 N644 Y681 M688	V640-Y686 HydrophobicContact CG1-CD1 3.93Å; V640-Y686 HydrophobicContact CG1-CE1 4.14Å; H641-Y686 AromaticContact CD2-CD2 3.92Å; H641-Y686 AromaticContact CD2-CE1 3.92Å; H641-Y686 AromaticContact CD2-CE2 3.74Å; H641-Y686 AromaticContact CD2-CZ 3.74Å; H641-Y686 AromaticContact CE1-CD2 3.52Å; H641-Y686 AromaticContact CE1-CE2 3.35Å; H641-Y686 WeakPolarHBondContact CE1-CE2 3.49Å; H641-Y686 AromaticContact CG-CE2 3.76Å; H641-Y686 AromaticContact CG-CZ 3.68Å; H641-Y686 AromaticContact ND1-CE2 3.54Å; H641-Y686 AromaticContact ND1-CZ 3.92Å; H641-Y686 AromaticContact NE2-CD2 3.34Å; H641-Y686 VanDerWaalsContact NE2-CD2 3.34Å; H641-Y686 WeakPolarHBondContact NE2-CD2 3.48Å; H641-Y686 AromaticContact NE2-CE2 3.48Å; H641-Y686 WeakPolarHBondContact NE2-CE2 3.24Å; H641-Y686 AromaticContact NE2-CG 3.75Å; H641-Y686 AromaticContact NE2-CZ 3.98Å; N644-Y686 HydrophobicContact CB-CE1 3.92Å; N644-Y686 VanDerWaalsContact ND2-CE1 3.35Å; N644-Y686 WeakPolarHBondContact ND2-CE1 3.26Å; N644-Y686 VanDerWaalsContact ND2-CZ 3.35Å; N644-Y686 PolarHBondContact ND2-OH 3.47Å; Y681-Y686 HydrophobicContact CE1-CG 4.37Å; Y681-Y686 PolarHBondContact O-N 3.09Å; Y686-M688 VanDerWaalsContact C-N 3.26Å; Y686-M688 HydrophobicContact CD1-CB 3.85Å; Y686-M688 HydrophobicContact CD1-CG 4.46Å; Y686-M688 HydrophobicContact CD1-SD 4.28Å; Y686-M688 HydrophobicContact CE1-CB 4.19Å; Y686-M688 HydrophobicContact CE1-CG 4.36Å; Y686-M688 HydrophobicContact CE1-SD 4.05Å; Y686-M688 PolarHBondContact O-N 3.26Å
687	K	93.7	Very high	92.4	Very high	142 Å²	142	45.4 Å²	45.4	62%	0.617	21%	0.21	S	C	*	.			trans	52.5	42.7	174.4	-56.8	178.3	-173.5	177.2	0	113	M682 V683 N684 L689 P690	M682-K687 PolarHBondContact O-N 3.17Å; V683-K687 WeakPolarHBondContact O-CA 3.29Å; N684-K687 WeakPolarHBondContact O-CE 3.28Å; N684-K687 WeakPolarHBondContact O-CG 3.32Å; K687-L689 VanDerWaalsContact C-N 3.32Å; K687-L689 PolarHBondContact O-N 3.46Å; K687-P690 WeakPolarHBondContact O-CD 3.41Å
688	M	95.1	Very high	92.1	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	21%	0.207	C	C	.	.			trans	-71.5	-26.8	-178	-174.2	165.7	176.1	0	0	113	V640 N644 I647 L664 M682 Y686 N691 L692	V640-M688 HydrophobicContact CG1-SD 3.94Å; N644-M688 HydrophobicContact CB-CE 3.48Å; N644-M688 VanDerWaalsContact CB-CE 3.48Å; N644-M688 HydrophobicContact CB-CG 4.48Å; N644-M688 HydrophobicContact CB-SD 3.83Å; N644-M688 WeakPolarHBondContact OD1-CE 3.26Å; I647-M688 HydrophobicContact CD1-CE 4.02Å; L664-M688 HydrophobicContact CD1-CE 3.35Å; L664-M688 HydrophobicContact CD1-SD 4.33Å; M682-M688 HydrophobicContact CE-SD 3.9Å; M682-M688 VanDerWaalsContact O-CB 3.28Å; M682-M688 WeakPolarHBondContact O-CB 3.32Å; M682-M688 PolarHBondContact O-N 3.44Å; Y686-M688 VanDerWaalsContact C-N 3.26Å; Y686-M688 HydrophobicContact CD1-CB 3.85Å; Y686-M688 HydrophobicContact CD1-CG 4.46Å; Y686-M688 HydrophobicContact CD1-SD 4.28Å; Y686-M688 HydrophobicContact CE1-CB 4.19Å; Y686-M688 HydrophobicContact CE1-CG 4.36Å; Y686-M688 HydrophobicContact CE1-SD 4.05Å; Y686-M688 PolarHBondContact O-N 3.26Å; M688-N691 PolarHBondContact O-N 3.22Å; M688-N691 PolarHBondContact O-ND2 2.95Å; M688-L692 HydrophobicContact CE-CD1 4.32Å; M688-L692 HydrophobicContact CE-CD2 3.99Å; M688-L692 HydrophobicContact CE-CG 4.21Å; M688-L692 HydrophobicContact CG-CD1 4.12Å; M688-L692 HydrophobicContact CG-CG 4.24Å
689	L	94.6	Very high	91.7	Very high	1 Å²	1	52 Å²	52	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-53.9	-46.1	-168.6	-176.7	53.9	0	0	0	114.8	V683 K687 N691 L692 L693 L711 T720 Q722 A723	V683-L689 HydrophobicContact CG1-CB 4.29Å; V683-L689 HydrophobicContact CG1-CD2 3.88Å; V683-L689 HydrophobicContact CG2-CB 4.48Å; V683-L689 HydrophobicContact CG2-CD2 4.44Å; K687-L689 VanDerWaalsContact C-N 3.32Å; K687-L689 PolarHBondContact O-N 3.46Å; L689-N691 VanDerWaalsContact C-N 3.32Å; L689-N691 PolarHBondContact O-N 2.94Å; L689-L692 WeakPolarHBondContact O-CB 3.44Å; L689-L692 PolarHBondContact O-N 3.33Å; L689-L693 HydrophobicContact CD1-CD2 4.09Å; L689-L693 HydrophobicContact CD1-CG 4.19Å; L689-L693 HydrophobicContact CG-CD1 4.34Å; L689-L693 HydrophobicContact CG-CG 4.46Å; L689-L693 WeakPolarHBondContact O-CG 3.42Å; L689-L693 PolarHBondContact O-N 3.47Å; L689-L711 HydrophobicContact CD1-CD2 3.33Å; L689-T720 HydrophobicContact CD2-CG2 3.98Å; L689-Q722 HydrophobicContact CD2-CG 3.67Å; L689-Q722 HydrophobicContact CG-CG 4.28Å; L689-A723 HydrophobicContact CD1-CB 4.43Å; L689-A723 HydrophobicContact CD2-CB 4.32Å
690	P	92.8	Very high	91.4	Very high	58 Å²	58	57 Å²	57	38%	0.377	26%	0.263	S	S	.	.	H	α-helix	trans	-53	-45.4	178.1	-28.9	37	0	0	0	114	K687 L692 L693	K687-P690 WeakPolarHBondContact O-CD 3.41Å; P690-L692 VanDerWaalsContact C-N 3.25Å; P690-L692 PolarHBondContact O-N 2.86Å; P690-L693 PolarHBondContact O-N 2.9Å
691	N	91.3	Very high	91.2	Very high	43 Å²	43	57.3 Å²	57.3	23%	0.23	27%	0.269	C	S	.	.	H	α-helix	trans	-62.3	-32.8	179.6	-36.5	-95.8	0	0	0	112.2	K648 M688 L689 H695	K648-N691 VanDerWaalsContact CE-CG 3.41Å; K648-N691 WeakPolarHBondContact CE-OD1 3.48Å; K648-N691 PolarHBondContact NZ-OD1 2.73Å; M688-N691 PolarHBondContact O-N 3.22Å; M688-N691 PolarHBondContact O-ND2 2.95Å; L689-N691 VanDerWaalsContact C-N 3.32Å; L689-N691 PolarHBondContact O-N 2.94Å; N691-H695 PolarHBondContact O-CD2 3.41Å; N691-H695 VanDerWaalsContact O-CD2 3.29Å
692	L	94.6	Very high	91	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-71.7	-29.2	176	-69.9	172.3	0	0	0	112.3	I647 M688 L689 P690 H695 L707 L710 L714	I647-L692 HydrophobicContact CD1-CD2 4.27Å; M688-L692 HydrophobicContact CE-CD1 4.32Å; M688-L692 HydrophobicContact CE-CD2 3.99Å; M688-L692 HydrophobicContact CE-CG 4.21Å; M688-L692 HydrophobicContact CG-CD1 4.12Å; M688-L692 HydrophobicContact CG-CG 4.24Å; L689-L692 WeakPolarHBondContact O-CB 3.44Å; L689-L692 PolarHBondContact O-N 3.33Å; P690-L692 VanDerWaalsContact C-N 3.25Å; P690-L692 PolarHBondContact O-N 2.86Å; L692-H695 PolarHBondContact O-N 3.38Å; L692-L707 HydrophobicContact CB-CD1 4.03Å; L692-L707 HydrophobicContact CD2-CD1 3.97Å; L692-L710 HydrophobicContact CD1-CD2 3.75Å; L692-L710 HydrophobicContact CD1-CG 4.42Å; L692-L710 HydrophobicContact CD2-CD2 3.99Å; L692-L714 HydrophobicContact CD1-CD1 4.23Å
693	L	94	Very high	90.8	Very high	22 Å²	22	59.6 Å²	59.6	12%	0.115	28%	0.284	C	S	.	.	H	α-helix	trans	-75	-25.4	-176.9	-61.3	173.8	0	0	0	113.2	L689 P690 H695 L696 L711 A723 A726	L689-L693 HydrophobicContact CD1-CD2 4.09Å; L689-L693 HydrophobicContact CD1-CG 4.19Å; L689-L693 HydrophobicContact CG-CD1 4.34Å; L689-L693 HydrophobicContact CG-CG 4.46Å; L689-L693 WeakPolarHBondContact O-CG 3.42Å; L689-L693 PolarHBondContact O-N 3.47Å; P690-L693 PolarHBondContact O-N 2.9Å; L693-H695 VanDerWaalsContact C-N 3.28Å; L693-H695 PolarHBondContact O-N 2.86Å; L693-L696 HydrophobicContact CD2-CD1 3.71Å; L693-L696 WeakPolarHBondContact O-CB 3.2Å; L693-L696 PolarHBondContact O-N 3.14Å; L693-L711 HydrophobicContact CD2-CD1 4.26Å; L693-L711 HydrophobicContact CD2-CD2 4.09Å; L693-A723 HydrophobicContact CD1-CB 3.92Å; L693-A723 HydrophobicContact CD2-CB 3.51Å; L693-A723 HydrophobicContact CG-CB 4.33Å; L693-A726 HydrophobicContact CB-CB 4.23Å; L693-A726 HydrophobicContact CD2-CB 4.2Å
694	D	89.9	Confident	90.8	Very high	88 Å²	88	59.3 Å²	59.3	47%	0.471	28%	0.283	S	S	.	.	H	α-helix	trans	-66.5	-32.2	175	-74.7	-48.4	0	0	0	112.2	L696 R697	D694-L696 VanDerWaalsContact C-N 3.27Å; D694-L696 PolarHBondContact O-N 3.45Å; D694-R697 WeakPolarHBondContact O-CG 3.41Å; D694-R697 PolarHBondContact O-N 3.03Å; D694-R697 IonicContact OD1-CZ 2.7Å; D694-R697 IonicContact OD1-NE 2.75Å; D694-R697 IonicContact OD1-NH2 2.98Å; D694-R697 PolarHBondContact OD1-NH2 2.93Å
695	H	90.6	Very high	90.9	Very high	41 Å²	41	57.2 Å²	57.2	19%	0.19	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-73.9	-8.8	175.3	-59.7	-60.5	0	0	0	114.4	I647 N691 L692 L693 R697 S698 L707	I647-H695 WeakPolarHBondContact CG2-NE2 3.18Å; N691-H695 PolarHBondContact O-CD2 3.41Å; N691-H695 VanDerWaalsContact O-CD2 3.29Å; L692-H695 PolarHBondContact O-N 3.38Å; L693-H695 VanDerWaalsContact C-N 3.28Å; L693-H695 PolarHBondContact O-N 2.86Å; H695-R697 PolarHBondContact O-N 3.47Å; H695-R697 VanDerWaalsContact O-N 3.13Å; H695-S698 VanDerWaalsContact O-CB 3.31Å; H695-S698 WeakPolarHBondContact O-CB 3.34Å; H695-S698 PolarHBondContact O-N 3.18Å; H695-L707 HydrophobicContact CB-CD2 3.64Å; H695-L707 WeakPolarHBondContact O-CD2 3.28Å
696	L	90.6	Very high	91.1	Very high	6 Å²	6	53.5 Å²	53.5	3%	0.031	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-63.7	-15.4	171.3	-76.7	172	0	0	0	112.8	L693 D694 S698 L704 L707 T708 L711 A726 V727 R730	L693-L696 HydrophobicContact CD2-CD1 3.71Å; L693-L696 WeakPolarHBondContact O-CB 3.2Å; L693-L696 PolarHBondContact O-N 3.14Å; D694-L696 VanDerWaalsContact C-N 3.27Å; D694-L696 PolarHBondContact O-N 3.45Å; L696-S698 VanDerWaalsContact C-N 3.27Å; L696-L704 HydrophobicContact CD2-CD1 3.89Å; L696-L707 HydrophobicContact CB-CD2 4.5Å; L696-L707 HydrophobicContact CD2-CD2 3.92Å; L696-L707 HydrophobicContact CD2-CG 4.22Å; L696-L707 HydrophobicContact CG-CD2 4Å; L696-T708 HydrophobicContact CD2-CG2 4.03Å; L696-L711 HydrophobicContact CD1-CD1 3.94Å; L696-L711 HydrophobicContact CD2-CD1 3.8Å; L696-L711 HydrophobicContact CG-CD1 4.1Å; L696-A726 HydrophobicContact CD1-CB 3.87Å; L696-V727 HydrophobicContact CD1-CG2 4.41Å; L696-R730 VanDerWaalsContact O-CD 3.3Å; L696-R730 WeakPolarHBondContact O-CD 3.37Å; L696-R730 PolarHBondContact O-NE 3.39Å
697	R	85.3	Confident	91.3	Very high	184 Å²	184	50.8 Å²	50.8	69%	0.694	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-79.6	-3.3	173.6	-50.9	-178.5	-150	-171.7	11.2	113.2	D694 H695 E699	D694-R697 WeakPolarHBondContact O-CG 3.41Å; D694-R697 PolarHBondContact O-N 3.03Å; D694-R697 IonicContact OD1-CZ 2.7Å; D694-R697 IonicContact OD1-NE 2.75Å; D694-R697 IonicContact OD1-NH2 2.98Å; D694-R697 PolarHBondContact OD1-NH2 2.93Å; H695-R697 PolarHBondContact O-N 3.47Å; H695-R697 VanDerWaalsContact O-N 3.13Å; R697-E699 PolarHBondContact O-N 3.48Å
698	S	84.7	Confident	91.5	Very high	18 Å²	18	44 Å²	44	13%	0.126	21%	0.209	C	C	.	.			trans	-69.3	127.4	-179.6	-169.4	0	0	0	0	111.5	H695 L696 R700 E703	H695-S698 VanDerWaalsContact O-CB 3.31Å; H695-S698 WeakPolarHBondContact O-CB 3.34Å; H695-S698 PolarHBondContact O-N 3.18Å; L696-S698 VanDerWaalsContact C-N 3.27Å; S698-R700 PolarHBondContact O-N 2.91Å; S698-R700 WeakPolarHBondContact OG-CB 3.21Å; S698-R700 PolarHBondContact OG-N 2.79Å; S698-E703 PolarHBondContact OG-OE2 2.62Å
699	E	84.4	Confident	91.6	Very high	167 Å²	167	44 Å²	44	78%	0.78	21%	0.209	S	C	*	.			trans	-70.6	-13.9	170.4	-60.4	175.5	173.9	0	0	112	R697 N701	R697-E699 PolarHBondContact O-N 3.48Å; E699-N701 PolarHBondContact O-N 2.72Å
700	R	88.3	Confident	91.8	Very high	103 Å²	103	44 Å²	44	39%	0.389	21%	0.209	S	C	.	.			trans	-77	93.6	-175.1	-61.8	166	171.2	-177.6	-4.4	110	I652 R657 S698 N702 E703 L704	I652-R700 PolarHBondContact O-NH1 2.92Å; I652-R700 PolarHBondContact O-NH2 2.93Å; I652-R700 VanDerWaalsContact O-NH2 3.11Å; R657-R700 VanDerWaalsContact NH2-NH1 3.14Å; S698-R700 PolarHBondContact O-N 2.91Å; S698-R700 WeakPolarHBondContact OG-CB 3.21Å; S698-R700 PolarHBondContact OG-N 2.79Å; R700-N702 VanDerWaalsContact C-N 3.27Å; R700-N702 PolarHBondContact O-N 2.93Å; R700-E703 HydrophobicContact CB-CB 3.99Å; R700-E703 VanDerWaalsContact CD-OE2 3.24Å; R700-E703 WeakPolarHBondContact CD-OE2 3.32Å; R700-E703 WeakPolarHBondContact O-CA 3.33Å; R700-E703 VanDerWaalsContact O-CB 3.32Å; R700-E703 WeakPolarHBondContact O-CB 3.25Å; R700-E703 PolarHBondContact O-N 3.19Å; R700-L704 PolarHBondContact O-N 3.48Å
701	N	88.3	Confident	92	Very high	75 Å²	75	41.4 Å²	41.4	40%	0.401	19%	0.192	S	C	.	.	H	α-helix	trans	-45.7	-40.1	-176.3	-85	-45.3	0	0	0	115.3	E699 L704 R705 S740	E699-N701 PolarHBondContact O-N 2.72Å; N701-L704 PolarHBondContact O-N 3.06Å; N701-R705 WeakPolarHBondContact O-CB 3.25Å; N701-R705 PolarHBondContact O-N 3.03Å; N701-S740 PolarHBondContact OD1-N 3.11Å
702	N	89.1	Confident	92.3	Very high	83 Å²	83	43.8 Å²	43.8	44%	0.444	20%	0.198	S	C	.	.	H	α-helix	trans	-68.3	-37.8	178.9	-62.6	-6.7	0	0	0	113.4	E658 R700 R705 S706	E658-N702 HydrophobicContact CG-CB 4.4Å; E658-N702 WeakPolarHBondContact OE2-CB 3.35Å; R700-N702 VanDerWaalsContact C-N 3.27Å; R700-N702 PolarHBondContact O-N 2.93Å; N702-R705 PolarHBondContact O-NH2 2.79Å; N702-S706 PolarHBondContact O-N 2.81Å; N702-S706 VanDerWaalsContact O-N 3.14Å; N702-S706 PolarHBondContact O-OG 2.75Å
703	E	90.9	Very high	92.4	Very high	3 Å²	3	45.1 Å²	45.1	1%	0.014	21%	0.205	C	C	.	.	H	α-helix	trans	-65.4	-50.1	175.2	-171	-173	166.3	0	0	109	R657 I661 S698 R700 R705 S706 L707	R657-E703 IonicContact CZ-OE1 2.8Å; R657-E703 VanDerWaalsContact CZ-OE1 3.25Å; R657-E703 IonicContact CZ-OE2 2.75Å; R657-E703 IonicContact NE-OE1 3.95Å; R657-E703 PolarHBondContact NE-OE1 3.22Å; R657-E703 IonicContact NE-OE2 3.93Å; R657-E703 VanDerWaalsContact NH2-CD 3.3Å; R657-E703 IonicContact NH2-OE1 3.7Å; R657-E703 PolarHBondContact NH2-OE1 3.26Å; R657-E703 IonicContact NH2-OE2 2.81Å; R657-E703 PolarHBondContact NH2-OE2 3.03Å; I661-E703 HydrophobicContact CD1-CG 4.05Å; S698-E703 PolarHBondContact OG-OE2 2.62Å; R700-E703 HydrophobicContact CB-CB 3.99Å; R700-E703 VanDerWaalsContact CD-OE2 3.24Å; R700-E703 WeakPolarHBondContact CD-OE2 3.32Å; R700-E703 WeakPolarHBondContact O-CA 3.33Å; R700-E703 VanDerWaalsContact O-CB 3.32Å; R700-E703 WeakPolarHBondContact O-CB 3.25Å; R700-E703 PolarHBondContact O-N 3.19Å; E703-R705 PolarHBondContact O-N 3.19Å; E703-S706 PolarHBondContact O-N 2.78Å; E703-L707 VanDerWaalsContact O-CB 3.31Å; E703-L707 WeakPolarHBondContact O-CB 3.31Å; E703-L707 PolarHBondContact O-N 2.78Å
704	L	92.9	Very high	92.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.9	-40.8	178	-174.6	62.1	0	0	0	112.6	L696 R700 N701 S706 L707 T708 R730 P739 A743	L696-L704 HydrophobicContact CD2-CD1 3.89Å; R700-L704 PolarHBondContact O-N 3.48Å; N701-L704 PolarHBondContact O-N 3.06Å; L704-S706 VanDerWaalsContact C-N 3.34Å; L704-S706 PolarHBondContact O-N 2.82Å; L704-L707 PolarHBondContact O-N 3.16Å; L704-T708 HydrophobicContact CD1-CG2 3.99Å; L704-T708 HydrophobicContact CG-CG2 4.32Å; L704-T708 WeakPolarHBondContact O-CB 3.49Å; L704-T708 VanDerWaalsContact O-CG2 3.25Å; L704-T708 WeakPolarHBondContact O-CG2 3.49Å; L704-T708 PolarHBondContact O-N 2.98Å; L704-T708 PolarHBondContact O-OG1 3.42Å; L704-R730 HydrophobicContact CD1-CG 4.29Å; L704-R730 HydrophobicContact CD2-CG 4.41Å; L704-P739 HydrophobicContact CD2-CB 3.95Å; L704-P739 HydrophobicContact CD2-CG 4.36Å; L704-A743 HydrophobicContact CD2-CB 4.48Å; L704-A743 HydrophobicContact CG-CB 4.24Å
705	R	94.3	Very high	92.8	Very high	32 Å²	32	40 Å²	40	12%	0.121	18%	0.178	C	C	.	.	H	α-helix	trans	-60	-42.2	174.1	-178	-160.4	55.1	48.7	8.6	111.9	S315 E658 N701 N702 E703 T708 G709 E742	S315-R705 PolarHBondContact OG-NE 3Å; S315-R705 VanDerWaalsContact OG-NE 3.15Å; S315-R705 PolarHBondContact OG-NH2 3.29Å; E658-R705 IonicContact OE1-NH2 2.7Å; E658-R705 PolarHBondContact OE1-NH2 2.75Å; E658-R705 VanDerWaalsContact OE1-NH2 3.14Å; N701-R705 WeakPolarHBondContact O-CB 3.25Å; N701-R705 PolarHBondContact O-N 3.03Å; N702-R705 PolarHBondContact O-NH2 2.79Å; E703-R705 PolarHBondContact O-N 3.19Å; R705-T708 PolarHBondContact O-OG1 3.45Å; R705-G709 PolarHBondContact O-N 3.28Å; R705-E742 HydrophobicContact CG-CB 4.07Å
706	S	95.9	Very high	93	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-72.2	-41	178.8	-51.5	0	0	0	0	111.1	E658 Q665 N702 E703 L704 G709 L710	E658-S706 WeakPolarHBondContact CG-OG 3.45Å; Q665-S706 PolarHBondContact OE1-O 2.83Å; N702-S706 PolarHBondContact O-N 2.81Å; N702-S706 VanDerWaalsContact O-N 3.14Å; N702-S706 PolarHBondContact O-OG 2.75Å; E703-S706 PolarHBondContact O-N 2.78Å; L704-S706 VanDerWaalsContact C-N 3.34Å; L704-S706 PolarHBondContact O-N 2.82Å; S706-G709 PolarHBondContact O-N 3.11Å; S706-L710 PolarHBondContact O-N 2.95Å
707	L	96.9	Very high	93.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.4	-48	-179.9	179.3	60.9	0	0	0	112.5	I661 L692 H695 L696 E703 L704 G709 L710 L711	I661-L707 VanDerWaalsContact CG2-CA 3.46Å; I661-L707 HydrophobicContact CG2-CB 3.99Å; I661-L707 HydrophobicContact CG2-CD1 4.33Å; L692-L707 HydrophobicContact CB-CD1 4.03Å; L692-L707 HydrophobicContact CD2-CD1 3.97Å; H695-L707 HydrophobicContact CB-CD2 3.64Å; H695-L707 WeakPolarHBondContact O-CD2 3.28Å; L696-L707 HydrophobicContact CB-CD2 4.5Å; L696-L707 HydrophobicContact CD2-CD2 3.92Å; L696-L707 HydrophobicContact CD2-CG 4.22Å; L696-L707 HydrophobicContact CG-CD2 4Å; E703-L707 VanDerWaalsContact O-CB 3.31Å; E703-L707 WeakPolarHBondContact O-CB 3.31Å; E703-L707 PolarHBondContact O-N 2.78Å; L704-L707 PolarHBondContact O-N 3.16Å; L707-G709 VanDerWaalsContact C-N 3.26Å; L707-G709 PolarHBondContact O-N 3.27Å; L707-L710 PolarHBondContact O-N 2.99Å; L707-L711 HydrophobicContact CG-CD1 4.36Å; L707-L711 WeakPolarHBondContact O-CG 3.23Å; L707-L711 PolarHBondContact O-N 3.14Å
708	T	97	Very high	93.5	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.1	-34.9	174.9	53.6	0	0	0	0	111.4	L696 L704 R705 L711 R712 A743 L747	L696-T708 HydrophobicContact CD2-CG2 4.03Å; L704-T708 HydrophobicContact CD1-CG2 3.99Å; L704-T708 HydrophobicContact CG-CG2 4.32Å; L704-T708 WeakPolarHBondContact O-CB 3.49Å; L704-T708 VanDerWaalsContact O-CG2 3.25Å; L704-T708 WeakPolarHBondContact O-CG2 3.49Å; L704-T708 PolarHBondContact O-N 2.98Å; L704-T708 PolarHBondContact O-OG1 3.42Å; R705-T708 PolarHBondContact O-OG1 3.45Å; T708-L711 PolarHBondContact O-N 3.28Å; T708-R712 WeakPolarHBondContact O-CB 3.06Å; T708-R712 PolarHBondContact O-N 2.95Å; T708-A743 HydrophobicContact CG2-CB 4.44Å; T708-L747 HydrophobicContact CG2-CD1 4.27Å; T708-L747 HydrophobicContact CG2-CD2 3.75Å; T708-L747 HydrophobicContact CG2-CG 3.69Å
709	G	97.2	Very high	93.8	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-62.9	-45.5	171.4	0	0	0	0	0	113.4	R705 S706 L707 R712 N713 N746	R705-G709 PolarHBondContact O-N 3.28Å; S706-G709 PolarHBondContact O-N 3.11Å; L707-G709 VanDerWaalsContact C-N 3.26Å; L707-G709 PolarHBondContact O-N 3.27Å; G709-R712 WeakPolarHBondContact O-CB 3.48Å; G709-R712 PolarHBondContact O-N 3.46Å; G709-N713 PolarHBondContact O-N 3.46Å; G709-N713 VanDerWaalsContact O-N 3.12Å; G709-N713 PolarHBondContact O-OD1 3.47Å; G709-N746 WeakPolarHBondContact CA-ND2 3.38Å; G709-N746 PolarHBondContact N-ND2 2.95Å
710	L	98	Very high	94.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61	-47	173	171.7	57.9	0	0	0	111.6	I661 L664 Q665 T668 M682 L692 S706 L707 R712 N713 L714	I661-L710 HydrophobicContact CG2-CD2 4.33Å; L664-L710 HydrophobicContact CB-CD1 4.02Å; L664-L710 HydrophobicContact CB-CD2 3.74Å; L664-L710 HydrophobicContact CD1-CD2 4.17Å; Q665-L710 HydrophobicContact CB-CB 4.16Å; T668-L710 HydrophobicContact CG2-CD1 4.26Å; T668-L710 WeakPolarHBondContact OG1-CD1 3.45Å; M682-L710 HydrophobicContact CE-CD1 4.07Å; L692-L710 HydrophobicContact CD1-CD2 3.75Å; L692-L710 HydrophobicContact CD1-CG 4.42Å; L692-L710 HydrophobicContact CD2-CD2 3.99Å; S706-L710 PolarHBondContact O-N 2.95Å; L707-L710 PolarHBondContact O-N 2.99Å; L710-R712 VanDerWaalsContact C-N 3.26Å; L710-R712 PolarHBondContact O-N 2.74Å; L710-N713 WeakPolarHBondContact O-CB 3.41Å; L710-N713 PolarHBondContact O-N 3.16Å; L710-L714 HydrophobicContact CD1-CD1 4.06Å; L710-L714 HydrophobicContact CD1-CD2 4.42Å; L710-L714 HydrophobicContact CD1-CG 3.99Å; L710-L714 HydrophobicContact CG-CD1 4.13Å; L710-L714 HydrophobicContact CG-CG 4.46Å; L710-L714 WeakPolarHBondContact O-CG 3.45Å; L710-L714 PolarHBondContact O-N 3.45Å
711	L	97.8	Very high	94.5	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.016	13%	0.126	C	C	.	.	H	α-helix	trans	-60.1	-37.7	177.5	-69	171.6	0	0	0	111.9	L689 L693 L696 L707 T708 L714 S715 V750	L689-L711 HydrophobicContact CD1-CD2 3.33Å; L693-L711 HydrophobicContact CD2-CD1 4.26Å; L693-L711 HydrophobicContact CD2-CD2 4.09Å; L696-L711 HydrophobicContact CD1-CD1 3.94Å; L696-L711 HydrophobicContact CD2-CD1 3.8Å; L696-L711 HydrophobicContact CG-CD1 4.1Å; L707-L711 HydrophobicContact CG-CD1 4.36Å; L707-L711 WeakPolarHBondContact O-CG 3.23Å; L707-L711 PolarHBondContact O-N 3.14Å; T708-L711 PolarHBondContact O-N 3.28Å; L711-L714 PolarHBondContact O-N 2.82Å; L711-S715 WeakPolarHBondContact O-CB 2.99Å; L711-S715 PolarHBondContact O-N 3.14Å; L711-S715 PolarHBondContact O-OG 3.22Å; L711-V750 HydrophobicContact CB-CG2 3.84Å
712	R	97.2	Very high	94.6	Very high	94 Å²	94	25.9 Å²	25.9	36%	0.355	13%	0.132	S	C	.	.	H	α-helix	trans	-60.9	-49.1	175.1	179.7	177.3	168	-168	-3.4	111	T708 G709 L710 S715 S716 N746 V750 N753	T708-R712 WeakPolarHBondContact O-CB 3.06Å; T708-R712 PolarHBondContact O-N 2.95Å; G709-R712 WeakPolarHBondContact O-CB 3.48Å; G709-R712 PolarHBondContact O-N 3.46Å; L710-R712 VanDerWaalsContact C-N 3.26Å; L710-R712 PolarHBondContact O-N 2.74Å; R712-S715 PolarHBondContact O-N 3.35Å; R712-S715 PolarHBondContact O-OG 3.5Å; R712-S716 PolarHBondContact O-N 3.26Å; R712-S716 PolarHBondContact O-OG 3.45Å; R712-N746 VanDerWaalsContact CD-OD1 3.29Å; R712-N746 WeakPolarHBondContact CD-OD1 3.42Å; R712-N746 PolarHBondContact NH1-OD1 3.41Å; R712-V750 VanDerWaalsContact CA-CG2 3.49Å; R712-V750 HydrophobicContact CB-CG2 4Å; R712-V750 VanDerWaalsContact N-CG2 3.33Å; R712-N753 PolarHBondContact O-ND2 3.22Å
713	N	97.2	Very high	94.9	Very high	28 Å²	28	22 Å²	22	15%	0.15	11%	0.111	C	C	.	.	H	α-helix	trans	-58.6	-49.6	176.2	-68	0.3	0	0	0	112.2	Q665 T668 G669 G709 L710 S715 S716 H717	Q665-N713 PolarHBondContact O-ND2 3.2Å; T668-N713 WeakPolarHBondContact O-CB 3.23Å; T668-N713 PolarHBondContact OG1-ND2 3.01Å; G669-N713 WeakPolarHBondContact CA-ND2 3.2Å; G669-N713 PolarHBondContact N-ND2 3.17Å; G709-N713 PolarHBondContact O-N 3.46Å; G709-N713 VanDerWaalsContact O-N 3.12Å; G709-N713 PolarHBondContact O-OD1 3.47Å; L710-N713 WeakPolarHBondContact O-CB 3.41Å; L710-N713 PolarHBondContact O-N 3.16Å; N713-S715 VanDerWaalsContact C-N 3.3Å; N713-S715 PolarHBondContact O-N 3.46Å; N713-S716 PolarHBondContact O-N 3.36Å; N713-S716 PolarHBondContact O-OG 2.98Å; N713-H717 PolarHBondContact O-CD2 3.02Å; N713-H717 PolarHBondContact O-N 3.16Å
714	L	97	Very high	95.1	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-58	-43.8	178.3	-66.4	176.6	0	0	0	111.3	T668 M682 V683 L692 L710 L711 S716 H717 T718 T720	T668-L714 HydrophobicContact CG2-CD2 4.04Å; M682-L714 HydrophobicContact CB-CD2 4.11Å; M682-L714 HydrophobicContact CE-CD1 4.33Å; M682-L714 HydrophobicContact CE-CD2 4.16Å; M682-L714 HydrophobicContact SD-CD2 4.13Å; V683-L714 HydrophobicContact CG2-CB 4.28Å; V683-L714 HydrophobicContact CG2-CD1 4.13Å; V683-L714 HydrophobicContact CG2-CD2 4.15Å; V683-L714 HydrophobicContact CG2-CG 4.42Å; L692-L714 HydrophobicContact CD1-CD1 4.23Å; L710-L714 HydrophobicContact CD1-CD1 4.06Å; L710-L714 HydrophobicContact CD1-CD2 4.42Å; L710-L714 HydrophobicContact CD1-CG 3.99Å; L710-L714 HydrophobicContact CG-CD1 4.13Å; L710-L714 HydrophobicContact CG-CG 4.46Å; L710-L714 WeakPolarHBondContact O-CG 3.45Å; L710-L714 PolarHBondContact O-N 3.45Å; L711-L714 PolarHBondContact O-N 2.82Å; L714-S716 VanDerWaalsContact C-N 3.34Å; L714-S716 PolarHBondContact O-N 3.22Å; L714-H717 PolarHBondContact O-N 2.87Å; L714-T718 PolarHBondContact O-N 3.25Å; L714-T720 HydrophobicContact CB-CG2 4.08Å
715	S	96.3	Very high	95.1	Very high	1 Å²	1	25 Å²	25	1%	0.007	13%	0.127	C	C	.	.	H	α-helix	trans	-67.5	-25.7	-179.3	70.8	0	0	0	0	114.9	L711 R712 N713 T720 N753 R757	L711-S715 WeakPolarHBondContact O-CB 2.99Å; L711-S715 PolarHBondContact O-N 3.14Å; L711-S715 PolarHBondContact O-OG 3.22Å; R712-S715 PolarHBondContact O-N 3.35Å; R712-S715 PolarHBondContact O-OG 3.5Å; N713-S715 VanDerWaalsContact C-N 3.3Å; N713-S715 PolarHBondContact O-N 3.46Å; S715-T720 WeakPolarHBondContact CA-OG1 3.43Å; S715-T720 WeakPolarHBondContact CB-OG1 3.16Å; S715-N753 PolarHBondContact OG-ND2 2.91Å; S715-R757 PolarHBondContact O-NH1 2.89Å
716	S	94.3	Very high	95.1	Very high	45 Å²	45	24.1 Å²	24.1	32%	0.315	13%	0.127	S	C	.	.	H	α-helix	trans	-71.6	-32	172.8	32.7	0	0	0	0	112.3	R712 N713 L714 N753 R757	R712-S716 PolarHBondContact O-N 3.26Å; R712-S716 PolarHBondContact O-OG 3.45Å; N713-S716 PolarHBondContact O-N 3.36Å; N713-S716 PolarHBondContact O-OG 2.98Å; L714-S716 VanDerWaalsContact C-N 3.34Å; L714-S716 PolarHBondContact O-N 3.22Å; S716-N753 PolarHBondContact N-ND2 3.37Å; S716-R757 PolarHBondContact O-NH1 3.46Å
717	H	92.4	Very high	95.1	Very high	9 Å²	9	24.1 Å²	24.1	4%	0.042	13%	0.127	C	C	.	.	H	α-helix	trans	-91.6	-51.1	-176.7	-64.3	-59.2	0	0	0	113	E676 S679 N713 L714 R757	E676-H717 HydrophobicContact CB-CB 4.4Å; E676-H717 HydrophobicContact CG-CB 4.15Å; S679-H717 PolarHBondContact OG-CD2 2.96Å; N713-H717 PolarHBondContact O-CD2 3.02Å; N713-H717 PolarHBondContact O-N 3.16Å; L714-H717 PolarHBondContact O-N 2.87Å; H717-R757 PolarHBondContact O-NH1 3.15Å; H717-R757 PolarHBondContact O-NH2 3.37Å
718	T	92.8	Very high	95	Very high	9 Å²	9	24.7 Å²	24.7	6%	0.055	13%	0.13	C	C	.	.	S	Bend	trans	-123	165.6	-172.4	-166.6	0	0	0	0	112.8	V683 N684 L714 T720	V683-T718 HydrophobicContact CB-CG2 3.64Å; V683-T718 HydrophobicContact CG1-CG2 4.15Å; V683-T718 HydrophobicContact CG2-CG2 3.53Å; N684-T718 PolarHBondContact ND2-OG1 3.44Å; N684-T718 PolarHBondContact OD1-OG1 2.87Å; L714-T718 PolarHBondContact O-N 3.25Å; T718-T720 HydrophobicContact CG2-CG2 4.34Å; T718-T720 PolarHBondContact O-N 2.97Å
719	D	92.2	Very high	94.7	Very high	89 Å²	89	32.3 Å²	32.3	48%	0.476	16%	0.159	S	C	.	.			trans	-65.8	128.3	172	-177.6	24.2	0	0	0	110.1	V683 S721	V683-D719 WeakPolarHBondContact CG1-O 3.38Å; D719-S721 VanDerWaalsContact OD1-CB 3.25Å; D719-S721 WeakPolarHBondContact OD1-CB 3.22Å; D719-S721 PolarHBondContact OD1-N 3.37Å; D719-S721 PolarHBondContact OD1-OG 3.01Å; D719-S721 PolarHBondContact OD2-OG 3.33Å
720	T	93.9	Very high	94.5	Very high	5 Å²	5	33.5 Å²	33.5	3%	0.031	16%	0.163	C	C	.	.			trans	-123.1	13.7	-179.3	47.3	0	0	0	0	111.5	V683 L689 L714 S715 T718 Q722 A723 M754	V683-T720 HydrophobicContact CG2-CG2 4.38Å; L689-T720 HydrophobicContact CD2-CG2 3.98Å; L714-T720 HydrophobicContact CB-CG2 4.08Å; S715-T720 WeakPolarHBondContact CA-OG1 3.43Å; S715-T720 WeakPolarHBondContact CB-OG1 3.16Å; T718-T720 HydrophobicContact CG2-CG2 4.34Å; T718-T720 PolarHBondContact O-N 2.97Å; T720-Q722 PolarHBondContact O-N 3.43Å; T720-A723 VanDerWaalsContact O-CB 3.28Å; T720-A723 WeakPolarHBondContact O-CB 3.37Å; T720-A723 PolarHBondContact O-N 2.83Å; T720-M754 VanDerWaalsContact O-CE 3.23Å; T720-M754 WeakPolarHBondContact O-CE 3.36Å; T720-M754 WeakPolarHBondContact OG1-CE 3.39Å
721	S	92.1	Very high	94.1	Very high	30 Å²	30	33.7 Å²	33.7	21%	0.21	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-45.9	-32.4	-173.2	-72	0	0	0	0	115.7	D719 A723 L724	D719-S721 VanDerWaalsContact OD1-CB 3.25Å; D719-S721 WeakPolarHBondContact OD1-CB 3.22Å; D719-S721 PolarHBondContact OD1-N 3.37Å; D719-S721 PolarHBondContact OD1-OG 3.01Å; D719-S721 PolarHBondContact OD2-OG 3.33Å; S721-A723 PolarHBondContact O-N 2.94Å; S721-L724 WeakPolarHBondContact O-CB 3.46Å; S721-L724 PolarHBondContact O-N 3.35Å; S721-L724 VanDerWaalsContact O-N 3.14Å
722	Q	91.8	Very high	93.6	Very high	110 Å²	110	33.8 Å²	33.8	51%	0.514	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-58.8	-23.8	173.4	60	-179.3	-41.9	0	0	114.5	L689 T720	L689-Q722 HydrophobicContact CD2-CG 3.67Å; L689-Q722 HydrophobicContact CG-CG 4.28Å; T720-Q722 PolarHBondContact O-N 3.43Å
723	A	94.4	Very high	92.8	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.008	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-79.5	-13.3	177.8	0	0	0	0	0	114.4	L689 L693 T720 S721 D725 A726 V727 M754	L689-A723 HydrophobicContact CD1-CB 4.43Å; L689-A723 HydrophobicContact CD2-CB 4.32Å; L693-A723 HydrophobicContact CD1-CB 3.92Å; L693-A723 HydrophobicContact CD2-CB 3.51Å; L693-A723 HydrophobicContact CG-CB 4.33Å; T720-A723 VanDerWaalsContact O-CB 3.28Å; T720-A723 WeakPolarHBondContact O-CB 3.37Å; T720-A723 PolarHBondContact O-N 2.83Å; S721-A723 PolarHBondContact O-N 2.94Å; A723-D725 PolarHBondContact O-N 3.29Å; A723-A726 PolarHBondContact O-N 2.86Å; A723-A726 VanDerWaalsContact O-N 3.11Å; A723-V727 HydrophobicContact CB-CG2 4.29Å; A723-V727 WeakPolarHBondContact O-CG2 3.32Å; A723-V727 PolarHBondContact O-N 3.42Å; A723-M754 HydrophobicContact CB-CE 3.87Å
724	L	95.4	Very high	91.3	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-50.6	-52.2	-169.9	-176.4	71	0	0	0	112.9	S721 A726 V727 V728 L751 M754 I761 K764 L765	S721-L724 WeakPolarHBondContact O-CB 3.46Å; S721-L724 PolarHBondContact O-N 3.35Å; S721-L724 VanDerWaalsContact O-N 3.14Å; L724-A726 VanDerWaalsContact C-N 3.27Å; L724-A726 PolarHBondContact O-N 2.81Å; L724-V727 PolarHBondContact O-N 3.47Å; L724-V728 HydrophobicContact CD1-CG2 4.31Å; L724-V728 HydrophobicContact CG-CG2 4.37Å; L724-V728 WeakPolarHBondContact O-CB 3.46Å; L724-V728 VanDerWaalsContact O-CG2 3.31Å; L724-V728 WeakPolarHBondContact O-CG2 3.29Å; L724-V728 PolarHBondContact O-N 3.43Å; L724-L751 HydrophobicContact CD1-CD2 3.63Å; L724-M754 HydrophobicContact CB-SD 4.25Å; L724-M754 HydrophobicContact CD1-SD 3.78Å; L724-I761 HydrophobicContact CD1-CG2 3.58Å; L724-I761 HydrophobicContact CD2-CD1 3.93Å; L724-I761 HydrophobicContact CD2-CG2 3.95Å; L724-I761 HydrophobicContact CG-CG2 4.34Å; L724-K764 HydrophobicContact CD2-CB 4.18Å; L724-K764 HydrophobicContact CD2-CD 3.75Å; L724-K764 HydrophobicContact CD2-CG 3.97Å; L724-L765 HydrophobicContact CD1-CD1 4.1Å; L724-L765 HydrophobicContact CD1-CD2 3.92Å; L724-L765 HydrophobicContact CD1-CG 3.93Å
725	D	93.8	Very high	89.9	Confident	65 Å²	65	42.5 Å²	42.5	35%	0.348	22%	0.216	S	C	.	.	H	α-helix	trans	-71.3	-25.5	-172.2	-58.7	-29.9	0	0	0	112.2	A723 R729 K764	A723-D725 PolarHBondContact O-N 3.29Å; D725-R729 VanDerWaalsContact CB-NH2 3.34Å; D725-R729 VanDerWaalsContact O-CB 3.26Å; D725-R729 WeakPolarHBondContact O-CB 3.45Å; D725-R729 VanDerWaalsContact O-CG 3.24Å; D725-R729 WeakPolarHBondContact O-CG 3.18Å; D725-R729 VanDerWaalsContact O-CZ 3.23Å; D725-R729 PolarHBondContact O-N 2.95Å; D725-R729 VanDerWaalsContact O-N 3.14Å; D725-R729 PolarHBondContact O-NE 3.22Å; D725-K764 WeakPolarHBondContact OD1-CE 3.24Å; D725-K764 IonicContact OD1-NZ 2.74Å; D725-K764 PolarHBondContact OD1-NZ 3.2Å; D725-K764 IonicContact OD2-NZ 2.75Å; D725-K764 PolarHBondContact OD2-NZ 2.71Å
726	A	94.3	Very high	88.4	Confident	13 Å²	13	50.4 Å²	50.4	11%	0.107	25%	0.25	C	S	.	.	H	α-helix	trans	-77.5	-41.1	174	0	0	0	0	0	111.6	L693 L696 A723 L724 R729 R730	L693-A726 HydrophobicContact CB-CB 4.23Å; L693-A726 HydrophobicContact CD2-CB 4.2Å; L696-A726 HydrophobicContact CD1-CB 3.87Å; A723-A726 PolarHBondContact O-N 2.86Å; A723-A726 VanDerWaalsContact O-N 3.11Å; L724-A726 VanDerWaalsContact C-N 3.27Å; L724-A726 PolarHBondContact O-N 2.81Å; A726-R729 PolarHBondContact O-N 3.03Å; A726-R730 PolarHBondContact O-N 3.39Å
727	V	95.3	Very high	87.4	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63	-47.2	175	169.9	0	0	0	0	110.7	L696 A723 L724 R729 R730 L731 L747 V750 L751	L696-V727 HydrophobicContact CD1-CG2 4.41Å; A723-V727 HydrophobicContact CB-CG2 4.29Å; A723-V727 WeakPolarHBondContact O-CG2 3.32Å; A723-V727 PolarHBondContact O-N 3.42Å; L724-V727 PolarHBondContact O-N 3.47Å; V727-R729 VanDerWaalsContact C-N 3.34Å; V727-R729 PolarHBondContact O-N 3.38Å; V727-R730 PolarHBondContact O-N 3.29Å; V727-L731 PolarHBondContact O-N 3.33Å; V727-L747 HydrophobicContact CB-CD2 4.33Å; V727-L747 HydrophobicContact CG1-CD2 3.81Å; V727-L747 HydrophobicContact CG2-CD2 4.39Å; V727-V750 HydrophobicContact CG1-CB 4.47Å; V727-V750 HydrophobicContact CG1-CG1 4.23Å; V727-V750 HydrophobicContact CG2-CG1 3.95Å; V727-L751 HydrophobicContact CB-CD2 4.41Å; V727-L751 HydrophobicContact CG1-CD1 4.2Å; V727-L751 HydrophobicContact CG1-CD2 3.61Å; V727-L751 HydrophobicContact CG1-CG 3.66Å
728	V	94.2	Very high	86.9	Confident	12 Å²	12	54.6 Å²	54.6	7%	0.073	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-41.2	175.1	172.1	0	0	0	0	111.3	L724 R730 L731 L751 L765 R773	L724-V728 HydrophobicContact CD1-CG2 4.31Å; L724-V728 HydrophobicContact CG-CG2 4.37Å; L724-V728 WeakPolarHBondContact O-CB 3.46Å; L724-V728 VanDerWaalsContact O-CG2 3.31Å; L724-V728 WeakPolarHBondContact O-CG2 3.29Å; L724-V728 PolarHBondContact O-N 3.43Å; V728-R730 PolarHBondContact O-N 3.29Å; V728-L731 WeakPolarHBondContact O-CB 3.41Å; V728-L731 PolarHBondContact O-N 3.22Å; V728-L731 VanDerWaalsContact O-N 3.14Å; V728-L751 HydrophobicContact CG2-CD2 4.23Å; V728-L765 HydrophobicContact CG2-CD2 3.38Å; V728-R773 PolarHBondContact O-NH1 2.87Å; V728-R773 VanDerWaalsContact O-NH1 3.1Å
729	R	91.8	Very high	86.6	Confident	161 Å²	161	54.2 Å²	54.2	61%	0.608	27%	0.268	S	S	*	.	H	α-helix	trans	-63	-24.7	177.2	-86.9	-179.6	-98.4	118.5	-6.5	113.9	D725 A726 V727 R773	D725-R729 VanDerWaalsContact CB-NH2 3.34Å; D725-R729 VanDerWaalsContact O-CB 3.26Å; D725-R729 WeakPolarHBondContact O-CB 3.45Å; D725-R729 VanDerWaalsContact O-CG 3.24Å; D725-R729 WeakPolarHBondContact O-CG 3.18Å; D725-R729 VanDerWaalsContact O-CZ 3.23Å; D725-R729 PolarHBondContact O-N 2.95Å; D725-R729 VanDerWaalsContact O-N 3.14Å; D725-R729 PolarHBondContact O-NE 3.22Å; A726-R729 PolarHBondContact O-N 3.03Å; V727-R729 VanDerWaalsContact C-N 3.34Å; V727-R729 PolarHBondContact O-N 3.38Å; R729-R773 VanDerWaalsContact C-NH1 3.33Å; R729-R773 PolarHBondContact O-NH1 2.97Å
730	R	91.4	Very high	86.6	Confident	25 Å²	25	50.8 Å²	50.8	9%	0.094	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-1.1	175.1	-159.6	58.6	-179.1	125.1	-8.5	114.4	L696 L704 A726 V727 V728 D737 P739 L747	L696-R730 VanDerWaalsContact O-CD 3.3Å; L696-R730 WeakPolarHBondContact O-CD 3.37Å; L696-R730 PolarHBondContact O-NE 3.39Å; L704-R730 HydrophobicContact CD1-CG 4.29Å; L704-R730 HydrophobicContact CD2-CG 4.41Å; A726-R730 PolarHBondContact O-N 3.39Å; V727-R730 PolarHBondContact O-N 3.29Å; V728-R730 PolarHBondContact O-N 3.29Å; R730-D737 IonicContact CZ-OD1 2.91Å; R730-D737 IonicContact CZ-OD2 2.77Å; R730-D737 PolarHBondContact NH1-O 2.99Å; R730-D737 VanDerWaalsContact NH1-O 3.09Å; R730-D737 IonicContact NH1-OD1 3.3Å; R730-D737 PolarHBondContact NH1-OD1 3.14Å; R730-D737 IonicContact NH1-OD2 3.04Å; R730-D737 PolarHBondContact NH1-OD2 3.24Å; R730-D737 IonicContact NH2-OD1 2.71Å; R730-D737 PolarHBondContact NH2-OD1 2.97Å; R730-D737 IonicContact NH2-OD2 3.51Å; R730-D737 PolarHBondContact NH2-OD2 3.11Å; R730-P739 HydrophobicContact CG-CG 4.33Å; R730-P739 WeakPolarHBondContact O-CG 3.48Å; R730-L747 HydrophobicContact CB-CD1 4.44Å; R730-L747 HydrophobicContact CG-CD1 4.42Å
731	L	91.1	Very high	86.5	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.021	26%	0.258	C	S	.	.	S	Bend	trans	-66	145.6	161.4	-66.7	-175.8	0	0	0	109.7	V727 V728 L747 L751 R773 L774 M777	V727-L731 PolarHBondContact O-N 3.33Å; V728-L731 WeakPolarHBondContact O-CB 3.41Å; V728-L731 PolarHBondContact O-N 3.22Å; V728-L731 VanDerWaalsContact O-N 3.14Å; L731-L747 HydrophobicContact CD2-CB 4.11Å; L731-L751 HydrophobicContact CD1-CD1 3.8Å; L731-L751 HydrophobicContact CD2-CD1 4.4Å; L731-L751 HydrophobicContact CG-CD1 4.38Å; L731-R773 HydrophobicContact CB-CB 3.92Å; L731-R773 HydrophobicContact CD1-CB 4.07Å; L731-R773 PolarHBondContact O-NH1 3.18Å; L731-L774 HydrophobicContact CD1-CD2 4.11Å; L731-L774 HydrophobicContact CD1-CG 4.07Å; L731-M777 HydrophobicContact CD2-SD 3.97Å
732	P	86.7	Confident	86.5	Confident	5 Å²	5	54.8 Å²	54.8	3%	0.032	27%	0.269	C	S	.	.			trans	-64.9	154.1	-176.3	27.5	-34.2	0	0	0	111.8	V738 L744 R773 M777 L780	P732-V738 HydrophobicContact CB-CG1 4.27Å; P732-V738 HydrophobicContact CB-CG2 4.1Å; P732-L744 HydrophobicContact CG-CD2 4.29Å; P732-R773 WeakPolarHBondContact O-CG 3.46Å; P732-M777 HydrophobicContact CG-CB 4.43Å; P732-L780 HydrophobicContact CG-CD1 4.04Å
733	E	79.6	Confident	86.7	Confident	84 Å²	84	49.6 Å²	49.6	39%	0.393	24%	0.244	S	C	.	.	B	Isolated β-bridge	trans	-145.2	126.4	179.3	-171.8	163.8	-98.5	0	0	108.5	N735 K736 R773	E733-N735 VanDerWaalsContact C-N 3.27Å; E733-N735 PolarHBondContact O-N 2.75Å; E733-K736 PolarHBondContact O-N 3Å; E733-R773 VanDerWaalsContact CD-CZ 3.48Å; E733-R773 IonicContact OE1-CZ 2.67Å; E733-R773 IonicContact OE1-NE 3.23Å; E733-R773 PolarHBondContact OE1-NE 2.88Å; E733-R773 IonicContact OE1-NH2 2.93Å; E733-R773 PolarHBondContact OE1-NH2 3.26Å; E733-R773 IonicContact OE2-CZ 2.7Å; E733-R773 IonicContact OE2-NH2 2.72Å; E733-R773 PolarHBondContact OE2-NH2 3.03Å
734	N	67.5	Low	86.7	Confident	135 Å²	135	49.5 Å²	49.5	72%	0.722	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.5	34.9	-179.4	-54.8	-54	0	0	0	115.2	K736	N734-K736 PolarHBondContact O-N 3.13Å; N734-K736 VanDerWaalsContact O-N 3.1Å
735	N	65.9	Low	86.7	Confident	87 Å²	87	51 Å²	51	47%	0.465	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	26.5	178.1	-72.6	4.2	0	0	0	116.2	E733 L780 D783	E733-N735 VanDerWaalsContact C-N 3.27Å; E733-N735 PolarHBondContact O-N 2.75Å; N735-L780 WeakPolarHBondContact OD1-CD2 3.48Å; N735-D783 PolarHBondContact ND2-OD2 3.05Å
736	K	64.8	Low	86.8	Confident	168 Å²	168	48.8 Å²	48.8	73%	0.73	24%	0.241	S	C	*	.	B	Isolated β-bridge	trans	-113.8	144.6	173.1	-67.2	175.1	-177.1	177.9	0	110.3	E733 N734 V738	E733-K736 PolarHBondContact O-N 3Å; N734-K736 PolarHBondContact O-N 3.13Å; N734-K736 VanDerWaalsContact O-N 3.1Å; K736-V738 PolarHBondContact O-N 3.19Å
737	D	73.6	Confident	87	Confident	107 Å²	107	48.1 Å²	48.1	57%	0.572	24%	0.236	S	C	*	.	S	Bend	trans	47.4	53.6	-175.7	179.1	27.3	0	0	0	113.1	R730 P739	R730-D737 IonicContact CZ-OD1 2.91Å; R730-D737 IonicContact CZ-OD2 2.77Å; R730-D737 PolarHBondContact NH1-O 2.99Å; R730-D737 VanDerWaalsContact NH1-O 3.09Å; R730-D737 IonicContact NH1-OD1 3.3Å; R730-D737 PolarHBondContact NH1-OD1 3.14Å; R730-D737 IonicContact NH1-OD2 3.04Å; R730-D737 PolarHBondContact NH1-OD2 3.24Å; R730-D737 IonicContact NH2-OD1 2.71Å; R730-D737 PolarHBondContact NH2-OD1 2.97Å; R730-D737 IonicContact NH2-OD2 3.51Å; R730-D737 PolarHBondContact NH2-OD2 3.11Å; D737-P739 VanDerWaalsContact O-CD 3.29Å; D737-P739 WeakPolarHBondContact O-CD 3.49Å
738	V	81.8	Confident	87	Confident	35 Å²	35	48.2 Å²	48.2	21%	0.212	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-76.3	118.8	177.5	-174.6	0	0	0	0	109.6	P732 K736 L744 L780 Y787	P732-V738 HydrophobicContact CB-CG1 4.27Å; P732-V738 HydrophobicContact CB-CG2 4.1Å; K736-V738 PolarHBondContact O-N 3.19Å; V738-L744 HydrophobicContact CG1-CD1 4.01Å; V738-L780 HydrophobicContact CG1-CD1 4.27Å; V738-Y787 HydrophobicContact CG1-CE1 3.89Å
739	P	87.7	Confident	87.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-60.9	162.1	174.3	-22.2	32	0	0	0	113.6	L704 R730 D737 A743 L744	L704-P739 HydrophobicContact CD2-CB 3.95Å; L704-P739 HydrophobicContact CD2-CG 4.36Å; R730-P739 HydrophobicContact CG-CG 4.33Å; R730-P739 WeakPolarHBondContact O-CG 3.48Å; D737-P739 VanDerWaalsContact O-CD 3.29Å; D737-P739 WeakPolarHBondContact O-CD 3.49Å; P739-A743 HydrophobicContact CB-CB 4.11Å; P739-L744 HydrophobicContact CB-CD2 4.06Å; P739-L744 HydrophobicContact CB-CG 4.17Å; P739-L744 HydrophobicContact CG-CD2 3.97Å
740	S	90.9	Very high	87.4	Confident	18 Å²	18	40.7 Å²	40.7	13%	0.126	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-56.2	150.5	175.3	92.6	0	0	0	0	112.7	N701 E742 A743 L744	N701-S740 PolarHBondContact OD1-N 3.11Å; S740-E742 VanDerWaalsContact CB-OE2 3.24Å; S740-E742 WeakPolarHBondContact CB-OE2 3.48Å; S740-E742 PolarHBondContact O-N 3.18Å; S740-E742 VanDerWaalsContact O-N 3.15Å; S740-E742 PolarHBondContact OG-OE2 2.99Å; S740-A743 WeakPolarHBondContact O-CB 3.26Å; S740-A743 PolarHBondContact O-N 3.2Å; S740-A743 PolarHBondContact OG-N 3.23Å; S740-L744 PolarHBondContact O-N 3.03Å
741	P	92	Very high	87.7	Confident	27 Å²	27	39.5 Å²	39.5	18%	0.175	21%	0.206	C	C	.	.	H	α-helix	trans	-54.3	-37.1	-178.3	-24.3	32.2	0	0	0	113.4	L744 V745 V786 Y787	P741-L744 PolarHBondContact O-N 3.44Å; P741-V745 WeakPolarHBondContact O-CB 3.24Å; P741-V745 VanDerWaalsContact O-CG2 3.26Å; P741-V745 WeakPolarHBondContact O-CG2 3.4Å; P741-V745 PolarHBondContact O-N 3.07Å; P741-V786 HydrophobicContact CG-CG1 3.65Å; P741-Y787 HydrophobicContact CB-CD1 4.2Å; P741-Y787 HydrophobicContact CB-CE1 4.47Å; P741-Y787 HydrophobicContact CG-CD1 3.92Å; P741-Y787 HydrophobicContact CG-CE1 3.82Å
742	E	93.4	Very high	88	Confident	92 Å²	92	41 Å²	41	43%	0.43	21%	0.214	S	C	.	.	H	α-helix	trans	-70.1	-38.3	178.9	-48	81.6	177.7	0	0	111.8	R705 S740 L744 N746	R705-E742 HydrophobicContact CG-CB 4.07Å; S740-E742 VanDerWaalsContact CB-OE2 3.24Å; S740-E742 WeakPolarHBondContact CB-OE2 3.48Å; S740-E742 PolarHBondContact O-N 3.18Å; S740-E742 VanDerWaalsContact O-N 3.15Å; S740-E742 PolarHBondContact OG-OE2 2.99Å; E742-L744 VanDerWaalsContact C-N 3.35Å; E742-N746 WeakPolarHBondContact O-CB 3.33Å; E742-N746 VanDerWaalsContact O-CG 3.3Å; E742-N746 PolarHBondContact O-N 3.01Å; E742-N746 PolarHBondContact O-ND2 3.03Å
743	A	94.7	Very high	88.4	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.1	-40.7	173.4	0	0	0	0	0	110.9	L704 T708 P739 S740 N746 L747	L704-A743 HydrophobicContact CD2-CB 4.48Å; L704-A743 HydrophobicContact CG-CB 4.24Å; T708-A743 HydrophobicContact CG2-CB 4.44Å; P739-A743 HydrophobicContact CB-CB 4.11Å; S740-A743 WeakPolarHBondContact O-CB 3.26Å; S740-A743 PolarHBondContact O-N 3.2Å; S740-A743 PolarHBondContact OG-N 3.23Å; A743-N746 PolarHBondContact O-N 3.27Å; A743-L747 WeakPolarHBondContact O-CB 3.31Å; A743-L747 VanDerWaalsContact O-CG 3.26Å; A743-L747 WeakPolarHBondContact O-CG 3.3Å; A743-L747 PolarHBondContact O-N 2.8Å
744	L	94.3	Very high	89.2	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.9	-46.3	174.5	-69.4	179.8	0	0	0	112.9	P732 V738 P739 S740 P741 E742 N746 L747 C748 M777 L780 Y787 A790	P732-L744 HydrophobicContact CG-CD2 4.29Å; V738-L744 HydrophobicContact CG1-CD1 4.01Å; P739-L744 HydrophobicContact CB-CD2 4.06Å; P739-L744 HydrophobicContact CB-CG 4.17Å; P739-L744 HydrophobicContact CG-CD2 3.97Å; S740-L744 PolarHBondContact O-N 3.03Å; P741-L744 PolarHBondContact O-N 3.44Å; E742-L744 VanDerWaalsContact C-N 3.35Å; L744-N746 VanDerWaalsContact C-N 3.27Å; L744-N746 PolarHBondContact O-N 2.76Å; L744-L747 HydrophobicContact CD2-CD1 4.39Å; L744-L747 PolarHBondContact O-N 3.2Å; L744-C748 PolarHBondContact O-N 2.94Å; L744-M777 HydrophobicContact CB-CE 3.73Å; L744-M777 HydrophobicContact CB-SD 4.42Å; L744-M777 HydrophobicContact CD2-SD 4.18Å; L744-L780 HydrophobicContact CD1-CD1 4.32Å; L744-Y787 HydrophobicContact CD1-CD1 3.78Å; L744-Y787 HydrophobicContact CD1-CE1 3.79Å; L744-A790 HydrophobicContact CB-CB 3.89Å; L744-A790 HydrophobicContact CD1-CB 4.21Å
745	V	95.9	Very high	90.5	Very high	32 Å²	32	32.1 Å²	32.1	19%	0.194	17%	0.169	C	C	.	.	H	α-helix	trans	-56.5	-43	173.1	166.8	0	0	0	0	110.6	P741 C748 G749 D789 A790	P741-V745 WeakPolarHBondContact O-CB 3.24Å; P741-V745 VanDerWaalsContact O-CG2 3.26Å; P741-V745 WeakPolarHBondContact O-CG2 3.4Å; P741-V745 PolarHBondContact O-N 3.07Å; V745-C748 PolarHBondContact O-N 2.96Å; V745-G749 PolarHBondContact O-N 3.31Å; V745-D789 HydrophobicContact CG2-CB 4.15Å; V745-A790 HydrophobicContact CG2-CB 4.33Å
746	N	96.9	Very high	91.8	Very high	19 Å²	19	31 Å²	31	10%	0.102	17%	0.172	C	C	.	.	H	α-helix	trans	-68.7	-42.3	177.8	-74.8	-25.3	0	0	0	113.1	G709 R712 E742 A743 L744 C748 G749 V750	G709-N746 WeakPolarHBondContact CA-ND2 3.38Å; G709-N746 PolarHBondContact N-ND2 2.95Å; R712-N746 VanDerWaalsContact CD-OD1 3.29Å; R712-N746 WeakPolarHBondContact CD-OD1 3.42Å; R712-N746 PolarHBondContact NH1-OD1 3.41Å; E742-N746 WeakPolarHBondContact O-CB 3.33Å; E742-N746 VanDerWaalsContact O-CG 3.3Å; E742-N746 PolarHBondContact O-N 3.01Å; E742-N746 PolarHBondContact O-ND2 3.03Å; A743-N746 PolarHBondContact O-N 3.27Å; L744-N746 VanDerWaalsContact C-N 3.27Å; L744-N746 PolarHBondContact O-N 2.76Å; N746-C748 VanDerWaalsContact C-N 3.33Å; N746-C748 PolarHBondContact O-N 3.38Å; N746-G749 WeakPolarHBondContact O-CA 3.31Å; N746-G749 PolarHBondContact O-N 3.41Å; N746-G749 VanDerWaalsContact O-N 3.08Å; N746-V750 WeakPolarHBondContact O-CG2 3.38Å; N746-V750 PolarHBondContact O-N 2.64Å
747	L	96.6	Very high	93	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.3	-42.4	174	-72.2	163.4	0	0	0	111.4	T708 V727 R730 L731 A743 L744 V750 L751	T708-L747 HydrophobicContact CG2-CD1 4.27Å; T708-L747 HydrophobicContact CG2-CD2 3.75Å; T708-L747 HydrophobicContact CG2-CG 3.69Å; V727-L747 HydrophobicContact CB-CD2 4.33Å; V727-L747 HydrophobicContact CG1-CD2 3.81Å; V727-L747 HydrophobicContact CG2-CD2 4.39Å; R730-L747 HydrophobicContact CB-CD1 4.44Å; R730-L747 HydrophobicContact CG-CD1 4.42Å; L731-L747 HydrophobicContact CD2-CB 4.11Å; A743-L747 WeakPolarHBondContact O-CB 3.31Å; A743-L747 VanDerWaalsContact O-CG 3.26Å; A743-L747 WeakPolarHBondContact O-CG 3.3Å; A743-L747 PolarHBondContact O-N 2.8Å; L744-L747 HydrophobicContact CD2-CD1 4.39Å; L744-L747 PolarHBondContact O-N 3.2Å; L747-V750 WeakPolarHBondContact O-CB 3.24Å; L747-V750 PolarHBondContact O-N 2.92Å; L747-L751 WeakPolarHBondContact O-CG 3.3Å; L747-L751 PolarHBondContact O-N 3.33Å
748	C	96.8	Very high	94	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.014	15%	0.145	C	C	.	.	H	α-helix	trans	-65.9	-36.3	172	-85.1	0	0	0	0	113	L744 V745 N746 L751 N752 M777 V797	L744-C748 PolarHBondContact O-N 2.94Å; V745-C748 PolarHBondContact O-N 2.96Å; N746-C748 VanDerWaalsContact C-N 3.33Å; N746-C748 PolarHBondContact O-N 3.38Å; C748-L751 PolarHBondContact O-N 2.88Å; C748-N752 VanDerWaalsContact O-CB 3.26Å; C748-N752 WeakPolarHBondContact O-CB 3.43Å; C748-N752 PolarHBondContact O-N 2.85Å; C748-M777 HydrophobicContact CB-CE 4.25Å; C748-M777 WeakPolarHBondContact SG-CE 3Å; C748-V797 HydrophobicContact CB-CG2 3.96Å; C748-V797 VanDerWaalsContact O-CG2 3.29Å; C748-V797 WeakPolarHBondContact O-CG2 3.39Å
749	G	96.7	Very high	94.6	Very high	13 Å²	13	26.7 Å²	26.7	13%	0.134	15%	0.146	C	C	.	.	H	α-helix	trans	-58.4	-45.3	171.4	0	0	0	0	0	112.5	V745 N746 N752 N753	V745-G749 PolarHBondContact O-N 3.31Å; N746-G749 WeakPolarHBondContact O-CA 3.31Å; N746-G749 PolarHBondContact O-N 3.41Å; N746-G749 VanDerWaalsContact O-N 3.08Å; G749-N752 PolarHBondContact O-N 2.95Å; G749-N753 PolarHBondContact O-N 3.14Å; G749-N753 PolarHBondContact O-ND2 3.2Å; G749-N753 PolarHBondContact O-OD1 2.87Å
750	V	97.6	Very high	94.9	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.012	17%	0.173	C	C	.	.	H	α-helix	trans	-58.8	-51.7	174.5	175.2	0	0	0	0	111.2	L711 R712 V727 N746 L747 N752 N753 M754	L711-V750 HydrophobicContact CB-CG2 3.84Å; R712-V750 VanDerWaalsContact CA-CG2 3.49Å; R712-V750 HydrophobicContact CB-CG2 4Å; R712-V750 VanDerWaalsContact N-CG2 3.33Å; V727-V750 HydrophobicContact CG1-CB 4.47Å; V727-V750 HydrophobicContact CG1-CG1 4.23Å; V727-V750 HydrophobicContact CG2-CG1 3.95Å; N746-V750 WeakPolarHBondContact O-CG2 3.38Å; N746-V750 PolarHBondContact O-N 2.64Å; L747-V750 WeakPolarHBondContact O-CB 3.24Å; L747-V750 PolarHBondContact O-N 2.92Å; V750-N752 VanDerWaalsContact C-N 3.34Å; V750-N752 PolarHBondContact O-N 3.44Å; V750-N753 PolarHBondContact O-N 3.33Å; V750-M754 HydrophobicContact CG1-CE 3.64Å; V750-M754 HydrophobicContact CG1-SD 4.33Å; V750-M754 WeakPolarHBondContact O-CG 3.44Å; V750-M754 PolarHBondContact O-N 3.14Å; V750-M754 VanDerWaalsContact O-N 3.09Å
751	L	97.6	Very high	95.1	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.6	-40.2	179.9	-67.9	177.6	0	0	0	112.1	L724 V727 V728 L731 L747 C748 N753 M754 V755 L765 L774 V797	L724-L751 HydrophobicContact CD1-CD2 3.63Å; V727-L751 HydrophobicContact CB-CD2 4.41Å; V727-L751 HydrophobicContact CG1-CD1 4.2Å; V727-L751 HydrophobicContact CG1-CD2 3.61Å; V727-L751 HydrophobicContact CG1-CG 3.66Å; V728-L751 HydrophobicContact CG2-CD2 4.23Å; L731-L751 HydrophobicContact CD1-CD1 3.8Å; L731-L751 HydrophobicContact CD2-CD1 4.4Å; L731-L751 HydrophobicContact CG-CD1 4.38Å; L747-L751 WeakPolarHBondContact O-CG 3.3Å; L747-L751 PolarHBondContact O-N 3.33Å; C748-L751 PolarHBondContact O-N 2.88Å; L751-N753 VanDerWaalsContact C-N 3.35Å; L751-N753 PolarHBondContact O-N 3.11Å; L751-M754 PolarHBondContact O-N 3.26Å; L751-V755 VanDerWaalsContact O-CB 3.3Å; L751-V755 WeakPolarHBondContact O-CB 3.42Å; L751-V755 VanDerWaalsContact O-CG2 3.24Å; L751-V755 WeakPolarHBondContact O-CG2 3.42Å; L751-V755 PolarHBondContact O-N 3.27Å; L751-L765 HydrophobicContact CD2-CD1 4.35Å; L751-L765 HydrophobicContact CD2-CD2 4.08Å; L751-L774 HydrophobicContact CD1-CD2 4.32Å; L751-V797 HydrophobicContact CB-CG1 4.17Å; L751-V797 HydrophobicContact CB-CG2 4.35Å
752	N	96.8	Very high	95.3	Very high	34 Å²	34	30.3 Å²	30.3	18%	0.182	16%	0.163	C	C	.	.	H	α-helix	trans	-59.7	-45.3	176.1	-175.6	73.9	0	0	0	111.7	C748 G749 V750 V755 A756 V797 N800	C748-N752 VanDerWaalsContact O-CB 3.26Å; C748-N752 WeakPolarHBondContact O-CB 3.43Å; C748-N752 PolarHBondContact O-N 2.85Å; G749-N752 PolarHBondContact O-N 2.95Å; V750-N752 VanDerWaalsContact C-N 3.34Å; V750-N752 PolarHBondContact O-N 3.44Å; N752-V755 PolarHBondContact O-N 2.81Å; N752-A756 VanDerWaalsContact O-CB 3.32Å; N752-A756 WeakPolarHBondContact O-CB 3.47Å; N752-A756 PolarHBondContact O-N 2.71Å; N752-V797 HydrophobicContact CB-CG2 4.01Å; N752-N800 PolarHBondContact OD1-ND2 2.99Å
753	N	95.9	Very high	95.4	Very high	35 Å²	35	29.6 Å²	29.6	19%	0.187	16%	0.158	C	C	.	.	H	α-helix	trans	-64.3	-41.2	179.6	-67.9	-12	0	0	0	111.8	R712 S715 S716 G749 V750 L751 R757	R712-N753 PolarHBondContact O-ND2 3.22Å; S715-N753 PolarHBondContact OG-ND2 2.91Å; S716-N753 PolarHBondContact N-ND2 3.37Å; G749-N753 PolarHBondContact O-N 3.14Å; G749-N753 PolarHBondContact O-ND2 3.2Å; G749-N753 PolarHBondContact O-OD1 2.87Å; V750-N753 PolarHBondContact O-N 3.33Å; L751-N753 VanDerWaalsContact C-N 3.35Å; L751-N753 PolarHBondContact O-N 3.11Å; N753-R757 VanDerWaalsContact O-CG 3.29Å; N753-R757 WeakPolarHBondContact O-CG 3.48Å; N753-R757 PolarHBondContact O-N 3.19Å
754	M	95.7	Very high	95.4	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.015	18%	0.178	C	C	.	.	H	α-helix	trans	-67.3	-45.4	174.8	-60.8	175.5	174.4	0	0	112.3	T720 A723 L724 V750 L751 A756 R757 S758 I761	T720-M754 VanDerWaalsContact O-CE 3.23Å; T720-M754 WeakPolarHBondContact O-CE 3.36Å; T720-M754 WeakPolarHBondContact OG1-CE 3.39Å; A723-M754 HydrophobicContact CB-CE 3.87Å; L724-M754 HydrophobicContact CB-SD 4.25Å; L724-M754 HydrophobicContact CD1-SD 3.78Å; V750-M754 HydrophobicContact CG1-CE 3.64Å; V750-M754 HydrophobicContact CG1-SD 4.33Å; V750-M754 WeakPolarHBondContact O-CG 3.44Å; V750-M754 PolarHBondContact O-N 3.14Å; V750-M754 VanDerWaalsContact O-N 3.09Å; L751-M754 PolarHBondContact O-N 3.26Å; M754-A756 VanDerWaalsContact C-N 3.33Å; M754-A756 PolarHBondContact O-N 3.19Å; M754-R757 PolarHBondContact O-N 3.1Å; M754-R757 VanDerWaalsContact O-N 3.17Å; M754-S758 PolarHBondContact O-N 2.68Å; M754-I761 HydrophobicContact CB-CG2 3.81Å
755	V	95.7	Very high	95.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.4	-39.7	178.9	163.8	0	0	0	0	111.4	L751 N752 R757 A762 L765 V797 N800 M801 Y804	L751-V755 VanDerWaalsContact O-CB 3.3Å; L751-V755 WeakPolarHBondContact O-CB 3.42Å; L751-V755 VanDerWaalsContact O-CG2 3.24Å; L751-V755 WeakPolarHBondContact O-CG2 3.42Å; L751-V755 PolarHBondContact O-N 3.27Å; N752-V755 PolarHBondContact O-N 2.81Å; V755-R757 VanDerWaalsContact C-N 3.29Å; V755-R757 PolarHBondContact O-N 3.46Å; V755-A762 HydrophobicContact CG1-CB 4.14Å; V755-A762 HydrophobicContact CG2-CB 4.3Å; V755-L765 HydrophobicContact CG2-CD1 3.4Å; V755-L765 VanDerWaalsContact CG2-CD1 3.4Å; V755-V797 HydrophobicContact CG2-CG1 4.49Å; V755-N800 HydrophobicContact CG1-CB 4.19Å; V755-M801 HydrophobicContact CG1-CG 3.84Å; V755-M801 HydrophobicContact CG2-CG 4Å; V755-Y804 HydrophobicContact CG1-CE2 4.22Å; V755-Y804 PolarHBondContact O-OH 3.42Å
756	A	93.2	Very high	95.4	Very high	65 Å²	65	32.9 Å²	32.9	54%	0.537	17%	0.17	S	C	.	.	H	α-helix	trans	-68	-27.8	177.4	0	0	0	0	0	113.2	N752 M754	N752-A756 VanDerWaalsContact O-CB 3.32Å; N752-A756 WeakPolarHBondContact O-CB 3.47Å; N752-A756 PolarHBondContact O-N 2.71Å; M754-A756 VanDerWaalsContact C-N 3.33Å; M754-A756 PolarHBondContact O-N 3.19Å
757	R	90.3	Very high	95.2	Very high	134 Å²	134	36.7 Å²	36.7	51%	0.506	19%	0.187	S	C	.	.	H	α-helix	trans	-90.9	-27.2	-179.4	-66.9	172.5	97.3	132.3	5.1	113.5	S715 S716 H717 N753 M754 V755	S715-R757 PolarHBondContact O-NH1 2.89Å; S716-R757 PolarHBondContact O-NH1 3.46Å; H717-R757 PolarHBondContact O-NH1 3.15Å; H717-R757 PolarHBondContact O-NH2 3.37Å; N753-R757 VanDerWaalsContact O-CG 3.29Å; N753-R757 WeakPolarHBondContact O-CG 3.48Å; N753-R757 PolarHBondContact O-N 3.19Å; M754-R757 PolarHBondContact O-N 3.1Å; M754-R757 VanDerWaalsContact O-N 3.17Å; V755-R757 VanDerWaalsContact C-N 3.29Å; V755-R757 PolarHBondContact O-N 3.46Å
758	S	93.1	Very high	95	Very high	32 Å²	32	38.5 Å²	38.5	22%	0.224	21%	0.205	C	C	.	.			trans	-141.9	120.7	-172.8	-180	0	0	0	0	114.5	M754 D760 I761 A762	M754-S758 PolarHBondContact O-N 2.68Å; S758-D760 VanDerWaalsContact C-N 3.29Å; S758-D760 PolarHBondContact O-N 3.06Å; S758-D760 PolarHBondContact OG-N 3.43Å; S758-I761 PolarHBondContact O-N 3.43Å; S758-I761 PolarHBondContact OG-N 2.88Å; S758-A762 PolarHBondContact O-N 3.14Å
759	F	94.9	Very high	94.7	Very high	52 Å²	52	40.9 Å²	40.9	23%	0.228	22%	0.222	C	C	.	.	H	α-helix	trans	-59.8	-37.8	169.4	169.1	-104.4	0	0	0	112.3	I761 A762 K763 Y804 K806 L807	F759-I761 VanDerWaalsContact C-N 3.31Å; F759-I761 PolarHBondContact O-N 3.41Å; F759-A762 WeakPolarHBondContact O-CB 3.35Å; F759-A762 PolarHBondContact O-N 3.27Å; F759-K763 HydrophobicContact CE1-CB 4.49Å; F759-K763 HydrophobicContact CE1-CD 4.43Å; F759-K763 HydrophobicContact CZ-CB 4.41Å; F759-K763 WeakPolarHBondContact O-CB 3.33Å; F759-K763 PolarHBondContact O-N 2.85Å; F759-Y804 HydrophobicContact CB-CD1 4.46Å; F759-Y804 HydrophobicContact CB-CE1 4.13Å; F759-Y804 AromaticContact CD2-CD1 3.68Å; F759-Y804 HydrophobicContact CD2-CD1 3.68Å; F759-Y804 HydrophobicContact CD2-CD2 4.47Å; F759-Y804 HydrophobicContact CD2-CE1 4.19Å; F759-Y804 AromaticContact CD2-CG 3.84Å; F759-Y804 HydrophobicContact CD2-CG 3.84Å; F759-Y804 HydrophobicContact CE2-CG 4.43Å; F759-K806 HydrophobicContact CE1-CD 4.18Å; F759-K806 HydrophobicContact CE2-CB 3.71Å; F759-K806 HydrophobicContact CE2-CD 4Å; F759-K806 HydrophobicContact CE2-CG 4.42Å; F759-K806 HydrophobicContact CZ-CB 3.74Å; F759-K806 HydrophobicContact CZ-CD 3.72Å; F759-K806 HydrophobicContact CZ-CG 4.37Å; F759-L807 HydrophobicContact CE2-CD2 3.74Å; F759-L807 HydrophobicContact CE2-CG 3.95Å; F759-L807 HydrophobicContact CZ-CD2 4.03Å
760	D	94.4	Very high	94.5	Very high	107 Å²	107	40.4 Å²	40.4	57%	0.572	22%	0.217	S	C	*	.	H	α-helix	trans	-71.7	-28.1	-176.6	-63.7	-62.5	0	0	0	112.1	S758 K764	S758-D760 VanDerWaalsContact C-N 3.29Å; S758-D760 PolarHBondContact O-N 3.06Å; S758-D760 PolarHBondContact OG-N 3.43Å; D760-K764 WeakPolarHBondContact O-CB 3.49Å; D760-K764 PolarHBondContact O-N 3.4Å
761	I	95.4	Very high	94.4	Very high	15 Å²	15	40.3 Å²	40.3	8%	0.077	22%	0.216	C	C	.	.	H	α-helix	trans	-68.8	-46.3	168.2	-61	-65.5	0	0	0	110.9	L724 M754 S758 F759 K763 K764 L765	L724-I761 HydrophobicContact CD1-CG2 3.58Å; L724-I761 HydrophobicContact CD2-CD1 3.93Å; L724-I761 HydrophobicContact CD2-CG2 3.95Å; L724-I761 HydrophobicContact CG-CG2 4.34Å; M754-I761 HydrophobicContact CB-CG2 3.81Å; S758-I761 PolarHBondContact O-N 3.43Å; S758-I761 PolarHBondContact OG-N 2.88Å; F759-I761 VanDerWaalsContact C-N 3.31Å; F759-I761 PolarHBondContact O-N 3.41Å; I761-K763 PolarHBondContact O-N 3.34Å; I761-K764 PolarHBondContact O-N 2.86Å; I761-L765 HydrophobicContact CG2-CD1 4.01Å; I761-L765 HydrophobicContact CG2-CG 4.5Å; I761-L765 WeakPolarHBondContact O-CB 3.5Å; I761-L765 WeakPolarHBondContact O-CG 3.15Å; I761-L765 PolarHBondContact O-N 3.04Å
762	A	95.5	Very high	94.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.6	-37	175.3	0	0	0	0	0	112.1	V755 S758 F759 T766 Y804 L807	V755-A762 HydrophobicContact CG1-CB 4.14Å; V755-A762 HydrophobicContact CG2-CB 4.3Å; S758-A762 PolarHBondContact O-N 3.14Å; F759-A762 WeakPolarHBondContact O-CB 3.35Å; F759-A762 PolarHBondContact O-N 3.27Å; A762-T766 WeakPolarHBondContact O-CB 3.43Å; A762-T766 PolarHBondContact O-N 3.33Å; A762-T766 VanDerWaalsContact O-N 3.11Å; A762-T766 PolarHBondContact O-OG1 3.34Å; A762-Y804 HydrophobicContact CB-CD2 3.65Å; A762-Y804 HydrophobicContact CB-CE2 3.68Å; A762-L807 HydrophobicContact CB-CD1 3.98Å
763	K	95.6	Very high	93.9	Very high	77 Å²	77	41.8 Å²	41.8	34%	0.335	23%	0.226	S	C	.	.	H	α-helix	trans	-64.9	-51.8	172.3	-173.3	-166.8	169.9	-156.8	0	111.6	F759 I761 L765 T766 E767 L807	F759-K763 HydrophobicContact CE1-CB 4.49Å; F759-K763 HydrophobicContact CE1-CD 4.43Å; F759-K763 HydrophobicContact CZ-CB 4.41Å; F759-K763 WeakPolarHBondContact O-CB 3.33Å; F759-K763 PolarHBondContact O-N 2.85Å; I761-K763 PolarHBondContact O-N 3.34Å; K763-L765 VanDerWaalsContact C-N 3.33Å; K763-L765 PolarHBondContact O-N 2.8Å; K763-T766 CarbonylContact O-C 3.49Å; K763-T766 WeakPolarHBondContact O-CA 3.25Å; K763-T766 WeakPolarHBondContact O-CB 3.39Å; K763-T766 PolarHBondContact O-N 3.14Å; K763-E767 VanDerWaalsContact CE-CD 3.43Å; K763-E767 WeakPolarHBondContact CE-OE1 3.29Å; K763-E767 VanDerWaalsContact CE-OE2 3.24Å; K763-E767 WeakPolarHBondContact CE-OE2 3.17Å; K763-E767 HydrophobicContact CG-CG 4.44Å; K763-E767 IonicContact NZ-OE1 3.01Å; K763-E767 IonicContact NZ-OE2 2.84Å; K763-E767 PolarHBondContact O-N 3.17Å; K763-L807 HydrophobicContact CB-CD2 3.93Å; K763-L807 HydrophobicContact CG-CD2 4.11Å
764	K	95.6	Very high	93.9	Very high	98 Å²	98	40.1 Å²	40.1	43%	0.426	22%	0.217	S	C	.	.	H	α-helix	trans	-60.4	-39.3	180	-175.7	171.8	170.2	-167.5	0	112.4	L724 D725 D760 I761 T766 E767 G768	L724-K764 HydrophobicContact CD2-CB 4.18Å; L724-K764 HydrophobicContact CD2-CD 3.75Å; L724-K764 HydrophobicContact CD2-CG 3.97Å; D725-K764 WeakPolarHBondContact OD1-CE 3.24Å; D725-K764 IonicContact OD1-NZ 2.74Å; D725-K764 PolarHBondContact OD1-NZ 3.2Å; D725-K764 IonicContact OD2-NZ 2.75Å; D725-K764 PolarHBondContact OD2-NZ 2.71Å; D760-K764 WeakPolarHBondContact O-CB 3.49Å; D760-K764 PolarHBondContact O-N 3.4Å; I761-K764 PolarHBondContact O-N 2.86Å; K764-T766 VanDerWaalsContact C-N 3.35Å; K764-E767 PolarHBondContact O-N 3.39Å; K764-G768 PolarHBondContact O-N 3.45Å
765	L	94.9	Very high	93.7	Very high	3 Å²	3	40.8 Å²	40.8	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-61.4	-40.5	171.2	-78.6	165.5	0	0	0	113	L724 V728 L751 V755 I761 K763 L771 M801	L724-L765 HydrophobicContact CD1-CD1 4.1Å; L724-L765 HydrophobicContact CD1-CD2 3.92Å; L724-L765 HydrophobicContact CD1-CG 3.93Å; V728-L765 HydrophobicContact CG2-CD2 3.38Å; L751-L765 HydrophobicContact CD2-CD1 4.35Å; L751-L765 HydrophobicContact CD2-CD2 4.08Å; V755-L765 HydrophobicContact CG2-CD1 3.4Å; V755-L765 VanDerWaalsContact CG2-CD1 3.4Å; I761-L765 HydrophobicContact CG2-CD1 4.01Å; I761-L765 HydrophobicContact CG2-CG 4.5Å; I761-L765 WeakPolarHBondContact O-CB 3.5Å; I761-L765 WeakPolarHBondContact O-CG 3.15Å; I761-L765 PolarHBondContact O-N 3.04Å; K763-L765 VanDerWaalsContact C-N 3.33Å; K763-L765 PolarHBondContact O-N 2.8Å; L765-L771 PolarHBondContact O-N 3.33Å; L765-M801 HydrophobicContact CB-CE 3.72Å; L765-M801 HydrophobicContact CB-SD 4.36Å; L765-M801 HydrophobicContact CD1-SD 4.41Å
766	T	94.7	Very high	93.4	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-70.7	-37.9	179.4	-62	0	0	0	0	112.2	A762 K763 K764 L771 M801 L807 I810 F811 K814	A762-T766 WeakPolarHBondContact O-CB 3.43Å; A762-T766 PolarHBondContact O-N 3.33Å; A762-T766 VanDerWaalsContact O-N 3.11Å; A762-T766 PolarHBondContact O-OG1 3.34Å; K763-T766 CarbonylContact O-C 3.49Å; K763-T766 WeakPolarHBondContact O-CA 3.25Å; K763-T766 WeakPolarHBondContact O-CB 3.39Å; K763-T766 PolarHBondContact O-N 3.14Å; K764-T766 VanDerWaalsContact C-N 3.35Å; T766-L771 HydrophobicContact CG2-CD2 4.34Å; T766-M801 WeakPolarHBondContact OG1-CE 3.24Å; T766-L807 HydrophobicContact CG2-CB 4.5Å; T766-I810 HydrophobicContact CG2-CB 3.84Å; T766-I810 HydrophobicContact CG2-CD1 4.43Å; T766-I810 HydrophobicContact CG2-CG2 3.74Å; T766-F811 HydrophobicContact CG2-CD1 3.68Å; T766-F811 HydrophobicContact CG2-CE1 3.42Å; T766-F811 VanDerWaalsContact CG2-CE1 3.42Å; T766-F811 HydrophobicContact CG2-CZ 4.32Å; T766-F811 WeakPolarHBondContact OG1-CE1 3.45Å; T766-K814 WeakPolarHBondContact O-CE 3.43Å; T766-K814 PolarHBondContact O-NZ 3.28Å
767	E	93.1	Very high	93.3	Very high	98 Å²	98	40.8 Å²	40.8	46%	0.458	21%	0.211	S	C	.	.	H	α-helix	trans	-78.7	-39.4	-179	-70.9	175.8	160.3	0	0	111.8	K763 K764 I810 K814	K763-E767 VanDerWaalsContact CE-CD 3.43Å; K763-E767 WeakPolarHBondContact CE-OE1 3.29Å; K763-E767 VanDerWaalsContact CE-OE2 3.24Å; K763-E767 WeakPolarHBondContact CE-OE2 3.17Å; K763-E767 HydrophobicContact CG-CG 4.44Å; K763-E767 IonicContact NZ-OE1 3.01Å; K763-E767 IonicContact NZ-OE2 2.84Å; K763-E767 PolarHBondContact O-N 3.17Å; K764-E767 PolarHBondContact O-N 3.39Å; E767-I810 HydrophobicContact CG-CD1 4.08Å; E767-I810 HydrophobicContact CG-CG2 4.47Å; E767-K814 VanDerWaalsContact C-NZ 3.33Å; E767-K814 PolarHBondContact O-NZ 2.85Å
768	G	91.3	Very high	93.3	Very high	38 Å²	38	36 Å²	36	39%	0.392	19%	0.194	S	C	.	.	S	Bend	trans	-79	-159	174.3	0	0	0	0	0	115.5	K764 K814	K764-G768 PolarHBondContact O-N 3.45Å; G768-K814 PolarHBondContact O-NZ 3.25Å
769	S	90.9	Very high	93.1	Very high	53 Å²	53	37 Å²	37	37%	0.371	20%	0.201	S	C	.	.	S	Bend	trans	-83.1	-4.8	178.3	53.8	0	0	0	0	114.6	L771 S772 R773	S769-L771 VanDerWaalsContact C-N 3.31Å; S769-L771 PolarHBondContact O-N 3.1Å; S769-S772 PolarHBondContact O-N 3.48Å; S769-S772 PolarHBondContact O-OG 3.44Å; S769-R773 WeakPolarHBondContact O-CG 3.4Å; S769-R773 PolarHBondContact O-N 3.32Å; S769-R773 VanDerWaalsContact O-N 3.11Å
770	G	92.9	Very high	92.6	Very high	2 Å²	2	34.8 Å²	34.8	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-59.2	-40.7	-179.7	0	0	0	0	0	112.9	L774	G770-L774 WeakPolarHBondContact O-CB 3.35Å; G770-L774 WeakPolarHBondContact O-CD1 3.46Å; G770-L774 VanDerWaalsContact O-CG 3.25Å; G770-L774 WeakPolarHBondContact O-CG 3.44Å; G770-L774 PolarHBondContact O-N 3.18Å
771	L	94.4	Very high	92.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.5	-45.5	177.3	177.8	60.4	0	0	0	113.3	L765 T766 S769 L774 M775 L798 M801 F811 K814 Y816 F821	L765-L771 PolarHBondContact O-N 3.33Å; T766-L771 HydrophobicContact CG2-CD2 4.34Å; S769-L771 VanDerWaalsContact C-N 3.31Å; S769-L771 PolarHBondContact O-N 3.1Å; L771-L774 PolarHBondContact O-N 3.34Å; L771-M775 HydrophobicContact CD1-CE 4.12Å; L771-M775 WeakPolarHBondContact O-CG 3.3Å; L771-M775 PolarHBondContact O-N 3.14Å; L771-M775 VanDerWaalsContact O-N 3.17Å; L771-L798 HydrophobicContact CD1-CD2 3.75Å; L771-M801 HydrophobicContact CD1-CE 4.48Å; L771-F811 HydrophobicContact CD1-CE1 4.4Å; L771-F811 HydrophobicContact CD2-CD1 3.83Å; L771-F811 HydrophobicContact CD2-CE1 4.17Å; L771-K814 HydrophobicContact CD2-CD 4.06Å; L771-Y816 HydrophobicContact CD2-CD2 3.67Å; L771-Y816 HydrophobicContact CD2-CE2 3.64Å; L771-Y816 HydrophobicContact CG-CD2 4.19Å; L771-Y816 HydrophobicContact CG-CE2 3.81Å; L771-F821 HydrophobicContact CD1-CE1 3.73Å; L771-F821 HydrophobicContact CD1-CZ 4.12Å
772	S	92.6	Very high	91.8	Very high	40 Å²	40	36.3 Å²	36.3	28%	0.28	20%	0.201	S	C	.	.	H	α-helix	trans	-67.3	-48.7	-180	50.9	0	0	0	0	110.8	S769 L774 M775 D776	S769-S772 PolarHBondContact O-N 3.48Å; S769-S772 PolarHBondContact O-OG 3.44Å; S772-L774 PolarHBondContact O-N 2.83Å; S772-L774 VanDerWaalsContact O-N 3.16Å; S772-M775 CarbonylContact O-C 3.58Å; S772-M775 WeakPolarHBondContact O-CA 3.31Å; S772-M775 WeakPolarHBondContact O-CB 3.47Å; S772-M775 PolarHBondContact O-N 2.91Å; S772-D776 PolarHBondContact O-N 3.39Å
773	R	92.8	Very high	91.1	Very high	25 Å²	25	41.6 Å²	41.6	9%	0.094	23%	0.229	C	C	.	.	H	α-helix	trans	-59.3	-31	177.9	-65.4	-172.9	-178.9	-157.6	4.7	113.2	V728 R729 L731 P732 E733 S769 M777	V728-R773 PolarHBondContact O-NH1 2.87Å; V728-R773 VanDerWaalsContact O-NH1 3.1Å; R729-R773 VanDerWaalsContact C-NH1 3.33Å; R729-R773 PolarHBondContact O-NH1 2.97Å; L731-R773 HydrophobicContact CB-CB 3.92Å; L731-R773 HydrophobicContact CD1-CB 4.07Å; L731-R773 PolarHBondContact O-NH1 3.18Å; P732-R773 WeakPolarHBondContact O-CG 3.46Å; E733-R773 VanDerWaalsContact CD-CZ 3.48Å; E733-R773 IonicContact OE1-CZ 2.67Å; E733-R773 IonicContact OE1-NE 3.23Å; E733-R773 PolarHBondContact OE1-NE 2.88Å; E733-R773 IonicContact OE1-NH2 2.93Å; E733-R773 PolarHBondContact OE1-NH2 3.26Å; E733-R773 IonicContact OE2-CZ 2.7Å; E733-R773 IonicContact OE2-NH2 2.72Å; E733-R773 PolarHBondContact OE2-NH2 3.03Å; S769-R773 WeakPolarHBondContact O-CG 3.4Å; S769-R773 PolarHBondContact O-N 3.32Å; S769-R773 VanDerWaalsContact O-N 3.11Å; R773-M777 WeakPolarHBondContact O-CB 3.34Å; R773-M777 PolarHBondContact O-N 3.06Å
774	L	94.2	Very high	90.6	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-72.3	-32	172.3	-75.8	169	0	0	0	113.3	L731 L751 G770 L771 S772 K778 A794 V797 L798 M801	L731-L774 HydrophobicContact CD1-CD2 4.11Å; L731-L774 HydrophobicContact CD1-CG 4.07Å; L751-L774 HydrophobicContact CD1-CD2 4.32Å; G770-L774 WeakPolarHBondContact O-CB 3.35Å; G770-L774 WeakPolarHBondContact O-CD1 3.46Å; G770-L774 VanDerWaalsContact O-CG 3.25Å; G770-L774 WeakPolarHBondContact O-CG 3.44Å; G770-L774 PolarHBondContact O-N 3.18Å; L771-L774 PolarHBondContact O-N 3.34Å; S772-L774 PolarHBondContact O-N 2.83Å; S772-L774 VanDerWaalsContact O-N 3.16Å; L774-K778 WeakPolarHBondContact O-CB 3.24Å; L774-K778 PolarHBondContact O-N 2.81Å; L774-A794 HydrophobicContact CD2-CB 4.16Å; L774-V797 HydrophobicContact CD1-CB 4.37Å; L774-V797 HydrophobicContact CD1-CG1 3.69Å; L774-V797 HydrophobicContact CD2-CB 4.34Å; L774-V797 HydrophobicContact CD2-CG1 4.36Å; L774-L798 HydrophobicContact CB-CD1 4.4Å; L774-L798 HydrophobicContact CB-CD2 3.85Å; L774-L798 HydrophobicContact CB-CG 4.1Å; L774-L798 HydrophobicContact CD1-CD2 4.4Å; L774-M801 HydrophobicContact CD1-SD 3.94Å
775	M	92.4	Very high	90.3	Very high	17 Å²	17	43.6 Å²	43.6	8%	0.084	25%	0.247	C	C	.	.	H	α-helix	trans	-74.6	-38.2	173.4	-67.2	-67.4	-169.5	0	0	111.8	L771 S772 K778 S779 L798 Y816 D820 F821	L771-M775 HydrophobicContact CD1-CE 4.12Å; L771-M775 WeakPolarHBondContact O-CG 3.3Å; L771-M775 PolarHBondContact O-N 3.14Å; L771-M775 VanDerWaalsContact O-N 3.17Å; S772-M775 CarbonylContact O-C 3.58Å; S772-M775 WeakPolarHBondContact O-CA 3.31Å; S772-M775 WeakPolarHBondContact O-CB 3.47Å; S772-M775 PolarHBondContact O-N 2.91Å; M775-K778 WeakPolarHBondContact O-CB 3.26Å; M775-K778 PolarHBondContact O-N 2.95Å; M775-K778 HydrophobicContact SD-CD 4.5Å; M775-S779 PolarHBondContact O-N 3.17Å; M775-S779 VanDerWaalsContact O-N 3.14Å; M775-S779 PolarHBondContact O-OG 3.19Å; M775-L798 HydrophobicContact CE-CD1 4.23Å; M775-L798 HydrophobicContact CE-CD2 3.89Å; M775-L798 HydrophobicContact CG-CD1 4.5Å; M775-L798 HydrophobicContact CG-CD2 4.47Å; M775-L798 HydrophobicContact SD-CD1 3.64Å; M775-L798 HydrophobicContact SD-CD2 4.17Å; M775-Y816 HydrophobicContact CB-CE1 4.38Å; M775-Y816 HydrophobicContact CE-CD1 3.86Å; M775-Y816 HydrophobicContact CE-CE1 4.19Å; M775-Y816 HydrophobicContact CE-CG 4.22Å; M775-Y816 HydrophobicContact CG-CD1 4.37Å; M775-Y816 HydrophobicContact CG-CE1 3.74Å; M775-Y816 HydrophobicContact SD-CE1 4.44Å; M775-D820 HydrophobicContact CE-CB 3.57Å; M775-D820 HydrophobicContact SD-CB 4.18Å; M775-F821 HydrophobicContact CE-CD1 3.97Å; M775-F821 HydrophobicContact CE-CD2 4.49Å; M775-F821 HydrophobicContact CE-CE1 3.61Å; M775-F821 HydrophobicContact CE-CE2 4.15Å; M775-F821 HydrophobicContact CE-CG 4.39Å; M775-F821 HydrophobicContact CE-CZ 3.69Å
776	D	89.9	Confident	90.1	Very high	65 Å²	65	48 Å²	48	35%	0.348	27%	0.274	S	S	.	.	H	α-helix	trans	-60.6	-48.5	171.3	-53.9	-29.7	0	0	0	109.4	S772 K778 S779 L780	S772-D776 PolarHBondContact O-N 3.39Å; D776-K778 PolarHBondContact O-N 2.86Å; D776-S779 CarbonylContact O-C 3.59Å; D776-S779 WeakPolarHBondContact O-CA 3.25Å; D776-S779 WeakPolarHBondContact O-CB 3.45Å; D776-S779 PolarHBondContact O-N 3.16Å; D776-L780 PolarHBondContact O-N 2.84Å
777	M	90.3	Very high	89.9	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.4	-31.8	176.4	-176.8	175.4	158.5	0	0	113.8	L731 P732 L744 C748 R773 S779 L780 A790 A794	L731-M777 HydrophobicContact CD2-SD 3.97Å; P732-M777 HydrophobicContact CG-CB 4.43Å; L744-M777 HydrophobicContact CB-CE 3.73Å; L744-M777 HydrophobicContact CB-SD 4.42Å; L744-M777 HydrophobicContact CD2-SD 4.18Å; C748-M777 HydrophobicContact CB-CE 4.25Å; C748-M777 WeakPolarHBondContact SG-CE 3Å; R773-M777 WeakPolarHBondContact O-CB 3.34Å; R773-M777 PolarHBondContact O-N 3.06Å; M777-S779 PolarHBondContact O-N 2.99Å; M777-L780 HydrophobicContact CB-CD1 4.46Å; M777-L780 HydrophobicContact CG-CD1 4.3Å; M777-A790 HydrophobicContact CE-CB 4Å; M777-A790 WeakPolarHBondContact CE-O 3.33Å; M777-A794 HydrophobicContact CB-CB 4.27Å; M777-A794 HydrophobicContact CE-CB 4.16Å; M777-A794 HydrophobicContact CG-CB 3.98Å; M777-A794 HydrophobicContact SD-CB 4.29Å
778	K	90.9	Very high	89.8	Confident	33 Å²	33	47.2 Å²	47.2	14%	0.143	28%	0.275	C	S	.	.	H	α-helix	trans	-60.1	-34.1	167.8	177.1	-178.5	-177.5	-173.5	0	110.8	L774 M775 D776 S791 R795 L798 D820 D823	L774-K778 WeakPolarHBondContact O-CB 3.24Å; L774-K778 PolarHBondContact O-N 2.81Å; M775-K778 WeakPolarHBondContact O-CB 3.26Å; M775-K778 PolarHBondContact O-N 2.95Å; M775-K778 HydrophobicContact SD-CD 4.5Å; D776-K778 PolarHBondContact O-N 2.86Å; K778-S791 WeakPolarHBondContact O-CB 3.44Å; K778-S791 PolarHBondContact O-OG 2.72Å; K778-R795 HydrophobicContact CD-CG 3.96Å; K778-R795 HydrophobicContact CG-CG 3.75Å; K778-L798 HydrophobicContact CB-CD1 4.25Å; K778-L798 HydrophobicContact CD-CD1 4.16Å; K778-D820 PolarHBondContact NZ-O 2.88Å; K778-D823 IonicContact NZ-OD1 3.87Å
779	S	88.9	Confident	89.9	Confident	55 Å²	55	48.8 Å²	48.8	39%	0.385	28%	0.275	S	S	.	.	H	α-helix	trans	-87.4	-22.4	-172.7	-53.4	0	0	0	0	114.2	M775 D776 M777 V781 N782	M775-S779 PolarHBondContact O-N 3.17Å; M775-S779 VanDerWaalsContact O-N 3.14Å; M775-S779 PolarHBondContact O-OG 3.19Å; D776-S779 CarbonylContact O-C 3.59Å; D776-S779 WeakPolarHBondContact O-CA 3.25Å; D776-S779 WeakPolarHBondContact O-CB 3.45Å; D776-S779 PolarHBondContact O-N 3.16Å; M777-S779 PolarHBondContact O-N 2.99Å; S779-V781 PolarHBondContact O-N 3.32Å; S779-N782 VanDerWaalsContact O-CB 3.25Å; S779-N782 WeakPolarHBondContact O-CB 3.22Å; S779-N782 VanDerWaalsContact O-CG 3.29Å; S779-N782 PolarHBondContact O-N 3.46Å; S779-N782 PolarHBondContact O-ND2 3.35Å
780	L	84.9	Confident	90	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-49.9	-26.8	179.2	-76.4	175.9	0	0	0	115.7	P732 N735 V738 L744 D776 M777 N782 D783 N784 Y787	P732-L780 HydrophobicContact CG-CD1 4.04Å; N735-L780 WeakPolarHBondContact OD1-CD2 3.48Å; V738-L780 HydrophobicContact CG1-CD1 4.27Å; L744-L780 HydrophobicContact CD1-CD1 4.32Å; D776-L780 PolarHBondContact O-N 2.84Å; M777-L780 HydrophobicContact CB-CD1 4.46Å; M777-L780 HydrophobicContact CG-CD1 4.3Å; L780-N782 PolarHBondContact O-N 3.05Å; L780-D783 PolarHBondContact O-N 3.16Å; L780-N784 PolarHBondContact O-N 3.11Å; L780-Y787 HydrophobicContact CB-CD2 4.37Å; L780-Y787 HydrophobicContact CB-CG 4.27Å; L780-Y787 HydrophobicContact CD1-CG 4.48Å
781	V	86.6	Confident	90.1	Very high	24 Å²	24	46.3 Å²	46.3	15%	0.145	26%	0.257	C	S	.	.	H	α-helix	trans	-64.7	-23.8	176.5	66.1	0	0	0	0	112.9	S779 N784 L785 A788	S779-V781 PolarHBondContact O-N 3.32Å; V781-N784 CarbonylContact O-C 3.6Å; V781-L785 HydrophobicContact CG2-CD2 4.3Å; V781-A788 HydrophobicContact CG2-CB 3.88Å
782	N	84.9	Confident	90.1	Very high	131 Å²	131	51.3 Å²	51.3	70%	0.701	28%	0.276	S	S	*	.	H	α-helix	trans	-73	-35.2	175.1	-55.4	-18.8	0	0	0	111.2	S779 L780	S779-N782 VanDerWaalsContact O-CB 3.25Å; S779-N782 WeakPolarHBondContact O-CB 3.22Å; S779-N782 VanDerWaalsContact O-CG 3.29Å; S779-N782 PolarHBondContact O-N 3.46Å; S779-N782 PolarHBondContact O-ND2 3.35Å; L780-N782 PolarHBondContact O-N 3.05Å
783	D	82.3	Confident	90.2	Very high	110 Å²	110	50.7 Å²	50.7	59%	0.588	27%	0.272	S	S	*	.	H	α-helix	trans	-78.8	-39.3	177.9	-59.4	-29.9	0	0	0	111.2	N735 L780	N735-D783 PolarHBondContact ND2-OD2 3.05Å; L780-D783 PolarHBondContact O-N 3.16Å
784	N	84.8	Confident	90.3	Very high	76 Å²	76	49.5 Å²	49.5	41%	0.406	27%	0.267	S	S	.	.			trans	-155.4	120.6	178.5	-176	-12.7	0	0	0	112.4	L780 V781 V786 Y787	L780-N784 PolarHBondContact O-N 3.11Å; V781-N784 CarbonylContact O-C 3.6Å; N784-V786 PolarHBondContact O-N 2.86Å; N784-V786 VanDerWaalsContact OD1-CB 3.31Å; N784-V786 WeakPolarHBondContact OD1-CB 3.36Å; N784-V786 VanDerWaalsContact OD1-CG2 3.3Å; N784-V786 WeakPolarHBondContact OD1-CG2 3.38Å; N784-V786 PolarHBondContact OD1-N 3.47Å; N784-Y787 HydrophobicContact CB-CD2 4.05Å; N784-Y787 HydrophobicContact CB-CE2 4.33Å; N784-Y787 PolarHBondContact O-N 2.76Å
785	L	89.4	Confident	90.4	Very high	141 Å²	141	53.2 Å²	53.2	74%	0.738	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-57.6	-21.8	179.3	-64.4	176.8	0	0	0	114.5	V781 Y787 A788	V781-L785 HydrophobicContact CG2-CD2 4.3Å; L785-Y787 PolarHBondContact O-N 3.4Å; L785-Y787 VanDerWaalsContact O-N 3.16Å; L785-A788 VanDerWaalsContact O-CB 3.22Å; L785-A788 WeakPolarHBondContact O-CB 3.43Å; L785-A788 PolarHBondContact O-N 3.09Å
786	V	89.2	Confident	90.5	Very high	97 Å²	97	55.9 Å²	55.9	59%	0.588	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-58.3	-25	174.1	172.9	0	0	0	0	112	P741 N784	P741-V786 HydrophobicContact CG-CG1 3.65Å; N784-V786 PolarHBondContact O-N 2.86Å; N784-V786 VanDerWaalsContact OD1-CB 3.31Å; N784-V786 WeakPolarHBondContact OD1-CB 3.36Å; N784-V786 VanDerWaalsContact OD1-CG2 3.3Å; N784-V786 WeakPolarHBondContact OD1-CG2 3.38Å; N784-V786 PolarHBondContact OD1-N 3.47Å
787	Y	90.4	Very high	90.8	Very high	42 Å²	42	52.8 Å²	52.8	17%	0.165	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-89	13.3	175	-62.4	-70.8	0	0	0	114.4	V738 P741 L744 L780 N784 L785 D789 A790 S791	V738-Y787 HydrophobicContact CG1-CE1 3.89Å; P741-Y787 HydrophobicContact CB-CD1 4.2Å; P741-Y787 HydrophobicContact CB-CE1 4.47Å; P741-Y787 HydrophobicContact CG-CD1 3.92Å; P741-Y787 HydrophobicContact CG-CE1 3.82Å; L744-Y787 HydrophobicContact CD1-CD1 3.78Å; L744-Y787 HydrophobicContact CD1-CE1 3.79Å; L780-Y787 HydrophobicContact CB-CD2 4.37Å; L780-Y787 HydrophobicContact CB-CG 4.27Å; L780-Y787 HydrophobicContact CD1-CG 4.48Å; N784-Y787 HydrophobicContact CB-CD2 4.05Å; N784-Y787 HydrophobicContact CB-CE2 4.33Å; N784-Y787 PolarHBondContact O-N 2.76Å; L785-Y787 PolarHBondContact O-N 3.4Å; L785-Y787 VanDerWaalsContact O-N 3.16Å; Y787-D789 PolarHBondContact O-N 3.01Å; Y787-A790 HydrophobicContact CD1-CB 4.31Å; Y787-A790 WeakPolarHBondContact O-CB 3.38Å; Y787-A790 PolarHBondContact O-N 2.8Å; Y787-A790 VanDerWaalsContact O-N 3.14Å; Y787-S791 PolarHBondContact O-N 2.81Å
788	A	92.8	Very high	91.1	Very high	38 Å²	38	52.8 Å²	52.8	31%	0.314	28%	0.282	S	S	.	.	H	α-helix	trans	-57.2	-44	-177.7	0	0	0	0	0	114.1	V781 L785 R792	V781-A788 HydrophobicContact CG2-CB 3.88Å; L785-A788 VanDerWaalsContact O-CB 3.22Å; L785-A788 WeakPolarHBondContact O-CB 3.43Å; L785-A788 PolarHBondContact O-N 3.09Å; A788-R792 WeakPolarHBondContact O-CB 3.44Å; A788-R792 PolarHBondContact O-N 2.74Å
789	D	92.9	Very high	91.3	Very high	72 Å²	72	58.8 Å²	58.8	39%	0.385	30%	0.304	S	S	.	.	H	α-helix	trans	-74.1	-29.3	177.7	-73.7	-18.6	0	0	0	112.5	V745 Y787 R792 S793	V745-D789 HydrophobicContact CG2-CB 4.15Å; Y787-D789 PolarHBondContact O-N 3.01Å; D789-R792 IonicContact OD1-CZ 2.66Å; D789-R792 IonicContact OD1-NE 2.78Å; D789-R792 IonicContact OD1-NH1 3.31Å; D789-R792 IonicContact OD1-NH2 2.77Å; D789-R792 PolarHBondContact OD1-NH2 2.97Å; D789-S793 WeakPolarHBondContact O-CB 3.42Å; D789-S793 PolarHBondContact O-N 2.81Å; D789-S793 PolarHBondContact O-OG 2.95Å
790	A	93.5	Very high	91.5	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-66.7	-49.5	172.8	0	0	0	0	0	110.7	L744 V745 M777 Y787 R792 S793 A794	L744-A790 HydrophobicContact CB-CB 3.89Å; L744-A790 HydrophobicContact CD1-CB 4.21Å; V745-A790 HydrophobicContact CG2-CB 4.33Å; M777-A790 HydrophobicContact CE-CB 4Å; M777-A790 WeakPolarHBondContact CE-O 3.33Å; Y787-A790 HydrophobicContact CD1-CB 4.31Å; Y787-A790 WeakPolarHBondContact O-CB 3.38Å; Y787-A790 PolarHBondContact O-N 2.8Å; Y787-A790 VanDerWaalsContact O-N 3.14Å; A790-R792 PolarHBondContact O-N 2.76Å; A790-S793 WeakPolarHBondContact O-CB 3.41Å; A790-S793 PolarHBondContact O-N 3.2Å; A790-S793 VanDerWaalsContact O-N 3.16Å; A790-A794 PolarHBondContact O-N 3.21Å
791	S	93.9	Very high	92	Very high	2 Å²	2	58.1 Å²	58.1	1%	0.014	30%	0.296	C	S	.	.	H	α-helix	trans	-56	-48.5	171.5	171.3	0	0	0	0	111.4	K778 Y787 S793 A794 R795	K778-S791 WeakPolarHBondContact O-CB 3.44Å; K778-S791 PolarHBondContact O-OG 2.72Å; Y787-S791 PolarHBondContact O-N 2.81Å; S791-S793 VanDerWaalsContact C-N 3.26Å; S791-S793 PolarHBondContact O-N 2.79Å; S791-A794 PolarHBondContact O-N 2.88Å; S791-A794 VanDerWaalsContact O-N 3.14Å; S791-R795 WeakPolarHBondContact O-CG 3.42Å; S791-R795 PolarHBondContact O-N 2.75Å; S791-R795 PolarHBondContact OG-NE 3.32Å
792	R	94.1	Very high	92.4	Very high	105 Å²	105	58.9 Å²	58.9	40%	0.396	30%	0.296	S	S	.	.	H	α-helix	trans	-57.1	-39.9	177.1	-162.1	-168.6	-52.8	167.3	10.6	111.9	R308 A788 D789 A790 R795 V796	R308-R792 PolarHBondContact O-NH1 3.33Å; A788-R792 WeakPolarHBondContact O-CB 3.44Å; A788-R792 PolarHBondContact O-N 2.74Å; D789-R792 IonicContact OD1-CZ 2.66Å; D789-R792 IonicContact OD1-NE 2.78Å; D789-R792 IonicContact OD1-NH1 3.31Å; D789-R792 IonicContact OD1-NH2 2.77Å; D789-R792 PolarHBondContact OD1-NH2 2.97Å; A790-R792 PolarHBondContact O-N 2.76Å; R792-R795 PolarHBondContact O-N 3.5Å; R792-V796 PolarHBondContact O-N 3.19Å
793	S	95.4	Very high	92.8	Very high	28 Å²	28	57.5 Å²	57.5	20%	0.196	29%	0.289	C	S	.	.	H	α-helix	trans	-67.5	-41.8	177.2	-57.8	0	0	0	0	112.3	D789 A790 S791 R795 V796 V797	D789-S793 WeakPolarHBondContact O-CB 3.42Å; D789-S793 PolarHBondContact O-N 2.81Å; D789-S793 PolarHBondContact O-OG 2.95Å; A790-S793 WeakPolarHBondContact O-CB 3.41Å; A790-S793 PolarHBondContact O-N 3.2Å; A790-S793 VanDerWaalsContact O-N 3.16Å; S791-S793 VanDerWaalsContact C-N 3.26Å; S791-S793 PolarHBondContact O-N 2.79Å; S793-R795 VanDerWaalsContact C-N 3.34Å; S793-R795 PolarHBondContact O-N 3.1Å; S793-V796 PolarHBondContact O-N 3.45Å; S793-V797 PolarHBondContact O-N 3.05Å
794	A	95.5	Very high	93.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.4	-40.4	174.2	0	0	0	0	0	112.1	L774 M777 A790 S791 V796 V797 L798	L774-A794 HydrophobicContact CD2-CB 4.16Å; M777-A794 HydrophobicContact CB-CB 4.27Å; M777-A794 HydrophobicContact CE-CB 4.16Å; M777-A794 HydrophobicContact CG-CB 3.98Å; M777-A794 HydrophobicContact SD-CB 4.29Å; A790-A794 PolarHBondContact O-N 3.21Å; S791-A794 PolarHBondContact O-N 2.88Å; S791-A794 VanDerWaalsContact O-N 3.14Å; A794-V796 VanDerWaalsContact C-N 3.3Å; A794-V796 PolarHBondContact O-N 2.97Å; A794-V797 PolarHBondContact O-N 3.01Å; A794-L798 WeakPolarHBondContact O-CB 3.36Å; A794-L798 WeakPolarHBondContact O-CG 3.45Å; A794-L798 PolarHBondContact O-N 3.1Å
795	R	94.6	Very high	93.9	Very high	78 Å²	78	62.1 Å²	62.1	29%	0.294	29%	0.293	S	S	.	.	H	α-helix	trans	-59.9	-37.1	175.3	-65.1	179.6	-159.2	-156.5	1	112.9	K778 S791 R792 S793 L798 R799 D823	K778-R795 HydrophobicContact CD-CG 3.96Å; K778-R795 HydrophobicContact CG-CG 3.75Å; S791-R795 WeakPolarHBondContact O-CG 3.42Å; S791-R795 PolarHBondContact O-N 2.75Å; S791-R795 PolarHBondContact OG-NE 3.32Å; R792-R795 PolarHBondContact O-N 3.5Å; S793-R795 VanDerWaalsContact C-N 3.34Å; S793-R795 PolarHBondContact O-N 3.1Å; R795-L798 PolarHBondContact O-N 3.38Å; R795-R799 VanDerWaalsContact O-CB 3.32Å; R795-R799 WeakPolarHBondContact O-CB 3.01Å; R795-R799 PolarHBondContact O-N 2.79Å; R795-D823 WeakPolarHBondContact CD-OD2 3.42Å; R795-D823 IonicContact CZ-OD1 3.16Å; R795-D823 IonicContact CZ-OD2 3.65Å; R795-D823 IonicContact NE-OD2 2.8Å; R795-D823 VanDerWaalsContact NH1-CG 3.27Å; R795-D823 IonicContact NH1-OD1 2.72Å; R795-D823 PolarHBondContact NH1-OD1 2.91Å; R795-D823 IonicContact NH1-OD2 3.14Å; R795-D823 PolarHBondContact NH1-OD2 2.99Å
796	V	95.1	Very high	94.2	Very high	72 Å²	72	63.2 Å²	63.2	44%	0.436	29%	0.292	S	S	.	.	H	α-helix	trans	-65.6	-44.3	176	175.1	0	0	0	0	111.1	R792 S793 A794 R799 N800	R792-V796 PolarHBondContact O-N 3.19Å; S793-V796 PolarHBondContact O-N 3.45Å; A794-V796 VanDerWaalsContact C-N 3.3Å; A794-V796 PolarHBondContact O-N 2.97Å; V796-R799 PolarHBondContact O-N 2.86Å; V796-N800 WeakPolarHBondContact O-CB 3.5Å; V796-N800 PolarHBondContact O-N 3.21Å
797	V	96.4	Very high	94.5	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.5	-49.4	174.6	-176.5	0	0	0	0	110.5	C748 L751 N752 V755 L774 S793 A794 R799 N800 M801	C748-V797 HydrophobicContact CB-CG2 3.96Å; C748-V797 VanDerWaalsContact O-CG2 3.29Å; C748-V797 WeakPolarHBondContact O-CG2 3.39Å; L751-V797 HydrophobicContact CB-CG1 4.17Å; L751-V797 HydrophobicContact CB-CG2 4.35Å; N752-V797 HydrophobicContact CB-CG2 4.01Å; V755-V797 HydrophobicContact CG2-CG1 4.49Å; L774-V797 HydrophobicContact CD1-CB 4.37Å; L774-V797 HydrophobicContact CD1-CG1 3.69Å; L774-V797 HydrophobicContact CD2-CB 4.34Å; L774-V797 HydrophobicContact CD2-CG1 4.36Å; S793-V797 PolarHBondContact O-N 3.05Å; A794-V797 PolarHBondContact O-N 3.01Å; V797-R799 PolarHBondContact O-N 3.47Å; V797-N800 PolarHBondContact O-N 3.49Å; V797-M801 HydrophobicContact CG1-CG 4.44Å; V797-M801 HydrophobicContact CG1-SD 4.02Å; V797-M801 WeakPolarHBondContact O-CG 3.45Å; V797-M801 PolarHBondContact O-N 3.21Å
798	L	96.3	Very high	94.6	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.1	-45.1	179.8	-72.2	169.8	0	0	0	112.4	L771 L774 M775 K778 A794 R795 N800 M801 Y802 F821	L771-L798 HydrophobicContact CD1-CD2 3.75Å; L774-L798 HydrophobicContact CB-CD1 4.4Å; L774-L798 HydrophobicContact CB-CD2 3.85Å; L774-L798 HydrophobicContact CB-CG 4.1Å; L774-L798 HydrophobicContact CD1-CD2 4.4Å; M775-L798 HydrophobicContact CE-CD1 4.23Å; M775-L798 HydrophobicContact CE-CD2 3.89Å; M775-L798 HydrophobicContact CG-CD1 4.5Å; M775-L798 HydrophobicContact CG-CD2 4.47Å; M775-L798 HydrophobicContact SD-CD1 3.64Å; M775-L798 HydrophobicContact SD-CD2 4.17Å; K778-L798 HydrophobicContact CB-CD1 4.25Å; K778-L798 HydrophobicContact CD-CD1 4.16Å; A794-L798 WeakPolarHBondContact O-CB 3.36Å; A794-L798 WeakPolarHBondContact O-CG 3.45Å; A794-L798 PolarHBondContact O-N 3.1Å; R795-L798 PolarHBondContact O-N 3.38Å; L798-N800 VanDerWaalsContact C-N 3.34Å; L798-N800 PolarHBondContact O-N 3.16Å; L798-M801 PolarHBondContact O-N 3.46Å; L798-Y802 WeakPolarHBondContact O-CB 3.34Å; L798-Y802 PolarHBondContact O-N 3.45Å; L798-F821 HydrophobicContact CB-CD1 4.08Å; L798-F821 HydrophobicContact CD2-CD1 4.18Å; L798-F821 HydrophobicContact CD2-CE1 4.14Å; L798-F821 WeakPolarHBondContact O-CD1 3.43Å
799	R	94.8	Very high	94.7	Very high	160 Å²	160	65.6 Å²	65.6	60%	0.604	28%	0.283	S	S	*	.	H	α-helix	trans	-60.1	-43.2	175.1	-179.8	176.6	173.1	174	-2.3	111.6	R795 V796 V797 Y802 N803	R795-R799 VanDerWaalsContact O-CB 3.32Å; R795-R799 WeakPolarHBondContact O-CB 3.01Å; R795-R799 PolarHBondContact O-N 2.79Å; V796-R799 PolarHBondContact O-N 2.86Å; V797-R799 PolarHBondContact O-N 3.47Å; R799-Y802 PolarHBondContact O-N 3.41Å; R799-N803 PolarHBondContact O-N 3.48Å; R799-N803 VanDerWaalsContact O-N 3.16Å; R799-N803 PolarHBondContact O-OD1 2.94Å
800	N	94.3	Very high	94.7	Very high	45 Å²	45	63.4 Å²	63.4	24%	0.241	27%	0.271	C	S	.	.	H	α-helix	trans	-69.9	-35.2	178.9	-75.1	-20.2	0	0	0	112.7	N752 V755 V796 V797 L798 Y802 N803	N752-N800 PolarHBondContact OD1-ND2 2.99Å; V755-N800 HydrophobicContact CG1-CB 4.19Å; V796-N800 WeakPolarHBondContact O-CB 3.5Å; V796-N800 PolarHBondContact O-N 3.21Å; V797-N800 PolarHBondContact O-N 3.49Å; L798-N800 VanDerWaalsContact C-N 3.34Å; L798-N800 PolarHBondContact O-N 3.16Å; N800-Y802 VanDerWaalsContact C-N 3.32Å; N800-N803 PolarHBondContact O-N 3.47Å; N800-N803 PolarHBondContact OD1-ND2 3.2Å
801	M	95.5	Very high	94.8	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.2	-39	167.8	-69	173	65.4	0	0	111.7	V755 L765 T766 L771 L774 V797 L798 N803 Y804 F811	V755-M801 HydrophobicContact CG1-CG 3.84Å; V755-M801 HydrophobicContact CG2-CG 4Å; L765-M801 HydrophobicContact CB-CE 3.72Å; L765-M801 HydrophobicContact CB-SD 4.36Å; L765-M801 HydrophobicContact CD1-SD 4.41Å; T766-M801 WeakPolarHBondContact OG1-CE 3.24Å; L771-M801 HydrophobicContact CD1-CE 4.48Å; L774-M801 HydrophobicContact CD1-SD 3.94Å; V797-M801 HydrophobicContact CG1-CG 4.44Å; V797-M801 HydrophobicContact CG1-SD 4.02Å; V797-M801 WeakPolarHBondContact O-CG 3.45Å; V797-M801 PolarHBondContact O-N 3.21Å; L798-M801 PolarHBondContact O-N 3.46Å; M801-N803 VanDerWaalsContact C-N 3.32Å; M801-N803 PolarHBondContact O-N 2.97Å; M801-Y804 PolarHBondContact O-N 3.29Å; M801-F811 HydrophobicContact CB-CZ 4.32Å
802	Y	94.5	Very high	94.8	Very high	40 Å²	40	71.6 Å²	71.6	16%	0.157	30%	0.302	C	S	.	.	H	α-helix	trans	-69.7	-24.4	-179	-169.6	-97.7	0	0	0	114.3	L798 R799 N800 Y804 H808 F811 R818 F821	L798-Y802 WeakPolarHBondContact O-CB 3.34Å; L798-Y802 PolarHBondContact O-N 3.45Å; R799-Y802 PolarHBondContact O-N 3.41Å; N800-Y802 VanDerWaalsContact C-N 3.32Å; Y802-Y804 PolarHBondContact O-N 2.98Å; Y802-H808 AromaticContact CD1-NE2 3.98Å; Y802-H808 AromaticContact CD2-NE2 3.75Å; Y802-H808 AromaticContact CE1-CE1 3.74Å; Y802-H808 AromaticContact CE1-NE2 3.8Å; Y802-H808 AromaticContact CE2-CD2 3.99Å; Y802-H808 AromaticContact CE2-CE1 3.81Å; Y802-H808 AromaticContact CE2-NE2 3.57Å; Y802-H808 AromaticContact CG-NE2 3.94Å; Y802-H808 AromaticContact CZ-CE1 3.43Å; Y802-H808 VanDerWaalsContact CZ-CE1 3.43Å; Y802-H808 AromaticContact CZ-NE2 3.59Å; Y802-H808 PolarHBondContact O-NE2 3.26Å; Y802-F811 AromaticContact CD2-CD2 3.91Å; Y802-F811 HydrophobicContact CD2-CD2 3.91Å; Y802-F811 AromaticContact CD2-CE2 3.95Å; Y802-F811 HydrophobicContact CD2-CE2 3.95Å; Y802-F811 HydrophobicContact CE2-CD2 4.32Å; Y802-R818 HydrophobicContact CE1-CG 4.08Å; Y802-R818 WeakPolarHBondContact OH-CB 3.37Å; Y802-F821 HydrophobicContact CD1-CB 4.41Å; Y802-F821 HydrophobicContact CD2-CB 3.74Å; Y802-F821 HydrophobicContact CD2-CD1 4.18Å; Y802-F821 AromaticContact CD2-CD2 3.37Å; Y802-F821 HydrophobicContact CD2-CD2 3.37Å; Y802-F821 AromaticContact CD2-CE2 4Å; Y802-F821 HydrophobicContact CD2-CE2 4Å; Y802-F821 AromaticContact CD2-CG 3.5Å; Y802-F821 HydrophobicContact CD2-CG 3.5Å; Y802-F821 AromaticContact CE2-CD2 3.83Å; Y802-F821 HydrophobicContact CE2-CD2 3.83Å; Y802-F821 HydrophobicContact CE2-CE2 4.37Å; Y802-F821 HydrophobicContact CE2-CG 4.37Å; Y802-F821 HydrophobicContact CG-CB 3.63Å; Y802-F821 HydrophobicContact CG-CD1 4.49Å; Y802-F821 HydrophobicContact CG-CD2 4.18Å; Y802-F821 AromaticContact CG-CG 3.87Å; Y802-F821 HydrophobicContact CG-CG 3.87Å
803	N	93.7	Very high	94.8	Very high	102 Å²	102	75.6 Å²	75.6	55%	0.545	32%	0.317	S	S	.	.	H	α-helix	trans	-58.7	-28.5	173.1	-66.8	-27.7	0	0	0	112.2	R799 N800 M801 R805	R799-N803 PolarHBondContact O-N 3.48Å; R799-N803 VanDerWaalsContact O-N 3.16Å; R799-N803 PolarHBondContact O-OD1 2.94Å; N800-N803 PolarHBondContact O-N 3.47Å; N800-N803 PolarHBondContact OD1-ND2 3.2Å; M801-N803 VanDerWaalsContact C-N 3.32Å; M801-N803 PolarHBondContact O-N 2.97Å; N803-R805 PolarHBondContact O-N 3.21Å
804	Y	95.1	Very high	94.7	Very high	63 Å²	63	78.3 Å²	78.3	25%	0.247	33%	0.325	C	S	.	.			trans	-75.3	87	175	-65.8	-64.6	0	0	0	111.9	V755 F759 A762 M801 Y802 K806 L807	V755-Y804 HydrophobicContact CG1-CE2 4.22Å; V755-Y804 PolarHBondContact O-OH 3.42Å; F759-Y804 HydrophobicContact CB-CD1 4.46Å; F759-Y804 HydrophobicContact CB-CE1 4.13Å; F759-Y804 AromaticContact CD2-CD1 3.68Å; F759-Y804 HydrophobicContact CD2-CD1 3.68Å; F759-Y804 HydrophobicContact CD2-CD2 4.47Å; F759-Y804 HydrophobicContact CD2-CE1 4.19Å; F759-Y804 AromaticContact CD2-CG 3.84Å; F759-Y804 HydrophobicContact CD2-CG 3.84Å; F759-Y804 HydrophobicContact CE2-CG 4.43Å; A762-Y804 HydrophobicContact CB-CD2 3.65Å; A762-Y804 HydrophobicContact CB-CE2 3.68Å; M801-Y804 PolarHBondContact O-N 3.29Å; Y802-Y804 PolarHBondContact O-N 2.98Å; Y804-K806 PolarHBondContact O-N 3.49Å; Y804-L807 HydrophobicContact CD2-CD1 4.35Å; Y804-L807 HydrophobicContact CG-CD1 4.48Å; Y804-L807 WeakPolarHBondContact O-CB 3.49Å; Y804-L807 PolarHBondContact O-N 2.97Å
805	R	94.1	Very high	94.6	Very high	219 Å²	219	81.2 Å²	81.2	83%	0.826	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-44.6	-34.8	176.6	-61.8	-177.1	-176.4	179.2	1.1	114.2	N803 L807 H808	N803-R805 PolarHBondContact O-N 3.21Å; R805-L807 PolarHBondContact O-N 3.03Å; R805-H808 WeakPolarHBondContact O-CB 3.47Å; R805-H808 PolarHBondContact O-N 3.02Å; R805-H808 VanDerWaalsContact O-N 3.14Å
806	K	95.4	Very high	94.5	Very high	165 Å²	165	80.1 Å²	80.1	72%	0.717	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-56.3	-29.9	176.2	-68.5	-179.3	178.8	178.8	0	113.5	F759 Y804	F759-K806 HydrophobicContact CE1-CD 4.18Å; F759-K806 HydrophobicContact CE2-CB 3.71Å; F759-K806 HydrophobicContact CE2-CD 4Å; F759-K806 HydrophobicContact CE2-CG 4.42Å; F759-K806 HydrophobicContact CZ-CB 3.74Å; F759-K806 HydrophobicContact CZ-CD 3.72Å; F759-K806 HydrophobicContact CZ-CG 4.37Å; Y804-K806 PolarHBondContact O-N 3.49Å
807	L	95.4	Very high	94.3	Very high	1 Å²	1	81.4 Å²	81.4	1%	0.005	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-82.5	-13.9	-178.6	-56.2	-179.7	0	0	0	113.3	F759 A762 K763 T766 Y804 R805 R809 I810 F811	F759-L807 HydrophobicContact CE2-CD2 3.74Å; F759-L807 HydrophobicContact CE2-CG 3.95Å; F759-L807 HydrophobicContact CZ-CD2 4.03Å; A762-L807 HydrophobicContact CB-CD1 3.98Å; K763-L807 HydrophobicContact CB-CD2 3.93Å; K763-L807 HydrophobicContact CG-CD2 4.11Å; T766-L807 HydrophobicContact CG2-CB 4.5Å; Y804-L807 HydrophobicContact CD2-CD1 4.35Å; Y804-L807 HydrophobicContact CG-CD1 4.48Å; Y804-L807 WeakPolarHBondContact O-CB 3.49Å; Y804-L807 PolarHBondContact O-N 2.97Å; R805-L807 PolarHBondContact O-N 3.03Å; L807-R809 PolarHBondContact O-N 3.1Å; L807-R809 VanDerWaalsContact O-N 3.16Å; L807-I810 HydrophobicContact CD2-CD1 4.21Å; L807-I810 WeakPolarHBondContact O-CA 3.5Å; L807-I810 WeakPolarHBondContact O-CB 3.41Å; L807-I810 PolarHBondContact O-N 3.39Å; L807-F811 HydrophobicContact CB-CD2 4.25Å; L807-F811 HydrophobicContact CB-CE1 4.17Å; L807-F811 HydrophobicContact CB-CE2 3.55Å; L807-F811 HydrophobicContact CB-CZ 3.51Å; L807-F811 HydrophobicContact CD1-CZ 3.97Å; L807-F811 HydrophobicContact CG-CZ 4.38Å; L807-F811 PolarHBondContact O-N 3.35Å
808	H	94.5	Very high	93.9	Very high	37 Å²	37	89.7 Å²	89.7	17%	0.171	38%	0.384	C	S	.	.	H	α-helix	trans	-60.8	-29.9	-174	-71.4	-159.7	0	0	0	113.8	Y802 R805 I810 F811 R812	Y802-H808 AromaticContact CD1-NE2 3.98Å; Y802-H808 AromaticContact CD2-NE2 3.75Å; Y802-H808 AromaticContact CE1-CE1 3.74Å; Y802-H808 AromaticContact CE1-NE2 3.8Å; Y802-H808 AromaticContact CE2-CD2 3.99Å; Y802-H808 AromaticContact CE2-CE1 3.81Å; Y802-H808 AromaticContact CE2-NE2 3.57Å; Y802-H808 AromaticContact CG-NE2 3.94Å; Y802-H808 AromaticContact CZ-CE1 3.43Å; Y802-H808 VanDerWaalsContact CZ-CE1 3.43Å; Y802-H808 AromaticContact CZ-NE2 3.59Å; Y802-H808 PolarHBondContact O-NE2 3.26Å; R805-H808 WeakPolarHBondContact O-CB 3.47Å; R805-H808 PolarHBondContact O-N 3.02Å; R805-H808 VanDerWaalsContact O-N 3.14Å; H808-I810 VanDerWaalsContact C-N 3.3Å; H808-F811 AromaticContact CD2-CD2 3.93Å; H808-F811 AromaticContact CD2-CE2 3.97Å; H808-R812 PolarHBondContact O-N 3.27Å
809	R	93.9	Very high	93.6	Very high	188 Å²	188	97.9 Å²	97.9	71%	0.709	42%	0.415	S	S	*	.	H	α-helix	trans	-69.6	-27.4	173.3	-170.9	177.6	-177.6	-167.6	1.4	112.4	L807 R813	L807-R809 PolarHBondContact O-N 3.1Å; L807-R809 VanDerWaalsContact O-N 3.16Å; R809-R813 WeakPolarHBondContact O-CB 3.46Å; R809-R813 PolarHBondContact O-N 3.12Å
810	I	93.3	Very high	93.3	Very high	27 Å²	27	92.3 Å²	92.3	14%	0.138	40%	0.398	C	S	.	.	H	α-helix	trans	-84	-42.7	178.7	-44.7	177.5	0	0	0	110	T766 E767 L807 H808 R812 R813 K814	T766-I810 HydrophobicContact CG2-CB 3.84Å; T766-I810 HydrophobicContact CG2-CD1 4.43Å; T766-I810 HydrophobicContact CG2-CG2 3.74Å; E767-I810 HydrophobicContact CG-CD1 4.08Å; E767-I810 HydrophobicContact CG-CG2 4.47Å; L807-I810 HydrophobicContact CD2-CD1 4.21Å; L807-I810 WeakPolarHBondContact O-CA 3.5Å; L807-I810 WeakPolarHBondContact O-CB 3.41Å; L807-I810 PolarHBondContact O-N 3.39Å; H808-I810 VanDerWaalsContact C-N 3.3Å; I810-R812 PolarHBondContact O-N 3.35Å; I810-R813 WeakPolarHBondContact O-CB 3.47Å; I810-R813 PolarHBondContact O-N 3.39Å; I810-R813 VanDerWaalsContact O-N 3.1Å; I810-K814 PolarHBondContact O-N 2.99Å
811	F	95	Very high	93	Very high	3 Å²	3	90.4 Å²	90.4	1%	0.013	39%	0.387	C	S	.	.	H	α-helix	trans	-54.5	-51.5	173.4	-59.1	-38.1	0	0	0	111.6	T766 L771 M801 Y802 L807 H808 R813 K814 G815 Y816 F821	T766-F811 HydrophobicContact CG2-CD1 3.68Å; T766-F811 HydrophobicContact CG2-CE1 3.42Å; T766-F811 VanDerWaalsContact CG2-CE1 3.42Å; T766-F811 HydrophobicContact CG2-CZ 4.32Å; T766-F811 WeakPolarHBondContact OG1-CE1 3.45Å; L771-F811 HydrophobicContact CD1-CE1 4.4Å; L771-F811 HydrophobicContact CD2-CD1 3.83Å; L771-F811 HydrophobicContact CD2-CE1 4.17Å; M801-F811 HydrophobicContact CB-CZ 4.32Å; Y802-F811 AromaticContact CD2-CD2 3.91Å; Y802-F811 HydrophobicContact CD2-CD2 3.91Å; Y802-F811 AromaticContact CD2-CE2 3.95Å; Y802-F811 HydrophobicContact CD2-CE2 3.95Å; Y802-F811 HydrophobicContact CE2-CD2 4.32Å; L807-F811 HydrophobicContact CB-CD2 4.25Å; L807-F811 HydrophobicContact CB-CE1 4.17Å; L807-F811 HydrophobicContact CB-CE2 3.55Å; L807-F811 HydrophobicContact CB-CZ 3.51Å; L807-F811 HydrophobicContact CD1-CZ 3.97Å; L807-F811 HydrophobicContact CG-CZ 4.38Å; L807-F811 PolarHBondContact O-N 3.35Å; H808-F811 AromaticContact CD2-CD2 3.93Å; H808-F811 AromaticContact CD2-CE2 3.97Å; F811-R813 VanDerWaalsContact C-N 3.3Å; F811-R813 PolarHBondContact O-N 3.48Å; F811-K814 CarbonylContact O-C 3.45Å; F811-K814 WeakPolarHBondContact O-CA 3.42Å; F811-K814 PolarHBondContact O-N 3.5Å; F811-G815 PolarHBondContact O-N 2.86Å; F811-Y816 CarbonylContact C-O 3.58Å; F811-Y816 PolarHBondContact O-N 3.41Å; F811-F821 HydrophobicContact CB-CE2 4.06Å; F811-F821 HydrophobicContact CB-CZ 3.93Å; F811-F821 AromaticContact CD1-CE1 3.94Å; F811-F821 HydrophobicContact CD1-CE1 3.94Å; F811-F821 HydrophobicContact CD1-CE2 4.38Å; F811-F821 AromaticContact CD1-CZ 3.48Å; F811-F821 HydrophobicContact CD1-CZ 3.48Å; F811-F821 VanDerWaalsContact CD1-CZ 3.48Å; F811-F821 HydrophobicContact CD2-CE1 4.43Å; F811-F821 HydrophobicContact CD2-CE2 4.18Å; F811-F821 AromaticContact CD2-CZ 3.95Å; F811-F821 HydrophobicContact CD2-CZ 3.95Å; F811-F821 AromaticContact CE1-CE1 3.85Å; F811-F821 HydrophobicContact CE1-CE1 3.85Å; F811-F821 AromaticContact CE1-CZ 3.91Å; F811-F821 HydrophobicContact CE1-CZ 3.91Å; F811-F821 HydrophobicContact CE2-CE1 4.39Å; F811-F821 HydrophobicContact CE2-CZ 4.36Å; F811-F821 HydrophobicContact CG-CE1 4.24Å; F811-F821 AromaticContact CG-CE2 3.97Å; F811-F821 HydrophobicContact CG-CE2 3.97Å; F811-F821 AromaticContact CG-CZ 3.52Å; F811-F821 HydrophobicContact CG-CZ 3.52Å; F811-F821 HydrophobicContact CZ-CE1 4.1Å; F811-F821 HydrophobicContact CZ-CZ 4.34Å
812	R	94	Very high	92.3	Very high	170 Å²	170	92.1 Å²	92.1	64%	0.642	40%	0.398	S	S	*	.	H	α-helix	trans	-61.1	-34.5	176	-71	-166.6	-66.8	-94.1	8.1	113.3	H808 I810 K814 G815	H808-R812 PolarHBondContact O-N 3.27Å; I810-R812 PolarHBondContact O-N 3.35Å; R812-K814 VanDerWaalsContact C-N 3.31Å; R812-K814 PolarHBondContact O-N 3.1Å; R812-G815 PolarHBondContact O-N 3.36Å
813	R	94.1	Very high	90.8	Very high	190 Å²	190	94.6 Å²	94.6	72%	0.717	42%	0.415	S	S	*	.	H	α-helix	trans	-68.2	-30.6	175.3	-167	-167.7	-60.5	177.3	0.2	112.3	R809 I810 F811 G815	R809-R813 WeakPolarHBondContact O-CB 3.46Å; R809-R813 PolarHBondContact O-N 3.12Å; I810-R813 WeakPolarHBondContact O-CB 3.47Å; I810-R813 PolarHBondContact O-N 3.39Å; I810-R813 VanDerWaalsContact O-N 3.1Å; F811-R813 VanDerWaalsContact C-N 3.3Å; F811-R813 PolarHBondContact O-N 3.48Å; R813-G815 VanDerWaalsContact C-N 3.29Å
814	K	92.7	Very high	88.2	Confident	84 Å²	84	99.7 Å²	99.7	37%	0.365	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	9	173.3	-74	-169.8	167.7	-176.4	0	113.6	T766 E767 G768 L771 I810 F811 R812 Y816	T766-K814 WeakPolarHBondContact O-CE 3.43Å; T766-K814 PolarHBondContact O-NZ 3.28Å; E767-K814 VanDerWaalsContact C-NZ 3.33Å; E767-K814 PolarHBondContact O-NZ 2.85Å; G768-K814 PolarHBondContact O-NZ 3.25Å; L771-K814 HydrophobicContact CD2-CD 4.06Å; I810-K814 PolarHBondContact O-N 2.99Å; F811-K814 CarbonylContact O-C 3.45Å; F811-K814 WeakPolarHBondContact O-CA 3.42Å; F811-K814 PolarHBondContact O-N 3.5Å; R812-K814 VanDerWaalsContact C-N 3.31Å; R812-K814 PolarHBondContact O-N 3.1Å; K814-Y816 HydrophobicContact CB-CD2 3.77Å; K814-Y816 HydrophobicContact CB-CE2 3.87Å
815	G	93.1	Very high	87.8	Confident	62 Å²	62	101.5 Å²	101.5	64%	0.639	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	5.9	176.5	0	0	0	0	0	115.8	F811 R812 R813	F811-G815 PolarHBondContact O-N 2.86Å; R812-G815 PolarHBondContact O-N 3.36Å; R813-G815 VanDerWaalsContact C-N 3.29Å
816	Y	93.4	Very high	87.5	Confident	54 Å²	54	95.3 Å²	95.3	21%	0.212	44%	0.439	C	S	.	.			trans	-95	140.1	-177.1	-58	-70.7	0	0	0	113.3	L771 M775 F811 K814 D820 F821	L771-Y816 HydrophobicContact CD2-CD2 3.67Å; L771-Y816 HydrophobicContact CD2-CE2 3.64Å; L771-Y816 HydrophobicContact CG-CD2 4.19Å; L771-Y816 HydrophobicContact CG-CE2 3.81Å; M775-Y816 HydrophobicContact CB-CE1 4.38Å; M775-Y816 HydrophobicContact CE-CD1 3.86Å; M775-Y816 HydrophobicContact CE-CE1 4.19Å; M775-Y816 HydrophobicContact CE-CG 4.22Å; M775-Y816 HydrophobicContact CG-CD1 4.37Å; M775-Y816 HydrophobicContact CG-CE1 3.74Å; M775-Y816 HydrophobicContact SD-CE1 4.44Å; F811-Y816 CarbonylContact C-O 3.58Å; F811-Y816 PolarHBondContact O-N 3.41Å; K814-Y816 HydrophobicContact CB-CD2 3.77Å; K814-Y816 HydrophobicContact CB-CE2 3.87Å; Y816-D820 WeakPolarHBondContact CA-OD2 3.24Å; Y816-D820 HydrophobicContact CD1-CB 4.38Å; Y816-F821 HydrophobicContact CG-CZ 4.37Å
817	E	90.8	Very high	87.1	Confident	99 Å²	99	91.4 Å²	91.4	46%	0.463	42%	0.424	S	S	.	.			trans	-115.4	172.4	-177.3	-64.6	-175	154.2	0	0	112.1	R819 D820 F821	E817-R819 HydrophobicContact CB-CG 4.12Å; E817-R819 PolarHBondContact O-N 3.02Å; E817-R819 IonicContact OE2-CZ 2.7Å; E817-R819 IonicContact OE2-NE 3.06Å; E817-R819 PolarHBondContact OE2-NE 3.44Å; E817-R819 IonicContact OE2-NH2 3.28Å; E817-R819 PolarHBondContact OE2-NH2 3.28Å; E817-D820 PolarHBondContact N-OD2 2.8Å; E817-D820 WeakPolarHBondContact O-CB 3.38Å; E817-D820 PolarHBondContact O-N 3.22Å; E817-F821 VanDerWaalsContact O-CD2 3.22Å; E817-F821 WeakPolarHBondContact O-CD2 3.49Å
818	R	88.5	Confident	86.6	Confident	175 Å²	175	96.8 Å²	96.8	66%	0.66	45%	0.449	S	S	*	.	H	α-helix	trans	-56.1	-36	-177.5	-177.5	173.2	171.9	-169.3	-4.7	113.5	Y802 D820 F821 C822	Y802-R818 HydrophobicContact CE1-CG 4.08Å; Y802-R818 WeakPolarHBondContact OH-CB 3.37Å; R818-D820 PolarHBondContact O-N 3.01Å; R818-F821 PolarHBondContact O-N 3.28Å; R818-C822 PolarHBondContact O-N 3.04Å
819	R	88.8	Confident	86.1	Confident	172 Å²	172	100.5 Å²	100.5	65%	0.649	47%	0.466	S	S	*	.	H	α-helix	trans	-62.5	-20.9	178	53.7	173.3	162.7	156	-2.5	114.3	E817	E817-R819 HydrophobicContact CB-CG 4.12Å; E817-R819 PolarHBondContact O-N 3.02Å; E817-R819 IonicContact OE2-CZ 2.7Å; E817-R819 IonicContact OE2-NE 3.06Å; E817-R819 PolarHBondContact OE2-NE 3.44Å; E817-R819 IonicContact OE2-NH2 3.28Å; E817-R819 PolarHBondContact OE2-NH2 3.28Å
820	D	88.6	Confident	85.6	Confident	43 Å²	43	94.7 Å²	94.7	23%	0.23	45%	0.45	C	S	.	.	H	α-helix	trans	-79.9	-27.5	-179.1	-52	-37.3	0	0	0	111.2	M775 K778 Y816 E817 R818	M775-D820 HydrophobicContact CE-CB 3.57Å; M775-D820 HydrophobicContact SD-CB 4.18Å; K778-D820 PolarHBondContact NZ-O 2.88Å; Y816-D820 WeakPolarHBondContact CA-OD2 3.24Å; Y816-D820 HydrophobicContact CD1-CB 4.38Å; E817-D820 PolarHBondContact N-OD2 2.8Å; E817-D820 WeakPolarHBondContact O-CB 3.38Å; E817-D820 PolarHBondContact O-N 3.22Å; R818-D820 PolarHBondContact O-N 3.01Å
821	F	89.1	Confident	85	Confident	5 Å²	5	99.5 Å²	99.5	2%	0.022	47%	0.472	C	S	.	.	H	α-helix	trans	-104.2	-17.8	-178.8	-52.2	-90.8	0	0	0	114.4	L771 M775 L798 Y802 F811 Y816 E817 R818	L771-F821 HydrophobicContact CD1-CE1 3.73Å; L771-F821 HydrophobicContact CD1-CZ 4.12Å; M775-F821 HydrophobicContact CE-CD1 3.97Å; M775-F821 HydrophobicContact CE-CD2 4.49Å; M775-F821 HydrophobicContact CE-CE1 3.61Å; M775-F821 HydrophobicContact CE-CE2 4.15Å; M775-F821 HydrophobicContact CE-CG 4.39Å; M775-F821 HydrophobicContact CE-CZ 3.69Å; L798-F821 HydrophobicContact CB-CD1 4.08Å; L798-F821 HydrophobicContact CD2-CD1 4.18Å; L798-F821 HydrophobicContact CD2-CE1 4.14Å; L798-F821 WeakPolarHBondContact O-CD1 3.43Å; Y802-F821 HydrophobicContact CD1-CB 4.41Å; Y802-F821 HydrophobicContact CD2-CB 3.74Å; Y802-F821 HydrophobicContact CD2-CD1 4.18Å; Y802-F821 AromaticContact CD2-CD2 3.37Å; Y802-F821 HydrophobicContact CD2-CD2 3.37Å; Y802-F821 AromaticContact CD2-CE2 4Å; Y802-F821 HydrophobicContact CD2-CE2 4Å; Y802-F821 AromaticContact CD2-CG 3.5Å; Y802-F821 HydrophobicContact CD2-CG 3.5Å; Y802-F821 AromaticContact CE2-CD2 3.83Å; Y802-F821 HydrophobicContact CE2-CD2 3.83Å; Y802-F821 HydrophobicContact CE2-CE2 4.37Å; Y802-F821 HydrophobicContact CE2-CG 4.37Å; Y802-F821 HydrophobicContact CG-CB 3.63Å; Y802-F821 HydrophobicContact CG-CD1 4.49Å; Y802-F821 HydrophobicContact CG-CD2 4.18Å; Y802-F821 AromaticContact CG-CG 3.87Å; Y802-F821 HydrophobicContact CG-CG 3.87Å; F811-F821 HydrophobicContact CB-CE2 4.06Å; F811-F821 HydrophobicContact CB-CZ 3.93Å; F811-F821 AromaticContact CD1-CE1 3.94Å; F811-F821 HydrophobicContact CD1-CE1 3.94Å; F811-F821 HydrophobicContact CD1-CE2 4.38Å; F811-F821 AromaticContact CD1-CZ 3.48Å; F811-F821 HydrophobicContact CD1-CZ 3.48Å; F811-F821 VanDerWaalsContact CD1-CZ 3.48Å; F811-F821 HydrophobicContact CD2-CE1 4.43Å; F811-F821 HydrophobicContact CD2-CE2 4.18Å; F811-F821 AromaticContact CD2-CZ 3.95Å; F811-F821 HydrophobicContact CD2-CZ 3.95Å; F811-F821 AromaticContact CE1-CE1 3.85Å; F811-F821 HydrophobicContact CE1-CE1 3.85Å; F811-F821 AromaticContact CE1-CZ 3.91Å; F811-F821 HydrophobicContact CE1-CZ 3.91Å; F811-F821 HydrophobicContact CE2-CE1 4.39Å; F811-F821 HydrophobicContact CE2-CZ 4.36Å; F811-F821 HydrophobicContact CG-CE1 4.24Å; F811-F821 AromaticContact CG-CE2 3.97Å; F811-F821 HydrophobicContact CG-CE2 3.97Å; F811-F821 AromaticContact CG-CZ 3.52Å; F811-F821 HydrophobicContact CG-CZ 3.52Å; F811-F821 HydrophobicContact CZ-CE1 4.1Å; F811-F821 HydrophobicContact CZ-CZ 4.34Å; Y816-F821 HydrophobicContact CG-CZ 4.37Å; E817-F821 VanDerWaalsContact O-CD2 3.22Å; E817-F821 WeakPolarHBondContact O-CD2 3.49Å; R818-F821 PolarHBondContact O-N 3.28Å
822	C	79.4	Confident	84.3	Confident	35 Å²	35	106.9 Å²	106.9	24%	0.236	51%	0.507	C	S	.	.	S	Bend	trans	-121.2	114.9	177.5	-64.3	0	0	0	0	109.3	R818	R818-C822 PolarHBondContact O-N 3.04Å
823	D	63.8	Low	83.5	Confident	93 Å²	93	101.7 Å²	101.7	50%	0.497	50%	0.496	S	S	.	.			trans	-62	147.4	161	-64.9	-12.9	0	0	0	109.1	K778 R795	K778-D823 IonicContact NZ-OD1 3.87Å; R795-D823 WeakPolarHBondContact CD-OD2 3.42Å; R795-D823 IonicContact CZ-OD1 3.16Å; R795-D823 IonicContact CZ-OD2 3.65Å; R795-D823 IonicContact NE-OD2 2.8Å; R795-D823 VanDerWaalsContact NH1-CG 3.27Å; R795-D823 IonicContact NH1-OD1 2.72Å; R795-D823 PolarHBondContact NH1-OD1 2.91Å; R795-D823 IonicContact NH1-OD2 3.14Å; R795-D823 PolarHBondContact NH1-OD2 2.99Å
824	V	39.1	Very low	82.5	Confident	208 Å²	208	93.6 Å²	93.6	100%	1.261	48%	0.476	S	S	*	.			trans	-101.6	0	176.2	179.1	0	0	0	0	108.8

Retrieved 824 of 824 residues in 367.3 ms (Link to these results)

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