A0A5K4EDG4_SCHMA Loading...

Putative cyclin l

AlphaFold DB , UniProt , Accession A0A5K4EDG4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 680 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.3	Very low	39.5	Very low	250 Å²	250	149.2 Å²	149.2	100%	1.232	88%	0.876	S	S	*	*				0	137.1	0	-73.2	172.2	166.9	0	0	107.7
2	A	35.4	Very low	39.3	Very low	106 Å²	106	151 Å²	151	88%	0.876	87%	0.869	S	S	*	*			trans	-93.4	150.2	-179.7	0	0	0	0	0	111.4
3	A	40.5	Very low	39.7	Very low	101 Å²	101	148.5 Å²	148.5	84%	0.835	86%	0.862	S	S	*	*			trans	-144.3	133.2	164.3	0	0	0	0	0	107.2
4	E	38.5	Very low	40.4	Very low	196 Å²	196	148.5 Å²	148.5	92%	0.916	86%	0.857	S	S	*	*			trans	-85.8	137.7	-158.4	-63	165.9	116.3	0	0	114	G6	E4-G6 PolarHBondContact O-N 3.1Å; E4-G6 VanDerWaalsContact O-N 3.1Å
5	S	41.6	Very low	41.3	Very low	121 Å²	121	145.4 Å²	145.4	85%	0.846	85%	0.847	S	S	*	*			trans	-85	69.4	178	42.1	0	0	0	0	112.5	S7	S5-S7 PolarHBondContact O-N 2.96Å
6	G	40.3	Very low	42.1	Very low	75 Å²	75	140.8 Å²	140.8	77%	0.773	82%	0.822	S	S	*	*			trans	-67.1	90.5	177.8	0	0	0	0	0	114.2	E4 R8	E4-G6 PolarHBondContact O-N 3.1Å; E4-G6 VanDerWaalsContact O-N 3.1Å; G6-R8 PolarHBondContact O-N 3.22Å; G6-R8 VanDerWaalsContact O-N 3.12Å
7	S	40.3	Very low	42.7	Very low	121 Å²	121	144.6 Å²	144.6	85%	0.846	82%	0.819	S	S	*	*			trans	-77	90.9	-177.6	48.2	0	0	0	0	113.6	S5 S9	S5-S7 PolarHBondContact O-N 2.96Å; S7-S9 PolarHBondContact O-N 3.12Å
8	R	39.7	Very low	43.5	Very low	237 Å²	237	144.4 Å²	144.4	89%	0.894	81%	0.811	S	S	*	*			trans	-72.7	108.5	168.7	-83.8	-174	170.6	177.6	-1.7	111.5	G6 V10	G6-R8 PolarHBondContact O-N 3.22Å; G6-R8 VanDerWaalsContact O-N 3.12Å; R8-V10 PolarHBondContact O-N 3.29Å
9	S	38.8	Very low	43.9	Very low	116 Å²	116	143.7 Å²	143.7	81%	0.811	80%	0.795	S	S	*	*			trans	-60.7	119.4	166.1	-179.6	0	0	0	0	110.7	S7	S7-S9 PolarHBondContact O-N 3.12Å
10	V	40.5	Very low	44.7	Very low	129 Å²	129	142.3 Å²	142.3	78%	0.782	79%	0.794	S	S	*	*			trans	-90.5	101.6	173	179.7	0	0	0	0	108	R8 Q12	R8-V10 PolarHBondContact O-N 3.29Å; V10-Q12 PolarHBondContact O-N 3.41Å
11	K	42.4	Very low	45.3	Very low	189 Å²	189	138.7 Å²	138.7	82%	0.822	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-58.3	132.2	164.2	-71.6	-169.5	173.8	-168.6	0	108.7
12	Q	37.7	Very low	46.1	Very low	171 Å²	171	130.8 Å²	130.8	80%	0.799	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-66.8	148.2	166.4	-68.1	-166.9	-0	0	0	109.4	V10 D14	V10-Q12 PolarHBondContact O-N 3.41Å; Q12-D14 PolarHBondContact O-N 3.36Å
13	P	44.2	Very low	47.2	Very low	119 Å²	119	128.4 Å²	128.4	77%	0.773	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-73.5	125.1	177.7	29.5	-33.1	0	0	0	110.3	S15	P13-S15 PolarHBondContact O-N 2.86Å; P13-S15 VanDerWaalsContact O-N 3.09Å
14	D	48.7	Very low	47.8	Very low	148 Å²	148	128.7 Å²	128.7	79%	0.791	71%	0.714	S	S	*	*			trans	-59.9	112.7	173.2	-61.4	-57.4	0	0	0	109.7	Q12 T16	Q12-D14 PolarHBondContact O-N 3.36Å; D14-T16 PolarHBondContact O-N 3.46Å
15	S	54.9	Low	48.7	Very low	102 Å²	102	121.8 Å²	121.8	71%	0.713	69%	0.686	S	S	*	*			trans	-84	7.1	-175.9	59.1	0	0	0	0	113.6	P13 W17	P13-S15 PolarHBondContact O-N 2.86Å; P13-S15 VanDerWaalsContact O-N 3.09Å; S15-W17 PolarHBondContact O-N 3.12Å
16	T	53.2	Low	49.4	Very low	72 Å²	72	123 Å²	123	44%	0.442	68%	0.681	S	S	.	*			trans	-86	93.1	-178.1	49	0	0	0	0	111.4	D14 E18 N23	D14-T16 PolarHBondContact O-N 3.46Å; T16-E18 PolarHBondContact O-N 3.02Å; T16-E18 VanDerWaalsContact O-N 3.17Å; T16-N23 WeakPolarHBondContact CG2-ND2 3.3Å
17	W	53.4	Low	50.2	Low	205 Å²	205	126 Å²	126	78%	0.777	67%	0.674	S	S	*	*			trans	-79.9	93.7	171.5	-68.8	81.5	0	0	0	110	S15 L24	S15-W17 PolarHBondContact O-N 3.12Å; W17-L24 PolarHBondContact O-N 2.87Å
18	E	55.9	Low	51.2	Low	142 Å²	142	124.1 Å²	124.1	66%	0.664	66%	0.655	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.6	125.4	167.7	-65	-164.1	158.9	0	0	111	T16 V22 N23	T16-E18 PolarHBondContact O-N 3.02Å; T16-E18 VanDerWaalsContact O-N 3.17Å; E18-V22 WeakPolarHBondContact CA-O 3.32Å; E18-N23 HydrophobicContact CG-CB 4.35Å
19	Y	52.8	Low	52.8	Low	131 Å²	131	114.3 Å²	114.3	51%	0.514	62%	0.62	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-123.8	114.7	171.8	-174.9	-94.8	0	0	0	109.3	G21 V22 L24 Y592	Y19-G21 PolarHBondContact O-N 3.09Å; Y19-V22 PolarHBondContact N-O 3.09Å; Y19-V22 WeakPolarHBondContact O-CB 3.4Å; Y19-V22 PolarHBondContact O-N 3.14Å; Y19-L24 HydrophobicContact CG-CD1 4.5Å; Y19-Y592 PolarHBondContact OH-OH 3.34Å
20	C	59	Low	55	Low	115 Å²	115	111.2 Å²	111.2	78%	0.777	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	51.3	39.8	-175.1	-60	0	0	0	0	113.8	V22	C20-V22 VanDerWaalsContact C-N 3.29Å; C20-V22 PolarHBondContact O-N 3.3Å
21	G	56.4	Low	57	Low	67 Å²	67	106.1 Å²	106.1	69%	0.691	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	76.8	7.4	-177	0	0	0	0	0	115	Y19	Y19-G21 PolarHBondContact O-N 3.09Å
22	V	54.7	Low	58.9	Low	83 Å²	83	100 Å²	100	50%	0.503	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	116.1	173.4	-174.9	0	0	0	0	109.2	E18 Y19 C20 L24	E18-V22 WeakPolarHBondContact CA-O 3.32Å; Y19-V22 PolarHBondContact N-O 3.09Å; Y19-V22 WeakPolarHBondContact O-CB 3.4Å; Y19-V22 PolarHBondContact O-N 3.14Å; C20-V22 VanDerWaalsContact C-N 3.29Å; C20-V22 PolarHBondContact O-N 3.3Å; V22-L24 HydrophobicContact CG1-CD2 3.91Å; V22-L24 HydrophobicContact CG1-CG 4.44Å; V22-L24 PolarHBondContact O-N 2.88Å
23	N	57.7	Low	61.1	Low	57 Å²	57	99.9 Å²	99.9	31%	0.305	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	104.9	176.4	-167.8	-19.8	0	0	0	110.3	T16 E18 T25	T16-N23 WeakPolarHBondContact CG2-ND2 3.3Å; E18-N23 HydrophobicContact CG-CB 4.35Å; N23-T25 PolarHBondContact O-N 3.31Å; N23-T25 VanDerWaalsContact O-N 3.16Å; N23-T25 WeakPolarHBondContact OD1-CG2 3.22Å
24	L	53.6	Low	62.9	Low	106 Å²	106	102.3 Å²	102.3	56%	0.555	54%	0.542	S	S	*	.			trans	-89.5	64.8	-172.6	-67.9	176.9	0	0	0	112.1	W17 Y19 V22	W17-L24 PolarHBondContact O-N 2.87Å; Y19-L24 HydrophobicContact CG-CD1 4.5Å; V22-L24 HydrophobicContact CG1-CD2 3.91Å; V22-L24 HydrophobicContact CG1-CG 4.44Å; V22-L24 PolarHBondContact O-N 2.88Å
25	T	57.2	Low	64.5	Low	52 Å²	52	103.2 Å²	103.2	32%	0.319	53%	0.534	S	S	.	.			trans	-76.6	139.6	171.1	71.5	0	0	0	0	111.3	N23 H27 N28	N23-T25 PolarHBondContact O-N 3.31Å; N23-T25 VanDerWaalsContact O-N 3.16Å; N23-T25 WeakPolarHBondContact OD1-CG2 3.22Å; T25-H27 PolarHBondContact O-N 3.39Å; T25-H27 VanDerWaalsContact O-N 3.13Å; T25-N28 WeakPolarHBondContact O-CB 3.34Å; T25-N28 PolarHBondContact O-N 3.16Å; T25-N28 PolarHBondContact OG1-N 3.43Å
26	I	57.2	Low	66	Low	146 Å²	146	99.9 Å²	99.9	75%	0.749	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-18.5	170	-58.2	173	0	0	0	110.8
27	H	56.6	Low	67.7	Low	138 Å²	138	103.5 Å²	103.5	64%	0.639	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	1.3	-178.1	-56.5	-86.2	0	0	0	114	T25 I29	T25-H27 PolarHBondContact O-N 3.39Å; T25-H27 VanDerWaalsContact O-N 3.13Å; H27-I29 PolarHBondContact O-N 3.49Å
28	N	60.2	Low	69.4	Low	82 Å²	82	96.9 Å²	96.9	44%	0.439	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	54.6	179.2	-153.4	-24.9	0	0	0	112.4	T25 R85	T25-N28 WeakPolarHBondContact O-CB 3.34Å; T25-N28 PolarHBondContact O-N 3.16Å; T25-N28 PolarHBondContact OG1-N 3.43Å; N28-R85 PolarHBondContact O-NH2 2.94Å; N28-R85 VanDerWaalsContact O-NH2 3.14Å
29	I	74.9	Confident	71.2	Confident	31 Å²	31	90.2 Å²	90.2	16%	0.159	47%	0.471	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-43.7	178.6	-58	178.3	0	0	0	109.8	H27 R85	H27-I29 PolarHBondContact O-N 3.49Å; I29-R85 PolarHBondContact O-NE 2.87Å
30	I	83.5	Confident	73.2	Confident	51 Å²	51	85.7 Å²	85.7	26%	0.262	46%	0.458	S	S	.	.	S	Bend	trans	-68.1	145.6	174.7	-69.1	171.3	0	0	0	110.2	V210 R211 L213	I30-V210 WeakPolarHBondContact CA-O 3.19Å; I30-R211 WeakPolarHBondContact CG2-O 3.5Å; I30-L213 HydrophobicContact CD1-CD2 3.65Å; I30-L213 HydrophobicContact CD1-CG 3.72Å
31	I	83.6	Confident	74.9	Confident	21 Å²	21	80.2 Å²	80.2	11%	0.108	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-95	125.4	176.8	-63	-177.1	0	0	0	108.2	R35 L36 Y88 V210	I31-R35 HydrophobicContact CG2-CB 3.7Å; I31-L36 HydrophobicContact CB-CD2 4.11Å; I31-L36 HydrophobicContact CG2-CD2 3.94Å; I31-Y88 HydrophobicContact CD1-CD2 4.14Å; I31-Y88 HydrophobicContact CD1-CG 3.86Å; I31-V210 HydrophobicContact CD1-CB 3.88Å; I31-V210 HydrophobicContact CD1-CG1 4.31Å; I31-V210 HydrophobicContact CD1-CG2 4.11Å; I31-V210 HydrophobicContact CG1-CB 4.09Å; I31-V210 PolarHBondContact N-O 2.99Å
32	P	82.2	Confident	76.7	Confident	61 Å²	61	78.9 Å²	78.9	40%	0.396	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-54.6	143.6	175.9	-26.6	34.6	0	0	0	112.1	E34 R35	P32-E34 PolarHBondContact O-N 3.17Å; P32-R35 WeakPolarHBondContact O-CB 3.43Å; P32-R35 PolarHBondContact O-N 3.49Å
33	E	82.7	Confident	78.6	Confident	169 Å²	169	80.7 Å²	80.7	79%	0.79	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-58	-36.6	-172.5	-61	-177.4	164.2	0	0	112.7	R35 L36	E33-R35 PolarHBondContact O-N 3.34Å; E33-L36 HydrophobicContact CG-CD1 4.45Å; E33-L36 WeakPolarHBondContact O-CB 3.47Å; E33-L36 PolarHBondContact O-N 3.1Å
34	E	83	Confident	80.3	Confident	169 Å²	169	78.9 Å²	78.9	79%	0.79	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-49.6	-22.1	169.9	-58.4	172.3	-176.7	0	0	115	P32	P32-E34 PolarHBondContact O-N 3.17Å
35	R	83.2	Confident	82.2	Confident	167 Å²	167	82.5 Å²	82.5	63%	0.63	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-109.2	-2.4	-178.9	-60.4	-175.6	-176.6	-179	2.5	113.4	I31 P32 E33	I31-R35 HydrophobicContact CG2-CB 3.7Å; P32-R35 WeakPolarHBondContact O-CB 3.43Å; P32-R35 PolarHBondContact O-N 3.49Å; E33-R35 PolarHBondContact O-N 3.34Å
36	L	85.9	Confident	83.9	Confident	33 Å²	33	80.3 Å²	80.3	17%	0.173	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-32.2	170.9	-59.9	179.2	0	0	0	110.9	I31 E33 T39 Y88 V210 R211	I31-L36 HydrophobicContact CB-CD2 4.11Å; I31-L36 HydrophobicContact CG2-CD2 3.94Å; E33-L36 HydrophobicContact CG-CD1 4.45Å; E33-L36 WeakPolarHBondContact O-CB 3.47Å; E33-L36 PolarHBondContact O-N 3.1Å; L36-T39 WeakPolarHBondContact O-CG2 3.35Å; L36-Y88 HydrophobicContact CD2-CD1 4.08Å; L36-Y88 HydrophobicContact CD2-CE1 3.86Å; L36-V210 HydrophobicContact CD2-CG2 4.38Å; L36-R211 HydrophobicContact CD1-CG 3.92Å; L36-R211 HydrophobicContact CD2-CG 4.39Å
37	F	87.4	Confident	85.7	Confident	147 Å²	147	79.2 Å²	79.2	65%	0.645	38%	0.382	S	S	*	.	S	Bend	trans	-148	132.1	176.4	-178.5	-97.4	0	0	0	111.8
38	P	90.4	Very high	87.5	Confident	66 Å²	66	78.5 Å²	78.5	43%	0.429	38%	0.375	S	S	.	.	S	Bend	cis	-76.4	139.5	-5.9	31.8	-34.7	0	0	0	112	Q42 L43	P38-Q42 HydrophobicContact CB-CB 4.48Å; P38-L43 HydrophobicContact CB-CD2 4.31Å; P38-L43 HydrophobicContact CB-CG 4.5Å; P38-L43 HydrophobicContact CG-CD2 4.06Å; P38-L43 HydrophobicContact CG-CG 4.47Å
39	T	93.6	Very high	89.1	Confident	3 Å²	3	78.5 Å²	78.5	2%	0.018	37%	0.372	C	S	.	.			trans	-68.7	157.6	176.5	76.2	0	0	0	0	111.4	L36 S41 Q42 L43 E51 Y88	L36-T39 WeakPolarHBondContact O-CG2 3.35Å; T39-S41 PolarHBondContact O-N 3.17Å; T39-S41 WeakPolarHBondContact OG1-CB 3.3Å; T39-S41 PolarHBondContact OG1-N 3.25Å; T39-Q42 PolarHBondContact O-N 3.16Å; T39-Q42 VanDerWaalsContact O-N 3.11Å; T39-Q42 WeakPolarHBondContact OG1-CG 3.45Å; T39-Q42 PolarHBondContact OG1-N 3.28Å; T39-L43 WeakPolarHBondContact O-CG 3.37Å; T39-L43 PolarHBondContact O-N 3.03Å; T39-L43 VanDerWaalsContact O-N 3.07Å; T39-E51 WeakPolarHBondContact CB-OE2 3.38Å; T39-E51 WeakPolarHBondContact CG2-OE2 3.33Å; T39-E51 PolarHBondContact OG1-OE1 3.36Å; T39-E51 PolarHBondContact OG1-OE2 2.75Å; T39-Y88 HydrophobicContact CG2-CD1 4.44Å; T39-Y88 HydrophobicContact CG2-CE1 4.26Å
40	P	94.5	Very high	90	Very high	36 Å²	36	77.7 Å²	77.7	23%	0.234	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-20.9	170	-26.9	37	0	0	0	114.2	D44 Y88 S91	P40-D44 PolarHBondContact O-N 3.46Å; P40-Y88 WeakPolarHBondContact CD-O 3.33Å; P40-Y88 VanDerWaalsContact CG-O 3.29Å; P40-Y88 WeakPolarHBondContact CG-O 3.38Å; P40-S91 WeakPolarHBondContact O-CB 3.43Å
41	S	94.7	Very high	90.6	Very high	0 Å²	0	75.4 Å²	75.4	0%	0	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-40.9	175.4	-53.4	0	0	0	0	112.4	T39 L43 D44 K45 M46 E51 F92	T39-S41 PolarHBondContact O-N 3.17Å; T39-S41 WeakPolarHBondContact OG1-CB 3.3Å; T39-S41 PolarHBondContact OG1-N 3.25Å; S41-L43 VanDerWaalsContact C-N 3.31Å; S41-D44 CarbonylContact O-C 3.41Å; S41-D44 WeakPolarHBondContact O-CA 3.31Å; S41-D44 WeakPolarHBondContact O-CB 3.23Å; S41-D44 PolarHBondContact O-N 2.96Å; S41-K45 PolarHBondContact O-N 2.84Å; S41-M46 WeakPolarHBondContact O-CB 3.4Å; S41-M46 PolarHBondContact O-N 3.26Å; S41-E51 VanDerWaalsContact CB-CD 3.42Å; S41-E51 WeakPolarHBondContact CB-OE1 3.38Å; S41-E51 WeakPolarHBondContact CB-OE2 3.48Å; S41-E51 PolarHBondContact OG-OE1 3.23Å; S41-F92 PolarHBondContact OG-N 3.45Å
42	Q	94.4	Very high	91.2	Very high	38 Å²	38	76.3 Å²	76.3	18%	0.178	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-64	-37.7	174	-71.2	171.6	-44.3	0	0	111	P38 T39 D44 K45	P38-Q42 HydrophobicContact CB-CB 4.48Å; T39-Q42 PolarHBondContact O-N 3.16Å; T39-Q42 VanDerWaalsContact O-N 3.11Å; T39-Q42 WeakPolarHBondContact OG1-CG 3.45Å; T39-Q42 PolarHBondContact OG1-N 3.28Å; Q42-D44 PolarHBondContact O-N 3.36Å; Q42-K45 WeakPolarHBondContact O-CA 3.44Å; Q42-K45 PolarHBondContact O-N 3.07Å
43	L	93.5	Very high	91.8	Very high	122 Å²	122	74.7 Å²	74.7	64%	0.639	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-62.6	-23.4	170.4	-64.3	177.7	0	0	0	113.4	P38 T39 S41 K45	P38-L43 HydrophobicContact CB-CD2 4.31Å; P38-L43 HydrophobicContact CB-CG 4.5Å; P38-L43 HydrophobicContact CG-CD2 4.06Å; P38-L43 HydrophobicContact CG-CG 4.47Å; T39-L43 WeakPolarHBondContact O-CG 3.37Å; T39-L43 PolarHBondContact O-N 3.03Å; T39-L43 VanDerWaalsContact O-N 3.07Å; S41-L43 VanDerWaalsContact C-N 3.31Å; L43-K45 VanDerWaalsContact C-N 3.29Å
44	D	93.7	Very high	92.5	Very high	19 Å²	19	66.6 Å²	66.6	10%	0.102	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-90.4	15.5	170.5	-90	-14.4	0	0	0	113.3	P40 S41 Q42 M46 S91 V93 R94 Q282	P40-D44 PolarHBondContact O-N 3.46Å; S41-D44 CarbonylContact O-C 3.41Å; S41-D44 WeakPolarHBondContact O-CA 3.31Å; S41-D44 WeakPolarHBondContact O-CB 3.23Å; S41-D44 PolarHBondContact O-N 2.96Å; Q42-D44 PolarHBondContact O-N 3.36Å; D44-M46 VanDerWaalsContact C-N 3.33Å; D44-M46 PolarHBondContact O-N 2.88Å; D44-S91 WeakPolarHBondContact OD2-CB 3.14Å; D44-S91 PolarHBondContact OD2-OG 2.89Å; D44-V93 HydrophobicContact CB-CB 4.09Å; D44-V93 HydrophobicContact CB-CG2 3.93Å; D44-R94 IonicContact OD1-CZ 3.72Å; D44-R94 IonicContact OD1-NE 3.45Å; D44-R94 PolarHBondContact OD1-NE 2.86Å; D44-R94 VanDerWaalsContact OD1-NE 3.14Å; D44-R94 IonicContact OD1-NH2 2.75Å; D44-R94 PolarHBondContact OD1-NH2 3.49Å; D44-R94 WeakPolarHBondContact OD2-CD 3.39Å; D44-R94 VanDerWaalsContact OD2-CG 3.29Å; D44-R94 WeakPolarHBondContact OD2-CG 3.45Å; D44-R94 IonicContact OD2-CZ 3.37Å; D44-R94 IonicContact OD2-NE 3.49Å; D44-R94 PolarHBondContact OD2-NE 3.08Å; D44-R94 IonicContact OD2-NH2 2.67Å; D44-Q282 PolarHBondContact OD1-NE2 3.41Å; D44-Q282 PolarHBondContact OD2-NE2 3.34Å
45	K	93.2	Very high	93.2	Very high	182 Å²	182	59 Å²	59	79%	0.791	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	26.7	-179.8	-50.4	-173.1	179.1	-170.2	0	115.2	S41 Q42 L43 L278	S41-K45 PolarHBondContact O-N 2.84Å; Q42-K45 WeakPolarHBondContact O-CA 3.44Å; Q42-K45 PolarHBondContact O-N 3.07Å; L43-K45 VanDerWaalsContact C-N 3.29Å; K45-L278 WeakPolarHBondContact O-CD2 3.3Å
46	M	94	Very high	93.8	Very high	6 Å²	6	52 Å²	52	3%	0.03	25%	0.25	C	S	.	.			trans	-82.9	137.2	168.4	-160.5	163.1	76.4	0	0	110.8	S41 D44 T50 E51 L54 F92 V93 L275 L278	S41-M46 WeakPolarHBondContact O-CB 3.4Å; S41-M46 PolarHBondContact O-N 3.26Å; D44-M46 VanDerWaalsContact C-N 3.33Å; D44-M46 PolarHBondContact O-N 2.88Å; M46-T50 HydrophobicContact CG-CG2 3.73Å; M46-T50 HydrophobicContact SD-CG2 3.95Å; M46-E51 HydrophobicContact CE-CB 3.61Å; M46-E51 HydrophobicContact CE-CG 3.76Å; M46-L54 HydrophobicContact CE-CD1 3.69Å; M46-L54 HydrophobicContact SD-CD1 3.59Å; M46-L54 VanDerWaalsContact SD-CD1 3.59Å; M46-F92 HydrophobicContact CE-CB 3.7Å; M46-F92 HydrophobicContact CE-CD2 3.58Å; M46-F92 HydrophobicContact CE-CG 3.98Å; M46-F92 HydrophobicContact SD-CB 4.14Å; M46-V93 HydrophobicContact CB-CG2 4.32Å; M46-V93 HydrophobicContact SD-CG2 4.34Å; M46-L275 HydrophobicContact SD-CD2 3.76Å; M46-L278 HydrophobicContact CB-CD1 3.89Å; M46-L278 HydrophobicContact CG-CD1 3.65Å; M46-L278 HydrophobicContact SD-CD1 4.18Å
47	E	94.8	Very high	94.3	Very high	122 Å²	122	51 Å²	51	57%	0.57	25%	0.245	S	C	*	.			trans	-65.2	146.4	174.5	179.4	-167.5	-135.3	0	0	111.5	T50 E51	E47-T50 PolarHBondContact O-N 3.26Å; E47-T50 PolarHBondContact OE2-OG1 3.16Å; E47-E51 PolarHBondContact O-N 2.96Å
48	Y	93.4	Very high	94.7	Very high	124 Å²	124	44 Å²	44	49%	0.486	21%	0.214	S	C	.	.	H	α-helix	trans	-59	-46	179.8	-178.7	-116.1	0	0	0	113.4	E51 I52	Y48-E51 WeakPolarHBondContact O-CA 3.31Å; Y48-E51 WeakPolarHBondContact O-CB 3.33Å; Y48-E51 PolarHBondContact O-N 3.31Å; Y48-E51 VanDerWaalsContact O-N 3.1Å; Y48-I52 HydrophobicContact CD1-CD1 3.95Å; Y48-I52 HydrophobicContact CE1-CD1 3.53Å; Y48-I52 HydrophobicContact CE2-CD1 4.22Å; Y48-I52 HydrophobicContact CG-CD1 4.47Å; Y48-I52 PolarHBondContact O-N 3.3Å
49	E	94.2	Very high	95.1	Very high	81 Å²	81	40.8 Å²	40.8	38%	0.379	19%	0.194	S	C	.	.	H	α-helix	trans	-67.4	-42.6	179.5	-63.2	-56.4	144.9	0	0	111.9	E51 I52 D53 R263	E49-E51 PolarHBondContact O-N 2.81Å; E49-I52 PolarHBondContact O-N 3.21Å; E49-D53 PolarHBondContact O-N 3.16Å; E49-R263 PolarHBondContact O-NH2 3.35Å; E49-R263 VanDerWaalsContact O-NH2 3.09Å; E49-R263 IonicContact OE2-CZ 3.82Å; E49-R263 IonicContact OE2-NH1 3.74Å; E49-R263 PolarHBondContact OE2-NH1 3.4Å; E49-R263 IonicContact OE2-NH2 3.08Å; E49-R263 PolarHBondContact OE2-NH2 2.91Å
50	T	95.2	Very high	95.2	Very high	15 Å²	15	45 Å²	45	9%	0.092	21%	0.213	C	C	.	.	H	α-helix	trans	-56.3	-34.9	169.5	-68.6	0	0	0	0	112	M46 E47 L54 L271 V274	M46-T50 HydrophobicContact CG-CG2 3.73Å; M46-T50 HydrophobicContact SD-CG2 3.95Å; E47-T50 PolarHBondContact O-N 3.26Å; E47-T50 PolarHBondContact OE2-OG1 3.16Å; T50-L54 HydrophobicContact CG2-CD1 4.28Å; T50-L54 WeakPolarHBondContact O-CD1 3.48Å; T50-L54 WeakPolarHBondContact O-CG 3.45Å; T50-L54 PolarHBondContact O-N 3.13Å; T50-L271 HydrophobicContact CG2-CD1 4.06Å; T50-V274 HydrophobicContact CG2-CG1 4.09Å
51	E	95.7	Very high	95.3	Very high	3 Å²	3	43.7 Å²	43.7	1%	0.014	20%	0.204	C	C	.	.	H	α-helix	trans	-69.8	-45.3	174.7	-170.5	166.3	-166.4	0	0	113.2	T39 S41 M46 E47 Y48 E49 D53 L54 R55 F92	T39-E51 WeakPolarHBondContact CB-OE2 3.38Å; T39-E51 WeakPolarHBondContact CG2-OE2 3.33Å; T39-E51 PolarHBondContact OG1-OE1 3.36Å; T39-E51 PolarHBondContact OG1-OE2 2.75Å; S41-E51 VanDerWaalsContact CB-CD 3.42Å; S41-E51 WeakPolarHBondContact CB-OE1 3.38Å; S41-E51 WeakPolarHBondContact CB-OE2 3.48Å; S41-E51 PolarHBondContact OG-OE1 3.23Å; M46-E51 HydrophobicContact CE-CB 3.61Å; M46-E51 HydrophobicContact CE-CG 3.76Å; E47-E51 PolarHBondContact O-N 2.96Å; Y48-E51 WeakPolarHBondContact O-CA 3.31Å; Y48-E51 WeakPolarHBondContact O-CB 3.33Å; Y48-E51 PolarHBondContact O-N 3.31Å; Y48-E51 VanDerWaalsContact O-N 3.1Å; E49-E51 PolarHBondContact O-N 2.81Å; E51-D53 VanDerWaalsContact C-N 3.28Å; E51-D53 PolarHBondContact O-N 3.28Å; E51-L54 PolarHBondContact O-N 3.29Å; E51-R55 WeakPolarHBondContact O-CG 3.36Å; E51-R55 PolarHBondContact O-N 3.23Å; E51-R55 IonicContact OE1-CZ 3.35Å; E51-R55 IonicContact OE1-NE 2.97Å; E51-R55 PolarHBondContact OE1-NE 3.35Å; E51-R55 IonicContact OE1-NH2 2.95Å; E51-R55 PolarHBondContact OE1-NH2 3.02Å; E51-F92 HydrophobicContact CG-CD2 3.94Å; E51-F92 HydrophobicContact CG-CE2 3.82Å
52	I	95.3	Very high	95.5	Very high	39 Å²	39	43.7 Å²	43.7	20%	0.2	20%	0.204	C	C	.	.	H	α-helix	trans	-60.1	-43	177.1	-66.3	166.7	0	0	0	110.1	Y48 E49 L54 R55 I56 R263	Y48-I52 HydrophobicContact CD1-CD1 3.95Å; Y48-I52 HydrophobicContact CE1-CD1 3.53Å; Y48-I52 HydrophobicContact CE2-CD1 4.22Å; Y48-I52 HydrophobicContact CG-CD1 4.47Å; Y48-I52 PolarHBondContact O-N 3.3Å; E49-I52 PolarHBondContact O-N 3.21Å; I52-L54 VanDerWaalsContact C-N 3.31Å; I52-L54 PolarHBondContact O-N 3.34Å; I52-R55 WeakPolarHBondContact O-CB 3.43Å; I52-R55 PolarHBondContact O-N 2.73Å; I52-R55 VanDerWaalsContact O-N 3.11Å; I52-I56 HydrophobicContact CG2-CD1 3.69Å; I52-I56 HydrophobicContact CG2-CG1 4.3Å; I52-I56 WeakPolarHBondContact O-CG1 3.44Å; I52-I56 PolarHBondContact O-N 2.91Å; I52-R263 VanDerWaalsContact CG2-CZ 3.5Å
53	D	96	Very high	95.6	Very high	27 Å²	27	44 Å²	44	14%	0.144	21%	0.206	C	C	.	.	H	α-helix	trans	-59.4	-40	177.2	-76.8	-1.1	0	0	0	112.4	E49 E51 L57 R263 V266 L271	E49-D53 PolarHBondContact O-N 3.16Å; E51-D53 VanDerWaalsContact C-N 3.28Å; E51-D53 PolarHBondContact O-N 3.28Å; D53-L57 WeakPolarHBondContact O-CB 3.37Å; D53-L57 PolarHBondContact O-N 3.43Å; D53-R263 IonicContact OD1-CZ 2.68Å; D53-R263 IonicContact OD1-NE 3.82Å; D53-R263 PolarHBondContact OD1-NE 2.9Å; D53-R263 IonicContact OD1-NH2 3.26Å; D53-R263 PolarHBondContact OD1-NH2 3.02Å; D53-V266 HydrophobicContact CB-CG1 4.03Å; D53-V266 HydrophobicContact CB-CG2 3.83Å; D53-V266 WeakPolarHBondContact OD1-CG2 3.41Å; D53-V266 WeakPolarHBondContact OD2-CG1 3.47Å; D53-V266 WeakPolarHBondContact OD2-CG2 3.49Å; D53-L271 HydrophobicContact CB-CD1 3.71Å; D53-L271 HydrophobicContact CB-CD2 4.12Å
54	L	96.7	Very high	95.7	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-71.6	-28.5	175.6	-76.5	166	0	0	0	113.8	M46 T50 E51 I52 G58 Y83 F92 Y97 L271 L275	M46-L54 HydrophobicContact CE-CD1 3.69Å; M46-L54 HydrophobicContact SD-CD1 3.59Å; M46-L54 VanDerWaalsContact SD-CD1 3.59Å; T50-L54 HydrophobicContact CG2-CD1 4.28Å; T50-L54 WeakPolarHBondContact O-CD1 3.48Å; T50-L54 WeakPolarHBondContact O-CG 3.45Å; T50-L54 PolarHBondContact O-N 3.13Å; E51-L54 PolarHBondContact O-N 3.29Å; I52-L54 VanDerWaalsContact C-N 3.31Å; I52-L54 PolarHBondContact O-N 3.34Å; L54-G58 PolarHBondContact O-N 3.05Å; L54-Y83 PolarHBondContact O-OH 2.67Å; L54-F92 HydrophobicContact CB-CD1 4.16Å; L54-F92 HydrophobicContact CB-CD2 4.32Å; L54-F92 HydrophobicContact CB-CE1 4Å; L54-F92 HydrophobicContact CB-CE2 4.16Å; L54-F92 HydrophobicContact CB-CG 4.31Å; L54-F92 HydrophobicContact CB-CZ 3.99Å; L54-F92 HydrophobicContact CD1-CB 4.18Å; L54-F92 HydrophobicContact CD1-CD1 4.48Å; L54-F92 HydrophobicContact CD1-CG 4.17Å; L54-Y97 HydrophobicContact CD2-CD1 3.68Å; L54-Y97 HydrophobicContact CD2-CE1 3.86Å; L54-Y97 HydrophobicContact CD2-CG 4.24Å; L54-L271 HydrophobicContact CD2-CD2 3.49Å; L54-L271 VanDerWaalsContact CD2-CD2 3.49Å; L54-L271 HydrophobicContact CD2-CG 3.77Å; L54-L271 HydrophobicContact CG-CD1 4.18Å; L54-L271 HydrophobicContact CG-CD2 3.71Å; L54-L271 HydrophobicContact CG-CG 3.86Å; L54-L275 HydrophobicContact CD1-CD1 3.72Å; L54-L275 HydrophobicContact CD1-CD2 3.8Å; L54-L275 HydrophobicContact CD1-CG 3.79Å; L54-L275 HydrophobicContact CD2-CD1 3.47Å; L54-L275 VanDerWaalsContact CD2-CD1 3.47Å; L54-L275 HydrophobicContact CD2-CG 4.34Å; L54-L275 HydrophobicContact CG-CD1 4.26Å
55	R	96.6	Very high	95.9	Very high	8 Å²	8	39.1 Å²	39.1	3%	0.03	18%	0.18	C	C	.	.	H	α-helix	trans	-69.6	-51	172.3	-70.8	172.7	-177.7	-79.9	0.4	110.7	E51 I52 G58 C59 Q84 F87 F92	E51-R55 WeakPolarHBondContact O-CG 3.36Å; E51-R55 PolarHBondContact O-N 3.23Å; E51-R55 IonicContact OE1-CZ 3.35Å; E51-R55 IonicContact OE1-NE 2.97Å; E51-R55 PolarHBondContact OE1-NE 3.35Å; E51-R55 IonicContact OE1-NH2 2.95Å; E51-R55 PolarHBondContact OE1-NH2 3.02Å; I52-R55 WeakPolarHBondContact O-CB 3.43Å; I52-R55 PolarHBondContact O-N 2.73Å; I52-R55 VanDerWaalsContact O-N 3.11Å; R55-G58 PolarHBondContact O-N 2.86Å; R55-C59 PolarHBondContact O-N 2.95Å; R55-Q84 PolarHBondContact NH1-O 3.08Å; R55-F87 VanDerWaalsContact NH2-C 3.27Å; R55-F87 PolarHBondContact NH2-O 3.3Å; R55-F92 HydrophobicContact CG-CE2 3.82Å; R55-F92 HydrophobicContact CG-CZ 3.78Å
56	I	96.6	Very high	96.2	Very high	20 Å²	20	30.5 Å²	30.5	10%	0.103	14%	0.143	C	C	.	.	H	α-helix	trans	-59.6	-52.3	177.9	-66.6	169.1	0	0	0	110.6	I52 G58 C59 E60 L260	I52-I56 HydrophobicContact CG2-CD1 3.69Å; I52-I56 HydrophobicContact CG2-CG1 4.3Å; I52-I56 WeakPolarHBondContact O-CG1 3.44Å; I52-I56 PolarHBondContact O-N 2.91Å; I56-G58 VanDerWaalsContact C-N 3.25Å; I56-G58 PolarHBondContact O-N 3.14Å; I56-C59 PolarHBondContact O-N 2.96Å; I56-C59 VanDerWaalsContact O-N 3.08Å; I56-E60 HydrophobicContact CG2-CG 4.39Å; I56-E60 WeakPolarHBondContact O-CG 3.49Å; I56-E60 PolarHBondContact O-N 3.4Å; I56-L260 HydrophobicContact CD1-CD1 3.69Å; I56-L260 HydrophobicContact CG1-CD1 4.08Å
57	L	96.1	Very high	96.3	Very high	12 Å²	12	34 Å²	34	6%	0.063	17%	0.165	C	C	.	.	H	α-helix	trans	-55.8	-39.9	178.6	174.8	63.2	0	0	0	112.2	D53 E60 L61 Y97 V268 L271	D53-L57 WeakPolarHBondContact O-CB 3.37Å; D53-L57 PolarHBondContact O-N 3.43Å; L57-E60 PolarHBondContact O-N 3.41Å; L57-L61 HydrophobicContact CD1-CD1 4.34Å; L57-L61 HydrophobicContact CD1-CG 4.3Å; L57-L61 HydrophobicContact CG-CD1 4.24Å; L57-L61 VanDerWaalsContact O-CG 3.3Å; L57-L61 WeakPolarHBondContact O-CG 3.43Å; L57-L61 PolarHBondContact O-N 3.17Å; L57-Y97 HydrophobicContact CD2-CE2 3.81Å; L57-Y97 HydrophobicContact CG-CE2 4.33Å; L57-V268 HydrophobicContact CD1-CG1 4.39Å; L57-V268 HydrophobicContact CD1-CG2 3.75Å; L57-V268 HydrophobicContact CD2-CB 4.44Å; L57-V268 HydrophobicContact CD2-CG1 3.56Å; L57-V268 HydrophobicContact CD2-CG2 4.07Å; L57-L271 HydrophobicContact CD2-CD2 3.74Å
58	G	97.4	Very high	96.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.6	-47.6	175.3	0	0	0	0	0	113.2	L54 R55 I56 E60 L61 I62 Y83	L54-G58 PolarHBondContact O-N 3.05Å; R55-G58 PolarHBondContact O-N 2.86Å; I56-G58 VanDerWaalsContact C-N 3.25Å; I56-G58 PolarHBondContact O-N 3.14Å; G58-E60 VanDerWaalsContact C-N 3.31Å; G58-E60 PolarHBondContact O-N 3.42Å; G58-L61 PolarHBondContact O-N 2.76Å; G58-I62 VanDerWaalsContact O-CG1 3.27Å; G58-I62 WeakPolarHBondContact O-CG1 3.32Å; G58-I62 PolarHBondContact O-N 2.76Å; G58-Y83 VanDerWaalsContact CA-CZ 3.48Å; G58-Y83 VanDerWaalsContact CA-OH 3.3Å; G58-Y83 WeakPolarHBondContact CA-OH 3.41Å
59	C	97.4	Very high	96.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-65.2	-32.9	176.7	-69.8	0	0	0	0	112.7	R55 I56 Q63 Q80 L204 R205	R55-C59 PolarHBondContact O-N 2.95Å; I56-C59 PolarHBondContact O-N 2.96Å; I56-C59 VanDerWaalsContact O-N 3.08Å; C59-Q63 PolarHBondContact O-N 3.45Å; C59-Q80 HydrophobicContact CB-CG 3.99Å; C59-Q80 PolarHBondContact O-NE2 2.93Å; C59-L204 PolarHBondContact SG-O 2.96Å; C59-R205 HydrophobicContact CB-CB 4.25Å; C59-R205 HydrophobicContact CB-CG 4.05Å
60	E	95.7	Very high	96.7	Very high	90 Å²	90	28.6 Å²	28.6	42%	0.421	14%	0.138	S	C	.	.	H	α-helix	trans	-65.8	-47.9	171.5	-70.9	-170.4	149.6	0	0	112.2	I56 L57 G58 I62 Q63 D64	I56-E60 HydrophobicContact CG2-CG 4.39Å; I56-E60 WeakPolarHBondContact O-CG 3.49Å; I56-E60 PolarHBondContact O-N 3.4Å; L57-E60 PolarHBondContact O-N 3.41Å; G58-E60 VanDerWaalsContact C-N 3.31Å; G58-E60 PolarHBondContact O-N 3.42Å; E60-I62 VanDerWaalsContact C-N 3.25Å; E60-I62 PolarHBondContact O-N 3.05Å; E60-Q63 PolarHBondContact O-N 3.29Å; E60-Q63 VanDerWaalsContact O-N 3.17Å; E60-D64 PolarHBondContact O-N 3.26Å
61	L	97.2	Very high	96.8	Very high	10 Å²	10	28.5 Å²	28.5	5%	0.052	14%	0.136	C	C	.	.	H	α-helix	trans	-60.3	-35.5	175.9	-71.9	172.6	0	0	0	112.1	L57 G58 S65 Y97 F125 I128	L57-L61 HydrophobicContact CD1-CD1 4.34Å; L57-L61 HydrophobicContact CD1-CG 4.3Å; L57-L61 HydrophobicContact CG-CD1 4.24Å; L57-L61 VanDerWaalsContact O-CG 3.3Å; L57-L61 WeakPolarHBondContact O-CG 3.43Å; L57-L61 PolarHBondContact O-N 3.17Å; G58-L61 PolarHBondContact O-N 2.76Å; L61-S65 WeakPolarHBondContact O-CB 3.37Å; L61-S65 PolarHBondContact O-N 3.34Å; L61-S65 PolarHBondContact O-OG 3.34Å; L61-Y97 HydrophobicContact CD1-CD2 4.22Å; L61-Y97 HydrophobicContact CD1-CE2 3.85Å; L61-F125 HydrophobicContact CB-CE1 4Å; L61-F125 HydrophobicContact CB-CZ 4.43Å; L61-I128 HydrophobicContact CD2-CG2 3.68Å
62	I	98.1	Very high	96.8	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-67.8	-43.3	175.1	-69.9	166.9	0	0	0	111.4	G58 E60 S65 G66 A79 Q80 Y83 A101 C104 I105	G58-I62 VanDerWaalsContact O-CG1 3.27Å; G58-I62 WeakPolarHBondContact O-CG1 3.32Å; G58-I62 PolarHBondContact O-N 2.76Å; E60-I62 VanDerWaalsContact C-N 3.25Å; E60-I62 PolarHBondContact O-N 3.05Å; I62-S65 PolarHBondContact O-OG 3.27Å; I62-G66 PolarHBondContact O-N 2.84Å; I62-A79 HydrophobicContact CG2-CB 3.47Å; I62-A79 VanDerWaalsContact CG2-CB 3.47Å; I62-Q80 HydrophobicContact CB-CG 4.09Å; I62-Q80 HydrophobicContact CD1-CG 4.45Å; I62-Q80 HydrophobicContact CG2-CG 3.74Å; I62-Y83 HydrophobicContact CD1-CD1 4.44Å; I62-Y83 HydrophobicContact CD1-CD2 3.95Å; I62-Y83 HydrophobicContact CD1-CG 3.78Å; I62-A101 HydrophobicContact CD1-CB 4.37Å; I62-A101 HydrophobicContact CG1-CB 3.97Å; I62-C104 HydrophobicContact CD1-CB 4.42Å; I62-I105 HydrophobicContact CG2-CD1 4.21Å
63	Q	96.6	Very high	96.7	Very high	43 Å²	43	32 Å²	32	20%	0.201	16%	0.157	C	C	.	.	H	α-helix	trans	-66.5	-49.2	177.5	-172.6	70.4	22.1	0	0	111.5	C59 E60 S65 G66 V67 Q73 M76	C59-Q63 PolarHBondContact O-N 3.45Å; E60-Q63 PolarHBondContact O-N 3.29Å; E60-Q63 VanDerWaalsContact O-N 3.17Å; Q63-S65 PolarHBondContact O-N 2.98Å; Q63-G66 PolarHBondContact O-N 3.37Å; Q63-V67 WeakPolarHBondContact O-CG2 3.3Å; Q63-V67 PolarHBondContact O-N 2.84Å; Q63-Q73 VanDerWaalsContact OE1-NE2 3.08Å; Q63-M76 VanDerWaalsContact O-SD 3.41Å
64	D	96.9	Very high	96.6	Very high	40 Å²	40	33.4 Å²	33.4	21%	0.214	17%	0.166	C	C	.	.	H	α-helix	trans	-64.8	-39.1	-179.2	-84.3	-1.9	0	0	0	111.9	E60 L68 I128 R506	E60-D64 PolarHBondContact O-N 3.26Å; D64-L68 WeakPolarHBondContact O-CG 3.43Å; D64-L68 PolarHBondContact O-N 2.93Å; D64-L68 VanDerWaalsContact O-N 3.15Å; D64-I128 HydrophobicContact CB-CD1 4.08Å; D64-R506 VanDerWaalsContact CG-NH1 3.32Å; D64-R506 IonicContact OD1-CZ 3.68Å; D64-R506 IonicContact OD1-NH1 2.69Å; D64-R506 PolarHBondContact OD1-NH1 3.19Å; D64-R506 VanDerWaalsContact OD1-NH1 3.08Å; D64-R506 IonicContact OD1-NH2 2.61Å; D64-R506 PolarHBondContact OD1-NH2 3.45Å; D64-R506 IonicContact OD2-CZ 2.72Å; D64-R506 IonicContact OD2-NH1 3.15Å; D64-R506 PolarHBondContact OD2-NH1 3.13Å; D64-R506 IonicContact OD2-NH2 3.75Å
65	S	97.8	Very high	96.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-69.7	-38.3	174.9	62.7	0	0	0	0	112.7	L61 I62 Q63 L68 L69 F125	L61-S65 WeakPolarHBondContact O-CB 3.37Å; L61-S65 PolarHBondContact O-N 3.34Å; L61-S65 PolarHBondContact O-OG 3.34Å; I62-S65 PolarHBondContact O-OG 3.27Å; Q63-S65 PolarHBondContact O-N 2.98Å; S65-L68 PolarHBondContact O-N 2.96Å; S65-L69 VanDerWaalsContact O-CB 3.27Å; S65-L69 WeakPolarHBondContact O-CB 3.47Å; S65-L69 WeakPolarHBondContact O-CD1 3.46Å; S65-L69 WeakPolarHBondContact O-CG 3.33Å; S65-L69 PolarHBondContact O-N 3.19Å; S65-F125 VanDerWaalsContact OG-CE2 3.25Å; S65-F125 WeakPolarHBondContact OG-CE2 3.33Å
66	G	97.7	Very high	96.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-64.3	-39.8	176.3	0	0	0	0	0	113.2	I62 Q63 L69 R70 L71 M76	I62-G66 PolarHBondContact O-N 2.84Å; Q63-G66 PolarHBondContact O-N 3.37Å; G66-L69 CarbonylContact O-C 2.91Å; G66-L69 PolarHBondContact O-N 3.44Å; G66-R70 PolarHBondContact O-N 3.14Å; G66-L71 PolarHBondContact O-N 3.09Å; G66-M76 WeakPolarHBondContact CA-SD 3.35Å
67	V	96.9	Very high	96.5	Very high	81 Å²	81	32.4 Å²	32.4	49%	0.491	16%	0.162	S	C	.	.	H	α-helix	trans	-61.7	-48.1	172.9	170.3	0	0	0	0	111	Q63 L69 R70 M76	Q63-V67 WeakPolarHBondContact O-CG2 3.3Å; Q63-V67 PolarHBondContact O-N 2.84Å; V67-L69 VanDerWaalsContact C-N 3.33Å; V67-L69 PolarHBondContact O-N 2.78Å; V67-R70 WeakPolarHBondContact O-CA 3.47Å; V67-R70 PolarHBondContact O-N 3.22Å; V67-M76 HydrophobicContact CG2-CE 4.23Å; V67-M76 HydrophobicContact CG2-SD 4.1Å; V67-M76 PolarHBondContact N-SD 3.47Å
68	L	96.9	Very high	96.5	Very high	27 Å²	27	31.9 Å²	31.9	14%	0.141	16%	0.159	C	C	.	.	H	α-helix	trans	-66.8	-32	178.5	-70	174	0	0	0	113	D64 S65 R70 V124 I128 I496 T500	D64-L68 WeakPolarHBondContact O-CG 3.43Å; D64-L68 PolarHBondContact O-N 2.93Å; D64-L68 VanDerWaalsContact O-N 3.15Å; S65-L68 PolarHBondContact O-N 2.96Å; L68-R70 PolarHBondContact O-N 3.11Å; L68-V124 HydrophobicContact CB-CG1 3.73Å; L68-V124 HydrophobicContact CB-CG2 4.07Å; L68-V124 HydrophobicContact CD1-CG1 4.01Å; L68-I128 HydrophobicContact CD1-CD1 4.13Å; L68-I128 HydrophobicContact CD1-CG1 3.79Å; L68-I496 HydrophobicContact CD2-CG2 4.5Å; L68-T500 HydrophobicContact CD2-CG2 4.02Å
69	L	97.4	Very high	96.5	Very high	14 Å²	14	31.9 Å²	31.9	7%	0.073	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-4	171.1	-68.9	167.8	0	0	0	113.4	S65 G66 V67 L71 I105 R116 D120 V121 V124	S65-L69 VanDerWaalsContact O-CB 3.27Å; S65-L69 WeakPolarHBondContact O-CB 3.47Å; S65-L69 WeakPolarHBondContact O-CD1 3.46Å; S65-L69 WeakPolarHBondContact O-CG 3.33Å; S65-L69 PolarHBondContact O-N 3.19Å; G66-L69 CarbonylContact O-C 2.91Å; G66-L69 PolarHBondContact O-N 3.44Å; V67-L69 VanDerWaalsContact C-N 3.33Å; V67-L69 PolarHBondContact O-N 2.78Å; L69-L71 VanDerWaalsContact C-N 3.3Å; L69-L71 HydrophobicContact CB-CD1 3.99Å; L69-L71 HydrophobicContact CB-CG 4.01Å; L69-L71 HydrophobicContact CD1-CD1 4.06Å; L69-L71 PolarHBondContact O-N 3Å; L69-I105 HydrophobicContact CD1-CG1 4.36Å; L69-R116 HydrophobicContact CB-CG 4.5Å; L69-R116 HydrophobicContact CD2-CG 4.4Å; L69-R116 PolarHBondContact O-NE 3.46Å; L69-R116 PolarHBondContact O-NH2 2.85Å; L69-D120 HydrophobicContact CD2-CB 3.95Å; L69-V121 HydrophobicContact CD1-CG2 4.01Å; L69-V121 HydrophobicContact CD2-CG2 4.47Å; L69-V124 HydrophobicContact CD2-CB 4.47Å; L69-V124 HydrophobicContact CD2-CG2 3.92Å; L69-V124 HydrophobicContact CG-CB 4.44Å; L69-V124 HydrophobicContact CG-CG1 4.41Å; L69-V124 HydrophobicContact CG-CG2 4.13Å
70	R	96.9	Very high	96.4	Very high	172 Å²	172	32 Å²	32	65%	0.649	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	46.3	-174.5	-53.9	-176.9	-175.1	-175.4	0.8	112.5	G66 V67 L68 R116	G66-R70 PolarHBondContact O-N 3.14Å; V67-R70 WeakPolarHBondContact O-CA 3.47Å; V67-R70 PolarHBondContact O-N 3.22Å; L68-R70 PolarHBondContact O-N 3.11Å; R70-R116 PolarHBondContact O-NH2 2.96Å
71	L	97	Very high	96.4	Very high	12 Å²	12	28.1 Å²	28.1	6%	0.063	14%	0.142	C	C	.	.			trans	-84.7	151.7	175.5	-74.6	169.6	0	0	0	110.8	G66 L69 A75 I105 A109 S114 R116	G66-L71 PolarHBondContact O-N 3.09Å; L69-L71 VanDerWaalsContact C-N 3.3Å; L69-L71 HydrophobicContact CB-CD1 3.99Å; L69-L71 HydrophobicContact CB-CG 4.01Å; L69-L71 HydrophobicContact CD1-CD1 4.06Å; L69-L71 PolarHBondContact O-N 3Å; L71-A75 HydrophobicContact CB-CB 4.38Å; L71-I105 HydrophobicContact CD1-CD1 3.57Å; L71-I105 HydrophobicContact CD1-CG1 3.66Å; L71-A109 HydrophobicContact CD1-CB 4.05Å; L71-A109 HydrophobicContact CD2-CB 3.78Å; L71-S114 VanDerWaalsContact CD2-O 3.31Å; L71-S114 WeakPolarHBondContact CD2-O 3.47Å; L71-R116 HydrophobicContact CD1-CG 4.47Å; L71-R116 HydrophobicContact CD2-CG 4.02Å; L71-R116 HydrophobicContact CG-CG 4.4Å
72	P	95.8	Very high	96.3	Very high	58 Å²	58	27.7 Å²	27.7	38%	0.377	14%	0.14	S	C	.	.			trans	-67.4	151.1	175.1	29.3	-34.4	0	0	0	110.9	V74 A75 M76	P72-V74 PolarHBondContact O-N 3.33Å; P72-V74 VanDerWaalsContact O-N 3.12Å; P72-A75 HydrophobicContact CG-CB 3.92Å; P72-A75 WeakPolarHBondContact O-CB 3.44Å; P72-A75 PolarHBondContact O-N 2.93Å; P72-M76 PolarHBondContact O-N 3.5Å
73	Q	93.3	Very high	96.2	Very high	59 Å²	59	27.7 Å²	27.7	28%	0.276	14%	0.14	S	C	.	.	H	α-helix	trans	-57.2	-30.8	180	-174.1	60.7	52.4	0	0	112.8	Q63 A75 M76 A77	Q63-Q73 VanDerWaalsContact OE1-NE2 3.08Å; Q73-A75 VanDerWaalsContact C-N 3.32Å; Q73-A75 PolarHBondContact O-N 3.22Å; Q73-M76 HydrophobicContact CB-CE 4.39Å; Q73-M76 PolarHBondContact O-N 3.15Å; Q73-M76 VanDerWaalsContact OE1-CE 3.3Å; Q73-A77 WeakPolarHBondContact O-CB 3.37Å; Q73-A77 PolarHBondContact O-N 3.33Å
74	V	94.1	Very high	96.2	Very high	55 Å²	55	25.8 Å²	25.8	33%	0.333	13%	0.131	S	C	.	.	H	α-helix	trans	-59.3	-41.6	174	-168.8	0	0	0	0	111.4	P72 A77 T78 E112	P72-V74 PolarHBondContact O-N 3.33Å; P72-V74 VanDerWaalsContact O-N 3.12Å; V74-A77 PolarHBondContact O-N 3.4Å; V74-T78 WeakPolarHBondContact O-CB 3.47Å; V74-T78 PolarHBondContact O-N 3.47Å; V74-T78 PolarHBondContact O-OG1 3.2Å; V74-T78 VanDerWaalsContact O-OG1 3.08Å; V74-E112 HydrophobicContact CG1-CG 4.38Å; V74-E112 WeakPolarHBondContact CG1-OE2 3.37Å
75	A	95.9	Very high	96	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-71.2	-32.9	177.9	0	0	0	0	0	112.9	L71 P72 Q73 A79 A108 E112	L71-A75 HydrophobicContact CB-CB 4.38Å; P72-A75 HydrophobicContact CG-CB 3.92Å; P72-A75 WeakPolarHBondContact O-CB 3.44Å; P72-A75 PolarHBondContact O-N 2.93Å; Q73-A75 VanDerWaalsContact C-N 3.32Å; Q73-A75 PolarHBondContact O-N 3.22Å; A75-A79 VanDerWaalsContact O-CB 3.28Å; A75-A79 WeakPolarHBondContact O-CB 3.43Å; A75-A79 PolarHBondContact O-N 2.85Å; A75-A108 VanDerWaalsContact O-CB 3.3Å; A75-A108 WeakPolarHBondContact O-CB 3.45Å; A75-E112 HydrophobicContact CB-CB 3.97Å; A75-E112 HydrophobicContact CB-CG 3.79Å
76	M	96.2	Very high	95.9	Very high	8 Å²	8	24.8 Å²	24.8	4%	0.039	12%	0.124	C	C	.	.	H	α-helix	trans	-68.4	-44.8	173.3	-65.3	-171.4	-78.4	0	0	111	Q63 G66 V67 P72 Q73 A79 Q80 I105	Q63-M76 VanDerWaalsContact O-SD 3.41Å; G66-M76 WeakPolarHBondContact CA-SD 3.35Å; V67-M76 HydrophobicContact CG2-CE 4.23Å; V67-M76 HydrophobicContact CG2-SD 4.1Å; V67-M76 PolarHBondContact N-SD 3.47Å; P72-M76 PolarHBondContact O-N 3.5Å; Q73-M76 HydrophobicContact CB-CE 4.39Å; Q73-M76 PolarHBondContact O-N 3.15Å; Q73-M76 VanDerWaalsContact OE1-CE 3.3Å; M76-A79 PolarHBondContact O-N 3.5Å; M76-Q80 WeakPolarHBondContact O-CG 3.31Å; M76-Q80 PolarHBondContact O-N 3.28Å; M76-Q80 PolarHBondContact O-OE1 3.47Å; M76-I105 HydrophobicContact CG-CD1 4.36Å
77	A	95.3	Very high	95.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.5	-47.8	174.9	0	0	0	0	0	112.1	Q73 V74 A79 Q80 V81 H172 L204	Q73-A77 WeakPolarHBondContact O-CB 3.37Å; Q73-A77 PolarHBondContact O-N 3.33Å; V74-A77 PolarHBondContact O-N 3.4Å; A77-A79 VanDerWaalsContact C-N 3.29Å; A77-A79 PolarHBondContact O-N 2.7Å; A77-Q80 PolarHBondContact O-N 2.88Å; A77-V81 WeakPolarHBondContact O-CG2 3.43Å; A77-V81 PolarHBondContact O-N 2.9Å; A77-H172 VanDerWaalsContact C-CE1 3.48Å; A77-H172 VanDerWaalsContact CB-CE1 3.43Å; A77-H172 WeakPolarHBondContact CB-CE1 3.22Å; A77-L204 HydrophobicContact CB-CD1 3.68Å; A77-L204 HydrophobicContact CB-CD2 3.86Å; A77-L204 HydrophobicContact CB-CG 4.47Å
78	T	95.3	Very high	95.7	Very high	1 Å²	1	22 Å²	22	1%	0.006	11%	0.105	C	C	.	.	H	α-helix	trans	-57.4	-42.2	174.7	-66.4	0	0	0	0	110.9	V74 V81 L82 A108 L111 E112 A170 H172	V74-T78 WeakPolarHBondContact O-CB 3.47Å; V74-T78 PolarHBondContact O-N 3.47Å; V74-T78 PolarHBondContact O-OG1 3.2Å; V74-T78 VanDerWaalsContact O-OG1 3.08Å; T78-V81 PolarHBondContact O-N 3.22Å; T78-L82 HydrophobicContact CG2-CD1 3.96Å; T78-L82 HydrophobicContact CG2-CG 4.42Å; T78-L82 WeakPolarHBondContact O-CB 3.27Å; T78-L82 WeakPolarHBondContact O-CG 3.14Å; T78-L82 PolarHBondContact O-N 3.46Å; T78-A108 HydrophobicContact CG2-CB 3.92Å; T78-L111 HydrophobicContact CG2-CD1 4.32Å; T78-E112 WeakPolarHBondContact CB-OE1 3.5Å; T78-E112 PolarHBondContact OG1-OE1 2.9Å; T78-A170 HydrophobicContact CG2-CB 4.48Å; T78-H172 PolarHBondContact N-CE1 3.49Å; T78-H172 PolarHBondContact N-NE2 3Å; T78-H172 PolarHBondContact OG1-NE2 3.47Å
79	A	97.3	Very high	95.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-63.8	-41.2	176	0	0	0	0	0	113.4	I62 A75 M76 A77 L82 Y83 C104 I105 A108	I62-A79 HydrophobicContact CG2-CB 3.47Å; I62-A79 VanDerWaalsContact CG2-CB 3.47Å; A75-A79 VanDerWaalsContact O-CB 3.28Å; A75-A79 WeakPolarHBondContact O-CB 3.43Å; A75-A79 PolarHBondContact O-N 2.85Å; M76-A79 PolarHBondContact O-N 3.5Å; A77-A79 VanDerWaalsContact C-N 3.29Å; A77-A79 PolarHBondContact O-N 2.7Å; A79-L82 PolarHBondContact O-N 3.01Å; A79-Y83 WeakPolarHBondContact O-CB 3.33Å; A79-Y83 PolarHBondContact O-N 2.98Å; A79-C104 HydrophobicContact CB-CB 4.37Å; A79-C104 WeakPolarHBondContact O-CB 3.21Å; A79-I105 HydrophobicContact CB-CB 4.24Å; A79-I105 HydrophobicContact CB-CD1 3.79Å; A79-A108 HydrophobicContact CB-CB 3.71Å
80	Q	96.8	Very high	95.3	Very high	3 Å²	3	24.9 Å²	24.9	1%	0.014	12%	0.121	C	C	.	.	H	α-helix	trans	-64.9	-43.5	177.3	-72.7	163.6	-37.3	0	0	111.6	C59 I62 M76 A77 Y83 Q84 L204	C59-Q80 HydrophobicContact CB-CG 3.99Å; C59-Q80 PolarHBondContact O-NE2 2.93Å; I62-Q80 HydrophobicContact CB-CG 4.09Å; I62-Q80 HydrophobicContact CD1-CG 4.45Å; I62-Q80 HydrophobicContact CG2-CG 3.74Å; M76-Q80 WeakPolarHBondContact O-CG 3.31Å; M76-Q80 PolarHBondContact O-N 3.28Å; M76-Q80 PolarHBondContact O-OE1 3.47Å; A77-Q80 PolarHBondContact O-N 2.88Å; Q80-Y83 PolarHBondContact O-N 2.99Å; Q80-Q84 PolarHBondContact O-N 3.01Å; Q80-L204 HydrophobicContact CB-CB 4.4Å; Q80-L204 VanDerWaalsContact OE1-CB 3.29Å
81	V	94.6	Very high	95.3	Very high	7 Å²	7	16.9 Å²	16.9	4%	0.042	9%	0.091	C	C	.	.	H	α-helix	trans	-63.2	-44.3	175.7	175.8	0	0	0	0	111.7	A77 T78 Y83 Q84 R85 A170 L204 F209	A77-V81 WeakPolarHBondContact O-CG2 3.43Å; A77-V81 PolarHBondContact O-N 2.9Å; T78-V81 PolarHBondContact O-N 3.22Å; V81-Y83 VanDerWaalsContact C-N 3.33Å; V81-Y83 PolarHBondContact O-N 2.86Å; V81-Q84 PolarHBondContact O-N 3.05Å; V81-R85 HydrophobicContact CG1-CG 4.48Å; V81-R85 WeakPolarHBondContact O-CG 3.41Å; V81-R85 PolarHBondContact O-N 3.44Å; V81-A170 HydrophobicContact CB-CB 4.4Å; V81-A170 HydrophobicContact CG1-CB 4.22Å; V81-L204 HydrophobicContact CG2-CD2 4.29Å; V81-F209 HydrophobicContact CG2-CB 4.03Å; V81-F209 HydrophobicContact CG2-CD1 3.72Å; V81-F209 HydrophobicContact CG2-CE1 4.47Å; V81-F209 HydrophobicContact CG2-CG 4.08Å
82	L	95.5	Very high	95.3	Very high	2 Å²	2	16.3 Å²	16.3	1%	0.01	9%	0.088	C	C	.	.	H	α-helix	trans	-61.7	-40.2	175.9	-69.5	170	0	0	0	112.1	T78 A79 F86 C104 L107 A108 L111 L164 V168	T78-L82 HydrophobicContact CG2-CD1 3.96Å; T78-L82 HydrophobicContact CG2-CG 4.42Å; T78-L82 WeakPolarHBondContact O-CB 3.27Å; T78-L82 WeakPolarHBondContact O-CG 3.14Å; T78-L82 PolarHBondContact O-N 3.46Å; A79-L82 PolarHBondContact O-N 3.01Å; L82-F86 WeakPolarHBondContact O-CB 3.4Å; L82-F86 PolarHBondContact O-N 3.3Å; L82-C104 HydrophobicContact CB-CB 4.45Å; L82-L107 HydrophobicContact CD1-CD2 4.24Å; L82-L107 HydrophobicContact CD1-CG 4.37Å; L82-A108 HydrophobicContact CD1-CB 4.44Å; L82-L111 HydrophobicContact CD1-CD1 4Å; L82-L164 HydrophobicContact CB-CD1 4.47Å; L82-L164 HydrophobicContact CD2-CD1 3.53Å; L82-V168 HydrophobicContact CD2-CB 3.9Å; L82-V168 HydrophobicContact CD2-CG1 3.93Å
83	Y	97.1	Very high	95.2	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-64.3	-48.9	177.4	177.6	-90.8	0	0	0	111.7	L54 G58 I62 A79 Q80 V81 F86 F87 F92 Y97 A101	L54-Y83 PolarHBondContact O-OH 2.67Å; G58-Y83 VanDerWaalsContact CA-CZ 3.48Å; G58-Y83 VanDerWaalsContact CA-OH 3.3Å; G58-Y83 WeakPolarHBondContact CA-OH 3.41Å; I62-Y83 HydrophobicContact CD1-CD1 4.44Å; I62-Y83 HydrophobicContact CD1-CD2 3.95Å; I62-Y83 HydrophobicContact CD1-CG 3.78Å; A79-Y83 WeakPolarHBondContact O-CB 3.33Å; A79-Y83 PolarHBondContact O-N 2.98Å; Q80-Y83 PolarHBondContact O-N 2.99Å; V81-Y83 VanDerWaalsContact C-N 3.33Å; V81-Y83 PolarHBondContact O-N 2.86Å; Y83-F86 PolarHBondContact O-N 2.97Å; Y83-F87 HydrophobicContact CD1-CD2 4.27Å; Y83-F87 AromaticContact CD2-CD2 3.97Å; Y83-F87 HydrophobicContact CD2-CD2 3.97Å; Y83-F87 AromaticContact CD2-CE2 3.75Å; Y83-F87 HydrophobicContact CD2-CE2 3.75Å; Y83-F87 HydrophobicContact CE1-CD2 4.05Å; Y83-F87 HydrophobicContact CE1-CE2 4.47Å; Y83-F87 AromaticContact CE2-CD2 3.76Å; Y83-F87 HydrophobicContact CE2-CD2 3.76Å; Y83-F87 AromaticContact CE2-CE2 3.36Å; Y83-F87 HydrophobicContact CE2-CE2 3.36Å; Y83-F87 HydrophobicContact CE2-CZ 4.44Å; Y83-F87 HydrophobicContact CG-CD2 4.22Å; Y83-F87 HydrophobicContact CG-CE2 4.45Å; Y83-F87 AromaticContact CZ-CD2 3.78Å; Y83-F87 AromaticContact CZ-CE2 3.75Å; Y83-F87 WeakPolarHBondContact O-CD2 3.47Å; Y83-F87 PolarHBondContact O-N 2.87Å; Y83-F87 VanDerWaalsContact O-N 3.08Å; Y83-F92 HydrophobicContact CE1-CZ 4.49Å; Y83-F92 WeakPolarHBondContact OH-CE1 3.24Å; Y83-Y97 WeakPolarHBondContact OH-CB 3.5Å; Y83-A101 HydrophobicContact CD2-CB 4.41Å; Y83-A101 HydrophobicContact CE2-CB 4.18Å
84	Q	95	Very high	95.3	Very high	3 Å²	3	18 Å²	18	1%	0.014	9%	0.085	C	C	.	.	H	α-helix	trans	-60.8	-48.9	177.7	-72.6	-73.5	32.2	0	0	112.1	R55 Q80 V81 F86 F87 Y88 T206 V210	R55-Q84 PolarHBondContact NH1-O 3.08Å; Q80-Q84 PolarHBondContact O-N 3.01Å; V81-Q84 PolarHBondContact O-N 3.05Å; Q84-F86 VanDerWaalsContact C-N 3.28Å; Q84-F86 PolarHBondContact O-N 3Å; Q84-F87 PolarHBondContact O-N 3.34Å; Q84-F87 VanDerWaalsContact O-N 3.15Å; Q84-Y88 WeakPolarHBondContact O-CD2 3.43Å; Q84-Y88 PolarHBondContact O-N 3.48Å; Q84-T206 PolarHBondContact NE2-O 3.21Å; Q84-V210 HydrophobicContact CB-CG1 3.95Å
85	R	93.4	Very high	95.3	Very high	17 Å²	17	16.4 Å²	16.4	6%	0.064	7%	0.074	C	C	.	.	H	α-helix	trans	-61.1	-36.2	179.2	-68	174.7	77.3	-137.2	-0.7	111.9	N28 I29 V81 S89 L164 C167 V210	N28-R85 PolarHBondContact O-NH2 2.94Å; N28-R85 VanDerWaalsContact O-NH2 3.14Å; I29-R85 PolarHBondContact O-NE 2.87Å; V81-R85 HydrophobicContact CG1-CG 4.48Å; V81-R85 WeakPolarHBondContact O-CG 3.41Å; V81-R85 PolarHBondContact O-N 3.44Å; R85-S89 PolarHBondContact O-N 3.11Å; R85-S89 PolarHBondContact O-OG 3.42Å; R85-L164 HydrophobicContact CB-CD2 3.63Å; R85-C167 PolarHBondContact NH1-O 2.57Å; R85-C167 PolarHBondContact NH2-SG 2.75Å; R85-V210 HydrophobicContact CB-CG1 4.5Å; R85-V210 HydrophobicContact CG-CB 4.42Å; R85-V210 HydrophobicContact CG-CG1 3.45Å; R85-V210 VanDerWaalsContact CG-CG1 3.45Å
86	F	95.1	Very high	95.3	Very high	1 Å²	1	18.9 Å²	18.9	0%	0.004	9%	0.085	C	C	.	.	H	α-helix	trans	-64.2	-46	173.3	-179.2	-94.4	0	0	0	112.5	L82 Y83 Q84 S89 K90 H95 Y100 R159 V160 E163	L82-F86 WeakPolarHBondContact O-CB 3.4Å; L82-F86 PolarHBondContact O-N 3.3Å; Y83-F86 PolarHBondContact O-N 2.97Å; Q84-F86 VanDerWaalsContact C-N 3.28Å; Q84-F86 PolarHBondContact O-N 3Å; F86-S89 CarbonylContact O-C 3.54Å; F86-S89 WeakPolarHBondContact O-CA 3.22Å; F86-S89 WeakPolarHBondContact O-CB 3.31Å; F86-S89 PolarHBondContact O-N 2.89Å; F86-K90 HydrophobicContact CD1-CB 4.48Å; F86-K90 HydrophobicContact CE1-CB 3.88Å; F86-K90 HydrophobicContact CE1-CG 4.34Å; F86-K90 HydrophobicContact CE2-CB 4.38Å; F86-K90 HydrophobicContact CE2-CG 3.96Å; F86-K90 HydrophobicContact CZ-CB 3.82Å; F86-K90 HydrophobicContact CZ-CG 3.78Å; F86-K90 PolarHBondContact O-N 2.86Å; F86-H95 HydrophobicContact CE1-CB 4.23Å; F86-Y100 AromaticContact CD1-CD1 3.71Å; F86-Y100 HydrophobicContact CD1-CD1 3.71Å; F86-Y100 HydrophobicContact CD1-CE1 4.18Å; F86-Y100 HydrophobicContact CD1-CG 4.27Å; F86-Y100 HydrophobicContact CD2-CD1 4.5Å; F86-Y100 AromaticContact CE1-CD1 3.35Å; F86-Y100 HydrophobicContact CE1-CD1 3.35Å; F86-Y100 HydrophobicContact CE1-CD2 4.47Å; F86-Y100 AromaticContact CE1-CE1 3.42Å; F86-Y100 HydrophobicContact CE1-CE1 3.42Å; F86-Y100 VanDerWaalsContact CE1-CE1 3.42Å; F86-Y100 AromaticContact CE1-CG 3.94Å; F86-Y100 HydrophobicContact CE1-CG 3.94Å; F86-Y100 HydrophobicContact CE2-CD1 4.2Å; F86-Y100 AromaticContact CE2-CE1 3.8Å; F86-Y100 HydrophobicContact CE2-CE1 3.8Å; F86-Y100 HydrophobicContact CG-CD1 4.27Å; F86-Y100 AromaticContact CZ-CD1 3.63Å; F86-Y100 HydrophobicContact CZ-CD1 3.63Å; F86-Y100 AromaticContact CZ-CE1 3.19Å; F86-Y100 HydrophobicContact CZ-CE1 3.19Å; F86-Y100 AromaticContact CZ-CZ 3.83Å; F86-R159 HydrophobicContact CE2-CB 4.41Å; F86-V160 HydrophobicContact CD2-CB 4.4Å; F86-V160 HydrophobicContact CD2-CG2 3.9Å; F86-V160 HydrophobicContact CE2-CG2 4.34Å; F86-V160 HydrophobicContact CG-CG2 4.14Å; F86-E163 HydrophobicContact CD2-CB 4.23Å; F86-E163 HydrophobicContact CD2-CG 4.48Å; F86-E163 HydrophobicContact CE2-CB 4.17Å; F86-E163 HydrophobicContact CE2-CG 3.92Å
87	F	95.9	Very high	95.3	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-78.9	-19.1	-176.2	-78.9	-71	0	0	0	114.9	R55 Y83 Q84 S89 K90 F92 H95 Y100	R55-F87 VanDerWaalsContact NH2-C 3.27Å; R55-F87 PolarHBondContact NH2-O 3.3Å; Y83-F87 HydrophobicContact CD1-CD2 4.27Å; Y83-F87 AromaticContact CD2-CD2 3.97Å; Y83-F87 HydrophobicContact CD2-CD2 3.97Å; Y83-F87 AromaticContact CD2-CE2 3.75Å; Y83-F87 HydrophobicContact CD2-CE2 3.75Å; Y83-F87 HydrophobicContact CE1-CD2 4.05Å; Y83-F87 HydrophobicContact CE1-CE2 4.47Å; Y83-F87 AromaticContact CE2-CD2 3.76Å; Y83-F87 HydrophobicContact CE2-CD2 3.76Å; Y83-F87 AromaticContact CE2-CE2 3.36Å; Y83-F87 HydrophobicContact CE2-CE2 3.36Å; Y83-F87 HydrophobicContact CE2-CZ 4.44Å; Y83-F87 HydrophobicContact CG-CD2 4.22Å; Y83-F87 HydrophobicContact CG-CE2 4.45Å; Y83-F87 AromaticContact CZ-CD2 3.78Å; Y83-F87 AromaticContact CZ-CE2 3.75Å; Y83-F87 WeakPolarHBondContact O-CD2 3.47Å; Y83-F87 PolarHBondContact O-N 2.87Å; Y83-F87 VanDerWaalsContact O-N 3.08Å; Q84-F87 PolarHBondContact O-N 3.34Å; Q84-F87 VanDerWaalsContact O-N 3.15Å; F87-S89 VanDerWaalsContact C-N 3.26Å; F87-K90 WeakPolarHBondContact CA-O 3.36Å; F87-K90 VanDerWaalsContact CD1-O 3.29Å; F87-K90 WeakPolarHBondContact CD1-O 3.41Å; F87-K90 VanDerWaalsContact O-O 3.09Å; F87-F92 HydrophobicContact CB-CD2 4.46Å; F87-F92 HydrophobicContact CB-CE1 4.16Å; F87-F92 HydrophobicContact CB-CE2 3.75Å; F87-F92 HydrophobicContact CB-CZ 3.58Å; F87-F92 HydrophobicContact CD1-CB 4.49Å; F87-F92 AromaticContact CD1-CD1 3.36Å; F87-F92 HydrophobicContact CD1-CD1 3.36Å; F87-F92 AromaticContact CD1-CD2 3.88Å; F87-F92 HydrophobicContact CD1-CD2 3.88Å; F87-F92 AromaticContact CD1-CE1 3.34Å; F87-F92 HydrophobicContact CD1-CE1 3.34Å; F87-F92 AromaticContact CD1-CE2 3.87Å; F87-F92 HydrophobicContact CD1-CE2 3.87Å; F87-F92 AromaticContact CD1-CG 3.64Å; F87-F92 HydrophobicContact CD1-CG 3.64Å; F87-F92 AromaticContact CD1-CZ 3.62Å; F87-F92 HydrophobicContact CD1-CZ 3.62Å; F87-F92 HydrophobicContact CD2-CD1 4.38Å; F87-F92 AromaticContact CD2-CE1 3.6Å; F87-F92 HydrophobicContact CD2-CE1 3.6Å; F87-F92 AromaticContact CD2-CZ 3.8Å; F87-F92 HydrophobicContact CD2-CZ 3.8Å; F87-F92 HydrophobicContact CE1-CB 4.46Å; F87-F92 AromaticContact CE1-CD1 3.3Å; F87-F92 HydrophobicContact CE1-CD1 3.3Å; F87-F92 AromaticContact CE1-CE1 3.54Å; F87-F92 HydrophobicContact CE1-CE1 3.54Å; F87-F92 AromaticContact CE1-CG 3.88Å; F87-F92 HydrophobicContact CE1-CG 3.88Å; F87-F92 HydrophobicContact CE1-CZ 4.29Å; F87-F92 HydrophobicContact CE2-CD1 4.33Å; F87-F92 AromaticContact CE2-CE1 3.79Å; F87-F92 HydrophobicContact CE2-CE1 3.79Å; F87-F92 HydrophobicContact CE2-CZ 4.44Å; F87-F92 AromaticContact CG-CD1 3.95Å; F87-F92 HydrophobicContact CG-CD1 3.95Å; F87-F92 HydrophobicContact CG-CD2 4.35Å; F87-F92 AromaticContact CG-CE1 3.39Å; F87-F92 HydrophobicContact CG-CE1 3.39Å; F87-F92 AromaticContact CG-CE2 3.86Å; F87-F92 HydrophobicContact CG-CE2 3.86Å; F87-F92 HydrophobicContact CG-CG 4.4Å; F87-F92 AromaticContact CG-CZ 3.35Å; F87-F92 HydrophobicContact CG-CZ 3.35Å; F87-F92 AromaticContact CZ-CD1 3.83Å; F87-F92 HydrophobicContact CZ-CD1 3.83Å; F87-F92 AromaticContact CZ-CE1 3.76Å; F87-F92 HydrophobicContact CZ-CE1 3.76Å; F87-H95 HydrophobicContact CE1-CB 3.96Å; F87-H95 HydrophobicContact CZ-CB 4.35Å; F87-Y100 HydrophobicContact CE2-CG 4.21Å; F87-Y100 HydrophobicContact CZ-CD2 4.13Å; F87-Y100 AromaticContact CZ-CG 3.91Å; F87-Y100 HydrophobicContact CZ-CG 3.91Å
88	Y	94	Very high	95.4	Very high	24 Å²	24	19.4 Å²	19.4	9%	0.094	9%	0.087	C	C	.	.	H	α-helix	trans	-70.1	-25.1	159.9	-82.8	-78.2	0	0	0	112.5	I31 L36 T39 P40 Q84 D207 V210	I31-Y88 HydrophobicContact CD1-CD2 4.14Å; I31-Y88 HydrophobicContact CD1-CG 3.86Å; L36-Y88 HydrophobicContact CD2-CD1 4.08Å; L36-Y88 HydrophobicContact CD2-CE1 3.86Å; T39-Y88 HydrophobicContact CG2-CD1 4.44Å; T39-Y88 HydrophobicContact CG2-CE1 4.26Å; P40-Y88 WeakPolarHBondContact CD-O 3.33Å; P40-Y88 VanDerWaalsContact CG-O 3.29Å; P40-Y88 WeakPolarHBondContact CG-O 3.38Å; Q84-Y88 WeakPolarHBondContact O-CD2 3.43Å; Q84-Y88 PolarHBondContact O-N 3.48Å; Y88-D207 HydrophobicContact CE2-CB 4.06Å; Y88-D207 WeakPolarHBondContact OH-CB 3.47Å; Y88-V210 HydrophobicContact CD2-CG2 3.65Å; Y88-V210 HydrophobicContact CE2-CG2 3.53Å; Y88-V210 HydrophobicContact CG-CG2 4.47Å
89	S	92.3	Very high	95.5	Very high	44 Å²	44	21.3 Å²	21.3	31%	0.308	10%	0.096	S	C	.	.	H	α-helix	trans	-89	-15	177.8	-55.3	0	0	0	0	114	R85 F86 F87	R85-S89 PolarHBondContact O-N 3.11Å; R85-S89 PolarHBondContact O-OG 3.42Å; F86-S89 CarbonylContact O-C 3.54Å; F86-S89 WeakPolarHBondContact O-CA 3.22Å; F86-S89 WeakPolarHBondContact O-CB 3.31Å; F86-S89 PolarHBondContact O-N 2.89Å; F87-S89 VanDerWaalsContact C-N 3.26Å
90	K	95	Very high	95.5	Very high	57 Å²	57	21.9 Å²	21.9	25%	0.248	10%	0.098	C	C	.	.	S	Bend	trans	-154.7	136.4	-172.8	-68.5	-61.5	169.6	-75.2	0	113.5	F86 F87 E163	F86-K90 HydrophobicContact CD1-CB 4.48Å; F86-K90 HydrophobicContact CE1-CB 3.88Å; F86-K90 HydrophobicContact CE1-CG 4.34Å; F86-K90 HydrophobicContact CE2-CB 4.38Å; F86-K90 HydrophobicContact CE2-CG 3.96Å; F86-K90 HydrophobicContact CZ-CB 3.82Å; F86-K90 HydrophobicContact CZ-CG 3.78Å; F86-K90 PolarHBondContact O-N 2.86Å; F87-K90 WeakPolarHBondContact CA-O 3.36Å; F87-K90 VanDerWaalsContact CD1-O 3.29Å; F87-K90 WeakPolarHBondContact CD1-O 3.41Å; F87-K90 VanDerWaalsContact O-O 3.09Å; K90-E163 WeakPolarHBondContact CE-OE2 3.25Å; K90-E163 HydrophobicContact CG-CG 4.31Å; K90-E163 IonicContact NZ-OE2 2.78Å; K90-E163 PolarHBondContact NZ-OE2 3.32Å
91	S	96.1	Very high	95.6	Very high	3 Å²	3	21.7 Å²	21.7	2%	0.021	10%	0.097	C	C	.	.			trans	-56.8	135.4	175.9	167.9	0	0	0	0	114.9	P40 D44 V93 R94 H95	P40-S91 WeakPolarHBondContact O-CB 3.43Å; D44-S91 WeakPolarHBondContact OD2-CB 3.14Å; D44-S91 PolarHBondContact OD2-OG 2.89Å; S91-V93 VanDerWaalsContact C-N 3.32Å; S91-V93 WeakPolarHBondContact OG-CB 3.4Å; S91-V93 PolarHBondContact OG-N 3.38Å; S91-R94 PolarHBondContact O-N 3.19Å; S91-R94 PolarHBondContact OG-N 2.83Å; S91-H95 WeakPolarHBondContact O-CB 3.27Å; S91-H95 PolarHBondContact O-N 2.85Å; S91-H95 VanDerWaalsContact O-N 3.15Å; S91-H95 PolarHBondContact O-ND1 3.28Å
92	F	96.9	Very high	95.8	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-32.2	165.7	-76	-74.3	0	0	0	113.8	S41 M46 E51 L54 R55 Y83 F87 R94 H95 L275 R279	S41-F92 PolarHBondContact OG-N 3.45Å; M46-F92 HydrophobicContact CE-CB 3.7Å; M46-F92 HydrophobicContact CE-CD2 3.58Å; M46-F92 HydrophobicContact CE-CG 3.98Å; M46-F92 HydrophobicContact SD-CB 4.14Å; E51-F92 HydrophobicContact CG-CD2 3.94Å; E51-F92 HydrophobicContact CG-CE2 3.82Å; L54-F92 HydrophobicContact CB-CD1 4.16Å; L54-F92 HydrophobicContact CB-CD2 4.32Å; L54-F92 HydrophobicContact CB-CE1 4Å; L54-F92 HydrophobicContact CB-CE2 4.16Å; L54-F92 HydrophobicContact CB-CG 4.31Å; L54-F92 HydrophobicContact CB-CZ 3.99Å; L54-F92 HydrophobicContact CD1-CB 4.18Å; L54-F92 HydrophobicContact CD1-CD1 4.48Å; L54-F92 HydrophobicContact CD1-CG 4.17Å; R55-F92 HydrophobicContact CG-CE2 3.82Å; R55-F92 HydrophobicContact CG-CZ 3.78Å; Y83-F92 HydrophobicContact CE1-CZ 4.49Å; Y83-F92 WeakPolarHBondContact OH-CE1 3.24Å; F87-F92 HydrophobicContact CB-CD2 4.46Å; F87-F92 HydrophobicContact CB-CE1 4.16Å; F87-F92 HydrophobicContact CB-CE2 3.75Å; F87-F92 HydrophobicContact CB-CZ 3.58Å; F87-F92 HydrophobicContact CD1-CB 4.49Å; F87-F92 AromaticContact CD1-CD1 3.36Å; F87-F92 HydrophobicContact CD1-CD1 3.36Å; F87-F92 AromaticContact CD1-CD2 3.88Å; F87-F92 HydrophobicContact CD1-CD2 3.88Å; F87-F92 AromaticContact CD1-CE1 3.34Å; F87-F92 HydrophobicContact CD1-CE1 3.34Å; F87-F92 AromaticContact CD1-CE2 3.87Å; F87-F92 HydrophobicContact CD1-CE2 3.87Å; F87-F92 AromaticContact CD1-CG 3.64Å; F87-F92 HydrophobicContact CD1-CG 3.64Å; F87-F92 AromaticContact CD1-CZ 3.62Å; F87-F92 HydrophobicContact CD1-CZ 3.62Å; F87-F92 HydrophobicContact CD2-CD1 4.38Å; F87-F92 AromaticContact CD2-CE1 3.6Å; F87-F92 HydrophobicContact CD2-CE1 3.6Å; F87-F92 AromaticContact CD2-CZ 3.8Å; F87-F92 HydrophobicContact CD2-CZ 3.8Å; F87-F92 HydrophobicContact CE1-CB 4.46Å; F87-F92 AromaticContact CE1-CD1 3.3Å; F87-F92 HydrophobicContact CE1-CD1 3.3Å; F87-F92 AromaticContact CE1-CE1 3.54Å; F87-F92 HydrophobicContact CE1-CE1 3.54Å; F87-F92 AromaticContact CE1-CG 3.88Å; F87-F92 HydrophobicContact CE1-CG 3.88Å; F87-F92 HydrophobicContact CE1-CZ 4.29Å; F87-F92 HydrophobicContact CE2-CD1 4.33Å; F87-F92 AromaticContact CE2-CE1 3.79Å; F87-F92 HydrophobicContact CE2-CE1 3.79Å; F87-F92 HydrophobicContact CE2-CZ 4.44Å; F87-F92 AromaticContact CG-CD1 3.95Å; F87-F92 HydrophobicContact CG-CD1 3.95Å; F87-F92 HydrophobicContact CG-CD2 4.35Å; F87-F92 AromaticContact CG-CE1 3.39Å; F87-F92 HydrophobicContact CG-CE1 3.39Å; F87-F92 AromaticContact CG-CE2 3.86Å; F87-F92 HydrophobicContact CG-CE2 3.86Å; F87-F92 HydrophobicContact CG-CG 4.4Å; F87-F92 AromaticContact CG-CZ 3.35Å; F87-F92 HydrophobicContact CG-CZ 3.35Å; F87-F92 AromaticContact CZ-CD1 3.83Å; F87-F92 HydrophobicContact CZ-CD1 3.83Å; F87-F92 AromaticContact CZ-CE1 3.76Å; F87-F92 HydrophobicContact CZ-CE1 3.76Å; F92-R94 VanDerWaalsContact C-N 3.34Å; F92-R94 PolarHBondContact O-N 3.39Å; F92-H95 CarbonylContact O-C 3.51Å; F92-H95 PolarHBondContact O-N 3.15Å; F92-L275 HydrophobicContact CB-CD2 4.29Å; F92-R279 PolarHBondContact O-NH2 3.03Å
93	V	94.8	Very high	95.9	Very high	3 Å²	3	21.3 Å²	21.3	2%	0.018	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-45.9	177	-174.5	0	0	0	0	109.3	D44 M46 S91 H95 L278 R279 Q282	D44-V93 HydrophobicContact CB-CB 4.09Å; D44-V93 HydrophobicContact CB-CG2 3.93Å; M46-V93 HydrophobicContact CB-CG2 4.32Å; M46-V93 HydrophobicContact SD-CG2 4.34Å; S91-V93 VanDerWaalsContact C-N 3.32Å; S91-V93 WeakPolarHBondContact OG-CB 3.4Å; S91-V93 PolarHBondContact OG-N 3.38Å; V93-H95 VanDerWaalsContact C-N 3.34Å; V93-H95 PolarHBondContact O-N 3.38Å; V93-L278 HydrophobicContact CG1-CB 3.98Å; V93-L278 HydrophobicContact CG2-CB 3.98Å; V93-L278 HydrophobicContact CG2-CD1 4.09Å; V93-R279 HydrophobicContact CG1-CG 3.87Å; V93-R279 WeakPolarHBondContact O-CD 3.46Å; V93-R279 VanDerWaalsContact O-CG 3.24Å; V93-R279 WeakPolarHBondContact O-CG 3.22Å; V93-R279 PolarHBondContact O-NE 3.22Å; V93-Q282 HydrophobicContact CG1-CB 4.39Å
94	R	93.8	Very high	96	Very high	150 Å²	150	21.3 Å²	21.3	57%	0.566	10%	0.095	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-19.8	177.9	-64.5	171	-158.6	-153.7	3.9	113.9	D44 S91 F92	D44-R94 IonicContact OD1-CZ 3.72Å; D44-R94 IonicContact OD1-NE 3.45Å; D44-R94 PolarHBondContact OD1-NE 2.86Å; D44-R94 VanDerWaalsContact OD1-NE 3.14Å; D44-R94 IonicContact OD1-NH2 2.75Å; D44-R94 PolarHBondContact OD1-NH2 3.49Å; D44-R94 WeakPolarHBondContact OD2-CD 3.39Å; D44-R94 VanDerWaalsContact OD2-CG 3.29Å; D44-R94 WeakPolarHBondContact OD2-CG 3.45Å; D44-R94 IonicContact OD2-CZ 3.37Å; D44-R94 IonicContact OD2-NE 3.49Å; D44-R94 PolarHBondContact OD2-NE 3.08Å; D44-R94 IonicContact OD2-NH2 2.67Å; S91-R94 PolarHBondContact O-N 3.19Å; S91-R94 PolarHBondContact OG-N 2.83Å; F92-R94 VanDerWaalsContact C-N 3.34Å; F92-R94 PolarHBondContact O-N 3.39Å
95	H	95.6	Very high	96.1	Very high	21 Å²	21	21.2 Å²	21.2	10%	0.097	10%	0.095	C	C	.	.	S	Bend	trans	-136	104.9	-170.9	-62.8	103.8	0	0	0	112.3	F86 F87 S91 F92 V93 Y97 Y100 R159	F86-H95 HydrophobicContact CE1-CB 4.23Å; F87-H95 HydrophobicContact CE1-CB 3.96Å; F87-H95 HydrophobicContact CZ-CB 4.35Å; S91-H95 WeakPolarHBondContact O-CB 3.27Å; S91-H95 PolarHBondContact O-N 2.85Å; S91-H95 VanDerWaalsContact O-N 3.15Å; S91-H95 PolarHBondContact O-ND1 3.28Å; F92-H95 CarbonylContact O-C 3.51Å; F92-H95 PolarHBondContact O-N 3.15Å; V93-H95 VanDerWaalsContact C-N 3.34Å; V93-H95 PolarHBondContact O-N 3.38Å; H95-Y97 PolarHBondContact O-N 2.96Å; H95-Y97 VanDerWaalsContact O-N 3.13Å; H95-Y100 HydrophobicContact CB-CD2 4.08Å; H95-Y100 HydrophobicContact CB-CE2 3.67Å; H95-Y100 AromaticContact CD2-CE2 3.95Å; H95-Y100 AromaticContact CD2-CZ 3.73Å; H95-Y100 PolarHBondContact CD2-OH 3.08Å; H95-Y100 VanDerWaalsContact CD2-OH 3.24Å; H95-R159 PolarHBondContact CD2-NH1 3.24Å; H95-R159 VanDerWaalsContact CD2-NH1 3.3Å; H95-R159 PolarHBondContact NE2-NH1 3.22Å
96	F	95.2	Very high	96.3	Very high	52 Å²	52	21.8 Å²	21.8	23%	0.228	10%	0.097	C	C	.	.			trans	-63.2	113.6	-178.9	-176.7	-119.1	0	0	0	112.2	E98 H99 Y100	F96-E98 VanDerWaalsContact C-N 3.31Å; F96-E98 HydrophobicContact CD1-CB 3.98Å; F96-E98 HydrophobicContact CE1-CB 3.4Å; F96-E98 HydrophobicContact CE1-CG 4.44Å; F96-E98 HydrophobicContact CZ-CB 3.85Å; F96-E98 PolarHBondContact O-N 3.2Å; F96-H99 AromaticContact CD1-CE1 3.78Å; F96-H99 AromaticContact CD1-ND1 3.8Å; F96-H99 PolarHBondContact O-N 3.35Å; F96-Y100 WeakPolarHBondContact O-CD2 3.2Å
97	Y	96.5	Very high	96.5	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-53.1	-40.3	-167.8	64.1	-87.4	0	0	0	114.4	L54 L57 L61 Y83 H95 H99 Y100 A101 E272 L275	L54-Y97 HydrophobicContact CD2-CD1 3.68Å; L54-Y97 HydrophobicContact CD2-CE1 3.86Å; L54-Y97 HydrophobicContact CD2-CG 4.24Å; L57-Y97 HydrophobicContact CD2-CE2 3.81Å; L57-Y97 HydrophobicContact CG-CE2 4.33Å; L61-Y97 HydrophobicContact CD1-CD2 4.22Å; L61-Y97 HydrophobicContact CD1-CE2 3.85Å; Y83-Y97 WeakPolarHBondContact OH-CB 3.5Å; H95-Y97 PolarHBondContact O-N 2.96Å; H95-Y97 VanDerWaalsContact O-N 3.13Å; Y97-H99 VanDerWaalsContact C-N 3.29Å; Y97-H99 PolarHBondContact O-N 3.32Å; Y97-Y100 CarbonylContact O-C 3.59Å; Y97-Y100 WeakPolarHBondContact O-CA 3.22Å; Y97-Y100 PolarHBondContact O-N 3.16Å; Y97-A101 PolarHBondContact O-N 2.83Å; Y97-E272 HydrophobicContact CE1-CG 4.42Å; Y97-E272 WeakPolarHBondContact OH-CG 3.33Å; Y97-E272 PolarHBondContact OH-OE1 3.4Å; Y97-E272 VanDerWaalsContact OH-OE1 3.04Å; Y97-L275 HydrophobicContact CD1-CD1 3.71Å; Y97-L275 HydrophobicContact CE1-CD1 3.72Å
98	E	96.7	Very high	96.5	Very high	19 Å²	19	22 Å²	22	9%	0.089	10%	0.099	C	C	.	.	H	α-helix	trans	-60.7	-37.7	-176	-153.3	-169.8	86.9	0	0	111.8	F96 Y100 M102 F125 R129	F96-E98 VanDerWaalsContact C-N 3.31Å; F96-E98 HydrophobicContact CD1-CB 3.98Å; F96-E98 HydrophobicContact CE1-CB 3.4Å; F96-E98 HydrophobicContact CE1-CG 4.44Å; F96-E98 HydrophobicContact CZ-CB 3.85Å; F96-E98 PolarHBondContact O-N 3.2Å; E98-Y100 VanDerWaalsContact C-N 3.29Å; E98-Y100 PolarHBondContact O-N 3.02Å; E98-M102 HydrophobicContact CB-CE 4.47Å; E98-M102 HydrophobicContact CG-CE 3.98Å; E98-M102 WeakPolarHBondContact O-CB 3.31Å; E98-M102 WeakPolarHBondContact O-CE 3.49Å; E98-M102 PolarHBondContact O-N 3.07Å; E98-F125 HydrophobicContact CG-CD1 3.9Å; E98-F125 HydrophobicContact CG-CE1 4.33Å; E98-R129 IonicContact OE1-NH1 3.74Å; E98-R129 IonicContact OE2-CZ 3.77Å; E98-R129 IonicContact OE2-NH1 2.69Å; E98-R129 PolarHBondContact OE2-NH1 3.34Å
99	H	97.5	Very high	96.7	Very high	42 Å²	42	21 Å²	21	19%	0.194	10%	0.095	C	C	.	.	H	α-helix	trans	-64.9	-32.9	173.8	-62.1	152.5	0	0	0	112.6	F96 Y97 A103 L149 A156	F96-H99 AromaticContact CD1-CE1 3.78Å; F96-H99 AromaticContact CD1-ND1 3.8Å; F96-H99 PolarHBondContact O-N 3.35Å; Y97-H99 VanDerWaalsContact C-N 3.29Å; Y97-H99 PolarHBondContact O-N 3.32Å; H99-A103 WeakPolarHBondContact O-CB 3.26Å; H99-A103 PolarHBondContact O-N 2.91Å; H99-L149 VanDerWaalsContact CD2-CD1 3.45Å; H99-L149 WeakPolarHBondContact CD2-CD1 3.31Å; H99-L149 WeakPolarHBondContact NE2-CD1 3.21Å; H99-A156 HydrophobicContact CB-CB 4.42Å
100	Y	98.2	Very high	96.9	Very high	11 Å²	11	22.7 Å²	22.7	4%	0.043	10%	0.097	C	C	.	.	H	α-helix	trans	-84	-33.2	-179.5	-74.5	-91.3	0	0	0	112	F86 F87 H95 F96 Y97 E98 A103 C104 A156 R159 V160	F86-Y100 AromaticContact CD1-CD1 3.71Å; F86-Y100 HydrophobicContact CD1-CD1 3.71Å; F86-Y100 HydrophobicContact CD1-CE1 4.18Å; F86-Y100 HydrophobicContact CD1-CG 4.27Å; F86-Y100 HydrophobicContact CD2-CD1 4.5Å; F86-Y100 AromaticContact CE1-CD1 3.35Å; F86-Y100 HydrophobicContact CE1-CD1 3.35Å; F86-Y100 HydrophobicContact CE1-CD2 4.47Å; F86-Y100 AromaticContact CE1-CE1 3.42Å; F86-Y100 HydrophobicContact CE1-CE1 3.42Å; F86-Y100 VanDerWaalsContact CE1-CE1 3.42Å; F86-Y100 AromaticContact CE1-CG 3.94Å; F86-Y100 HydrophobicContact CE1-CG 3.94Å; F86-Y100 HydrophobicContact CE2-CD1 4.2Å; F86-Y100 AromaticContact CE2-CE1 3.8Å; F86-Y100 HydrophobicContact CE2-CE1 3.8Å; F86-Y100 HydrophobicContact CG-CD1 4.27Å; F86-Y100 AromaticContact CZ-CD1 3.63Å; F86-Y100 HydrophobicContact CZ-CD1 3.63Å; F86-Y100 AromaticContact CZ-CE1 3.19Å; F86-Y100 HydrophobicContact CZ-CE1 3.19Å; F86-Y100 AromaticContact CZ-CZ 3.83Å; F87-Y100 HydrophobicContact CE2-CG 4.21Å; F87-Y100 HydrophobicContact CZ-CD2 4.13Å; F87-Y100 AromaticContact CZ-CG 3.91Å; F87-Y100 HydrophobicContact CZ-CG 3.91Å; H95-Y100 HydrophobicContact CB-CD2 4.08Å; H95-Y100 HydrophobicContact CB-CE2 3.67Å; H95-Y100 AromaticContact CD2-CE2 3.95Å; H95-Y100 AromaticContact CD2-CZ 3.73Å; H95-Y100 PolarHBondContact CD2-OH 3.08Å; H95-Y100 VanDerWaalsContact CD2-OH 3.24Å; F96-Y100 WeakPolarHBondContact O-CD2 3.2Å; Y97-Y100 CarbonylContact O-C 3.59Å; Y97-Y100 WeakPolarHBondContact O-CA 3.22Å; Y97-Y100 PolarHBondContact O-N 3.16Å; E98-Y100 VanDerWaalsContact C-N 3.29Å; E98-Y100 PolarHBondContact O-N 3.02Å; Y100-A103 PolarHBondContact O-N 3.33Å; Y100-C104 WeakPolarHBondContact O-CB 3.25Å; Y100-C104 PolarHBondContact O-N 3.23Å; Y100-C104 PolarHBondContact O-SG 3.07Å; Y100-A156 HydrophobicContact CD1-CB 3.98Å; Y100-A156 HydrophobicContact CD2-CB 4.23Å; Y100-A156 HydrophobicContact CE1-CB 3.68Å; Y100-A156 HydrophobicContact CE2-CB 3.94Å; Y100-A156 HydrophobicContact CG-CB 4.23Å; Y100-R159 HydrophobicContact CE1-CB 4.28Å; Y100-R159 WeakPolarHBondContact OH-CD 3.48Å; Y100-V160 HydrophobicContact CD1-CG2 3.71Å; Y100-V160 HydrophobicContact CE1-CG2 4.1Å
101	A	98.3	Very high	96.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-60.2	-49.2	167.5	0	0	0	0	0	110.8	I62 Y83 Y97 A103 C104 I105 F125	I62-A101 HydrophobicContact CD1-CB 4.37Å; I62-A101 HydrophobicContact CG1-CB 3.97Å; Y83-A101 HydrophobicContact CD2-CB 4.41Å; Y83-A101 HydrophobicContact CE2-CB 4.18Å; Y97-A101 PolarHBondContact O-N 2.83Å; A101-A103 PolarHBondContact O-N 3.06Å; A101-C104 PolarHBondContact O-N 3.19Å; A101-I105 WeakPolarHBondContact O-CG2 3.41Å; A101-I105 PolarHBondContact O-N 3.5Å; A101-I105 VanDerWaalsContact O-N 3.08Å; A101-F125 HydrophobicContact CB-CE1 3.78Å; A101-F125 HydrophobicContact CB-CZ 3.85Å
102	M	98.5	Very high	96.9	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-57.1	-44.5	172.5	-80.6	-173.3	-102.3	0	0	112.8	E98 F106 V121 I122 F125 L149 V153	E98-M102 HydrophobicContact CB-CE 4.47Å; E98-M102 HydrophobicContact CG-CE 3.98Å; E98-M102 WeakPolarHBondContact O-CB 3.31Å; E98-M102 WeakPolarHBondContact O-CE 3.49Å; E98-M102 PolarHBondContact O-N 3.07Å; M102-F106 WeakPolarHBondContact O-CB 3.39Å; M102-F106 PolarHBondContact O-N 3.06Å; M102-F106 VanDerWaalsContact O-N 3.08Å; M102-V121 HydrophobicContact CB-CG1 4.2Å; M102-V121 HydrophobicContact CG-CG1 4.07Å; M102-I122 HydrophobicContact SD-CG1 4.14Å; M102-F125 HydrophobicContact CB-CE2 4.43Å; M102-F125 HydrophobicContact CE-CB 4.22Å; M102-F125 HydrophobicContact CE-CD1 4.17Å; M102-F125 HydrophobicContact CE-CG 4.27Å; M102-F125 HydrophobicContact CG-CB 4.09Å; M102-F125 HydrophobicContact CG-CD1 3.62Å; M102-F125 HydrophobicContact CG-CD2 3.43Å; M102-F125 VanDerWaalsContact CG-CD2 3.43Å; M102-F125 HydrophobicContact CG-CE1 3.82Å; M102-F125 HydrophobicContact CG-CE2 3.63Å; M102-F125 HydrophobicContact CG-CG 3.42Å; M102-F125 VanDerWaalsContact CG-CG 3.42Å; M102-F125 HydrophobicContact CG-CZ 3.83Å; M102-F125 HydrophobicContact SD-CB 3.99Å; M102-F125 HydrophobicContact SD-CD1 4.4Å; M102-F125 HydrophobicContact SD-CD2 4.36Å; M102-F125 HydrophobicContact SD-CG 4Å; M102-L149 HydrophobicContact CE-CD1 4.14Å; M102-V153 HydrophobicContact CB-CG1 4.1Å; M102-V153 HydrophobicContact CB-CG2 3.9Å; M102-V153 HydrophobicContact SD-CG2 3.86Å
103	A	98.3	Very high	96.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-67.4	-39.3	178	0	0	0	0	0	113.2	H99 Y100 A101 L107 V153 A156 E157	H99-A103 WeakPolarHBondContact O-CB 3.26Å; H99-A103 PolarHBondContact O-N 2.91Å; Y100-A103 PolarHBondContact O-N 3.33Å; A101-A103 PolarHBondContact O-N 3.06Å; A103-L107 WeakPolarHBondContact O-CB 3.33Å; A103-L107 PolarHBondContact O-N 3.3Å; A103-V153 HydrophobicContact CB-CG1 4.39Å; A103-A156 HydrophobicContact CB-CB 3.76Å; A103-E157 HydrophobicContact CB-CB 4.12Å
104	C	98.2	Very high	96.7	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-69.2	-42.2	-179.6	-67.8	0	0	0	0	111.9	I62 A79 L82 Y100 A101 L107 A108	I62-C104 HydrophobicContact CD1-CB 4.42Å; A79-C104 HydrophobicContact CB-CB 4.37Å; A79-C104 WeakPolarHBondContact O-CB 3.21Å; L82-C104 HydrophobicContact CB-CB 4.45Å; Y100-C104 WeakPolarHBondContact O-CB 3.25Å; Y100-C104 PolarHBondContact O-N 3.23Å; Y100-C104 PolarHBondContact O-SG 3.07Å; A101-C104 PolarHBondContact O-N 3.19Å; C104-L107 PolarHBondContact O-N 3.11Å; C104-A108 VanDerWaalsContact O-CB 3.3Å; C104-A108 WeakPolarHBondContact O-CB 3.04Å; C104-A108 PolarHBondContact O-N 3.49Å
105	I	98.1	Very high	96.8	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-70.7	-35.4	176.1	-164.8	58.2	0	0	0	112.3	I62 L69 L71 M76 A79 A101 A109 V121 F125	I62-I105 HydrophobicContact CG2-CD1 4.21Å; L69-I105 HydrophobicContact CD1-CG1 4.36Å; L71-I105 HydrophobicContact CD1-CD1 3.57Å; L71-I105 HydrophobicContact CD1-CG1 3.66Å; M76-I105 HydrophobicContact CG-CD1 4.36Å; A79-I105 HydrophobicContact CB-CB 4.24Å; A79-I105 HydrophobicContact CB-CD1 3.79Å; A101-I105 WeakPolarHBondContact O-CG2 3.41Å; A101-I105 PolarHBondContact O-N 3.5Å; A101-I105 VanDerWaalsContact O-N 3.08Å; I105-A109 VanDerWaalsContact O-CB 3.22Å; I105-A109 WeakPolarHBondContact O-CB 3.38Å; I105-A109 PolarHBondContact O-N 2.97Å; I105-V121 HydrophobicContact CG2-CG1 3.99Å; I105-F125 HydrophobicContact CG2-CE2 4.05Å
106	F	98	Very high	96.9	Very high	28 Å²	28	34 Å²	34	12%	0.123	16%	0.164	C	C	.	.	H	α-helix	trans	-66.7	-36	173	178.1	-110.5	0	0	0	112.7	M102 K110 R116 I118 V121 E157	M102-F106 WeakPolarHBondContact O-CB 3.39Å; M102-F106 PolarHBondContact O-N 3.06Å; M102-F106 VanDerWaalsContact O-N 3.08Å; F106-K110 WeakPolarHBondContact O-CE 3.32Å; F106-R116 WeakPolarHBondContact CE2-O 3.02Å; F106-I118 HydrophobicContact CD2-CB 4.4Å; F106-I118 HydrophobicContact CE2-CB 3.99Å; F106-I118 HydrophobicContact CZ-CB 4.29Å; F106-V121 HydrophobicContact CB-CG2 4.4Å; F106-V121 HydrophobicContact CD2-CG2 4.26Å; F106-E157 WeakPolarHBondContact CD1-OE1 3.4Å; F106-E157 VanDerWaalsContact CE1-OE1 3.25Å; F106-E157 WeakPolarHBondContact CE1-OE1 3.4Å
107	L	97.5	Very high	96.9	Very high	7 Å²	7	39.7 Å²	39.7	4%	0.037	18%	0.184	C	C	.	.	H	α-helix	trans	-71.6	-52.1	175	178	56.8	0	0	0	111.3	L82 A103 C104 A109 K110 L111 V160 L161	L82-L107 HydrophobicContact CD1-CD2 4.24Å; L82-L107 HydrophobicContact CD1-CG 4.37Å; A103-L107 WeakPolarHBondContact O-CB 3.33Å; A103-L107 PolarHBondContact O-N 3.3Å; C104-L107 PolarHBondContact O-N 3.11Å; L107-A109 VanDerWaalsContact C-N 3.31Å; L107-A109 PolarHBondContact O-N 3.45Å; L107-K110 WeakPolarHBondContact O-CA 3.19Å; L107-K110 WeakPolarHBondContact O-CB 3.38Å; L107-K110 PolarHBondContact O-N 3.02Å; L107-L111 HydrophobicContact CD1-CD1 4.4Å; L107-L111 HydrophobicContact CD1-CG 4.36Å; L107-L111 HydrophobicContact CG-CD1 4.1Å; L107-L111 HydrophobicContact CG-CG 4.49Å; L107-L111 PolarHBondContact O-N 3.14Å; L107-L111 VanDerWaalsContact O-N 3.13Å; L107-V160 HydrophobicContact CD2-CG1 4.03Å; L107-L161 HydrophobicContact CD1-CD1 4.42Å; L107-L161 HydrophobicContact CD1-CD2 4.04Å; L107-L161 HydrophobicContact CD1-CG 4.38Å; L107-L161 HydrophobicContact CD2-CD2 3.87Å; L107-L161 HydrophobicContact CD2-CG 4.02Å
108	A	97.4	Very high	96.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-60.4	-37.8	-179.7	0	0	0	0	0	112.8	A75 T78 A79 L82 C104 K110 L111 E112	A75-A108 VanDerWaalsContact O-CB 3.3Å; A75-A108 WeakPolarHBondContact O-CB 3.45Å; T78-A108 HydrophobicContact CG2-CB 3.92Å; A79-A108 HydrophobicContact CB-CB 3.71Å; L82-A108 HydrophobicContact CD1-CB 4.44Å; C104-A108 VanDerWaalsContact O-CB 3.3Å; C104-A108 WeakPolarHBondContact O-CB 3.04Å; C104-A108 PolarHBondContact O-N 3.49Å; A108-K110 PolarHBondContact O-N 3.08Å; A108-K110 VanDerWaalsContact O-N 3.16Å; A108-L111 PolarHBondContact O-N 3.38Å; A108-E112 PolarHBondContact O-N 2.86Å
109	A	97.5	Very high	96.8	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.008	20%	0.202	C	C	.	.	H	α-helix	trans	-57.6	-27.9	172.6	0	0	0	0	0	113.2	L71 I105 L107 S114 P115 R116	L71-A109 HydrophobicContact CD1-CB 4.05Å; L71-A109 HydrophobicContact CD2-CB 3.78Å; I105-A109 VanDerWaalsContact O-CB 3.22Å; I105-A109 WeakPolarHBondContact O-CB 3.38Å; I105-A109 PolarHBondContact O-N 2.97Å; L107-A109 VanDerWaalsContact C-N 3.31Å; L107-A109 PolarHBondContact O-N 3.45Å; A109-S114 CarbonylContact O-C 3.58Å; A109-S114 WeakPolarHBondContact O-CA 3.25Å; A109-S114 PolarHBondContact O-N 3.15Å; A109-P115 WeakPolarHBondContact O-CA 3.4Å; A109-R116 HydrophobicContact CB-CG 4.46Å
110	K	96.6	Very high	96.8	Very high	81 Å²	81	43 Å²	43	35%	0.352	20%	0.197	S	C	.	.	H	α-helix	trans	-85.1	-28.8	173.3	-65.2	179.8	-68.8	168.5	0	113.3	F106 L107 A108 P115 E157	F106-K110 WeakPolarHBondContact O-CE 3.32Å; L107-K110 WeakPolarHBondContact O-CA 3.19Å; L107-K110 WeakPolarHBondContact O-CB 3.38Å; L107-K110 PolarHBondContact O-N 3.02Å; A108-K110 PolarHBondContact O-N 3.08Å; A108-K110 VanDerWaalsContact O-N 3.16Å; K110-P115 HydrophobicContact CG-CB 4.23Å; K110-E157 VanDerWaalsContact CE-OE1 3.28Å; K110-E157 WeakPolarHBondContact CE-OE1 3.33Å; K110-E157 IonicContact NZ-OE1 2.75Å; K110-E157 PolarHBondContact NZ-OE1 2.88Å; K110-E157 IonicContact NZ-OE2 2.6Å
111	L	95.4	Very high	96.7	Very high	67 Å²	67	42.6 Å²	42.6	35%	0.351	20%	0.195	S	C	.	.	H	α-helix	trans	-74.4	-38.4	178.6	-62.3	173.5	0	0	0	111.7	T78 L82 L107 A108 E113 V168	T78-L111 HydrophobicContact CG2-CD1 4.32Å; L82-L111 HydrophobicContact CD1-CD1 4Å; L107-L111 HydrophobicContact CD1-CD1 4.4Å; L107-L111 HydrophobicContact CD1-CG 4.36Å; L107-L111 HydrophobicContact CG-CD1 4.1Å; L107-L111 HydrophobicContact CG-CG 4.49Å; L107-L111 PolarHBondContact O-N 3.14Å; L107-L111 VanDerWaalsContact O-N 3.13Å; A108-L111 PolarHBondContact O-N 3.38Å; L111-E113 VanDerWaalsContact C-N 3.27Å; L111-E113 PolarHBondContact O-N 2.76Å; L111-V168 HydrophobicContact CD1-CB 3.75Å; L111-V168 HydrophobicContact CD1-CG2 3.74Å; L111-V168 HydrophobicContact CD2-CG2 3.71Å; L111-V168 HydrophobicContact CG-CG2 4.4Å
112	E	94.9	Very high	96.7	Very high	64 Å²	64	42.8 Å²	42.8	30%	0.299	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	34.5	177	-50.9	-61.1	161	0	0	112.3	V74 A75 T78 A108 S114	V74-E112 HydrophobicContact CG1-CG 4.38Å; V74-E112 WeakPolarHBondContact CG1-OE2 3.37Å; A75-E112 HydrophobicContact CB-CB 3.97Å; A75-E112 HydrophobicContact CB-CG 3.79Å; T78-E112 WeakPolarHBondContact CB-OE1 3.5Å; T78-E112 PolarHBondContact OG1-OE1 2.9Å; A108-E112 PolarHBondContact O-N 2.86Å; E112-S114 WeakPolarHBondContact O-CB 3.36Å; E112-S114 PolarHBondContact O-N 2.98Å; E112-S114 PolarHBondContact O-OG 3.44Å
113	E	94.6	Very high	96.5	Very high	170 Å²	170	45.2 Å²	45.2	79%	0.794	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	43.6	32.6	175.1	-67	-62.5	158.9	0	0	115.8	L111	L111-E113 VanDerWaalsContact C-N 3.27Å; L111-E113 PolarHBondContact O-N 2.76Å
114	S	94.3	Very high	96.5	Very high	20 Å²	20	45.5 Å²	45.5	14%	0.14	21%	0.211	C	C	.	.			trans	-131	49.7	-175.1	46.7	0	0	0	0	112.3	L71 A109 E112 R116	L71-S114 VanDerWaalsContact CD2-O 3.31Å; L71-S114 WeakPolarHBondContact CD2-O 3.47Å; A109-S114 CarbonylContact O-C 3.58Å; A109-S114 WeakPolarHBondContact O-CA 3.25Å; A109-S114 PolarHBondContact O-N 3.15Å; E112-S114 WeakPolarHBondContact O-CB 3.36Å; E112-S114 PolarHBondContact O-N 2.98Å; E112-S114 PolarHBondContact O-OG 3.44Å; S114-R116 PolarHBondContact O-NH1 3.26Å
115	P	95.9	Very high	96.4	Very high	79 Å²	79	45.8 Å²	45.8	51%	0.513	21%	0.212	S	C	.	.			trans	-60	155.8	-167.1	23.9	-35.4	0	0	0	113.9	A109 K110	A109-P115 WeakPolarHBondContact O-CA 3.4Å; K110-P115 HydrophobicContact CG-CB 4.23Å
116	R	96.5	Very high	96.2	Very high	70 Å²	70	48.8 Å²	48.8	26%	0.264	23%	0.226	S	C	.	.			trans	-129.9	154.2	176.1	-65.1	-64.9	-178.5	-88.3	-0.1	110.4	L69 R70 L71 F106 A109 S114 V121	L69-R116 HydrophobicContact CB-CG 4.5Å; L69-R116 HydrophobicContact CD2-CG 4.4Å; L69-R116 PolarHBondContact O-NE 3.46Å; L69-R116 PolarHBondContact O-NH2 2.85Å; R70-R116 PolarHBondContact O-NH2 2.96Å; L71-R116 HydrophobicContact CD1-CG 4.47Å; L71-R116 HydrophobicContact CD2-CG 4.02Å; L71-R116 HydrophobicContact CG-CG 4.4Å; F106-R116 WeakPolarHBondContact CE2-O 3.02Å; A109-R116 HydrophobicContact CB-CG 4.46Å; S114-R116 PolarHBondContact O-NH1 3.26Å; R116-V121 HydrophobicContact CB-CG2 4.37Å
117	R	96.3	Very high	96	Very high	173 Å²	173	47.8 Å²	47.8	65%	0.653	22%	0.222	S	C	*	.			trans	-73.2	139.8	173	-63.6	175.4	172.6	-175.6	-3.3	108.8	R119 D120 V121	R117-R119 PolarHBondContact O-N 3.49Å; R117-D120 HydrophobicContact CB-CB 4.47Å; R117-D120 WeakPolarHBondContact O-CB 3.4Å; R117-D120 PolarHBondContact O-N 2.83Å; R117-V121 PolarHBondContact O-N 2.97Å
118	I	96.1	Very high	95.9	Very high	24 Å²	24	48.3 Å²	48.3	12%	0.123	23%	0.225	C	C	.	.	H	α-helix	trans	-60.6	-27.8	178.5	-166.1	168.9	0	0	0	113	F106 V121 I122 K150 V153 I154	F106-I118 HydrophobicContact CD2-CB 4.4Å; F106-I118 HydrophobicContact CE2-CB 3.99Å; F106-I118 HydrophobicContact CZ-CB 4.29Å; I118-V121 PolarHBondContact O-N 2.88Å; I118-I122 HydrophobicContact CG1-CD1 4.2Å; I118-I122 WeakPolarHBondContact O-CG1 3.26Å; I118-I122 PolarHBondContact O-N 3.08Å; I118-I122 VanDerWaalsContact O-N 3.08Å; I118-K150 HydrophobicContact CD1-CG 4.16Å; I118-K150 HydrophobicContact CG2-CG 4.31Å; I118-V153 HydrophobicContact CD1-CB 4.18Å; I118-V153 HydrophobicContact CD1-CG1 3.94Å; I118-V153 HydrophobicContact CG1-CG1 4.39Å; I118-I154 HydrophobicContact CD1-CD1 3.98Å; I118-I154 HydrophobicContact CD1-CG1 3.54Å
119	R	95.6	Very high	95.7	Very high	89 Å²	89	52 Å²	52	34%	0.336	24%	0.239	S	C	.	.	H	α-helix	trans	-60.5	-46.9	170.1	-176.5	-172.5	-73.1	168.6	-1.2	111.2	R117 V121 I122 N123 D489	R117-R119 PolarHBondContact O-N 3.49Å; R119-V121 VanDerWaalsContact C-N 3.28Å; R119-V121 PolarHBondContact O-N 2.65Å; R119-I122 PolarHBondContact O-N 3.35Å; R119-N123 WeakPolarHBondContact O-CB 3.38Å; R119-N123 PolarHBondContact O-N 3.4Å; R119-N123 PolarHBondContact O-OD1 3.05Å; R119-D489 IonicContact NH1-OD2 3.33Å
120	D	96.2	Very high	95.4	Very high	18 Å²	18	52.9 Å²	52.9	10%	0.096	24%	0.243	C	C	.	.	H	α-helix	trans	-59.8	-41.6	-179	-56.1	2.1	0	0	0	110.3	L69 R117 V124 R492	L69-D120 HydrophobicContact CD2-CB 3.95Å; R117-D120 HydrophobicContact CB-CB 4.47Å; R117-D120 WeakPolarHBondContact O-CB 3.4Å; R117-D120 PolarHBondContact O-N 2.83Å; D120-V124 WeakPolarHBondContact O-CB 3.2Å; D120-V124 WeakPolarHBondContact O-CG2 3.48Å; D120-V124 PolarHBondContact O-N 2.86Å; D120-R492 IonicContact OD1-NH1 3.84Å; D120-R492 PolarHBondContact OD1-NH1 2.95Å; D120-R492 IonicContact OD2-CZ 2.74Å; D120-R492 IonicContact OD2-NH1 3.8Å; D120-R492 PolarHBondContact OD2-NH1 3.48Å; D120-R492 IonicContact OD2-NH2 3.62Å
121	V	97.4	Very high	95.2	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.006	25%	0.247	C	C	.	.	H	α-helix	trans	-63	-50.1	176	-177.2	0	0	0	0	111.4	L69 M102 I105 F106 R116 R117 I118 R119 N123 V124 F125	L69-V121 HydrophobicContact CD1-CG2 4.01Å; L69-V121 HydrophobicContact CD2-CG2 4.47Å; M102-V121 HydrophobicContact CB-CG1 4.2Å; M102-V121 HydrophobicContact CG-CG1 4.07Å; I105-V121 HydrophobicContact CG2-CG1 3.99Å; F106-V121 HydrophobicContact CB-CG2 4.4Å; F106-V121 HydrophobicContact CD2-CG2 4.26Å; R116-V121 HydrophobicContact CB-CG2 4.37Å; R117-V121 PolarHBondContact O-N 2.97Å; I118-V121 PolarHBondContact O-N 2.88Å; R119-V121 VanDerWaalsContact C-N 3.28Å; R119-V121 PolarHBondContact O-N 2.65Å; V121-N123 PolarHBondContact O-N 2.84Å; V121-V124 PolarHBondContact O-N 3Å; V121-F125 HydrophobicContact CG1-CD2 4.12Å; V121-F125 HydrophobicContact CG1-CE2 4.19Å; V121-F125 WeakPolarHBondContact O-CD2 3.41Å; V121-F125 PolarHBondContact O-N 2.87Å
122	I	97.1	Very high	94.9	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-61.9	-43.3	179.5	-68.5	166.2	0	0	0	111.1	M102 I118 R119 V124 F125 H126 Y146 L149 K150	M102-I122 HydrophobicContact SD-CG1 4.14Å; I118-I122 HydrophobicContact CG1-CD1 4.2Å; I118-I122 WeakPolarHBondContact O-CG1 3.26Å; I118-I122 PolarHBondContact O-N 3.08Å; I118-I122 VanDerWaalsContact O-N 3.08Å; R119-I122 PolarHBondContact O-N 3.35Å; I122-V124 VanDerWaalsContact C-N 3.31Å; I122-V124 PolarHBondContact O-N 3.44Å; I122-F125 PolarHBondContact O-N 2.83Å; I122-H126 WeakPolarHBondContact O-CB 3.42Å; I122-H126 PolarHBondContact O-N 2.87Å; I122-Y146 HydrophobicContact CB-CE2 4.33Å; I122-Y146 HydrophobicContact CD1-CD2 4.49Å; I122-Y146 HydrophobicContact CD1-CE2 3.95Å; I122-Y146 HydrophobicContact CG2-CD2 3.98Å; I122-Y146 HydrophobicContact CG2-CE2 3.95Å; I122-L149 HydrophobicContact CG2-CD2 3.83Å; I122-K150 HydrophobicContact CD1-CB 3.98Å
123	N	95.7	Very high	94.6	Very high	53 Å²	53	52.7 Å²	52.7	28%	0.283	25%	0.245	S	C	.	.	H	α-helix	trans	-61.1	-39.4	177.6	-71.3	8.4	0	0	0	111.9	R119 V121 H127 V140	R119-N123 WeakPolarHBondContact O-CB 3.38Å; R119-N123 PolarHBondContact O-N 3.4Å; R119-N123 PolarHBondContact O-OD1 3.05Å; V121-N123 PolarHBondContact O-N 2.84Å; N123-H127 WeakPolarHBondContact O-CB 3.18Å; N123-H127 PolarHBondContact O-N 2.75Å; N123-V140 HydrophobicContact CB-CG2 4.44Å; N123-V140 WeakPolarHBondContact OD1-CG2 3.32Å
124	V	96.3	Very high	94.3	Very high	5 Å²	5	54 Å²	54	3%	0.03	25%	0.247	C	C	.	.	H	α-helix	trans	-68.9	-43.8	177.4	163.6	0	0	0	0	111.9	L68 L69 D120 V121 I122 H126 H127 I128	L68-V124 HydrophobicContact CB-CG1 3.73Å; L68-V124 HydrophobicContact CB-CG2 4.07Å; L68-V124 HydrophobicContact CD1-CG1 4.01Å; L69-V124 HydrophobicContact CD2-CB 4.47Å; L69-V124 HydrophobicContact CD2-CG2 3.92Å; L69-V124 HydrophobicContact CG-CB 4.44Å; L69-V124 HydrophobicContact CG-CG1 4.41Å; L69-V124 HydrophobicContact CG-CG2 4.13Å; D120-V124 WeakPolarHBondContact O-CB 3.2Å; D120-V124 WeakPolarHBondContact O-CG2 3.48Å; D120-V124 PolarHBondContact O-N 2.86Å; V121-V124 PolarHBondContact O-N 3Å; I122-V124 VanDerWaalsContact C-N 3.31Å; I122-V124 PolarHBondContact O-N 3.44Å; V124-H126 PolarHBondContact O-N 3.02Å; V124-H127 PolarHBondContact O-N 3.32Å; V124-I128 HydrophobicContact CG1-CD1 3.87Å; V124-I128 VanDerWaalsContact O-CG1 3.31Å; V124-I128 WeakPolarHBondContact O-CG1 3.38Å; V124-I128 PolarHBondContact O-N 3.3Å
125	F	96.6	Very high	94	Very high	6 Å²	6	58.6 Å²	58.6	3%	0.026	27%	0.265	C	S	.	.	H	α-helix	trans	-64.4	-39.6	175.7	-89.2	-104.9	0	0	0	112.3	L61 S65 E98 A101 M102 I105 V121 I122 I128 R129	L61-F125 HydrophobicContact CB-CE1 4Å; L61-F125 HydrophobicContact CB-CZ 4.43Å; S65-F125 VanDerWaalsContact OG-CE2 3.25Å; S65-F125 WeakPolarHBondContact OG-CE2 3.33Å; E98-F125 HydrophobicContact CG-CD1 3.9Å; E98-F125 HydrophobicContact CG-CE1 4.33Å; A101-F125 HydrophobicContact CB-CE1 3.78Å; A101-F125 HydrophobicContact CB-CZ 3.85Å; M102-F125 HydrophobicContact CB-CE2 4.43Å; M102-F125 HydrophobicContact CE-CB 4.22Å; M102-F125 HydrophobicContact CE-CD1 4.17Å; M102-F125 HydrophobicContact CE-CG 4.27Å; M102-F125 HydrophobicContact CG-CB 4.09Å; M102-F125 HydrophobicContact CG-CD1 3.62Å; M102-F125 HydrophobicContact CG-CD2 3.43Å; M102-F125 VanDerWaalsContact CG-CD2 3.43Å; M102-F125 HydrophobicContact CG-CE1 3.82Å; M102-F125 HydrophobicContact CG-CE2 3.63Å; M102-F125 HydrophobicContact CG-CG 3.42Å; M102-F125 VanDerWaalsContact CG-CG 3.42Å; M102-F125 HydrophobicContact CG-CZ 3.83Å; M102-F125 HydrophobicContact SD-CB 3.99Å; M102-F125 HydrophobicContact SD-CD1 4.4Å; M102-F125 HydrophobicContact SD-CD2 4.36Å; M102-F125 HydrophobicContact SD-CG 4Å; I105-F125 HydrophobicContact CG2-CE2 4.05Å; V121-F125 HydrophobicContact CG1-CD2 4.12Å; V121-F125 HydrophobicContact CG1-CE2 4.19Å; V121-F125 WeakPolarHBondContact O-CD2 3.41Å; V121-F125 PolarHBondContact O-N 2.87Å; I122-F125 PolarHBondContact O-N 2.83Å; F125-I128 PolarHBondContact O-N 2.93Å; F125-R129 WeakPolarHBondContact O-CB 3.47Å; F125-R129 PolarHBondContact O-N 2.96Å
126	H	94.8	Very high	93.4	Very high	64 Å²	64	60.4 Å²	60.4	30%	0.296	28%	0.275	S	S	.	.	H	α-helix	trans	-59.1	-46.1	172.6	-174.8	-101.6	0	0	0	111.8	I122 V124 R129 Q130 T138 V140	I122-H126 WeakPolarHBondContact O-CB 3.42Å; I122-H126 PolarHBondContact O-N 2.87Å; V124-H126 PolarHBondContact O-N 3.02Å; H126-R129 PolarHBondContact O-N 2.95Å; H126-Q130 VanDerWaalsContact CE1-CD 3.43Å; H126-Q130 PolarHBondContact CE1-NE2 2.83Å; H126-Q130 PolarHBondContact ND1-OE1 3.05Å; H126-Q130 WeakPolarHBondContact O-CG 3.41Å; H126-Q130 PolarHBondContact O-N 2.97Å; H126-T138 PolarHBondContact CE1-O 3.04Å; H126-T138 VanDerWaalsContact CE1-O 3.3Å; H126-T138 PolarHBondContact ND1-O 3.43Å; H126-V140 HydrophobicContact CB-CG2 3.59Å
127	H	94.4	Very high	92.9	Very high	7 Å²	7	59.3 Å²	59.3	3%	0.032	28%	0.277	C	S	.	.	H	α-helix	trans	-60.9	-47.2	176.6	-173.5	77.1	0	0	0	112.4	N123 V124 R129 Q130 V131 P137 N497 T500	N123-H127 WeakPolarHBondContact O-CB 3.18Å; N123-H127 PolarHBondContact O-N 2.75Å; V124-H127 PolarHBondContact O-N 3.32Å; H127-R129 VanDerWaalsContact C-N 3.31Å; H127-R129 PolarHBondContact O-N 3.47Å; H127-Q130 PolarHBondContact O-N 3.37Å; H127-V131 WeakPolarHBondContact O-CG2 3.48Å; H127-V131 PolarHBondContact O-N 3.42Å; H127-P137 WeakPolarHBondContact CE1-CB 3.3Å; H127-P137 WeakPolarHBondContact CE1-CG 3.3Å; H127-N497 PolarHBondContact CE1-OD1 2.84Å; H127-T500 PolarHBondContact CE1-OG1 3.13Å; H127-T500 WeakPolarHBondContact NE2-CB 3.45Å; H127-T500 WeakPolarHBondContact NE2-CG2 3.41Å; H127-T500 PolarHBondContact NE2-OG1 2.65Å
128	I	94.7	Very high	92.5	Very high	19 Å²	19	54.2 Å²	54.2	10%	0.097	27%	0.265	C	S	.	.	H	α-helix	trans	-57.8	-45.4	176.7	-67.9	163.3	0	0	0	110.5	L61 D64 L68 V124 F125 V131 R132	L61-I128 HydrophobicContact CD2-CG2 3.68Å; D64-I128 HydrophobicContact CB-CD1 4.08Å; L68-I128 HydrophobicContact CD1-CD1 4.13Å; L68-I128 HydrophobicContact CD1-CG1 3.79Å; V124-I128 HydrophobicContact CG1-CD1 3.87Å; V124-I128 VanDerWaalsContact O-CG1 3.31Å; V124-I128 WeakPolarHBondContact O-CG1 3.38Å; V124-I128 PolarHBondContact O-N 3.3Å; F125-I128 PolarHBondContact O-N 2.93Å; I128-V131 PolarHBondContact O-N 3.43Å; I128-R132 WeakPolarHBondContact O-CB 3.4Å; I128-R132 PolarHBondContact O-N 3.26Å
129	R	93	Very high	92	Very high	77 Å²	77	57.2 Å²	57.2	29%	0.291	29%	0.286	S	S	.	.	H	α-helix	trans	-62.5	-43.6	178	-169.1	171.4	-176.2	130.8	8.4	112	E98 F125 H126 H127 R132 D133 E272	E98-R129 IonicContact OE1-NH1 3.74Å; E98-R129 IonicContact OE2-CZ 3.77Å; E98-R129 IonicContact OE2-NH1 2.69Å; E98-R129 PolarHBondContact OE2-NH1 3.34Å; F125-R129 WeakPolarHBondContact O-CB 3.47Å; F125-R129 PolarHBondContact O-N 2.96Å; H126-R129 PolarHBondContact O-N 2.95Å; H127-R129 VanDerWaalsContact C-N 3.31Å; H127-R129 PolarHBondContact O-N 3.47Å; R129-R132 PolarHBondContact O-N 2.95Å; R129-D133 VanDerWaalsContact O-CB 3.29Å; R129-D133 WeakPolarHBondContact O-CB 3.38Å; R129-D133 PolarHBondContact O-N 2.67Å; R129-E272 IonicContact CZ-OE2 3.54Å; R129-E272 IonicContact NH1-OE2 3.84Å; R129-E272 IonicContact NH2-OE1 3.78Å; R129-E272 IonicContact NH2-OE2 3.53Å; R129-E272 PolarHBondContact NH2-OE2 3.05Å
130	Q	91.9	Very high	91.5	Very high	20 Å²	20	54.2 Å²	54.2	9%	0.093	28%	0.277	C	S	.	.	H	α-helix	trans	-63	-44.3	176.5	-72.6	-179.2	-37.4	0	0	112.7	H126 H127 D133 K134 K135 T138	H126-Q130 VanDerWaalsContact CE1-CD 3.43Å; H126-Q130 PolarHBondContact CE1-NE2 2.83Å; H126-Q130 PolarHBondContact ND1-OE1 3.05Å; H126-Q130 WeakPolarHBondContact O-CG 3.41Å; H126-Q130 PolarHBondContact O-N 2.97Å; H127-Q130 PolarHBondContact O-N 3.37Å; Q130-D133 CarbonylContact O-C 3.56Å; Q130-D133 PolarHBondContact O-N 2.85Å; Q130-K134 PolarHBondContact O-N 2.7Å; Q130-K135 HydrophobicContact CB-CB 4.38Å; Q130-K135 PolarHBondContact O-N 3.13Å; Q130-T138 PolarHBondContact NE2-OG1 3.05Å; Q130-T138 PolarHBondContact OE1-O 3.33Å
131	V	91.6	Very high	91	Very high	72 Å²	72	59.9 Å²	59.9	44%	0.436	31%	0.306	S	S	.	.	H	α-helix	trans	-63.2	-43.1	176.9	171.5	0	0	0	0	111.2	H127 I128 K134	H127-V131 WeakPolarHBondContact O-CG2 3.48Å; H127-V131 PolarHBondContact O-N 3.42Å; I128-V131 PolarHBondContact O-N 3.43Å; V131-K134 PolarHBondContact O-N 3.16Å; V131-K134 VanDerWaalsContact O-N 3.12Å
132	R	88.4	Confident	90.5	Very high	76 Å²	76	64.8 Å²	64.8	29%	0.287	33%	0.332	S	S	.	.	H	α-helix	trans	-62.4	-42.7	175.9	-170.9	-171.8	70.4	-174.5	11.1	112.1	I128 R129 K134 E272	I128-R132 WeakPolarHBondContact O-CB 3.4Å; I128-R132 PolarHBondContact O-N 3.26Å; R129-R132 PolarHBondContact O-N 2.95Å; R132-K134 PolarHBondContact O-N 2.92Å; R132-E272 IonicContact CZ-OE1 3.89Å; R132-E272 IonicContact NH1-OE1 2.7Å; R132-E272 IonicContact NH2-OE1 2.77Å; R132-E272 PolarHBondContact NH2-OE1 3.25Å
133	D	88.3	Confident	90.2	Very high	59 Å²	59	67.6 Å²	67.6	32%	0.316	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	2.1	176.3	-68.2	8.4	0	0	0	113.2	R129 Q130 K135	R129-D133 VanDerWaalsContact O-CB 3.29Å; R129-D133 WeakPolarHBondContact O-CB 3.38Å; R129-D133 PolarHBondContact O-N 2.67Å; Q130-D133 CarbonylContact O-C 3.56Å; Q130-D133 PolarHBondContact O-N 2.85Å; D133-K135 HydrophobicContact CB-CD 3.69Å; D133-K135 HydrophobicContact CB-CG 3.99Å; D133-K135 PolarHBondContact O-N 3.32Å; D133-K135 IonicContact OD2-NZ 3.99Å; D133-K135 PolarHBondContact OD2-NZ 2.85Å
134	K	88.2	Confident	90.1	Very high	197 Å²	197	71 Å²	71	86%	0.857	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	23.5	-175.3	-54.1	176.6	-175.2	171.9	0	114.4	Q130 V131 R132	Q130-K134 PolarHBondContact O-N 2.7Å; V131-K134 PolarHBondContact O-N 3.16Å; V131-K134 VanDerWaalsContact O-N 3.12Å; R132-K134 PolarHBondContact O-N 2.92Å
135	K	88	Confident	89.9	Confident	118 Å²	118	74.4 Å²	74.4	51%	0.513	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-83	153.9	178.1	-68.1	164.9	-174.6	160.4	0	110.2	Q130 D133	Q130-K135 HydrophobicContact CB-CB 4.38Å; Q130-K135 PolarHBondContact O-N 3.13Å; D133-K135 HydrophobicContact CB-CD 3.69Å; D133-K135 HydrophobicContact CB-CG 3.99Å; D133-K135 PolarHBondContact O-N 3.32Å; D133-K135 IonicContact OD2-NZ 3.99Å; D133-K135 PolarHBondContact OD2-NZ 2.85Å
136	T	85.2	Confident	89.8	Confident	116 Å²	116	75.2 Å²	75.2	71%	0.712	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-61.8	130.8	166.2	39.7	0	0	0	0	109.3	T138	T136-T138 PolarHBondContact O-N 3.5Å
137	P	85.1	Confident	89.8	Confident	47 Å²	47	74.2 Å²	74.2	31%	0.305	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-59.8	129.9	175.2	-27.4	36.5	0	0	0	111.4	H127 Y493	H127-P137 WeakPolarHBondContact CE1-CB 3.3Å; H127-P137 WeakPolarHBondContact CE1-CG 3.3Å; P137-Y493 PolarHBondContact O-OH 2.85Å
138	T	87.6	Confident	89.9	Confident	66 Å²	66	78 Å²	78	41%	0.405	41%	0.409	S	S	.	.			trans	-126.8	147.9	172.2	66.9	0	0	0	0	110.9	H126 Q130 T136 Y493	H126-T138 PolarHBondContact CE1-O 3.04Å; H126-T138 VanDerWaalsContact CE1-O 3.3Å; H126-T138 PolarHBondContact ND1-O 3.43Å; Q130-T138 PolarHBondContact NE2-OG1 3.05Å; Q130-T138 PolarHBondContact OE1-O 3.33Å; T136-T138 PolarHBondContact O-N 3.5Å; T138-Y493 VanDerWaalsContact C-OH 3.27Å; T138-Y493 WeakPolarHBondContact CA-OH 3.35Å; T138-Y493 PolarHBondContact N-OH 3.07Å; T138-Y493 VanDerWaalsContact N-OH 3.15Å
139	P	85.8	Confident	90	Very high	87 Å²	87	79.3 Å²	79.3	57%	0.565	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-63.6	146.9	176.1	27.5	-35.4	0	0	0	111.3	I141	P139-I141 PolarHBondContact O-N 3.48Å
140	V	85.4	Confident	90.2	Very high	26 Å²	26	79.5 Å²	79.5	16%	0.158	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-62.7	123.7	175.7	177	0	0	0	0	110	N123 H126 Y146	N123-V140 HydrophobicContact CB-CG2 4.44Å; N123-V140 WeakPolarHBondContact OD1-CG2 3.32Å; H126-V140 HydrophobicContact CB-CG2 3.59Å; V140-Y146 HydrophobicContact CG1-CD2 3.67Å; V140-Y146 HydrophobicContact CG1-CE2 4.37Å; V140-Y146 HydrophobicContact CG1-CG 4.37Å
141	I	84.9	Confident	90.4	Very high	137 Å²	137	82.4 Å²	82.4	70%	0.703	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-72.3	128.8	173.7	-53.9	178.5	0	0	0	108.3	P139 D143 Y146	P139-I141 PolarHBondContact O-N 3.48Å; I141-D143 HydrophobicContact CG2-CB 4.2Å; I141-D143 PolarHBondContact O-N 3.01Å; I141-Y146 WeakPolarHBondContact O-CB 3.18Å
142	L	88.5	Confident	90.7	Very high	104 Å²	104	83 Å²	83	55%	0.545	43%	0.433	S	S	.	.			trans	-86.3	60.3	-175.8	-62.5	179.8	0	0	0	111.7	Y146	L142-Y146 HydrophobicContact CD2-CD1 3.85Å; L142-Y146 HydrophobicContact CD2-CD2 4.21Å; L142-Y146 HydrophobicContact CD2-CE1 3.75Å; L142-Y146 HydrophobicContact CD2-CE2 4.11Å; L142-Y146 HydrophobicContact CD2-CG 4.08Å
143	D	89.7	Confident	91.2	Very high	64 Å²	64	79.3 Å²	79.3	34%	0.342	42%	0.419	S	S	.	.	S	Bend	trans	-98.6	-165.9	-174.8	82.9	-44.3	0	0	0	113.4	I141 S145 Y146 S147	I141-D143 HydrophobicContact CG2-CB 4.2Å; I141-D143 PolarHBondContact O-N 3.01Å; D143-S145 VanDerWaalsContact C-N 3.35Å; D143-S145 VanDerWaalsContact CG-OG 3.26Å; D143-S145 WeakPolarHBondContact OD1-CA 2.99Å; D143-S145 WeakPolarHBondContact OD1-CB 3.47Å; D143-S145 PolarHBondContact OD1-N 3.45Å; D143-S145 VanDerWaalsContact OD1-N 3.09Å; D143-S145 PolarHBondContact OD1-OG 2.98Å; D143-S145 WeakPolarHBondContact OD2-CB 3.4Å; D143-S145 PolarHBondContact OD2-N 3.45Å; D143-S145 PolarHBondContact OD2-OG 3.36Å; D143-S145 VanDerWaalsContact OD2-OG 3.13Å; D143-Y146 PolarHBondContact OD1-N 3.21Å; D143-S147 PolarHBondContact O-N 3.12Å; D143-S147 VanDerWaalsContact O-N 3.14Å; D143-S147 PolarHBondContact O-OG 3.48Å
144	Q	93.1	Very high	91.6	Very high	125 Å²	125	78.8 Å²	78.8	58%	0.584	42%	0.416	S	S	*	.	H	α-helix	trans	-68.2	-31.5	172.7	-171.1	57.8	42.2	0	0	112.4	S147 N148	Q144-S147 PolarHBondContact O-N 3.35Å; Q144-N148 PolarHBondContact NE2-OD1 3.11Å; Q144-N148 WeakPolarHBondContact O-CB 3.29Å; Q144-N148 PolarHBondContact O-N 2.97Å; Q144-N148 PolarHBondContact O-ND2 3.42Å
145	S	92.3	Very high	92.1	Very high	75 Å²	75	74 Å²	74	52%	0.524	40%	0.395	S	S	.	.	H	α-helix	trans	-64.1	-45.1	174.8	87.7	0	0	0	0	111.8	D143 S147 N148 L149	D143-S145 VanDerWaalsContact C-N 3.35Å; D143-S145 VanDerWaalsContact CG-OG 3.26Å; D143-S145 WeakPolarHBondContact OD1-CA 2.99Å; D143-S145 WeakPolarHBondContact OD1-CB 3.47Å; D143-S145 PolarHBondContact OD1-N 3.45Å; D143-S145 VanDerWaalsContact OD1-N 3.09Å; D143-S145 PolarHBondContact OD1-OG 2.98Å; D143-S145 WeakPolarHBondContact OD2-CB 3.4Å; D143-S145 PolarHBondContact OD2-N 3.45Å; D143-S145 PolarHBondContact OD2-OG 3.36Å; D143-S145 VanDerWaalsContact OD2-OG 3.13Å; S145-S147 VanDerWaalsContact C-N 3.32Å; S145-S147 PolarHBondContact O-N 3.47Å; S145-N148 PolarHBondContact O-N 3.37Å; S145-L149 WeakPolarHBondContact O-CB 3.2Å; S145-L149 PolarHBondContact O-N 3.09Å
146	Y	94.9	Very high	92.5	Very high	24 Å²	24	68.5 Å²	68.5	9%	0.094	37%	0.371	C	S	.	.	H	α-helix	trans	-58.9	-43.6	172.2	168.1	-96.6	0	0	0	111.5	I122 V140 I141 L142 D143 N148 L149 K150	I122-Y146 HydrophobicContact CB-CE2 4.33Å; I122-Y146 HydrophobicContact CD1-CD2 4.49Å; I122-Y146 HydrophobicContact CD1-CE2 3.95Å; I122-Y146 HydrophobicContact CG2-CD2 3.98Å; I122-Y146 HydrophobicContact CG2-CE2 3.95Å; V140-Y146 HydrophobicContact CG1-CD2 3.67Å; V140-Y146 HydrophobicContact CG1-CE2 4.37Å; V140-Y146 HydrophobicContact CG1-CG 4.37Å; I141-Y146 WeakPolarHBondContact O-CB 3.18Å; L142-Y146 HydrophobicContact CD2-CD1 3.85Å; L142-Y146 HydrophobicContact CD2-CD2 4.21Å; L142-Y146 HydrophobicContact CD2-CE1 3.75Å; L142-Y146 HydrophobicContact CD2-CE2 4.11Å; L142-Y146 HydrophobicContact CD2-CG 4.08Å; D143-Y146 PolarHBondContact OD1-N 3.21Å; Y146-N148 PolarHBondContact O-N 2.96Å; Y146-L149 PolarHBondContact O-N 3.35Å; Y146-K150 VanDerWaalsContact O-CB 3.32Å; Y146-K150 WeakPolarHBondContact O-CB 3.48Å; Y146-K150 PolarHBondContact O-N 3.45Å
147	S	95.7	Very high	93.1	Very high	43 Å²	43	63.9 Å²	63.9	30%	0.301	34%	0.342	S	S	.	.	H	α-helix	trans	-64.6	-39	178.1	-61.4	0	0	0	0	112.2	D143 Q144 S145 N151	D143-S147 PolarHBondContact O-N 3.12Å; D143-S147 VanDerWaalsContact O-N 3.14Å; D143-S147 PolarHBondContact O-OG 3.48Å; Q144-S147 PolarHBondContact O-N 3.35Å; S145-S147 VanDerWaalsContact C-N 3.32Å; S145-S147 PolarHBondContact O-N 3.47Å; S147-N151 WeakPolarHBondContact O-CB 3.39Å; S147-N151 VanDerWaalsContact O-CG 3.3Å; S147-N151 PolarHBondContact O-N 3Å; S147-N151 VanDerWaalsContact O-N 3.16Å; S147-N151 PolarHBondContact O-ND2 3.22Å; S147-N151 VanDerWaalsContact O-ND2 3.11Å
148	N	96.3	Very high	93.7	Very high	85 Å²	85	68.9 Å²	68.9	46%	0.455	35%	0.354	S	S	.	.	H	α-helix	trans	-66.1	-46.7	173.4	-71	-16.7	0	0	0	111.5	Q144 S145 Y146 N151 Q152	Q144-N148 PolarHBondContact NE2-OD1 3.11Å; Q144-N148 WeakPolarHBondContact O-CB 3.29Å; Q144-N148 PolarHBondContact O-N 2.97Å; Q144-N148 PolarHBondContact O-ND2 3.42Å; S145-N148 PolarHBondContact O-N 3.37Å; Y146-N148 PolarHBondContact O-N 2.96Å; N148-N151 CarbonylContact O-C 3.56Å; N148-N151 WeakPolarHBondContact O-CB 3.37Å; N148-N151 PolarHBondContact O-N 3.29Å; N148-N151 VanDerWaalsContact O-N 3.14Å; N148-Q152 WeakPolarHBondContact O-CG 3.45Å; N148-Q152 PolarHBondContact O-N 3Å
149	L	96.5	Very high	94.2	Very high	47 Å²	47	71.1 Å²	71.1	25%	0.246	36%	0.355	C	S	.	.	H	α-helix	trans	-59.9	-49.2	178.4	177.6	58.3	0	0	0	111.8	H99 M102 I122 S145 Y146 N151 Q152 V153	H99-L149 VanDerWaalsContact CD2-CD1 3.45Å; H99-L149 WeakPolarHBondContact CD2-CD1 3.31Å; H99-L149 WeakPolarHBondContact NE2-CD1 3.21Å; M102-L149 HydrophobicContact CE-CD1 4.14Å; I122-L149 HydrophobicContact CG2-CD2 3.83Å; S145-L149 WeakPolarHBondContact O-CB 3.2Å; S145-L149 PolarHBondContact O-N 3.09Å; Y146-L149 PolarHBondContact O-N 3.35Å; L149-N151 PolarHBondContact O-N 2.68Å; L149-Q152 WeakPolarHBondContact O-CA 3.35Å; L149-Q152 PolarHBondContact O-N 3Å; L149-V153 HydrophobicContact CD1-CG2 4.48Å; L149-V153 PolarHBondContact O-N 2.83Å
150	K	97	Very high	94.7	Very high	82 Å²	82	67 Å²	67	36%	0.357	33%	0.328	S	S	.	.	H	α-helix	trans	-52.4	-44.4	172.6	-179.3	-167.7	172.5	-165.7	0	111.4	I118 I122 Y146 V153 I154	I118-K150 HydrophobicContact CD1-CG 4.16Å; I118-K150 HydrophobicContact CG2-CG 4.31Å; I122-K150 HydrophobicContact CD1-CB 3.98Å; Y146-K150 VanDerWaalsContact O-CB 3.32Å; Y146-K150 WeakPolarHBondContact O-CB 3.48Å; Y146-K150 PolarHBondContact O-N 3.45Å; K150-V153 PolarHBondContact O-N 3.17Å; K150-I154 HydrophobicContact CG-CD1 4.03Å; K150-I154 VanDerWaalsContact O-CG1 3.29Å; K150-I154 WeakPolarHBondContact O-CG1 3.36Å; K150-I154 PolarHBondContact O-N 3.43Å; K150-I154 VanDerWaalsContact O-N 3.09Å
151	N	97.3	Very high	95.2	Very high	80 Å²	80	67.3 Å²	67.3	43%	0.428	33%	0.329	S	S	.	.	H	α-helix	trans	-68.5	-30.2	176.9	-75.8	-31	0	0	0	113.2	S147 N148 L149 K155	S147-N151 WeakPolarHBondContact O-CB 3.39Å; S147-N151 VanDerWaalsContact O-CG 3.3Å; S147-N151 PolarHBondContact O-N 3Å; S147-N151 VanDerWaalsContact O-N 3.16Å; S147-N151 PolarHBondContact O-ND2 3.22Å; S147-N151 VanDerWaalsContact O-ND2 3.11Å; N148-N151 CarbonylContact O-C 3.56Å; N148-N151 WeakPolarHBondContact O-CB 3.37Å; N148-N151 PolarHBondContact O-N 3.29Å; N148-N151 VanDerWaalsContact O-N 3.14Å; L149-N151 PolarHBondContact O-N 2.68Å; N151-K155 WeakPolarHBondContact O-CB 3.38Å; N151-K155 WeakPolarHBondContact O-CD 3.3Å; N151-K155 WeakPolarHBondContact O-CG 2.99Å; N151-K155 PolarHBondContact O-N 2.88Å; N151-K155 VanDerWaalsContact O-N 3.12Å
152	Q	97.3	Very high	95.6	Very high	84 Å²	84	67.9 Å²	67.9	39%	0.393	33%	0.327	S	S	.	.	H	α-helix	trans	-71.5	-41.8	172.4	-63.2	-63.6	14.7	0	0	112.1	N148 L149 I154 K155 A156	N148-Q152 WeakPolarHBondContact O-CG 3.45Å; N148-Q152 PolarHBondContact O-N 3Å; L149-Q152 WeakPolarHBondContact O-CA 3.35Å; L149-Q152 PolarHBondContact O-N 3Å; Q152-I154 PolarHBondContact O-N 3.28Å; Q152-K155 CarbonylContact O-C 3.37Å; Q152-K155 WeakPolarHBondContact O-CA 3.41Å; Q152-K155 WeakPolarHBondContact O-CB 3.37Å; Q152-K155 PolarHBondContact O-N 3.35Å; Q152-A156 WeakPolarHBondContact O-CB 3.38Å; Q152-A156 PolarHBondContact O-N 3.19Å
153	V	97.8	Very high	95.8	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.7	-43.3	175.8	177.2	0	0	0	0	111	M102 A103 I118 L149 K150 K155 A156 E157	M102-V153 HydrophobicContact CB-CG1 4.1Å; M102-V153 HydrophobicContact CB-CG2 3.9Å; M102-V153 HydrophobicContact SD-CG2 3.86Å; A103-V153 HydrophobicContact CB-CG1 4.39Å; I118-V153 HydrophobicContact CD1-CB 4.18Å; I118-V153 HydrophobicContact CD1-CG1 3.94Å; I118-V153 HydrophobicContact CG1-CG1 4.39Å; L149-V153 HydrophobicContact CD1-CG2 4.48Å; L149-V153 PolarHBondContact O-N 2.83Å; K150-V153 PolarHBondContact O-N 3.17Å; V153-K155 VanDerWaalsContact C-N 3.25Å; V153-K155 PolarHBondContact O-N 2.77Å; V153-A156 PolarHBondContact O-N 2.86Å; V153-E157 PolarHBondContact O-N 3.31Å
154	I	97.6	Very high	95.8	Very high	48 Å²	48	63.8 Å²	63.8	25%	0.246	30%	0.303	C	S	.	.	H	α-helix	trans	-67.8	-22.9	175.2	-61.6	165.6	0	0	0	112.2	I118 K150 Q152 R158	I118-I154 HydrophobicContact CD1-CD1 3.98Å; I118-I154 HydrophobicContact CD1-CG1 3.54Å; K150-I154 HydrophobicContact CG-CD1 4.03Å; K150-I154 VanDerWaalsContact O-CG1 3.29Å; K150-I154 WeakPolarHBondContact O-CG1 3.36Å; K150-I154 PolarHBondContact O-N 3.43Å; K150-I154 VanDerWaalsContact O-N 3.09Å; Q152-I154 PolarHBondContact O-N 3.28Å; I154-R158 PolarHBondContact O-NE 2.85Å; I154-R158 PolarHBondContact O-NH2 3.13Å
155	K	97.7	Very high	95.6	Very high	97 Å²	97	60.6 Å²	60.6	42%	0.422	30%	0.303	S	S	.	.	H	α-helix	trans	-80	-38.6	170.4	-75.4	167	-176.7	177.9	0	111.9	N151 Q152 V153 R159	N151-K155 WeakPolarHBondContact O-CB 3.38Å; N151-K155 WeakPolarHBondContact O-CD 3.3Å; N151-K155 WeakPolarHBondContact O-CG 2.99Å; N151-K155 PolarHBondContact O-N 2.88Å; N151-K155 VanDerWaalsContact O-N 3.12Å; Q152-K155 CarbonylContact O-C 3.37Å; Q152-K155 WeakPolarHBondContact O-CA 3.41Å; Q152-K155 WeakPolarHBondContact O-CB 3.37Å; Q152-K155 PolarHBondContact O-N 3.35Å; V153-K155 VanDerWaalsContact C-N 3.25Å; V153-K155 PolarHBondContact O-N 2.77Å; K155-R159 WeakPolarHBondContact O-CG 3.46Å; K155-R159 PolarHBondContact O-N 2.93Å
156	A	98.1	Very high	95.5	Very high	2 Å²	2	64.1 Å²	64.1	2%	0.017	31%	0.31	C	S	.	.	H	α-helix	trans	-65.1	-47	177.7	0	0	0	0	0	111.3	H99 Y100 A103 Q152 V153 R158 R159 V160	H99-A156 HydrophobicContact CB-CB 4.42Å; Y100-A156 HydrophobicContact CD1-CB 3.98Å; Y100-A156 HydrophobicContact CD2-CB 4.23Å; Y100-A156 HydrophobicContact CE1-CB 3.68Å; Y100-A156 HydrophobicContact CE2-CB 3.94Å; Y100-A156 HydrophobicContact CG-CB 4.23Å; A103-A156 HydrophobicContact CB-CB 3.76Å; Q152-A156 WeakPolarHBondContact O-CB 3.38Å; Q152-A156 PolarHBondContact O-N 3.19Å; V153-A156 PolarHBondContact O-N 2.86Å; A156-R158 PolarHBondContact O-N 3.39Å; A156-R159 CarbonylContact O-C 3.55Å; A156-R159 WeakPolarHBondContact O-CA 3.49Å; A156-R159 WeakPolarHBondContact O-CB 3.24Å; A156-R159 PolarHBondContact O-N 3.34Å; A156-V160 WeakPolarHBondContact O-CG2 3.36Å; A156-V160 PolarHBondContact O-N 3.29Å
157	E	97.6	Very high	95.2	Very high	19 Å²	19	65 Å²	65	9%	0.089	32%	0.319	C	S	.	.	H	α-helix	trans	-52.2	-51.2	174.6	170.7	177.6	-116.9	0	0	112.4	A103 F106 K110 V153 R159 V160 L161	A103-E157 HydrophobicContact CB-CB 4.12Å; F106-E157 WeakPolarHBondContact CD1-OE1 3.4Å; F106-E157 VanDerWaalsContact CE1-OE1 3.25Å; F106-E157 WeakPolarHBondContact CE1-OE1 3.4Å; K110-E157 VanDerWaalsContact CE-OE1 3.28Å; K110-E157 WeakPolarHBondContact CE-OE1 3.33Å; K110-E157 IonicContact NZ-OE1 2.75Å; K110-E157 PolarHBondContact NZ-OE1 2.88Å; K110-E157 IonicContact NZ-OE2 2.6Å; V153-E157 PolarHBondContact O-N 3.31Å; E157-R159 PolarHBondContact O-N 2.93Å; E157-V160 PolarHBondContact O-N 3.42Å; E157-L161 HydrophobicContact CG-CD1 4.33Å; E157-L161 PolarHBondContact O-N 3.12Å
158	R	97.5	Very high	94.8	Very high	151 Å²	151	64.1 Å²	64.1	57%	0.57	31%	0.312	S	S	*	.	H	α-helix	trans	-65.6	-25.9	179.6	-73.8	179.9	-70.9	164.1	-3.8	112.9	I154 A156 K162	I154-R158 PolarHBondContact O-NE 2.85Å; I154-R158 PolarHBondContact O-NH2 3.13Å; A156-R158 PolarHBondContact O-N 3.39Å; R158-K162 WeakPolarHBondContact O-CB 3.49Å; R158-K162 PolarHBondContact O-N 2.92Å
159	R	97.1	Very high	94.3	Very high	113 Å²	113	65.6 Å²	65.6	43%	0.426	32%	0.315	S	S	.	.	H	α-helix	trans	-74.4	-46.1	170.9	-72.4	169.4	178.5	-154.2	8.7	111.2	F86 H95 Y100 K155 A156 E157 L161 K162 E163	F86-R159 HydrophobicContact CE2-CB 4.41Å; H95-R159 PolarHBondContact CD2-NH1 3.24Å; H95-R159 VanDerWaalsContact CD2-NH1 3.3Å; H95-R159 PolarHBondContact NE2-NH1 3.22Å; Y100-R159 HydrophobicContact CE1-CB 4.28Å; Y100-R159 WeakPolarHBondContact OH-CD 3.48Å; K155-R159 WeakPolarHBondContact O-CG 3.46Å; K155-R159 PolarHBondContact O-N 2.93Å; A156-R159 CarbonylContact O-C 3.55Å; A156-R159 WeakPolarHBondContact O-CA 3.49Å; A156-R159 WeakPolarHBondContact O-CB 3.24Å; A156-R159 PolarHBondContact O-N 3.34Å; E157-R159 PolarHBondContact O-N 2.93Å; R159-L161 VanDerWaalsContact C-N 3.31Å; R159-L161 PolarHBondContact O-N 3.02Å; R159-K162 PolarHBondContact O-N 3.16Å; R159-K162 VanDerWaalsContact O-N 3.12Å; R159-E163 WeakPolarHBondContact O-CB 3.28Å; R159-E163 VanDerWaalsContact O-CG 3.3Å; R159-E163 WeakPolarHBondContact O-CG 3.35Å; R159-E163 PolarHBondContact O-N 3.05Å
160	V	96.6	Very high	93.5	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-54.1	-48.8	175.4	175	0	0	0	0	110.6	F86 Y100 L107 A156 E157 K162 L164	F86-V160 HydrophobicContact CD2-CB 4.4Å; F86-V160 HydrophobicContact CD2-CG2 3.9Å; F86-V160 HydrophobicContact CE2-CG2 4.34Å; F86-V160 HydrophobicContact CG-CG2 4.14Å; Y100-V160 HydrophobicContact CD1-CG2 3.71Å; Y100-V160 HydrophobicContact CE1-CG2 4.1Å; L107-V160 HydrophobicContact CD2-CG1 4.03Å; A156-V160 WeakPolarHBondContact O-CG2 3.36Å; A156-V160 PolarHBondContact O-N 3.29Å; E157-V160 PolarHBondContact O-N 3.42Å; V160-K162 PolarHBondContact O-N 2.92Å; V160-L164 HydrophobicContact CG1-CD1 3.76Å; V160-L164 HydrophobicContact CG1-CG 4.45Å; V160-L164 WeakPolarHBondContact O-CB 3.2Å; V160-L164 WeakPolarHBondContact O-CG 3.28Å; V160-L164 PolarHBondContact O-N 2.99Å
161	L	95.5	Very high	93	Very high	33 Å²	33	65.3 Å²	65.3	17%	0.173	32%	0.315	C	S	.	.	H	α-helix	trans	-59.9	-42.7	176.6	-73.9	171.2	0	0	0	113.4	L107 E157 R159 G165 F166 V168	L107-L161 HydrophobicContact CD1-CD1 4.42Å; L107-L161 HydrophobicContact CD1-CD2 4.04Å; L107-L161 HydrophobicContact CD1-CG 4.38Å; L107-L161 HydrophobicContact CD2-CD2 3.87Å; L107-L161 HydrophobicContact CD2-CG 4.02Å; E157-L161 HydrophobicContact CG-CD1 4.33Å; E157-L161 PolarHBondContact O-N 3.12Å; R159-L161 VanDerWaalsContact C-N 3.31Å; R159-L161 PolarHBondContact O-N 3.02Å; L161-G165 PolarHBondContact O-N 2.85Å; L161-F166 HydrophobicContact CB-CD1 4.28Å; L161-F166 HydrophobicContact CB-CE1 3.98Å; L161-F166 HydrophobicContact CB-CZ 4.37Å; L161-F166 HydrophobicContact CD1-CE1 4.36Å; L161-F166 HydrophobicContact CD2-CD1 3.98Å; L161-F166 HydrophobicContact CD2-CE1 4.26Å; L161-F166 HydrophobicContact CG-CE1 4.44Å; L161-F166 PolarHBondContact O-N 3.38Å; L161-V168 HydrophobicContact CD2-CG1 3.88Å
162	K	94.2	Very high	92.5	Very high	149 Å²	149	63.1 Å²	63.1	65%	0.648	30%	0.302	S	S	*	.	H	α-helix	trans	-68	-49.9	179.5	-174.4	-168.6	173.3	-163.9	0	112.1	R158 R159 V160 L164 G165	R158-K162 WeakPolarHBondContact O-CB 3.49Å; R158-K162 PolarHBondContact O-N 2.92Å; R159-K162 PolarHBondContact O-N 3.16Å; R159-K162 VanDerWaalsContact O-N 3.12Å; V160-K162 PolarHBondContact O-N 2.92Å; K162-L164 VanDerWaalsContact C-N 3.34Å; K162-L164 PolarHBondContact O-N 2.8Å; K162-G165 PolarHBondContact O-N 3.11Å; K162-G165 VanDerWaalsContact O-N 3.08Å
163	E	92.4	Very high	92.2	Very high	68 Å²	68	59.1 Å²	59.1	32%	0.318	28%	0.283	S	S	.	.	H	α-helix	trans	-71.5	-29.7	-173.6	-59.7	-56	150.7	0	0	112.2	F86 K90 R159 G165	F86-E163 HydrophobicContact CD2-CB 4.23Å; F86-E163 HydrophobicContact CD2-CG 4.48Å; F86-E163 HydrophobicContact CE2-CB 4.17Å; F86-E163 HydrophobicContact CE2-CG 3.92Å; K90-E163 WeakPolarHBondContact CE-OE2 3.25Å; K90-E163 HydrophobicContact CG-CG 4.31Å; K90-E163 IonicContact NZ-OE2 2.78Å; K90-E163 PolarHBondContact NZ-OE2 3.32Å; R159-E163 WeakPolarHBondContact O-CB 3.28Å; R159-E163 VanDerWaalsContact O-CG 3.3Å; R159-E163 WeakPolarHBondContact O-CG 3.35Å; R159-E163 PolarHBondContact O-N 3.05Å; E163-G165 VanDerWaalsContact C-N 3.26Å; E163-G165 PolarHBondContact O-N 3.06Å
164	L	90.2	Very high	91.9	Very high	15 Å²	15	59.9 Å²	59.9	8%	0.079	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	4.6	171	-59.9	-179.8	0	0	0	113.2	L82 R85 V160 K162 F166 C167	L82-L164 HydrophobicContact CB-CD1 4.47Å; L82-L164 HydrophobicContact CD2-CD1 3.53Å; R85-L164 HydrophobicContact CB-CD2 3.63Å; V160-L164 HydrophobicContact CG1-CD1 3.76Å; V160-L164 HydrophobicContact CG1-CG 4.45Å; V160-L164 WeakPolarHBondContact O-CB 3.2Å; V160-L164 WeakPolarHBondContact O-CG 3.28Å; V160-L164 PolarHBondContact O-N 2.99Å; K162-L164 VanDerWaalsContact C-N 3.34Å; K162-L164 PolarHBondContact O-N 2.8Å; L164-F166 PolarHBondContact O-N 3.32Å; L164-F166 VanDerWaalsContact O-N 3.15Å; L164-C167 WeakPolarHBondContact O-CB 3.19Å; L164-C167 PolarHBondContact O-N 3.24Å
165	G	88.8	Confident	91.7	Very high	57 Å²	57	63.5 Å²	63.5	59%	0.588	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	29.9	179.4	0	0	0	0	0	114.3	L161 K162 E163 C167	L161-G165 PolarHBondContact O-N 2.85Å; K162-G165 PolarHBondContact O-N 3.11Å; K162-G165 VanDerWaalsContact O-N 3.08Å; E163-G165 VanDerWaalsContact C-N 3.26Å; E163-G165 PolarHBondContact O-N 3.06Å; G165-C167 PolarHBondContact O-N 3.07Å; G165-C167 VanDerWaalsContact O-N 3.14Å
166	F	89.8	Confident	91.5	Very high	150 Å²	150	60.9 Å²	60.9	66%	0.658	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	8.8	-168.2	-59.7	-95.5	0	0	0	115.9	L161 L164 V168	L161-F166 HydrophobicContact CB-CD1 4.28Å; L161-F166 HydrophobicContact CB-CE1 3.98Å; L161-F166 HydrophobicContact CB-CZ 4.37Å; L161-F166 HydrophobicContact CD1-CE1 4.36Å; L161-F166 HydrophobicContact CD2-CD1 3.98Å; L161-F166 HydrophobicContact CD2-CE1 4.26Å; L161-F166 HydrophobicContact CG-CE1 4.44Å; L161-F166 PolarHBondContact O-N 3.38Å; L164-F166 PolarHBondContact O-N 3.32Å; L164-F166 VanDerWaalsContact O-N 3.15Å; F166-V168 PolarHBondContact O-N 3.19Å
167	C	88	Confident	91.3	Very high	42 Å²	42	60.8 Å²	60.8	28%	0.284	29%	0.29	S	S	.	.			trans	-72.9	73.5	169.3	-176	0	0	0	0	110.3	R85 L164 G165	R85-C167 PolarHBondContact NH1-O 2.57Å; R85-C167 PolarHBondContact NH2-SG 2.75Å; L164-C167 WeakPolarHBondContact O-CB 3.19Å; L164-C167 PolarHBondContact O-N 3.24Å; G165-C167 PolarHBondContact O-N 3.07Å; G165-C167 VanDerWaalsContact O-N 3.14Å
168	V	88.5	Confident	91.2	Very high	25 Å²	25	61.9 Å²	61.9	15%	0.152	30%	0.296	C	S	.	.			trans	-102.6	3	-176	-61.5	0	0	0	0	114.4	L82 L111 L161 F166	L82-V168 HydrophobicContact CD2-CB 3.9Å; L82-V168 HydrophobicContact CD2-CG1 3.93Å; L111-V168 HydrophobicContact CD1-CB 3.75Å; L111-V168 HydrophobicContact CD1-CG2 3.74Å; L111-V168 HydrophobicContact CD2-CG2 3.71Å; L111-V168 HydrophobicContact CG-CG2 4.4Å; L161-V168 HydrophobicContact CD2-CG1 3.88Å; F166-V168 PolarHBondContact O-N 3.19Å
169	H	84	Confident	91	Very high	115 Å²	115	57.9 Å²	57.9	53%	0.532	29%	0.29	S	S	.	.			trans	-71.8	128.3	174.2	-179.9	68.3	0	0	0	110.6	K171	H169-K171 WeakPolarHBondContact NE2-CG 3.2Å
170	A	80.7	Confident	91	Very high	13 Å²	13	53.4 Å²	53.4	11%	0.107	27%	0.274	C	S	.	.			trans	-117.1	124.9	172.7	0	0	0	0	0	109.3	T78 V81	T78-A170 HydrophobicContact CG2-CB 4.48Å; V81-A170 HydrophobicContact CB-CB 4.4Å; V81-A170 HydrophobicContact CG1-CB 4.22Å
171	K	85.7	Confident	90.9	Very high	110 Å²	110	53.4 Å²	53.4	48%	0.478	27%	0.274	S	S	.	.			trans	-89.3	123.3	168.5	-73.5	-171.8	173.8	-171.4	0	108.6	H169 P214	H169-K171 WeakPolarHBondContact NE2-CG 3.2Å; K171-P214 HydrophobicContact CB-CG 3.75Å; K171-P214 WeakPolarHBondContact O-CG 3.34Å
172	H	87.2	Confident	90.8	Very high	34 Å²	34	56 Å²	56	16%	0.157	29%	0.285	C	S	.	.			trans	-104.1	131.1	-175.3	-67.6	-59.1	0	0	0	112.1	A77 T78 H174	A77-H172 VanDerWaalsContact C-CE1 3.48Å; A77-H172 VanDerWaalsContact CB-CE1 3.43Å; A77-H172 WeakPolarHBondContact CB-CE1 3.22Å; T78-H172 PolarHBondContact N-CE1 3.49Å; T78-H172 PolarHBondContact N-NE2 3Å; T78-H172 PolarHBondContact OG1-NE2 3.47Å; H172-H174 PolarHBondContact O-N 3.05Å
173	P	91	Very high	90.8	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-8.6	-173.9	28.8	-35.4	0	0	0	114.5	K175 L176 V177 M200 F209 P214 I217 A218	P173-K175 PolarHBondContact O-N 2.93Å; P173-L176 WeakPolarHBondContact O-CA 3.31Å; P173-L176 WeakPolarHBondContact O-CB 3.44Å; P173-L176 PolarHBondContact O-N 3.35Å; P173-V177 PolarHBondContact O-N 3.45Å; P173-M200 HydrophobicContact CB-CG 4.27Å; P173-M200 HydrophobicContact CG-CG 3.62Å; P173-M200 HydrophobicContact CG-SD 4.01Å; P173-F209 HydrophobicContact CG-CE1 3.94Å; P173-F209 HydrophobicContact CG-CZ 3.84Å; P173-P214 HydrophobicContact CB-CB 4.17Å; P173-P214 WeakPolarHBondContact CB-O 3.44Å; P173-I217 HydrophobicContact CB-CB 4.39Å; P173-I217 HydrophobicContact CB-CG2 4.27Å; P173-I217 HydrophobicContact CG-CB 4.33Å; P173-I217 HydrophobicContact CG-CG2 3.81Å; P173-A218 HydrophobicContact CB-CB 4.26Å
174	H	91.7	Very high	90.8	Very high	16 Å²	16	49.1 Å²	49.1	7%	0.074	27%	0.265	C	S	.	.	H	α-helix	trans	-44.8	-42.4	-179.6	-61.3	68	0	0	0	114	H172 W197 M200 N201	H172-H174 PolarHBondContact O-N 3.05Å; H174-W197 HydrophobicContact CB-CE3 4.47Å; H174-W197 HydrophobicContact CB-CH2 3.8Å; H174-W197 HydrophobicContact CB-CZ3 3.74Å; H174-W197 AromaticContact CD2-CH2 3.82Å; H174-W197 AromaticContact CD2-CZ2 3.71Å; H174-W197 WeakPolarHBondContact O-CZ3 3.4Å; H174-M200 WeakPolarHBondContact CA-SD 3.5Å; H174-M200 HydrophobicContact CB-SD 4.03Å; H174-M200 WeakPolarHBondContact CD2-CE 3.05Å; H174-M200 VanDerWaalsContact CG-SD 3.54Å; H174-M200 PolarHBondContact N-SD 3.2Å; H174-M200 WeakPolarHBondContact NE2-CE 3.44Å; H174-N201 PolarHBondContact NE2-OD1 3.49Å
175	K	92.7	Very high	90.9	Very high	125 Å²	125	55.3 Å²	55.3	54%	0.543	30%	0.298	S	S	.	.	H	α-helix	trans	-74.4	-36.7	178.6	-66.3	-174.1	179.4	-177.9	0	112.7	P173 I178 C179 F657	P173-K175 PolarHBondContact O-N 2.93Å; K175-I178 PolarHBondContact O-N 3.27Å; K175-C179 PolarHBondContact O-N 3Å; K175-C179 PolarHBondContact O-SG 3.15Å; K175-C179 VanDerWaalsContact O-SG 3.35Å; K175-F657 HydrophobicContact CG-CE2 4.24Å
176	L	94.6	Very high	90.9	Very high	41 Å²	41	54.9 Å²	54.9	22%	0.215	28%	0.28	C	S	.	.	H	α-helix	trans	-66.8	-38.4	179.5	-59.9	177	0	0	0	111.1	P173 I178 C179 Y180 P214 E215 A218	P173-L176 WeakPolarHBondContact O-CA 3.31Å; P173-L176 WeakPolarHBondContact O-CB 3.44Å; P173-L176 PolarHBondContact O-N 3.35Å; L176-I178 VanDerWaalsContact C-N 3.26Å; L176-I178 PolarHBondContact O-N 2.93Å; L176-C179 PolarHBondContact O-N 2.97Å; L176-Y180 HydrophobicContact CB-CE1 4.38Å; L176-Y180 HydrophobicContact CB-CE2 4.21Å; L176-Y180 HydrophobicContact CD2-CE1 4.3Å; L176-Y180 VanDerWaalsContact O-CB 3.31Å; L176-Y180 WeakPolarHBondContact O-CB 3.39Å; L176-Y180 WeakPolarHBondContact O-CD1 3.37Å; L176-Y180 PolarHBondContact O-N 3.08Å; L176-P214 HydrophobicContact CD1-CB 3.81Å; L176-E215 HydrophobicContact CD1-CB 4.45Å; L176-E215 HydrophobicContact CD1-CG 3.96Å; L176-A218 HydrophobicContact CB-CB 3.73Å
177	V	94.4	Very high	90.9	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-55.6	-42.2	174.4	175.2	0	0	0	0	111.6	P173 L181 A196 M200 A218 I222	P173-V177 PolarHBondContact O-N 3.45Å; V177-L181 HydrophobicContact CG1-CD1 4.2Å; V177-L181 WeakPolarHBondContact O-CB 3.4Å; V177-L181 VanDerWaalsContact O-CG 3.32Å; V177-L181 WeakPolarHBondContact O-CG 3.39Å; V177-L181 PolarHBondContact O-N 3.12Å; V177-A196 HydrophobicContact CG1-CB 3.81Å; V177-M200 HydrophobicContact CG2-CB 4.42Å; V177-M200 HydrophobicContact CG2-CG 4.21Å; V177-M200 HydrophobicContact CG2-SD 4.21Å; V177-A218 HydrophobicContact CG2-CB 3.87Å; V177-I222 HydrophobicContact CG1-CD1 4.44Å; V177-I222 HydrophobicContact CG1-CG1 4.2Å
178	I	94.1	Very high	91	Very high	43 Å²	43	56.4 Å²	56.4	22%	0.221	29%	0.294	C	S	.	.	H	α-helix	trans	-69	-52.4	176.1	-61	172.9	0	0	0	110.4	K175 L176 Y180 L181 Q182 W197 L660	K175-I178 PolarHBondContact O-N 3.27Å; L176-I178 VanDerWaalsContact C-N 3.26Å; L176-I178 PolarHBondContact O-N 2.93Å; I178-Y180 VanDerWaalsContact C-N 3.28Å; I178-Y180 PolarHBondContact O-N 3.34Å; I178-L181 PolarHBondContact O-N 3.36Å; I178-Q182 HydrophobicContact CG2-CG 4.46Å; I178-Q182 WeakPolarHBondContact O-CG 3.41Å; I178-Q182 PolarHBondContact O-N 2.99Å; I178-W197 HydrophobicContact CD1-CZ3 3.89Å; I178-W197 HydrophobicContact CG1-CZ3 4.3Å; I178-L660 HydrophobicContact CD1-CD2 4.39Å
179	C	94.7	Very high	91.2	Very high	66 Å²	66	57.6 Å²	57.6	45%	0.446	30%	0.299	S	S	.	.	H	α-helix	trans	-63	-31.1	-176.7	-65	0	0	0	0	113.7	K175 L176 A183	K175-C179 PolarHBondContact O-N 3Å; K175-C179 PolarHBondContact O-SG 3.15Å; K175-C179 VanDerWaalsContact O-SG 3.35Å; L176-C179 PolarHBondContact O-N 2.97Å; C179-A183 PolarHBondContact O-N 3.3Å
180	Y	95.7	Very high	91.7	Very high	19 Å²	19	60.2 Å²	60.2	8%	0.075	31%	0.309	C	S	.	.	H	α-helix	trans	-76.1	-41.4	176.3	-65	-5.2	0	0	0	111.2	L176 I178 Q182 A183 L184 E215 A218 I222 F243	L176-Y180 HydrophobicContact CB-CE1 4.38Å; L176-Y180 HydrophobicContact CB-CE2 4.21Å; L176-Y180 HydrophobicContact CD2-CE1 4.3Å; L176-Y180 VanDerWaalsContact O-CB 3.31Å; L176-Y180 WeakPolarHBondContact O-CB 3.39Å; L176-Y180 WeakPolarHBondContact O-CD1 3.37Å; L176-Y180 PolarHBondContact O-N 3.08Å; I178-Y180 VanDerWaalsContact C-N 3.28Å; I178-Y180 PolarHBondContact O-N 3.34Å; Y180-Q182 PolarHBondContact O-N 3.46Å; Y180-A183 PolarHBondContact O-N 3.09Å; Y180-A183 VanDerWaalsContact O-N 3.16Å; Y180-L184 VanDerWaalsContact O-CG 3.23Å; Y180-L184 WeakPolarHBondContact O-CG 3.05Å; Y180-L184 PolarHBondContact O-N 3.26Å; Y180-L184 VanDerWaalsContact O-N 3.1Å; Y180-E215 WeakPolarHBondContact OH-CB 3.46Å; Y180-E215 WeakPolarHBondContact OH-CG 3.27Å; Y180-A218 HydrophobicContact CD2-CB 3.83Å; Y180-A218 HydrophobicContact CE2-CB 3.73Å; Y180-I222 HydrophobicContact CD2-CD1 4.32Å; Y180-F243 AromaticContact CD1-CD1 3.69Å; Y180-F243 HydrophobicContact CD1-CD1 3.69Å; Y180-F243 HydrophobicContact CD1-CD2 4.14Å; Y180-F243 AromaticContact CD1-CE1 3.43Å; Y180-F243 HydrophobicContact CD1-CE1 3.43Å; Y180-F243 VanDerWaalsContact CD1-CE1 3.43Å; Y180-F243 AromaticContact CD1-CE2 3.89Å; Y180-F243 HydrophobicContact CD1-CE2 3.89Å; Y180-F243 HydrophobicContact CD1-CG 4.05Å; Y180-F243 AromaticContact CD1-CZ 3.54Å; Y180-F243 HydrophobicContact CD1-CZ 3.54Å; Y180-F243 AromaticContact CD2-CD2 3.84Å; Y180-F243 HydrophobicContact CD2-CD2 3.84Å; Y180-F243 AromaticContact CD2-CE2 3.98Å; Y180-F243 HydrophobicContact CD2-CE2 3.98Å; Y180-F243 HydrophobicContact CD2-CG 4.2Å; Y180-F243 HydrophobicContact CD2-CZ 4.47Å; Y180-F243 HydrophobicContact CE1-CB 4.42Å; Y180-F243 AromaticContact CE1-CD1 3.39Å; Y180-F243 HydrophobicContact CE1-CD1 3.39Å; Y180-F243 HydrophobicContact CE1-CD2 4.26Å; Y180-F243 AromaticContact CE1-CE1 3.63Å; Y180-F243 HydrophobicContact CE1-CE1 3.63Å; Y180-F243 HydrophobicContact CE1-CE2 4.44Å; Y180-F243 AromaticContact CE1-CG 3.75Å; Y180-F243 HydrophobicContact CE1-CG 3.75Å; Y180-F243 HydrophobicContact CE1-CZ 4.16Å; Y180-F243 HydrophobicContact CE2-CB 4.18Å; Y180-F243 HydrophobicContact CE2-CD1 4.41Å; Y180-F243 AromaticContact CE2-CD2 3.96Å; Y180-F243 HydrophobicContact CE2-CD2 3.96Å; Y180-F243 AromaticContact CE2-CG 3.91Å; Y180-F243 HydrophobicContact CE2-CG 3.91Å; Y180-F243 HydrophobicContact CG-CD1 4.33Å; Y180-F243 AromaticContact CG-CD2 3.93Å; Y180-F243 HydrophobicContact CG-CD2 3.93Å; Y180-F243 HydrophobicContact CG-CE1 4.08Å; Y180-F243 AromaticContact CG-CE2 3.64Å; Y180-F243 HydrophobicContact CG-CE2 3.64Å; Y180-F243 HydrophobicContact CG-CG 4.27Å; Y180-F243 AromaticContact CG-CZ 3.73Å; Y180-F243 HydrophobicContact CG-CZ 3.73Å; Y180-F243 AromaticContact CZ-CD1 3.79Å; Y180-F243 AromaticContact CZ-CG 3.67Å
181	L	94.9	Very high	92.4	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-65.8	-25.8	172.5	-70.2	173.4	0	0	0	112.6	V177 I178 H186 E187 L192 V193 A196 I222	V177-L181 HydrophobicContact CG1-CD1 4.2Å; V177-L181 WeakPolarHBondContact O-CB 3.4Å; V177-L181 VanDerWaalsContact O-CG 3.32Å; V177-L181 WeakPolarHBondContact O-CG 3.39Å; V177-L181 PolarHBondContact O-N 3.12Å; I178-L181 PolarHBondContact O-N 3.36Å; L181-H186 HydrophobicContact CD2-CB 4.2Å; L181-H186 CarbonylContact O-C 3.23Å; L181-H186 WeakPolarHBondContact O-CA 3.4Å; L181-H186 PolarHBondContact O-N 2.97Å; L181-E187 PolarHBondContact O-N 3.3Å; L181-L192 HydrophobicContact CD1-CG 4.47Å; L181-L192 HydrophobicContact CD2-CD2 3.72Å; L181-L192 HydrophobicContact CD2-CG 3.93Å; L181-V193 HydrophobicContact CD1-CB 4.2Å; L181-V193 HydrophobicContact CD1-CG2 3.74Å; L181-A196 HydrophobicContact CD1-CB 4.45Å; L181-I222 HydrophobicContact CD1-CG1 4.36Å; L181-I222 HydrophobicContact CD2-CD1 4.22Å; L181-I222 HydrophobicContact CD2-CG1 4.16Å; L181-I222 HydrophobicContact CD2-CG2 3.85Å; L181-I222 HydrophobicContact CG-CD1 3.9Å; L181-I222 HydrophobicContact CG-CG1 4.07Å
182	Q	94	Very high	92.9	Very high	88 Å²	88	59.9 Å²	59.9	41%	0.411	31%	0.311	S	S	.	.	H	α-helix	trans	-69.2	-45.9	168.1	-74.8	-179.2	-43.5	0	0	112.3	I178 Y180 L184 D185 E187	I178-Q182 HydrophobicContact CG2-CG 4.46Å; I178-Q182 WeakPolarHBondContact O-CG 3.41Å; I178-Q182 PolarHBondContact O-N 2.99Å; Y180-Q182 PolarHBondContact O-N 3.46Å; Q182-L184 PolarHBondContact O-N 2.68Å; Q182-L184 VanDerWaalsContact O-N 3.17Å; Q182-D185 PolarHBondContact O-N 2.61Å; Q182-D185 VanDerWaalsContact O-N 3.16Å; Q182-E187 HydrophobicContact CG-CB 3.71Å; Q182-E187 HydrophobicContact CG-CG 4.1Å; Q182-E187 VanDerWaalsContact CG-OE2 3.3Å; Q182-E187 WeakPolarHBondContact CG-OE2 3.38Å; Q182-E187 PolarHBondContact NE2-OE2 3.3Å
183	A	93.2	Very high	93.3	Very high	53 Å²	53	59.9 Å²	59.9	44%	0.438	31%	0.313	S	S	.	.	H	α-helix	trans	-68.8	-7.2	176.7	0	0	0	0	0	114.4	C179 Y180 F243	C179-A183 PolarHBondContact O-N 3.3Å; Y180-A183 PolarHBondContact O-N 3.09Å; Y180-A183 VanDerWaalsContact O-N 3.16Å; A183-F243 HydrophobicContact CB-CE1 4.49Å; A183-F243 HydrophobicContact CB-CZ 4.05Å
184	L	93	Very high	93.6	Very high	19 Å²	19	62.4 Å²	62.4	10%	0.099	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	15.4	175.4	-60.4	170.6	0	0	0	112.5	Y180 Q182 H186 W239	Y180-L184 VanDerWaalsContact O-CG 3.23Å; Y180-L184 WeakPolarHBondContact O-CG 3.05Å; Y180-L184 PolarHBondContact O-N 3.26Å; Y180-L184 VanDerWaalsContact O-N 3.1Å; Q182-L184 PolarHBondContact O-N 2.68Å; Q182-L184 VanDerWaalsContact O-N 3.17Å; L184-H186 PolarHBondContact O-CD2 3.18Å; L184-H186 VanDerWaalsContact O-CG 3.28Å; L184-H186 PolarHBondContact O-N 3.08Å; L184-W239 HydrophobicContact CD1-CD2 4Å; L184-W239 HydrophobicContact CD1-CE3 3.68Å; L184-W239 HydrophobicContact CD1-CZ3 4.01Å; L184-W239 HydrophobicContact CD2-CB 3.89Å; L184-W239 HydrophobicContact CD2-CE3 4.36Å; L184-W239 HydrophobicContact CD2-CG 4.36Å
185	D	91.7	Very high	93.8	Very high	146 Å²	146	62.8 Å²	62.8	78%	0.781	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	27.3	-179.1	-65.2	-48.7	0	0	0	114.9	Q182	Q182-D185 PolarHBondContact O-N 2.61Å; Q182-D185 VanDerWaalsContact O-N 3.16Å
186	H	90.1	Very high	94.1	Very high	47 Å²	47	56.8 Å²	56.8	22%	0.218	30%	0.302	C	S	.	.			trans	-113.6	5.4	-174.1	-75.7	-22.8	0	0	0	114.5	L181 L184 T188 N189 L192 L233	L181-H186 HydrophobicContact CD2-CB 4.2Å; L181-H186 CarbonylContact O-C 3.23Å; L181-H186 WeakPolarHBondContact O-CA 3.4Å; L181-H186 PolarHBondContact O-N 2.97Å; L184-H186 PolarHBondContact O-CD2 3.18Å; L184-H186 VanDerWaalsContact O-CG 3.28Å; L184-H186 PolarHBondContact O-N 3.08Å; H186-T188 PolarHBondContact O-N 3.02Å; H186-T188 VanDerWaalsContact O-N 3.14Å; H186-N189 WeakPolarHBondContact O-CB 3.33Å; H186-N189 PolarHBondContact O-N 3.36Å; H186-L192 HydrophobicContact CB-CD2 4.07Å; H186-L233 WeakPolarHBondContact CD2-CD2 3.34Å; H186-L233 VanDerWaalsContact NE2-CD2 3.33Å; H186-L233 WeakPolarHBondContact NE2-CD2 3.47Å
187	E	88.7	Confident	94.1	Very high	108 Å²	108	56.6 Å²	56.6	51%	0.505	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-26.9	178.2	60.3	154.5	-160.7	0	0	114.2	L181 Q182 N189	L181-E187 PolarHBondContact O-N 3.3Å; Q182-E187 HydrophobicContact CG-CB 3.71Å; Q182-E187 HydrophobicContact CG-CG 4.1Å; Q182-E187 VanDerWaalsContact CG-OE2 3.3Å; Q182-E187 WeakPolarHBondContact CG-OE2 3.38Å; Q182-E187 PolarHBondContact NE2-OE2 3.3Å; E187-N189 VanDerWaalsContact C-N 3.28Å; E187-N189 PolarHBondContact O-N 3.19Å
188	T	90.6	Very high	94.2	Very high	116 Å²	116	60.3 Å²	60.3	71%	0.712	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-23	177.8	57.7	0	0	0	0	112.6	H186 K190	H186-T188 PolarHBondContact O-N 3.02Å; H186-T188 VanDerWaalsContact O-N 3.14Å; T188-K190 PolarHBondContact O-N 2.97Å
189	N	93.4	Very high	94.3	Very high	51 Å²	51	59.1 Å²	59.1	27%	0.273	31%	0.311	S	S	.	.			trans	-81.3	81.2	-179.8	-170.6	-21.5	0	0	0	110.7	H186 E187 N191 L192 V193 I231	H186-N189 WeakPolarHBondContact O-CB 3.33Å; H186-N189 PolarHBondContact O-N 3.36Å; E187-N189 VanDerWaalsContact C-N 3.28Å; E187-N189 PolarHBondContact O-N 3.19Å; N189-N191 PolarHBondContact O-N 2.87Å; N189-N191 VanDerWaalsContact O-N 3.08Å; N189-N191 PolarHBondContact OD1-N 2.81Å; N189-L192 HydrophobicContact CB-CB 4.09Å; N189-L192 PolarHBondContact O-N 2.92Å; N189-L192 PolarHBondContact OD1-N 3.31Å; N189-L192 VanDerWaalsContact OD1-N 3.11Å; N189-V193 WeakPolarHBondContact O-CG2 3.42Å; N189-V193 PolarHBondContact O-N 3.12Å; N189-I231 VanDerWaalsContact ND2-CD1 3.3Å; N189-I231 WeakPolarHBondContact ND2-CD1 3.48Å
190	K	94.3	Very high	94.3	Very high	169 Å²	169	56 Å²	56	74%	0.735	29%	0.29	S	S	*	.	H	α-helix	trans	-49.5	-35.8	178	-61.5	-173.2	179.9	-176.4	0	113.4	T188 Q194	T188-K190 PolarHBondContact O-N 2.97Å; K190-Q194 VanDerWaalsContact O-CB 3.22Å; K190-Q194 WeakPolarHBondContact O-CB 3.37Å; K190-Q194 PolarHBondContact O-N 2.84Å
191	N	95.6	Very high	94.3	Very high	116 Å²	116	56.6 Å²	56.6	62%	0.62	30%	0.295	S	S	*	.	H	α-helix	trans	-68.3	-42	179.8	-68.8	-13.3	0	0	0	111.7	N189 T195 L229	N189-N191 PolarHBondContact O-N 2.87Å; N189-N191 VanDerWaalsContact O-N 3.08Å; N189-N191 PolarHBondContact OD1-N 2.81Å; N191-T195 WeakPolarHBondContact O-CB 3.36Å; N191-T195 PolarHBondContact O-N 2.61Å; N191-T195 PolarHBondContact O-OG1 3.08Å; N191-L229 HydrophobicContact CB-CD1 4.45Å
192	L	96.2	Very high	94.3	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-66.9	-48.1	174.5	178.1	57.2	0	0	0	111.3	L181 H186 N189 Q194 T195 A196 A225 L229 I231	L181-L192 HydrophobicContact CD1-CG 4.47Å; L181-L192 HydrophobicContact CD2-CD2 3.72Å; L181-L192 HydrophobicContact CD2-CG 3.93Å; H186-L192 HydrophobicContact CB-CD2 4.07Å; N189-L192 HydrophobicContact CB-CB 4.09Å; N189-L192 PolarHBondContact O-N 2.92Å; N189-L192 PolarHBondContact OD1-N 3.31Å; N189-L192 VanDerWaalsContact OD1-N 3.11Å; L192-Q194 PolarHBondContact O-N 3.34Å; L192-T195 PolarHBondContact O-N 2.92Å; L192-A196 WeakPolarHBondContact O-CB 3.5Å; L192-A196 PolarHBondContact O-N 3.01Å; L192-A225 HydrophobicContact CD1-CB 3.61Å; L192-L229 HydrophobicContact CB-CD1 4.03Å; L192-L229 HydrophobicContact CD1-CD1 4.2Å; L192-I231 HydrophobicContact CB-CD1 3.88Å; L192-I231 HydrophobicContact CD1-CD1 4.23Å; L192-I231 HydrophobicContact CD2-CD1 3.89Å; L192-I231 HydrophobicContact CD2-CG2 4.42Å; L192-I231 HydrophobicContact CG-CD1 4.22Å
193	V	95.9	Very high	94.4	Very high	35 Å²	35	54.4 Å²	54.4	21%	0.212	29%	0.286	C	S	.	.	H	α-helix	trans	-55.9	-51.4	177.1	176.9	0	0	0	0	111	L181 N189 T195 W197	L181-V193 HydrophobicContact CD1-CB 4.2Å; L181-V193 HydrophobicContact CD1-CG2 3.74Å; N189-V193 WeakPolarHBondContact O-CG2 3.42Å; N189-V193 PolarHBondContact O-N 3.12Å; V193-T195 PolarHBondContact O-N 3.4Å; V193-W197 VanDerWaalsContact O-CB 3.24Å; V193-W197 WeakPolarHBondContact O-CB 3.38Å; V193-W197 PolarHBondContact O-N 3.39Å
194	Q	95.9	Very high	94.4	Very high	52 Å²	52	52 Å²	52	24%	0.243	27%	0.266	C	S	.	.	H	α-helix	trans	-67.9	-35.1	-179.4	-168.3	62	51.4	0	0	112.3	K190 L192 N198	K190-Q194 VanDerWaalsContact O-CB 3.22Å; K190-Q194 WeakPolarHBondContact O-CB 3.37Å; K190-Q194 PolarHBondContact O-N 2.84Å; L192-Q194 PolarHBondContact O-N 3.34Å; Q194-N198 PolarHBondContact NE2-OD1 3.38Å; Q194-N198 WeakPolarHBondContact O-CB 3.44Å; Q194-N198 PolarHBondContact O-N 3Å; Q194-N198 PolarHBondContact O-ND2 3.46Å; Q194-N198 PolarHBondContact O-OD1 2.99Å
195	T	96.9	Very high	94.5	Very high	24 Å²	24	53.9 Å²	53.9	15%	0.147	27%	0.271	C	S	.	.	H	α-helix	trans	-68.5	-45.5	177.7	-61.2	0	0	0	0	111.4	N191 L192 V193 N198 Y199 A225 K228	N191-T195 WeakPolarHBondContact O-CB 3.36Å; N191-T195 PolarHBondContact O-N 2.61Å; N191-T195 PolarHBondContact O-OG1 3.08Å; L192-T195 PolarHBondContact O-N 2.92Å; V193-T195 PolarHBondContact O-N 3.4Å; T195-N198 PolarHBondContact O-N 2.87Å; T195-Y199 HydrophobicContact CG2-CD2 3.88Å; T195-Y199 HydrophobicContact CG2-CE2 3.51Å; T195-Y199 VanDerWaalsContact O-CD2 3.26Å; T195-Y199 WeakPolarHBondContact O-CD2 3.4Å; T195-Y199 PolarHBondContact O-N 3.15Å; T195-A225 HydrophobicContact CG2-CB 3.72Å; T195-K228 HydrophobicContact CG2-CD 4.39Å
196	A	97.5	Very high	94.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.2	-41.1	175.2	0	0	0	0	0	111.8	V177 L181 L192 Y199 M200 I222 A225	V177-A196 HydrophobicContact CG1-CB 3.81Å; L181-A196 HydrophobicContact CD1-CB 4.45Å; L192-A196 WeakPolarHBondContact O-CB 3.5Å; L192-A196 PolarHBondContact O-N 3.01Å; A196-Y199 PolarHBondContact O-N 3.49Å; A196-M200 VanDerWaalsContact O-CB 3.31Å; A196-M200 WeakPolarHBondContact O-CB 3.39Å; A196-M200 PolarHBondContact O-N 2.89Å; A196-I222 HydrophobicContact CB-CG1 4.01Å; A196-A225 HydrophobicContact CB-CB 3.86Å
197	W	95.7	Very high	94.7	Very high	37 Å²	37	46.3 Å²	46.3	14%	0.14	23%	0.233	C	C	.	.	H	α-helix	trans	-64.2	-39.4	174.5	-173.6	-86.4	0	0	0	112.4	H174 I178 V193 M200 N201	H174-W197 HydrophobicContact CB-CE3 4.47Å; H174-W197 HydrophobicContact CB-CH2 3.8Å; H174-W197 HydrophobicContact CB-CZ3 3.74Å; H174-W197 AromaticContact CD2-CH2 3.82Å; H174-W197 AromaticContact CD2-CZ2 3.71Å; H174-W197 WeakPolarHBondContact O-CZ3 3.4Å; I178-W197 HydrophobicContact CD1-CZ3 3.89Å; I178-W197 HydrophobicContact CG1-CZ3 4.3Å; V193-W197 VanDerWaalsContact O-CB 3.24Å; V193-W197 WeakPolarHBondContact O-CB 3.38Å; V193-W197 PolarHBondContact O-N 3.39Å; W197-M200 HydrophobicContact CD2-CE 4.48Å; W197-M200 WeakPolarHBondContact O-CE 3.44Å; W197-M200 PolarHBondContact O-N 2.82Å; W197-N201 PolarHBondContact NE1-ND2 2.9Å; W197-N201 VanDerWaalsContact NE1-ND2 3.19Å; W197-N201 PolarHBondContact O-N 3.03Å; W197-N201 VanDerWaalsContact O-N 3.09Å; W197-N201 PolarHBondContact O-ND2 3.01Å
198	N	95.9	Very high	95	Very high	77 Å²	77	41.2 Å²	41.2	41%	0.412	21%	0.209	S	C	.	.	H	α-helix	trans	-65	-47.4	175.7	-71.6	-9.5	0	0	0	111	Q194 T195 M200 N201 D202	Q194-N198 PolarHBondContact NE2-OD1 3.38Å; Q194-N198 WeakPolarHBondContact O-CB 3.44Å; Q194-N198 PolarHBondContact O-N 3Å; Q194-N198 PolarHBondContact O-ND2 3.46Å; Q194-N198 PolarHBondContact O-OD1 2.99Å; T195-N198 PolarHBondContact O-N 2.87Å; N198-M200 VanDerWaalsContact C-N 3.3Å; N198-M200 PolarHBondContact O-N 2.84Å; N198-N201 PolarHBondContact O-N 3.49Å; N198-N201 VanDerWaalsContact O-N 3.11Å; N198-D202 PolarHBondContact O-N 3Å
199	Y	97	Very high	95.1	Very high	19 Å²	19	36.4 Å²	36.4	8%	0.075	18%	0.178	C	C	.	.	H	α-helix	trans	-56.5	-43.1	174.9	-78.9	-47	0	0	0	112.9	T195 A196 N201 D202 S203 L224 A225 K228 L257 Y261	T195-Y199 HydrophobicContact CG2-CD2 3.88Å; T195-Y199 HydrophobicContact CG2-CE2 3.51Å; T195-Y199 VanDerWaalsContact O-CD2 3.26Å; T195-Y199 WeakPolarHBondContact O-CD2 3.4Å; T195-Y199 PolarHBondContact O-N 3.15Å; A196-Y199 PolarHBondContact O-N 3.49Å; Y199-N201 VanDerWaalsContact C-N 3.31Å; Y199-N201 PolarHBondContact O-N 3.26Å; Y199-D202 PolarHBondContact O-N 3.06Å; Y199-S203 WeakPolarHBondContact O-CB 3.3Å; Y199-S203 PolarHBondContact O-N 3.4Å; Y199-S203 PolarHBondContact O-OG 2.76Å; Y199-L224 HydrophobicContact CD1-CD2 3.75Å; Y199-L224 HydrophobicContact CD1-CG 4.5Å; Y199-L224 HydrophobicContact CD2-CB 4.31Å; Y199-L224 HydrophobicContact CD2-CD2 4.19Å; Y199-L224 HydrophobicContact CD2-CG 4.15Å; Y199-L224 HydrophobicContact CE1-CD2 3.62Å; Y199-L224 HydrophobicContact CE1-CG 4.15Å; Y199-L224 HydrophobicContact CE2-CB 4.26Å; Y199-L224 HydrophobicContact CE2-CD2 4.05Å; Y199-L224 HydrophobicContact CE2-CG 3.75Å; Y199-L224 HydrophobicContact CG-CD2 4.06Å; Y199-A225 HydrophobicContact CD2-CB 4.05Å; Y199-A225 HydrophobicContact CE2-CB 4.23Å; Y199-K228 HydrophobicContact CE2-CD 4.38Å; Y199-K228 WeakPolarHBondContact OH-CD 3.44Å; Y199-L257 HydrophobicContact CD1-CD1 4.29Å; Y199-L257 HydrophobicContact CD1-CD2 4.48Å; Y199-L257 HydrophobicContact CG-CD1 4.37Å; Y199-Y261 AromaticContact CD1-CE2 3.64Å; Y199-Y261 HydrophobicContact CD1-CE2 3.64Å; Y199-Y261 AromaticContact CD1-CZ 3.87Å; Y199-Y261 VanDerWaalsContact CD1-OH 3.25Å; Y199-Y261 WeakPolarHBondContact CD1-OH 3.29Å; Y199-Y261 HydrophobicContact CE1-CD2 4.36Å; Y199-Y261 AromaticContact CE1-CE2 3.43Å; Y199-Y261 HydrophobicContact CE1-CE2 3.43Å; Y199-Y261 VanDerWaalsContact CE1-CE2 3.43Å; Y199-Y261 AromaticContact CE1-CZ 3.87Å
200	M	94.9	Very high	94.9	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-71.5	-20.5	179.6	173.6	-114.3	53.4	0	0	113.4	P173 H174 V177 A196 W197 N198 S203 C221	P173-M200 HydrophobicContact CB-CG 4.27Å; P173-M200 HydrophobicContact CG-CG 3.62Å; P173-M200 HydrophobicContact CG-SD 4.01Å; H174-M200 WeakPolarHBondContact CA-SD 3.5Å; H174-M200 HydrophobicContact CB-SD 4.03Å; H174-M200 WeakPolarHBondContact CD2-CE 3.05Å; H174-M200 VanDerWaalsContact CG-SD 3.54Å; H174-M200 PolarHBondContact N-SD 3.2Å; H174-M200 WeakPolarHBondContact NE2-CE 3.44Å; V177-M200 HydrophobicContact CG2-CB 4.42Å; V177-M200 HydrophobicContact CG2-CG 4.21Å; V177-M200 HydrophobicContact CG2-SD 4.21Å; A196-M200 VanDerWaalsContact O-CB 3.31Å; A196-M200 WeakPolarHBondContact O-CB 3.39Å; A196-M200 PolarHBondContact O-N 2.89Å; W197-M200 HydrophobicContact CD2-CE 4.48Å; W197-M200 WeakPolarHBondContact O-CE 3.44Å; W197-M200 PolarHBondContact O-N 2.82Å; N198-M200 VanDerWaalsContact C-N 3.3Å; N198-M200 PolarHBondContact O-N 2.84Å; M200-S203 PolarHBondContact O-OG 3.14Å; M200-S203 VanDerWaalsContact O-OG 3.12Å; M200-C221 HydrophobicContact CB-CB 3.95Å
201	N	94.8	Very high	94.8	Very high	32 Å²	32	28.4 Å²	28.4	17%	0.171	14%	0.14	C	C	.	.	H	α-helix	trans	-85.4	-37.1	170.6	-73.1	-68.9	0	0	0	111.7	H174 W197 N198 Y199 S203 L204	H174-N201 PolarHBondContact NE2-OD1 3.49Å; W197-N201 PolarHBondContact NE1-ND2 2.9Å; W197-N201 VanDerWaalsContact NE1-ND2 3.19Å; W197-N201 PolarHBondContact O-N 3.03Å; W197-N201 VanDerWaalsContact O-N 3.09Å; W197-N201 PolarHBondContact O-ND2 3.01Å; N198-N201 PolarHBondContact O-N 3.49Å; N198-N201 VanDerWaalsContact O-N 3.11Å; Y199-N201 VanDerWaalsContact C-N 3.31Å; Y199-N201 PolarHBondContact O-N 3.26Å; N201-S203 VanDerWaalsContact C-N 3.31Å; N201-S203 PolarHBondContact O-N 2.72Å; N201-L204 WeakPolarHBondContact O-CB 3.45Å; N201-L204 PolarHBondContact O-N 2.56Å
202	D	95.1	Very high	94.7	Very high	42 Å²	42	25 Å²	25	23%	0.225	12%	0.118	C	C	.	.	H	α-helix	trans	-67.2	-32.4	175.8	-80.1	-29.9	0	0	0	112.3	N198 Y199 L204 R205 L257 L260 Y261	N198-D202 PolarHBondContact O-N 3Å; Y199-D202 PolarHBondContact O-N 3.06Å; D202-L204 PolarHBondContact O-N 3.33Å; D202-R205 WeakPolarHBondContact O-CB 3.3Å; D202-R205 PolarHBondContact O-N 2.84Å; D202-R205 VanDerWaalsContact O-N 3.08Å; D202-R205 IonicContact OD1-CZ 3.05Å; D202-R205 IonicContact OD1-NH1 2.75Å; D202-R205 PolarHBondContact OD1-NH1 3.39Å; D202-R205 IonicContact OD1-NH2 3.62Å; D202-R205 PolarHBondContact OD1-NH2 3Å; D202-L257 HydrophobicContact CB-CD2 4.37Å; D202-L260 HydrophobicContact CB-CD2 4.39Å; D202-L260 WeakPolarHBondContact O-CD2 3.43Å; D202-Y261 HydrophobicContact CB-CE1 4.37Å; D202-Y261 VanDerWaalsContact CB-OH 3.24Å; D202-Y261 WeakPolarHBondContact CB-OH 3.44Å; D202-Y261 WeakPolarHBondContact OD2-CE1 3.29Å; D202-Y261 PolarHBondContact OD2-OH 3.14Å
203	S	95.5	Very high	94.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-66.7	-14.5	177.7	65.3	0	0	0	0	114.4	Y199 M200 N201 R205 T206 I208	Y199-S203 WeakPolarHBondContact O-CB 3.3Å; Y199-S203 PolarHBondContact O-N 3.4Å; Y199-S203 PolarHBondContact O-OG 2.76Å; M200-S203 PolarHBondContact O-OG 3.14Å; M200-S203 VanDerWaalsContact O-OG 3.12Å; N201-S203 VanDerWaalsContact C-N 3.31Å; N201-S203 PolarHBondContact O-N 2.72Å; S203-R205 PolarHBondContact O-N 2.69Å; S203-R205 VanDerWaalsContact O-N 3.16Å; S203-T206 PolarHBondContact O-N 2.69Å; S203-T206 PolarHBondContact O-OG1 3.43Å; S203-I208 VanDerWaalsContact CB-CD1 3.48Å
204	L	94.4	Very high	94.3	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.016	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-63.1	-14.4	169	-69.5	160.6	0	0	0	113.1	C59 A77 Q80 V81 N201 D202 F209	C59-L204 PolarHBondContact SG-O 2.96Å; A77-L204 HydrophobicContact CB-CD1 3.68Å; A77-L204 HydrophobicContact CB-CD2 3.86Å; A77-L204 HydrophobicContact CB-CG 4.47Å; Q80-L204 HydrophobicContact CB-CB 4.4Å; Q80-L204 VanDerWaalsContact OE1-CB 3.29Å; V81-L204 HydrophobicContact CG2-CD2 4.29Å; N201-L204 WeakPolarHBondContact O-CB 3.45Å; N201-L204 PolarHBondContact O-N 2.56Å; D202-L204 PolarHBondContact O-N 3.33Å; L204-F209 HydrophobicContact CB-CE2 4.43Å; L204-F209 HydrophobicContact CD2-CD1 4.07Å; L204-F209 HydrophobicContact CD2-CD2 3.95Å; L204-F209 HydrophobicContact CD2-CE1 3.64Å; L204-F209 HydrophobicContact CD2-CE2 3.52Å; L204-F209 HydrophobicContact CD2-CG 4.21Å; L204-F209 HydrophobicContact CD2-CZ 3.35Å; L204-F209 HydrophobicContact CG-CD2 4.47Å; L204-F209 HydrophobicContact CG-CE2 3.76Å; L204-F209 HydrophobicContact CG-CZ 3.82Å
205	R	94	Very high	94.3	Very high	57 Å²	57	29.2 Å²	29.2	22%	0.215	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-82.2	-13.3	169.7	-56.4	-166.9	-163	79	1.7	113.9	C59 D202 S203 L260	C59-R205 HydrophobicContact CB-CB 4.25Å; C59-R205 HydrophobicContact CB-CG 4.05Å; D202-R205 WeakPolarHBondContact O-CB 3.3Å; D202-R205 PolarHBondContact O-N 2.84Å; D202-R205 VanDerWaalsContact O-N 3.08Å; D202-R205 IonicContact OD1-CZ 3.05Å; D202-R205 IonicContact OD1-NH1 2.75Å; D202-R205 PolarHBondContact OD1-NH1 3.39Å; D202-R205 IonicContact OD1-NH2 3.62Å; D202-R205 PolarHBondContact OD1-NH2 3Å; S203-R205 PolarHBondContact O-N 2.69Å; S203-R205 VanDerWaalsContact O-N 3.16Å; R205-L260 HydrophobicContact CB-CD1 4.28Å; R205-L260 HydrophobicContact CB-CD2 4.36Å
206	T	94.5	Very high	94.2	Very high	13 Å²	13	28.4 Å²	28.4	8%	0.08	14%	0.136	C	C	.	.	S	Bend	trans	-97.7	-177	-179.5	69.7	0	0	0	0	111.5	Q84 S203 L260	Q84-T206 PolarHBondContact NE2-O 3.21Å; S203-T206 PolarHBondContact O-N 2.69Å; S203-T206 PolarHBondContact O-OG1 3.43Å; T206-L260 HydrophobicContact CG2-CB 4.03Å; T206-L260 HydrophobicContact CG2-CD1 4.34Å; T206-L260 HydrophobicContact CG2-CD2 3.97Å; T206-L260 HydrophobicContact CG2-CG 4.33Å
207	D	93	Very high	94.1	Very high	22 Å²	22	28.5 Å²	28.5	12%	0.118	14%	0.137	C	C	.	.	S	Bend	trans	-88.8	-7	178.2	66.8	-31.9	0	0	0	114.2	Y88 F209 V210 R211 C256	Y88-D207 HydrophobicContact CE2-CB 4.06Å; Y88-D207 WeakPolarHBondContact OH-CB 3.47Å; D207-F209 PolarHBondContact O-N 3.01Å; D207-V210 HydrophobicContact CB-CG2 4.36Å; D207-V210 WeakPolarHBondContact O-CG2 3.48Å; D207-V210 PolarHBondContact O-N 2.77Å; D207-R211 PolarHBondContact O-N 2.97Å; D207-R211 IonicContact OD1-NH1 3.4Å; D207-R211 PolarHBondContact OD1-NH1 2.75Å; D207-R211 VanDerWaalsContact OD2-CD 3.26Å; D207-R211 WeakPolarHBondContact OD2-CD 3.45Å; D207-R211 IonicContact OD2-CZ 3.41Å; D207-R211 IonicContact OD2-NE 2.87Å; D207-R211 IonicContact OD2-NH1 3.37Å; D207-R211 PolarHBondContact OD2-NH1 3.14Å; D207-C256 PolarHBondContact OD1-SG 3.1Å; D207-C256 VanDerWaalsContact OD1-SG 3.42Å
208	I	93.9	Very high	94.2	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-57.7	-30.6	-171.2	71	171.5	0	0	0	113.5	S203 V210 R211 Y212 I217 I253 C256	S203-I208 VanDerWaalsContact CB-CD1 3.48Å; I208-V210 PolarHBondContact O-N 3.09Å; I208-R211 PolarHBondContact O-N 3.2Å; I208-R211 VanDerWaalsContact O-N 3.16Å; I208-Y212 HydrophobicContact CB-CD2 3.95Å; I208-Y212 HydrophobicContact CB-CE2 4.47Å; I208-Y212 HydrophobicContact CG2-CD2 4.29Å; I208-Y212 HydrophobicContact CG2-CE2 4.32Å; I208-Y212 PolarHBondContact O-N 3.44Å; I208-I217 HydrophobicContact CD1-CB 4.4Å; I208-I217 HydrophobicContact CD1-CD1 4.47Å; I208-I217 HydrophobicContact CD1-CG1 4.03Å; I208-I217 HydrophobicContact CD1-CG2 3.71Å; I208-I217 HydrophobicContact CG1-CD1 4.22Å; I208-I217 HydrophobicContact CG1-CG1 4.22Å; I208-I217 HydrophobicContact CG1-CG2 4.5Å; I208-I253 HydrophobicContact CB-CG1 4.49Å; I208-I253 HydrophobicContact CD1-CG2 3.74Å; I208-I253 HydrophobicContact CG2-CG1 4.29Å; I208-C256 HydrophobicContact CG2-CB 3.95Å
209	F	92.6	Very high	94.2	Very high	14 Å²	14	23 Å²	23	6%	0.061	11%	0.11	C	C	.	.	H	α-helix	trans	-68	-7.5	175.3	-80.4	-95.3	0	0	0	114.9	V81 P173 L204 D207 I217	V81-F209 HydrophobicContact CG2-CB 4.03Å; V81-F209 HydrophobicContact CG2-CD1 3.72Å; V81-F209 HydrophobicContact CG2-CE1 4.47Å; V81-F209 HydrophobicContact CG2-CG 4.08Å; P173-F209 HydrophobicContact CG-CE1 3.94Å; P173-F209 HydrophobicContact CG-CZ 3.84Å; L204-F209 HydrophobicContact CB-CE2 4.43Å; L204-F209 HydrophobicContact CD2-CD1 4.07Å; L204-F209 HydrophobicContact CD2-CD2 3.95Å; L204-F209 HydrophobicContact CD2-CE1 3.64Å; L204-F209 HydrophobicContact CD2-CE2 3.52Å; L204-F209 HydrophobicContact CD2-CG 4.21Å; L204-F209 HydrophobicContact CD2-CZ 3.35Å; L204-F209 HydrophobicContact CG-CD2 4.47Å; L204-F209 HydrophobicContact CG-CE2 3.76Å; L204-F209 HydrophobicContact CG-CZ 3.82Å; D207-F209 PolarHBondContact O-N 3.01Å; F209-I217 HydrophobicContact CD1-CD1 4.15Å; F209-I217 HydrophobicContact CD2-CD1 4.32Å; F209-I217 HydrophobicContact CE1-CD1 4.42Å; F209-I217 HydrophobicContact CE2-CG2 4.41Å; F209-I217 HydrophobicContact CG-CD1 4.1Å; F209-I217 HydrophobicContact CZ-CG2 4.39Å
210	V	90.5	Very high	94.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-113.8	-11.1	170.5	-49.5	0	0	0	0	113.5	I30 I31 L36 Q84 R85 Y88 D207 I208	I30-V210 WeakPolarHBondContact CA-O 3.19Å; I31-V210 HydrophobicContact CD1-CB 3.88Å; I31-V210 HydrophobicContact CD1-CG1 4.31Å; I31-V210 HydrophobicContact CD1-CG2 4.11Å; I31-V210 HydrophobicContact CG1-CB 4.09Å; I31-V210 PolarHBondContact N-O 2.99Å; L36-V210 HydrophobicContact CD2-CG2 4.38Å; Q84-V210 HydrophobicContact CB-CG1 3.95Å; R85-V210 HydrophobicContact CB-CG1 4.5Å; R85-V210 HydrophobicContact CG-CB 4.42Å; R85-V210 HydrophobicContact CG-CG1 3.45Å; R85-V210 VanDerWaalsContact CG-CG1 3.45Å; Y88-V210 HydrophobicContact CD2-CG2 3.65Å; Y88-V210 HydrophobicContact CE2-CG2 3.53Å; Y88-V210 HydrophobicContact CG-CG2 4.47Å; D207-V210 HydrophobicContact CB-CG2 4.36Å; D207-V210 WeakPolarHBondContact O-CG2 3.48Å; D207-V210 PolarHBondContact O-N 2.77Å; I208-V210 PolarHBondContact O-N 3.09Å
211	R	91.4	Very high	94.4	Very high	53 Å²	53	22.1 Å²	22.1	20%	0.2	11%	0.107	C	C	.	.	H	α-helix	trans	-95.3	-41.1	175.7	-53.6	-151.5	-51.2	-132.5	23.6	113.2	I30 L36 D207 I208 E252	I30-R211 WeakPolarHBondContact CG2-O 3.5Å; L36-R211 HydrophobicContact CD1-CG 3.92Å; L36-R211 HydrophobicContact CD2-CG 4.39Å; D207-R211 PolarHBondContact O-N 2.97Å; D207-R211 IonicContact OD1-NH1 3.4Å; D207-R211 PolarHBondContact OD1-NH1 2.75Å; D207-R211 VanDerWaalsContact OD2-CD 3.26Å; D207-R211 WeakPolarHBondContact OD2-CD 3.45Å; D207-R211 IonicContact OD2-CZ 3.41Å; D207-R211 IonicContact OD2-NE 2.87Å; D207-R211 IonicContact OD2-NH1 3.37Å; D207-R211 PolarHBondContact OD2-NH1 3.14Å; I208-R211 PolarHBondContact O-N 3.2Å; I208-R211 VanDerWaalsContact O-N 3.16Å; R211-E252 IonicContact NH2-OE2 3.67Å; R211-E252 PolarHBondContact NH2-OE2 3.43Å
212	Y	92.8	Very high	94.5	Very high	43 Å²	43	20.6 Å²	20.6	17%	0.169	10%	0.099	C	C	.	.	S	Bend	trans	-120.6	157.6	-166.8	-57.7	-75.4	0	0	0	113.1	I208 E252 I253	I208-Y212 HydrophobicContact CB-CD2 3.95Å; I208-Y212 HydrophobicContact CB-CE2 4.47Å; I208-Y212 HydrophobicContact CG2-CD2 4.29Å; I208-Y212 HydrophobicContact CG2-CE2 4.32Å; I208-Y212 PolarHBondContact O-N 3.44Å; Y212-E252 WeakPolarHBondContact OH-CB 3.4Å; Y212-I253 HydrophobicContact CD1-CD1 4.23Å; Y212-I253 HydrophobicContact CD2-CD1 3.69Å; Y212-I253 HydrophobicContact CD2-CG1 3.52Å; Y212-I253 HydrophobicContact CE2-CD1 4.19Å; Y212-I253 HydrophobicContact CE2-CG1 3.6Å; Y212-I253 HydrophobicContact CG-CD1 3.72Å; Y212-I253 HydrophobicContact CG-CG1 4.07Å
213	L	92	Very high	94.6	Very high	96 Å²	96	20 Å²	20	50%	0.503	9%	0.093	S	C	.	.			trans	-72	150	171.9	-70.6	175.7	0	0	0	110.9	I30 E215 A216 I217	I30-L213 HydrophobicContact CD1-CD2 3.65Å; I30-L213 HydrophobicContact CD1-CG 3.72Å; L213-E215 WeakPolarHBondContact CB-OE2 3.49Å; L213-E215 PolarHBondContact O-N 2.79Å; L213-E215 VanDerWaalsContact O-N 3.11Å; L213-A216 PolarHBondContact O-N 3.48Å; L213-I217 PolarHBondContact O-N 3.01Å; L213-I217 VanDerWaalsContact O-N 3.09Å
214	P	93.1	Very high	94.7	Very high	19 Å²	19	20.7 Å²	20.7	12%	0.123	10%	0.097	C	C	.	.	H	α-helix	trans	-51.6	-34	176.8	-27.9	34.9	0	0	0	114.3	K171 P173 L176 I217 A218	K171-P214 HydrophobicContact CB-CG 3.75Å; K171-P214 WeakPolarHBondContact O-CG 3.34Å; P173-P214 HydrophobicContact CB-CB 4.17Å; P173-P214 WeakPolarHBondContact CB-O 3.44Å; L176-P214 HydrophobicContact CD1-CB 3.81Å; P214-I217 PolarHBondContact O-N 2.92Å; P214-A218 WeakPolarHBondContact O-CB 3.17Å; P214-A218 PolarHBondContact O-N 3.37Å
215	E	94.2	Very high	94.8	Very high	61 Å²	61	20.6 Å²	20.6	29%	0.285	10%	0.096	S	C	.	.	H	α-helix	trans	-58.7	-47.9	175.6	-65.8	74.2	-170.9	0	0	111.2	L176 Y180 L213 A218 C219	L176-E215 HydrophobicContact CD1-CB 4.45Å; L176-E215 HydrophobicContact CD1-CG 3.96Å; Y180-E215 WeakPolarHBondContact OH-CB 3.46Å; Y180-E215 WeakPolarHBondContact OH-CG 3.27Å; L213-E215 WeakPolarHBondContact CB-OE2 3.49Å; L213-E215 PolarHBondContact O-N 2.79Å; L213-E215 VanDerWaalsContact O-N 3.11Å; E215-A218 PolarHBondContact O-N 3.22Å; E215-C219 PolarHBondContact O-N 3.15Å; E215-C219 VanDerWaalsContact O-N 3.15Å; E215-C219 PolarHBondContact O-SG 3.28Å
216	A	95.7	Very high	94.9	Very high	8 Å²	8	18.1 Å²	18.1	7%	0.066	9%	0.088	C	C	.	.	H	α-helix	trans	-68.7	-37.7	175.6	0	0	0	0	0	112.6	L213 C219 G220 V245 I253	L213-A216 PolarHBondContact O-N 3.48Å; A216-C219 PolarHBondContact O-N 3.4Å; A216-G220 PolarHBondContact O-N 3.11Å; A216-V245 HydrophobicContact CB-CG1 3.68Å; A216-V245 HydrophobicContact CB-CG2 4.14Å; A216-I253 HydrophobicContact CB-CD1 4.07Å; A216-I253 WeakPolarHBondContact O-CD1 3.21Å
217	I	96.3	Very high	95	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-63.1	-43.7	176.7	-62.4	170.2	0	0	0	111	P173 I208 F209 L213 P214 C219 G220 C221 I253	P173-I217 HydrophobicContact CB-CB 4.39Å; P173-I217 HydrophobicContact CB-CG2 4.27Å; P173-I217 HydrophobicContact CG-CB 4.33Å; P173-I217 HydrophobicContact CG-CG2 3.81Å; I208-I217 HydrophobicContact CD1-CB 4.4Å; I208-I217 HydrophobicContact CD1-CD1 4.47Å; I208-I217 HydrophobicContact CD1-CG1 4.03Å; I208-I217 HydrophobicContact CD1-CG2 3.71Å; I208-I217 HydrophobicContact CG1-CD1 4.22Å; I208-I217 HydrophobicContact CG1-CG1 4.22Å; I208-I217 HydrophobicContact CG1-CG2 4.5Å; F209-I217 HydrophobicContact CD1-CD1 4.15Å; F209-I217 HydrophobicContact CD2-CD1 4.32Å; F209-I217 HydrophobicContact CE1-CD1 4.42Å; F209-I217 HydrophobicContact CE2-CG2 4.41Å; F209-I217 HydrophobicContact CG-CD1 4.1Å; F209-I217 HydrophobicContact CZ-CG2 4.39Å; L213-I217 PolarHBondContact O-N 3.01Å; L213-I217 VanDerWaalsContact O-N 3.09Å; P214-I217 PolarHBondContact O-N 2.92Å; I217-C219 VanDerWaalsContact C-N 3.33Å; I217-C219 PolarHBondContact O-N 2.81Å; I217-G220 PolarHBondContact O-N 2.82Å; I217-C221 PolarHBondContact O-N 3.2Å; I217-C221 VanDerWaalsContact O-N 3.08Å; I217-C221 PolarHBondContact O-SG 2.92Å; I217-C221 VanDerWaalsContact O-SG 3.33Å; I217-I253 HydrophobicContact CG1-CD1 4.35Å
218	A	96.7	Very high	95.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61	-42.3	174.2	0	0	0	0	0	111.6	P173 L176 V177 Y180 P214 E215 C221 I222	P173-A218 HydrophobicContact CB-CB 4.26Å; L176-A218 HydrophobicContact CB-CB 3.73Å; V177-A218 HydrophobicContact CG2-CB 3.87Å; Y180-A218 HydrophobicContact CD2-CB 3.83Å; Y180-A218 HydrophobicContact CE2-CB 3.73Å; P214-A218 WeakPolarHBondContact O-CB 3.17Å; P214-A218 PolarHBondContact O-N 3.37Å; E215-A218 PolarHBondContact O-N 3.22Å; A218-C221 PolarHBondContact O-N 3.42Å; A218-I222 WeakPolarHBondContact O-CG1 3.32Å; A218-I222 PolarHBondContact O-N 2.88Å
219	C	97.1	Very high	95.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.4	-49.4	177.4	-67.5	0	0	0	0	112.7	E215 A216 I217 C221 I222 Y223 W239 W240 V245 V250	E215-C219 PolarHBondContact O-N 3.15Å; E215-C219 VanDerWaalsContact O-N 3.15Å; E215-C219 PolarHBondContact O-SG 3.28Å; A216-C219 PolarHBondContact O-N 3.4Å; I217-C219 VanDerWaalsContact C-N 3.33Å; I217-C219 PolarHBondContact O-N 2.81Å; C219-C221 PolarHBondContact O-N 3.45Å; C219-I222 PolarHBondContact O-N 3.3Å; C219-Y223 WeakPolarHBondContact O-CB 3.38Å; C219-Y223 PolarHBondContact O-N 3.24Å; C219-W239 HydrophobicContact CB-CH2 4.07Å; C219-W239 HydrophobicContact CB-CZ3 4.33Å; C219-W240 HydrophobicContact CB-CB 4.3Å; C219-V245 HydrophobicContact CB-CG1 4.28Å; C219-V245 HydrophobicContact CB-CG2 4.4Å; C219-V250 HydrophobicContact CB-CG2 3.98Å
220	G	97.4	Very high	95.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.1	-38.5	178.5	0	0	0	0	0	113.8	A216 I217 L224	A216-G220 PolarHBondContact O-N 3.11Å; I217-G220 PolarHBondContact O-N 2.82Å; G220-L224 WeakPolarHBondContact O-CB 3.29Å; G220-L224 PolarHBondContact O-N 2.92Å; G220-L224 VanDerWaalsContact O-N 3.07Å
221	C	97.6	Very high	95.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-72.7	-35.4	177.7	-66.4	0	0	0	0	113.4	M200 I217 A218 C219 A225	M200-C221 HydrophobicContact CB-CB 3.95Å; I217-C221 PolarHBondContact O-N 3.2Å; I217-C221 VanDerWaalsContact O-N 3.08Å; I217-C221 PolarHBondContact O-SG 2.92Å; I217-C221 VanDerWaalsContact O-SG 3.33Å; A218-C221 PolarHBondContact O-N 3.42Å; C219-C221 PolarHBondContact O-N 3.45Å; C221-A225 WeakPolarHBondContact O-CB 3.25Å; C221-A225 PolarHBondContact O-N 2.93Å
222	I	97.2	Very high	95.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-68.3	-43.4	171.9	-71.2	165.5	0	0	0	110.6	V177 Y180 L181 A196 A218 C219 A225 S226 L233 W239	V177-I222 HydrophobicContact CG1-CD1 4.44Å; V177-I222 HydrophobicContact CG1-CG1 4.2Å; Y180-I222 HydrophobicContact CD2-CD1 4.32Å; L181-I222 HydrophobicContact CD1-CG1 4.36Å; L181-I222 HydrophobicContact CD2-CD1 4.22Å; L181-I222 HydrophobicContact CD2-CG1 4.16Å; L181-I222 HydrophobicContact CD2-CG2 3.85Å; L181-I222 HydrophobicContact CG-CD1 3.9Å; L181-I222 HydrophobicContact CG-CG1 4.07Å; A196-I222 HydrophobicContact CB-CG1 4.01Å; A218-I222 WeakPolarHBondContact O-CG1 3.32Å; A218-I222 PolarHBondContact O-N 2.88Å; C219-I222 PolarHBondContact O-N 3.3Å; I222-A225 WeakPolarHBondContact O-CB 3.39Å; I222-A225 PolarHBondContact O-N 3.45Å; I222-S226 PolarHBondContact O-N 3.08Å; I222-S226 PolarHBondContact O-OG 3.07Å; I222-L233 HydrophobicContact CG2-CD1 3.94Å; I222-W239 HydrophobicContact CB-CH2 3.74Å; I222-W239 HydrophobicContact CB-CZ2 4.19Å; I222-W239 HydrophobicContact CD1-CH2 4.4Å; I222-W239 HydrophobicContact CG2-CH2 3.53Å; I222-W239 HydrophobicContact CG2-CZ2 3.7Å; I222-W239 HydrophobicContact CG2-CZ3 4.39Å
223	Y	97.1	Very high	95.5	Very high	30 Å²	30	37 Å²	37	12%	0.118	20%	0.2	C	C	.	.	H	α-helix	trans	-56.4	-54.8	177.6	179.2	-121.1	0	0	0	111.3	C219 A225 S226 C227 W240 V250 H251 A254	C219-Y223 WeakPolarHBondContact O-CB 3.38Å; C219-Y223 PolarHBondContact O-N 3.24Å; Y223-A225 PolarHBondContact O-N 3.18Å; Y223-S226 PolarHBondContact O-N 3.25Å; Y223-S226 PolarHBondContact O-OG 3.46Å; Y223-C227 PolarHBondContact O-N 3.28Å; Y223-C227 PolarHBondContact O-SG 3.42Å; Y223-C227 VanDerWaalsContact O-SG 3.38Å; Y223-W240 AromaticContact CD2-CZ3 3.91Å; Y223-W240 HydrophobicContact CD2-CZ3 3.91Å; Y223-W240 HydrophobicContact CE2-CH2 4.37Å; Y223-W240 AromaticContact CE2-CZ3 3.97Å; Y223-W240 HydrophobicContact CE2-CZ3 3.97Å; Y223-V250 HydrophobicContact CD1-CG1 3.48Å; Y223-V250 VanDerWaalsContact CD1-CG1 3.48Å; Y223-V250 HydrophobicContact CD2-CG1 4.31Å; Y223-V250 HydrophobicContact CE1-CG1 4.21Å; Y223-V250 HydrophobicContact CG-CG1 3.51Å; Y223-H251 AromaticContact CE1-CD2 3.76Å; Y223-H251 AromaticContact CE1-NE2 3.52Å; Y223-H251 AromaticContact CZ-CE1 3.99Å; Y223-H251 AromaticContact CZ-NE2 3.48Å; Y223-H251 PolarHBondContact OH-NE2 3.47Å; Y223-A254 HydrophobicContact CD1-CB 4.21Å
224	L	96.9	Very high	95.5	Very high	14 Å²	14	35.9 Å²	35.9	7%	0.073	20%	0.198	C	C	.	.	H	α-helix	trans	-59.4	-34.7	178.2	-174.5	62.8	0	0	0	112.7	Y199 G220 K228 A254 L257 L258	Y199-L224 HydrophobicContact CD1-CD2 3.75Å; Y199-L224 HydrophobicContact CD1-CG 4.5Å; Y199-L224 HydrophobicContact CD2-CB 4.31Å; Y199-L224 HydrophobicContact CD2-CD2 4.19Å; Y199-L224 HydrophobicContact CD2-CG 4.15Å; Y199-L224 HydrophobicContact CE1-CD2 3.62Å; Y199-L224 HydrophobicContact CE1-CG 4.15Å; Y199-L224 HydrophobicContact CE2-CB 4.26Å; Y199-L224 HydrophobicContact CE2-CD2 4.05Å; Y199-L224 HydrophobicContact CE2-CG 3.75Å; Y199-L224 HydrophobicContact CG-CD2 4.06Å; G220-L224 WeakPolarHBondContact O-CB 3.29Å; G220-L224 PolarHBondContact O-N 2.92Å; G220-L224 VanDerWaalsContact O-N 3.07Å; L224-K228 WeakPolarHBondContact O-CB 3.47Å; L224-K228 PolarHBondContact O-N 2.95Å; L224-K228 VanDerWaalsContact O-N 3.07Å; L224-A254 HydrophobicContact CB-CB 4.23Å; L224-A254 HydrophobicContact CD1-CB 4.38Å; L224-L257 HydrophobicContact CD2-CB 3.7Å; L224-L257 HydrophobicContact CD2-CD1 3.93Å; L224-L257 HydrophobicContact CD2-CG 4.44Å; L224-L258 HydrophobicContact CD1-CD1 4.17Å; L224-L258 HydrophobicContact CD1-CD2 4.1Å; L224-L258 HydrophobicContact CD1-CG 4.06Å
225	A	97.6	Very high	95.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-68.8	-41.3	174.2	0	0	0	0	0	113.1	L192 T195 A196 Y199 C221 I222 Y223 K228 L229	L192-A225 HydrophobicContact CD1-CB 3.61Å; T195-A225 HydrophobicContact CG2-CB 3.72Å; A196-A225 HydrophobicContact CB-CB 3.86Å; Y199-A225 HydrophobicContact CD2-CB 4.05Å; Y199-A225 HydrophobicContact CE2-CB 4.23Å; C221-A225 WeakPolarHBondContact O-CB 3.25Å; C221-A225 PolarHBondContact O-N 2.93Å; I222-A225 WeakPolarHBondContact O-CB 3.39Å; I222-A225 PolarHBondContact O-N 3.45Å; Y223-A225 PolarHBondContact O-N 3.18Å; A225-K228 PolarHBondContact O-N 3.03Å; A225-L229 WeakPolarHBondContact O-CB 3.17Å; A225-L229 WeakPolarHBondContact O-CG 3.27Å; A225-L229 PolarHBondContact O-N 3.08Å; A225-L229 VanDerWaalsContact O-N 3.11Å
226	S	96.6	Very high	94.9	Very high	6 Å²	6	48.1 Å²	48.1	4%	0.042	25%	0.247	C	C	.	.	H	α-helix	trans	-64.8	-43.4	176.6	69.9	0	0	0	0	111.9	I222 Y223 L229 N230 I231	I222-S226 PolarHBondContact O-N 3.08Å; I222-S226 PolarHBondContact O-OG 3.07Å; Y223-S226 PolarHBondContact O-N 3.25Å; Y223-S226 PolarHBondContact O-OG 3.46Å; S226-L229 CarbonylContact O-C 3.51Å; S226-L229 PolarHBondContact O-N 3.43Å; S226-N230 PolarHBondContact O-N 2.79Å; S226-I231 PolarHBondContact O-N 2.98Å
227	C	95.8	Very high	94.5	Very high	54 Å²	54	52.7 Å²	52.7	37%	0.365	28%	0.276	S	S	.	.	H	α-helix	trans	-60.6	-48.4	174.5	-65.6	0	0	0	0	111.6	Y223 L229 N230	Y223-C227 PolarHBondContact O-N 3.28Å; Y223-C227 PolarHBondContact O-SG 3.42Å; Y223-C227 VanDerWaalsContact O-SG 3.38Å; C227-L229 PolarHBondContact O-N 3.07Å; C227-N230 PolarHBondContact O-N 3.02Å; C227-N230 PolarHBondContact O-OD1 3.34Å
228	K	95.8	Very high	94.3	Very high	113 Å²	113	53.2 Å²	53.2	49%	0.491	28%	0.28	S	S	.	.	H	α-helix	trans	-62.5	-30	179.2	173.3	168.8	171.6	-178.2	0	113.7	T195 Y199 L224 A225	T195-K228 HydrophobicContact CG2-CD 4.39Å; Y199-K228 HydrophobicContact CE2-CD 4.38Å; Y199-K228 WeakPolarHBondContact OH-CD 3.44Å; L224-K228 WeakPolarHBondContact O-CB 3.47Å; L224-K228 PolarHBondContact O-N 2.95Å; L224-K228 VanDerWaalsContact O-N 3.07Å; A225-K228 PolarHBondContact O-N 3.03Å
229	L	95.9	Very high	94.2	Very high	59 Å²	59	53.6 Å²	53.6	31%	0.309	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	3.9	-178.4	-63	175.3	0	0	0	113.1	N191 L192 A225 S226 C227 I231	N191-L229 HydrophobicContact CB-CD1 4.45Å; L192-L229 HydrophobicContact CB-CD1 4.03Å; L192-L229 HydrophobicContact CD1-CD1 4.2Å; A225-L229 WeakPolarHBondContact O-CB 3.17Å; A225-L229 WeakPolarHBondContact O-CG 3.27Å; A225-L229 PolarHBondContact O-N 3.08Å; A225-L229 VanDerWaalsContact O-N 3.11Å; S226-L229 CarbonylContact O-C 3.51Å; S226-L229 PolarHBondContact O-N 3.43Å; C227-L229 PolarHBondContact O-N 3.07Å; L229-I231 HydrophobicContact CB-CD1 3.65Å; L229-I231 HydrophobicContact CB-CG1 3.86Å; L229-I231 HydrophobicContact CD1-CD1 3.98Å; L229-I231 HydrophobicContact CG-CD1 4.49Å; L229-I231 PolarHBondContact O-N 3.32Å
230	N	94.5	Very high	94.1	Very high	149 Å²	149	54 Å²	54	80%	0.797	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	37.4	-174.1	-62.4	-39.5	0	0	0	113.6	S226 C227	S226-N230 PolarHBondContact O-N 2.79Å; C227-N230 PolarHBondContact O-N 3.02Å; C227-N230 PolarHBondContact O-OD1 3.34Å
231	I	94.3	Very high	94	Very high	31 Å²	31	59.1 Å²	59.1	16%	0.159	31%	0.307	C	S	.	.			trans	-92.2	117.1	178.5	-62.5	168.4	0	0	0	108.5	N189 L192 S226 L229 L233	N189-I231 VanDerWaalsContact ND2-CD1 3.3Å; N189-I231 WeakPolarHBondContact ND2-CD1 3.48Å; L192-I231 HydrophobicContact CB-CD1 3.88Å; L192-I231 HydrophobicContact CD1-CD1 4.23Å; L192-I231 HydrophobicContact CD2-CD1 3.89Å; L192-I231 HydrophobicContact CD2-CG2 4.42Å; L192-I231 HydrophobicContact CG-CD1 4.22Å; S226-I231 PolarHBondContact O-N 2.98Å; L229-I231 HydrophobicContact CB-CD1 3.65Å; L229-I231 HydrophobicContact CB-CG1 3.86Å; L229-I231 HydrophobicContact CD1-CD1 3.98Å; L229-I231 HydrophobicContact CG-CD1 4.49Å; L229-I231 PolarHBondContact O-N 3.32Å; I231-L233 HydrophobicContact CG2-CD2 4.24Å; I231-L233 PolarHBondContact O-N 3.17Å
232	P	91.8	Very high	93.7	Very high	118 Å²	118	65.3 Å²	65.3	77%	0.766	34%	0.338	S	S	*	.			trans	-72.4	122.7	176.2	29.2	-33	0	0	0	110.5
233	L	91.8	Very high	93.5	Very high	17 Å²	17	67 Å²	67	9%	0.089	35%	0.345	C	S	.	.			trans	-105.4	156.3	170.1	-59.5	-176.4	0	0	0	110.4	H186 I222 I231 R235 W239	H186-L233 WeakPolarHBondContact CD2-CD2 3.34Å; H186-L233 VanDerWaalsContact NE2-CD2 3.33Å; H186-L233 WeakPolarHBondContact NE2-CD2 3.47Å; I222-L233 HydrophobicContact CG2-CD1 3.94Å; I231-L233 HydrophobicContact CG2-CD2 4.24Å; I231-L233 PolarHBondContact O-N 3.17Å; L233-R235 PolarHBondContact O-N 3.06Å; L233-W239 VanDerWaalsContact CB-CD1 3.45Å; L233-W239 HydrophobicContact CB-CG 4.26Å; L233-W239 HydrophobicContact CD1-CD2 4.37Å; L233-W239 HydrophobicContact CD1-CZ2 3.82Å
234	P	91.5	Very high	93.3	Very high	73 Å²	73	71.2 Å²	71.2	47%	0.474	38%	0.379	S	S	.	.			trans	-58.6	128.6	-177.6	-24.3	33.8	0	0	0	113.5	W239	P234-W239 HydrophobicContact CB-CB 4.23Å; P234-W239 HydrophobicContact CG-CB 4.46Å; P234-W239 WeakPolarHBondContact O-CB 3.3Å; P234-W239 VanDerWaalsContact O-CD1 3.28Å; P234-W239 PolarHBondContact O-N 2.89Å
235	R	89	Confident	93.1	Very high	154 Å²	154	71.2 Å²	71.2	58%	0.581	38%	0.38	S	S	*	.	B	Isolated β-bridge	trans	-111.3	-14.3	-179.3	-73.1	-174.2	173.7	-167.8	-5	115	L233 P237 A238	L233-R235 PolarHBondContact O-N 3.06Å; R235-P237 CarbonylContact C-O 3.4Å; R235-P237 VanDerWaalsContact C-O 3.23Å; R235-P237 CarbonylContact O-C 3.44Å; R235-A238 PolarHBondContact O-N 3.33Å
236	H	87	Confident	93	Very high	184 Å²	184	73.7 Å²	73.7	85%	0.852	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.3	98.6	-178.7	-54.9	-56	0	0	0	110.9
237	P	87.2	Confident	93	Very high	104 Å²	104	78.7 Å²	78.7	68%	0.675	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	cis	-60.8	161.9	-12.7	29.8	-36.3	0	0	0	111.8	R235 W239 E241	R235-P237 CarbonylContact C-O 3.4Å; R235-P237 VanDerWaalsContact C-O 3.23Å; R235-P237 CarbonylContact O-C 3.44Å; P237-W239 PolarHBondContact O-N 3Å; P237-E241 VanDerWaalsContact CB-OE2 3.3Å; P237-E241 WeakPolarHBondContact CB-OE2 3.42Å
238	A	92.7	Very high	93	Very high	12 Å²	12	83.6 Å²	83.6	10%	0.099	44%	0.437	C	S	.	.	B	Isolated β-bridge	trans	-76.3	129.1	-177.3	0	0	0	0	0	110	R235 W240 E241	R235-A238 PolarHBondContact O-N 3.33Å; A238-W240 HydrophobicContact CB-CD2 4.09Å; A238-W240 VanDerWaalsContact CB-CE2 3.5Å; A238-W240 HydrophobicContact CB-CH2 4.27Å; A238-W240 HydrophobicContact CB-CZ2 3.61Å; A238-W240 PolarHBondContact O-N 2.68Å; A238-E241 HydrophobicContact CB-CG 4.09Å; A238-E241 PolarHBondContact N-OE2 3.17Å; A238-E241 WeakPolarHBondContact O-CB 3.48Å; A238-E241 WeakPolarHBondContact O-CG 3.5Å; A238-E241 PolarHBondContact O-N 3.46Å
239	W	94.5	Very high	93	Very high	8 Å²	8	79.3 Å²	79.3	3%	0.03	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-59.1	-26	-165.4	70.2	-94.9	0	0	0	114.8	L184 C219 I222 L233 P234 P237 E241 M242 F243	L184-W239 HydrophobicContact CD1-CD2 4Å; L184-W239 HydrophobicContact CD1-CE3 3.68Å; L184-W239 HydrophobicContact CD1-CZ3 4.01Å; L184-W239 HydrophobicContact CD2-CB 3.89Å; L184-W239 HydrophobicContact CD2-CE3 4.36Å; L184-W239 HydrophobicContact CD2-CG 4.36Å; C219-W239 HydrophobicContact CB-CH2 4.07Å; C219-W239 HydrophobicContact CB-CZ3 4.33Å; I222-W239 HydrophobicContact CB-CH2 3.74Å; I222-W239 HydrophobicContact CB-CZ2 4.19Å; I222-W239 HydrophobicContact CD1-CH2 4.4Å; I222-W239 HydrophobicContact CG2-CH2 3.53Å; I222-W239 HydrophobicContact CG2-CZ2 3.7Å; I222-W239 HydrophobicContact CG2-CZ3 4.39Å; L233-W239 VanDerWaalsContact CB-CD1 3.45Å; L233-W239 HydrophobicContact CB-CG 4.26Å; L233-W239 HydrophobicContact CD1-CD2 4.37Å; L233-W239 HydrophobicContact CD1-CZ2 3.82Å; P234-W239 HydrophobicContact CB-CB 4.23Å; P234-W239 HydrophobicContact CG-CB 4.46Å; P234-W239 WeakPolarHBondContact O-CB 3.3Å; P234-W239 VanDerWaalsContact O-CD1 3.28Å; P234-W239 PolarHBondContact O-N 2.89Å; P237-W239 PolarHBondContact O-N 3Å; W239-E241 VanDerWaalsContact C-N 3.31Å; W239-E241 PolarHBondContact O-N 3.12Å; W239-M242 WeakPolarHBondContact O-CB 3.29Å; W239-M242 PolarHBondContact O-N 3.28Å; W239-F243 HydrophobicContact CE3-CD2 4.09Å; W239-F243 AromaticContact CE3-CE2 3.83Å; W239-F243 HydrophobicContact CE3-CE2 3.83Å; W239-F243 HydrophobicContact CZ3-CD2 4.01Å; W239-F243 AromaticContact CZ3-CE2 3.89Å; W239-F243 HydrophobicContact CZ3-CE2 3.89Å
240	W	95	Very high	93	Very high	9 Å²	9	76.5 Å²	76.5	3%	0.034	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-71	-21.9	175.9	51.5	74.5	0	0	0	113.8	C219 Y223 A238 M242 F243 S244 V245 E247 V250	C219-W240 HydrophobicContact CB-CB 4.3Å; Y223-W240 AromaticContact CD2-CZ3 3.91Å; Y223-W240 HydrophobicContact CD2-CZ3 3.91Å; Y223-W240 HydrophobicContact CE2-CH2 4.37Å; Y223-W240 AromaticContact CE2-CZ3 3.97Å; Y223-W240 HydrophobicContact CE2-CZ3 3.97Å; A238-W240 HydrophobicContact CB-CD2 4.09Å; A238-W240 VanDerWaalsContact CB-CE2 3.5Å; A238-W240 HydrophobicContact CB-CH2 4.27Å; A238-W240 HydrophobicContact CB-CZ2 3.61Å; A238-W240 PolarHBondContact O-N 2.68Å; W240-M242 PolarHBondContact O-N 2.93Å; W240-F243 PolarHBondContact O-N 2.93Å; W240-S244 PolarHBondContact O-N 3.43Å; W240-V245 HydrophobicContact CB-CB 4.43Å; W240-V245 PolarHBondContact O-N 3.44Å; W240-E247 HydrophobicContact CZ2-CB 4.09Å; W240-E247 HydrophobicContact CZ2-CG 3.77Å; W240-V250 HydrophobicContact CB-CG2 3.91Å; W240-V250 HydrophobicContact CD2-CG2 4.11Å; W240-V250 HydrophobicContact CE3-CG1 4.26Å; W240-V250 HydrophobicContact CG-CG2 3.85Å
241	E	93.7	Very high	93.1	Very high	107 Å²	107	72.2 Å²	72.2	50%	0.5	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-64.7	-31.7	175.5	-59.5	175.1	143.9	0	0	111.1	P237 A238 W239 F243 S244	P237-E241 VanDerWaalsContact CB-OE2 3.3Å; P237-E241 WeakPolarHBondContact CB-OE2 3.42Å; A238-E241 HydrophobicContact CB-CG 4.09Å; A238-E241 PolarHBondContact N-OE2 3.17Å; A238-E241 WeakPolarHBondContact O-CB 3.48Å; A238-E241 WeakPolarHBondContact O-CG 3.5Å; A238-E241 PolarHBondContact O-N 3.46Å; W239-E241 VanDerWaalsContact C-N 3.31Å; W239-E241 PolarHBondContact O-N 3.12Å; E241-F243 PolarHBondContact O-N 3.32Å; E241-F243 VanDerWaalsContact O-N 3.16Å; E241-S244 PolarHBondContact O-N 3.09Å
242	M	91.9	Very high	93.2	Very high	130 Å²	130	73.5 Å²	73.5	64%	0.64	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-57	-29.1	173	-168.8	-174.6	-65.1	0	0	112.3	W239 W240	W239-M242 WeakPolarHBondContact O-CB 3.29Å; W239-M242 PolarHBondContact O-N 3.28Å; W240-M242 PolarHBondContact O-N 2.93Å
243	F	92.9	Very high	93.5	Very high	36 Å²	36	67.9 Å²	67.9	16%	0.158	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-100.2	11.4	178.6	-52.8	-54.7	0	0	0	113.1	Y180 A183 W239 W240 E241 V245	Y180-F243 AromaticContact CD1-CD1 3.69Å; Y180-F243 HydrophobicContact CD1-CD1 3.69Å; Y180-F243 HydrophobicContact CD1-CD2 4.14Å; Y180-F243 AromaticContact CD1-CE1 3.43Å; Y180-F243 HydrophobicContact CD1-CE1 3.43Å; Y180-F243 VanDerWaalsContact CD1-CE1 3.43Å; Y180-F243 AromaticContact CD1-CE2 3.89Å; Y180-F243 HydrophobicContact CD1-CE2 3.89Å; Y180-F243 HydrophobicContact CD1-CG 4.05Å; Y180-F243 AromaticContact CD1-CZ 3.54Å; Y180-F243 HydrophobicContact CD1-CZ 3.54Å; Y180-F243 AromaticContact CD2-CD2 3.84Å; Y180-F243 HydrophobicContact CD2-CD2 3.84Å; Y180-F243 AromaticContact CD2-CE2 3.98Å; Y180-F243 HydrophobicContact CD2-CE2 3.98Å; Y180-F243 HydrophobicContact CD2-CG 4.2Å; Y180-F243 HydrophobicContact CD2-CZ 4.47Å; Y180-F243 HydrophobicContact CE1-CB 4.42Å; Y180-F243 AromaticContact CE1-CD1 3.39Å; Y180-F243 HydrophobicContact CE1-CD1 3.39Å; Y180-F243 HydrophobicContact CE1-CD2 4.26Å; Y180-F243 AromaticContact CE1-CE1 3.63Å; Y180-F243 HydrophobicContact CE1-CE1 3.63Å; Y180-F243 HydrophobicContact CE1-CE2 4.44Å; Y180-F243 AromaticContact CE1-CG 3.75Å; Y180-F243 HydrophobicContact CE1-CG 3.75Å; Y180-F243 HydrophobicContact CE1-CZ 4.16Å; Y180-F243 HydrophobicContact CE2-CB 4.18Å; Y180-F243 HydrophobicContact CE2-CD1 4.41Å; Y180-F243 AromaticContact CE2-CD2 3.96Å; Y180-F243 HydrophobicContact CE2-CD2 3.96Å; Y180-F243 AromaticContact CE2-CG 3.91Å; Y180-F243 HydrophobicContact CE2-CG 3.91Å; Y180-F243 HydrophobicContact CG-CD1 4.33Å; Y180-F243 AromaticContact CG-CD2 3.93Å; Y180-F243 HydrophobicContact CG-CD2 3.93Å; Y180-F243 HydrophobicContact CG-CE1 4.08Å; Y180-F243 AromaticContact CG-CE2 3.64Å; Y180-F243 HydrophobicContact CG-CE2 3.64Å; Y180-F243 HydrophobicContact CG-CG 4.27Å; Y180-F243 AromaticContact CG-CZ 3.73Å; Y180-F243 HydrophobicContact CG-CZ 3.73Å; Y180-F243 AromaticContact CZ-CD1 3.79Å; Y180-F243 AromaticContact CZ-CG 3.67Å; A183-F243 HydrophobicContact CB-CE1 4.49Å; A183-F243 HydrophobicContact CB-CZ 4.05Å; W239-F243 HydrophobicContact CE3-CD2 4.09Å; W239-F243 AromaticContact CE3-CE2 3.83Å; W239-F243 HydrophobicContact CE3-CE2 3.83Å; W239-F243 HydrophobicContact CZ3-CD2 4.01Å; W239-F243 AromaticContact CZ3-CE2 3.89Å; W239-F243 HydrophobicContact CZ3-CE2 3.89Å; W240-F243 PolarHBondContact O-N 2.93Å; E241-F243 PolarHBondContact O-N 3.32Å; E241-F243 VanDerWaalsContact O-N 3.16Å; F243-V245 VanDerWaalsContact C-N 3.33Å; F243-V245 HydrophobicContact CB-CG2 4.32Å; F243-V245 PolarHBondContact O-N 3.15Å
244	S	92.4	Very high	93.7	Very high	118 Å²	118	67.3 Å²	67.3	83%	0.825	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	36.7	-179.5	-54	0	0	0	0	114.3	W240 E241	W240-S244 PolarHBondContact O-N 3.43Å; E241-S244 PolarHBondContact O-N 3.09Å
245	V	94.2	Very high	94	Very high	14 Å²	14	67.5 Å²	67.5	9%	0.085	35%	0.345	C	S	.	.			trans	-106.4	138	178.5	-178.8	0	0	0	0	110.2	A216 C219 W240 F243 V250	A216-V245 HydrophobicContact CB-CG1 3.68Å; A216-V245 HydrophobicContact CB-CG2 4.14Å; C219-V245 HydrophobicContact CB-CG1 4.28Å; C219-V245 HydrophobicContact CB-CG2 4.4Å; W240-V245 HydrophobicContact CB-CB 4.43Å; W240-V245 PolarHBondContact O-N 3.44Å; F243-V245 VanDerWaalsContact C-N 3.33Å; F243-V245 HydrophobicContact CB-CG2 4.32Å; F243-V245 PolarHBondContact O-N 3.15Å; V245-V250 HydrophobicContact CG1-CG2 3.74Å
246	S	95	Very high	94.3	Very high	52 Å²	52	60.8 Å²	60.8	36%	0.364	32%	0.322	S	S	.	.			trans	-77.4	146.2	175	70	0	0	0	0	112.4	E248 S249 V250	S246-E248 PolarHBondContact O-N 3.46Å; S246-S249 WeakPolarHBondContact O-CB 3.48Å; S246-S249 PolarHBondContact O-N 2.85Å; S246-S249 PolarHBondContact OG-N 3.43Å; S246-S249 PolarHBondContact OG-OG 2.98Å; S246-V250 PolarHBondContact O-N 2.95Å
247	E	95.2	Very high	94.8	Very high	110 Å²	110	52 Å²	52	51%	0.514	28%	0.281	S	S	.	.	H	α-helix	trans	-57.5	-36.9	176.3	178.4	166.8	-153.9	0	0	112.4	W240 S249 V250 H251	W240-E247 HydrophobicContact CZ2-CB 4.09Å; W240-E247 HydrophobicContact CZ2-CG 3.77Å; E247-S249 VanDerWaalsContact C-N 3.33Å; E247-S249 PolarHBondContact O-N 3.36Å; E247-V250 PolarHBondContact O-N 2.7Å; E247-H251 VanDerWaalsContact CG-ND1 3.33Å; E247-H251 WeakPolarHBondContact CG-ND1 3.41Å; E247-H251 PolarHBondContact O-N 3.36Å; E247-H251 PolarHBondContact O-ND1 3.3Å; E247-H251 IonicContact OE1-CE1 3.9Å; E247-H251 PolarHBondContact OE1-CE1 2.6Å
248	E	96	Very high	95.2	Very high	158 Å²	158	51.2 Å²	51.2	74%	0.738	27%	0.27	S	S	*	.	H	α-helix	trans	-57.6	-44.3	174.2	-59.5	170.5	151.7	0	0	111.7	S246 H251 E252	S246-E248 PolarHBondContact O-N 3.46Å; E248-H251 PolarHBondContact O-N 3.29Å; E248-E252 PolarHBondContact O-N 2.95Å
249	S	95.7	Very high	95.4	Very high	22 Å²	22	57 Å²	57	15%	0.154	29%	0.29	C	S	.	.	H	α-helix	trans	-64.3	-43	178.2	-60.6	0	0	0	0	111.3	S246 E247 H251 I253	S246-S249 WeakPolarHBondContact O-CB 3.48Å; S246-S249 PolarHBondContact O-N 2.85Å; S246-S249 PolarHBondContact OG-N 3.43Å; S246-S249 PolarHBondContact OG-OG 2.98Å; E247-S249 VanDerWaalsContact C-N 3.33Å; E247-S249 PolarHBondContact O-N 3.36Å; S249-H251 VanDerWaalsContact C-N 3.35Å; S249-H251 PolarHBondContact O-N 3.22Å; S249-I253 WeakPolarHBondContact O-CB 3.46Å; S249-I253 VanDerWaalsContact O-CD1 3.27Å; S249-I253 WeakPolarHBondContact O-CD1 3.39Å; S249-I253 WeakPolarHBondContact O-CG1 3.24Å; S249-I253 PolarHBondContact O-N 2.83Å; S249-I253 VanDerWaalsContact O-N 3.08Å
250	V	96.9	Very high	95.4	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.8	-45.2	177.6	176.5	0	0	0	0	110.6	C219 Y223 W240 V245 S246 E247 A254	C219-V250 HydrophobicContact CB-CG2 3.98Å; Y223-V250 HydrophobicContact CD1-CG1 3.48Å; Y223-V250 VanDerWaalsContact CD1-CG1 3.48Å; Y223-V250 HydrophobicContact CD2-CG1 4.31Å; Y223-V250 HydrophobicContact CE1-CG1 4.21Å; Y223-V250 HydrophobicContact CG-CG1 3.51Å; W240-V250 HydrophobicContact CB-CG2 3.91Å; W240-V250 HydrophobicContact CD2-CG2 4.11Å; W240-V250 HydrophobicContact CE3-CG1 4.26Å; W240-V250 HydrophobicContact CG-CG2 3.85Å; V245-V250 HydrophobicContact CG1-CG2 3.74Å; S246-V250 PolarHBondContact O-N 2.95Å; E247-V250 PolarHBondContact O-N 2.7Å; V250-A254 WeakPolarHBondContact O-CB 3.41Å; V250-A254 PolarHBondContact O-N 2.94Å; V250-A254 VanDerWaalsContact O-N 3.15Å
251	H	96.6	Very high	95.5	Very high	60 Å²	60	61.2 Å²	61.2	28%	0.278	31%	0.308	S	S	.	.	H	α-helix	trans	-69.9	-46.4	179.8	-77	94.1	0	0	0	113.3	Y223 E247 E248 S249 I253 A254 L255	Y223-H251 AromaticContact CE1-CD2 3.76Å; Y223-H251 AromaticContact CE1-NE2 3.52Å; Y223-H251 AromaticContact CZ-CE1 3.99Å; Y223-H251 AromaticContact CZ-NE2 3.48Å; Y223-H251 PolarHBondContact OH-NE2 3.47Å; E247-H251 VanDerWaalsContact CG-ND1 3.33Å; E247-H251 WeakPolarHBondContact CG-ND1 3.41Å; E247-H251 PolarHBondContact O-N 3.36Å; E247-H251 PolarHBondContact O-ND1 3.3Å; E247-H251 IonicContact OE1-CE1 3.9Å; E247-H251 PolarHBondContact OE1-CE1 2.6Å; E248-H251 PolarHBondContact O-N 3.29Å; S249-H251 VanDerWaalsContact C-N 3.35Å; S249-H251 PolarHBondContact O-N 3.22Å; H251-I253 VanDerWaalsContact C-N 3.31Å; H251-I253 PolarHBondContact O-N 3.18Å; H251-A254 PolarHBondContact O-N 2.78Å; H251-L255 WeakPolarHBondContact O-CB 3.39Å; H251-L255 VanDerWaalsContact O-CG 3.31Å; H251-L255 WeakPolarHBondContact O-CG 3.48Å; H251-L255 PolarHBondContact O-N 3.47Å
252	E	96.6	Very high	95.6	Very high	57 Å²	57	59.4 Å²	59.4	27%	0.266	31%	0.311	S	S	.	.	H	α-helix	trans	-66.2	-32	179	-100.2	-65.4	123.2	0	0	112.8	R211 Y212 E248 C256 R259	R211-E252 IonicContact NH2-OE2 3.67Å; R211-E252 PolarHBondContact NH2-OE2 3.43Å; Y212-E252 WeakPolarHBondContact OH-CB 3.4Å; E248-E252 PolarHBondContact O-N 2.95Å; E252-C256 VanDerWaalsContact O-CB 3.25Å; E252-C256 WeakPolarHBondContact O-CB 3.4Å; E252-C256 PolarHBondContact O-N 3.4Å; E252-R259 IonicContact OE1-CZ 2.76Å; E252-R259 IonicContact OE1-NH1 2.96Å; E252-R259 PolarHBondContact OE1-NH1 3.18Å; E252-R259 IonicContact OE1-NH2 3.75Å; E252-R259 PolarHBondContact OE1-NH2 2.75Å; E252-R259 IonicContact OE2-NH1 2.95Å; E252-R259 PolarHBondContact OE2-NH1 3.41Å
253	I	97.2	Very high	95.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-67.1	-43.1	173.1	-70	166.8	0	0	0	111	I208 Y212 A216 I217 S249 H251 C256 L257	I208-I253 HydrophobicContact CB-CG1 4.49Å; I208-I253 HydrophobicContact CD1-CG2 3.74Å; I208-I253 HydrophobicContact CG2-CG1 4.29Å; Y212-I253 HydrophobicContact CD1-CD1 4.23Å; Y212-I253 HydrophobicContact CD2-CD1 3.69Å; Y212-I253 HydrophobicContact CD2-CG1 3.52Å; Y212-I253 HydrophobicContact CE2-CD1 4.19Å; Y212-I253 HydrophobicContact CE2-CG1 3.6Å; Y212-I253 HydrophobicContact CG-CD1 3.72Å; Y212-I253 HydrophobicContact CG-CG1 4.07Å; A216-I253 HydrophobicContact CB-CD1 4.07Å; A216-I253 WeakPolarHBondContact O-CD1 3.21Å; I217-I253 HydrophobicContact CG1-CD1 4.35Å; S249-I253 WeakPolarHBondContact O-CB 3.46Å; S249-I253 VanDerWaalsContact O-CD1 3.27Å; S249-I253 WeakPolarHBondContact O-CD1 3.39Å; S249-I253 WeakPolarHBondContact O-CG1 3.24Å; S249-I253 PolarHBondContact O-N 2.83Å; S249-I253 VanDerWaalsContact O-N 3.08Å; H251-I253 VanDerWaalsContact C-N 3.31Å; H251-I253 PolarHBondContact O-N 3.18Å; I253-C256 PolarHBondContact O-N 3.45Å; I253-L257 PolarHBondContact O-N 2.83Å; I253-L257 VanDerWaalsContact O-N 3.13Å
254	A	97.4	Very high	95.7	Very high	6 Å²	6	58.8 Å²	58.8	5%	0.05	31%	0.314	C	S	.	.	H	α-helix	trans	-63.9	-43.7	174.7	0	0	0	0	0	112	Y223 L224 V250 H251 L257 L258	Y223-A254 HydrophobicContact CD1-CB 4.21Å; L224-A254 HydrophobicContact CB-CB 4.23Å; L224-A254 HydrophobicContact CD1-CB 4.38Å; V250-A254 WeakPolarHBondContact O-CB 3.41Å; V250-A254 PolarHBondContact O-N 2.94Å; V250-A254 VanDerWaalsContact O-N 3.15Å; H251-A254 PolarHBondContact O-N 2.78Å; A254-L257 PolarHBondContact O-N 2.77Å; A254-L258 WeakPolarHBondContact O-CG 3.45Å; A254-L258 PolarHBondContact O-N 2.89Å
255	L	97	Very high	95.5	Very high	76 Å²	76	60.7 Å²	60.7	40%	0.398	31%	0.308	S	S	.	.	H	α-helix	trans	-64.1	-39.7	175.3	-71.6	171.4	0	0	0	112.1	H251 L257 L258 R259	H251-L255 WeakPolarHBondContact O-CB 3.39Å; H251-L255 VanDerWaalsContact O-CG 3.31Å; H251-L255 WeakPolarHBondContact O-CG 3.48Å; H251-L255 PolarHBondContact O-N 3.47Å; L255-L257 VanDerWaalsContact C-N 3.34Å; L255-L257 PolarHBondContact O-N 2.91Å; L255-L258 PolarHBondContact O-N 3.29Å; L255-R259 WeakPolarHBondContact O-CB 3.47Å; L255-R259 WeakPolarHBondContact O-CG 3.48Å; L255-R259 PolarHBondContact O-N 3.23Å
256	C	96.2	Very high	95.2	Very high	14 Å²	14	62.4 Å²	62.4	10%	0.095	32%	0.318	C	S	.	.	H	α-helix	trans	-62.7	-40.4	176	-168.6	0	0	0	0	111.8	D207 I208 E252 I253 R259 L260	D207-C256 PolarHBondContact OD1-SG 3.1Å; D207-C256 VanDerWaalsContact OD1-SG 3.42Å; I208-C256 HydrophobicContact CG2-CB 3.95Å; E252-C256 VanDerWaalsContact O-CB 3.25Å; E252-C256 WeakPolarHBondContact O-CB 3.4Å; E252-C256 PolarHBondContact O-N 3.4Å; I253-C256 PolarHBondContact O-N 3.45Å; C256-R259 PolarHBondContact O-N 3.26Å; C256-L260 PolarHBondContact O-N 3.48Å
257	L	96.3	Very high	95.1	Very high	0 Å²	0	64 Å²	64	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-64.5	-44.1	171.6	-89.9	168.5	0	0	0	112.9	Y199 D202 L224 I253 A254 L255 R259 L260 Y261	Y199-L257 HydrophobicContact CD1-CD1 4.29Å; Y199-L257 HydrophobicContact CD1-CD2 4.48Å; Y199-L257 HydrophobicContact CG-CD1 4.37Å; D202-L257 HydrophobicContact CB-CD2 4.37Å; L224-L257 HydrophobicContact CD2-CB 3.7Å; L224-L257 HydrophobicContact CD2-CD1 3.93Å; L224-L257 HydrophobicContact CD2-CG 4.44Å; I253-L257 PolarHBondContact O-N 2.83Å; I253-L257 VanDerWaalsContact O-N 3.13Å; A254-L257 PolarHBondContact O-N 2.77Å; L255-L257 VanDerWaalsContact C-N 3.34Å; L255-L257 PolarHBondContact O-N 2.91Å; L257-R259 PolarHBondContact O-N 3.13Å; L257-L260 HydrophobicContact CD2-CD2 4.4Å; L257-L260 WeakPolarHBondContact O-CB 3.49Å; L257-L260 PolarHBondContact O-N 3.08Å; L257-Y261 HydrophobicContact CB-CE2 4.36Å; L257-Y261 HydrophobicContact CD2-CE2 3.97Å; L257-Y261 WeakPolarHBondContact O-CD2 3.46Å; L257-Y261 PolarHBondContact O-N 2.91Å; L257-Y261 VanDerWaalsContact O-N 3.09Å
258	L	96.7	Very high	95	Very high	86 Å²	86	59.7 Å²	59.7	45%	0.45	30%	0.304	S	S	.	.	H	α-helix	trans	-62.9	-41.3	176.1	-70.9	172	0	0	0	112	L224 A254 L255 L260 Y261 A262	L224-L258 HydrophobicContact CD1-CD1 4.17Å; L224-L258 HydrophobicContact CD1-CD2 4.1Å; L224-L258 HydrophobicContact CD1-CG 4.06Å; A254-L258 WeakPolarHBondContact O-CG 3.45Å; A254-L258 PolarHBondContact O-N 2.89Å; L255-L258 PolarHBondContact O-N 3.29Å; L258-L260 VanDerWaalsContact C-N 3.33Å; L258-L260 PolarHBondContact O-N 2.91Å; L258-Y261 PolarHBondContact O-N 2.78Å; L258-A262 WeakPolarHBondContact O-CB 3.45Å; L258-A262 PolarHBondContact O-N 3.19Å
259	R	96.1	Very high	94.8	Very high	133 Å²	133	54.6 Å²	54.6	50%	0.502	29%	0.294	S	S	.	.	H	α-helix	trans	-58.7	-41.6	172.5	-70.5	165.6	-171.8	145.9	3.6	111.2	E252 L255 C256 L257 A262 R263	E252-R259 IonicContact OE1-CZ 2.76Å; E252-R259 IonicContact OE1-NH1 2.96Å; E252-R259 PolarHBondContact OE1-NH1 3.18Å; E252-R259 IonicContact OE1-NH2 3.75Å; E252-R259 PolarHBondContact OE1-NH2 2.75Å; E252-R259 IonicContact OE2-NH1 2.95Å; E252-R259 PolarHBondContact OE2-NH1 3.41Å; L255-R259 WeakPolarHBondContact O-CB 3.47Å; L255-R259 WeakPolarHBondContact O-CG 3.48Å; L255-R259 PolarHBondContact O-N 3.23Å; C256-R259 PolarHBondContact O-N 3.26Å; L257-R259 PolarHBondContact O-N 3.13Å; R259-A262 PolarHBondContact O-N 3.16Å; R259-R263 PolarHBondContact O-N 3.43Å; R259-R263 VanDerWaalsContact O-N 3.14Å
260	L	95.6	Very high	94.6	Very high	25 Å²	25	60.1 Å²	60.1	13%	0.131	32%	0.315	C	S	.	.	H	α-helix	trans	-60	-47.5	174.5	178	71.4	0	0	0	112.2	I56 D202 R205 T206 C256 L257 L258 R263	I56-L260 HydrophobicContact CD1-CD1 3.69Å; I56-L260 HydrophobicContact CG1-CD1 4.08Å; D202-L260 HydrophobicContact CB-CD2 4.39Å; D202-L260 WeakPolarHBondContact O-CD2 3.43Å; R205-L260 HydrophobicContact CB-CD1 4.28Å; R205-L260 HydrophobicContact CB-CD2 4.36Å; T206-L260 HydrophobicContact CG2-CB 4.03Å; T206-L260 HydrophobicContact CG2-CD1 4.34Å; T206-L260 HydrophobicContact CG2-CD2 3.97Å; T206-L260 HydrophobicContact CG2-CG 4.33Å; C256-L260 PolarHBondContact O-N 3.48Å; L257-L260 HydrophobicContact CD2-CD2 4.4Å; L257-L260 WeakPolarHBondContact O-CB 3.49Å; L257-L260 PolarHBondContact O-N 3.08Å; L258-L260 VanDerWaalsContact C-N 3.33Å; L258-L260 PolarHBondContact O-N 2.91Å; L260-R263 WeakPolarHBondContact O-CB 3.31Å; L260-R263 PolarHBondContact O-N 2.94Å
261	Y	95.1	Very high	94.5	Very high	82 Å²	82	60.5 Å²	60.5	32%	0.322	32%	0.317	S	S	.	.	H	α-helix	trans	-71	-33.6	-179.5	-64.9	-61.6	0	0	0	113.2	Y199 D202 L257 L258 R263 R509	Y199-Y261 AromaticContact CD1-CE2 3.64Å; Y199-Y261 HydrophobicContact CD1-CE2 3.64Å; Y199-Y261 AromaticContact CD1-CZ 3.87Å; Y199-Y261 VanDerWaalsContact CD1-OH 3.25Å; Y199-Y261 WeakPolarHBondContact CD1-OH 3.29Å; Y199-Y261 HydrophobicContact CE1-CD2 4.36Å; Y199-Y261 AromaticContact CE1-CE2 3.43Å; Y199-Y261 HydrophobicContact CE1-CE2 3.43Å; Y199-Y261 VanDerWaalsContact CE1-CE2 3.43Å; Y199-Y261 AromaticContact CE1-CZ 3.87Å; D202-Y261 HydrophobicContact CB-CE1 4.37Å; D202-Y261 VanDerWaalsContact CB-OH 3.24Å; D202-Y261 WeakPolarHBondContact CB-OH 3.44Å; D202-Y261 WeakPolarHBondContact OD2-CE1 3.29Å; D202-Y261 PolarHBondContact OD2-OH 3.14Å; L257-Y261 HydrophobicContact CB-CE2 4.36Å; L257-Y261 HydrophobicContact CD2-CE2 3.97Å; L257-Y261 WeakPolarHBondContact O-CD2 3.46Å; L257-Y261 PolarHBondContact O-N 2.91Å; L257-Y261 VanDerWaalsContact O-N 3.09Å; L258-Y261 PolarHBondContact O-N 2.78Å; Y261-R263 VanDerWaalsContact C-N 3.33Å; Y261-R509 PolarHBondContact O-NH1 2.97Å; Y261-R509 PolarHBondContact O-NH2 3.25Å
262	A	95.8	Very high	94.3	Very high	69 Å²	69	59.6 Å²	59.6	57%	0.57	31%	0.313	S	S	*	.	H	α-helix	trans	-63.4	-38.1	174.9	0	0	0	0	0	112	L258 R259 R509	L258-A262 WeakPolarHBondContact O-CB 3.45Å; L258-A262 PolarHBondContact O-N 3.19Å; R259-A262 PolarHBondContact O-N 3.16Å; A262-R509 PolarHBondContact O-NH2 3.28Å
263	R	94.1	Very high	94.2	Very high	48 Å²	48	59.4 Å²	59.4	18%	0.181	32%	0.318	C	S	.	.	S	Bend	trans	-50	138.1	-174.9	-154.6	172.1	-172.2	79.5	9.2	113.7	E49 I52 D53 R259 L260 Y261 R509	E49-R263 PolarHBondContact O-NH2 3.35Å; E49-R263 VanDerWaalsContact O-NH2 3.09Å; E49-R263 IonicContact OE2-CZ 3.82Å; E49-R263 IonicContact OE2-NH1 3.74Å; E49-R263 PolarHBondContact OE2-NH1 3.4Å; E49-R263 IonicContact OE2-NH2 3.08Å; E49-R263 PolarHBondContact OE2-NH2 2.91Å; I52-R263 VanDerWaalsContact CG2-CZ 3.5Å; D53-R263 IonicContact OD1-CZ 2.68Å; D53-R263 IonicContact OD1-NE 3.82Å; D53-R263 PolarHBondContact OD1-NE 2.9Å; D53-R263 IonicContact OD1-NH2 3.26Å; D53-R263 PolarHBondContact OD1-NH2 3.02Å; R259-R263 PolarHBondContact O-N 3.43Å; R259-R263 VanDerWaalsContact O-N 3.14Å; L260-R263 WeakPolarHBondContact O-CB 3.31Å; L260-R263 PolarHBondContact O-N 2.94Å; Y261-R263 VanDerWaalsContact C-N 3.33Å; R263-R509 PolarHBondContact O-NH1 3.2Å
264	P	93	Very high	94.1	Very high	104 Å²	104	61.7 Å²	61.7	68%	0.675	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-69.7	164.4	174.1	29.9	-35.7	0	0	0	111.9
265	K	88.3	Confident	93.9	Very high	159 Å²	159	61.4 Å²	61.4	69%	0.691	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-75.5	127	172.3	-72.8	-170.2	175.2	-173.9	0	110.3
266	V	89.6	Confident	93.8	Very high	50 Å²	50	60.5 Å²	60.5	30%	0.303	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-75.3	136.4	-177.9	-168.1	0	0	0	0	111.3	D53 V268 L271	D53-V266 HydrophobicContact CB-CG1 4.03Å; D53-V266 HydrophobicContact CB-CG2 3.83Å; D53-V266 WeakPolarHBondContact OD1-CG2 3.41Å; D53-V266 WeakPolarHBondContact OD2-CG1 3.47Å; D53-V266 WeakPolarHBondContact OD2-CG2 3.49Å; V266-V268 PolarHBondContact O-N 3.28Å; V266-L271 HydrophobicContact CG1-CB 4.34Å; V266-L271 HydrophobicContact CG1-CD1 4.21Å; V266-L271 HydrophobicContact CG1-CD2 4.12Å; V266-L271 HydrophobicContact CG1-CG 4.47Å
267	D	91.8	Very high	93.7	Very high	84 Å²	84	66.1 Å²	66.1	45%	0.449	36%	0.357	S	S	.	.			trans	-83.3	103.9	166	179.6	-3.6	0	0	0	109.8	G269 K270 L271	D267-G269 PolarHBondContact O-N 2.95Å; D267-G269 PolarHBondContact OD1-N 3.11Å; D267-K270 HydrophobicContact CB-CB 4.45Å; D267-K270 HydrophobicContact CB-CD 4.02Å; D267-K270 HydrophobicContact CB-CG 4.21Å; D267-K270 PolarHBondContact O-N 3.5Å; D267-K270 VanDerWaalsContact O-N 3.1Å; D267-K270 WeakPolarHBondContact OD2-CE 3.38Å; D267-K270 WeakPolarHBondContact OD2-CG 3.37Å; D267-K270 IonicContact OD2-NZ 2.76Å; D267-L271 PolarHBondContact O-N 3.08Å; D267-L271 VanDerWaalsContact O-N 3.13Å
268	V	92.4	Very high	93.6	Very high	21 Å²	21	67.4 Å²	67.4	13%	0.127	36%	0.364	C	S	.	.	H	α-helix	trans	-63.6	-23.6	-177.7	-170.6	0	0	0	0	112.5	L57 V266 K270 L271 E272	L57-V268 HydrophobicContact CD1-CG1 4.39Å; L57-V268 HydrophobicContact CD1-CG2 3.75Å; L57-V268 HydrophobicContact CD2-CB 4.44Å; L57-V268 HydrophobicContact CD2-CG1 3.56Å; L57-V268 HydrophobicContact CD2-CG2 4.07Å; V266-V268 PolarHBondContact O-N 3.28Å; V268-K270 VanDerWaalsContact C-N 3.35Å; V268-L271 PolarHBondContact O-N 3.21Å; V268-E272 HydrophobicContact CG1-CG 4.16Å; V268-E272 WeakPolarHBondContact O-CB 3.34Å; V268-E272 WeakPolarHBondContact O-CG 3.32Å; V268-E272 PolarHBondContact O-N 2.87Å
269	G	91.8	Very high	93.5	Very high	51 Å²	51	66.4 Å²	66.4	53%	0.526	36%	0.355	S	S	.	.	H	α-helix	trans	-65.5	-38.2	174.5	0	0	0	0	0	112.5	D267 S273	D267-G269 PolarHBondContact O-N 2.95Å; D267-G269 PolarHBondContact OD1-N 3.11Å; G269-S273 PolarHBondContact O-N 3.46Å
270	K	93.3	Very high	93.4	Very high	138 Å²	138	66.7 Å²	66.7	60%	0.6	36%	0.359	S	S	*	.	H	α-helix	trans	-72.1	-40.5	173.4	-63.2	175.7	-171.7	171.3	0	111.3	D267 V268 S273 V274	D267-K270 HydrophobicContact CB-CB 4.45Å; D267-K270 HydrophobicContact CB-CD 4.02Å; D267-K270 HydrophobicContact CB-CG 4.21Å; D267-K270 PolarHBondContact O-N 3.5Å; D267-K270 VanDerWaalsContact O-N 3.1Å; D267-K270 WeakPolarHBondContact OD2-CE 3.38Å; D267-K270 WeakPolarHBondContact OD2-CG 3.37Å; D267-K270 IonicContact OD2-NZ 2.76Å; V268-K270 VanDerWaalsContact C-N 3.35Å; K270-S273 PolarHBondContact O-N 3.25Å; K270-S273 PolarHBondContact O-OG 2.89Å; K270-V274 WeakPolarHBondContact O-CG2 3.39Å; K270-V274 PolarHBondContact O-N 3.28Å
271	L	93.3	Very high	93.3	Very high	8 Å²	8	68.1 Å²	68.1	4%	0.042	37%	0.372	C	S	.	.	H	α-helix	trans	-65.1	-40.7	179.4	-156	72.8	0	0	0	112.2	T50 D53 L54 L57 V266 D267 V268 L275	T50-L271 HydrophobicContact CG2-CD1 4.06Å; D53-L271 HydrophobicContact CB-CD1 3.71Å; D53-L271 HydrophobicContact CB-CD2 4.12Å; L54-L271 HydrophobicContact CD2-CD2 3.49Å; L54-L271 VanDerWaalsContact CD2-CD2 3.49Å; L54-L271 HydrophobicContact CD2-CG 3.77Å; L54-L271 HydrophobicContact CG-CD1 4.18Å; L54-L271 HydrophobicContact CG-CD2 3.71Å; L54-L271 HydrophobicContact CG-CG 3.86Å; L57-L271 HydrophobicContact CD2-CD2 3.74Å; V266-L271 HydrophobicContact CG1-CB 4.34Å; V266-L271 HydrophobicContact CG1-CD1 4.21Å; V266-L271 HydrophobicContact CG1-CD2 4.12Å; V266-L271 HydrophobicContact CG1-CG 4.47Å; D267-L271 PolarHBondContact O-N 3.08Å; D267-L271 VanDerWaalsContact O-N 3.13Å; V268-L271 PolarHBondContact O-N 3.21Å; L271-L275 WeakPolarHBondContact O-CB 2.41Å; L271-L275 PolarHBondContact O-N 3.13Å
272	E	93.7	Very high	93.1	Very high	41 Å²	41	65.7 Å²	65.7	19%	0.192	36%	0.363	C	S	.	.	H	α-helix	trans	-67.2	-32.8	172.7	-75.8	-174.1	-140.1	0	0	112.1	Y97 R129 R132 V268 A276	Y97-E272 HydrophobicContact CE1-CG 4.42Å; Y97-E272 WeakPolarHBondContact OH-CG 3.33Å; Y97-E272 PolarHBondContact OH-OE1 3.4Å; Y97-E272 VanDerWaalsContact OH-OE1 3.04Å; R129-E272 IonicContact CZ-OE2 3.54Å; R129-E272 IonicContact NH1-OE2 3.84Å; R129-E272 IonicContact NH2-OE1 3.78Å; R129-E272 IonicContact NH2-OE2 3.53Å; R129-E272 PolarHBondContact NH2-OE2 3.05Å; R132-E272 IonicContact CZ-OE1 3.89Å; R132-E272 IonicContact NH1-OE1 2.7Å; R132-E272 IonicContact NH2-OE1 2.77Å; R132-E272 PolarHBondContact NH2-OE1 3.25Å; V268-E272 HydrophobicContact CG1-CG 4.16Å; V268-E272 WeakPolarHBondContact O-CB 3.34Å; V268-E272 WeakPolarHBondContact O-CG 3.32Å; V268-E272 PolarHBondContact O-N 2.87Å; E272-A276 PolarHBondContact O-N 2.96Å
273	S	94.4	Very high	92.9	Very high	53 Å²	53	65 Å²	65	37%	0.371	36%	0.357	S	S	.	.	H	α-helix	trans	-76.2	-41.4	179.1	78.5	0	0	0	0	113.5	G269 K270 L275 A276 Q277	G269-S273 PolarHBondContact O-N 3.46Å; K270-S273 PolarHBondContact O-N 3.25Å; K270-S273 PolarHBondContact O-OG 2.89Å; S273-L275 VanDerWaalsContact C-N 3.31Å; S273-L275 PolarHBondContact O-N 3.34Å; S273-A276 WeakPolarHBondContact O-CB 3.46Å; S273-A276 PolarHBondContact O-N 3.06Å; S273-Q277 WeakPolarHBondContact O-CG 3.41Å; S273-Q277 PolarHBondContact O-N 3.33Å
274	V	94.3	Very high	92.9	Very high	48 Å²	48	66.6 Å²	66.6	29%	0.291	37%	0.367	S	S	.	.	H	α-helix	trans	-59	-44.6	171.6	171.7	0	0	0	0	110.3	T50 K270 A276 Q277 L278	T50-V274 HydrophobicContact CG2-CG1 4.09Å; K270-V274 WeakPolarHBondContact O-CG2 3.39Å; K270-V274 PolarHBondContact O-N 3.28Å; V274-A276 VanDerWaalsContact C-N 3.28Å; V274-A276 PolarHBondContact O-N 3.12Å; V274-Q277 PolarHBondContact O-N 3.3Å; V274-L278 HydrophobicContact CG1-CD1 4.06Å; V274-L278 WeakPolarHBondContact O-CG 3.45Å; V274-L278 PolarHBondContact O-N 3.47Å
275	L	93.4	Very high	92.8	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-62.3	-31.3	173.5	-87.3	-176.7	0	0	0	114	M46 L54 F92 Y97 L271 S273 R279	M46-L275 HydrophobicContact SD-CD2 3.76Å; L54-L275 HydrophobicContact CD1-CD1 3.72Å; L54-L275 HydrophobicContact CD1-CD2 3.8Å; L54-L275 HydrophobicContact CD1-CG 3.79Å; L54-L275 HydrophobicContact CD2-CD1 3.47Å; L54-L275 VanDerWaalsContact CD2-CD1 3.47Å; L54-L275 HydrophobicContact CD2-CG 4.34Å; L54-L275 HydrophobicContact CG-CD1 4.26Å; F92-L275 HydrophobicContact CB-CD2 4.29Å; Y97-L275 HydrophobicContact CD1-CD1 3.71Å; Y97-L275 HydrophobicContact CE1-CD1 3.72Å; L271-L275 WeakPolarHBondContact O-CB 2.41Å; L271-L275 PolarHBondContact O-N 3.13Å; S273-L275 VanDerWaalsContact C-N 3.31Å; S273-L275 PolarHBondContact O-N 3.34Å; L275-R279 WeakPolarHBondContact O-CB 3.49Å; L275-R279 VanDerWaalsContact O-CG 3.28Å; L275-R279 WeakPolarHBondContact O-CG 3.5Å; L275-R279 PolarHBondContact O-N 3.09Å
276	A	94.1	Very high	92.9	Very high	57 Å²	57	60.6 Å²	60.6	47%	0.471	34%	0.338	S	S	.	.	H	α-helix	trans	-71.8	-41.9	174.7	0	0	0	0	0	111.5	E272 S273 V274 R279 K280	E272-A276 PolarHBondContact O-N 2.96Å; S273-A276 WeakPolarHBondContact O-CB 3.46Å; S273-A276 PolarHBondContact O-N 3.06Å; V274-A276 VanDerWaalsContact C-N 3.28Å; V274-A276 PolarHBondContact O-N 3.12Å; A276-R279 PolarHBondContact O-N 3.27Å; A276-K280 PolarHBondContact O-N 2.8Å
277	Q	95.2	Very high	93	Very high	131 Å²	131	64 Å²	64	61%	0.612	35%	0.351	S	S	*	.	H	α-helix	trans	-61.8	-47.3	175.5	-69.1	172.6	-2.6	0	0	111.8	S273 V274 R279 K280 S281	S273-Q277 WeakPolarHBondContact O-CG 3.41Å; S273-Q277 PolarHBondContact O-N 3.33Å; V274-Q277 PolarHBondContact O-N 3.3Å; Q277-R279 VanDerWaalsContact C-N 3.31Å; Q277-R279 PolarHBondContact O-N 3.35Å; Q277-K280 PolarHBondContact O-N 3.11Å; Q277-S281 PolarHBondContact O-N 3.32Å; Q277-S281 PolarHBondContact O-OG 3.44Å
278	L	93.9	Very high	93.1	Very high	27 Å²	27	66.8 Å²	66.8	14%	0.141	36%	0.355	C	S	.	.	H	α-helix	trans	-62.9	-34.5	176.7	-69.8	172.5	0	0	0	112.8	K45 M46 V93 V274 S281 Q282	K45-L278 WeakPolarHBondContact O-CD2 3.3Å; M46-L278 HydrophobicContact CB-CD1 3.89Å; M46-L278 HydrophobicContact CG-CD1 3.65Å; M46-L278 HydrophobicContact SD-CD1 4.18Å; V93-L278 HydrophobicContact CG1-CB 3.98Å; V93-L278 HydrophobicContact CG2-CB 3.98Å; V93-L278 HydrophobicContact CG2-CD1 4.09Å; V274-L278 HydrophobicContact CG1-CD1 4.06Å; V274-L278 WeakPolarHBondContact O-CG 3.45Å; V274-L278 PolarHBondContact O-N 3.47Å; L278-S281 PolarHBondContact O-OG 3.08Å; L278-Q282 VanDerWaalsContact O-CB 3.31Å; L278-Q282 WeakPolarHBondContact O-CB 3.4Å; L278-Q282 PolarHBondContact O-N 3.46Å
279	R	94.5	Very high	93	Very high	66 Å²	66	70.4 Å²	70.4	25%	0.249	37%	0.371	C	S	.	.	H	α-helix	trans	-70.9	-38.3	174	-76.3	178.6	-167.2	113.9	12.5	112.6	F92 V93 L275 A276 Q277 A283	F92-R279 PolarHBondContact O-NH2 3.03Å; V93-R279 HydrophobicContact CG1-CG 3.87Å; V93-R279 WeakPolarHBondContact O-CD 3.46Å; V93-R279 VanDerWaalsContact O-CG 3.24Å; V93-R279 WeakPolarHBondContact O-CG 3.22Å; V93-R279 PolarHBondContact O-NE 3.22Å; L275-R279 WeakPolarHBondContact O-CB 3.49Å; L275-R279 VanDerWaalsContact O-CG 3.28Å; L275-R279 WeakPolarHBondContact O-CG 3.5Å; L275-R279 PolarHBondContact O-N 3.09Å; A276-R279 PolarHBondContact O-N 3.27Å; Q277-R279 VanDerWaalsContact C-N 3.31Å; Q277-R279 PolarHBondContact O-N 3.35Å; R279-A283 PolarHBondContact O-N 3.48Å
280	K	94.3	Very high	93	Very high	138 Å²	138	72.2 Å²	72.2	60%	0.6	37%	0.368	S	S	*	.	H	α-helix	trans	-62.1	-52.5	174.5	177.5	175.8	168.4	179.1	0	110.7	A276 Q277 Q282 A283 E284	A276-K280 PolarHBondContact O-N 2.8Å; Q277-K280 PolarHBondContact O-N 3.11Å; K280-Q282 VanDerWaalsContact C-N 3.31Å; K280-Q282 PolarHBondContact O-N 3.46Å; K280-A283 WeakPolarHBondContact O-CA 3.28Å; K280-A283 WeakPolarHBondContact O-CB 3.34Å; K280-A283 PolarHBondContact O-N 3.21Å; K280-E284 WeakPolarHBondContact CE-OE1 3.31Å; K280-E284 HydrophobicContact CG-CG 4.45Å; K280-E284 IonicContact NZ-OE1 2.91Å; K280-E284 WeakPolarHBondContact O-CG 3.49Å; K280-E284 PolarHBondContact O-N 3.15Å
281	S	93.4	Very high	92.9	Very high	56 Å²	56	70 Å²	70	39%	0.392	36%	0.36	S	S	.	.	H	α-helix	trans	-64.5	-33.2	-179.7	66.3	0	0	0	0	113.1	Q277 L278 A285	Q277-S281 PolarHBondContact O-N 3.32Å; Q277-S281 PolarHBondContact O-OG 3.44Å; L278-S281 PolarHBondContact O-OG 3.08Å; S281-A285 VanDerWaalsContact O-CB 3.29Å; S281-A285 WeakPolarHBondContact O-CB 3.44Å; S281-A285 PolarHBondContact O-N 3.36Å
282	Q	90.3	Very high	92.7	Very high	31 Å²	31	74.6 Å²	74.6	15%	0.145	38%	0.384	C	S	.	.	H	α-helix	trans	-68.9	-30.7	172	-165.4	-170.9	88.2	0	0	112.9	D44 V93 L278 K280 K286	D44-Q282 PolarHBondContact OD1-NE2 3.41Å; D44-Q282 PolarHBondContact OD2-NE2 3.34Å; V93-Q282 HydrophobicContact CG1-CB 4.39Å; L278-Q282 VanDerWaalsContact O-CB 3.31Å; L278-Q282 WeakPolarHBondContact O-CB 3.4Å; L278-Q282 PolarHBondContact O-N 3.46Å; K280-Q282 VanDerWaalsContact C-N 3.31Å; K280-Q282 PolarHBondContact O-N 3.46Å; Q282-K286 WeakPolarHBondContact O-CD 3.5Å; Q282-K286 WeakPolarHBondContact O-CG 3.47Å; Q282-K286 PolarHBondContact O-N 3.27Å
283	A	91.6	Very high	92.4	Very high	54 Å²	54	77.9 Å²	77.9	45%	0.446	40%	0.398	S	S	.	.	H	α-helix	trans	-70.5	-49.8	173.2	0	0	0	0	0	110.9	R279 K280 A285 K286 E287	R279-A283 PolarHBondContact O-N 3.48Å; K280-A283 WeakPolarHBondContact O-CA 3.28Å; K280-A283 WeakPolarHBondContact O-CB 3.34Å; K280-A283 PolarHBondContact O-N 3.21Å; A283-A285 VanDerWaalsContact C-N 3.25Å; A283-A285 PolarHBondContact O-N 3.45Å; A283-K286 PolarHBondContact O-N 2.77Å; A283-K286 VanDerWaalsContact O-N 3.07Å; A283-E287 PolarHBondContact O-N 3.05Å
284	E	93.4	Very high	92	Very high	81 Å²	81	82 Å²	82	38%	0.379	41%	0.409	S	S	.	.	H	α-helix	trans	-61.5	-30.3	177.6	-66.6	166.8	158.3	0	0	112.9	K280 R288	K280-E284 WeakPolarHBondContact CE-OE1 3.31Å; K280-E284 HydrophobicContact CG-CG 4.45Å; K280-E284 IonicContact NZ-OE1 2.91Å; K280-E284 WeakPolarHBondContact O-CG 3.49Å; K280-E284 PolarHBondContact O-N 3.15Å; E284-R288 WeakPolarHBondContact O-CG 3.43Å; E284-R288 PolarHBondContact O-N 3.25Å; E284-R288 PolarHBondContact O-NE 3.35Å
285	A	91.3	Very high	91.1	Very high	44 Å²	44	85.9 Å²	85.9	36%	0.364	42%	0.424	S	S	.	.	H	α-helix	trans	-68.5	-44	172.5	0	0	0	0	0	112.2	S281 A283 E289	S281-A285 VanDerWaalsContact O-CB 3.29Å; S281-A285 WeakPolarHBondContact O-CB 3.44Å; S281-A285 PolarHBondContact O-N 3.36Å; A283-A285 VanDerWaalsContact C-N 3.25Å; A283-A285 PolarHBondContact O-N 3.45Å; A285-E289 WeakPolarHBondContact O-CB 3.29Å; A285-E289 PolarHBondContact O-N 3.15Å
286	K	91	Very high	89.8	Confident	93 Å²	93	92.6 Å²	92.6	40%	0.404	46%	0.455	S	S	.	.	H	α-helix	trans	-69	-33.4	177.6	-70.9	165.7	-174.7	162.3	0	112.4	Q282 A283 E289 N290	Q282-K286 WeakPolarHBondContact O-CD 3.5Å; Q282-K286 WeakPolarHBondContact O-CG 3.47Å; Q282-K286 PolarHBondContact O-N 3.27Å; A283-K286 PolarHBondContact O-N 2.77Å; A283-K286 VanDerWaalsContact O-N 3.07Å; K286-E289 PolarHBondContact O-N 3.5Å; K286-N290 WeakPolarHBondContact O-CB 3.39Å; K286-N290 PolarHBondContact O-N 3.26Å; K286-N290 PolarHBondContact O-ND2 3.5Å
287	E	92.5	Very high	88.3	Confident	123 Å²	123	95.1 Å²	95.1	58%	0.575	47%	0.465	S	S	*	.	H	α-helix	trans	-62.5	-53.1	175.4	-170	150.1	-136.8	0	0	110.5	A283 E289 N290 E291	A283-E287 PolarHBondContact O-N 3.05Å; E287-E289 VanDerWaalsContact C-N 3.33Å; E287-E289 PolarHBondContact O-N 2.97Å; E287-N290 WeakPolarHBondContact O-CA 3.34Å; E287-N290 WeakPolarHBondContact O-CB 3.5Å; E287-N290 PolarHBondContact O-N 3.45Å; E287-E291 WeakPolarHBondContact O-CG 3.43Å; E287-E291 PolarHBondContact O-N 3.18Å
288	R	93	Very high	86.7	Confident	142 Å²	142	94.7 Å²	94.7	54%	0.536	47%	0.471	S	S	.	.	H	α-helix	trans	-59.3	-38.7	174.3	-71.4	175.5	-69.8	147.7	-7.9	113.6	E284 N290 E291 L292	E284-R288 WeakPolarHBondContact O-CG 3.43Å; E284-R288 PolarHBondContact O-N 3.25Å; E284-R288 PolarHBondContact O-NE 3.35Å; R288-N290 VanDerWaalsContact C-N 3.31Å; R288-N290 PolarHBondContact O-N 3.04Å; R288-E291 PolarHBondContact O-N 3.32Å; R288-L292 WeakPolarHBondContact O-CG 3.44Å; R288-L292 PolarHBondContact O-N 3.05Å
289	E	91.2	Very high	85	Confident	97 Å²	97	98.5 Å²	98.5	45%	0.453	50%	0.496	S	S	.	.	H	α-helix	trans	-61	-40.5	174.3	-166.6	-163.9	146.3	0	0	111.8	A285 K286 E287 K293	A285-E289 WeakPolarHBondContact O-CB 3.29Å; A285-E289 PolarHBondContact O-N 3.15Å; K286-E289 PolarHBondContact O-N 3.5Å; E287-E289 VanDerWaalsContact C-N 3.33Å; E287-E289 PolarHBondContact O-N 2.97Å; E289-K293 WeakPolarHBondContact O-CD 3.47Å; E289-K293 VanDerWaalsContact O-CG 3.3Å; E289-K293 WeakPolarHBondContact O-CG 3.28Å; E289-K293 PolarHBondContact O-N 3.49Å; E289-K293 VanDerWaalsContact O-N 3.15Å; E289-K293 IonicContact OE1-NZ 2.72Å; E289-K293 PolarHBondContact OE1-NZ 2.93Å
290	N	91.3	Very high	82.9	Confident	89 Å²	89	100.6 Å²	100.6	48%	0.476	52%	0.516	S	S	.	.	H	α-helix	trans	-71.9	-30.8	176.2	-70.4	-40.3	0	0	0	112.7	K286 E287 R288 K294	K286-N290 WeakPolarHBondContact O-CB 3.39Å; K286-N290 PolarHBondContact O-N 3.26Å; K286-N290 PolarHBondContact O-ND2 3.5Å; E287-N290 WeakPolarHBondContact O-CA 3.34Å; E287-N290 WeakPolarHBondContact O-CB 3.5Å; E287-N290 PolarHBondContact O-N 3.45Å; R288-N290 VanDerWaalsContact C-N 3.31Å; R288-N290 PolarHBondContact O-N 3.04Å; N290-K294 VanDerWaalsContact O-CG 3.31Å; N290-K294 WeakPolarHBondContact O-CG 3.43Å; N290-K294 PolarHBondContact O-N 2.93Å
291	E	90.9	Very high	80.7	Confident	92 Å²	92	99.4 Å²	99.4	43%	0.43	52%	0.523	S	S	.	.	H	α-helix	trans	-69	-47.3	174	-69.6	174.3	145	0	0	111.9	E287 R288 K293 K294 Q295	E287-E291 WeakPolarHBondContact O-CG 3.43Å; E287-E291 PolarHBondContact O-N 3.18Å; R288-E291 PolarHBondContact O-N 3.32Å; E291-K293 VanDerWaalsContact C-N 3.28Å; E291-K293 PolarHBondContact O-N 2.99Å; E291-K294 WeakPolarHBondContact O-CB 3.31Å; E291-K294 PolarHBondContact O-N 2.94Å; E291-K294 VanDerWaalsContact O-N 3.11Å; E291-Q295 PolarHBondContact O-N 3.35Å
292	L	89.3	Confident	78.5	Confident	104 Å²	104	102.9 Å²	102.9	55%	0.545	54%	0.544	S	S	.	.	H	α-helix	trans	-58.6	-40.5	175.4	-70.5	167	0	0	0	111.7	R288 K294 Q295 Q296	R288-L292 WeakPolarHBondContact O-CG 3.44Å; R288-L292 PolarHBondContact O-N 3.05Å; L292-K294 PolarHBondContact O-N 3.02Å; L292-Q295 PolarHBondContact O-N 2.94Å; L292-Q296 PolarHBondContact O-N 3.28Å
293	K	87.2	Confident	76.5	Confident	109 Å²	109	107.2 Å²	107.2	47%	0.474	58%	0.577	S	S	.	*	H	α-helix	trans	-62.7	-39.7	174.8	-76.8	169	174.5	174.7	0	112.9	E289 E291 Q296 T297	E289-K293 WeakPolarHBondContact O-CD 3.47Å; E289-K293 VanDerWaalsContact O-CG 3.3Å; E289-K293 WeakPolarHBondContact O-CG 3.28Å; E289-K293 PolarHBondContact O-N 3.49Å; E289-K293 VanDerWaalsContact O-N 3.15Å; E289-K293 IonicContact OE1-NZ 2.72Å; E289-K293 PolarHBondContact OE1-NZ 2.93Å; E291-K293 VanDerWaalsContact C-N 3.28Å; E291-K293 PolarHBondContact O-N 2.99Å; K293-Q296 PolarHBondContact O-N 3.36Å; K293-T297 PolarHBondContact O-N 3.22Å; K293-T297 PolarHBondContact O-OG1 3.35Å
294	K	85	Confident	74.3	Confident	141 Å²	141	111 Å²	111	61%	0.613	60%	0.595	S	S	*	*	H	α-helix	trans	-64.3	-38.8	174.1	-70.3	164.5	-175.1	172.1	0	112	N290 E291 L292 T297	N290-K294 VanDerWaalsContact O-CG 3.31Å; N290-K294 WeakPolarHBondContact O-CG 3.43Å; N290-K294 PolarHBondContact O-N 2.93Å; E291-K294 WeakPolarHBondContact O-CB 3.31Å; E291-K294 PolarHBondContact O-N 2.94Å; E291-K294 VanDerWaalsContact O-N 3.11Å; L292-K294 PolarHBondContact O-N 3.02Å; K294-T297 WeakPolarHBondContact CA-OG1 3.5Å; K294-T297 PolarHBondContact O-N 3.06Å; K294-T297 PolarHBondContact O-OG1 3.07Å
295	Q	75.8	Confident	72	Confident	128 Å²	128	118.4 Å²	118.4	60%	0.598	62%	0.62	S	S	*	*	H	α-helix	trans	-66.5	-43.2	178.5	-68.8	175.3	5.3	0	0	111.6	E291 L292 T297 V298	E291-Q295 PolarHBondContact O-N 3.35Å; L292-Q295 PolarHBondContact O-N 2.94Å; Q295-T297 VanDerWaalsContact C-N 3.3Å; Q295-T297 PolarHBondContact O-N 3Å; Q295-V298 PolarHBondContact O-N 3.33Å; Q295-V298 VanDerWaalsContact O-N 3.15Å
296	Q	66.5	Low	69.8	Low	141 Å²	141	120.9 Å²	120.9	66%	0.659	63%	0.634	S	S	*	*	H	α-helix	trans	-63.8	-30.8	177.3	-72.2	-178.8	-8.2	0	0	113.5	L292 K293 V298 T299	L292-Q296 PolarHBondContact O-N 3.28Å; K293-Q296 PolarHBondContact O-N 3.36Å; Q296-V298 PolarHBondContact O-N 3.06Å; Q296-T299 PolarHBondContact O-N 3.39Å; Q296-T299 PolarHBondContact O-OG1 3.33Å
297	T	62.2	Low	67.5	Low	110 Å²	110	123.7 Å²	123.7	68%	0.675	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-5.2	175.4	45.9	0	0	0	0	115	K293 K294 Q295	K293-T297 PolarHBondContact O-N 3.22Å; K293-T297 PolarHBondContact O-OG1 3.35Å; K294-T297 WeakPolarHBondContact CA-OG1 3.5Å; K294-T297 PolarHBondContact O-N 3.06Å; K294-T297 PolarHBondContact O-OG1 3.07Å; Q295-T297 VanDerWaalsContact C-N 3.3Å; Q295-T297 PolarHBondContact O-N 3Å
298	V	61.2	Low	65.3	Low	122 Å²	122	127.2 Å²	127.2	74%	0.739	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	-18.3	179.8	179.4	0	0	0	0	112.4	Q295 Q296	Q295-V298 PolarHBondContact O-N 3.33Å; Q295-V298 VanDerWaalsContact O-N 3.15Å; Q296-V298 PolarHBondContact O-N 3.06Å
299	T	59.7	Low	62.9	Low	108 Å²	108	125.2 Å²	125.2	66%	0.663	68%	0.677	S	S	*	*	S	Bend	trans	-98.9	5.3	-169.4	36.6	0	0	0	0	116.2	Q296 P301	Q296-T299 PolarHBondContact O-N 3.39Å; Q296-T299 PolarHBondContact O-OG1 3.33Å; T299-P301 VanDerWaalsContact O-CD 3.28Å; T299-P301 WeakPolarHBondContact O-CD 3.41Å
300	T	49.3	Very low	60.7	Low	110 Å²	110	129.9 Å²	129.9	68%	0.675	70%	0.696	S	S	*	*			trans	-106.9	96.9	174	50.2	0	0	0	0	112.3	P302	T300-P302 WeakPolarHBondContact O-CD 3.17Å
301	P	48.2	Very low	58.2	Low	113 Å²	113	128.8 Å²	128.8	73%	0.734	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-76.4	125.1	172.1	30.2	-32.8	0	0	0	111	T299 S303	T299-P301 VanDerWaalsContact O-CD 3.28Å; T299-P301 WeakPolarHBondContact O-CD 3.41Å; P301-S303 PolarHBondContact O-N 3.2Å
302	P	48.3	Very low	56.1	Low	129 Å²	129	134.8 Å²	134.8	84%	0.838	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-71.8	116.7	173.7	-15.6	30.8	0	0	0	110.7	T300	T300-P302 WeakPolarHBondContact O-CD 3.17Å
303	S	46.7	Very low	53.8	Low	121 Å²	121	137.7 Å²	137.7	85%	0.846	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-67.3	147.7	171.5	-60.1	0	0	0	0	111.7	P301	P301-S303 PolarHBondContact O-N 3.2Å
304	T	46.6	Very low	51.9	Low	133 Å²	133	138.1 Å²	138.1	82%	0.816	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-73.7	137.1	-173	45.7	0	0	0	0	113.6
305	R	44	Very low	49.8	Very low	238 Å²	238	137.4 Å²	137.4	90%	0.898	77%	0.769	S	S	*	*				-175.2	119.1	129.7	-105.3	163.9	173.1	169	-2.5	115.1
306	S	46.2	Very low	48	Very low	95 Å²	95	139.9 Å²	139.9	66%	0.664	78%	0.78	S	S	*	*			trans	27.2	114.4	139.4	57.7	0	0	0	0	120.9
307	D	41.9	Very low	46.9	Very low	152 Å²	152	141.2 Å²	141.2	81%	0.813	79%	0.792	S	S	*	*			trans	21	124.7	130.4	-52.7	-31.9	0	0	0	120.2
308	H	46.2	Very low	45.8	Very low	197 Å²	197	143.7 Å²	143.7	91%	0.912	80%	0.796	S	S	*	*			trans	-141.6	132	136.6	-100.6	-77.5	0	0	0	110.3
309	S	42.6	Very low	44.9	Very low	100 Å²	100	146.4 Å²	146.4	70%	0.699	81%	0.805	S	S	*	*			trans	-78.1	143.5	-179.4	117.4	0	0	0	0	111.7
310	F	44.4	Very low	43.9	Very low	196 Å²	196	145.7 Å²	145.7	86%	0.86	81%	0.805	S	S	*	*			trans	-154.3	126.9	136.3	-101.7	-69.1	0	0	0	110.7
311	G	39.5	Very low	43.5	Very low	66 Å²	66	150.8 Å²	150.8	68%	0.68	82%	0.817	S	S	*	*			trans	-112	143.3	175.6	0	0	0	0	0	112
312	Y	47.5	Very low	43.1	Very low	218 Å²	218	150.4 Å²	150.4	86%	0.855	82%	0.817	S	S	*	*			trans	-130.2	124.9	171.1	-90	-85.2	0	0	0	110.3
313	N	40.9	Very low	42.7	Very low	164 Å²	164	154.1 Å²	154.1	88%	0.877	82%	0.82	S	S	*	*			trans	-92.5	144.4	178.3	-80.8	-34.4	0	0	0	111.6
314	S	46.9	Very low	42.2	Very low	119 Å²	119	154.9 Å²	154.9	83%	0.832	82%	0.815	S	S	*	*			trans	-159.1	150	154.2	-88.2	0	0	0	0	110.6
315	P	40	Very low	42	Very low	125 Å²	125	156.1 Å²	156.1	81%	0.812	81%	0.811	S	S	*	*			trans	-115	165.2	-132.6	16	4.5	0	0	0	116.1
316	Q	39.1	Very low	41.7	Very low	180 Å²	180	151.1 Å²	151.1	84%	0.841	80%	0.803	S	S	*	*			trans	-79.4	147.2	169.4	-67.7	-179.6	-15	0	0	111.5
317	N	42.5	Very low	41.4	Very low	169 Å²	169	155.8 Å²	155.8	90%	0.904	81%	0.811	S	S	*	*			trans	-108.2	118.1	179.3	-147.8	-5.5	0	0	0	110.2
318	H	39.3	Very low	41.3	Very low	162 Å²	162	153.4 Å²	153.4	75%	0.75	80%	0.804	S	S	*	*			trans	-87.9	143.5	177	-92.6	-101.5	0	0	0	111.1
319	L	43.9	Very low	40.7	Very low	179 Å²	179	152 Å²	152	94%	0.937	80%	0.803	S	S	*	*			trans	-142.3	126.8	151.6	-159.6	67.8	0	0	0	110.8
320	S	38.6	Very low	40.4	Very low	94 Å²	94	151 Å²	151	66%	0.657	81%	0.809	S	S	*	*			trans	-110.9	152.4	-170.5	55	0	0	0	0	112.6
321	K	41	Very low	40	Very low	216 Å²	216	148.4 Å²	148.4	94%	0.939	80%	0.804	S	S	*	*			trans	-155.8	131.5	147.2	-115.2	163.4	-171.3	174.4	0	111.9
322	S	38.7	Very low	39.9	Very low	105 Å²	105	152.6 Å²	152.6	73%	0.734	81%	0.807	S	S	*	*			trans	-103	151.7	-169.9	-43.6	0	0	0	0	113
323	K	39.5	Very low	39.4	Very low	207 Å²	207	152 Å²	152	90%	0.9	81%	0.809	S	S	*	*			trans	-179.1	112.9	136.4	-98.9	163.6	-176.9	-173.2	0	107.2
324	N	38.1	Very low	39	Very low	137 Å²	137	149.3 Å²	149.3	73%	0.733	80%	0.804	S	S	*	*			cis	104.8	149.9	30.5	-168.4	22.5	0	0	0	111.7
325	Q	42.3	Very low	38.5	Very low	159 Å²	159	149.2 Å²	149.2	74%	0.743	80%	0.798	S	S	*	*			trans	81	116	-174.3	-52.7	-172.7	8.1	0	0	113.6
326	N	37.6	Very low	38.3	Very low	134 Å²	134	150.2 Å²	150.2	72%	0.717	80%	0.796	S	S	*	*				94.6	140.9	59.5	-73.6	-22.1	0	0	0	111
327	K	40	Very low	38.1	Very low	193 Å²	193	146.7 Å²	146.7	84%	0.839	79%	0.791	S	S	*	*			cis	-154.2	170.9	-2.9	-120.4	-175.8	175.5	-175.2	0	109.4
328	P	39.4	Very low	37.7	Very low	101 Å²	101	148 Å²	148	66%	0.656	79%	0.789	S	S	*	*			trans	-121.6	-177.2	-165	44.9	-35.8	0	0	0	117.2
329	N	32.9	Very low	37.4	Very low	167 Å²	167	144.6 Å²	144.6	89%	0.893	79%	0.789	S	S	*	*			trans	85.8	145.2	154.9	-68	-4.5	0	0	0	121.4
330	G	37.3	Very low	36.9	Very low	80 Å²	80	144.7 Å²	144.7	83%	0.825	79%	0.785	S	S	*	*			trans	128.1	107.6	178.5	0	0	0	0	0	112.2
331	N	34.8	Very low	36.7	Very low	141 Å²	141	145.5 Å²	145.5	75%	0.754	79%	0.787	S	S	*	*			cis	147.1	136.1	-11.1	176.1	42.3	0	0	0	106.7
332	M	37.5	Very low	36.5	Very low	154 Å²	154	144 Å²	144	76%	0.759	78%	0.784	S	S	*	*			trans	53.9	110.9	163	-86.1	-176.9	161.8	0	0	120.8
333	K	37.1	Very low	36.2	Very low	206 Å²	206	146.1 Å²	146.1	90%	0.896	79%	0.787	S	S	*	*				-170.1	177.3	94.7	-105.3	168.1	-177.2	177.8	0	112.4
334	S	32.7	Very low	36.2	Very low	108 Å²	108	142.9 Å²	142.9	76%	0.755	78%	0.778	S	S	*	*			trans	-127.4	178.2	-155	52.2	0	0	0	0	114.4
335	V	37.3	Very low	36.3	Very low	117 Å²	117	142.7 Å²	142.7	71%	0.709	78%	0.782	S	S	*	*			trans	105.6	105.5	163.7	-175.5	0	0	0	0	115.8
336	D	34.3	Very low	36.2	Very low	145 Å²	145	140.2 Å²	140.2	78%	0.775	78%	0.778	S	S	*	*				40.5	139.8	129.7	-51	-24.7	0	0	0	120.9
337	S	36.7	Very low	36.5	Very low	106 Å²	106	140.9 Å²	140.9	74%	0.741	79%	0.786	S	S	*	*			cis	-165.9	164.1	18.9	33.9	0	0	0	0	115.3
338	K	32.7	Very low	36.6	Very low	198 Å²	198	138.2 Å²	138.2	86%	0.861	78%	0.775	S	S	*	*			trans	72.4	123.8	149.1	-84.1	179.5	175.6	179.6	0	122.8
339	A	33.5	Very low	37.4	Very low	90 Å²	90	136.6 Å²	136.6	74%	0.744	77%	0.77	S	S	*	*			trans	66.3	139.8	136.2	0	0	0	0	0	120
340	E	33.3	Very low	38.3	Very low	181 Å²	181	134.2 Å²	134.2	85%	0.846	76%	0.764	S	S	*	*			cis	-150.3	156	-12.3	-103.7	-68.9	97.8	0	0	107.6
341	P	35.3	Very low	39.3	Very low	110 Å²	110	137.9 Å²	137.9	71%	0.714	77%	0.765	S	S	*	*			trans	-103.2	177	-163	39.9	-35.7	0	0	0	116.5
342	E	36.5	Very low	41.4	Very low	186 Å²	186	132.9 Å²	132.9	87%	0.869	74%	0.74	S	S	*	*			trans	-79.2	159.5	-179.1	-61	-172.3	144	0	0	115.1
343	D	32.8	Very low	43.1	Very low	148 Å²	148	133 Å²	133	79%	0.791	74%	0.743	S	S	*	*			trans	-85.9	114	-176.8	-178.4	14.7	0	0	0	113.1
344	I	39	Very low	44.8	Very low	139 Å²	139	127.6 Å²	127.6	71%	0.713	72%	0.724	S	S	*	*			trans	-131.3	116.9	167.1	-62.1	-177	0	0	0	109.9	T346	I344-T346 PolarHBondContact O-N 2.95Å
345	T	39.2	Very low	46.6	Very low	134 Å²	134	124.5 Å²	124.5	82%	0.822	71%	0.705	S	S	*	*			trans	-66.9	115.2	-179.9	28.9	0	0	0	0	112.3
346	T	39.6	Very low	48.4	Very low	107 Å²	107	121.9 Å²	121.9	66%	0.656	69%	0.692	S	S	*	*			trans	-108.8	154.3	174.3	49	0	0	0	0	111.7	I344 F348	I344-T346 PolarHBondContact O-N 2.95Å; T346-F348 PolarHBondContact O-N 3.45Å
347	V	44.3	Very low	50.5	Low	148 Å²	148	117.8 Å²	117.8	90%	0.897	68%	0.678	S	S	*	*			trans	-80.1	114.4	-171.9	-179.2	0	0	0	0	110.4
348	F	43	Very low	52.6	Low	136 Å²	136	117.2 Å²	117.2	60%	0.596	67%	0.666	S	S	*	*			trans	-69.7	135.5	178.3	-73.2	-76.4	0	0	0	113	T346 L354	T346-F348 PolarHBondContact O-N 3.45Å; F348-L354 HydrophobicContact CE2-CD1 4.17Å; F348-L354 HydrophobicContact CZ-CD1 4.34Å
349	A	55.7	Low	54.7	Low	68 Å²	68	110.5 Å²	110.5	56%	0.562	65%	0.647	S	S	*	*			trans	-65	152.8	171.5	0	0	0	0	0	111.8	N351 S352	A349-N351 PolarHBondContact O-N 3.24Å; A349-S352 PolarHBondContact O-N 3.2Å
350	P	52.3	Low	56.9	Low	116 Å²	116	110.9 Å²	110.9	75%	0.753	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-6.1	-169.8	24.7	-35	0	0	0	115.9
351	N	58.1	Low	59.2	Low	158 Å²	158	105.1 Å²	105.1	85%	0.845	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	9.3	-175.8	-57.3	14.2	0	0	0	112.9	A349	A349-N351 PolarHBondContact O-N 3.24Å
352	S	79	Confident	61.3	Low	35 Å²	35	106.8 Å²	106.8	25%	0.245	62%	0.616	C	S	.	*			trans	-75	140.2	179.7	178	0	0	0	0	112.6	A349 L354 A355 S356	A349-S352 PolarHBondContact O-N 3.2Å; S352-L354 PolarHBondContact O-N 2.87Å; S352-L354 VanDerWaalsContact O-N 3.15Å; S352-L354 PolarHBondContact OG-N 3.18Å; S352-A355 WeakPolarHBondContact O-CB 3.44Å; S352-A355 PolarHBondContact O-N 3.34Å; S352-S356 PolarHBondContact O-N 3.05Å
353	L	74.1	Confident	63.3	Low	156 Å²	156	100.5 Å²	100.5	82%	0.817	60%	0.596	S	S	*	*	H	α-helix	trans	-51.1	-35.1	169.9	-82.9	165.5	0	0	0	112.5	A355 S356 A357	L353-A355 PolarHBondContact O-N 3.13Å; L353-S356 PolarHBondContact O-N 3.2Å; L353-A357 PolarHBondContact O-N 2.77Å
354	L	70.9	Confident	65.5	Low	94 Å²	94	97.5 Å²	97.5	49%	0.492	58%	0.583	S	S	.	*	H	α-helix	trans	-66	-37.5	178.7	-155.9	164.6	0	0	0	111.3	F348 S352 A357 L358	F348-L354 HydrophobicContact CE2-CD1 4.17Å; F348-L354 HydrophobicContact CZ-CD1 4.34Å; S352-L354 PolarHBondContact O-N 2.87Å; S352-L354 VanDerWaalsContact O-N 3.15Å; S352-L354 PolarHBondContact OG-N 3.18Å; L354-A357 PolarHBondContact O-N 3.41Å; L354-L358 WeakPolarHBondContact O-CB 3.33Å; L354-L358 PolarHBondContact O-N 3.36Å
355	A	70.4	Confident	67.1	Low	42 Å²	42	93.3 Å²	93.3	35%	0.347	57%	0.569	S	S	.	*	H	α-helix	trans	-66.4	-40.3	175.7	0	0	0	0	0	111.7	S352 L353 L358 A359	S352-A355 WeakPolarHBondContact O-CB 3.44Å; S352-A355 PolarHBondContact O-N 3.34Å; L353-A355 PolarHBondContact O-N 3.13Å; A355-L358 PolarHBondContact O-N 3.41Å; A355-A359 PolarHBondContact O-N 3.1Å
356	S	76.1	Confident	68.6	Low	63 Å²	63	89.8 Å²	89.8	44%	0.441	55%	0.554	S	S	.	*	H	α-helix	trans	-63.7	-44.6	173.8	-174.6	0	0	0	0	111.9	S352 L353 L358 A359 N360	S352-S356 PolarHBondContact O-N 3.05Å; L353-S356 PolarHBondContact O-N 3.2Å; S356-L358 VanDerWaalsContact C-N 3.32Å; S356-L358 PolarHBondContact O-N 2.74Å; S356-A359 PolarHBondContact O-N 3.04Å; S356-N360 PolarHBondContact O-N 2.72Å
357	A	78	Confident	70.2	Confident	58 Å²	58	88.8 Å²	88.8	48%	0.479	55%	0.548	S	S	.	.	H	α-helix	trans	-59.5	-40.8	174.8	0	0	0	0	0	112.6	L353 L354 N360 A361	L353-A357 PolarHBondContact O-N 2.77Å; L354-A357 PolarHBondContact O-N 3.41Å; A357-N360 PolarHBondContact O-N 3.48Å; A357-A361 WeakPolarHBondContact O-CB 3.39Å; A357-A361 PolarHBondContact O-N 2.83Å
358	L	80.6	Confident	71.4	Confident	94 Å²	94	87 Å²	87	49%	0.492	53%	0.532	S	S	.	.	H	α-helix	trans	-70.6	-32.9	178	-136.9	171.7	0	0	0	112.3	L354 A355 S356 K362	L354-L358 WeakPolarHBondContact O-CB 3.33Å; L354-L358 PolarHBondContact O-N 3.36Å; A355-L358 PolarHBondContact O-N 3.41Å; S356-L358 VanDerWaalsContact C-N 3.32Å; S356-L358 PolarHBondContact O-N 2.74Å; L358-K362 WeakPolarHBondContact O-CG 3.37Å; L358-K362 PolarHBondContact O-N 2.93Å
359	A	77.7	Confident	72.5	Confident	57 Å²	57	85.4 Å²	85.4	47%	0.471	53%	0.533	S	S	.	.	H	α-helix	trans	-66.2	-47.3	171.1	0	0	0	0	0	111.4	A355 S356 A361 K362 A363	A355-A359 PolarHBondContact O-N 3.1Å; S356-A359 PolarHBondContact O-N 3.04Å; A359-A361 PolarHBondContact O-N 2.92Å; A359-K362 WeakPolarHBondContact O-CB 3.36Å; A359-K362 PolarHBondContact O-N 2.91Å; A359-K362 VanDerWaalsContact O-N 3.17Å; A359-A363 PolarHBondContact O-N 2.84Å
360	N	80	Confident	72.8	Confident	98 Å²	98	85.4 Å²	85.4	52%	0.524	53%	0.533	S	S	.	.	H	α-helix	trans	-61.9	-41.2	177.4	-69.3	-12.5	0	0	0	111.9	S356 A357 K362 A363 V364	S356-N360 PolarHBondContact O-N 2.72Å; A357-N360 PolarHBondContact O-N 3.48Å; N360-K362 VanDerWaalsContact C-N 3.32Å; N360-K362 PolarHBondContact O-N 3.23Å; N360-A363 PolarHBondContact O-N 3.42Å; N360-V364 WeakPolarHBondContact O-CG2 3.47Å; N360-V364 PolarHBondContact O-N 2.94Å
361	A	80.1	Confident	73	Confident	60 Å²	60	84 Å²	84	50%	0.496	53%	0.527	S	S	.	.	H	α-helix	trans	-60.4	-39.3	174.9	0	0	0	0	0	112.6	A357 A359 A365	A357-A361 WeakPolarHBondContact O-CB 3.39Å; A357-A361 PolarHBondContact O-N 2.83Å; A359-A361 PolarHBondContact O-N 2.92Å; A361-A365 WeakPolarHBondContact O-CB 3.45Å; A361-A365 PolarHBondContact O-N 2.98Å; A361-A365 VanDerWaalsContact O-N 3.1Å
362	K	79.8	Confident	72.7	Confident	145 Å²	145	85.6 Å²	85.6	63%	0.63	53%	0.526	S	S	*	.	H	α-helix	trans	-67.5	-40.2	173.7	-75.6	178.6	177.4	179.8	0	112.5	L358 A359 N360 A365 A366	L358-K362 WeakPolarHBondContact O-CG 3.37Å; L358-K362 PolarHBondContact O-N 2.93Å; A359-K362 WeakPolarHBondContact O-CB 3.36Å; A359-K362 PolarHBondContact O-N 2.91Å; A359-K362 VanDerWaalsContact O-N 3.17Å; N360-K362 VanDerWaalsContact C-N 3.32Å; N360-K362 PolarHBondContact O-N 3.23Å; K362-A365 PolarHBondContact O-N 3.4Å; K362-A366 PolarHBondContact O-N 3.34Å
363	A	78.1	Confident	71.2	Confident	54 Å²	54	89.2 Å²	89.2	45%	0.446	55%	0.551	S	S	.	*	H	α-helix	trans	-62.2	-47.1	176.6	0	0	0	0	0	111.4	A359 N360 A365 A366 T367	A359-A363 PolarHBondContact O-N 2.84Å; N360-A363 PolarHBondContact O-N 3.42Å; A363-A365 VanDerWaalsContact C-N 3.35Å; A363-A365 PolarHBondContact O-N 3.4Å; A363-A366 WeakPolarHBondContact O-CB 3.37Å; A363-A366 PolarHBondContact O-N 2.94Å; A363-A366 VanDerWaalsContact O-N 3.16Å; A363-T367 PolarHBondContact O-N 3.32Å; A363-T367 PolarHBondContact O-OG1 3.32Å
364	V	80.4	Confident	69.6	Low	86 Å²	86	84.9 Å²	84.9	52%	0.521	54%	0.544	S	S	.	.	H	α-helix	trans	-59.8	-43	176	171.5	0	0	0	0	111.5	N360 A366 T367 I368	N360-V364 WeakPolarHBondContact O-CG2 3.47Å; N360-V364 PolarHBondContact O-N 2.94Å; V364-A366 VanDerWaalsContact C-N 3.34Å; V364-A366 PolarHBondContact O-N 3.24Å; V364-T367 PolarHBondContact O-N 2.99Å; V364-I368 HydrophobicContact CG1-CD1 3.78Å; V364-I368 HydrophobicContact CG1-CG1 4.45Å; V364-I368 VanDerWaalsContact O-CG1 3.31Å; V364-I368 WeakPolarHBondContact O-CG1 3.45Å; V364-I368 PolarHBondContact O-N 3.14Å
365	A	72.8	Confident	67.9	Low	51 Å²	51	88.6 Å²	88.6	42%	0.421	56%	0.561	S	S	.	*	H	α-helix	trans	-63	-37.6	176	0	0	0	0	0	113	A361 K362 A363 T369	A361-A365 WeakPolarHBondContact O-CB 3.45Å; A361-A365 PolarHBondContact O-N 2.98Å; A361-A365 VanDerWaalsContact O-N 3.1Å; K362-A365 PolarHBondContact O-N 3.4Å; A363-A365 VanDerWaalsContact C-N 3.35Å; A363-A365 PolarHBondContact O-N 3.4Å; A365-T369 PolarHBondContact O-N 3.4Å; A365-T369 VanDerWaalsContact O-N 3.15Å; A365-T369 PolarHBondContact O-OG1 2.95Å
366	A	70.6	Confident	66.2	Low	60 Å²	60	94.7 Å²	94.7	50%	0.496	59%	0.586	S	S	.	*	H	α-helix	trans	-64.7	-46	173.9	0	0	0	0	0	111.3	K362 A363 V364 I368 T369 A370	K362-A366 PolarHBondContact O-N 3.34Å; A363-A366 WeakPolarHBondContact O-CB 3.37Å; A363-A366 PolarHBondContact O-N 2.94Å; A363-A366 VanDerWaalsContact O-N 3.16Å; V364-A366 VanDerWaalsContact C-N 3.34Å; V364-A366 PolarHBondContact O-N 3.24Å; A366-I368 PolarHBondContact O-N 3.32Å; A366-T369 WeakPolarHBondContact O-CB 3.4Å; A366-T369 PolarHBondContact O-N 3.01Å; A366-T369 VanDerWaalsContact O-N 3.13Å; A366-A370 PolarHBondContact O-N 3.02Å
367	T	73.1	Confident	64.2	Low	86 Å²	86	97.8 Å²	97.8	53%	0.528	60%	0.602	S	S	.	*	H	α-helix	trans	-60.1	-47.2	177.2	-53.9	0	0	0	0	112	A363 V364 T369 A370 S371	A363-T367 PolarHBondContact O-N 3.32Å; A363-T367 PolarHBondContact O-OG1 3.32Å; V364-T367 PolarHBondContact O-N 2.99Å; T367-T369 PolarHBondContact O-N 2.88Å; T367-A370 PolarHBondContact O-N 2.28Å; T367-A370 VanDerWaalsContact O-N 3.11Å; T367-S371 PolarHBondContact O-N 3.36Å; T367-S371 PolarHBondContact O-OG 2.46Å; T367-S371 VanDerWaalsContact O-OG 3.13Å
368	I	69.5	Low	62	Low	111 Å²	111	102.5 Å²	102.5	57%	0.569	62%	0.619	S	S	*	*	H	α-helix	trans	-58.3	-35.6	176.4	-68.4	166.6	0	0	0	111.4	V364 A366	V364-I368 HydrophobicContact CG1-CD1 3.78Å; V364-I368 HydrophobicContact CG1-CG1 4.45Å; V364-I368 VanDerWaalsContact O-CG1 3.31Å; V364-I368 WeakPolarHBondContact O-CG1 3.45Å; V364-I368 PolarHBondContact O-N 3.14Å; A366-I368 PolarHBondContact O-N 3.32Å
369	T	65.8	Low	59.9	Low	102 Å²	102	106.1 Å²	106.1	63%	0.626	63%	0.634	S	S	*	*	H	α-helix	trans	-72.6	-39.5	177.5	-51.2	0	0	0	0	111.7	A365 A366 T367	A365-T369 PolarHBondContact O-N 3.4Å; A365-T369 VanDerWaalsContact O-N 3.15Å; A365-T369 PolarHBondContact O-OG1 2.95Å; A366-T369 WeakPolarHBondContact O-CB 3.4Å; A366-T369 PolarHBondContact O-N 3.01Å; A366-T369 VanDerWaalsContact O-N 3.13Å; T367-T369 PolarHBondContact O-N 2.88Å
370	A	61.5	Low	58	Low	68 Å²	68	110.5 Å²	110.5	56%	0.562	65%	0.648	S	S	*	*	H	α-helix	trans	-68	-47.1	177.1	0	0	0	0	0	112.4	A366 T367 K372 S373	A366-A370 PolarHBondContact O-N 3.02Å; T367-A370 PolarHBondContact O-N 2.28Å; T367-A370 VanDerWaalsContact O-N 3.11Å; A370-K372 PolarHBondContact O-N 3.49Å; A370-K372 VanDerWaalsContact O-N 3.08Å; A370-S373 PolarHBondContact O-N 3.13Å
371	S	56.3	Low	55.9	Low	87 Å²	87	110.5 Å²	110.5	61%	0.608	66%	0.656	S	S	*	*	H	α-helix	trans	-59.3	-22.9	178.8	-60.5	0	0	0	0	113.3	T367 S373	T367-S371 PolarHBondContact O-N 3.36Å; T367-S371 PolarHBondContact O-OG 2.46Å; T367-S371 VanDerWaalsContact O-OG 3.13Å; S371-S373 VanDerWaalsContact C-N 3.31Å
372	K	51.9	Low	53.9	Low	190 Å²	190	116.4 Å²	116.4	83%	0.826	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	2.1	178.7	-151.7	165.1	-172.3	171.2	0	114.3	A370	A370-K372 PolarHBondContact O-N 3.49Å; A370-K372 VanDerWaalsContact O-N 3.08Å
373	S	47.4	Very low	51.8	Low	112 Å²	112	116.2 Å²	116.2	78%	0.783	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.3	8.8	-177.3	-166.7	0	0	0	0	114.4	A370 S371	A370-S373 PolarHBondContact O-N 3.13Å; S371-S373 VanDerWaalsContact C-N 3.31Å
374	G	41	Very low	49.8	Very low	64 Å²	64	116.7 Å²	116.7	66%	0.66	69%	0.691	S	S	*	*			trans	-124.4	29.5	-167.3	0	0	0	0	0	116.8
375	M	34.1	Very low	47.7	Very low	173 Å²	173	119 Å²	119	85%	0.852	71%	0.706	S	S	*	*			trans	-140.7	59.7	-175.8	-69.3	-173.6	67.7	0	0	114.7
376	I	36.5	Very low	46	Very low	170 Å²	170	123.7 Å²	123.7	87%	0.872	72%	0.724	S	S	*	*			trans	-148.1	81.5	157.5	-47.4	177.8	0	0	0	111
377	T	32.3	Very low	44.7	Very low	128 Å²	128	125.7 Å²	125.7	79%	0.785	73%	0.732	S	S	*	*			trans	-158.8	129.6	154.4	43.9	0	0	0	0	110
378	D	32.8	Very low	42.8	Very low	156 Å²	156	127.1 Å²	127.1	83%	0.834	75%	0.745	S	S	*	*			trans	140.3	120	142	-75.4	-0.7	0	0	0	112.9
379	E	36.4	Very low	41.3	Very low	170 Å²	170	128 Å²	128	79%	0.794	76%	0.755	S	S	*	*			trans	-170.6	150.8	150.7	-111	-77.1	62.9	0	0	110.1
380	L	38.6	Very low	40	Very low	149 Å²	149	128.1 Å²	128.1	78%	0.78	76%	0.756	S	S	*	*			trans	65.8	99	165.2	-65.9	160.5	0	0	0	120.6
381	S	34.2	Very low	38.7	Very low	99 Å²	99	130.4 Å²	130.4	69%	0.692	77%	0.765	S	S	*	*			trans	-55.9	172.6	153.8	65.9	0	0	0	0	113.7
382	K	38.4	Very low	37.8	Very low	183 Å²	183	135 Å²	135	80%	0.796	78%	0.777	S	S	*	*			cis	-178.4	157.2	46.4	-146.3	167.2	-173.5	172.2	0	111.9
383	V	37	Very low	36.6	Very low	142 Å²	142	135.2 Å²	135.2	86%	0.861	78%	0.778	S	S	*	*			trans	69.1	137.3	169.4	-166.8	0	0	0	0	115.8
384	G	35.1	Very low	35.8	Very low	63 Å²	63	136 Å²	136	65%	0.649	78%	0.781	S	S	*	*			cis	166.2	147.7	-11.7	0	0	0	0	0	114.5
385	T	37.3	Very low	35.2	Very low	136 Å²	136	141.7 Å²	141.7	83%	0.834	79%	0.791	S	S	*	*			trans	82.6	89.6	158.5	-39.4	0	0	0	0	121.3
386	D	36.4	Very low	35.5	Very low	148 Å²	148	138.7 Å²	138.7	79%	0.791	78%	0.784	S	S	*	*				58.1	157	105.2	-89.6	38	0	0	0	124.2
387	P	42.9	Very low	35.6	Very low	103 Å²	103	135.6 Å²	135.6	67%	0.669	78%	0.778	S	S	*	*				-142.4	-154.1	-95.3	40	-16.1	0	0	0	116
388	S	34.4	Very low	35.8	Very low	115 Å²	115	138.3 Å²	138.3	80%	0.804	78%	0.781	S	S	*	*			trans	77.8	162.9	174.4	86.3	0	0	0	0	115.5
389	V	37.7	Very low	35.9	Very low	129 Å²	129	138 Å²	138	78%	0.782	78%	0.78	S	S	*	*			cis	-161.2	163.1	-0.9	92.8	0	0	0	0	106.8
390	V	37.2	Very low	36	Very low	105 Å²	105	136.1 Å²	136.1	64%	0.636	78%	0.78	S	S	*	*			cis	-158.3	156.4	-14	94.9	0	0	0	0	107
391	P	34.2	Very low	35.7	Very low	116 Å²	116	134.1 Å²	134.1	75%	0.753	78%	0.778	S	S	*	*			trans	-90.9	156.1	-175.7	35.8	-35.2	0	0	0	114.7
392	H	38.5	Very low	36.2	Very low	185 Å²	185	135.3 Å²	135.3	86%	0.856	78%	0.784	S	S	*	*			trans	-141.7	159.1	171.1	-98.3	-84.9	0	0	0	114.4
393	K	27.2	Very low	36.2	Very low	194 Å²	194	130 Å²	130	84%	0.843	78%	0.78	S	S	*	*			trans	-153.9	131.4	-173.9	175.3	-166.6	179.6	-170.5	0	109
394	C	30.6	Very low	36	Very low	127 Å²	127	128.9 Å²	128.9	86%	0.858	78%	0.779	S	S	*	*			trans	-160.7	157.5	164.8	-96.1	0	0	0	0	111.7
395	E	27.3	Very low	36.2	Very low	184 Å²	184	131.5 Å²	131.5	86%	0.86	79%	0.785	S	S	*	*			trans	-118.7	-145.3	170.2	-67.5	-175.4	152.5	0	0	109.1
396	P	41.7	Very low	36.2	Very low	111 Å²	111	135.2 Å²	135.2	72%	0.721	79%	0.789	S	S	*	*				-126.7	175	-99.6	39.9	-23.6	0	0	0	114.6
397	S	36.7	Very low	36	Very low	105 Å²	105	137 Å²	137	73%	0.734	79%	0.793	S	S	*	*			trans	-175.4	138.9	151.2	29.1	0	0	0	0	113.6
398	E	37.3	Very low	35.6	Very low	184 Å²	184	140.4 Å²	140.4	86%	0.86	81%	0.805	S	S	*	*				44.6	143.5	129.7	-69	160.4	-148.7	0	0	122
399	D	34.9	Very low	35.7	Very low	149 Å²	149	139.1 Å²	139.1	80%	0.797	80%	0.801	S	S	*	*			cis	-168.9	-166.9	-13.5	-158	-9.9	0	0	0	109.6
400	V	39.6	Very low	35.3	Very low	131 Å²	131	140.9 Å²	140.9	79%	0.794	80%	0.801	S	S	*	*			trans	97.6	127.4	159.5	-170	0	0	0	0	118.6
401	S	31.7	Very low	35.3	Very low	108 Å²	108	141 Å²	141	76%	0.755	80%	0.804	S	S	*	*			trans	-143.2	-177.8	166.2	-142.6	0	0	0	0	107.1
402	P	43.2	Very low	35.1	Very low	124 Å²	124	141.5 Å²	141.5	81%	0.805	80%	0.8	S	S	*	*			cis	-131	-172.3	-8.8	41.8	-25.1	0	0	0	113.4
403	G	39.3	Very low	35	Very low	70 Å²	70	141.1 Å²	141.1	72%	0.722	80%	0.798	S	S	*	*			trans	-175.7	140.8	169	0	0	0	0	0	115.3
404	S	31.9	Very low	35.2	Very low	119 Å²	119	138.5 Å²	138.5	83%	0.832	79%	0.792	S	S	*	*			trans	-159.9	-178.7	-176.6	-58.9	0	0	0	0	110.1
405	P	40.8	Very low	35.5	Very low	119 Å²	119	139.9 Å²	139.9	77%	0.773	79%	0.791	S	S	*	*				-122.6	-175.2	-55.2	38	-24.9	0	0	0	111.2
406	K	37.5	Very low	35.7	Very low	213 Å²	213	138 Å²	138	93%	0.926	79%	0.787	S	S	*	*			trans	-160.9	148.2	152.8	-114.2	157.9	-170.9	175.3	0	113.7
407	Q	30.5	Very low	35.5	Very low	185 Å²	185	141 Å²	141	86%	0.864	80%	0.795	S	S	*	*			trans	-114.2	153.1	179.6	-60.4	167	-51.4	0	0	110.6
408	L	35.8	Very low	35.3	Very low	176 Å²	176	140.3 Å²	140.3	92%	0.921	79%	0.79	S	S	*	*			trans	170.2	150.9	156.8	-90.8	143.5	0	0	0	107.2
409	A	36.3	Very low	35.2	Very low	88 Å²	88	138.2 Å²	138.2	73%	0.727	79%	0.785	S	S	*	*			cis	-163.3	162	-37	0	0	0	0	0	108.8
410	E	28.8	Very low	35.4	Very low	166 Å²	166	136.4 Å²	136.4	78%	0.776	78%	0.779	S	S	*	*			trans	-81.4	-177.5	172.7	-109.1	-160	-128.6	0	0	112
411	P	36.8	Very low	35.3	Very low	108 Å²	108	134.7 Å²	134.7	70%	0.701	77%	0.773	S	S	*	*			cis	-140	-171.1	13.1	35.5	-11.5	0	0	0	117.4
412	N	31.7	Very low	35.3	Very low	126 Å²	126	136.5 Å²	136.5	67%	0.674	77%	0.774	S	S	*	*			trans	-57	151.1	174.6	-50.3	-88.6	0	0	0	118.1
413	Q	35.9	Very low	35.1	Very low	176 Å²	176	140.6 Å²	140.6	82%	0.822	78%	0.779	S	S	*	*			trans	-172.4	124.7	133.5	-99.1	145.2	109.5	0	0	108.2
414	I	31.5	Very low	34.7	Very low	140 Å²	140	144.7 Å²	144.7	72%	0.718	78%	0.777	S	S	*	*				60	108.6	80.5	-59.3	171.5	0	0	0	112.9
415	D	36.5	Very low	35	Very low	156 Å²	156	144.9 Å²	144.9	83%	0.834	78%	0.775	S	S	*	*				-161.1	159.9	122.3	-118.4	-30.1	0	0	0	113
416	N	30.4	Very low	34.5	Very low	143 Å²	143	144.7 Å²	144.7	77%	0.765	77%	0.768	S	S	*	*			trans	-107.1	156.9	178.2	-61.5	-91	0	0	0	111.2
417	I	37.6	Very low	34.6	Very low	176 Å²	176	146.6 Å²	146.6	90%	0.903	77%	0.77	S	S	*	*			trans	-157.8	152.2	145.5	-104.7	147.5	0	0	0	109.3
418	S	32.3	Very low	34.5	Very low	89 Å²	89	144.2 Å²	144.2	62%	0.622	77%	0.768	S	S	*	*			trans	-112.7	-157.6	-164.9	56.1	0	0	0	0	113.4
419	D	36.9	Very low	34.5	Very low	140 Å²	140	142.8 Å²	142.8	75%	0.749	77%	0.766	S	S	*	*			trans	86.9	142.8	156.3	-67.3	15.4	0	0	0	118.3
420	V	38	Very low	34.2	Very low	112 Å²	112	146.1 Å²	146.1	68%	0.679	77%	0.766	S	S	*	*			cis	-163.1	154.5	-12.1	118.7	0	0	0	0	111
421	S	37.5	Very low	34.4	Very low	95 Å²	95	145.2 Å²	145.2	66%	0.664	76%	0.762	S	S	*	*			trans	66.5	170.7	159.9	77.2	0	0	0	0	120.1
422	N	33.2	Very low	33.9	Very low	146 Å²	146	147.1 Å²	147.1	78%	0.781	77%	0.766	S	S	*	*			cis	-169	139.1	-46.2	-93.5	-40.1	0	0	0	109
423	K	37.1	Very low	34.1	Very low	209 Å²	209	147.2 Å²	147.2	91%	0.909	78%	0.777	S	S	*	*				161.3	133.2	125.4	-89	165.9	-176.2	175	0	113.2
424	K	31.9	Very low	33.9	Very low	156 Å²	156	146.9 Å²	146.9	68%	0.678	78%	0.776	S	S	*	*			trans	-99.2	172.4	164.8	-138	-172.3	178.2	-151.7	0	108.2	D426	K424-D426 WeakPolarHBondContact CE-OD1 2.76Å; K424-D426 WeakPolarHBondContact CE-OD2 3.14Å; K424-D426 IonicContact NZ-OD1 2.67Å; K424-D426 PolarHBondContact NZ-OD1 2.91Å; K424-D426 IonicContact NZ-OD2 2.73Å; K424-D426 PolarHBondContact NZ-OD2 3.43Å
425	P	38.8	Very low	34.2	Very low	123 Å²	123	144.8 Å²	144.8	80%	0.799	77%	0.773	S	S	*	*				-149	180	71.3	39.2	-18.7	0	0	0	116
426	D	30	Very low	34.3	Very low	116 Å²	116	144.8 Å²	144.8	62%	0.62	77%	0.766	S	S	*	*			trans	-82.9	162.1	-177	-54.3	-90.9	0	0	0	115	K424	K424-D426 WeakPolarHBondContact CE-OD1 2.76Å; K424-D426 WeakPolarHBondContact CE-OD2 3.14Å; K424-D426 IonicContact NZ-OD1 2.67Å; K424-D426 PolarHBondContact NZ-OD1 2.91Å; K424-D426 IonicContact NZ-OD2 2.73Å; K424-D426 PolarHBondContact NZ-OD2 3.43Å
427	R	38.2	Very low	34.6	Very low	253 Å²	253	149 Å²	149	96%	0.955	77%	0.771	S	S	*	*			trans	-154.6	129.3	142.9	-116.3	176.4	-171.5	-174.9	2.2	112.5
428	T	28.4	Very low	34.4	Very low	135 Å²	135	151 Å²	151	83%	0.828	77%	0.767	S	S	*	*			trans	-94.5	152.4	170.2	34.8	0	0	0	0	111.4
429	V	35.8	Very low	34.4	Very low	146 Å²	146	152.6 Å²	152.6	89%	0.885	78%	0.776	S	S	*	*			trans	-172.5	164.9	144.8	136.7	0	0	0	0	109.3
430	Q	30.8	Very low	34.5	Very low	157 Å²	157	152.4 Å²	152.4	73%	0.734	77%	0.773	S	S	*	*			trans	-89.6	169.7	-163	-76.9	159.9	-118.6	0	0	116.9
431	E	32.5	Very low	34.4	Very low	147 Å²	147	153.3 Å²	153.3	69%	0.687	77%	0.773	S	S	*	*			trans	98	103.8	136.7	-96.1	159.5	-126.9	0	0	122.6
432	N	27.9	Very low	34.1	Very low	148 Å²	148	159.3 Å²	159.3	79%	0.791	78%	0.781	S	S	*	*				55.3	112.1	126.4	-64.9	-8.9	0	0	0	121.4
433	S	35	Very low	34.2	Very low	129 Å²	129	158.1 Å²	158.1	90%	0.902	78%	0.782	S	S	*	*				-158.3	147.8	119.5	38.5	0	0	0	0	112.1
434	E	32.6	Very low	34	Very low	168 Å²	168	153.1 Å²	153.1	79%	0.785	78%	0.779	S	S	*	*			trans	-91.9	161	-173.4	-50.9	171.1	87.4	0	0	113.8
435	S	36.3	Very low	34.2	Very low	96 Å²	96	149.7 Å²	149.7	67%	0.671	78%	0.78	S	S	*	*				-165.9	108.4	123.4	-89.7	0	0	0	0	116.6
436	K	38.2	Very low	34.1	Very low	157 Å²	157	154.7 Å²	154.7	68%	0.683	78%	0.784	S	S	*	*				52.4	127.8	128.3	-57.6	146.9	-172.4	151.7	0	117.5
437	R	36.7	Very low	34.5	Very low	231 Å²	231	153.5 Å²	153.5	87%	0.872	79%	0.785	S	S	*	*				-175.3	160.7	71	-74.5	162.4	-158.9	-169.7	2.3	107.8
438	R	33.8	Very low	34.1	Very low	218 Å²	218	149 Å²	149	82%	0.823	78%	0.78	S	S	*	*			cis	-165	126.6	-7.4	-119.5	-178	175.5	177.8	-1.5	108.6
439	P	33.2	Very low	34.5	Very low	123 Å²	123	150.3 Å²	150.3	80%	0.799	78%	0.78	S	S	*	*			trans	-107.1	149.1	170.8	36.8	-30.8	0	0	0	113.7
440	I	38.5	Very low	34.4	Very low	136 Å²	136	149.2 Å²	149.2	70%	0.697	78%	0.776	S	S	*	*			trans	-148.9	112.4	179.2	-61.9	-175	0	0	0	107.3
441	I	34.8	Very low	34.3	Very low	131 Å²	131	147.2 Å²	147.2	67%	0.672	78%	0.779	S	S	*	*				69.4	128.3	79.4	-75.3	168.8	0	0	0	111.3
442	R	31.3	Very low	34.5	Very low	220 Å²	220	147.9 Å²	147.9	83%	0.83	79%	0.788	S	S	*	*			cis	-170.6	-167.3	16.9	-122.8	175.1	-149.4	157.1	2.7	107.9
443	P	36.2	Very low	34.6	Very low	122 Å²	122	147.9 Å²	147.9	79%	0.792	79%	0.788	S	S	*	*			cis	-129.3	-163.7	-24.4	38.5	-19	0	0	0	112.9
444	A	32.4	Very low	34.6	Very low	103 Å²	103	147.4 Å²	147.4	85%	0.851	78%	0.78	S	S	*	*			trans	-138.7	153.5	178.8	0	0	0	0	0	114.5
445	A	37.4	Very low	34.4	Very low	85 Å²	85	147.4 Å²	147.4	70%	0.702	78%	0.78	S	S	*	*			trans	178.5	153.2	156	0	0	0	0	0	107.9
446	Y	36.9	Very low	34.2	Very low	227 Å²	227	148.2 Å²	148.2	89%	0.89	79%	0.785	S	S	*	*			cis	-135.7	168.1	21.4	-103	-89.1	0	0	0	114.1
447	S	36.5	Very low	34.2	Very low	92 Å²	92	148 Å²	148	64%	0.643	79%	0.791	S	S	*	*			trans	-54.2	135.7	-173.9	51.2	0	0	0	0	120.6
448	N	31	Very low	34	Very low	157 Å²	157	145.2 Å²	145.2	84%	0.84	79%	0.786	S	S	*	*				21	134	123	-53.9	-5.3	0	0	0	120.8
449	I	36.2	Very low	34	Very low	164 Å²	164	146 Å²	146	84%	0.841	79%	0.789	S	S	*	*			trans	-130	130.9	144.3	-61.6	179	0	0	0	106.9
450	P	33.4	Very low	34.1	Very low	122 Å²	122	151.2 Å²	151.2	79%	0.792	79%	0.793	S	S	*	*			trans	-85.2	153.7	-171.5	33.4	-35.8	0	0	0	114.1
451	S	29.4	Very low	33.9	Very low	115 Å²	115	155.2 Å²	155.2	80%	0.804	80%	0.799	S	S	*	*			trans	-80.2	150.5	169.2	51.4	0	0	0	0	112.2
452	N	36.6	Very low	33.9	Very low	161 Å²	161	156.9 Å²	156.9	86%	0.861	80%	0.803	S	S	*	*			trans	-137.9	155.3	163.5	-113.6	-17.6	0	0	0	110.3
453	N	29.9	Very low	34.3	Very low	148 Å²	148	155.4 Å²	155.4	79%	0.791	81%	0.806	S	S	*	*			trans	-74.3	172.8	176	-48.8	-50.9	0	0	0	109.7
454	T	35.4	Very low	34.2	Very low	119 Å²	119	159.3 Å²	159.3	73%	0.73	81%	0.805	S	S	*	*			cis	-154.9	149.6	25.4	-6.7	0	0	0	0	111.6
455	E	29.3	Very low	34.3	Very low	169 Å²	169	160.9 Å²	160.9	79%	0.79	79%	0.794	S	S	*	*				45.5	138	127.5	-163.3	161.2	-143.2	0	0	122.9
456	S	31.3	Very low	34.3	Very low	112 Å²	112	166.9 Å²	166.9	78%	0.783	80%	0.804	S	S	*	*			trans	66.9	149.4	172.2	72.8	0	0	0	0	116.2
457	D	37.2	Very low	34.1	Very low	152 Å²	152	166.3 Å²	166.3	81%	0.813	80%	0.802	S	S	*	*			cis	-146.8	-179.7	19.5	-159.2	1.6	0	0	0	113.7
458	K	33.9	Very low	34	Very low	174 Å²	174	167.8 Å²	167.8	76%	0.757	81%	0.812	S	S	*	*			trans	-103.7	161.4	-173.5	-59.5	160.9	179.7	160.5	0	112.1
459	R	32.4	Very low	34.1	Very low	233 Å²	233	165 Å²	165	88%	0.879	81%	0.805	S	S	*	*			trans	76.7	113.6	159.9	-51.5	160	163.1	-177.7	-5	118.8
460	R	36.5	Very low	34.2	Very low	234 Å²	234	166.9 Å²	166.9	88%	0.883	81%	0.807	S	S	*	*				173	120.9	113.8	-93.1	160	170.2	165.4	-3.8	108.9
461	R	34.3	Very low	34.1	Very low	220 Å²	220	169.8 Å²	169.8	83%	0.83	81%	0.807	S	S	*	*				83.4	109.7	69.1	-81.1	-169.2	175.9	-175.7	0.1	114.6
462	H	34	Very low	34.5	Very low	166 Å²	166	172.1 Å²	172.1	77%	0.769	81%	0.805	S	S	*	*			trans	31.4	121	146.1	-52.6	-75.5	0	0	0	122.3
463	H	39.7	Very low	34.4	Very low	189 Å²	189	172.9 Å²	172.9	88%	0.875	80%	0.803	S	S	*	*				-159.5	121.4	124.1	-91.8	-75.7	0	0	0	105.5
464	R	34	Very low	34.2	Very low	204 Å²	204	176.1 Å²	176.1	77%	0.77	81%	0.806	S	S	*	*			cis	75.3	95.3	34.8	-159.4	175.8	-168.7	-144.3	-2.9	115.7
465	H	35.4	Very low	34	Very low	136 Å²	136	177.6 Å²	177.6	63%	0.63	81%	0.809	S	S	*	*			trans	47.4	135.1	159	-54.3	-56.1	0	0	0	120.5
466	K	37.8	Very low	34.1	Very low	210 Å²	210	174.2 Å²	174.2	91%	0.913	80%	0.804	S	S	*	*				-143.5	136.1	111.4	-110.8	169.8	-175.7	176.1	0	110.9
467	Y	31.9	Very low	34.1	Very low	216 Å²	216	176.5 Å²	176.5	85%	0.847	81%	0.806	S	S	*	*			trans	-74	148.8	162.5	-92.1	-104.6	0	0	0	108.9
468	S	34.9	Very low	33.7	Very low	122 Å²	122	174.2 Å²	174.2	85%	0.853	80%	0.802	S	S	*	*			trans	-151.2	152.1	140.1	-163.1	0	0	0	0	110.3
469	S	32.9	Very low	33.5	Very low	99 Å²	99	171.5 Å²	171.5	69%	0.692	81%	0.805	S	S	*	*			trans	-105	141	-173.1	178.8	0	0	0	0	111.1
470	K	37.1	Very low	33.4	Very low	203 Å²	203	165.9 Å²	165.9	88%	0.883	80%	0.801	S	S	*	*			trans	-153.2	107.6	152.9	-114.2	166.6	-173.9	179.5	0	111.3
471	K	32.2	Very low	33.2	Very low	183 Å²	183	159.3 Å²	159.3	80%	0.796	79%	0.791	S	S	*	*			trans	-69.6	142.3	156.2	-62.1	173.4	177.3	176.9	0	108
472	H	37.3	Very low	33.1	Very low	165 Å²	165	154.4 Å²	154.4	76%	0.764	79%	0.79	S	S	*	*			trans	-172.8	105.6	140.6	-90.6	-66.6	0	0	0	105.8
473	H	34.2	Very low	33.2	Very low	176 Å²	176	150.9 Å²	150.9	82%	0.815	79%	0.785	S	S	*	*				93.5	141.7	93.6	-93.2	77.3	0	0	0	112.4
474	Y	27.3	Very low	33.2	Very low	216 Å²	216	144.9 Å²	144.9	85%	0.847	76%	0.764	S	S	*	*			trans	-105.6	162.7	-168.4	-118.2	-98.8	0	0	0	111.8
475	N	30.7	Very low	33.4	Very low	150 Å²	150	140.1 Å²	140.1	80%	0.802	75%	0.754	S	S	*	*			trans	72.8	151.4	179.9	-46	-30.4	0	0	0	112.9
476	S	32	Very low	33.7	Very low	98 Å²	98	143 Å²	143	69%	0.685	76%	0.759	S	S	*	*			cis	-154.7	148.4	17.7	53.4	0	0	0	0	114.5
477	I	29.7	Very low	33.8	Very low	161 Å²	161	139.7 Å²	139.7	83%	0.826	75%	0.747	S	S	*	*			trans	42.6	104.8	139.1	-50.9	166.7	0	0	0	119.1
478	S	30.6	Very low	34.6	Very low	104 Å²	104	134 Å²	134	73%	0.727	73%	0.73	S	S	*	*			trans	171	133.9	134.4	37	0	0	0	0	107.8
479	S	28.1	Very low	35.2	Very low	116 Å²	116	131.2 Å²	131.2	81%	0.811	71%	0.705	S	S	*	*			cis	98.3	36.8	32.1	81.8	0	0	0	0	116.4
480	S	30.2	Very low	36	Very low	115 Å²	115	132.4 Å²	132.4	80%	0.804	70%	0.7	S	S	*	*			trans	-159	113	164.1	48.9	0	0	0	0	114.1
481	S	33.3	Very low	36.4	Very low	97 Å²	97	127.8 Å²	127.8	68%	0.678	69%	0.685	S	S	*	*			trans	-168.5	35.6	164.5	51.7	0	0	0	0	114.1	S483	S481-S483 VanDerWaalsContact C-N 3.32Å; S481-S483 PolarHBondContact O-N 3.15Å
482	S	31.4	Very low	37.5	Very low	116 Å²	116	124.4 Å²	124.4	81%	0.811	67%	0.668	S	S	*	*			trans	-75.4	74.3	179.1	176	0	0	0	0	113
483	S	37.3	Very low	38.2	Very low	93 Å²	93	119.5 Å²	119.5	65%	0.65	64%	0.643	S	S	*	*	S	Bend	trans	-159.7	-46.5	157.4	-147.2	0	0	0	0	113.9	S481 D485 R486	S481-S483 VanDerWaalsContact C-N 3.32Å; S481-S483 PolarHBondContact O-N 3.15Å; S483-D485 PolarHBondContact O-N 2.97Å; S483-R486 PolarHBondContact O-N 2.98Å
484	S	39.3	Very low	39	Very low	62 Å²	62	114.8 Å²	114.8	43%	0.434	62%	0.624	S	S	.	*	H	α-helix	trans	-64.4	-34.4	-167.6	51.6	0	0	0	0	115.5	R486 E487	S484-R486 PolarHBondContact O-N 2.8Å; S484-E487 PolarHBondContact O-N 3.38Å
485	D	38.3	Very low	40.3	Very low	104 Å²	104	106.6 Å²	106.6	56%	0.556	60%	0.598	S	S	*	*	H	α-helix	trans	-63.8	-29	-176.2	-79.6	1	0	0	0	112.7	S483 I488 D489	S483-D485 PolarHBondContact O-N 2.97Å; D485-I488 PolarHBondContact O-N 2.91Å; D485-D489 PolarHBondContact O-N 2.98Å; D485-D489 VanDerWaalsContact O-N 3.08Å
486	R	41.2	Very low	41.4	Very low	196 Å²	196	101.2 Å²	101.2	74%	0.74	57%	0.568	S	S	*	*	H	α-helix	trans	-66.4	-42.8	-179.6	-71.1	-175.8	177.5	173.5	0.2	111.9	S483 S484 I488 D489 Q490	S483-R486 PolarHBondContact O-N 2.98Å; S484-R486 PolarHBondContact O-N 2.8Å; R486-I488 VanDerWaalsContact C-N 3.32Å; R486-I488 PolarHBondContact O-N 3.47Å; R486-D489 PolarHBondContact O-N 3.3Å; R486-Q490 WeakPolarHBondContact O-CB 3.28Å; R486-Q490 PolarHBondContact O-N 3.25Å
487	E	39	Very low	42	Very low	141 Å²	141	97.9 Å²	97.9	66%	0.659	54%	0.543	S	S	*	.	H	α-helix	trans	-67.7	-33.2	178.8	-64.7	-171	122.8	0	0	112.2	S484 N491	S484-E487 PolarHBondContact O-N 3.38Å; E487-N491 WeakPolarHBondContact O-CB 3.46Å; E487-N491 PolarHBondContact O-N 2.83Å; E487-N491 PolarHBondContact O-ND2 3.11Å
488	I	49.2	Very low	42.8	Very low	97 Å²	97	95.7 Å²	95.7	50%	0.497	53%	0.533	S	S	.	.	H	α-helix	trans	-68.1	-46.4	176.8	-63	170.5	0	0	0	110.5	D485 R486 N491 R492	D485-I488 PolarHBondContact O-N 2.91Å; R486-I488 VanDerWaalsContact C-N 3.32Å; R486-I488 PolarHBondContact O-N 3.47Å; I488-N491 PolarHBondContact O-N 2.89Å; I488-R492 PolarHBondContact O-N 2.89Å
489	D	47.2	Very low	43.3	Very low	63 Å²	63	94.5 Å²	94.5	34%	0.337	52%	0.518	S	S	.	.	H	α-helix	trans	-67.5	-37.8	177	-84	-13.3	0	0	0	111.7	R119 D485 R486 N491 R492 Y493	R119-D489 IonicContact NH1-OD2 3.33Å; D485-D489 PolarHBondContact O-N 2.98Å; D485-D489 VanDerWaalsContact O-N 3.08Å; R486-D489 PolarHBondContact O-N 3.3Å; D489-N491 PolarHBondContact O-N 3.42Å; D489-R492 PolarHBondContact O-N 3.3Å; D489-Y493 WeakPolarHBondContact O-CB 3.41Å; D489-Y493 PolarHBondContact O-N 3.38Å
490	Q	49.5	Very low	43.9	Very low	125 Å²	125	90.6 Å²	90.6	58%	0.584	49%	0.489	S	S	*	.	H	α-helix	trans	-60.8	-44.2	175	-152.2	89.2	8.4	0	0	111.9	R486 Y493 N494	R486-Q490 WeakPolarHBondContact O-CB 3.28Å; R486-Q490 PolarHBondContact O-N 3.25Å; Q490-Y493 WeakPolarHBondContact O-CB 3.16Å; Q490-Y493 PolarHBondContact O-N 2.96Å; Q490-N494 VanDerWaalsContact O-CG 3.3Å; Q490-N494 PolarHBondContact O-N 2.98Å; Q490-N494 PolarHBondContact O-ND2 3.37Å
491	N	47.2	Very low	44.2	Very low	106 Å²	106	89.7 Å²	89.7	57%	0.567	48%	0.475	S	S	*	.	H	α-helix	trans	-71.9	-32.7	179.3	-76.7	-53.4	0	0	0	112.8	E487 I488 D489 S495	E487-N491 WeakPolarHBondContact O-CB 3.46Å; E487-N491 PolarHBondContact O-N 2.83Å; E487-N491 PolarHBondContact O-ND2 3.11Å; I488-N491 PolarHBondContact O-N 2.89Å; D489-N491 PolarHBondContact O-N 3.42Å; N491-S495 PolarHBondContact O-N 3.06Å; N491-S495 VanDerWaalsContact O-N 3.11Å; N491-S495 PolarHBondContact O-OG 2.88Å
492	R	54.7	Low	44.4	Very low	112 Å²	112	91.2 Å²	91.2	42%	0.423	48%	0.476	S	S	.	.	H	α-helix	trans	-62.7	-45.8	167.2	-83.5	-178.9	160.8	-151.5	-7.4	111.6	D120 I488 D489 N494 S495 I496	D120-R492 IonicContact OD1-NH1 3.84Å; D120-R492 PolarHBondContact OD1-NH1 2.95Å; D120-R492 IonicContact OD2-CZ 2.74Å; D120-R492 IonicContact OD2-NH1 3.8Å; D120-R492 PolarHBondContact OD2-NH1 3.48Å; D120-R492 IonicContact OD2-NH2 3.62Å; I488-R492 PolarHBondContact O-N 2.89Å; D489-R492 PolarHBondContact O-N 3.3Å; R492-N494 PolarHBondContact O-N 2.97Å; R492-S495 WeakPolarHBondContact CA-OG 3.27Å; R492-S495 PolarHBondContact O-N 2.95Å; R492-S495 PolarHBondContact O-OG 3.2Å; R492-S495 VanDerWaalsContact O-OG 3.09Å; R492-I496 WeakPolarHBondContact O-CG1 3.5Å; R492-I496 PolarHBondContact O-N 2.93Å
493	Y	52.4	Low	44.4	Very low	61 Å²	61	89.3 Å²	89.3	24%	0.239	46%	0.462	C	S	.	.	H	α-helix	trans	-60.5	-46.1	179.3	-166.4	-106.5	0	0	0	111.9	P137 T138 D489 Q490 S495 I496 N497	P137-Y493 PolarHBondContact O-OH 2.85Å; T138-Y493 VanDerWaalsContact C-OH 3.27Å; T138-Y493 WeakPolarHBondContact CA-OH 3.35Å; T138-Y493 PolarHBondContact N-OH 3.07Å; T138-Y493 VanDerWaalsContact N-OH 3.15Å; D489-Y493 WeakPolarHBondContact O-CB 3.41Å; D489-Y493 PolarHBondContact O-N 3.38Å; Q490-Y493 WeakPolarHBondContact O-CB 3.16Å; Q490-Y493 PolarHBondContact O-N 2.96Å; Y493-S495 PolarHBondContact O-N 2.94Å; Y493-I496 PolarHBondContact O-N 2.7Å; Y493-N497 VanDerWaalsContact CD1-ND2 3.27Å; Y493-N497 WeakPolarHBondContact CD1-ND2 3.25Å; Y493-N497 WeakPolarHBondContact CE1-ND2 3.35Å; Y493-N497 PolarHBondContact O-N 3.06Å; Y493-N497 PolarHBondContact O-ND2 2.94Å; Y493-N497 VanDerWaalsContact O-ND2 3.15Å
494	N	51	Low	44	Very low	78 Å²	78	92.3 Å²	92.3	42%	0.417	46%	0.463	S	S	.	.	H	α-helix	trans	-62.7	-39.2	176.8	-69.6	-18.9	0	0	0	112.8	Q490 R492 N497 L498	Q490-N494 VanDerWaalsContact O-CG 3.3Å; Q490-N494 PolarHBondContact O-N 2.98Å; Q490-N494 PolarHBondContact O-ND2 3.37Å; R492-N494 PolarHBondContact O-N 2.97Å; N494-N497 PolarHBondContact O-N 3.21Å; N494-L498 WeakPolarHBondContact O-CG 3.41Å; N494-L498 PolarHBondContact O-N 3.18Å
495	S	54	Low	43.6	Very low	43 Å²	43	93 Å²	93	30%	0.301	47%	0.469	S	S	.	.	H	α-helix	trans	-75.3	-27	178.4	50.7	0	0	0	0	114	N491 R492 Y493 L499	N491-S495 PolarHBondContact O-N 3.06Å; N491-S495 VanDerWaalsContact O-N 3.11Å; N491-S495 PolarHBondContact O-OG 2.88Å; R492-S495 WeakPolarHBondContact CA-OG 3.27Å; R492-S495 PolarHBondContact O-N 2.95Å; R492-S495 PolarHBondContact O-OG 3.2Å; R492-S495 VanDerWaalsContact O-OG 3.09Å; Y493-S495 PolarHBondContact O-N 2.94Å; S495-L499 WeakPolarHBondContact O-CG 3.43Å; S495-L499 PolarHBondContact O-N 3.2Å
496	I	53	Low	43.1	Very low	37 Å²	37	96.2 Å²	96.2	19%	0.19	47%	0.473	C	S	.	.	H	α-helix	trans	-66.4	-47.8	166.2	-70.7	167.2	0	0	0	110.2	L68 R492 Y493 L498 L499 T500	L68-I496 HydrophobicContact CD2-CG2 4.5Å; R492-I496 WeakPolarHBondContact O-CG1 3.5Å; R492-I496 PolarHBondContact O-N 2.93Å; Y493-I496 PolarHBondContact O-N 2.7Å; I496-L498 VanDerWaalsContact C-N 3.27Å; I496-L498 PolarHBondContact O-N 2.92Å; I496-L499 WeakPolarHBondContact O-CB 3.45Å; I496-L499 PolarHBondContact O-N 3.35Å; I496-L499 VanDerWaalsContact O-N 3.13Å; I496-T500 PolarHBondContact O-N 3.37Å; I496-T500 PolarHBondContact O-OG1 2.89Å
497	N	45.7	Very low	42.5	Very low	28 Å²	28	91.9 Å²	91.9	15%	0.15	46%	0.464	C	S	.	.	H	α-helix	trans	-61.9	-31.9	178.5	-74	-38.1	0	0	0	113.1	H127 Y493 N494 N501	H127-N497 PolarHBondContact CE1-OD1 2.84Å; Y493-N497 VanDerWaalsContact CD1-ND2 3.27Å; Y493-N497 WeakPolarHBondContact CD1-ND2 3.25Å; Y493-N497 WeakPolarHBondContact CE1-ND2 3.35Å; Y493-N497 PolarHBondContact O-N 3.06Å; Y493-N497 PolarHBondContact O-ND2 2.94Å; Y493-N497 VanDerWaalsContact O-ND2 3.15Å; N494-N497 PolarHBondContact O-N 3.21Å; N497-N501 VanDerWaalsContact O-CB 3.25Å; N497-N501 WeakPolarHBondContact O-CB 3.38Å; N497-N501 PolarHBondContact O-N 2.83Å; N497-N501 PolarHBondContact O-ND2 3.12Å
498	L	45.6	Very low	41.9	Very low	116 Å²	116	90.3 Å²	90.3	61%	0.607	45%	0.453	S	S	*	.	H	α-helix	trans	-68.6	-40	173.9	-76.7	164.8	0	0	0	112.4	N494 I496 N502	N494-L498 WeakPolarHBondContact O-CG 3.41Å; N494-L498 PolarHBondContact O-N 3.18Å; I496-L498 VanDerWaalsContact C-N 3.27Å; I496-L498 PolarHBondContact O-N 2.92Å; L498-N502 PolarHBondContact O-N 3.09Å; L498-N502 VanDerWaalsContact O-N 3.13Å
499	L	42.3	Very low	41	Very low	79 Å²	79	92.5 Å²	92.5	41%	0.414	46%	0.455	S	S	.	.	H	α-helix	trans	-63.8	-42.9	175.3	-72.3	163.9	0	0	0	111.6	S495 I496 S503	S495-L499 WeakPolarHBondContact O-CG 3.43Å; S495-L499 PolarHBondContact O-N 3.2Å; I496-L499 WeakPolarHBondContact O-CB 3.45Å; I496-L499 PolarHBondContact O-N 3.35Å; I496-L499 VanDerWaalsContact O-N 3.13Å; L499-S503 PolarHBondContact O-N 3.02Å; L499-S503 PolarHBondContact O-OG 3.3Å
500	T	40.9	Very low	40.1	Very low	34 Å²	34	97.7 Å²	97.7	21%	0.209	48%	0.477	C	S	.	.	H	α-helix	trans	-78.6	-29.9	179.5	56.6	0	0	0	0	113.8	L68 H127 I496 N502 S503	L68-T500 HydrophobicContact CD2-CG2 4.02Å; H127-T500 PolarHBondContact CE1-OG1 3.13Å; H127-T500 WeakPolarHBondContact NE2-CB 3.45Å; H127-T500 WeakPolarHBondContact NE2-CG2 3.41Å; H127-T500 PolarHBondContact NE2-OG1 2.65Å; I496-T500 PolarHBondContact O-N 3.37Å; I496-T500 PolarHBondContact O-OG1 2.89Å; T500-N502 VanDerWaalsContact C-N 3.34Å; T500-S503 WeakPolarHBondContact O-CB 3.41Å; T500-S503 PolarHBondContact O-N 3.31Å; T500-S503 VanDerWaalsContact O-N 3.12Å
501	N	36.6	Very low	39.1	Very low	95 Å²	95	100.7 Å²	100.7	51%	0.508	49%	0.488	S	S	.	.	H	α-helix	trans	-73.9	-21.7	173.3	-80.6	-69.1	0	0	0	113.9	N497 K504	N497-N501 VanDerWaalsContact O-CB 3.25Å; N497-N501 WeakPolarHBondContact O-CB 3.38Å; N497-N501 PolarHBondContact O-N 2.83Å; N497-N501 PolarHBondContact O-ND2 3.12Å; N501-K504 WeakPolarHBondContact O-CE 3.43Å; N501-K504 WeakPolarHBondContact O-CG 3.18Å
502	N	35.9	Very low	38.2	Very low	130 Å²	130	101.9 Å²	101.9	70%	0.695	49%	0.494	S	S	*	.	S	Bend	trans	-83.5	-10	166.5	-85	0.1	0	0	0	113.2	L498 T500 K504	L498-N502 PolarHBondContact O-N 3.09Å; L498-N502 VanDerWaalsContact O-N 3.13Å; T500-N502 VanDerWaalsContact C-N 3.34Å; N502-K504 PolarHBondContact O-N 3.37Å
503	S	32.4	Very low	37	Very low	76 Å²	76	104 Å²	104	53%	0.531	51%	0.514	S	S	.	.			trans	-78.3	30.1	172.7	-58.6	0	0	0	0	112.9	L499 T500 S505	L499-S503 PolarHBondContact O-N 3.02Å; L499-S503 PolarHBondContact O-OG 3.3Å; T500-S503 WeakPolarHBondContact O-CB 3.41Å; T500-S503 PolarHBondContact O-N 3.31Å; T500-S503 VanDerWaalsContact O-N 3.12Å; S503-S505 PolarHBondContact O-N 2.82Å
504	K	29.3	Very low	36	Very low	155 Å²	155	108.7 Å²	108.7	67%	0.674	54%	0.543	S	S	*	.			trans	-66.4	122.3	176.5	-80.8	170.7	-177.7	176.6	0	109.6	N501 N502	N501-K504 WeakPolarHBondContact O-CE 3.43Å; N501-K504 WeakPolarHBondContact O-CG 3.18Å; N502-K504 PolarHBondContact O-N 3.37Å
505	S	29.6	Very low	35.1	Very low	78 Å²	78	113 Å²	113	55%	0.545	57%	0.565	S	S	.	*			trans	78.2	65.1	174.9	-147.5	0	0	0	0	116.6	S503 N507	S503-S505 PolarHBondContact O-N 2.82Å; S505-N507 PolarHBondContact O-N 3.34Å; S505-N507 WeakPolarHBondContact OG-CB 3.48Å; S505-N507 PolarHBondContact OG-ND2 3.15Å
506	R	29.4	Very low	34	Very low	171 Å²	171	116.9 Å²	116.9	65%	0.645	59%	0.591	S	S	*	*			trans	-69.2	43.5	151.6	-84.8	-172.6	170.3	174.8	-1.6	112	D64 Y508	D64-R506 VanDerWaalsContact CG-NH1 3.32Å; D64-R506 IonicContact OD1-CZ 3.68Å; D64-R506 IonicContact OD1-NH1 2.69Å; D64-R506 PolarHBondContact OD1-NH1 3.19Å; D64-R506 VanDerWaalsContact OD1-NH1 3.08Å; D64-R506 IonicContact OD1-NH2 2.61Å; D64-R506 PolarHBondContact OD1-NH2 3.45Å; D64-R506 IonicContact OD2-CZ 2.72Å; D64-R506 IonicContact OD2-NH1 3.15Å; D64-R506 PolarHBondContact OD2-NH1 3.13Å; D64-R506 IonicContact OD2-NH2 3.75Å; R506-Y508 PolarHBondContact O-N 2.84Å
507	N	27.7	Very low	33.2	Very low	104 Å²	104	120.3 Å²	120.3	56%	0.556	62%	0.619	S	S	*	*			trans	-97.6	81.2	-176.6	-70.4	-41.3	0	0	0	111.3	S505	S505-N507 PolarHBondContact O-N 3.34Å; S505-N507 WeakPolarHBondContact OG-CB 3.48Å; S505-N507 PolarHBondContact OG-ND2 3.15Å
508	Y	25.8	Very low	32.7	Very low	108 Å²	108	124.9 Å²	124.9	42%	0.424	65%	0.653	S	S	.	*			trans	-123.8	41.9	-179.3	-83.6	-87.8	0	0	0	113.1	R506 L671 Q672	R506-Y508 PolarHBondContact O-N 2.84Å; Y508-L671 PolarHBondContact OH-O 2.88Å; Y508-Q672 HydrophobicContact CE1-CB 4.21Å; Y508-Q672 HydrophobicContact CE1-CG 3.7Å; Y508-Q672 VanDerWaalsContact OH-CB 3.29Å; Y508-Q672 WeakPolarHBondContact OH-CB 3.29Å; Y508-Q672 WeakPolarHBondContact OH-CG 3.19Å; Y508-Q672 PolarHBondContact OH-N 3.08Å
509	R	30.7	Very low	32	Very low	144 Å²	144	123 Å²	123	54%	0.543	66%	0.662	S	S	.	*			trans	-161.2	83.2	165.4	-148.8	163.5	174.5	165.7	-7.2	111.4	Y261 A262 R263	Y261-R509 PolarHBondContact O-NH1 2.97Å; Y261-R509 PolarHBondContact O-NH2 3.25Å; A262-R509 PolarHBondContact O-NH2 3.28Å; R263-R509 PolarHBondContact O-NH1 3.2Å
510	Q	27.7	Very low	31.9	Very low	172 Å²	172	124.7 Å²	124.7	80%	0.804	68%	0.68	S	S	*	*			trans	-152.1	139.6	170.7	-105.9	171.1	-18.4	0	0	108
511	K	28.5	Very low	31.7	Very low	187 Å²	187	131.6 Å²	131.6	81%	0.813	71%	0.71	S	S	*	*	S	Bend	trans	79	57.2	-163.9	-59.5	-162.2	168.6	-158.2	0	117.1	P675	K511-P675 WeakPolarHBondContact O-CG 3.37Å
512	L	28.4	Very low	31.9	Very low	131 Å²	131	134.2 Å²	134.2	69%	0.686	73%	0.73	S	S	*	*	S	Bend	trans	-142	147.2	131.6	-80.8	178.8	0	0	0	105.2
513	N	31.1	Very low	32	Very low	156 Å²	156	131.3 Å²	131.3	83%	0.834	73%	0.73	S	S	*	*	S	Bend	trans	75.2	79.9	-155.7	-54.3	4	0	0	0	112.8
514	D	31	Very low	32.2	Very low	160 Å²	160	135.1 Å²	135.1	86%	0.856	74%	0.744	S	S	*	*			trans	169.6	112.8	152.4	-91	-22.1	0	0	0	106.6
515	I	31	Very low	32.5	Very low	170 Å²	170	132.8 Å²	132.8	87%	0.872	75%	0.748	S	S	*	*			trans	131.4	90.7	179.9	-72.7	155.1	0	0	0	108.6
516	S	31.3	Very low	32.9	Very low	123 Å²	123	134.2 Å²	134.2	86%	0.86	76%	0.758	S	S	*	*			trans	-159.2	53.8	169.3	-71.6	0	0	0	0	109.9
517	S	36.5	Very low	33.3	Very low	110 Å²	110	131.5 Å²	131.5	77%	0.769	77%	0.765	S	S	*	*	S	Bend	trans	-158.6	133.9	168.9	-96.4	0	0	0	0	111
518	S	35.4	Very low	33.7	Very low	124 Å²	124	132.1 Å²	132.1	87%	0.867	78%	0.778	S	S	*	*			trans	46.8	115.3	157.7	60.5	0	0	0	0	119.8
519	G	31	Very low	34.5	Very low	77 Å²	77	132.4 Å²	132.4	79%	0.794	79%	0.793	S	S	*	*			trans	-148.7	103.9	162.1	0	0	0	0	0	111.9
520	S	38.8	Very low	34.6	Very low	113 Å²	113	129.8 Å²	129.8	79%	0.79	80%	0.796	S	S	*	*			trans	-172.3	86.4	171.2	55.1	0	0	0	0	107.2
521	E	38	Very low	35	Very low	179 Å²	179	130.1 Å²	130.1	84%	0.836	80%	0.795	S	S	*	*				91.1	143.7	77.3	-82.8	-152.5	144.5	0	0	113.8
522	T	40.2	Very low	35.3	Very low	151 Å²	151	130.1 Å²	130.1	93%	0.926	80%	0.798	S	S	*	*			trans	65.4	143.8	-173.8	73.9	0	0	0	0	115.6
523	G	37.7	Very low	35.4	Very low	68 Å²	68	131 Å²	131	70%	0.701	80%	0.801	S	S	*	*			cis	-170.4	164.1	-7.2	0	0	0	0	0	113.2
524	D	36.2	Very low	35.7	Very low	156 Å²	156	131.1 Å²	131.1	83%	0.834	80%	0.8	S	S	*	*			trans	51.9	99.1	155.6	-66.4	-8.4	0	0	0	123.7
525	S	36.2	Very low	35.5	Very low	106 Å²	106	128.2 Å²	128.2	74%	0.741	79%	0.793	S	S	*	*				105.3	139.4	105	80.2	0	0	0	0	122.8
526	S	37.6	Very low	35.7	Very low	108 Å²	108	126.7 Å²	126.7	76%	0.755	79%	0.791	S	S	*	*			trans	95	151.2	142.1	86	0	0	0	0	121.7
527	S	39.2	Very low	35.7	Very low	115 Å²	115	128.4 Å²	128.4	80%	0.804	79%	0.785	S	S	*	*			trans	73.8	130.5	175.4	76.6	0	0	0	0	118.4
528	S	36	Very low	35.4	Very low	117 Å²	117	129.1 Å²	129.1	82%	0.818	78%	0.78	S	S	*	*			trans	-142	-153.6	-179.8	-66.1	0	0	0	0	108.5
529	P	42.2	Very low	35.3	Very low	114 Å²	114	134.4 Å²	134.4	74%	0.74	78%	0.781	S	S	*	*				-125.6	172.5	-94.1	39.7	-25.4	0	0	0	113.8
530	S	33.7	Very low	35.2	Very low	88 Å²	88	141.8 Å²	141.8	62%	0.615	79%	0.785	S	S	*	*			trans	171.6	136.7	130.8	-86.3	0	0	0	0	116.9
531	K	34.7	Very low	35.1	Very low	180 Å²	180	144.8 Å²	144.8	78%	0.783	78%	0.784	S	S	*	*			trans	42.6	125.2	131.1	-50.3	163.6	-169.7	164.6	0	119.8
532	H	36.2	Very low	34.7	Very low	187 Å²	187	143.1 Å²	143.1	87%	0.866	78%	0.781	S	S	*	*				-151.4	160.6	100.6	-126.9	-90	0	0	0	113.4
533	I	30	Very low	34.4	Very low	149 Å²	149	146.8 Å²	146.8	76%	0.764	78%	0.779	S	S	*	*			trans	-113.8	131.8	-177.4	-61.3	165.6	0	0	0	109.1
534	I	36.1	Very low	34	Very low	158 Å²	158	149.8 Å²	149.8	81%	0.81	78%	0.779	S	S	*	*			trans	-139.6	132.6	152.7	-59.7	-177	0	0	0	108	V536	I534-V536 HydrophobicContact CG2-CG2 4.12Å
535	S	27.2	Very low	33.8	Very low	100 Å²	100	149.2 Å²	149.2	70%	0.699	78%	0.776	S	S	*	*			trans	-116.4	137.7	165.4	65.8	0	0	0	0	109.6
536	V	36.3	Very low	33.7	Very low	137 Å²	137	154.1 Å²	154.1	83%	0.83	78%	0.784	S	S	*	*			trans	-121.8	143.9	169.8	-176.8	0	0	0	0	109.2	I534	I534-V536 HydrophobicContact CG2-CG2 4.12Å
537	H	31.1	Very low	33.4	Very low	159 Å²	159	160 Å²	160	74%	0.736	79%	0.789	S	S	*	*			trans	-93	171.9	-168.6	-115.9	56.6	0	0	0	113.8
538	D	30.3	Very low	33.3	Very low	126 Å²	126	164.3 Å²	164.3	67%	0.674	79%	0.794	S	S	*	*			trans	63	120.5	155	-81.4	-59.6	0	0	0	121.4
539	R	33.7	Very low	33.2	Very low	234 Å²	234	166.7 Å²	166.7	88%	0.883	79%	0.792	S	S	*	*				-161	94.2	107.7	-103.6	166.6	-169.9	-164.7	5.1	112.2
540	R	27.8	Very low	32.8	Very low	233 Å²	233	169.3 Å²	169.3	88%	0.879	80%	0.798	S	S	*	*			trans	-85.6	135.8	149.3	-85.1	-177.8	170.7	171.4	-2.5	108.6
541	K	36.5	Very low	32.9	Very low	175 Å²	175	170.8 Å²	170.8	76%	0.761	81%	0.805	S	S	*	*			trans	-125	119.8	160.9	-84.4	-164.9	172.2	-172.7	0	110
542	N	30.6	Very low	32.7	Very low	145 Å²	145	173.7 Å²	173.7	78%	0.775	81%	0.811	S	S	*	*			trans	-68.3	146.4	166.2	-67.7	-29.3	0	0	0	109.7
543	Y	32.5	Very low	32.6	Very low	228 Å²	228	169.7 Å²	169.7	89%	0.894	81%	0.805	S	S	*	*			trans	-123.8	121.6	144.4	-92.9	-87.4	0	0	0	107.8
544	N	31.1	Very low	32.7	Very low	130 Å²	130	167.7 Å²	167.7	70%	0.695	80%	0.804	S	S	*	*			trans	-144.5	134.9	-175.9	-162.2	-1.1	0	0	0	109.1
545	N	30.9	Very low	32.6	Very low	144 Å²	144	164 Å²	164	77%	0.77	79%	0.792	S	S	*	*			trans	34.3	116.9	168.2	-71.9	-31.3	0	0	0	120.3
546	K	35.3	Very low	32.9	Very low	210 Å²	210	166.9 Å²	166.9	91%	0.913	79%	0.794	S	S	*	*			trans	-147.5	101	139.1	-117.4	165.8	-172.4	172.5	0	112
547	R	31.1	Very low	32.9	Very low	230 Å²	230	167 Å²	167	87%	0.868	79%	0.79	S	S	*	*			trans	-65.7	143	160.3	-80.4	177.4	166.1	175.5	-5.7	109.3
548	K	37.4	Very low	33.2	Very low	206 Å²	206	163.2 Å²	163.2	90%	0.896	78%	0.782	S	S	*	*			trans	-140.1	135.1	144.6	-80	-160.5	173.4	-170.6	0	109.6
549	H	32.1	Very low	33.5	Very low	167 Å²	167	165.8 Å²	165.8	77%	0.773	79%	0.79	S	S	*	*			trans	-79.5	161	163.7	-87.9	-119	0	0	0	110
550	I	35.7	Very low	33.6	Very low	170 Å²	170	160.3 Å²	160.3	87%	0.872	78%	0.782	S	S	*	*			trans	-170.8	154	132.6	-98.5	154.3	0	0	0	108
551	P	35.4	Very low	34.1	Very low	119 Å²	119	154.3 Å²	154.3	77%	0.773	78%	0.776	S	S	*	*			trans	-111.4	-174.6	-140.1	41.4	-35.3	0	0	0	116.9
552	R	30.6	Very low	34.2	Very low	241 Å²	241	150.9 Å²	150.9	91%	0.909	77%	0.774	S	S	*	*			trans	-82.2	143.9	167.6	-59	167.6	168.5	172.1	-6.9	111.5
553	S	33.6	Very low	34.3	Very low	103 Å²	103	153.1 Å²	153.1	72%	0.72	78%	0.777	S	S	*	*				166.7	156.5	121.3	61.8	0	0	0	0	111.8
554	S	32.8	Very low	34.6	Very low	107 Å²	107	146.8 Å²	146.8	75%	0.748	77%	0.766	S	S	*	*			trans	57.6	151.6	152.9	46.9	0	0	0	0	119.6
555	S	33.1	Very low	34.9	Very low	81 Å²	81	147.9 Å²	147.9	57%	0.566	77%	0.772	S	S	*	*			cis	-170.5	165.4	-19.4	50.6	0	0	0	0	108.3
556	E	34.2	Very low	35	Very low	159 Å²	159	146.6 Å²	146.6	74%	0.743	76%	0.762	S	S	*	*			trans	57.7	168.9	173.7	-71.3	88.3	-138.3	0	0	115.2
557	D	35.2	Very low	35.3	Very low	140 Å²	140	142.3 Å²	142.3	75%	0.749	76%	0.755	S	S	*	*			cis	-158.4	163.1	-12.7	-119.7	-23.7	0	0	0	105
558	S	37	Very low	35.2	Very low	80 Å²	80	140.4 Å²	140.4	56%	0.559	75%	0.748	S	S	*	*			cis	179.2	154.1	-10.4	-125.6	0	0	0	0	105.7
559	Q	37.5	Very low	35	Very low	180 Å²	180	140.8 Å²	140.8	84%	0.841	75%	0.75	S	S	*	*			trans	68.8	156.9	162.9	-57.4	169.2	35.7	0	0	116.9
560	T	36.5	Very low	35	Very low	118 Å²	118	137.8 Å²	137.8	72%	0.724	75%	0.748	S	S	*	*			cis	-134.6	156.3	20.5	49.6	0	0	0	0	115.2
561	S	38.4	Very low	35.1	Very low	108 Å²	108	135 Å²	135	76%	0.755	74%	0.741	S	S	*	*			trans	41.3	139.5	147.5	57.9	0	0	0	0	122.2
562	S	38	Very low	35	Very low	102 Å²	102	134.7 Å²	134.7	71%	0.713	74%	0.737	S	S	*	*			cis	-161.6	144.7	-7.1	56	0	0	0	0	107.6
563	F	33.2	Very low	35.2	Very low	192 Å²	192	130.5 Å²	130.5	84%	0.842	73%	0.727	S	S	*	*				46.3	123.2	76.9	-79.9	-83.8	0	0	0	113.4
564	S	38.3	Very low	35.2	Very low	95 Å²	95	133.2 Å²	133.2	66%	0.664	73%	0.728	S	S	*	*			cis	-147.9	-173.2	6.6	-43.3	0	0	0	0	110.8
565	D	36.7	Very low	35	Very low	153 Å²	153	135.5 Å²	135.5	82%	0.818	73%	0.732	S	S	*	*			cis	-157.8	-171.2	2.9	-138	-48.1	0	0	0	111.5
566	E	33.8	Very low	35.2	Very low	118 Å²	118	136.6 Å²	136.6	55%	0.551	74%	0.738	S	S	*	*			trans	-126.6	166.5	168.9	-148.1	-155	-134	0	0	111	R568	E566-R568 VanDerWaalsContact OE2-CD 3.3Å; E566-R568 WeakPolarHBondContact OE2-CD 3.21Å; E566-R568 VanDerWaalsContact OE2-CG 3.29Å; E566-R568 WeakPolarHBondContact OE2-CG 3.46Å; E566-R568 IonicContact OE2-CZ 3.14Å; E566-R568 PolarHBondContact OE2-N 2.93Å; E566-R568 IonicContact OE2-NE 3.53Å; E566-R568 PolarHBondContact OE2-NE 3.28Å
567	P	39.9	Very low	35	Very low	119 Å²	119	135.4 Å²	135.4	77%	0.773	74%	0.741	S	S	*	*				-148.3	153.3	88.3	37.6	-20	0	0	0	116.9
568	R	29.4	Very low	34.9	Very low	190 Å²	190	137.4 Å²	137.4	72%	0.717	74%	0.743	S	S	*	*			trans	-45.1	152.1	168.7	-49.6	111.4	-162.6	-132.1	0.9	115	E566	E566-R568 VanDerWaalsContact OE2-CD 3.3Å; E566-R568 WeakPolarHBondContact OE2-CD 3.21Å; E566-R568 VanDerWaalsContact OE2-CG 3.29Å; E566-R568 WeakPolarHBondContact OE2-CG 3.46Å; E566-R568 IonicContact OE2-CZ 3.14Å; E566-R568 PolarHBondContact OE2-N 2.93Å; E566-R568 IonicContact OE2-NE 3.53Å; E566-R568 PolarHBondContact OE2-NE 3.28Å
569	F	34.4	Very low	34.8	Very low	215 Å²	215	138.8 Å²	138.8	94%	0.943	75%	0.748	S	S	*	*				-153.5	128.9	119.1	-101.1	-71.1	0	0	0	111.5
570	S	31.5	Very low	34.5	Very low	104 Å²	104	140.3 Å²	140.3	73%	0.727	75%	0.752	S	S	*	*			trans	-103.7	154	167.7	-50.9	0	0	0	0	109.2
571	P	38.2	Very low	34.3	Very low	110 Å²	110	139.1 Å²	139.1	71%	0.714	75%	0.748	S	S	*	*				-153.6	131.8	108.7	35.8	-16.7	0	0	0	117.7
572	T	33.1	Very low	34	Very low	114 Å²	114	140.4 Å²	140.4	70%	0.699	75%	0.747	S	S	*	*				59.9	152.5	129.8	71	0	0	0	0	124.5
573	H	33.9	Very low	34	Very low	152 Å²	152	147.3 Å²	147.3	70%	0.704	76%	0.757	S	S	*	*			trans	65.9	147.6	161.2	-66.6	-74.7	0	0	0	118.3
574	H	33.6	Very low	34	Very low	161 Å²	161	149.5 Å²	149.5	75%	0.745	76%	0.76	S	S	*	*			cis	-154	158.6	-7	-129.8	-18.6	0	0	0	111.9
575	N	29.3	Very low	33.7	Very low	154 Å²	154	152.6 Å²	152.6	82%	0.824	76%	0.763	S	S	*	*			trans	-74.7	141.4	166.3	-86.9	-39.8	0	0	0	111.8
576	P	36.3	Very low	33.6	Very low	105 Å²	105	154 Å²	154	68%	0.682	77%	0.77	S	S	*	*			trans	-115.8	108.8	158.3	34.2	-22.8	0	0	0	112.2	K578	P576-K578 PolarHBondContact O-N 3.38Å
577	V	30.3	Very low	33.6	Very low	133 Å²	133	152.6 Å²	152.6	81%	0.806	77%	0.773	S	S	*	*			trans	-76	119.4	167.5	174.7	0	0	0	0	109.7
578	K	34.7	Very low	33.7	Very low	183 Å²	183	152.8 Å²	152.8	80%	0.796	77%	0.774	S	S	*	*			trans	-140.7	94	168.7	-66.4	-176.5	-179.7	176.4	0	109.3	P576	P576-K578 PolarHBondContact O-N 3.38Å
579	T	33.5	Very low	34.1	Very low	109 Å²	109	150 Å²	150	67%	0.669	78%	0.781	S	S	*	*				62.4	112.7	82.7	65.7	0	0	0	0	115.6
580	K	31.1	Very low	34	Very low	211 Å²	211	148.7 Å²	148.7	92%	0.917	77%	0.771	S	S	*	*			trans	48.7	136.9	141.4	-63.1	-175.7	-178.8	-178.8	0	118.7
581	S	32.9	Very low	34	Very low	93 Å²	93	147.8 Å²	147.8	65%	0.65	77%	0.77	S	S	*	*			cis	-164.6	-179	16.2	51.7	0	0	0	0	112.5
582	D	32.7	Very low	33.7	Very low	135 Å²	135	150.3 Å²	150.3	72%	0.722	77%	0.766	S	S	*	*			trans	60.6	102	152.2	-52.7	-37.3	0	0	0	121.4
583	R	36.3	Very low	33.7	Very low	247 Å²	247	152.3 Å²	152.3	93%	0.932	76%	0.761	S	S	*	*				-158.1	84.2	125.9	-107.5	161.9	-159.2	-148.3	4.2	114.1
584	R	33.5	Very low	33.6	Very low	239 Å²	239	152.3 Å²	152.3	90%	0.902	76%	0.763	S	S	*	*			trans	44.2	120.5	142.1	-58.4	-179	-172.9	174.7	2.6	120
585	H	32.2	Very low	33.5	Very low	160 Å²	160	149.9 Å²	149.9	74%	0.741	76%	0.756	S	S	*	*			trans	-42.9	145.1	167.8	-61.7	-106.8	0	0	0	116.4
586	L	35.2	Very low	33.7	Very low	182 Å²	182	153.3 Å²	153.3	95%	0.953	76%	0.759	S	S	*	*				-132.5	111.8	124.7	-86.1	110.2	0	0	0	109
587	S	33.5	Very low	33.6	Very low	89 Å²	89	156.1 Å²	156.1	62%	0.622	77%	0.768	S	S	*	*			trans	-108.3	136.3	174.4	-56.8	0	0	0	0	109
588	P	42.6	Very low	33.7	Very low	122 Å²	122	158.5 Å²	158.5	79%	0.792	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-56.7	143.3	174.1	-25.9	35.6	0	0	0	111.9
589	P	36.9	Very low	33.7	Very low	132 Å²	132	154.7 Å²	154.7	86%	0.857	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-71.9	158.8	-165.5	27.6	-35.6	0	0	0	114.5
590	Y	31.9	Very low	33.7	Very low	188 Å²	188	157.8 Å²	157.8	74%	0.737	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-98.5	120.4	-169.3	-154.9	-96.8	0	0	0	111.4	R593	Y590-R593 HydrophobicContact CE1-CB 3.88Å
591	A	32.8	Very low	33.9	Very low	85 Å²	85	156.8 Å²	156.8	70%	0.702	77%	0.766	S	S	*	*			trans	-157.6	133.7	167.6	0	0	0	0	0	108.6
592	Y	32	Very low	34	Very low	162 Å²	162	157.2 Å²	157.2	64%	0.635	77%	0.769	S	S	*	*			cis	-115.4	155	-2.7	-91.6	-108.9	0	0	0	111.2	Y19 M594	Y19-Y592 PolarHBondContact OH-OH 3.34Å; Y592-M594 HydrophobicContact CD1-CE 4.49Å
593	R	32.4	Very low	34	Very low	156 Å²	156	160.8 Å²	160.8	59%	0.589	78%	0.778	S	S	*	*			trans	-145.5	111.1	162.8	-174.2	177.8	179.6	123.7	12.8	110	Y590 D595	Y590-R593 HydrophobicContact CE1-CB 3.88Å; R593-D595 VanDerWaalsContact CD-OD2 3.31Å; R593-D595 WeakPolarHBondContact CD-OD2 3.39Å; R593-D595 WeakPolarHBondContact CG-OD2 2.75Å; R593-D595 IonicContact CZ-OD1 3.68Å; R593-D595 IonicContact CZ-OD2 2.75Å; R593-D595 IonicContact NE-OD1 3.22Å; R593-D595 PolarHBondContact NE-OD1 3.11Å; R593-D595 IonicContact NE-OD2 3.17Å; R593-D595 PolarHBondContact NE-OD2 3.02Å; R593-D595 IonicContact NH2-OD1 2.7Å; R593-D595 PolarHBondContact NH2-OD1 2.92Å; R593-D595 IonicContact NH2-OD2 2.77Å
594	M	31.5	Very low	34.2	Very low	152 Å²	152	157 Å²	157	75%	0.749	77%	0.771	S	S	*	*			trans	-102.3	88	173.2	-73.6	-67.8	-173.6	0	0	109.1	Y592 Y596	Y592-M594 HydrophobicContact CD1-CE 4.49Å; M594-Y596 PolarHBondContact O-N 3.01Å
595	D	32	Very low	34.3	Very low	111 Å²	111	155.9 Å²	155.9	59%	0.594	77%	0.766	S	S	*	*			trans	-76.2	112.5	171.2	-66.1	-62.5	0	0	0	109.2	R593 N597	R593-D595 VanDerWaalsContact CD-OD2 3.31Å; R593-D595 WeakPolarHBondContact CD-OD2 3.39Å; R593-D595 WeakPolarHBondContact CG-OD2 2.75Å; R593-D595 IonicContact CZ-OD1 3.68Å; R593-D595 IonicContact CZ-OD2 2.75Å; R593-D595 IonicContact NE-OD1 3.22Å; R593-D595 PolarHBondContact NE-OD1 3.11Å; R593-D595 IonicContact NE-OD2 3.17Å; R593-D595 PolarHBondContact NE-OD2 3.02Å; R593-D595 IonicContact NH2-OD1 2.7Å; R593-D595 PolarHBondContact NH2-OD1 2.92Å; R593-D595 IonicContact NH2-OD2 2.77Å; D595-N597 PolarHBondContact O-N 2.91Å
596	Y	32.8	Very low	34.5	Very low	226 Å²	226	153.3 Å²	153.3	89%	0.886	77%	0.766	S	S	*	*			trans	-69.1	114.4	-178.2	-107.6	-93.9	0	0	0	111.8	M594 K598	M594-Y596 PolarHBondContact O-N 3.01Å; Y596-K598 PolarHBondContact O-N 3.21Å; Y596-K598 VanDerWaalsContact O-N 3.14Å
597	N	33.9	Very low	34.7	Very low	163 Å²	163	149.3 Å²	149.3	87%	0.872	75%	0.754	S	S	*	*			trans	-68	108.2	177.5	-111.5	-30.2	0	0	0	111.4	D595 S599	D595-N597 PolarHBondContact O-N 2.91Å; N597-S599 PolarHBondContact O-N 3.38Å; N597-S599 VanDerWaalsContact O-N 3.12Å
598	K	33	Very low	35	Very low	183 Å²	183	152.1 Å²	152.1	80%	0.796	76%	0.761	S	S	*	*			trans	-83.2	90.5	-177.3	-160.4	173.7	-170.5	176.2	0	111.1	Y596 H600	Y596-K598 PolarHBondContact O-N 3.21Å; Y596-K598 VanDerWaalsContact O-N 3.14Å; K598-H600 PolarHBondContact O-N 2.92Å
599	S	34.4	Very low	34.8	Very low	104 Å²	104	156.6 Å²	156.6	73%	0.727	76%	0.762	S	S	*	*			trans	-59.5	104	-179.3	-174.7	0	0	0	0	112.6	N597	N597-S599 PolarHBondContact O-N 3.38Å; N597-S599 VanDerWaalsContact O-N 3.12Å
600	H	33.3	Very low	35	Very low	174 Å²	174	154.9 Å²	154.9	81%	0.806	75%	0.754	S	S	*	*			trans	-89	111.9	163.4	-87	-91.6	0	0	0	109.3	K598	K598-H600 PolarHBondContact O-N 2.92Å
601	K	36.7	Very low	35.5	Very low	190 Å²	190	150.4 Å²	150.4	83%	0.826	76%	0.755	S	S	*	*			trans	-127	130.2	167	-85	-170.4	172.8	-177.4	0	111.8
602	S	35	Very low	36.2	Very low	102 Å²	102	151.6 Å²	151.6	71%	0.713	76%	0.756	S	S	*	*			trans	49.4	114.5	154.8	-160.1	0	0	0	0	119.6
603	K	32.5	Very low	36.5	Very low	210 Å²	210	151.8 Å²	151.8	91%	0.913	77%	0.768	S	S	*	*			trans	-102.4	112.9	149.6	-82.7	-170	176.1	-176	0	109.5
604	H	39.5	Very low	36.8	Very low	167 Å²	167	147.9 Å²	147.9	77%	0.773	78%	0.776	S	S	*	*			trans	-145.1	144.1	162.7	-88.3	-78.3	0	0	0	105.4
605	R	35.8	Very low	37.2	Very low	215 Å²	215	149.3 Å²	149.3	81%	0.811	78%	0.781	S	S	*	*			cis	-162.4	152.2	3.7	-166.6	-169.9	-171.3	-176.2	2	106.7
606	S	37.7	Very low	37.5	Very low	106 Å²	106	149.3 Å²	149.3	74%	0.741	79%	0.79	S	S	*	*			trans	50.7	154.4	151.1	50.8	0	0	0	0	122
607	S	38.7	Very low	37.7	Very low	99 Å²	99	142.1 Å²	142.1	69%	0.692	78%	0.784	S	S	*	*			cis	-177.3	151.8	-28.1	-154.3	0	0	0	0	108.4
608	L	39.7	Very low	37.9	Very low	148 Å²	148	145.5 Å²	145.5	78%	0.775	79%	0.785	S	S	*	*			trans	66.9	153.2	166.3	-49.6	169.8	0	0	0	115.9
609	R	38.3	Very low	38	Very low	216 Å²	216	144.4 Å²	144.4	82%	0.815	79%	0.786	S	S	*	*			cis	-157.2	161.8	-12.2	-127.2	179	-177.4	-152	1.3	111.9
610	S	41.2	Very low	38.1	Very low	96 Å²	96	147.5 Å²	147.5	67%	0.671	79%	0.794	S	S	*	*			trans	0.2	151.8	149.3	53.4	0	0	0	0	121.2
611	A	42.7	Very low	37.9	Very low	93 Å²	93	150.2 Å²	150.2	77%	0.769	80%	0.797	S	S	*	*			cis	-172.3	170.2	-4.6	0	0	0	0	0	110.5
612	P	47	Very low	37.9	Very low	111 Å²	111	148.5 Å²	148.5	72%	0.721	79%	0.792	S	S	*	*			trans	-108.8	168.4	-175.3	40.8	-34.3	0	0	0	115.6
613	N	38.9	Very low	38	Very low	166 Å²	166	151 Å²	151	89%	0.888	79%	0.792	S	S	*	*			trans	177.4	142.3	135.9	-94.4	-11.8	0	0	0	115
614	G	38.1	Very low	38.1	Very low	74 Å²	74	145.3 Å²	145.3	76%	0.763	78%	0.778	S	S	*	*			trans	70.9	163.4	155.9	0	0	0	0	0	119.8
615	E	39.6	Very low	37.9	Very low	181 Å²	181	144.5 Å²	144.5	85%	0.846	78%	0.78	S	S	*	*			cis	-165.3	157.7	-31	-143.7	-176.1	-141.1	0	0	111.4
616	S	38.4	Very low	37.9	Very low	111 Å²	111	142.3 Å²	142.3	78%	0.776	78%	0.778	S	S	*	*			trans	57.6	133.1	154.9	-66.1	0	0	0	0	122.9
617	G	38.1	Very low	37.8	Very low	75 Å²	75	148.7 Å²	148.7	77%	0.773	79%	0.786	S	S	*	*			trans	157.5	95.6	154	0	0	0	0	0	120.8
618	R	36.6	Very low	37.3	Very low	235 Å²	235	152 Å²	152	89%	0.887	80%	0.795	S	S	*	*			trans	16.5	121.7	148.4	-61.5	176.3	-176.3	176.9	0.8	119.9
619	I	35.3	Very low	37.2	Very low	160 Å²	160	151.7 Å²	151.7	82%	0.821	80%	0.799	S	S	*	*				64.5	111.5	78.6	-60.1	163.7	0	0	0	115.3
620	L	36	Very low	36.9	Very low	169 Å²	169	146.4 Å²	146.4	89%	0.885	80%	0.795	S	S	*	*			trans	-164.6	-177.3	131.5	-110.9	167	0	0	0	111.8
621	R	31	Very low	36.4	Very low	230 Å²	230	146.4 Å²	146.4	87%	0.868	80%	0.795	S	S	*	*			trans	-132.2	-162.5	-162.8	-149.7	-176.6	-176	-169.5	1.2	111.3
622	E	35.5	Very low	35.9	Very low	155 Å²	155	153.6 Å²	153.6	72%	0.724	80%	0.802	S	S	*	*			trans	81.9	152.2	170.1	-48.5	-149.2	174.6	0	0	116.5
623	H	36.9	Very low	35.3	Very low	154 Å²	154	155.8 Å²	155.8	71%	0.713	80%	0.803	S	S	*	*			cis	-152.7	174	-27.9	-106.9	129.7	0	0	0	109.9
624	S	34.4	Very low	35.1	Very low	90 Å²	90	157.1 Å²	157.1	63%	0.629	80%	0.803	S	S	*	*			trans	-65.9	157.5	-176.2	50.1	0	0	0	0	116.5
625	N	36.9	Very low	34.7	Very low	150 Å²	150	159.6 Å²	159.6	80%	0.802	80%	0.799	S	S	*	*				-172.2	164.9	119	-101.1	-47	0	0	0	117.3
626	H	35.6	Very low	34.5	Very low	169 Å²	169	160.5 Å²	160.5	78%	0.782	80%	0.803	S	S	*	*			trans	-74.9	157.2	-168.5	-64.1	-113.2	0	0	0	117.3
627	R	34.6	Very low	34.2	Very low	241 Å²	241	164.3 Å²	164.3	91%	0.909	81%	0.808	S	S	*	*				-164.8	152.3	117.8	-110.5	177.7	-173	-153.4	0.1	114.9
628	L	28.9	Very low	33.8	Very low	167 Å²	167	172.8 Å²	172.8	87%	0.874	82%	0.816	S	S	*	*			trans	-121.1	136.2	171.6	-80.6	160.8	0	0	0	108.7
629	V	36.9	Very low	33.5	Very low	142 Å²	142	166.6 Å²	166.6	86%	0.861	81%	0.809	S	S	*	*			trans	-146.7	148.1	158.4	-178	0	0	0	0	110.6
630	S	33.5	Very low	33.1	Very low	106 Å²	106	165.7 Å²	165.7	74%	0.741	81%	0.806	S	S	*	*			trans	-61.5	147.2	-169.9	-163.1	0	0	0	0	119.2
631	S	28.7	Very low	32.8	Very low	95 Å²	95	167.1 Å²	167.1	66%	0.664	81%	0.805	S	S	*	*			trans	0.1	141.5	142.3	-170.8	0	0	0	0	121.4
632	R	34	Very low	32.8	Very low	245 Å²	245	161 Å²	161	93%	0.925	80%	0.797	S	S	*	*			trans	-152.8	139.8	136.9	-107.6	173.4	-173.7	-175.5	0.9	111
633	H	33.3	Very low	32.6	Very low	156 Å²	156	160.9 Å²	160.9	72%	0.722	80%	0.801	S	S	*	*			trans	-71.2	147	173	-86.3	-113.7	0	0	0	112.2
634	H	35.2	Very low	32.3	Very low	194 Å²	194	164 Å²	164	90%	0.898	81%	0.807	S	S	*	*			trans	-158.1	141.8	136.3	-110.8	50.7	0	0	0	110.2
635	D	30.3	Very low	32.1	Very low	127 Å²	127	169.1 Å²	169.1	68%	0.679	82%	0.82	S	S	*	*			trans	-87.9	141.2	-170	-54.5	-83.8	0	0	0	113.5
636	H	35.2	Very low	31.8	Very low	200 Å²	200	166.2 Å²	166.2	93%	0.926	81%	0.812	S	S	*	*			trans	-149.4	112.3	156.5	-89.7	-32.6	0	0	0	112.8	R638	H636-R638 PolarHBondContact O-N 3.42Å
637	H	32.2	Very low	31.7	Very low	191 Å²	191	164.2 Å²	164.2	88%	0.884	82%	0.817	S	S	*	*			trans	-62.3	119.1	164.5	-91.4	-120	0	0	0	111.1
638	R	29.4	Very low	31.6	Very low	252 Å²	252	159.4 Å²	159.4	95%	0.951	81%	0.808	S	S	*	*			trans	165.3	83.1	139.6	-94.8	175	168.3	-152	-3.7	112.3	H636	H636-R638 PolarHBondContact O-N 3.42Å
639	S	29	Very low	31.9	Very low	105 Å²	105	161.9 Å²	161.9	73%	0.734	81%	0.806	S	S	*	*			trans	-173.3	139	175.9	151.1	0	0	0	0	107.5
640	L	27.7	Very low	31.6	Very low	142 Å²	142	157.6 Å²	157.6	74%	0.743	79%	0.79	S	S	*	*			cis	-157.8	129.5	-2.9	-102	163.5	0	0	0	107.1
641	F	30.7	Very low	32.1	Very low	198 Å²	198	158.1 Å²	158.1	87%	0.868	79%	0.789	S	S	*	*			trans	-138.5	73.6	162.6	-99.7	-73	0	0	0	111.4	L643	F641-L643 HydrophobicContact CD1-CD1 4.21Å; F641-L643 HydrophobicContact CE1-CD1 3.97Å
642	S	29.3	Very low	32.7	Very low	102 Å²	102	159.8 Å²	159.8	71%	0.713	79%	0.786	S	S	*	*			trans	-120	78.8	163	-166.9	0	0	0	0	108.3	R644	S642-R644 PolarHBondContact O-N 3.44Å
643	L	32.7	Very low	33	Very low	152 Å²	152	150.6 Å²	150.6	80%	0.796	76%	0.759	S	S	*	*			trans	-73.6	74.8	173.5	-91.3	167.3	0	0	0	109.8	F641 E645	F641-L643 HydrophobicContact CD1-CD1 4.21Å; F641-L643 HydrophobicContact CE1-CD1 3.97Å; L643-E645 PolarHBondContact O-N 3.17Å
644	R	30.3	Very low	33.3	Very low	221 Å²	221	150.7 Å²	150.7	83%	0.834	76%	0.76	S	S	*	*			trans	-64.9	117.3	170.6	-174.9	-178.8	-174.3	-173.2	2.8	108.7	S642 S646	S642-R644 PolarHBondContact O-N 3.44Å; R644-S646 PolarHBondContact O-N 2.96Å; R644-S646 VanDerWaalsContact O-N 3.09Å
645	E	29.4	Very low	33.6	Very low	197 Å²	197	146.8 Å²	146.8	92%	0.921	75%	0.745	S	S	*	*			trans	-58.4	113	-175.7	-63.2	-179.2	126.2	0	0	112	L643	L643-E645 PolarHBondContact O-N 3.17Å
646	S	32	Very low	34.3	Very low	89 Å²	89	146.8 Å²	146.8	62%	0.622	74%	0.744	S	S	*	*			trans	-120.9	85.4	175	62.1	0	0	0	0	110.7	R644 I648	R644-S646 PolarHBondContact O-N 2.96Å; R644-S646 VanDerWaalsContact O-N 3.09Å; S646-I648 PolarHBondContact O-N 3.41Å
647	S	31.6	Very low	34.7	Very low	127 Å²	127	140.5 Å²	140.5	89%	0.888	71%	0.714	S	S	*	*			trans	-28.2	82.5	166	52.6	0	0	0	0	116.9
648	I	34.5	Very low	35.1	Very low	139 Å²	139	133 Å²	133	71%	0.713	69%	0.688	S	S	*	*			trans	-126	-22.8	172.6	-68.6	180	0	0	0	113	S646 G650	S646-I648 PolarHBondContact O-N 3.41Å; I648-G650 PolarHBondContact O-N 3.39Å
649	W	33.2	Very low	35.8	Very low	220 Å²	220	125.5 Å²	125.5	83%	0.833	67%	0.666	S	S	*	*			trans	-79.2	50.2	-175.7	-65	104.3	0	0	0	115.1
650	G	32.1	Very low	36.3	Very low	52 Å²	52	124.5 Å²	124.5	54%	0.536	65%	0.653	S	S	.	*			trans	-66.9	150.5	167.6	0	0	0	0	0	112.5	I648 H652	I648-G650 PolarHBondContact O-N 3.39Å; G650-H652 VanDerWaalsContact C-N 3.28Å; G650-H652 PolarHBondContact O-N 3.1Å
651	T	44.3	Very low	37.2	Very low	116 Å²	116	120.6 Å²	120.6	71%	0.712	63%	0.634	S	S	*	*	S	Bend	trans	55.5	-48.2	169.7	65.5	0	0	0	0	119.5
652	H	39.5	Very low	37.6	Very low	130 Å²	130	116.6 Å²	116.6	60%	0.602	62%	0.621	S	S	*	*	H	α-helix	trans	-74.5	-33.5	-171	-97.7	-104	0	0	0	115	G650 H654 L655 L656	G650-H652 VanDerWaalsContact C-N 3.28Å; G650-H652 PolarHBondContact O-N 3.1Å; H652-H654 PolarHBondContact O-N 3.29Å; H652-L655 PolarHBondContact O-N 2.97Å; H652-L656 PolarHBondContact O-N 3.16Å
653	S	41.7	Very low	38	Very low	52 Å²	52	117.4 Å²	117.4	36%	0.364	61%	0.612	S	S	.	*	H	α-helix	trans	-62.4	-40.5	-177.7	-176.3	0	0	0	0	112.6	L655 L656 F657	S653-L655 VanDerWaalsContact C-N 3.33Å; S653-L655 PolarHBondContact O-N 3.2Å; S653-L656 PolarHBondContact O-N 3Å; S653-F657 WeakPolarHBondContact O-CB 3.46Å; S653-F657 PolarHBondContact O-N 3.15Å
654	H	39.7	Very low	38.6	Very low	158 Å²	158	112.7 Å²	112.7	73%	0.731	59%	0.587	S	S	*	*	H	α-helix	trans	-68.2	-28.8	179.6	-78.7	-94.5	0	0	0	113.5	H652 G658	H652-H654 PolarHBondContact O-N 3.29Å; H654-G658 PolarHBondContact O-N 3.24Å
655	L	42	Very low	38.9	Very low	113 Å²	113	108.4 Å²	108.4	59%	0.592	58%	0.581	S	S	*	*	H	α-helix	trans	-71.4	-44.2	175.9	-88.1	162.5	0	0	0	111.7	H652 S653 G658 L659	H652-L655 PolarHBondContact O-N 2.97Å; S653-L655 VanDerWaalsContact C-N 3.33Å; S653-L655 PolarHBondContact O-N 3.2Å; L655-G658 PolarHBondContact O-N 3.27Å; L655-L659 WeakPolarHBondContact O-CB 3.29Å; L655-L659 PolarHBondContact O-N 3.5Å
656	L	43.7	Very low	39.2	Very low	126 Å²	126	109.4 Å²	109.4	66%	0.66	58%	0.576	S	S	*	*	H	α-helix	trans	-65.6	-42.9	174.4	-88	163.6	0	0	0	112.1	H652 S653 G658 L659 L660	H652-L656 PolarHBondContact O-N 3.16Å; S653-L656 PolarHBondContact O-N 3Å; L656-G658 VanDerWaalsContact C-N 3.33Å; L656-G658 PolarHBondContact O-N 3.13Å; L656-L659 PolarHBondContact O-N 3.45Å; L656-L660 WeakPolarHBondContact O-CB 3.49Å; L656-L660 PolarHBondContact O-N 2.74Å
657	F	44.6	Very low	39.4	Very low	69 Å²	69	112.2 Å²	112.2	30%	0.303	58%	0.58	S	S	.	*	H	α-helix	trans	-64.6	-39.6	176.3	-149	-97.8	0	0	0	111.4	K175 S653 V661	K175-F657 HydrophobicContact CG-CE2 4.24Å; S653-F657 WeakPolarHBondContact O-CB 3.46Å; S653-F657 PolarHBondContact O-N 3.15Å; F657-V661 HydrophobicContact CD1-CG2 4.15Å; F657-V661 HydrophobicContact CE1-CG2 4.19Å; F657-V661 VanDerWaalsContact O-CB 3.31Å; F657-V661 WeakPolarHBondContact O-CB 3.47Å; F657-V661 VanDerWaalsContact O-CG2 3.22Å; F657-V661 WeakPolarHBondContact O-CG2 3.4Å; F657-V661 PolarHBondContact O-N 2.93Å
658	G	40.7	Very low	39.6	Very low	32 Å²	32	112.5 Å²	112.5	33%	0.33	57%	0.571	S	S	.	*	H	α-helix	trans	-63.8	-43.9	173.6	0	0	0	0	0	113.2	H654 L655 L656 L662	H654-G658 PolarHBondContact O-N 3.24Å; L655-G658 PolarHBondContact O-N 3.27Å; L656-G658 VanDerWaalsContact C-N 3.33Å; L656-G658 PolarHBondContact O-N 3.13Å; G658-L662 WeakPolarHBondContact O-CB 3.47Å; G658-L662 WeakPolarHBondContact O-CG 3.3Å; G658-L662 PolarHBondContact O-N 2.98Å
659	L	43.8	Very low	39.3	Very low	95 Å²	95	108.7 Å²	108.7	50%	0.497	57%	0.566	S	S	.	*	H	α-helix	trans	-67	-41.9	176.7	-95	154	0	0	0	112.7	L655 L656 L662 F663	L655-L659 WeakPolarHBondContact O-CB 3.29Å; L655-L659 PolarHBondContact O-N 3.5Å; L656-L659 PolarHBondContact O-N 3.45Å; L659-L662 PolarHBondContact O-N 3.37Å; L659-F663 PolarHBondContact O-N 3.15Å
660	L	39.9	Very low	38.9	Very low	85 Å²	85	107.2 Å²	107.2	45%	0.445	56%	0.562	S	S	.	*	H	α-helix	trans	-66.1	-45.6	178	-167.7	71.9	0	0	0	111	I178 L656 L662 F663 I664	I178-L660 HydrophobicContact CD1-CD2 4.39Å; L656-L660 WeakPolarHBondContact O-CB 3.49Å; L656-L660 PolarHBondContact O-N 2.74Å; L660-L662 VanDerWaalsContact C-N 3.31Å; L660-L662 PolarHBondContact O-N 3.28Å; L660-F663 PolarHBondContact O-N 2.97Å; L660-I664 HydrophobicContact CD1-CD1 4.46Å; L660-I664 HydrophobicContact CG-CD1 4Å; L660-I664 WeakPolarHBondContact O-CB 3.46Å; L660-I664 VanDerWaalsContact O-CG1 3.31Å; L660-I664 WeakPolarHBondContact O-CG1 3.46Å; L660-I664 PolarHBondContact O-N 3.4Å
661	V	46.7	Very low	38.8	Very low	59 Å²	59	112.1 Å²	112.1	36%	0.358	58%	0.575	S	S	.	*	H	α-helix	trans	-62.8	-37.6	173.9	171.1	0	0	0	0	111.2	F657 N665	F657-V661 HydrophobicContact CD1-CG2 4.15Å; F657-V661 HydrophobicContact CE1-CG2 4.19Å; F657-V661 VanDerWaalsContact O-CB 3.31Å; F657-V661 WeakPolarHBondContact O-CB 3.47Å; F657-V661 VanDerWaalsContact O-CG2 3.22Å; F657-V661 WeakPolarHBondContact O-CG2 3.4Å; F657-V661 PolarHBondContact O-N 2.93Å; V661-N665 VanDerWaalsContact O-CB 3.32Å; V661-N665 WeakPolarHBondContact O-CB 3.42Å; V661-N665 PolarHBondContact O-N 3.31Å; V661-N665 PolarHBondContact O-ND2 2.99Å
662	L	38.8	Very low	37.8	Very low	114 Å²	114	113 Å²	113	60%	0.597	57%	0.57	S	S	*	*	H	α-helix	trans	-73	-31.4	176.6	-78.3	169.6	0	0	0	113.8	G658 L659 L660 R666	G658-L662 WeakPolarHBondContact O-CB 3.47Å; G658-L662 WeakPolarHBondContact O-CG 3.3Å; G658-L662 PolarHBondContact O-N 2.98Å; L659-L662 PolarHBondContact O-N 3.37Å; L660-L662 VanDerWaalsContact C-N 3.31Å; L660-L662 PolarHBondContact O-N 3.28Å; L662-R666 WeakPolarHBondContact O-CB 3.31Å; L662-R666 PolarHBondContact O-N 2.92Å
663	F	37.3	Very low	37.4	Very low	120 Å²	120	113 Å²	113	53%	0.526	57%	0.574	S	S	.	*	H	α-helix	trans	-69.4	-51.4	173	-109.4	-88	0	0	0	110.8	L659 L660 N665 R666 E667	L659-F663 PolarHBondContact O-N 3.15Å; L660-F663 PolarHBondContact O-N 2.97Å; F663-N665 PolarHBondContact O-N 3.49Å; F663-R666 PolarHBondContact O-N 3.21Å; F663-E667 HydrophobicContact CD1-CG 4.47Å; F663-E667 PolarHBondContact O-N 3.15Å
664	I	44.6	Very low	36.7	Very low	53 Å²	53	120.6 Å²	120.6	27%	0.272	59%	0.594	S	S	.	*	H	α-helix	trans	-59.3	-35.5	179.3	-65.3	168.8	0	0	0	111.4	L660	L660-I664 HydrophobicContact CD1-CD1 4.46Å; L660-I664 HydrophobicContact CG-CD1 4Å; L660-I664 WeakPolarHBondContact O-CB 3.46Å; L660-I664 VanDerWaalsContact O-CG1 3.31Å; L660-I664 WeakPolarHBondContact O-CG1 3.46Å; L660-I664 PolarHBondContact O-N 3.4Å
665	N	36.1	Very low	36.2	Very low	130 Å²	130	116.3 Å²	116.3	70%	0.695	58%	0.58	S	S	*	*	H	α-helix	trans	-88.4	8	176.9	-72.9	-89.8	0	0	0	114.9	V661 F663	V661-N665 VanDerWaalsContact O-CB 3.32Å; V661-N665 WeakPolarHBondContact O-CB 3.42Å; V661-N665 PolarHBondContact O-N 3.31Å; V661-N665 PolarHBondContact O-ND2 2.99Å; F663-N665 PolarHBondContact O-N 3.49Å
666	R	36.2	Very low	36	Very low	218 Å²	218	119.5 Å²	119.5	82%	0.823	59%	0.593	S	S	*	*	H	α-helix	trans	-123.8	-16.7	-175.5	-172.9	166.8	178	153.1	-0.4	115.5	L662 F663	L662-R666 WeakPolarHBondContact O-CB 3.31Å; L662-R666 PolarHBondContact O-N 2.92Å; F663-R666 PolarHBondContact O-N 3.21Å
667	E	35.9	Very low	35.4	Very low	149 Å²	149	120.2 Å²	120.2	70%	0.696	60%	0.597	S	S	*	*	H	α-helix	trans	-100.5	-34.1	177.1	-60	-161.9	130	0	0	113.6	F663 G669	F663-E667 HydrophobicContact CD1-CG 4.47Å; F663-E667 PolarHBondContact O-N 3.15Å; E667-G669 PolarHBondContact O-N 3.13Å; E667-G669 VanDerWaalsContact O-N 3.15Å
668	D	35.5	Very low	35.1	Very low	133 Å²	133	125.2 Å²	125.2	71%	0.711	63%	0.626	S	S	*	*			trans	-84.3	95.4	-173.1	-82.3	-30.3	0	0	0	114.8
669	G	28	Very low	34.6	Very low	58 Å²	58	127.2 Å²	127.2	60%	0.598	65%	0.647	S	S	*	*			trans	-110.3	133.9	151.9	0	0	0	0	0	111.1	E667	E667-G669 PolarHBondContact O-N 3.13Å; E667-G669 VanDerWaalsContact O-N 3.15Å
670	Y	26.9	Very low	33.9	Very low	190 Å²	190	135.4 Å²	135.4	75%	0.745	68%	0.682	S	S	*	*			trans	58.5	92.7	166.4	-63.7	-92.9	0	0	0	118.6
671	L	28.6	Very low	33.6	Very low	155 Å²	155	137.9 Å²	137.9	81%	0.812	69%	0.694	S	S	*	*			trans	-141	143.7	144.9	-92.6	166	0	0	0	107.7	Y508	Y508-L671 PolarHBondContact OH-O 2.88Å
672	Q	24.6	Very low	33	Very low	133 Å²	133	142.1 Å²	142.1	62%	0.621	71%	0.712	S	S	*	*			cis	130.5	-5.8	9.4	-87.8	161.8	11.5	0	0	111.6	Y508 R674	Y508-Q672 HydrophobicContact CE1-CB 4.21Å; Y508-Q672 HydrophobicContact CE1-CG 3.7Å; Y508-Q672 VanDerWaalsContact OH-CB 3.29Å; Y508-Q672 WeakPolarHBondContact OH-CB 3.29Å; Y508-Q672 WeakPolarHBondContact OH-CG 3.19Å; Y508-Q672 PolarHBondContact OH-N 3.08Å; Q672-R674 PolarHBondContact O-N 2.94Å
673	I	31.2	Very low	32.6	Very low	131 Å²	131	143.6 Å²	143.6	67%	0.672	72%	0.718	S	S	*	*			trans	-66.5	97.5	-178.2	-52.1	178.2	0	0	0	110.3
674	R	26.2	Very low	32.3	Very low	211 Å²	211	145 Å²	145	80%	0.796	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-69.3	149.3	158.2	-66.3	179	173.5	-176.5	-1.1	109.1	Q672 Q676	Q672-R674 PolarHBondContact O-N 2.94Å; R674-Q676 PolarHBondContact O-N 3.41Å
675	P	29.7	Very low	31.6	Very low	68 Å²	68	150.8 Å²	150.8	44%	0.442	76%	0.758	S	S	.	*	P	Polyproline II helix	trans	-64.2	129.7	151.7	29.7	-30.3	0	0	0	108.3	K511	K511-P675 WeakPolarHBondContact O-CG 3.37Å
676	Q	37.6	Very low	31.3	Very low	181 Å²	181	152.1 Å²	152.1	85%	0.846	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-96.8	140	153.5	-75.2	-177.4	-67.2	0	0	106.9	R674 L678	R674-Q676 PolarHBondContact O-N 3.41Å; Q676-L678 PolarHBondContact O-N 2.97Å
677	N	31.3	Very low	30.9	Very low	140 Å²	140	147.4 Å²	147.4	75%	0.749	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-69.1	123.4	174.2	-63.7	-10.9	0	0	0	108.1
678	L	37.2	Very low	30.5	Very low	174 Å²	174	147.3 Å²	147.3	91%	0.911	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-98.3	117.6	157.5	-83.7	160.2	0	0	0	106.1	Q676	Q676-L678 PolarHBondContact O-N 2.97Å
679	G	31.4	Very low	30.1	Very low	75 Å²	75	148.5 Å²	148.5	77%	0.773	77%	0.767	S	S	*	*			trans	-150.8	58.4	-174.1	0	0	0	0	0	109.6
680	E	29.1	Very low	30.3	Very low	266 Å²	266	156.7 Å²	156.7	100%	1.243	78%	0.783	S	S	*	*			trans	-160.4	0	162.5	-105.3	171.5	-161	0	0	106.7

Retrieved 680 of 680 residues in 244.2 ms (Link to these results)

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