A0A096N0J6_PAPAN Loading...

Nuclear receptor subfamily 2 group C member 1

AlphaFold DB (H9FZ60), UniProt , Accession A0A096N0J6, Species PAPAN (Papio anubis, Olive baboon), Gene NR2C1, Length 604 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36	Very low	40.2	Very low	241 Å²	241	107.3 Å²	107.3	100%	1.187	56%	0.555	S	S	*	*				0	113.2	0	-82.5	176.2	155.7	0	0	105.5
2	A	30.8	Very low	40.2	Very low	57 Å²	57	102.1 Å²	102.1	47%	0.471	53%	0.528	S	S	.	.			trans	-67.4	139.8	177.2	0	0	0	0	0	109.1	E6 I7	A2-E6 WeakPolarHBondContact CA-OE2 3.48Å; A2-E6 HydrophobicContact CB-CB 4.13Å; A2-I7 HydrophobicContact CB-CD1 4.36Å; A2-I7 HydrophobicContact CB-CG1 3.96Å
3	T	36.7	Very low	40.3	Very low	77 Å²	77	107.5 Å²	107.5	47%	0.472	55%	0.549	S	S	.	.			trans	-68.5	157.8	175.1	59.6	0	0	0	0	109.9	E5 E6 I7	T3-E5 PolarHBondContact O-N 3.39Å; T3-E6 PolarHBondContact N-OE2 3.4Å; T3-E6 WeakPolarHBondContact O-CB 3.36Å; T3-E6 PolarHBondContact O-N 3.48Å; T3-E6 WeakPolarHBondContact OG1-CG 3.41Å; T3-E6 PolarHBondContact OG1-OE2 3.2Å; T3-I7 PolarHBondContact O-N 3.39Å; T3-I7 VanDerWaalsContact O-N 3.16Å
4	I	42.2	Very low	40.5	Very low	95 Å²	95	112.4 Å²	112.4	49%	0.487	57%	0.569	S	S	.	*	H	α-helix	trans	-57.4	-32.4	-179.9	-68.5	171.4	0	0	0	111.2	A8	I4-A8 WeakPolarHBondContact O-CB 3.49Å; I4-A8 PolarHBondContact O-N 3.16Å
5	E	39.8	Very low	40.4	Very low	152 Å²	152	113.1 Å²	113.1	71%	0.71	57%	0.569	S	S	*	*	H	α-helix	trans	-66.6	-39.5	174.2	-71.9	178.6	160.4	0	0	112.7	T3 A8 H9	T3-E5 PolarHBondContact O-N 3.39Å; E5-A8 PolarHBondContact O-N 3.12Å; E5-H9 WeakPolarHBondContact O-CB 3.46Å; E5-H9 PolarHBondContact O-N 3.16Å
6	E	40.7	Very low	39.9	Very low	111 Å²	111	116.6 Å²	116.6	52%	0.519	59%	0.586	S	S	.	*	H	α-helix	trans	-66.9	-38.1	177.1	-74.7	169.9	158.1	0	0	111.7	A2 T3 Q10	A2-E6 WeakPolarHBondContact CA-OE2 3.48Å; A2-E6 HydrophobicContact CB-CB 4.13Å; T3-E6 PolarHBondContact N-OE2 3.4Å; T3-E6 WeakPolarHBondContact O-CB 3.36Å; T3-E6 PolarHBondContact O-N 3.48Å; T3-E6 WeakPolarHBondContact OG1-CG 3.41Å; T3-E6 PolarHBondContact OG1-OE2 3.2Å; E6-Q10 WeakPolarHBondContact O-CB 3.46Å; E6-Q10 PolarHBondContact O-N 3.35Å
7	I	44.7	Very low	39.9	Very low	75 Å²	75	110.9 Å²	110.9	39%	0.385	56%	0.563	S	S	.	*	H	α-helix	trans	-70.8	-35	176.7	-61.1	174.5	0	0	0	111	A2 T3 I11	A2-I7 HydrophobicContact CB-CD1 4.36Å; A2-I7 HydrophobicContact CB-CG1 3.96Å; T3-I7 PolarHBondContact O-N 3.39Å; T3-I7 VanDerWaalsContact O-N 3.16Å; I7-I11 HydrophobicContact CG2-CD1 4.34Å; I7-I11 WeakPolarHBondContact O-CG1 3.3Å; I7-I11 PolarHBondContact O-N 3.2Å
8	A	42.2	Very low	39.6	Very low	27 Å²	27	112.7 Å²	112.7	22%	0.223	57%	0.569	C	S	.	*	H	α-helix	trans	-69.7	-41.6	174.9	0	0	0	0	0	111.9	I4 E5 Q10 I11 I12 I19	I4-A8 WeakPolarHBondContact O-CB 3.49Å; I4-A8 PolarHBondContact O-N 3.16Å; E5-A8 PolarHBondContact O-N 3.12Å; A8-Q10 VanDerWaalsContact C-N 3.32Å; A8-Q10 PolarHBondContact O-N 2.95Å; A8-I11 PolarHBondContact O-N 3.43Å; A8-I12 WeakPolarHBondContact O-CG1 3.44Å; A8-I12 PolarHBondContact O-N 2.97Å; A8-I12 VanDerWaalsContact O-N 3.08Å; A8-I19 HydrophobicContact CB-CD1 4.12Å
9	H	42.3	Very low	39.6	Very low	125 Å²	125	110.3 Å²	110.3	58%	0.579	56%	0.557	S	S	*	*	H	α-helix	trans	-60.9	-39	173.8	-103.7	-87	0	0	0	112.5	E5 I11 I12 E13	E5-H9 WeakPolarHBondContact O-CB 3.46Å; E5-H9 PolarHBondContact O-N 3.16Å; H9-I11 VanDerWaalsContact C-N 3.28Å; H9-I11 PolarHBondContact O-N 3.31Å; H9-I12 PolarHBondContact O-N 3.34Å; H9-E13 PolarHBondContact O-N 3.49Å
10	Q	43.6	Very low	39.6	Very low	135 Å²	135	108.9 Å²	108.9	63%	0.631	55%	0.554	S	S	*	*	H	α-helix	trans	-69.7	-25.2	179.8	-138.5	165	21.5	0	0	113.3	E6 A8	E6-Q10 WeakPolarHBondContact O-CB 3.46Å; E6-Q10 PolarHBondContact O-N 3.35Å; A8-Q10 VanDerWaalsContact C-N 3.32Å; A8-Q10 PolarHBondContact O-N 2.95Å
11	I	43	Very low	39.8	Very low	85 Å²	85	108.4 Å²	108.4	44%	0.436	56%	0.556	S	S	.	*	H	α-helix	trans	-80.9	-33.2	173.8	-66.7	169	0	0	0	110.6	I7 A8 H9 Q14	I7-I11 HydrophobicContact CG2-CD1 4.34Å; I7-I11 WeakPolarHBondContact O-CG1 3.3Å; I7-I11 PolarHBondContact O-N 3.2Å; A8-I11 PolarHBondContact O-N 3.43Å; H9-I11 VanDerWaalsContact C-N 3.28Å; H9-I11 PolarHBondContact O-N 3.31Å; I11-Q14 PolarHBondContact O-N 3.36Å
12	I	40.5	Very low	39.8	Very low	45 Å²	45	104.7 Å²	104.7	23%	0.231	54%	0.536	C	S	.	.	H	α-helix	trans	-77.3	-30.7	177.8	-69.6	168.8	0	0	0	112.8	A8 H9 Q14 Q15 G17 I19	A8-I12 WeakPolarHBondContact O-CG1 3.44Å; A8-I12 PolarHBondContact O-N 2.97Å; A8-I12 VanDerWaalsContact O-N 3.08Å; H9-I12 PolarHBondContact O-N 3.34Å; I12-Q14 PolarHBondContact O-N 2.78Å; I12-Q15 CarbonylContact C-O 3.42Å; I12-Q15 CarbonylContact O-C 3.59Å; I12-Q15 PolarHBondContact O-N 2.83Å; I12-G17 VanDerWaalsContact CG2-O 3.23Å; I12-G17 WeakPolarHBondContact CG2-O 3.31Å; I12-I19 HydrophobicContact CD1-CD1 3.48Å; I12-I19 VanDerWaalsContact CD1-CD1 3.48Å; I12-I19 HydrophobicContact CD1-CG1 3.4Å; I12-I19 VanDerWaalsContact CD1-CG1 3.4Å
13	E	41.1	Very low	40.3	Very low	173 Å²	173	109.4 Å²	109.4	81%	0.808	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-19	172.5	-98	-168.5	154.3	0	0	112.8	H9	H9-E13 PolarHBondContact O-N 3.49Å
14	Q	43.3	Very low	40.4	Very low	176 Å²	176	115.3 Å²	115.3	82%	0.822	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-15.1	171.9	-64.5	-167.8	-6.9	0	0	114.1	I11 I12	I11-Q14 PolarHBondContact O-N 3.36Å; I12-Q14 PolarHBondContact O-N 2.78Å
15	Q	39.8	Very low	40.3	Very low	122 Å²	122	114.6 Å²	114.6	57%	0.57	57%	0.571	S	S	*	*	S	Bend	trans	-146.5	109.2	-177.6	-71	-174.8	-15.6	0	0	110.7	I12 G17	I12-Q15 CarbonylContact C-O 3.42Å; I12-Q15 CarbonylContact O-C 3.59Å; I12-Q15 PolarHBondContact O-N 2.83Å; Q15-G17 PolarHBondContact O-N 3.43Å
16	M	31.1	Very low	40.4	Very low	170 Å²	170	111.8 Å²	111.8	84%	0.837	58%	0.582	S	S	*	*			trans	-62	91.1	-175.3	-61.5	-137.9	76.5	0	0	113.3
17	G	40.5	Very low	40.4	Very low	19 Å²	19	113.8 Å²	113.8	20%	0.196	59%	0.592	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-146.8	144.8	177.1	0	0	0	0	0	113.3	I12 Q15 L35	I12-G17 VanDerWaalsContact CG2-O 3.23Å; I12-G17 WeakPolarHBondContact CG2-O 3.31Å; Q15-G17 PolarHBondContact O-N 3.43Å; G17-L35 WeakPolarHBondContact CA-O 3.41Å
18	E	35.1	Very low	40.3	Very low	143 Å²	143	117.6 Å²	117.6	67%	0.668	61%	0.606	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.2	140.2	-177.5	-155.8	176.2	-163.7	0	0	110.9
19	I	39.2	Very low	40.3	Very low	68 Å²	68	120.2 Å²	120.2	35%	0.349	62%	0.615	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.3	127.3	179.6	-60.6	172.2	0	0	0	110	A8 I12 T21 V32	A8-I19 HydrophobicContact CB-CD1 4.12Å; I12-I19 HydrophobicContact CD1-CD1 3.48Å; I12-I19 VanDerWaalsContact CD1-CD1 3.48Å; I12-I19 HydrophobicContact CD1-CG1 3.4Å; I12-I19 VanDerWaalsContact CD1-CG1 3.4Å; I19-T21 HydrophobicContact CG2-CG2 4.01Å; I19-V32 HydrophobicContact CG2-CG1 4.1Å
20	V	38.7	Very low	40.3	Very low	82 Å²	82	118.1 Å²	118.1	50%	0.497	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.9	111.8	166.7	-175.8	0	0	0	0	108.7
21	T	43.7	Very low	40.5	Very low	99 Å²	99	114.9 Å²	114.9	61%	0.607	59%	0.592	S	S	*	*			trans	-93.3	115.6	175.7	49.2	0	0	0	0	110.1	I19	I19-T21 HydrophobicContact CG2-CG2 4.01Å
22	E	36.7	Very low	40.7	Very low	163 Å²	163	112 Å²	112	76%	0.762	58%	0.578	S	S	*	*			trans	-132.9	131.7	172.9	-152.8	173.8	-164.7	0	0	111.1
23	Q	40.8	Very low	40.9	Very low	155 Å²	155	111.2 Å²	111.2	72%	0.724	58%	0.575	S	S	*	*			trans	72.1	103.2	174.7	-77	178.9	-15.1	0	0	119.4	T25	Q23-T25 PolarHBondContact O-N 2.99Å
24	Q	38.8	Very low	41.2	Very low	202 Å²	202	104.6 Å²	104.6	94%	0.944	55%	0.551	S	S	*	*			trans	-70.3	108.1	148.9	-73.8	-177.7	-7.5	0	0	108.6
25	T	40.6	Very low	41.3	Very low	79 Å²	79	99.5 Å²	99.5	49%	0.485	53%	0.529	S	S	.	.			trans	-82.6	144.6	163.2	56.3	0	0	0	0	108	Q23 Q27	Q23-T25 PolarHBondContact O-N 2.99Å; T25-Q27 PolarHBondContact O-N 3.37Å; T25-Q27 VanDerWaalsContact O-O 3.06Å
26	G	41.3	Very low	41.5	Very low	93 Å²	93	96.6 Å²	96.6	96%	0.959	52%	0.517	S	S	*	.	S	Bend	trans	-65.4	26.5	-174.8	0	0	0	0	0	116.4
27	Q	40.8	Very low	42.2	Very low	153 Å²	153	95.4 Å²	95.4	72%	0.715	51%	0.509	S	S	*	.	S	Bend	trans	-125.6	144.2	169.7	-69.2	-174.4	-12.2	0	0	108.9	T25 I29	T25-Q27 PolarHBondContact O-N 3.37Å; T25-Q27 VanDerWaalsContact O-O 3.06Å; Q27-I29 PolarHBondContact O-N 3.23Å
28	K	42.5	Very low	42.3	Very low	156 Å²	156	101.8 Å²	101.8	68%	0.678	54%	0.539	S	S	*	.	S	Bend	trans	-61.1	50.8	-167.6	-60.8	-179.4	169.6	-165.3	0	116.8
29	I	43.1	Very low	42.8	Very low	82 Å²	82	99 Å²	99	42%	0.421	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	134	-176.3	-54.7	175.2	0	0	0	109.1	Q27 L46	Q27-I29 PolarHBondContact O-N 3.23Å; I29-L46 HydrophobicContact CG2-CD2 3.97Å
30	Q	41.3	Very low	43	Very low	80 Å²	80	106.1 Å²	106.1	37%	0.374	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.5	126.7	174.7	-165.8	171.9	0.8	0	0	109.9	T47	Q30-T47 PolarHBondContact N-O 3.39Å; Q30-T47 PolarHBondContact O-N 3.14Å
31	I	47.9	Very low	43.6	Very low	67 Å²	67	103.1 Å²	103.1	34%	0.344	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	120.7	179.3	-46.6	-173.7	0	0	0	108.1	F44 L46	I31-F44 HydrophobicContact CG2-CD1 4.27Å; I31-L46 HydrophobicContact CB-CD2 4.31Å; I31-L46 HydrophobicContact CD1-CD2 4.21Å; I31-L46 HydrophobicContact CG1-CD2 3.69Å; I31-L46 HydrophobicContact CG2-CD2 4.24Å
32	V	47	Very low	43.8	Very low	26 Å²	26	104.1 Å²	104.1	16%	0.158	55%	0.545	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	127.6	174.5	-174.7	0	0	0	0	108.6	I19 I45	I19-V32 HydrophobicContact CG2-CG1 4.1Å; V32-I45 PolarHBondContact N-O 3.4Å; V32-I45 PolarHBondContact O-N 3.22Å
33	T	46.6	Very low	44.4	Very low	27 Å²	27	99.8 Å²	99.8	17%	0.166	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	122.4	176.8	-50.5	0	0	0	0	108.6	L35 F44	T33-L35 HydrophobicContact CG2-CD1 4.32Å; T33-F44 HydrophobicContact CG2-CD1 4.11Å; T33-F44 HydrophobicContact CG2-CE1 3.82Å
34	A	46.5	Very low	44.7	Very low	35 Å²	35	96.1 Å²	96.1	29%	0.289	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	123.3	169.2	0	0	0	0	0	108.4	Q43	A34-Q43 PolarHBondContact N-O 3.18Å; A34-Q43 VanDerWaalsContact N-O 3.11Å; A34-Q43 PolarHBondContact O-N 3.5Å
35	L	46.4	Very low	45.2	Very low	69 Å²	69	89 Å²	89	36%	0.361	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	117	167.3	-97	98.8	0	0	0	108.4	G17 T33 K42	G17-L35 WeakPolarHBondContact CA-O 3.41Å; T33-L35 HydrophobicContact CG2-CD1 4.32Å; L35-K42 HydrophobicContact CG-CG 4.39Å
36	D	43.2	Very low	45.5	Very low	60 Å²	60	87.6 Å²	87.6	32%	0.321	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	126.4	168	-166.3	-2.8	0	0	0	108.7	N38	D36-N38 PolarHBondContact O-N 3.38Å
37	H	44.6	Very low	45.8	Very low	146 Å²	146	84.9 Å²	84.9	68%	0.676	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-9.1	-173.8	-87.5	-70.1	0	0	0	113.9
38	N	43.8	Very low	46	Very low	153 Å²	153	82.7 Å²	82.7	82%	0.818	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	-0.5	-173.2	-124.2	-1.3	0	0	0	115.5	D36	D36-N38 PolarHBondContact O-N 3.38Å
39	T	44.4	Very low	46.1	Very low	83 Å²	83	81 Å²	81	51%	0.509	42%	0.416	S	S	.	.	S	Bend	trans	-138.4	138.1	169.8	44.1	0	0	0	0	109.6	G41	T39-G41 PolarHBondContact O-N 2.93Å
40	Q	43.5	Very low	46.1	Very low	218 Å²	218	81.2 Å²	81.2	100%	1.019	42%	0.418	S	S	*	.	S	Bend	trans	-69.8	33	179.9	-69.9	-173.5	-13.5	0	0	113.5
41	G	51.2	Low	46.2	Very low	20 Å²	20	81.8 Å²	81.8	21%	0.206	45%	0.445	C	S	.	.			trans	-120.3	124.3	-177.5	0	0	0	0	0	111.7	T39	T39-G41 PolarHBondContact O-N 2.93Å
42	K	48.3	Very low	45.8	Very low	119 Å²	119	82.6 Å²	82.6	52%	0.517	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	131.2	169.7	-62.7	-175	178.9	-174.1	0	109.3	L35 F44	L35-K42 HydrophobicContact CG-CG 4.39Å; K42-F44 HydrophobicContact CB-CE2 4.21Å; K42-F44 HydrophobicContact CB-CZ 4.19Å
43	Q	49.2	Very low	45.6	Very low	73 Å²	73	86.8 Å²	86.8	34%	0.341	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	140.2	173.1	-66.5	-174.7	1.9	0	0	110.3	A34	A34-Q43 PolarHBondContact N-O 3.18Å; A34-Q43 VanDerWaalsContact N-O 3.11Å; A34-Q43 PolarHBondContact O-N 3.5Å
44	F	48	Very low	45.3	Very low	78 Å²	78	90.8 Å²	90.8	34%	0.342	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	134.3	178.9	-57.2	-86.4	0	0	0	110.1	I31 T33 K42 L59	I31-F44 HydrophobicContact CG2-CD1 4.27Å; T33-F44 HydrophobicContact CG2-CD1 4.11Å; T33-F44 HydrophobicContact CG2-CE1 3.82Å; K42-F44 HydrophobicContact CB-CE2 4.21Å; K42-F44 HydrophobicContact CB-CZ 4.19Å; F44-L59 HydrophobicContact CB-CB 4.15Å; F44-L59 HydrophobicContact CB-CD1 4.32Å; F44-L59 PolarHBondContact N-O 3.1Å; F44-L59 VanDerWaalsContact N-O 3.14Å; F44-L59 WeakPolarHBondContact O-CB 2.93Å; F44-L59 PolarHBondContact O-N 3.02Å
45	I	49.6	Very low	45.2	Very low	51 Å²	51	93.1 Å²	93.1	26%	0.262	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	122.1	176.9	-57	175.7	0	0	0	107.8	V32 T47	V32-I45 PolarHBondContact N-O 3.4Å; V32-I45 PolarHBondContact O-N 3.22Å; I45-T47 HydrophobicContact CG2-CG2 4.08Å
46	L	46.8	Very low	45.1	Very low	51 Å²	51	93.9 Å²	93.9	27%	0.267	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	126.7	175.5	-66.8	169.9	0	0	0	109.3	I29 I31 V57 L59	I29-L46 HydrophobicContact CG2-CD2 3.97Å; I31-L46 HydrophobicContact CB-CD2 4.31Å; I31-L46 HydrophobicContact CD1-CD2 4.21Å; I31-L46 HydrophobicContact CG1-CD2 3.69Å; I31-L46 HydrophobicContact CG2-CD2 4.24Å; L46-V57 PolarHBondContact N-O 3.47Å; L46-L59 HydrophobicContact CD1-CD1 3.65Å; L46-L59 HydrophobicContact CG-CD1 4.14Å
47	T	46.7	Very low	45.3	Very low	36 Å²	36	92.8 Å²	92.8	22%	0.221	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	144.4	176	62	0	0	0	0	110.8	Q30 I45	Q30-T47 PolarHBondContact N-O 3.39Å; Q30-T47 PolarHBondContact O-N 3.14Å; I45-T47 HydrophobicContact CG2-CG2 4.08Å
48	N	45.5	Very low	45.3	Very low	106 Å²	106	88.7 Å²	88.7	57%	0.567	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	139.3	170.7	-98.6	-10.2	0	0	0	109.7	D50	N48-D50 VanDerWaalsContact C-N 3.32Å; N48-D50 PolarHBondContact O-N 2.96Å
49	H	45	Very low	45.4	Very low	120 Å²	120	83 Å²	83	56%	0.556	47%	0.472	S	S	*	.	S	Bend	trans	-68.9	-28	-179.1	180	-85.3	0	0	0	113.4
50	D	42	Very low	45.5	Very low	87 Å²	87	80.7 Å²	80.7	47%	0.465	46%	0.461	S	S	.	.	S	Bend	trans	-99.5	116.3	-175.5	-62.2	-18.6	0	0	0	109.3	N48 S52	N48-D50 VanDerWaalsContact C-N 3.32Å; N48-D50 PolarHBondContact O-N 2.96Å; D50-S52 PolarHBondContact O-N 3.26Å
51	G	43.4	Very low	45.5	Very low	92 Å²	92	78.3 Å²	78.3	95%	0.948	44%	0.442	S	S	*	.			trans	-62.8	31.8	-168.2	0	0	0	0	0	118.4
52	S	40.4	Very low	45	Very low	84 Å²	84	85.2 Å²	85.2	59%	0.587	47%	0.469	S	S	*	.	S	Bend	trans	-97	109.6	168.5	61.2	0	0	0	0	110.4	D50	D50-S52 PolarHBondContact O-N 3.26Å
53	T	41.5	Very low	44.5	Very low	115 Å²	115	85.7 Å²	85.7	71%	0.706	48%	0.477	S	S	*	.	S	Bend	trans	55.7	118.5	174.9	56.1	0	0	0	0	115.9	S55	T53-S55 PolarHBondContact O-N 3.1Å
54	P	41.2	Very low	44.2	Very low	110 Å²	110	88 Å²	88	71%	0.714	50%	0.502	S	S	*	.			trans	-79.6	91.8	-175.8	34.2	-32.8	0	0	0	109.5	K56	P54-K56 HydrophobicContact CB-CG 4.1Å; P54-K56 PolarHBondContact O-N 3.32Å
55	S	44	Very low	43.7	Very low	85 Å²	85	88.8 Å²	88.8	59%	0.594	51%	0.513	S	S	*	.			trans	-71.4	80	160.4	-58.8	0	0	0	0	108	T53 V57	T53-S55 PolarHBondContact O-N 3.1Å; S55-V57 PolarHBondContact O-N 2.9Å
56	K	45.8	Very low	43.2	Very low	84 Å²	84	92.5 Å²	92.5	37%	0.365	54%	0.54	S	S	.	.			trans	-71.1	118.9	175.8	-64.4	-175.7	-179.2	-178.1	0	108.1	P54	P54-K56 HydrophobicContact CB-CG 4.1Å; P54-K56 PolarHBondContact O-N 3.32Å
57	V	46.2	Very low	42.9	Very low	38 Å²	38	93.7 Å²	93.7	23%	0.23	57%	0.565	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.5	112.9	174	175.3	0	0	0	0	107.4	L46 S55 L71	L46-V57 PolarHBondContact N-O 3.47Å; S55-V57 PolarHBondContact O-N 2.9Å; V57-L71 HydrophobicContact CG1-CD2 3.15Å; V57-L71 HydrophobicContact CG1-CG 4.42Å
58	I	45.2	Very low	42.5	Very low	59 Å²	59	99.1 Å²	99.1	30%	0.303	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.4	123.1	179.9	-58.3	173.8	0	0	0	108.1
59	L	46.3	Very low	42.1	Very low	35 Å²	35	98.1 Å²	98.1	18%	0.183	58%	0.584	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.8	100.5	173.9	-72.6	165.1	0	0	0	108.5	F44 L46 V69 L71	F44-L59 HydrophobicContact CB-CB 4.15Å; F44-L59 HydrophobicContact CB-CD1 4.32Å; F44-L59 PolarHBondContact N-O 3.1Å; F44-L59 VanDerWaalsContact N-O 3.14Å; F44-L59 WeakPolarHBondContact O-CB 2.93Å; F44-L59 PolarHBondContact O-N 3.02Å; L46-L59 HydrophobicContact CD1-CD1 3.65Å; L46-L59 HydrophobicContact CG-CD1 4.14Å; L59-V69 HydrophobicContact CD2-CG1 3.25Å; L59-L71 HydrophobicContact CD2-CD2 3.33Å; L59-L71 HydrophobicContact CD2-CG 4.02Å; L59-L71 HydrophobicContact CG-CD2 3.97Å
60	A	44.9	Very low	41.9	Very low	34 Å²	34	98.6 Å²	98.6	28%	0.281	58%	0.584	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.9	122.1	173.8	0	0	0	0	0	110.1
61	R	44	Very low	41.6	Very low	168 Å²	168	97.3 Å²	97.3	63%	0.634	58%	0.577	S	S	*	*			trans	-95.8	99.4	167.8	-172	177.3	-173.6	169.3	1	108
62	Q	40.6	Very low	41.4	Very low	164 Å²	164	97 Å²	97	77%	0.766	56%	0.557	S	S	*	*			trans	-102.9	118.2	168.3	-110.7	177.7	-1.7	0	0	109.6
63	D	38.3	Very low	41.4	Very low	129 Å²	129	96.4 Å²	96.4	69%	0.69	55%	0.55	S	S	*	.	S	Bend	trans	71.3	153.5	165.4	-60.4	-26	0	0	0	120.5	T65	D63-T65 PolarHBondContact O-N 3.04Å
64	S	42.9	Very low	41.1	Very low	123 Å²	123	95.3 Å²	95.3	86%	0.86	55%	0.545	S	S	*	.	S	Bend	trans	-69.6	29.1	-158.1	48.2	0	0	0	0	116.3
65	T	38.2	Very low	40.9	Very low	94 Å²	94	96.1 Å²	96.1	58%	0.577	54%	0.543	S	S	*	.			trans	-101.2	128.8	169.9	57.7	0	0	0	0	110.6	D63 G67	D63-T65 PolarHBondContact O-N 3.04Å; T65-G67 PolarHBondContact O-N 3.27Å
66	P	37.4	Very low	40.7	Very low	128 Å²	128	97.6 Å²	97.6	83%	0.831	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	120.8	178	28.4	-29.7	0	0	0	109.1
67	G	41.4	Very low	40.4	Very low	77 Å²	77	98 Å²	98	79%	0.794	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	121.5	7.6	158.7	0	0	0	0	0	118.4	T65	T65-G67 PolarHBondContact O-N 3.27Å
68	K	37.4	Very low	40.1	Very low	149 Å²	149	99.5 Å²	99.5	65%	0.648	60%	0.603	S	S	*	*			trans	-114.1	118.8	171.7	-67.7	-175.7	-177	177.3	0	111.2	F70	K68-F70 HydrophobicContact CB-CE2 3.98Å; K68-F70 HydrophobicContact CB-CZ 4.31Å; K68-F70 HydrophobicContact CD-CZ 4.33Å
69	V	38.4	Very low	39.5	Very low	86 Å²	86	100.9 Å²	100.9	52%	0.521	61%	0.613	S	S	.	*			trans	-121.1	121.4	174	177.6	0	0	0	0	106.9	L59	L59-V69 HydrophobicContact CD2-CG1 3.25Å
70	F	39.6	Very low	38.8	Very low	129 Å²	129	106.6 Å²	106.6	57%	0.566	64%	0.644	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100.3	126.5	179.8	-63.5	-86.7	0	0	0	109.4	K68	K68-F70 HydrophobicContact CB-CE2 3.98Å; K68-F70 HydrophobicContact CB-CZ 4.31Å; K68-F70 HydrophobicContact CD-CZ 4.33Å
71	L	36.6	Very low	38.3	Very low	61 Å²	61	111 Å²	111	32%	0.319	66%	0.659	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.7	111.5	172.4	-68.2	160.6	0	0	0	107.2	V57 L59	V57-L71 HydrophobicContact CG1-CD2 3.15Å; V57-L71 HydrophobicContact CG1-CG 4.42Å; L59-L71 HydrophobicContact CD2-CD2 3.33Å; L59-L71 HydrophobicContact CD2-CG 4.02Å; L59-L71 HydrophobicContact CG-CD2 3.97Å
72	T	39.6	Very low	37.6	Very low	85 Å²	85	109.2 Å²	109.2	52%	0.521	66%	0.662	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.9	129.2	172.9	57.5	0	0	0	0	109.5
73	T	38.9	Very low	37.1	Very low	71 Å²	71	108.5 Å²	108.5	44%	0.436	66%	0.656	S	S	.	*			trans	-98.1	145.1	165.4	50.6	0	0	0	0	108.4	D75	T73-D75 PolarHBondContact O-N 3.43Å
74	P	36	Very low	36.6	Very low	93 Å²	93	111.9 Å²	111.9	60%	0.604	67%	0.665	S	S	*	*	S	Bend	trans	-70.4	-13.7	-178.4	-14.8	29.6	0	0	0	113.9
75	D	38.1	Very low	35.8	Very low	126 Å²	126	112 Å²	112	67%	0.674	66%	0.66	S	S	*	*	S	Bend	trans	-105	125.1	-168.7	-61.1	-21.9	0	0	0	112	T73 A77	T73-D75 PolarHBondContact O-N 3.43Å; D75-A77 PolarHBondContact O-N 3.24Å
76	A	39.4	Very low	35.4	Very low	117 Å²	117	113.7 Å²	113.7	97%	0.967	67%	0.671	S	S	*	*	S	Bend	trans	-73.5	35.5	-169.9	0	0	0	0	0	115.8
77	A	39	Very low	35.3	Very low	91 Å²	91	113.6 Å²	113.6	75%	0.752	67%	0.67	S	S	*	*	S	Bend	trans	-135.8	99.1	179.5	0	0	0	0	0	111.8	D75	D75-A77 PolarHBondContact O-N 3.24Å
78	G	40.4	Very low	34.6	Very low	71 Å²	71	117.1 Å²	117.1	73%	0.732	67%	0.671	S	S	*	*			trans	77.7	83.4	161.9	0	0	0	0	0	115.4	N80	G78-N80 PolarHBondContact O-N 2.81Å
79	V	32	Very low	34.7	Very low	87 Å²	87	117.7 Å²	117.7	53%	0.527	68%	0.681	S	S	.	*			trans	-87.9	99.8	173.8	-169	0	0	0	0	110	Q81	V79-Q81 HydrophobicContact CG1-CG 3.68Å; V79-Q81 PolarHBondContact O-N 3.38Å
80	N	32	Very low	34.4	Very low	156 Å²	156	119 Å²	119	83%	0.834	69%	0.694	S	S	*	*			trans	-76.7	103.6	157.8	-74	-52.5	0	0	0	108	G78	G78-N80 PolarHBondContact O-N 2.81Å
81	Q	33.3	Very low	34.2	Very low	125 Å²	125	117.1 Å²	117.1	58%	0.584	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-80.6	120.4	175	-66.8	-176.1	-4	0	0	110.3	V79 F83	V79-Q81 HydrophobicContact CG1-CG 3.68Å; V79-Q81 PolarHBondContact O-N 3.38Å; Q81-F83 HydrophobicContact CB-CE2 4.2Å
82	L	30.5	Very low	34.2	Very low	132 Å²	132	122 Å²	122	69%	0.691	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-99.9	124.6	167.5	-80.9	163.7	0	0	0	109
83	F	28.8	Very low	33.9	Very low	149 Å²	149	124 Å²	124	65%	0.654	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-100.2	127.1	171.9	-76.3	-89.2	0	0	0	109.9	Q81	Q81-F83 HydrophobicContact CB-CE2 4.2Å
84	F	28.8	Very low	33.7	Very low	200 Å²	200	127.7 Å²	127.7	88%	0.877	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-97.2	122	164.1	-69.2	-82.1	0	0	0	108.9
85	T	26	Very low	33.4	Very low	124 Å²	124	127.7 Å²	127.7	76%	0.761	73%	0.734	S	S	*	*			trans	-113.2	125.3	169	40.3	0	0	0	0	109.8
86	T	29.9	Very low	33.1	Very low	130 Å²	130	127.8 Å²	127.8	80%	0.798	73%	0.734	S	S	*	*			trans	-61.3	161.9	166.5	34.5	0	0	0	0	111.6	D88	T86-D88 PolarHBondContact O-N 3.1Å; T86-D88 VanDerWaalsContact O-N 3.12Å
87	P	34.7	Very low	32.8	Very low	126 Å²	126	129.5 Å²	129.5	82%	0.818	73%	0.726	S	S	*	*	S	Bend	trans	-84.1	99.3	-160.4	33.6	-29.3	0	0	0	109.9
88	D	27.6	Very low	32.5	Very low	151 Å²	151	131 Å²	131	81%	0.807	73%	0.726	S	S	*	*			trans	-145.8	136.1	150	-137.9	-15	0	0	0	112.1	T86 S90	T86-D88 PolarHBondContact O-N 3.1Å; T86-D88 VanDerWaalsContact O-N 3.12Å; D88-S90 PolarHBondContact O-N 3.5Å
89	L	39.1	Very low	32.1	Very low	162 Å²	162	135 Å²	135	85%	0.848	73%	0.73	S	S	*	*			trans	-73.3	103.8	-167.5	-88.8	79.1	0	0	0	111.2
90	S	31.7	Very low	32.1	Very low	114 Å²	114	138.1 Å²	138.1	80%	0.797	74%	0.744	S	S	*	*	S	Bend	trans	178.4	130.9	132.3	41.2	0	0	0	0	111.4	D88	D88-S90 PolarHBondContact O-N 3.5Å
91	A	36.3	Very low	32	Very low	89 Å²	89	136.5 Å²	136.5	74%	0.736	75%	0.746	S	S	*	*			trans	65.4	90.8	171.6	0	0	0	0	0	117.3	H93	A91-H93 PolarHBondContact O-N 3.32Å
92	Q	35.5	Very low	31.9	Very low	163 Å²	163	135.6 Å²	135.6	76%	0.762	75%	0.753	S	S	*	*			trans	-78.5	106	158.4	-70.1	171.2	-7	0	0	108.7
93	H	33.8	Very low	32.3	Very low	127 Å²	127	135.7 Å²	135.7	59%	0.588	76%	0.761	S	S	*	*			trans	-107.6	110.7	173.6	-165.8	70.2	0	0	0	108.9	A91 Q95	A91-H93 PolarHBondContact O-N 3.32Å; H93-Q95 PolarHBondContact NE2-OE1 2.86Å
94	L	34.6	Very low	32.8	Very low	148 Å²	148	135.4 Å²	135.4	78%	0.775	77%	0.767	S	S	*	*			trans	-101.8	99.1	175.9	-105.1	153.5	0	0	0	108
95	Q	30	Very low	33.2	Very low	93 Å²	93	134.5 Å²	134.5	44%	0.435	77%	0.765	S	S	.	*			trans	-102.3	111.7	176.4	-169.7	106.3	25.6	0	0	109.1	H93 V110	H93-Q95 PolarHBondContact NE2-OE1 2.86Å; Q95-V110 VanDerWaalsContact NE2-CG1 3.35Å
96	L	32.8	Very low	33.8	Very low	128 Å²	128	131.7 Å²	131.7	67%	0.67	76%	0.761	S	S	*	*			trans	-99.1	107.5	169	-73.5	166.1	0	0	0	108.5
97	L	32.2	Very low	34.4	Very low	153 Å²	153	131.6 Å²	131.6	80%	0.801	76%	0.762	S	S	*	*			trans	-83.1	113.2	164.4	-77.6	159.3	0	0	0	107.2
98	T	33.5	Very low	34.6	Very low	122 Å²	122	133.3 Å²	133.3	75%	0.748	77%	0.765	S	S	*	*			trans	-108.1	101.1	170.2	-1.4	0	0	0	0	106.9	N100	T98-N100 PolarHBondContact O-N 3.15Å
99	D	31.5	Very low	35.4	Very low	155 Å²	155	134 Å²	134	83%	0.829	76%	0.76	S	S	*	*			trans	-77	105.9	164	-82.6	-22.4	0	0	0	107.5
100	N	32.7	Very low	36.2	Very low	153 Å²	153	130.6 Å²	130.6	82%	0.818	75%	0.747	S	S	*	*			trans	-141.1	124.2	156.4	-91.8	-24	0	0	0	108	T98	T98-N100 PolarHBondContact O-N 3.15Å
101	S	29.2	Very low	37.7	Very low	123 Å²	123	130.6 Å²	130.6	86%	0.86	73%	0.732	S	S	*	*			trans	-72	132.8	-164.9	42.2	0	0	0	0	114.7
102	S	30.3	Very low	39.9	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	72%	0.715	S	S	*	*			trans	-152.3	128.4	137.5	55.9	0	0	0	0	108.1	D104	S102-D104 PolarHBondContact O-N 2.94Å
103	P	39	Very low	42.6	Very low	133 Å²	133	126.8 Å²	126.8	86%	0.864	70%	0.704	S	S	*	*			trans	-95.3	73.6	-171.7	37	-30.2	0	0	0	109.8
104	D	40	Very low	45.5	Very low	144 Å²	144	120.9 Å²	120.9	77%	0.77	68%	0.677	S	S	*	*			trans	-162.1	138.1	154.9	-142.1	-7.8	0	0	0	111.6	S102	S102-D104 PolarHBondContact O-N 2.94Å
105	Q	36.8	Very low	48.3	Very low	180 Å²	180	116 Å²	116	84%	0.841	65%	0.654	S	S	*	*	S	Bend	trans	90.3	94.3	175.5	-50.9	-173.4	11.7	0	0	119.5
106	G	39.3	Very low	51.5	Low	65 Å²	65	111.7 Å²	111.7	67%	0.67	63%	0.633	S	S	*	*	S	Bend	trans	76.1	160.6	142.2	0	0	0	0	0	118	N108	G106-N108 PolarHBondContact O-N 3.36Å; G106-N108 VanDerWaalsContact O-N 3.08Å
107	P	41.6	Very low	54.4	Low	128 Å²	128	105.9 Å²	105.9	83%	0.831	60%	0.603	S	S	*	*	S	Bend	trans	-64.6	115.9	-179.4	27	-31.4	0	0	0	109.7	K109	P107-K109 PolarHBondContact O-N 3.39Å
108	N	39.4	Very low	57.2	Low	162 Å²	162	100.9 Å²	100.9	87%	0.866	59%	0.589	S	S	*	*			trans	-43	103	174.5	-86.2	-37	0	0	0	111.4	G106 V110	G106-N108 PolarHBondContact O-N 3.36Å; G106-N108 VanDerWaalsContact O-N 3.08Å; N108-V110 PolarHBondContact O-N 3.43Å; N108-V110 VanDerWaalsContact O-N 3.12Å
109	K	44.1	Very low	60	Low	165 Å²	165	96.2 Å²	96.2	72%	0.717	56%	0.559	S	S	*	*			trans	-71.7	104.5	172.8	-93.5	-179.4	176.5	173.9	0	109.1	P107 F111	P107-K109 PolarHBondContact O-N 3.39Å; K109-F111 HydrophobicContact CB-CE1 3.95Å; K109-F111 HydrophobicContact CB-CE2 3.89Å; K109-F111 HydrophobicContact CB-CZ 3.55Å; K109-F111 HydrophobicContact CD-CE1 4.13Å; K109-F111 HydrophobicContact CD-CZ 4.01Å; K109-F111 HydrophobicContact CG-CZ 4.4Å; K109-F111 WeakPolarHBondContact O-CD2 3.24Å; K109-F111 WeakPolarHBondContact O-CE2 3.35Å; K109-F111 PolarHBondContact O-N 2.9Å
110	V	55.1	Low	63	Low	92 Å²	92	94.3 Å²	94.3	56%	0.558	54%	0.544	S	S	*	.			trans	-57.7	122.4	163.7	-179.1	0	0	0	0	107.9	Q95 N108	Q95-V110 VanDerWaalsContact NE2-CG1 3.35Å; N108-V110 PolarHBondContact O-N 3.43Å; N108-V110 VanDerWaalsContact O-N 3.12Å
111	F	64.3	Low	65.9	Low	113 Å²	113	87.8 Å²	87.8	50%	0.496	51%	0.511	S	S	.	.			trans	-112.8	126	175	-64	-66.4	0	0	0	109.8	K109 K120	K109-F111 HydrophobicContact CB-CE1 3.95Å; K109-F111 HydrophobicContact CB-CE2 3.89Å; K109-F111 HydrophobicContact CB-CZ 3.55Å; K109-F111 HydrophobicContact CD-CE1 4.13Å; K109-F111 HydrophobicContact CD-CZ 4.01Å; K109-F111 HydrophobicContact CG-CZ 4.4Å; K109-F111 WeakPolarHBondContact O-CD2 3.24Å; K109-F111 WeakPolarHBondContact O-CE2 3.35Å; K109-F111 PolarHBondContact O-N 2.9Å; F111-K120 HydrophobicContact CD1-CD 4.47Å; F111-K120 VanDerWaalsContact CE1-CE 3.4Å; F111-K120 VanDerWaalsContact CZ-NZ 3.29Å
112	D	82.3	Confident	69	Low	72 Å²	72	85 Å²	85	39%	0.385	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-67.9	143.6	171.7	-63.4	-32.9	0	0	0	110.7	A121 V129	D112-A121 HydrophobicContact CB-CB 3.98Å; D112-A121 WeakPolarHBondContact O-CB 3.38Å; D112-A121 PolarHBondContact O-N 2.87Å; D112-V129 HydrophobicContact CB-CG1 3.78Å
113	L	92.1	Very high	71.9	Confident	101 Å²	101	81 Å²	81	53%	0.529	47%	0.468	S	S	.	.	B	Isolated β-bridge	trans	-99.4	145.9	176.8	-69.6	164.8	0	0	0	110.6	V115 G118	L113-V115 PolarHBondContact O-N 3.11Å; L113-G118 WeakPolarHBondContact CD2-O 3.5Å
114	C	95.6	Very high	74.5	Confident	3 Å²	3	82.5 Å²	82.5	2%	0.02	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-70.3	117.2	177	174.5	0	0	0	0	110.3	V116 C117 G118 D119 T130 C131	C114-V116 PolarHBondContact O-N 2.99Å; C114-C117 PolarHBondContact O-N 3.44Å; C114-G118 WeakPolarHBondContact O-CA 3.02Å; C114-G118 PolarHBondContact O-N 3.37Å; C114-D119 WeakPolarHBondContact CB-O 3.44Å; C114-D119 PolarHBondContact N-O 3.02Å; C114-T130 VanDerWaalsContact SG-CA 3.59Å; C114-C131 HydrophobicContact CB-CB 3.93Å; C114-C131 PolarHBondContact SG-N 3.07Å
115	V	93.5	Very high	77.2	Confident	46 Å²	46	77 Å²	77	28%	0.279	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-21.5	-179.3	-58.6	0	0	0	0	114	L113 A128 V129 T130 F177	L113-V115 PolarHBondContact O-N 3.11Å; V115-A128 HydrophobicContact CG2-CB 4.15Å; V115-V129 WeakPolarHBondContact CG2-O 3.15Å; V115-V129 PolarHBondContact N-O 3.5Å; V115-V129 VanDerWaalsContact N-O 3.1Å; V115-T130 HydrophobicContact CG2-CG2 4.25Å; V115-F177 HydrophobicContact CB-CB 4.39Å; V115-F177 HydrophobicContact CB-CD1 4.3Å; V115-F177 HydrophobicContact CB-CG 4.43Å; V115-F177 HydrophobicContact CG2-CB 3.76Å; V115-F177 HydrophobicContact CG2-CG 4.31Å
116	V	95.3	Very high	80	Confident	1 Å²	1	70.6 Å²	70.6	1%	0.006	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-42.9	-179	179.4	0	0	0	0	112.9	C114 T130 C134 I158 R170 R173 M179	C114-V116 PolarHBondContact O-N 2.99Å; V116-T130 HydrophobicContact CG2-CG2 3.99Å; V116-C134 HydrophobicContact CB-CB 4.32Å; V116-C134 HydrophobicContact CG1-CB 4.46Å; V116-I158 HydrophobicContact CG1-CG2 4.28Å; V116-I158 WeakPolarHBondContact O-CG2 3.06Å; V116-R170 HydrophobicContact CG1-CG 4.47Å; V116-R173 HydrophobicContact CG1-CB 4.44Å; V116-R173 HydrophobicContact CG1-CG 4.34Å; V116-R173 VanDerWaalsContact O-CD 3.31Å; V116-R173 WeakPolarHBondContact O-CD 3.45Å; V116-R173 PolarHBondContact O-NE 3.02Å; V116-R173 VanDerWaalsContact O-NE 3.17Å; V116-M179 HydrophobicContact CG2-SD 4.28Å
117	C	94.1	Very high	82.4	Confident	6 Å²	6	68.7 Å²	68.7	4%	0.041	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.2	0.7	-169.2	70	0	0	0	0	115.2	C114 D119 C134 I158 N159 K160 R163	C114-C117 PolarHBondContact O-N 3.44Å; C117-D119 PolarHBondContact O-N 2.79Å; C117-C134 VanDerWaalsContact SG-SG 3.63Å; C117-I158 HydrophobicContact CB-CG2 4.04Å; C117-N159 CarbonylContact O-C 3.58Å; C117-N159 VanDerWaalsContact O-C 3.31Å; C117-N159 WeakPolarHBondContact O-CA 3.3Å; C117-K160 PolarHBondContact O-N 2.84Å; C117-R163 HydrophobicContact CB-CB 4.25Å; C117-R163 PolarHBondContact SG-NH1 3.4Å
118	G	90.6	Very high	84.8	Confident	48 Å²	48	62.8 Å²	62.8	50%	0.495	34%	0.336	S	S	.	.	S	Bend	trans	70.8	6.3	-179.9	0	0	0	0	0	115.3	L113 C114	L113-G118 WeakPolarHBondContact CD2-O 3.5Å; C114-G118 WeakPolarHBondContact O-CA 3.02Å; C114-G118 PolarHBondContact O-N 3.37Å
119	D	93.9	Very high	87.4	Confident	25 Å²	25	56.7 Å²	56.7	13%	0.134	31%	0.305	C	S	.	.	S	Bend	trans	-75.2	164.1	172.8	-161.9	10.6	0	0	0	111	C114 C117 A121 C131 K160 R163	C114-D119 WeakPolarHBondContact CB-O 3.44Å; C114-D119 PolarHBondContact N-O 3.02Å; C117-D119 PolarHBondContact O-N 2.79Å; D119-A121 PolarHBondContact O-N 3.28Å; D119-C131 HydrophobicContact CB-CB 4.14Å; D119-K160 HydrophobicContact CB-CB 4.26Å; D119-K160 HydrophobicContact CB-CD 4.34Å; D119-K160 HydrophobicContact CB-CG 4.11Å; D119-K160 WeakPolarHBondContact OD1-CD 3.45Å; D119-K160 VanDerWaalsContact OD1-CE 3.23Å; D119-K160 WeakPolarHBondContact OD1-CE 3.49Å; D119-K160 IonicContact OD1-NZ 3.97Å; D119-K160 PolarHBondContact OD1-NZ 3.3Å; D119-R163 IonicContact OD2-CZ 2.67Å; D119-R163 IonicContact OD2-NH1 3.5Å; D119-R163 PolarHBondContact OD2-NH1 3Å; D119-R163 IonicContact OD2-NH2 3.38Å; D119-R163 PolarHBondContact OD2-NH2 2.83Å
120	K	93.9	Very high	89.9	Confident	115 Å²	115	48.9 Å²	48.9	50%	0.5	27%	0.271	S	S	.	.	B	Isolated β-bridge	trans	-56.9	121.9	179	-173.2	174.8	-175.9	167.5	0	110.8	F111 C131	F111-K120 HydrophobicContact CD1-CD 4.47Å; F111-K120 VanDerWaalsContact CE1-CE 3.4Å; F111-K120 VanDerWaalsContact CZ-NZ 3.29Å; K120-C131 WeakPolarHBondContact O-CB 3.28Å
121	A	94.4	Very high	91.9	Very high	15 Å²	15	44.6 Å²	44.6	12%	0.124	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-74.5	144.2	177.3	0	0	0	0	0	110.5	D112 D119 V129 T130	D112-A121 HydrophobicContact CB-CB 3.98Å; D112-A121 WeakPolarHBondContact O-CB 3.38Å; D112-A121 PolarHBondContact O-N 2.87Å; D119-A121 PolarHBondContact O-N 3.28Å; A121-V129 HydrophobicContact CB-CG1 3.57Å; A121-T130 WeakPolarHBondContact CA-O 3.49Å
122	S	93.9	Very high	93.5	Very high	64 Å²	64	44 Å²	44	45%	0.448	24%	0.244	S	C	.	.			trans	-98.2	-6.3	171.5	52.9	0	0	0	0	112.3	H125 T130 E132	S122-H125 PolarHBondContact OG-NE2 3.49Å; S122-T130 PolarHBondContact N-O 3.32Å; S122-E132 WeakPolarHBondContact CB-OE1 3.34Å; S122-E132 PolarHBondContact OG-OE1 2.85Å
123	G	90.9	Very high	94.2	Very high	24 Å²	24	41.9 Å²	41.9	25%	0.247	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	141.1	-162.9	179.5	0	0	0	0	0	112	H125 V129 T130	G123-H125 PolarHBondContact O-CD2 2.93Å; G123-V129 WeakPolarHBondContact O-CA 3.16Å; G123-T130 PolarHBondContact O-N 3Å
124	R	94.1	Very high	94.5	Very high	163 Å²	163	37.1 Å²	37.1	62%	0.615	21%	0.214	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	118.2	178.3	-175.7	174.5	-106.8	-98	-9.7	110.3	G127 A128	R124-G127 PolarHBondContact NH1-O 3.29Å; R124-G127 PolarHBondContact NH2-O 3.01Å; R124-A128 CarbonylContact C-O 3.14Å; R124-A128 WeakPolarHBondContact CA-O 3.26Å
125	H	95.6	Very high	94.6	Very high	30 Å²	30	39.7 Å²	39.7	14%	0.139	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.8	176.7	-54.2	-69.9	0	0	0	109.9	S122 G123 G127 A128 T130 E132 K135	S122-H125 PolarHBondContact OG-NE2 3.49Å; G123-H125 PolarHBondContact O-CD2 2.93Å; H125-G127 PolarHBondContact O-N 3Å; H125-G127 VanDerWaalsContact O-N 3.07Å; H125-A128 PolarHBondContact N-O 3.25Å; H125-A128 PolarHBondContact O-N 3.31Å; H125-A128 VanDerWaalsContact O-N 3.13Å; H125-A128 VanDerWaalsContact O-O 3.14Å; H125-T130 WeakPolarHBondContact CB-OG1 3.41Å; H125-T130 PolarHBondContact CD2-O 2.9Å; H125-T130 PolarHBondContact CD2-OG1 2.99Å; H125-T130 VanDerWaalsContact CD2-OG1 3.32Å; H125-E132 IonicContact CE1-OE1 2.62Å; H125-E132 IonicContact NE2-OE1 3.88Å; H125-E132 PolarHBondContact NE2-OE1 3.12Å; H125-K135 HydrophobicContact CB-CB 4.01Å; H125-K135 HydrophobicContact CB-CD 4.37Å; H125-K135 HydrophobicContact CB-CG 3.84Å; H125-K135 WeakPolarHBondContact ND1-CD 3.32Å; H125-K135 VanDerWaalsContact ND1-CE 3.33Å; H125-K135 WeakPolarHBondContact ND1-CE 3.45Å
126	Y	95.8	Very high	94.7	Very high	45 Å²	45	38.3 Å²	38.3	18%	0.176	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	29.4	178.4	-48.4	-68.1	0	0	0	114.1	K135 F138 K139 M179 K180 V184	Y126-K135 HydrophobicContact CE2-CG 3.79Å; Y126-F138 AromaticContact CD2-CD1 3.8Å; Y126-F138 HydrophobicContact CD2-CD1 3.8Å; Y126-F138 HydrophobicContact CE2-CD1 4.4Å; Y126-F138 AromaticContact CG-CD1 3.98Å; Y126-F138 HydrophobicContact CG-CD1 3.98Å; Y126-F138 HydrophobicContact CG-CE1 4.25Å; Y126-K139 HydrophobicContact CE2-CB 4.23Å; Y126-K139 WeakPolarHBondContact OH-CB 3.33Å; Y126-K139 WeakPolarHBondContact OH-CD 3.46Å; Y126-K139 WeakPolarHBondContact OH-CG 3.49Å; Y126-M179 HydrophobicContact CD2-CE 3.59Å; Y126-M179 HydrophobicContact CG-CE 4.34Å; Y126-M179 CarbonylContact O-C 3.48Å; Y126-M179 VanDerWaalsContact O-CA 3.32Å; Y126-M179 WeakPolarHBondContact O-CA 3.42Å; Y126-K180 PolarHBondContact O-N 3.37Å; Y126-V184 HydrophobicContact CD1-CG2 3.72Å; Y126-V184 HydrophobicContact CE1-CB 4.4Å; Y126-V184 HydrophobicContact CE1-CG2 3.78Å; Y126-V184 HydrophobicContact CG-CG2 4.28Å
127	G	90.4	Very high	94.9	Very high	24 Å²	24	38.6 Å²	38.6	25%	0.247	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.1	-5.6	178.7	0	0	0	0	0	116.2	R124 H125	R124-G127 PolarHBondContact NH1-O 3.29Å; R124-G127 PolarHBondContact NH2-O 3.01Å; H125-G127 PolarHBondContact O-N 3Å; H125-G127 VanDerWaalsContact O-N 3.07Å
128	A	92.2	Very high	95.1	Very high	5 Å²	5	38.3 Å²	38.3	4%	0.041	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	149.4	179.6	0	0	0	0	0	113.4	V115 R124 H125 T130 F177 M179	V115-A128 HydrophobicContact CG2-CB 4.15Å; R124-A128 CarbonylContact C-O 3.14Å; R124-A128 WeakPolarHBondContact CA-O 3.26Å; H125-A128 PolarHBondContact N-O 3.25Å; H125-A128 PolarHBondContact O-N 3.31Å; H125-A128 VanDerWaalsContact O-N 3.13Å; H125-A128 VanDerWaalsContact O-O 3.14Å; A128-T130 HydrophobicContact CB-CG2 4.12Å; A128-T130 PolarHBondContact O-N 3.1Å; A128-F177 WeakPolarHBondContact CB-O 3.42Å; A128-M179 HydrophobicContact CB-CG 3.78Å
129	V	93.4	Very high	95.3	Very high	34 Å²	34	40.2 Å²	40.2	21%	0.206	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	108	176.4	179	0	0	0	0	109.4	D112 V115 A121 G123	D112-V129 HydrophobicContact CB-CG1 3.78Å; V115-V129 WeakPolarHBondContact CG2-O 3.15Å; V115-V129 PolarHBondContact N-O 3.5Å; V115-V129 VanDerWaalsContact N-O 3.1Å; A121-V129 HydrophobicContact CB-CG1 3.57Å; G123-V129 WeakPolarHBondContact O-CA 3.16Å
130	T	96.3	Very high	95.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	161.9	-170.9	57	0	0	0	0	113.4	C114 V115 V116 A121 S122 G123 H125 A128 M179	C114-T130 VanDerWaalsContact SG-CA 3.59Å; V115-T130 HydrophobicContact CG2-CG2 4.25Å; V116-T130 HydrophobicContact CG2-CG2 3.99Å; A121-T130 WeakPolarHBondContact CA-O 3.49Å; S122-T130 PolarHBondContact N-O 3.32Å; G123-T130 PolarHBondContact O-N 3Å; H125-T130 WeakPolarHBondContact CB-OG1 3.41Å; H125-T130 PolarHBondContact CD2-O 2.9Å; H125-T130 PolarHBondContact CD2-OG1 2.99Å; H125-T130 VanDerWaalsContact CD2-OG1 3.32Å; A128-T130 HydrophobicContact CB-CG2 4.12Å; A128-T130 PolarHBondContact O-N 3.1Å; T130-M179 HydrophobicContact CG2-CE 4.39Å; T130-M179 HydrophobicContact CG2-CG 4.38Å; T130-M179 HydrophobicContact CG2-SD 3.89Å
131	C	97.4	Very high	95.6	Very high	3 Å²	3	40.4 Å²	40.4	2%	0.02	21%	0.21	C	C	.	.			trans	-81.4	161.9	171.2	66.4	0	0	0	0	111	C114 D119 K120 G133 C134 K135 R163	C114-C131 HydrophobicContact CB-CB 3.93Å; C114-C131 PolarHBondContact SG-N 3.07Å; D119-C131 HydrophobicContact CB-CB 4.14Å; K120-C131 WeakPolarHBondContact O-CB 3.28Å; C131-G133 PolarHBondContact O-N 2.89Å; C131-G133 VanDerWaalsContact O-N 3.14Å; C131-C134 PolarHBondContact O-N 3.25Å; C131-C134 VanDerWaalsContact O-N 3.15Å; C131-C134 PolarHBondContact SG-N 3.09Å; C131-C134 VanDerWaalsContact SG-N 3.44Å; C131-K135 PolarHBondContact O-N 3.22Å; C131-R163 PolarHBondContact SG-NH1 2.91Å
132	E	97.3	Very high	95.7	Very high	100 Å²	100	41.7 Å²	41.7	47%	0.467	21%	0.214	S	C	.	.	H	α-helix	trans	-56.4	-32	175.9	-70.8	-57.4	127.3	0	0	113	S122 H125 K135 G136	S122-E132 WeakPolarHBondContact CB-OE1 3.34Å; S122-E132 PolarHBondContact OG-OE1 2.85Å; H125-E132 IonicContact CE1-OE1 2.62Å; H125-E132 IonicContact NE2-OE1 3.88Å; H125-E132 PolarHBondContact NE2-OE1 3.12Å; E132-K135 IonicContact OE1-NZ 3.69Å; E132-K135 PolarHBondContact OE1-NZ 3.12Å; E132-K135 VanDerWaalsContact OE1-NZ 3.07Å; E132-K135 WeakPolarHBondContact OE2-CD 3.26Å; E132-K135 IonicContact OE2-NZ 3.43Å; E132-K135 PolarHBondContact OE2-NZ 2.84Å; E132-G136 PolarHBondContact O-N 2.95Å
133	G	97.4	Very high	95.5	Very high	28 Å²	28	42.4 Å²	42.4	29%	0.289	21%	0.207	S	C	.	.	H	α-helix	trans	-64.3	-44.3	177.8	0	0	0	0	0	113.3	C131 F137 R170	C131-G133 PolarHBondContact O-N 2.89Å; C131-G133 VanDerWaalsContact O-N 3.14Å; G133-F137 VanDerWaalsContact O-CB 3.27Å; G133-F137 WeakPolarHBondContact O-CB 3.45Å; G133-F137 PolarHBondContact O-N 3.24Å; G133-F137 VanDerWaalsContact O-N 3.14Å; G133-R170 PolarHBondContact O-NH2 3.2Å
134	C	97.9	Very high	95.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-77.5	-34.8	178.7	-70.4	0	0	0	0	112.1	V116 C117 C131 F137 F138	V116-C134 HydrophobicContact CB-CB 4.32Å; V116-C134 HydrophobicContact CG1-CB 4.46Å; C117-C134 VanDerWaalsContact SG-SG 3.63Å; C131-C134 PolarHBondContact O-N 3.25Å; C131-C134 VanDerWaalsContact O-N 3.15Å; C131-C134 PolarHBondContact SG-N 3.09Å; C131-C134 VanDerWaalsContact SG-N 3.44Å; C134-F137 PolarHBondContact O-N 3.34Å; C134-F138 VanDerWaalsContact O-CB 3.31Å; C134-F138 WeakPolarHBondContact O-CB 3.39Å; C134-F138 PolarHBondContact O-N 2.88Å
135	K	97.6	Very high	95.2	Very high	57 Å²	57	47.3 Å²	47.3	25%	0.248	23%	0.233	C	C	.	.	H	α-helix	trans	-54.6	-55.5	169.4	174	-161.3	-171.3	179.2	0	111.8	H125 Y126 C131 E132 F137 F138 K139	H125-K135 HydrophobicContact CB-CB 4.01Å; H125-K135 HydrophobicContact CB-CD 4.37Å; H125-K135 HydrophobicContact CB-CG 3.84Å; H125-K135 WeakPolarHBondContact ND1-CD 3.32Å; H125-K135 VanDerWaalsContact ND1-CE 3.33Å; H125-K135 WeakPolarHBondContact ND1-CE 3.45Å; Y126-K135 HydrophobicContact CE2-CG 3.79Å; C131-K135 PolarHBondContact O-N 3.22Å; E132-K135 IonicContact OE1-NZ 3.69Å; E132-K135 PolarHBondContact OE1-NZ 3.12Å; E132-K135 VanDerWaalsContact OE1-NZ 3.07Å; E132-K135 WeakPolarHBondContact OE2-CD 3.26Å; E132-K135 IonicContact OE2-NZ 3.43Å; E132-K135 PolarHBondContact OE2-NZ 2.84Å; K135-F137 PolarHBondContact O-N 2.95Å; K135-F138 PolarHBondContact O-N 3.32Å; K135-K139 WeakPolarHBondContact O-CB 3.33Å; K135-K139 PolarHBondContact O-N 3.1Å
136	G	97.1	Very high	95.1	Very high	18 Å²	18	49 Å²	49	19%	0.186	24%	0.243	C	C	.	.	H	α-helix	trans	-65.8	-38.1	-178.5	0	0	0	0	0	112.9	E132 R140	E132-G136 PolarHBondContact O-N 2.95Å; G136-R140 WeakPolarHBondContact O-CG 3.44Å; G136-R140 PolarHBondContact O-N 2.92Å; G136-R140 VanDerWaalsContact O-N 3.09Å; G136-R140 PolarHBondContact O-NH1 3.09Å
137	F	98.3	Very high	94.9	Very high	7 Å²	7	53.1 Å²	53.1	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-61.8	-48.2	175.3	171.9	-99.5	0	0	0	112.1	G133 C134 K135 R140 S141 Y148 Q167 R170 L171	G133-F137 VanDerWaalsContact O-CB 3.27Å; G133-F137 WeakPolarHBondContact O-CB 3.45Å; G133-F137 PolarHBondContact O-N 3.24Å; G133-F137 VanDerWaalsContact O-N 3.14Å; C134-F137 PolarHBondContact O-N 3.34Å; K135-F137 PolarHBondContact O-N 2.95Å; F137-R140 PolarHBondContact O-N 3.5Å; F137-S141 WeakPolarHBondContact O-CB 3.07Å; F137-S141 PolarHBondContact O-N 3.2Å; F137-S141 PolarHBondContact O-OG 3.05Å; F137-Y148 HydrophobicContact CE2-CE2 4.08Å; F137-Y148 HydrophobicContact CZ-CD2 4.49Å; F137-Y148 AromaticContact CZ-CE2 3.81Å; F137-Y148 HydrophobicContact CZ-CE2 3.81Å; F137-Q167 HydrophobicContact CE2-CB 4.12Å; F137-Q167 HydrophobicContact CE2-CG 4.14Å; F137-Q167 HydrophobicContact CZ-CB 4.18Å; F137-Q167 WeakPolarHBondContact CZ-O 3.32Å; F137-R170 HydrophobicContact CD1-CG 3.97Å; F137-R170 HydrophobicContact CE1-CB 3.96Å; F137-R170 HydrophobicContact CE1-CG 3.74Å; F137-R170 HydrophobicContact CZ-CB 4.15Å; F137-R170 HydrophobicContact CZ-CG 4.3Å; F137-L171 HydrophobicContact CE1-CB 3.84Å; F137-L171 HydrophobicContact CE1-CD1 4.23Å; F137-L171 HydrophobicContact CZ-CB 4.01Å
138	F	97.8	Very high	95.2	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.3	-48.2	178	-170.7	-100.6	0	0	0	111.2	Y126 C134 K135 R140 S141 I142 L171 C174 I175 M179 K180 V184	Y126-F138 AromaticContact CD2-CD1 3.8Å; Y126-F138 HydrophobicContact CD2-CD1 3.8Å; Y126-F138 HydrophobicContact CE2-CD1 4.4Å; Y126-F138 AromaticContact CG-CD1 3.98Å; Y126-F138 HydrophobicContact CG-CD1 3.98Å; Y126-F138 HydrophobicContact CG-CE1 4.25Å; C134-F138 VanDerWaalsContact O-CB 3.31Å; C134-F138 WeakPolarHBondContact O-CB 3.39Å; C134-F138 PolarHBondContact O-N 2.88Å; K135-F138 PolarHBondContact O-N 3.32Å; F138-R140 VanDerWaalsContact C-N 3.34Å; F138-R140 PolarHBondContact O-N 3.09Å; F138-S141 PolarHBondContact O-N 3.49Å; F138-S141 VanDerWaalsContact O-N 3.17Å; F138-I142 HydrophobicContact CD1-CG1 4.17Å; F138-I142 HydrophobicContact CD2-CG1 4.44Å; F138-I142 HydrophobicContact CE1-CG1 3.87Å; F138-I142 HydrophobicContact CE2-CD1 4.26Å; F138-I142 HydrophobicContact CE2-CG1 4.16Å; F138-I142 HydrophobicContact CG-CG1 4.45Å; F138-I142 HydrophobicContact CZ-CD1 4.19Å; F138-I142 HydrophobicContact CZ-CG1 3.87Å; F138-I142 WeakPolarHBondContact O-CG1 3.31Å; F138-I142 PolarHBondContact O-N 2.55Å; F138-L171 HydrophobicContact CD2-CD1 3.93Å; F138-L171 HydrophobicContact CE2-CD1 4.27Å; F138-C174 HydrophobicContact CD2-CB 3.53Å; F138-C174 HydrophobicContact CE2-CB 4.01Å; F138-C174 HydrophobicContact CG-CB 4.49Å; F138-I175 HydrophobicContact CE2-CG1 3.96Å; F138-M179 HydrophobicContact CB-CE 3.5Å; F138-M179 VanDerWaalsContact CB-CE 3.5Å; F138-M179 HydrophobicContact CB-SD 4.08Å; F138-M179 HydrophobicContact CD1-CB 4.18Å; F138-M179 HydrophobicContact CD1-CE 3.77Å; F138-M179 HydrophobicContact CD2-CB 3.94Å; F138-M179 HydrophobicContact CD2-CE 4.28Å; F138-M179 HydrophobicContact CD2-SD 4.13Å; F138-M179 HydrophobicContact CE1-CB 3.91Å; F138-M179 HydrophobicContact CE2-CB 3.65Å; F138-M179 HydrophobicContact CG-CB 4.19Å; F138-M179 HydrophobicContact CG-CE 3.59Å; F138-M179 HydrophobicContact CG-SD 4.02Å; F138-M179 HydrophobicContact CZ-CB 3.63Å; F138-M179 VanDerWaalsContact CZ-O 3.26Å; F138-M179 WeakPolarHBondContact CZ-O 3.45Å; F138-K180 WeakPolarHBondContact CE1-O 3.08Å; F138-V184 HydrophobicContact CD1-CG2 3.94Å; F138-V184 HydrophobicContact CE1-CG2 3.74Å
139	K	96.4	Very high	95.3	Very high	87 Å²	87	58.6 Å²	58.6	38%	0.378	30%	0.301	S	S	.	.	H	α-helix	trans	-51.7	-48.5	176.4	-170.8	-173	178.7	-177.8	0	112.9	Y126 K135 R143 V184	Y126-K139 HydrophobicContact CE2-CB 4.23Å; Y126-K139 WeakPolarHBondContact OH-CB 3.33Å; Y126-K139 WeakPolarHBondContact OH-CD 3.46Å; Y126-K139 WeakPolarHBondContact OH-CG 3.49Å; K135-K139 WeakPolarHBondContact O-CB 3.33Å; K135-K139 PolarHBondContact O-N 3.1Å; K139-R143 WeakPolarHBondContact O-CB 3.41Å; K139-R143 WeakPolarHBondContact O-CG 3.44Å; K139-R143 PolarHBondContact O-N 2.71Å; K139-R143 VanDerWaalsContact O-N 3.07Å; K139-V184 HydrophobicContact CG-CG1 4.33Å
140	R	96.6	Very high	95.5	Very high	142 Å²	142	58.1 Å²	58.1	54%	0.536	30%	0.299	S	S	.	.	H	α-helix	trans	-69.9	-39.2	-179.2	-72.5	-171.3	-58.8	-88.6	2	112.3	G136 F137 F138 K144	G136-R140 WeakPolarHBondContact O-CG 3.44Å; G136-R140 PolarHBondContact O-N 2.92Å; G136-R140 VanDerWaalsContact O-N 3.09Å; G136-R140 PolarHBondContact O-NH1 3.09Å; F137-R140 PolarHBondContact O-N 3.5Å; F138-R140 VanDerWaalsContact C-N 3.34Å; F138-R140 PolarHBondContact O-N 3.09Å; R140-K144 WeakPolarHBondContact O-CB 3.4Å; R140-K144 PolarHBondContact O-N 2.81Å
141	S	96.8	Very high	95.4	Very high	2 Å²	2	70.3 Å²	70.3	1%	0.014	35%	0.345	C	S	.	.	H	α-helix	trans	-66.1	-43.4	-178.6	-54.5	0	0	0	0	111.2	F137 F138 N145 L146 Y148	F137-S141 WeakPolarHBondContact O-CB 3.07Å; F137-S141 PolarHBondContact O-N 3.2Å; F137-S141 PolarHBondContact O-OG 3.05Å; F138-S141 PolarHBondContact O-N 3.49Å; F138-S141 VanDerWaalsContact O-N 3.17Å; S141-N145 PolarHBondContact O-N 2.89Å; S141-L146 PolarHBondContact O-N 3.14Å; S141-Y148 WeakPolarHBondContact OG-CE2 3.4Å; S141-Y148 PolarHBondContact OG-OH 2.92Å
142	I	95.6	Very high	95.2	Very high	42 Å²	42	72.4 Å²	72.4	22%	0.215	37%	0.367	C	S	.	.	H	α-helix	trans	-72.3	-46.8	177.9	-57.9	-54.2	0	0	0	111.8	F138 K144 N145 Q181 V184	F138-I142 HydrophobicContact CD1-CG1 4.17Å; F138-I142 HydrophobicContact CD2-CG1 4.44Å; F138-I142 HydrophobicContact CE1-CG1 3.87Å; F138-I142 HydrophobicContact CE2-CD1 4.26Å; F138-I142 HydrophobicContact CE2-CG1 4.16Å; F138-I142 HydrophobicContact CG-CG1 4.45Å; F138-I142 HydrophobicContact CZ-CD1 4.19Å; F138-I142 HydrophobicContact CZ-CG1 3.87Å; F138-I142 WeakPolarHBondContact O-CG1 3.31Å; F138-I142 PolarHBondContact O-N 2.55Å; I142-K144 VanDerWaalsContact C-N 3.31Å; I142-K144 PolarHBondContact O-N 3.07Å; I142-N145 PolarHBondContact O-N 3.36Å; I142-N145 VanDerWaalsContact O-N 3.15Å; I142-Q181 HydrophobicContact CD1-CB 3.9Å; I142-Q181 HydrophobicContact CG1-CB 4.22Å; I142-Q181 HydrophobicContact CG2-CB 4.07Å; I142-V184 HydrophobicContact CB-CB 4.3Å; I142-V184 HydrophobicContact CB-CG1 4.27Å; I142-V184 HydrophobicContact CB-CG2 4.1Å; I142-V184 HydrophobicContact CG1-CG2 4.27Å; I142-V184 HydrophobicContact CG2-CB 3.93Å; I142-V184 HydrophobicContact CG2-CG1 4.22Å; I142-V184 HydrophobicContact CG2-CG2 4.11Å
143	R	90.7	Very high	95	Very high	79 Å²	79	72 Å²	72	30%	0.298	38%	0.376	S	S	.	.	H	α-helix	trans	-58.8	-39.5	-178.6	-88.4	-175.1	168.1	61.1	1.1	114.3	K139 N145 V184 Q185	K139-R143 WeakPolarHBondContact O-CB 3.41Å; K139-R143 WeakPolarHBondContact O-CG 3.44Å; K139-R143 PolarHBondContact O-N 2.71Å; K139-R143 VanDerWaalsContact O-N 3.07Å; R143-N145 VanDerWaalsContact C-N 3.33Å; R143-V184 HydrophobicContact CG-CG1 4.02Å; R143-Q185 PolarHBondContact NH1-O 3.34Å; R143-Q185 PolarHBondContact NH2-O 3.02Å
144	K	90.2	Very high	94.8	Very high	151 Å²	151	77.4 Å²	77.4	66%	0.657	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	9.9	-176.7	-66.6	-172	175.5	-162.1	0	112.4	R140 I142 L146	R140-K144 WeakPolarHBondContact O-CB 3.4Å; R140-K144 PolarHBondContact O-N 2.81Å; I142-K144 VanDerWaalsContact C-N 3.31Å; I142-K144 PolarHBondContact O-N 3.07Å; K144-L146 HydrophobicContact CB-CD1 4.25Å; K144-L146 HydrophobicContact CB-CD2 3.82Å; K144-L146 HydrophobicContact CB-CG 3.72Å; K144-L146 PolarHBondContact O-N 3.14Å; K144-L146 VanDerWaalsContact O-N 3.14Å
145	N	89.1	Confident	94.6	Very high	139 Å²	139	82.9 Å²	82.9	74%	0.743	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.4	47.3	-174.7	-160.5	9.5	0	0	0	112.8	S141 I142 R143 V147	S141-N145 PolarHBondContact O-N 2.89Å; I142-N145 PolarHBondContact O-N 3.36Å; I142-N145 VanDerWaalsContact O-N 3.15Å; R143-N145 VanDerWaalsContact C-N 3.33Å; N145-V147 PolarHBondContact O-N 3.34Å
146	L	93	Very high	94.4	Very high	67 Å²	67	82 Å²	82	35%	0.351	42%	0.421	S	S	.	.			trans	-75.9	121.2	-172.6	-63	177.8	0	0	0	110.6	S141 K144 Y148	S141-L146 PolarHBondContact O-N 3.14Å; K144-L146 HydrophobicContact CB-CD1 4.25Å; K144-L146 HydrophobicContact CB-CD2 3.82Å; K144-L146 HydrophobicContact CB-CG 3.72Å; K144-L146 PolarHBondContact O-N 3.14Å; K144-L146 VanDerWaalsContact O-N 3.14Å; L146-Y148 HydrophobicContact CB-CE1 4.18Å; L146-Y148 HydrophobicContact CB-CE2 4.23Å; L146-Y148 HydrophobicContact CD1-CE1 4.39Å; L146-Y148 VanDerWaalsContact CD1-OH 3.29Å; L146-Y148 WeakPolarHBondContact CD1-OH 3.46Å
147	V	91.9	Very high	94.2	Very high	131 Å²	131	87.6 Å²	87.6	79%	0.794	45%	0.445	S	S	*	.			trans	-94	122.6	171.2	-175.4	0	0	0	0	108.9	N145	N145-V147 PolarHBondContact O-N 3.34Å
148	Y	96.1	Very high	94.1	Very high	36 Å²	36	87.9 Å²	87.9	14%	0.141	45%	0.447	C	S	.	.			trans	-107.3	149.6	176.1	-56.7	-65.9	0	0	0	110.6	F137 S141 L146 Q167 Y168 L171	F137-Y148 HydrophobicContact CE2-CE2 4.08Å; F137-Y148 HydrophobicContact CZ-CD2 4.49Å; F137-Y148 AromaticContact CZ-CE2 3.81Å; F137-Y148 HydrophobicContact CZ-CE2 3.81Å; S141-Y148 WeakPolarHBondContact OG-CE2 3.4Å; S141-Y148 PolarHBondContact OG-OH 2.92Å; L146-Y148 HydrophobicContact CB-CE1 4.18Å; L146-Y148 HydrophobicContact CB-CE2 4.23Å; L146-Y148 HydrophobicContact CD1-CE1 4.39Å; L146-Y148 VanDerWaalsContact CD1-OH 3.29Å; L146-Y148 WeakPolarHBondContact CD1-OH 3.46Å; Y148-Q167 HydrophobicContact CD1-CB 3.55Å; Y148-Q167 HydrophobicContact CD1-CG 4.34Å; Y148-Q167 HydrophobicContact CD2-CB 3.92Å; Y148-Q167 HydrophobicContact CE1-CB 3.78Å; Y148-Q167 HydrophobicContact CE1-CG 4.22Å; Y148-Q167 HydrophobicContact CE2-CB 4.12Å; Y148-Q167 HydrophobicContact CG-CB 3.62Å; Y148-Y168 WeakPolarHBondContact O-CD2 3.43Å; Y148-L171 HydrophobicContact CD2-CB 4.22Å; Y148-L171 HydrophobicContact CD2-CD2 3.82Å; Y148-L171 HydrophobicContact CE2-CB 4.39Å; Y148-L171 HydrophobicContact CE2-CD2 3.92Å
149	S	94.9	Very high	93.8	Very high	107 Å²	107	90.4 Å²	90.4	75%	0.748	46%	0.46	S	S	*	.			trans	-113.3	133.8	171.9	-62.6	0	0	0	0	110.5
150	C	96.8	Very high	93.6	Very high	25 Å²	25	91.5 Å²	91.5	17%	0.169	47%	0.465	C	S	.	.			trans	-76	136.9	171.4	-166.7	0	0	0	0	110	G152 K154 C156 Y168	C150-G152 PolarHBondContact SG-N 3Å; C150-G152 VanDerWaalsContact SG-N 3.36Å; C150-K154 HydrophobicContact CB-CG 3.85Å; C150-C156 VanDerWaalsContact SG-SG 3.69Å; C150-Y168 HydrophobicContact CB-CD1 3.59Å; C150-Y168 HydrophobicContact CB-CE1 4.26Å; C150-Y168 HydrophobicContact CB-CG 4.01Å
151	R	94.8	Very high	93.4	Very high	256 Å²	256	91.7 Å²	91.7	97%	0.966	47%	0.472	S	S	*	.	S	Bend	trans	-91.5	0.8	173.3	-61	-176.7	-177.6	174.8	-0.3	113.5
152	G	92.1	Very high	93.2	Very high	47 Å²	47	97 Å²	97	49%	0.485	50%	0.496	S	S	.	.	S	Bend	trans	-129.7	-153.6	176.8	0	0	0	0	0	111.3	C150 K154	C150-G152 PolarHBondContact SG-N 3Å; C150-G152 VanDerWaalsContact SG-N 3.36Å; G152-K154 PolarHBondContact O-N 3.13Å; G152-K154 VanDerWaalsContact O-N 3.07Å
153	S	93.4	Very high	93.1	Very high	92 Å²	92	96.9 Å²	96.9	64%	0.643	49%	0.493	S	S	*	.	S	Bend	trans	-79	21.1	-174.1	35	0	0	0	0	115.8	D155	S153-D155 VanDerWaalsContact CB-OD1 3.3Å; S153-D155 WeakPolarHBondContact CB-OD1 2.97Å; S153-D155 PolarHBondContact O-N 2.9Å; S153-D155 VanDerWaalsContact O-N 3.14Å; S153-D155 PolarHBondContact OG-OD1 3.06Å
154	K	93.3	Very high	93.3	Very high	140 Å²	140	98.8 Å²	98.8	61%	0.609	51%	0.509	S	S	*	.	S	Bend	trans	61	13.4	-178.9	-62.7	-179	175.8	179.5	0	115.8	C150 G152 Y168 C169	C150-K154 HydrophobicContact CB-CG 3.85Å; G152-K154 PolarHBondContact O-N 3.13Å; G152-K154 VanDerWaalsContact O-N 3.07Å; K154-Y168 HydrophobicContact CB-CE1 3.85Å; K154-Y168 HydrophobicContact CD-CE1 3.82Å; K154-Y168 HydrophobicContact CG-CD1 4.25Å; K154-Y168 HydrophobicContact CG-CE1 3.59Å; K154-C169 PolarHBondContact O-SG 2.7Å
155	D	93.4	Very high	93.6	Very high	115 Å²	115	102.2 Å²	102.2	62%	0.615	52%	0.518	S	S	*	.			trans	-120.5	22.9	-177.5	64.1	-20.7	0	0	0	112.9	S153 I157	S153-D155 VanDerWaalsContact CB-OD1 3.3Å; S153-D155 WeakPolarHBondContact CB-OD1 2.97Å; S153-D155 PolarHBondContact O-N 2.9Å; S153-D155 VanDerWaalsContact O-N 3.14Å; S153-D155 PolarHBondContact OG-OD1 3.06Å; D155-I157 PolarHBondContact O-N 2.98Å
156	C	94.4	Very high	94	Very high	39 Å²	39	96.2 Å²	96.2	26%	0.264	49%	0.487	S	S	.	.			trans	-57.9	133.5	-176.6	-56.3	0	0	0	0	112.4	C150 I158 C166 C169	C150-C156 VanDerWaalsContact SG-SG 3.69Å; C156-I158 PolarHBondContact O-N 3.44Å; C156-C166 HydrophobicContact CB-CB 3.85Å; C156-C169 HydrophobicContact CB-CB 3.88Å; C156-C169 PolarHBondContact N-SG 3.45Å
157	I	92.5	Very high	94.2	Very high	136 Å²	136	97.9 Å²	97.9	70%	0.697	49%	0.493	S	S	*	.			trans	-64.9	126.3	177.9	-59.7	173.3	0	0	0	110.3	D155	D155-I157 PolarHBondContact O-N 2.98Å
158	I	95.5	Very high	94.5	Very high	12 Å²	12	94.1 Å²	94.1	6%	0.062	46%	0.464	C	S	.	.			trans	-109.4	108.4	177.7	-54.2	-56.8	0	0	0	109.3	V116 C117 C156 R163 C169 R170	V116-I158 HydrophobicContact CG1-CG2 4.28Å; V116-I158 WeakPolarHBondContact O-CG2 3.06Å; C117-I158 HydrophobicContact CB-CG2 4.04Å; C156-I158 PolarHBondContact O-N 3.44Å; I158-R163 HydrophobicContact CG2-CB 3.83Å; I158-C169 HydrophobicContact CD1-CB 4.09Å; I158-C169 HydrophobicContact CG1-CB 4.48Å; I158-R170 HydrophobicContact CD1-CB 3.99Å; I158-R170 HydrophobicContact CG1-CB 4.5Å; I158-R170 HydrophobicContact CG2-CG 4.2Å
159	N	93.1	Very high	94.6	Very high	53 Å²	53	92.8 Å²	92.8	28%	0.283	46%	0.461	S	S	.	.			trans	-132.2	176.1	174.3	66.8	22.6	0	0	0	110.7	C117 H161 H162 R163	C117-N159 CarbonylContact O-C 3.58Å; C117-N159 VanDerWaalsContact O-C 3.31Å; C117-N159 WeakPolarHBondContact O-CA 3.3Å; N159-H161 PolarHBondContact O-N 3.47Å; N159-H161 VanDerWaalsContact O-N 3.16Å; N159-H161 PolarHBondContact OD1-N 3.44Å; N159-H162 PolarHBondContact ND2-CD2 3.42Å; N159-H162 PolarHBondContact O-N 3.03Å; N159-H162 WeakPolarHBondContact OD1-CB 3.31Å; N159-H162 PolarHBondContact OD1-CD2 2.9Å; N159-H162 PolarHBondContact OD1-N 3.36Å; N159-R163 WeakPolarHBondContact O-CA 3.47Å; N159-R163 WeakPolarHBondContact O-CB 3.43Å; N159-R163 WeakPolarHBondContact O-CG 3.2Å; N159-R163 PolarHBondContact O-N 3.15Å
160	K	92.2	Very high	94.7	Very high	110 Å²	110	88.1 Å²	88.1	48%	0.478	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-41.1	-178.5	-179.7	178.9	-179.4	170.5	0	113.5	C117 D119	C117-K160 PolarHBondContact O-N 2.84Å; D119-K160 HydrophobicContact CB-CB 4.26Å; D119-K160 HydrophobicContact CB-CD 4.34Å; D119-K160 HydrophobicContact CB-CG 4.11Å; D119-K160 WeakPolarHBondContact OD1-CD 3.45Å; D119-K160 VanDerWaalsContact OD1-CE 3.23Å; D119-K160 WeakPolarHBondContact OD1-CE 3.49Å; D119-K160 IonicContact OD1-NZ 3.97Å; D119-K160 PolarHBondContact OD1-NZ 3.3Å
161	H	92.8	Very high	94.8	Very high	146 Å²	146	87.8 Å²	87.8	68%	0.676	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-35.7	-173.5	-58.9	-74.9	0	0	0	113.1	N159	N159-H161 PolarHBondContact O-N 3.47Å; N159-H161 VanDerWaalsContact O-N 3.16Å; N159-H161 PolarHBondContact OD1-N 3.44Å
162	H	90.9	Very high	94.9	Very high	113 Å²	113	79.6 Å²	79.6	52%	0.523	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114	6.1	-170.8	-51.2	-50.3	0	0	0	113.7	N159 N164 R165	N159-H162 PolarHBondContact ND2-CD2 3.42Å; N159-H162 PolarHBondContact O-N 3.03Å; N159-H162 WeakPolarHBondContact OD1-CB 3.31Å; N159-H162 PolarHBondContact OD1-CD2 2.9Å; N159-H162 PolarHBondContact OD1-N 3.36Å; H162-N164 PolarHBondContact O-N 3.28Å; H162-R165 VanDerWaalsContact O-CB 3.22Å; H162-R165 WeakPolarHBondContact O-CB 3.5Å; H162-R165 PolarHBondContact O-N 3.13Å
163	R	94.5	Very high	95.1	Very high	40 Å²	40	82 Å²	82	15%	0.151	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-21.5	175	60	-170.6	-174	-164.6	-6.1	114.4	C117 D119 C131 I158 N159 R170	C117-R163 HydrophobicContact CB-CB 4.25Å; C117-R163 PolarHBondContact SG-NH1 3.4Å; D119-R163 IonicContact OD2-CZ 2.67Å; D119-R163 IonicContact OD2-NH1 3.5Å; D119-R163 PolarHBondContact OD2-NH1 3Å; D119-R163 IonicContact OD2-NH2 3.38Å; D119-R163 PolarHBondContact OD2-NH2 2.83Å; C131-R163 PolarHBondContact SG-NH1 2.91Å; I158-R163 HydrophobicContact CG2-CB 3.83Å; N159-R163 WeakPolarHBondContact O-CA 3.47Å; N159-R163 WeakPolarHBondContact O-CB 3.43Å; N159-R163 WeakPolarHBondContact O-CG 3.2Å; N159-R163 PolarHBondContact O-N 3.15Å; R163-R170 VanDerWaalsContact O-CD 3.31Å; R163-R170 WeakPolarHBondContact O-CD 3.4Å
164	N	95.5	Very high	95.3	Very high	119 Å²	119	77.6 Å²	77.6	64%	0.636	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-5.6	177.7	-63.9	-23.8	0	0	0	113.6	H162 R170	H162-N164 PolarHBondContact O-N 3.28Å; N164-R170 PolarHBondContact OD1-NH1 3.18Å
165	R	95.7	Very high	95.4	Very high	224 Å²	224	74.4 Å²	74.4	85%	0.845	35%	0.348	S	S	*	.	S	Bend	trans	-69.4	-37.3	-176.8	-179.3	59.5	172.6	-174.8	-1.4	112.9	H162	H162-R165 VanDerWaalsContact O-CB 3.22Å; H162-R165 WeakPolarHBondContact O-CB 3.5Å; H162-R165 PolarHBondContact O-N 3.13Å
166	C	97.3	Very high	95.5	Very high	12 Å²	12	73 Å²	73	8%	0.081	35%	0.352	C	S	.	.			trans	-137.5	106.7	179.1	-175.6	0	0	0	0	110.3	C156 C169 R170	C156-C166 HydrophobicContact CB-CB 3.85Å; C166-C169 HydrophobicContact CB-CB 4.28Å; C166-C169 PolarHBondContact SG-N 3.33Å; C166-C169 VanDerWaalsContact SG-SG 3.64Å; C166-R170 WeakPolarHBondContact O-CB 3.45Å; C166-R170 PolarHBondContact O-N 3.11Å
167	Q	97.8	Very high	95.4	Very high	102 Å²	102	75 Å²	75	48%	0.477	36%	0.357	S	S	.	.	H	α-helix	trans	-69.3	-34.6	179.9	-65.5	168.5	-62.1	0	0	111.8	F137 Y148 R170 L171	F137-Q167 HydrophobicContact CE2-CB 4.12Å; F137-Q167 HydrophobicContact CE2-CG 4.14Å; F137-Q167 HydrophobicContact CZ-CB 4.18Å; F137-Q167 WeakPolarHBondContact CZ-O 3.32Å; Y148-Q167 HydrophobicContact CD1-CB 3.55Å; Y148-Q167 HydrophobicContact CD1-CG 4.34Å; Y148-Q167 HydrophobicContact CD2-CB 3.92Å; Y148-Q167 HydrophobicContact CE1-CB 3.78Å; Y148-Q167 HydrophobicContact CE1-CG 4.22Å; Y148-Q167 HydrophobicContact CE2-CB 4.12Å; Y148-Q167 HydrophobicContact CG-CB 3.62Å; Q167-R170 PolarHBondContact O-N 3.04Å; Q167-L171 WeakPolarHBondContact O-CB 3.14Å; Q167-L171 PolarHBondContact O-N 3.14Å
168	Y	98.2	Very high	95.3	Very high	52 Å²	52	70.2 Å²	70.2	20%	0.204	34%	0.341	C	S	.	.	H	α-helix	trans	-58.5	-59.9	175.4	176.5	-95.2	0	0	0	111.5	Y148 C150 K154 R170 L171 Q172	Y148-Y168 WeakPolarHBondContact O-CD2 3.43Å; C150-Y168 HydrophobicContact CB-CD1 3.59Å; C150-Y168 HydrophobicContact CB-CE1 4.26Å; C150-Y168 HydrophobicContact CB-CG 4.01Å; K154-Y168 HydrophobicContact CB-CE1 3.85Å; K154-Y168 HydrophobicContact CD-CE1 3.82Å; K154-Y168 HydrophobicContact CG-CD1 4.25Å; K154-Y168 HydrophobicContact CG-CE1 3.59Å; Y168-R170 PolarHBondContact O-N 3.04Å; Y168-L171 PolarHBondContact O-N 2.85Å; Y168-L171 VanDerWaalsContact O-N 3.1Å; Y168-Q172 HydrophobicContact CD1-CG 4.17Å; Y168-Q172 HydrophobicContact CD2-CG 4.28Å; Y168-Q172 HydrophobicContact CE1-CG 3.83Å; Y168-Q172 HydrophobicContact CE2-CG 3.98Å; Y168-Q172 HydrophobicContact CG-CG 4.42Å; Y168-Q172 WeakPolarHBondContact O-CG 3.43Å; Y168-Q172 PolarHBondContact O-N 3.27Å
169	C	97.3	Very high	95.4	Very high	9 Å²	9	69.9 Å²	69.9	6%	0.061	34%	0.339	C	S	.	.	H	α-helix	trans	-62.1	-32.8	-178.6	-66	0	0	0	0	111.9	K154 C156 I158 C166 R173	K154-C169 PolarHBondContact O-SG 2.7Å; C156-C169 HydrophobicContact CB-CB 3.88Å; C156-C169 PolarHBondContact N-SG 3.45Å; I158-C169 HydrophobicContact CD1-CB 4.09Å; I158-C169 HydrophobicContact CG1-CB 4.48Å; C166-C169 HydrophobicContact CB-CB 4.28Å; C166-C169 PolarHBondContact SG-N 3.33Å; C166-C169 VanDerWaalsContact SG-SG 3.64Å; C169-R173 WeakPolarHBondContact O-CB 3.31Å; C169-R173 PolarHBondContact O-N 3.16Å
170	R	98	Very high	95.4	Very high	9 Å²	9	73 Å²	73	3%	0.034	35%	0.35	C	S	.	.	H	α-helix	trans	-65.3	-45.6	174.1	-169	-169.2	-171.5	165.5	-2.7	112.4	V116 G133 F137 I158 R163 N164 C166 Q167 Y168 R173 C174	V116-R170 HydrophobicContact CG1-CG 4.47Å; G133-R170 PolarHBondContact O-NH2 3.2Å; F137-R170 HydrophobicContact CD1-CG 3.97Å; F137-R170 HydrophobicContact CE1-CB 3.96Å; F137-R170 HydrophobicContact CE1-CG 3.74Å; F137-R170 HydrophobicContact CZ-CB 4.15Å; F137-R170 HydrophobicContact CZ-CG 4.3Å; I158-R170 HydrophobicContact CD1-CB 3.99Å; I158-R170 HydrophobicContact CG1-CB 4.5Å; I158-R170 HydrophobicContact CG2-CG 4.2Å; R163-R170 VanDerWaalsContact O-CD 3.31Å; R163-R170 WeakPolarHBondContact O-CD 3.4Å; N164-R170 PolarHBondContact OD1-NH1 3.18Å; C166-R170 WeakPolarHBondContact O-CB 3.45Å; C166-R170 PolarHBondContact O-N 3.11Å; Q167-R170 PolarHBondContact O-N 3.04Å; Y168-R170 PolarHBondContact O-N 3.04Å; R170-R173 PolarHBondContact O-N 3.39Å; R170-C174 PolarHBondContact O-N 3.34Å; R170-C174 PolarHBondContact O-SG 3.15Å; R170-C174 VanDerWaalsContact O-SG 3.36Å
171	L	97.9	Very high	95.4	Very high	17 Å²	17	74 Å²	74	9%	0.089	36%	0.356	C	S	.	.	H	α-helix	trans	-67	-44.6	179.5	-177.7	62.4	0	0	0	111.2	F137 F138 Y148 Q167 Y168 R173 C174 I175	F137-L171 HydrophobicContact CE1-CB 3.84Å; F137-L171 HydrophobicContact CE1-CD1 4.23Å; F137-L171 HydrophobicContact CZ-CB 4.01Å; F138-L171 HydrophobicContact CD2-CD1 3.93Å; F138-L171 HydrophobicContact CE2-CD1 4.27Å; Y148-L171 HydrophobicContact CD2-CB 4.22Å; Y148-L171 HydrophobicContact CD2-CD2 3.82Å; Y148-L171 HydrophobicContact CE2-CB 4.39Å; Y148-L171 HydrophobicContact CE2-CD2 3.92Å; Q167-L171 WeakPolarHBondContact O-CB 3.14Å; Q167-L171 PolarHBondContact O-N 3.14Å; Y168-L171 PolarHBondContact O-N 2.85Å; Y168-L171 VanDerWaalsContact O-N 3.1Å; L171-R173 VanDerWaalsContact C-N 3.26Å; L171-R173 PolarHBondContact O-N 3.12Å; L171-C174 WeakPolarHBondContact O-CB 3.28Å; L171-C174 PolarHBondContact O-N 2.92Å; L171-C174 VanDerWaalsContact O-N 3.11Å; L171-I175 HydrophobicContact CG-CD1 4.31Å; L171-I175 WeakPolarHBondContact O-CG1 3.46Å; L171-I175 PolarHBondContact O-N 3.46Å; L171-I175 VanDerWaalsContact O-N 3.1Å
172	Q	97.3	Very high	95.3	Very high	85 Å²	85	72.8 Å²	72.8	40%	0.397	36%	0.355	S	S	.	.	H	α-helix	trans	-58.7	-41.5	174.8	-66.4	-53.7	-43	0	0	111.2	Y168 I175 A176	Y168-Q172 HydrophobicContact CD1-CG 4.17Å; Y168-Q172 HydrophobicContact CD2-CG 4.28Å; Y168-Q172 HydrophobicContact CE1-CG 3.83Å; Y168-Q172 HydrophobicContact CE2-CG 3.98Å; Y168-Q172 HydrophobicContact CG-CG 4.42Å; Y168-Q172 WeakPolarHBondContact O-CG 3.43Å; Y168-Q172 PolarHBondContact O-N 3.27Å; Q172-I175 PolarHBondContact O-N 2.99Å; Q172-A176 VanDerWaalsContact O-CB 3.29Å; Q172-A176 WeakPolarHBondContact O-CB 3.36Å; Q172-A176 PolarHBondContact O-N 3.24Å
173	R	96.5	Very high	95.2	Very high	97 Å²	97	69.9 Å²	69.9	37%	0.366	35%	0.347	S	S	.	.	H	α-helix	trans	-64.9	-39.6	174.9	-164.1	170.6	-174.6	110.4	2	112.5	V116 C169 R170 L171 I175 A176 F177	V116-R173 HydrophobicContact CG1-CB 4.44Å; V116-R173 HydrophobicContact CG1-CG 4.34Å; V116-R173 VanDerWaalsContact O-CD 3.31Å; V116-R173 WeakPolarHBondContact O-CD 3.45Å; V116-R173 PolarHBondContact O-NE 3.02Å; V116-R173 VanDerWaalsContact O-NE 3.17Å; C169-R173 WeakPolarHBondContact O-CB 3.31Å; C169-R173 PolarHBondContact O-N 3.16Å; R170-R173 PolarHBondContact O-N 3.39Å; L171-R173 VanDerWaalsContact C-N 3.26Å; L171-R173 PolarHBondContact O-N 3.12Å; R173-I175 VanDerWaalsContact C-N 3.33Å; R173-I175 PolarHBondContact O-N 3.2Å; R173-A176 PolarHBondContact O-N 3.29Å; R173-F177 HydrophobicContact CG-CD2 3.51Å; R173-F177 HydrophobicContact CG-CE2 3.57Å; R173-F177 VanDerWaalsContact O-CD2 3.28Å; R173-F177 WeakPolarHBondContact O-CD2 3.46Å; R173-F177 PolarHBondContact O-N 3.19Å
174	C	97.3	Very high	95	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-55.8	-47.5	173.2	-75	0	0	0	0	112	F138 R170 L171 G178 M179	F138-C174 HydrophobicContact CD2-CB 3.53Å; F138-C174 HydrophobicContact CE2-CB 4.01Å; F138-C174 HydrophobicContact CG-CB 4.49Å; R170-C174 PolarHBondContact O-N 3.34Å; R170-C174 PolarHBondContact O-SG 3.15Å; R170-C174 VanDerWaalsContact O-SG 3.36Å; L171-C174 WeakPolarHBondContact O-CB 3.28Å; L171-C174 PolarHBondContact O-N 2.92Å; L171-C174 VanDerWaalsContact O-N 3.11Å; C174-G178 PolarHBondContact O-N 3.41Å; C174-M179 HydrophobicContact CB-CB 4.32Å; C174-M179 HydrophobicContact CB-CG 4.28Å; C174-M179 HydrophobicContact CB-SD 3.62Å; C174-M179 VanDerWaalsContact O-CB 3.23Å; C174-M179 WeakPolarHBondContact O-CB 3.21Å; C174-M179 WeakPolarHBondContact O-CG 3.43Å; C174-M179 PolarHBondContact O-N 3.11Å; C174-M179 VanDerWaalsContact SG-SD 3.62Å
175	I	95.9	Very high	94.4	Very high	73 Å²	73	68.8 Å²	68.8	37%	0.374	34%	0.341	S	S	.	.	H	α-helix	trans	-67.8	-47	-179.4	-61.4	166.4	0	0	0	110.4	F138 L171 Q172 R173 F177 G178	F138-I175 HydrophobicContact CE2-CG1 3.96Å; L171-I175 HydrophobicContact CG-CD1 4.31Å; L171-I175 WeakPolarHBondContact O-CG1 3.46Å; L171-I175 PolarHBondContact O-N 3.46Å; L171-I175 VanDerWaalsContact O-N 3.1Å; Q172-I175 PolarHBondContact O-N 2.99Å; R173-I175 VanDerWaalsContact C-N 3.33Å; R173-I175 PolarHBondContact O-N 3.2Å; I175-F177 PolarHBondContact O-N 3.18Å; I175-G178 PolarHBondContact O-N 3.4Å
176	A	94.7	Very high	93.2	Very high	84 Å²	84	63.5 Å²	63.5	69%	0.694	34%	0.337	S	S	*	.	H	α-helix	trans	-59.3	-34	-179.9	0	0	0	0	0	112.9	Q172 R173 G178	Q172-A176 VanDerWaalsContact O-CB 3.29Å; Q172-A176 WeakPolarHBondContact O-CB 3.36Å; Q172-A176 PolarHBondContact O-N 3.24Å; R173-A176 PolarHBondContact O-N 3.29Å; A176-G178 VanDerWaalsContact C-N 3.29Å; A176-G178 PolarHBondContact O-N 3.36Å
177	F	92.3	Very high	91.8	Very high	83 Å²	83	70.5 Å²	70.5	36%	0.364	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	20.8	175.4	-74.2	-76.5	0	0	0	113.8	V115 A128 R173 I175	V115-F177 HydrophobicContact CB-CB 4.39Å; V115-F177 HydrophobicContact CB-CD1 4.3Å; V115-F177 HydrophobicContact CB-CG 4.43Å; V115-F177 HydrophobicContact CG2-CB 3.76Å; V115-F177 HydrophobicContact CG2-CG 4.31Å; A128-F177 WeakPolarHBondContact CB-O 3.42Å; R173-F177 HydrophobicContact CG-CD2 3.51Å; R173-F177 HydrophobicContact CG-CE2 3.57Å; R173-F177 VanDerWaalsContact O-CD2 3.28Å; R173-F177 WeakPolarHBondContact O-CD2 3.46Å; R173-F177 PolarHBondContact O-N 3.19Å; I175-F177 PolarHBondContact O-N 3.18Å
178	G	90.4	Very high	90.4	Very high	35 Å²	35	75 Å²	75	36%	0.361	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	16.7	164.9	0	0	0	0	0	115.9	C174 I175 A176 K180	C174-G178 PolarHBondContact O-N 3.41Å; I175-G178 PolarHBondContact O-N 3.4Å; A176-G178 VanDerWaalsContact C-N 3.29Å; A176-G178 PolarHBondContact O-N 3.36Å; G178-K180 PolarHBondContact O-N 2.82Å
179	M	97.1	Very high	88.1	Confident	4 Å²	4	81.5 Å²	81.5	2%	0.02	41%	0.411	C	S	.	.			trans	-73.2	118	166.1	-60.9	-173.6	77.7	0	0	109.5	V116 Y126 A128 T130 F138 C174	V116-M179 HydrophobicContact CG2-SD 4.28Å; Y126-M179 HydrophobicContact CD2-CE 3.59Å; Y126-M179 HydrophobicContact CG-CE 4.34Å; Y126-M179 CarbonylContact O-C 3.48Å; Y126-M179 VanDerWaalsContact O-CA 3.32Å; Y126-M179 WeakPolarHBondContact O-CA 3.42Å; A128-M179 HydrophobicContact CB-CG 3.78Å; T130-M179 HydrophobicContact CG2-CE 4.39Å; T130-M179 HydrophobicContact CG2-CG 4.38Å; T130-M179 HydrophobicContact CG2-SD 3.89Å; F138-M179 HydrophobicContact CB-CE 3.5Å; F138-M179 VanDerWaalsContact CB-CE 3.5Å; F138-M179 HydrophobicContact CB-SD 4.08Å; F138-M179 HydrophobicContact CD1-CB 4.18Å; F138-M179 HydrophobicContact CD1-CE 3.77Å; F138-M179 HydrophobicContact CD2-CB 3.94Å; F138-M179 HydrophobicContact CD2-CE 4.28Å; F138-M179 HydrophobicContact CD2-SD 4.13Å; F138-M179 HydrophobicContact CE1-CB 3.91Å; F138-M179 HydrophobicContact CE2-CB 3.65Å; F138-M179 HydrophobicContact CG-CB 4.19Å; F138-M179 HydrophobicContact CG-CE 3.59Å; F138-M179 HydrophobicContact CG-SD 4.02Å; F138-M179 HydrophobicContact CZ-CB 3.63Å; F138-M179 VanDerWaalsContact CZ-O 3.26Å; F138-M179 WeakPolarHBondContact CZ-O 3.45Å; C174-M179 HydrophobicContact CB-CB 4.32Å; C174-M179 HydrophobicContact CB-CG 4.28Å; C174-M179 HydrophobicContact CB-SD 3.62Å; C174-M179 VanDerWaalsContact O-CB 3.23Å; C174-M179 WeakPolarHBondContact O-CB 3.21Å; C174-M179 WeakPolarHBondContact O-CG 3.43Å; C174-M179 PolarHBondContact O-N 3.11Å; C174-M179 VanDerWaalsContact SG-SD 3.62Å
180	K	93.4	Very high	86	Confident	118 Å²	118	86.7 Å²	86.7	51%	0.513	44%	0.444	S	S	.	.			trans	-94.5	129.9	-175.2	-50	-175	172.6	-171.8	0	111.8	Y126 F138 G178 D182 S183	Y126-K180 PolarHBondContact O-N 3.37Å; F138-K180 WeakPolarHBondContact CE1-O 3.08Å; G178-K180 PolarHBondContact O-N 2.82Å; K180-D182 WeakPolarHBondContact CB-OD1 3.25Å; K180-S183 WeakPolarHBondContact O-CB 3.31Å; K180-S183 PolarHBondContact O-N 3.5Å
181	Q	92.7	Very high	83.9	Confident	131 Å²	131	93.1 Å²	93.1	61%	0.612	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-67.3	-35	-179.5	62	-171.6	-1.1	0	0	113.1	I142 S183 V184	I142-Q181 HydrophobicContact CD1-CB 3.9Å; I142-Q181 HydrophobicContact CG1-CB 4.22Å; I142-Q181 HydrophobicContact CG2-CB 4.07Å; Q181-S183 PolarHBondContact O-N 3.43Å; Q181-V184 WeakPolarHBondContact O-CB 3.47Å; Q181-V184 PolarHBondContact O-N 3.49Å; Q181-V184 VanDerWaalsContact O-N 3.08Å
182	D	90.2	Very high	81.5	Confident	121 Å²	121	101.2 Å²	101.2	65%	0.647	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-60.1	-26	176.5	62.6	-5.3	0	0	0	113.5	K180 V184	K180-D182 WeakPolarHBondContact CB-OD1 3.25Å; D182-V184 PolarHBondContact O-N 3.07Å
183	S	89.4	Confident	79	Confident	53 Å²	53	102.6 Å²	102.6	37%	0.371	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-77.9	-6	179.9	-58.6	0	0	0	0	112.3	K180 Q181 Q185	K180-S183 WeakPolarHBondContact O-CB 3.31Å; K180-S183 PolarHBondContact O-N 3.5Å; Q181-S183 PolarHBondContact O-N 3.43Å; S183-Q185 PolarHBondContact O-N 3.44Å
184	V	89.6	Confident	76.5	Confident	16 Å²	16	103.1 Å²	103.1	10%	0.097	55%	0.548	C	S	.	.	S	Bend	trans	-91.8	91.8	177.7	-173.5	0	0	0	0	109.1	Y126 F138 K139 I142 R143 Q181 D182	Y126-V184 HydrophobicContact CD1-CG2 3.72Å; Y126-V184 HydrophobicContact CE1-CB 4.4Å; Y126-V184 HydrophobicContact CE1-CG2 3.78Å; Y126-V184 HydrophobicContact CG-CG2 4.28Å; F138-V184 HydrophobicContact CD1-CG2 3.94Å; F138-V184 HydrophobicContact CE1-CG2 3.74Å; K139-V184 HydrophobicContact CG-CG1 4.33Å; I142-V184 HydrophobicContact CB-CB 4.3Å; I142-V184 HydrophobicContact CB-CG1 4.27Å; I142-V184 HydrophobicContact CB-CG2 4.1Å; I142-V184 HydrophobicContact CG1-CG2 4.27Å; I142-V184 HydrophobicContact CG2-CB 3.93Å; I142-V184 HydrophobicContact CG2-CG1 4.22Å; I142-V184 HydrophobicContact CG2-CG2 4.11Å; R143-V184 HydrophobicContact CG-CG1 4.02Å; Q181-V184 WeakPolarHBondContact O-CB 3.47Å; Q181-V184 PolarHBondContact O-N 3.49Å; Q181-V184 VanDerWaalsContact O-N 3.08Å; D182-V184 PolarHBondContact O-N 3.07Å
185	Q	83.7	Confident	74.1	Confident	120 Å²	120	113 Å²	113	56%	0.561	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-57.9	148.7	175.1	-64.6	178	-13.3	0	0	112.1	R143 S183	R143-Q185 PolarHBondContact NH1-O 3.34Å; R143-Q185 PolarHBondContact NH2-O 3.02Å; S183-Q185 PolarHBondContact O-N 3.44Å
186	C	70.8	Confident	72	Confident	113 Å²	113	118.2 Å²	118.2	76%	0.764	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-58	164.4	169.7	-67.2	0	0	0	0	112.2	R188	C186-R188 PolarHBondContact O-N 3.04Å
187	E	67.1	Low	69.4	Low	159 Å²	159	123.4 Å²	123.4	74%	0.743	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-58.4	126.1	176.6	-64.9	-163.2	159.3	0	0	110.3
188	R	69.1	Low	67.2	Low	195 Å²	195	123.4 Å²	123.4	74%	0.736	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-73.3	136.3	165.5	-61.9	-178.6	-164	170.7	2.9	105.9	C186	C186-R188 PolarHBondContact O-N 3.04Å
189	K	48.6	Very low	65.1	Low	189 Å²	189	127.1 Å²	127.1	82%	0.822	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-46.2	135.5	164.5	-66	-178.1	179.2	-178.7	0	107.4	I191	K189-I191 PolarHBondContact O-N 2.75Å; K189-I191 VanDerWaalsContact O-N 3.12Å
190	P	55.1	Low	63.1	Low	118 Å²	118	133.9 Å²	133.9	77%	0.766	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-46.6	128.7	171.4	-24.6	32.9	0	0	0	107.4	E192	P190-E192 VanDerWaalsContact C-N 3.28Å; P190-E192 PolarHBondContact O-N 2.61Å
191	I	51.9	Low	60.6	Low	145 Å²	145	133.6 Å²	133.6	74%	0.744	69%	0.694	S	S	*	*			trans	-60.2	106	170.4	-65.4	171.9	0	0	0	103.9	K189 V193	K189-I191 PolarHBondContact O-N 2.75Å; K189-I191 VanDerWaalsContact O-N 3.12Å; I191-V193 HydrophobicContact CB-CG2 4.43Å; I191-V193 HydrophobicContact CG2-CG2 3.73Å; I191-V193 PolarHBondContact O-N 2.86Å
192	E	49.3	Very low	58.3	Low	187 Å²	187	131.9 Å²	131.9	87%	0.874	70%	0.702	S	S	*	*			trans	-63.5	83.4	159.7	-78.6	-174.2	163.8	0	0	105	P190 S194	P190-E192 VanDerWaalsContact C-N 3.28Å; P190-E192 PolarHBondContact O-N 2.61Å; E192-S194 VanDerWaalsContact C-N 3.29Å; E192-S194 PolarHBondContact O-N 3.36Å
193	V	44.1	Very low	56.1	Low	114 Å²	114	131.6 Å²	131.6	69%	0.691	72%	0.716	S	S	*	*			trans	-61.6	109.5	159.7	-170	0	0	0	0	102.1	I191 R195	I191-V193 HydrophobicContact CB-CG2 4.43Å; I191-V193 HydrophobicContact CG2-CG2 3.73Å; I191-V193 PolarHBondContact O-N 2.86Å; V193-R195 PolarHBondContact O-N 2.63Å
194	S	44	Very low	54.3	Low	108 Å²	108	134.1 Å²	134.1	76%	0.755	73%	0.734	S	S	*	*			trans	-60.3	85.4	166	56.5	0	0	0	0	105.9	E192 E196	E192-S194 VanDerWaalsContact C-N 3.29Å; E192-S194 PolarHBondContact O-N 3.36Å; S194-E196 PolarHBondContact O-N 2.89Å
195	R	47	Very low	52.4	Low	208 Å²	208	139.2 Å²	139.2	79%	0.785	77%	0.765	S	S	*	*			trans	-66.4	98.3	166.6	-175.6	175.7	157.5	-179.2	-6.9	103.2	V193 K197	V193-R195 PolarHBondContact O-N 2.63Å; R195-K197 PolarHBondContact O-N 3.2Å
196	E	52.1	Low	50.6	Low	181 Å²	181	142.3 Å²	142.3	85%	0.846	78%	0.78	S	S	*	*			trans	-41.4	112.5	165.9	-85.6	-179.6	148	0	0	106.5	S194 S198	S194-E196 PolarHBondContact O-N 2.89Å; E196-S198 VanDerWaalsContact C-N 3.33Å; E196-S198 PolarHBondContact O-N 3.46Å
197	K	39.6	Very low	49.3	Very low	194 Å²	194	144.3 Å²	144.3	84%	0.843	78%	0.775	S	S	*	*			trans	-65.2	101.9	176.9	-84.7	177.3	175.6	175.8	0	105.7	R195 S199	R195-K197 PolarHBondContact O-N 3.2Å; K197-S199 PolarHBondContact O-N 3.16Å
198	S	45.5	Very low	48.4	Very low	83 Å²	83	143.6 Å²	143.6	58%	0.58	78%	0.775	S	S	*	*			trans	-48.2	125.3	161.1	53.6	0	0	0	0	108	E196 N200	E196-S198 VanDerWaalsContact C-N 3.33Å; E196-S198 PolarHBondContact O-N 3.46Å; S198-N200 PolarHBondContact O-N 2.89Å
199	S	47.6	Very low	47.4	Very low	112 Å²	112	142.3 Å²	142.3	78%	0.783	77%	0.771	S	S	*	*	S	Bend	trans	-65.9	20.2	-166.3	48.4	0	0	0	0	116.6	K197	K197-S199 PolarHBondContact O-N 3.16Å
200	N	55.3	Low	47.3	Very low	146 Å²	146	140.6 Å²	140.6	78%	0.781	77%	0.769	S	S	*	*			trans	-138.2	62.7	-173.5	-69.5	-36.2	0	0	0	113.1	S198	S198-N200 PolarHBondContact O-N 2.89Å
201	C	40.4	Very low	46.6	Very low	113 Å²	113	144.8 Å²	144.8	76%	0.764	77%	0.77	S	S	*	*			trans	-127.1	122.9	163.6	-73.3	0	0	0	0	109.5
202	A	43.7	Very low	46.5	Very low	95 Å²	95	148 Å²	148	79%	0.785	78%	0.778	S	S	*	*			trans	-55.1	141.6	-174.8	0	0	0	0	0	112.6	S204	A202-S204 VanDerWaalsContact C-N 3.29Å; A202-S204 PolarHBondContact O-N 3Å
203	A	43.3	Very low	46.3	Very low	114 Å²	114	145.5 Å²	145.5	94%	0.942	77%	0.771	S	S	*	*	S	Bend	trans	-68.1	80	175.3	0	0	0	0	0	111.1
204	S	51.8	Low	46.4	Very low	107 Å²	107	147.5 Å²	147.5	75%	0.748	78%	0.777	S	S	*	*			trans	-160.8	52.4	171	-151.3	0	0	0	0	113.7	A202	A202-S204 VanDerWaalsContact C-N 3.29Å; A202-S204 PolarHBondContact O-N 3Å
205	T	49.9	Very low	46.8	Very low	123 Å²	123	153.7 Å²	153.7	76%	0.755	78%	0.784	S	S	*	*	S	Bend	trans	-135.8	2.4	167.2	57.1	0	0	0	0	115.2
206	E	45.8	Very low	46.2	Very low	185 Å²	185	149.2 Å²	149.2	86%	0.864	79%	0.785	S	S	*	*	S	Bend	trans	-86.6	-2.8	-180	-75.6	-176.1	173.7	0	0	114.4
207	K	43.7	Very low	45.8	Very low	154 Å²	154	145.7 Å²	145.7	67%	0.67	78%	0.778	S	S	*	*			trans	-146.7	77	-177.4	-76.5	178.7	175.2	-175.9	0	112.1	Y209	K207-Y209 HydrophobicContact CB-CD2 3.99Å; K207-Y209 HydrophobicContact CB-CE2 3.51Å; K207-Y209 HydrophobicContact CD-CE2 3.71Å; K207-Y209 VanDerWaalsContact CD-OH 3.27Å; K207-Y209 WeakPolarHBondContact CD-OH 3.25Å; K207-Y209 WeakPolarHBondContact CE-OH 3.39Å; K207-Y209 HydrophobicContact CG-CE2 3.79Å; K207-Y209 PolarHBondContact O-N 3.19Å
208	I	48.6	Very low	45.6	Very low	144 Å²	144	144.2 Å²	144.2	74%	0.738	78%	0.778	S	S	*	*			trans	-81.7	102.2	160.7	-57.4	177.9	0	0	0	107	I210	I208-I210 HydrophobicContact CG2-CG1 4.05Å
209	Y	48.6	Very low	45.1	Very low	168 Å²	168	146.5 Å²	146.5	66%	0.659	79%	0.789	S	S	*	*			trans	-91.6	105.9	170.1	-66.9	-78.5	0	0	0	109.4	K207 R211	K207-Y209 HydrophobicContact CB-CD2 3.99Å; K207-Y209 HydrophobicContact CB-CE2 3.51Å; K207-Y209 HydrophobicContact CD-CE2 3.71Å; K207-Y209 VanDerWaalsContact CD-OH 3.27Å; K207-Y209 WeakPolarHBondContact CD-OH 3.25Å; K207-Y209 WeakPolarHBondContact CE-OH 3.39Å; K207-Y209 HydrophobicContact CG-CE2 3.79Å; K207-Y209 PolarHBondContact O-N 3.19Å; Y209-R211 PolarHBondContact O-N 2.73Å
210	I	45.7	Very low	44.5	Very low	153 Å²	153	146.1 Å²	146.1	79%	0.785	79%	0.792	S	S	*	*			trans	-85.7	109.8	169.4	-56.2	178.3	0	0	0	107.7	I208	I208-I210 HydrophobicContact CG2-CG1 4.05Å
211	R	41.2	Very low	43.6	Very low	207 Å²	207	145 Å²	145	78%	0.781	79%	0.791	S	S	*	*			trans	-76.9	128.2	167.2	-68.4	-173.7	179.3	135.9	-0.2	108.7	Y209	Y209-R211 PolarHBondContact O-N 2.73Å
212	K	49.8	Very low	43.4	Very low	211 Å²	211	145.2 Å²	145.2	92%	0.917	79%	0.791	S	S	*	*	S	Bend	trans	-86.5	-13.8	175.2	-151.6	175.3	-178.5	-178.7	0	113
213	D	44.8	Very low	43.2	Very low	136 Å²	136	146.5 Å²	146.5	73%	0.727	79%	0.789	S	S	*	*			trans	-158.8	151.8	173.4	-146.4	-26	0	0	0	112.7
214	L	45.2	Very low	42.7	Very low	156 Å²	156	149.7 Å²	149.7	82%	0.817	78%	0.782	S	S	*	*	S	Bend	trans	-95.3	9.2	-168	-86	158.6	0	0	0	114.9
215	R	52.8	Low	41.7	Very low	237 Å²	237	150.2 Å²	150.2	89%	0.894	78%	0.78	S	S	*	*			trans	-134.3	25.9	-168.6	-75.1	-166.6	172.3	128.7	-3	118.3
216	S	34.3	Very low	41	Very low	115 Å²	115	150.4 Å²	150.4	80%	0.804	78%	0.782	S	S	*	*			trans	-112.9	125.4	174.9	-169.3	0	0	0	0	112.9
217	P	43.2	Very low	40.2	Very low	107 Å²	107	148.8 Å²	148.8	70%	0.695	78%	0.779	S	S	*	*			trans	-94	136.9	172.1	34.8	-26.4	0	0	0	111.5
218	L	35.2	Very low	39.5	Very low	162 Å²	162	146.9 Å²	146.9	85%	0.848	79%	0.785	S	S	*	*	S	Bend	trans	108.9	116.3	160.6	-56.8	167.2	0	0	0	117.9
219	T	37.1	Very low	38.5	Very low	132 Å²	132	148.3 Å²	148.3	81%	0.81	79%	0.789	S	S	*	*			trans	57.8	101.8	159.4	46	0	0	0	0	119.5
220	A	34.6	Very low	37.5	Very low	103 Å²	103	146.1 Å²	146.1	85%	0.851	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-81.6	121	162.4	0	0	0	0	0	110.1
221	T	35.3	Very low	36.6	Very low	124 Å²	124	145.9 Å²	145.9	76%	0.761	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-91.3	138.9	169.2	39	0	0	0	0	110.4
222	P	36.6	Very low	36	Very low	116 Å²	116	147.4 Å²	147.4	75%	0.753	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-78.8	140.1	178	31.2	-31.3	0	0	0	111.4
223	T	39.1	Very low	35	Very low	122 Å²	122	142.1 Å²	142.1	75%	0.748	79%	0.794	S	S	*	*	S	Bend	trans	-93.1	7.9	-173.5	-49.4	0	0	0	0	114.5
224	F	33.5	Very low	34.2	Very low	182 Å²	182	142.7 Å²	142.7	80%	0.798	80%	0.802	S	S	*	*			trans	-140.8	116.2	178.7	-69.9	-82.8	0	0	0	111.1
225	V	30.9	Very low	33.4	Very low	117 Å²	117	138.4 Å²	138.4	71%	0.709	80%	0.796	S	S	*	*			trans	-112.6	114.9	160.6	179.4	0	0	0	0	106.2
226	T	33.9	Very low	32.2	Very low	128 Å²	128	134.5 Å²	134.5	79%	0.785	79%	0.792	S	S	*	*			trans	-98.2	106.6	166.9	48.9	0	0	0	0	106.9
227	D	29.2	Very low	32	Very low	151 Å²	151	136.4 Å²	136.4	81%	0.807	79%	0.793	S	S	*	*			trans	-104.8	109.2	171.5	-82.5	-18.3	0	0	0	110.1
228	S	29	Very low	31.2	Very low	113 Å²	113	138.5 Å²	138.5	79%	0.79	80%	0.798	S	S	*	*			trans	-106.6	108	158.9	58.2	0	0	0	0	109
229	E	28.8	Very low	30.8	Very low	175 Å²	175	136.8 Å²	136.8	82%	0.818	80%	0.8	S	S	*	*			trans	57	141	147.1	-64.7	-154.6	153.2	0	0	124.5
230	T	27.5	Very low	30.3	Very low	121 Å²	121	133.5 Å²	133.5	74%	0.742	79%	0.792	S	S	*	*			trans	81.6	109	152.2	46.9	0	0	0	0	120.5
231	T	26.5	Very low	30	Very low	149 Å²	149	136.7 Å²	136.7	91%	0.914	79%	0.791	S	S	*	*				-172.8	145.8	108.7	24.2	0	0	0	0	112.7
232	R	28.9	Very low	29.6	Very low	239 Å²	239	139.8 Å²	139.8	90%	0.902	79%	0.794	S	S	*	*			trans	-75.7	139.3	-174.8	-72.4	172.9	168.8	164.3	-4.1	113
233	S	29.4	Very low	29.5	Very low	100 Å²	100	139.9 Å²	139.9	70%	0.699	79%	0.792	S	S	*	*			trans	29.7	128	139.2	65.5	0	0	0	0	121.4
234	T	27.4	Very low	28.9	Very low	147 Å²	147	140.8 Å²	140.8	90%	0.902	79%	0.793	S	S	*	*				-172.9	137.1	112.4	28.9	0	0	0	0	110.1
235	G	27.4	Very low	28.6	Very low	67 Å²	67	140.1 Å²	140.1	69%	0.691	80%	0.796	S	S	*	*			trans	-93.3	-179.2	-176.6	0	0	0	0	0	114.9
236	L	28.8	Very low	28.5	Very low	155 Å²	155	142.6 Å²	142.6	81%	0.812	80%	0.799	S	S	*	*			trans	173.1	128.8	139.8	-117.9	96	0	0	0	111
237	L	30.5	Very low	28.8	Very low	155 Å²	155	141.9 Å²	141.9	81%	0.812	80%	0.797	S	S	*	*			trans	51.2	144	146.4	-43.5	178.8	0	0	0	119
238	D	25.7	Very low	28.6	Very low	150 Å²	150	140.6 Å²	140.6	80%	0.802	80%	0.8	S	S	*	*			cis	-163.9	149.9	20.9	-171.9	10.5	0	0	0	107.3
239	S	26.3	Very low	28.3	Very low	127 Å²	127	138.4 Å²	138.4	89%	0.888	80%	0.795	S	S	*	*			trans	-149.9	104.7	170	-97.1	0	0	0	0	110
240	G	26	Very low	28.1	Very low	62 Å²	62	136.9 Å²	136.9	64%	0.639	80%	0.797	S	S	*	*			trans	-152.4	115.8	162.2	0	0	0	0	0	109.7
241	M	29	Very low	28	Very low	170 Å²	170	140 Å²	140	84%	0.837	80%	0.801	S	S	*	*			trans	-160.2	104.9	145	-91	-131.3	138.1	0	0	112
242	F	28.1	Very low	27.8	Very low	189 Å²	189	139.6 Å²	139.6	83%	0.829	80%	0.798	S	S	*	*			trans	48.3	130.2	133.5	-63.9	-80.8	0	0	0	123
243	V	33.1	Very low	27.5	Very low	118 Å²	118	137 Å²	137	72%	0.715	80%	0.796	S	S	*	*			trans	-101.3	142.9	160	-168.5	0	0	0	0	109.1
244	N	27.4	Very low	27.1	Very low	142 Å²	142	138.4 Å²	138.4	76%	0.759	81%	0.806	S	S	*	*			trans	139.8	137	130.5	-80.8	-44.2	0	0	0	115.6
245	I	26.3	Very low	27	Very low	168 Å²	168	137.6 Å²	137.6	86%	0.862	80%	0.801	S	S	*	*			trans	-127	91.8	155.6	-64.9	174.1	0	0	0	107.7
246	H	29.1	Very low	26.8	Very low	168 Å²	168	140.2 Å²	140.2	78%	0.778	80%	0.803	S	S	*	*				39.2	161.1	120.1	-95.1	-47.7	0	0	0	123.9
247	P	40.9	Very low	26.5	Very low	114 Å²	114	139.5 Å²	139.5	74%	0.74	80%	0.8	S	S	*	*				-134.7	-171.1	-106.4	46.5	-29.8	0	0	0	114.8
248	S	23.9	Very low	26.1	Very low	123 Å²	123	139.4 Å²	139.4	86%	0.86	80%	0.797	S	S	*	*			trans	-158.7	137.1	153.6	174	0	0	0	0	110
249	G	23	Very low	25.9	Very low	67 Å²	67	138.4 Å²	138.4	69%	0.691	80%	0.796	S	S	*	*			trans	-145.1	155.7	178.8	0	0	0	0	0	112.6
250	V	24.8	Very low	25.8	Very low	144 Å²	144	137.4 Å²	137.4	87%	0.873	79%	0.789	S	S	*	*			trans	-150.5	139.4	161.3	-178.7	0	0	0	0	110.6
251	K	24.7	Very low	25.6	Very low	187 Å²	187	142.2 Å²	142.2	81%	0.813	80%	0.8	S	S	*	*			trans	-34	161	172.2	-62.8	165.4	176.1	179.6	0	116.8
252	T	22.9	Very low	25.5	Very low	140 Å²	140	142 Å²	142	86%	0.859	80%	0.795	S	S	*	*				-177.8	153	64.9	-32	0	0	0	0	111.7
253	E	22.2	Very low	25.2	Very low	185 Å²	185	137.8 Å²	137.8	86%	0.864	79%	0.794	S	S	*	*			trans	-81.4	152.1	176.4	-63.8	177.5	145.5	0	0	114.9
254	S	22.3	Very low	24.7	Very low	128 Å²	128	139.3 Å²	139.3	90%	0.895	79%	0.794	S	S	*	*			trans	-171.6	147.1	132.1	-111.9	0	0	0	0	114.7
255	T	23.5	Very low	24.6	Very low	131 Å²	131	137.4 Å²	137.4	80%	0.804	79%	0.791	S	S	*	*			trans	-82.7	160.4	-173	-48.7	0	0	0	0	113.5
256	V	24.5	Very low	24.5	Very low	122 Å²	122	135.7 Å²	135.7	74%	0.739	79%	0.793	S	S	*	*			trans	129.7	101.6	143.9	-179.6	0	0	0	0	116
257	L	21.9	Very low	24.5	Very low	140 Å²	140	136.1 Å²	136.1	73%	0.733	80%	0.795	S	S	*	*				77	123.9	124.3	-136.8	108.2	0	0	0	124.3
258	M	21.5	Very low	24.3	Very low	152 Å²	152	133.7 Å²	133.7	75%	0.749	79%	0.791	S	S	*	*			trans	66.1	139.9	158.3	-52.8	-60.4	153.6	0	0	117.9
259	T	21.8	Very low	24.9	Very low	130 Å²	130	133.2 Å²	133.2	80%	0.798	78%	0.779	S	S	*	*			cis	-153	163.1	34.2	42.7	0	0	0	0	111.9
260	S	24.9	Very low	26.2	Very low	105 Å²	105	132.9 Å²	132.9	73%	0.734	76%	0.761	S	S	*	*			trans	-48.2	136.3	165.4	176	0	0	0	0	113.6
261	D	22.4	Very low	27.5	Very low	164 Å²	164	126.6 Å²	126.6	88%	0.877	72%	0.723	S	S	*	*			trans	-152.7	129.5	141.5	-108.3	-23.1	0	0	0	112.2
262	K	25.3	Very low	29.2	Very low	166 Å²	166	119.3 Å²	119.3	72%	0.722	69%	0.694	S	S	*	*			trans	-66.7	130	177.1	-96.2	-178	162.5	-149.3	0	109.9	E264	K262-E264 IonicContact NZ-OE1 2.92Å; K262-E264 PolarHBondContact NZ-OE1 3.46Å
263	A	22.9	Very low	31.2	Very low	99 Å²	99	112.6 Å²	112.6	82%	0.818	65%	0.653	S	S	*	*			trans	-127	97.6	154.4	0	0	0	0	0	107.9	S265	A263-S265 PolarHBondContact O-N 2.7Å
264	E	22.7	Very low	33	Very low	151 Å²	151	104.5 Å²	104.5	71%	0.706	62%	0.618	S	S	*	*			trans	-68.1	105.2	169.4	-82.8	163.6	-171.8	0	0	108.6	K262	K262-E264 IonicContact NZ-OE1 2.92Å; K262-E264 PolarHBondContact NZ-OE1 3.46Å
265	S	24.6	Very low	34.9	Very low	101 Å²	101	99.8 Å²	99.8	71%	0.706	59%	0.585	S	S	*	*			trans	-84.7	108.8	163.1	62.3	0	0	0	0	108.6	A263 Q267	A263-S265 PolarHBondContact O-N 2.7Å; S265-Q267 PolarHBondContact O-N 2.73Å
266	C	25.4	Very low	36.7	Very low	132 Å²	132	94 Å²	94	89%	0.892	55%	0.549	S	S	*	.			trans	-64.9	99.1	174.6	-61.3	0	0	0	0	110.5
267	Q	29.3	Very low	38.6	Very low	178 Å²	178	88.3 Å²	88.3	83%	0.832	52%	0.515	S	S	*	.			trans	-93.7	103.4	169.3	-155.9	160.1	5.5	0	0	106.8	S265	S265-Q267 PolarHBondContact O-N 2.73Å
268	G	34.9	Very low	40.8	Very low	62 Å²	62	83.7 Å²	83.7	64%	0.639	49%	0.492	S	S	*	.			trans	-92	115.8	179	0	0	0	0	0	111.1	L270	G268-L270 PolarHBondContact O-N 3.32Å
269	D	37.9	Very low	42.7	Very low	114 Å²	114	78.5 Å²	78.5	61%	0.61	47%	0.471	S	S	*	.			trans	-69.3	121.6	178.3	-75.3	-33.3	0	0	0	112.4	S275	D269-S275 WeakPolarHBondContact O-CB 3.06Å; D269-S275 PolarHBondContact O-OG 3.45Å
270	L	50.3	Low	44.5	Very low	59 Å²	59	74.4 Å²	74.4	31%	0.309	44%	0.444	S	S	.	.			trans	-96.8	9.4	-171.1	-83.5	162.7	0	0	0	115.3	G268 T272 V276 S279 M590	G268-L270 PolarHBondContact O-N 3.32Å; L270-T272 VanDerWaalsContact C-N 3.31Å; L270-T272 PolarHBondContact O-N 3.37Å; L270-V276 HydrophobicContact CD2-CG2 4.48Å; L270-S279 VanDerWaalsContact CD2-OG 3.24Å; L270-S279 WeakPolarHBondContact CD2-OG 3.14Å; L270-M590 HydrophobicContact CB-CE 3.74Å; L270-M590 HydrophobicContact CD2-CE 4.41Å; L270-M590 HydrophobicContact CG-CE 4.48Å; L270-M590 WeakPolarHBondContact O-CE 3.24Å
271	S	51.3	Low	46.1	Very low	12 Å²	12	69.6 Å²	69.6	8%	0.084	41%	0.411	C	S	.	.			trans	-72.7	-12.3	-165.3	68.2	0	0	0	0	116.7	Q598	S271-Q598 PolarHBondContact OG-NE2 3.27Å; S271-Q598 PolarHBondContact OG-OE1 2.89Å
272	T	60.5	Low	47.5	Very low	34 Å²	34	65.9 Å²	65.9	21%	0.209	39%	0.391	C	S	.	.	S	Bend	trans	-116	151.2	-179.4	62.7	0	0	0	0	111.5	L270 A274 S275 V276 E396	L270-T272 VanDerWaalsContact C-N 3.31Å; L270-T272 PolarHBondContact O-N 3.37Å; T272-A274 PolarHBondContact O-N 3.48Å; T272-A274 VanDerWaalsContact O-N 3.09Å; T272-S275 WeakPolarHBondContact O-CA 3.44Å; T272-S275 WeakPolarHBondContact O-CB 3.32Å; T272-S275 PolarHBondContact O-N 2.84Å; T272-S275 PolarHBondContact OG1-N 2.98Å; T272-S275 PolarHBondContact OG1-OG 3.37Å; T272-S275 VanDerWaalsContact OG1-OG 3.09Å; T272-V276 PolarHBondContact O-N 3.17Å; T272-E396 HydrophobicContact CG2-CG 4.46Å
273	L	64.1	Low	48.7	Very low	0 Å²	0	63.7 Å²	63.7	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-51.4	-34.5	173.7	-165.5	74.9	0	0	0	110.9	V277 F403 F571 L574 I575 I580 V583 I587	L273-V277 WeakPolarHBondContact O-CB 3.18Å; L273-V277 WeakPolarHBondContact O-CG2 3.48Å; L273-V277 PolarHBondContact O-N 2.87Å; L273-F403 HydrophobicContact CB-CE2 4.18Å; L273-F403 HydrophobicContact CD1-CE2 3.79Å; L273-F403 HydrophobicContact CD1-CZ 4.44Å; L273-F571 HydrophobicContact CD2-CD1 3.85Å; L273-F571 HydrophobicContact CD2-CE1 4.43Å; L273-L574 HydrophobicContact CB-CD2 4.02Å; L273-L574 HydrophobicContact CD2-CD2 4.34Å; L273-I575 HydrophobicContact CB-CG2 4.43Å; L273-I575 HydrophobicContact CD2-CD1 4.25Å; L273-I575 HydrophobicContact CD2-CG2 3.22Å; L273-I575 HydrophobicContact CG-CG2 3.59Å; L273-I580 HydrophobicContact CD2-CD1 4.14Å; L273-V583 HydrophobicContact CD1-CG1 3.68Å; L273-I587 HydrophobicContact CD1-CD1 4.18Å
274	A	60.6	Low	49.8	Very low	15 Å²	15	60.4 Å²	60.4	12%	0.124	36%	0.363	C	S	.	.	H	α-helix	trans	-65.7	-40.1	173.9	0	0	0	0	0	113.9	T272 T278 F325 L574	T272-A274 PolarHBondContact O-N 3.48Å; T272-A274 VanDerWaalsContact O-N 3.09Å; A274-T278 VanDerWaalsContact O-CB 3.31Å; A274-T278 WeakPolarHBondContact O-CB 3.29Å; A274-T278 PolarHBondContact O-N 3.3Å; A274-T278 PolarHBondContact O-OG1 2.75Å; A274-F325 HydrophobicContact CB-CE2 4.35Å; A274-F325 HydrophobicContact CB-CZ 3.85Å; A274-L574 HydrophobicContact CB-CD1 4.16Å; A274-L574 HydrophobicContact CB-CG 4.42Å
275	S	62.2	Low	50.9	Low	29 Å²	29	58.4 Å²	58.4	20%	0.203	35%	0.351	C	S	.	.	H	α-helix	trans	-67	-40.4	174.8	-59.3	0	0	0	0	113.2	D269 T272 V277 T278 S279	D269-S275 WeakPolarHBondContact O-CB 3.06Å; D269-S275 PolarHBondContact O-OG 3.45Å; T272-S275 WeakPolarHBondContact O-CA 3.44Å; T272-S275 WeakPolarHBondContact O-CB 3.32Å; T272-S275 PolarHBondContact O-N 2.84Å; T272-S275 PolarHBondContact OG1-N 2.98Å; T272-S275 PolarHBondContact OG1-OG 3.37Å; T272-S275 VanDerWaalsContact OG1-OG 3.09Å; S275-V277 VanDerWaalsContact C-N 3.33Å; S275-T278 PolarHBondContact O-N 3.33Å; S275-S279 WeakPolarHBondContact O-CB 3.39Å; S275-S279 PolarHBondContact O-N 2.85Å; S275-S279 PolarHBondContact O-OG 3.04Å
276	V	62.4	Low	51.5	Low	9 Å²	9	58.5 Å²	58.5	6%	0.055	35%	0.348	C	S	.	.	H	α-helix	trans	-61.9	-45.8	176.6	175.7	0	0	0	0	110.4	L270 T272 S279 L280 F403 V583 H586 M590	L270-V276 HydrophobicContact CD2-CG2 4.48Å; T272-V276 PolarHBondContact O-N 3.17Å; V276-S279 PolarHBondContact O-N 3.28Å; V276-L280 WeakPolarHBondContact O-CB 3.23Å; V276-L280 PolarHBondContact O-N 3.1Å; V276-F403 HydrophobicContact CG2-CE1 4.42Å; V276-F403 HydrophobicContact CG2-CZ 3.92Å; V276-V583 HydrophobicContact CG1-CG1 4.4Å; V276-H586 HydrophobicContact CG1-CB 4.19Å; V276-M590 HydrophobicContact CG1-SD 4.29Å; V276-M590 HydrophobicContact CG2-CE 3.62Å; V276-M590 HydrophobicContact CG2-SD 3.4Å; V276-M590 WeakPolarHBondContact CG2-SD 3.33Å
277	V	64	Low	51.9	Low	3 Å²	3	60.5 Å²	60.5	2%	0.018	34%	0.342	C	S	.	.	H	α-helix	trans	-69.1	-42.1	179.9	-179.1	0	0	0	0	110.9	L273 S275 S279 L280 A281 F325 L328 I575 I578 V583	L273-V277 WeakPolarHBondContact O-CB 3.18Å; L273-V277 WeakPolarHBondContact O-CG2 3.48Å; L273-V277 PolarHBondContact O-N 2.87Å; S275-V277 VanDerWaalsContact C-N 3.33Å; V277-S279 VanDerWaalsContact C-N 3.3Å; V277-S279 PolarHBondContact O-N 3.19Å; V277-L280 PolarHBondContact O-N 3.37Å; V277-L280 VanDerWaalsContact O-N 3.15Å; V277-A281 PolarHBondContact O-N 3.24Å; V277-F325 HydrophobicContact CB-CD1 4.17Å; V277-F325 HydrophobicContact CB-CE1 3.5Å; V277-F325 HydrophobicContact CB-CZ 4.28Å; V277-F325 HydrophobicContact CG1-CD1 3.38Å; V277-F325 HydrophobicContact CG1-CE1 3.24Å; V277-F325 HydrophobicContact CG1-CZ 4.34Å; V277-F325 HydrophobicContact CG2-CE1 4.04Å; V277-L328 HydrophobicContact CB-CD1 4.4Å; V277-L328 HydrophobicContact CG1-CD1 3.33Å; V277-L328 WeakPolarHBondContact O-CD1 3.48Å; V277-I575 HydrophobicContact CG2-CG2 4.45Å; V277-I578 HydrophobicContact CG1-CD1 3.34Å; V277-V583 HydrophobicContact CG2-CG2 4.36Å
278	T	67.8	Low	52.2	Low	42 Å²	42	58.1 Å²	58.1	26%	0.258	33%	0.334	S	S	.	.	H	α-helix	trans	-60.2	-40.5	174.4	-57.4	0	0	0	0	111.9	A274 S275 A281 N282 A324	A274-T278 VanDerWaalsContact O-CB 3.31Å; A274-T278 WeakPolarHBondContact O-CB 3.29Å; A274-T278 PolarHBondContact O-N 3.3Å; A274-T278 PolarHBondContact O-OG1 2.75Å; S275-T278 PolarHBondContact O-N 3.33Å; T278-A281 WeakPolarHBondContact O-CB 3.37Å; T278-A281 PolarHBondContact O-N 3.35Å; T278-N282 PolarHBondContact O-N 3.29Å; T278-N282 VanDerWaalsContact O-N 3.1Å; T278-N282 PolarHBondContact O-ND2 3.25Å; T278-A324 HydrophobicContact CG2-CB 4.35Å
279	S	62.2	Low	52.2	Low	44 Å²	44	62.5 Å²	62.5	31%	0.308	34%	0.343	S	S	.	.	H	α-helix	trans	-66.5	-37.7	175.8	-60.9	0	0	0	0	112.1	L270 S275 V276 V277 N282 L283	L270-S279 VanDerWaalsContact CD2-OG 3.24Å; L270-S279 WeakPolarHBondContact CD2-OG 3.14Å; S275-S279 WeakPolarHBondContact O-CB 3.39Å; S275-S279 PolarHBondContact O-N 2.85Å; S275-S279 PolarHBondContact O-OG 3.04Å; V276-S279 PolarHBondContact O-N 3.28Å; V277-S279 VanDerWaalsContact C-N 3.3Å; V277-S279 PolarHBondContact O-N 3.19Å; S279-N282 PolarHBondContact O-N 3.49Å; S279-L283 PolarHBondContact O-N 3.14Å
280	L	58.2	Low	52	Low	43 Å²	43	61.8 Å²	61.8	23%	0.225	35%	0.346	C	S	.	.	H	α-helix	trans	-66.8	-36.6	174.7	-172.2	66.3	0	0	0	112.2	V276 V277 N282 L283 G284 L328 H586	V276-L280 WeakPolarHBondContact O-CB 3.23Å; V276-L280 PolarHBondContact O-N 3.1Å; V277-L280 PolarHBondContact O-N 3.37Å; V277-L280 VanDerWaalsContact O-N 3.15Å; L280-N282 VanDerWaalsContact C-N 3.33Å; L280-N282 PolarHBondContact O-N 3.26Å; L280-L283 PolarHBondContact O-N 3.01Å; L280-G284 PolarHBondContact O-N 3.47Å; L280-L328 HydrophobicContact CB-CD1 4.09Å; L280-L328 HydrophobicContact CD2-CD1 4.47Å; L280-L328 HydrophobicContact CD2-CD2 3.99Å; L280-L328 HydrophobicContact CG-CD1 4.38Å; L280-L328 HydrophobicContact CG-CD2 4.15Å; L280-H586 VanDerWaalsContact CD1-NE2 3.31Å; L280-H586 WeakPolarHBondContact CD1-NE2 3.19Å
281	A	58.4	Low	51.3	Low	5 Å²	5	66.7 Å²	66.7	4%	0.041	37%	0.368	C	S	.	.	H	α-helix	trans	-62.6	-39.3	171.7	0	0	0	0	0	112.1	V277 T278 G284 K285 L328	V277-A281 PolarHBondContact O-N 3.24Å; T278-A281 WeakPolarHBondContact O-CB 3.37Å; T278-A281 PolarHBondContact O-N 3.35Å; A281-G284 PolarHBondContact O-N 3.31Å; A281-K285 PolarHBondContact O-N 3.05Å; A281-L328 HydrophobicContact CB-CB 4.41Å; A281-L328 HydrophobicContact CB-CD1 3.63Å; A281-L328 HydrophobicContact CB-CG 3.86Å
282	N	52.7	Low	50.1	Low	85 Å²	85	74 Å²	74	46%	0.455	41%	0.406	S	S	.	.	H	α-helix	trans	-71.7	-34.5	177.7	-68.8	-21.6	0	0	0	112.3	T278 S279 L280 G284 K285 T286	T278-N282 PolarHBondContact O-N 3.29Å; T278-N282 VanDerWaalsContact O-N 3.1Å; T278-N282 PolarHBondContact O-ND2 3.25Å; S279-N282 PolarHBondContact O-N 3.49Å; L280-N282 VanDerWaalsContact C-N 3.33Å; L280-N282 PolarHBondContact O-N 3.26Å; N282-G284 VanDerWaalsContact C-N 3.34Å; N282-K285 PolarHBondContact O-N 3.32Å; N282-T286 PolarHBondContact O-N 3.45Å; N282-T286 PolarHBondContact O-OG1 3.29Å
283	L	51.2	Low	48.5	Very low	121 Å²	121	77.4 Å²	77.4	63%	0.634	43%	0.431	S	S	*	.	H	α-helix	trans	-66.9	-33.2	170.2	-106	99.7	0	0	0	112.8	S279 L280 T286	S279-L283 PolarHBondContact O-N 3.14Å; L280-L283 PolarHBondContact O-N 3.01Å; L283-T286 PolarHBondContact O-OG1 3.24Å
284	G	44.1	Very low	46.8	Very low	30 Å²	30	84.6 Å²	84.6	31%	0.309	47%	0.469	S	S	.	.	H	α-helix	trans	-62	-45.8	173.1	0	0	0	0	0	112.2	L280 A281 N282 T286 K287 D288	L280-G284 PolarHBondContact O-N 3.47Å; A281-G284 PolarHBondContact O-N 3.31Å; N282-G284 VanDerWaalsContact C-N 3.34Å; G284-T286 VanDerWaalsContact C-N 3.3Å; G284-T286 PolarHBondContact O-N 3.48Å; G284-K287 PolarHBondContact O-N 3.2Å; G284-K287 VanDerWaalsContact O-N 3.16Å; G284-D288 PolarHBondContact O-N 3.01Å
285	K	46.2	Very low	45.1	Very low	108 Å²	108	93.4 Å²	93.4	47%	0.47	51%	0.508	S	S	.	.	H	α-helix	trans	-63.9	-30.1	-179.9	-71.4	176.8	-177.8	174.6	0	114.2	A281 N282 K287 L289	A281-K285 PolarHBondContact O-N 3.05Å; N282-K285 PolarHBondContact O-N 3.32Å; K285-K287 VanDerWaalsContact C-N 3.34Å; K285-L289 PolarHBondContact O-N 3.42Å
286	T	37.2	Very low	43.3	Very low	103 Å²	103	100.5 Å²	100.5	63%	0.632	54%	0.54	S	S	*	.	H	α-helix	trans	-77.2	-21.2	178.2	48.6	0	0	0	0	113	N282 L283 G284	N282-T286 PolarHBondContact O-N 3.45Å; N282-T286 PolarHBondContact O-OG1 3.29Å; L283-T286 PolarHBondContact O-OG1 3.24Å; G284-T286 VanDerWaalsContact C-N 3.3Å; G284-T286 PolarHBondContact O-N 3.48Å
287	K	35.1	Very low	41.7	Very low	175 Å²	175	105.1 Å²	105.1	76%	0.761	57%	0.573	S	S	*	*	H	α-helix	trans	-76.3	-33.9	172	-117.2	177.1	178.2	178.6	0	112.4	G284 K285 S290	G284-K287 PolarHBondContact O-N 3.2Å; G284-K287 VanDerWaalsContact O-N 3.16Å; K285-K287 VanDerWaalsContact C-N 3.34Å; K287-S290 PolarHBondContact O-OG 3.46Å
288	D	34.9	Very low	39.9	Very low	127 Å²	127	113.3 Å²	113.3	68%	0.679	61%	0.613	S	S	*	*	H	α-helix	trans	-82.9	-9.4	179.7	-66.7	-28.5	0	0	0	113.9	G284 S290	G284-D288 PolarHBondContact O-N 3.01Å; D288-S290 VanDerWaalsContact C-N 3.34Å; D288-S290 PolarHBondContact O-N 3.28Å
289	L	35.6	Very low	38	Very low	155 Å²	155	118.9 Å²	118.9	81%	0.812	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	15.6	179.5	-132.5	75.4	0	0	0	114.6	K285	K285-L289 PolarHBondContact O-N 3.42Å
290	S	32.6	Very low	36.2	Very low	99 Å²	99	125.3 Å²	125.3	69%	0.692	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	0.5	175	66.1	0	0	0	0	114.2	K287 D288	K287-S290 PolarHBondContact O-OG 3.46Å; D288-S290 VanDerWaalsContact C-N 3.34Å; D288-S290 PolarHBondContact O-N 3.28Å
291	Q	35.4	Very low	34.8	Very low	162 Å²	162	128.2 Å²	128.2	76%	0.757	69%	0.689	S	S	*	*	S	Bend	trans	-140.5	130.9	171.9	-67.8	-175.7	-6.9	0	0	110.7
292	N	26.2	Very low	33.3	Very low	166 Å²	166	136.1 Å²	136.1	89%	0.888	73%	0.729	S	S	*	*			trans	86.8	85	175.2	-57.1	-22.1	0	0	0	117.4
293	S	27.4	Very low	31.9	Very low	104 Å²	104	137.6 Å²	137.6	73%	0.727	75%	0.747	S	S	*	*			trans	-85.4	147.9	152.5	54.4	0	0	0	0	111.3
294	N	28.1	Very low	30.9	Very low	152 Å²	152	139.1 Å²	139.1	81%	0.813	76%	0.755	S	S	*	*			trans	98.9	99.2	168.6	-58.8	-9.7	0	0	0	115.6
295	E	24.6	Very low	30.1	Very low	199 Å²	199	145.7 Å²	145.7	93%	0.93	78%	0.783	S	S	*	*				-172.7	155.7	89.1	-97.6	-163.8	149.9	0	0	111.5
296	M	25.7	Very low	29.1	Very low	178 Å²	178	147.4 Å²	147.4	88%	0.877	80%	0.798	S	S	*	*			trans	-114.4	133.1	-175.2	167.7	90.5	79.1	0	0	108.1
297	S	27.1	Very low	28.5	Very low	107 Å²	107	149.4 Å²	149.4	75%	0.748	81%	0.81	S	S	*	*			trans	165.1	124.9	133.6	58.9	0	0	0	0	114.6
298	M	26.5	Very low	28	Very low	175 Å²	175	146.3 Å²	146.3	86%	0.862	81%	0.81	S	S	*	*				51.9	121.7	115.8	-125.8	179.3	-163.7	0	0	120.7
299	I	27.7	Very low	27.6	Very low	158 Å²	158	148.3 Å²	148.3	81%	0.81	82%	0.82	S	S	*	*				165.1	154	115.5	-79	160.4	0	0	0	112.2
300	E	26.3	Very low	27.1	Very low	179 Å²	179	147.2 Å²	147.2	84%	0.836	82%	0.824	S	S	*	*			trans	-65.1	165.4	-162.7	-65.4	164.2	129	0	0	120.6
301	S	28.8	Very low	26.8	Very low	105 Å²	105	151.2 Å²	151.2	73%	0.734	83%	0.832	S	S	*	*			trans	-40.8	152.4	165.7	-45	0	0	0	0	118.3
302	L	25.2	Very low	26.3	Very low	170 Å²	170	153.3 Å²	153.3	89%	0.89	84%	0.839	S	S	*	*				163.9	122.3	115.8	-84.1	173.2	0	0	0	111.4
303	S	24.6	Very low	26.3	Very low	117 Å²	117	154.8 Å²	154.8	82%	0.818	84%	0.84	S	S	*	*				163.3	123.2	120	65.7	0	0	0	0	111.7
304	N	29.3	Very low	26.1	Very low	152 Å²	152	156.7 Å²	156.7	81%	0.813	84%	0.838	S	S	*	*			trans	-72.7	146.1	167.8	-77.4	-14.8	0	0	0	111.1
305	D	26.9	Very low	26	Very low	169 Å²	169	157.7 Å²	157.7	90%	0.904	84%	0.84	S	S	*	*			trans	-150.9	129.9	134.1	-118	-9.6	0	0	0	109.9
306	D	24.9	Very low	26.2	Very low	144 Å²	144	157.6 Å²	157.6	77%	0.77	84%	0.839	S	S	*	*			trans	-75.9	143.2	-171.3	-75.4	-51.1	0	0	0	113
307	T	25.5	Very low	26.4	Very low	144 Å²	144	154.1 Å²	154.1	88%	0.883	83%	0.828	S	S	*	*			trans	-154.4	125.1	131	-49.2	0	0	0	0	109.5
308	S	24.7	Very low	26.7	Very low	111 Å²	111	152 Å²	152	78%	0.776	81%	0.809	S	S	*	*			trans	-68.3	136.8	-166.2	47.4	0	0	0	0	116.2
309	L	26.2	Very low	27.1	Very low	168 Å²	168	145.9 Å²	145.9	88%	0.88	79%	0.79	S	S	*	*			trans	-137.9	123.5	152.2	-98.6	166.6	0	0	0	108.1	E311	L309-E311 PolarHBondContact O-N 2.81Å
310	C	25.8	Very low	27.6	Very low	133 Å²	133	143.5 Å²	143.5	90%	0.899	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-61.3	123.3	-174.9	-71.2	0	0	0	0	113.1
311	E	25.3	Very low	28.3	Very low	183 Å²	183	138.1 Å²	138.1	86%	0.855	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-70.7	140.7	163.2	-66.3	173	141.6	0	0	110.9	L309	L309-E311 PolarHBondContact O-N 2.81Å
312	F	26.2	Very low	28.9	Very low	205 Å²	205	136.7 Å²	136.7	90%	0.899	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-90.7	125.2	147.1	-82.7	-83.5	0	0	0	107	E314	F312-E314 PolarHBondContact O-N 3Å; F312-E314 VanDerWaalsContact O-N 3.14Å
313	Q	24.6	Very low	29.8	Very low	198 Å²	198	135.9 Å²	135.9	93%	0.925	73%	0.733	S	S	*	*			trans	-63	103.4	-171.7	-165.9	160.8	1	0	0	111.8
314	E	24.9	Very low	30.7	Very low	144 Å²	144	130.8 Å²	130.8	67%	0.673	70%	0.698	S	S	*	*			trans	-84.7	122.3	167.5	-81.3	-166.3	143.1	0	0	110.3	F312 Q316 N318	F312-E314 PolarHBondContact O-N 3Å; F312-E314 VanDerWaalsContact O-N 3.14Å; E314-Q316 PolarHBondContact O-N 3.23Å; E314-N318 PolarHBondContact OE1-ND2 3.21Å
315	M	25.6	Very low	31.7	Very low	173 Å²	173	124.3 Å²	124.3	85%	0.852	66%	0.663	S	S	*	*			trans	-74	93	174	-154.5	169.3	90.6	0	0	109.4	T317	M315-T317 VanDerWaalsContact C-N 3.32Å; M315-T317 PolarHBondContact O-N 3.24Å; M315-T317 PolarHBondContact O-OG1 2.83Å
316	Q	29.3	Very low	32.8	Very low	196 Å²	196	120.8 Å²	120.8	92%	0.916	64%	0.644	S	S	*	*	S	Bend	trans	23.8	46.8	144.3	-132.4	138.6	26.8	0	0	120.3	E314	E314-Q316 PolarHBondContact O-N 3.23Å
317	T	28.6	Very low	34.2	Very low	105 Å²	105	116.5 Å²	116.5	64%	0.644	62%	0.623	S	S	*	*	S	Bend	trans	-140.6	-14.7	160.2	53.2	0	0	0	0	113.3	M315 G319	M315-T317 VanDerWaalsContact C-N 3.32Å; M315-T317 PolarHBondContact O-N 3.24Å; M315-T317 PolarHBondContact O-OG1 2.83Å; T317-G319 PolarHBondContact O-N 3Å
318	N	34.5	Very low	35.3	Very low	64 Å²	64	110 Å²	110	34%	0.342	58%	0.583	S	S	.	*	H	α-helix	trans	-74	-19.9	-175.9	-77.1	-6.1	0	0	0	115.1	E314	E314-N318 PolarHBondContact OE1-ND2 3.21Å
319	G	34.8	Very low	36.3	Very low	45 Å²	45	105.7 Å²	105.7	46%	0.464	56%	0.555	S	S	.	*	H	α-helix	trans	-71.5	-30.9	-173.7	0	0	0	0	0	114.6	T317 R323	T317-G319 PolarHBondContact O-N 3Å; G319-R323 VanDerWaalsContact O-CB 3.3Å; G319-R323 WeakPolarHBondContact O-CB 2.82Å
320	D	37	Very low	37.4	Very low	109 Å²	109	105.7 Å²	105.7	58%	0.583	55%	0.547	S	S	*	.	H	α-helix	trans	-89.3	-30.2	-172	-67	-33.7	0	0	0	112.8	R323 A324	D320-R323 IonicContact OD1-CZ 3.72Å; D320-R323 IonicContact OD1-NH1 2.83Å; D320-R323 PolarHBondContact OD1-NH1 3.33Å; D320-A324 WeakPolarHBondContact O-CB 3.31Å; D320-A324 PolarHBondContact O-N 3.08Å
321	V	41.4	Very low	38.4	Very low	65 Å²	65	102.6 Å²	102.6	39%	0.394	53%	0.531	S	S	.	.	H	α-helix	trans	-69.8	-52.6	177.7	175.8	0	0	0	0	110.6	R323 A324 F325	V321-R323 VanDerWaalsContact C-N 3.26Å; V321-R323 PolarHBondContact O-N 3.46Å; V321-A324 WeakPolarHBondContact O-CB 3.37Å; V321-A324 PolarHBondContact O-N 3.47Å; V321-A324 VanDerWaalsContact O-N 3.1Å; V321-F325 HydrophobicContact CG1-CD2 3.78Å; V321-F325 HydrophobicContact CG1-CE2 3.32Å; V321-F325 HydrophobicContact CG1-CZ 4.43Å; V321-F325 WeakPolarHBondContact O-CD2 3.44Å; V321-F325 PolarHBondContact O-N 2.89Å; V321-F325 VanDerWaalsContact O-N 3.11Å
322	S	41.8	Very low	39	Very low	76 Å²	76	97.5 Å²	97.5	53%	0.531	51%	0.509	S	S	.	.	H	α-helix	trans	-58.7	-36.4	175.9	-66.6	0	0	0	0	112.6	F325 D326	S322-F325 PolarHBondContact O-N 3.09Å; S322-D326 PolarHBondContact O-N 3.35Å
323	R	44.2	Very low	39.7	Very low	152 Å²	152	93.4 Å²	93.4	57%	0.574	50%	0.497	S	S	*	.	H	α-helix	trans	-69.6	-34.5	176.6	-165	-172.9	-63	137.8	1.9	112.7	G319 D320 V321 T327	G319-R323 VanDerWaalsContact O-CB 3.3Å; G319-R323 WeakPolarHBondContact O-CB 2.82Å; D320-R323 IonicContact OD1-CZ 3.72Å; D320-R323 IonicContact OD1-NH1 2.83Å; D320-R323 PolarHBondContact OD1-NH1 3.33Å; V321-R323 VanDerWaalsContact C-N 3.26Å; V321-R323 PolarHBondContact O-N 3.46Å; R323-T327 PolarHBondContact O-N 3.19Å; R323-T327 VanDerWaalsContact O-N 3.14Å; R323-T327 PolarHBondContact O-OG1 3.31Å
324	A	43.6	Very low	40.2	Very low	11 Å²	11	89.6 Å²	89.6	9%	0.091	49%	0.489	C	S	.	.	H	α-helix	trans	-66.5	-41.6	174.4	0	0	0	0	0	111.6	T278 D320 V321 T327 L328	T278-A324 HydrophobicContact CG2-CB 4.35Å; D320-A324 WeakPolarHBondContact O-CB 3.31Å; D320-A324 PolarHBondContact O-N 3.08Å; V321-A324 WeakPolarHBondContact O-CB 3.37Å; V321-A324 PolarHBondContact O-N 3.47Å; V321-A324 VanDerWaalsContact O-N 3.1Å; A324-T327 PolarHBondContact O-N 2.97Å; A324-L328 PolarHBondContact O-N 2.9Å
325	F	49.3	Very low	40.6	Very low	15 Å²	15	86.2 Å²	86.2	7%	0.066	49%	0.494	C	S	.	.	H	α-helix	trans	-64.3	-43.3	174.9	-72.8	-70.3	0	0	0	113	A274 V277 V321 S322 T327 L328 A329 L574 I575 I578	A274-F325 HydrophobicContact CB-CE2 4.35Å; A274-F325 HydrophobicContact CB-CZ 3.85Å; V277-F325 HydrophobicContact CB-CD1 4.17Å; V277-F325 HydrophobicContact CB-CE1 3.5Å; V277-F325 HydrophobicContact CB-CZ 4.28Å; V277-F325 HydrophobicContact CG1-CD1 3.38Å; V277-F325 HydrophobicContact CG1-CE1 3.24Å; V277-F325 HydrophobicContact CG1-CZ 4.34Å; V277-F325 HydrophobicContact CG2-CE1 4.04Å; V321-F325 HydrophobicContact CG1-CD2 3.78Å; V321-F325 HydrophobicContact CG1-CE2 3.32Å; V321-F325 HydrophobicContact CG1-CZ 4.43Å; V321-F325 WeakPolarHBondContact O-CD2 3.44Å; V321-F325 PolarHBondContact O-N 2.89Å; V321-F325 VanDerWaalsContact O-N 3.11Å; S322-F325 PolarHBondContact O-N 3.09Å; F325-T327 VanDerWaalsContact C-N 3.3Å; F325-T327 PolarHBondContact O-N 2.75Å; F325-L328 PolarHBondContact O-N 3.44Å; F325-A329 PolarHBondContact O-N 3.04Å; F325-L574 WeakPolarHBondContact CE2-O 3.43Å; F325-L574 WeakPolarHBondContact CZ-O 3.27Å; F325-I575 WeakPolarHBondContact CD1-O 3.5Å; F325-I575 HydrophobicContact CE1-CB 4.06Å; F325-I575 HydrophobicContact CE1-CG2 4.1Å; F325-I578 HydrophobicContact CD1-CD1 3.79Å; F325-I578 HydrophobicContact CE1-CD1 4.47Å
326	D	50	Low	41	Very low	96 Å²	96	87.3 Å²	87.3	51%	0.513	50%	0.496	S	S	.	.	H	α-helix	trans	-63.6	-34.8	176.4	-82.9	-18.2	0	0	0	112.8	S322 L328 K330	S322-D326 PolarHBondContact O-N 3.35Å; D326-L328 VanDerWaalsContact C-N 3.34Å; D326-K330 WeakPolarHBondContact O-CG 3.26Å; D326-K330 PolarHBondContact O-N 3.19Å
327	T	54.3	Low	40.8	Very low	53 Å²	53	83.1 Å²	83.1	33%	0.325	49%	0.489	S	S	.	.	H	α-helix	trans	-67	-38.5	176.2	-55.1	0	0	0	0	111.2	R323 A324 F325 A331	R323-T327 PolarHBondContact O-N 3.19Å; R323-T327 VanDerWaalsContact O-N 3.14Å; R323-T327 PolarHBondContact O-OG1 3.31Å; A324-T327 PolarHBondContact O-N 2.97Å; F325-T327 VanDerWaalsContact C-N 3.3Å; F325-T327 PolarHBondContact O-N 2.75Å; T327-A331 PolarHBondContact O-N 3.5Å; T327-A331 VanDerWaalsContact O-N 3.12Å
328	L	49.1	Very low	40.6	Very low	7 Å²	7	85 Å²	85	4%	0.037	50%	0.5	C	S	.	.	H	α-helix	trans	-74	-38.8	178.7	-122.8	167.7	0	0	0	113	V277 L280 A281 A324 F325 D326 K330 A331 L332 I578	V277-L328 HydrophobicContact CB-CD1 4.4Å; V277-L328 HydrophobicContact CG1-CD1 3.33Å; V277-L328 WeakPolarHBondContact O-CD1 3.48Å; L280-L328 HydrophobicContact CB-CD1 4.09Å; L280-L328 HydrophobicContact CD2-CD1 4.47Å; L280-L328 HydrophobicContact CD2-CD2 3.99Å; L280-L328 HydrophobicContact CG-CD1 4.38Å; L280-L328 HydrophobicContact CG-CD2 4.15Å; A281-L328 HydrophobicContact CB-CB 4.41Å; A281-L328 HydrophobicContact CB-CD1 3.63Å; A281-L328 HydrophobicContact CB-CG 3.86Å; A324-L328 PolarHBondContact O-N 2.9Å; F325-L328 PolarHBondContact O-N 3.44Å; D326-L328 VanDerWaalsContact C-N 3.34Å; L328-K330 PolarHBondContact O-N 3.25Å; L328-A331 PolarHBondContact O-N 3.22Å; L328-A331 VanDerWaalsContact O-N 3.16Å; L328-L332 HydrophobicContact CD2-CD1 3.6Å; L328-L332 HydrophobicContact CD2-CG 3.91Å; L328-L332 WeakPolarHBondContact O-CB 3.48Å; L328-L332 WeakPolarHBondContact O-CG 3.3Å; L328-L332 PolarHBondContact O-N 2.93Å; L328-I578 HydrophobicContact CB-CD1 4Å; L328-I578 HydrophobicContact CD1-CD1 4.28Å
329	A	45.9	Very low	40.2	Very low	22 Å²	22	86.2 Å²	86.2	18%	0.182	52%	0.519	C	S	.	.	H	α-helix	trans	-61	-35.4	174.4	0	0	0	0	0	111.9	F325 N333	F325-A329 PolarHBondContact O-N 3.04Å; A329-N333 PolarHBondContact O-N 3.17Å
330	K	49.5	Very low	39.6	Very low	167 Å²	167	90.3 Å²	90.3	73%	0.726	54%	0.54	S	S	*	.	H	α-helix	trans	-71.4	-36.3	172.7	-73.9	175.6	-178.3	175.4	0	113.1	D326 L328	D326-K330 WeakPolarHBondContact O-CG 3.26Å; D326-K330 PolarHBondContact O-N 3.19Å; L328-K330 PolarHBondContact O-N 3.25Å
331	A	45.7	Very low	39	Very low	68 Å²	68	94 Å²	94	56%	0.562	55%	0.553	S	S	*	*	H	α-helix	trans	-71.7	-28.6	177.6	0	0	0	0	0	113.3	T327 L328	T327-A331 PolarHBondContact O-N 3.5Å; T327-A331 VanDerWaalsContact O-N 3.12Å; L328-A331 PolarHBondContact O-N 3.22Å; L328-A331 VanDerWaalsContact O-N 3.16Å
332	L	38.3	Very low	38.1	Very low	76 Å²	76	96.8 Å²	96.8	40%	0.398	58%	0.575	S	S	.	*	H	α-helix	trans	-90.1	-13.2	-177.4	-68.8	172.2	0	0	0	114.5	L328	L328-L332 HydrophobicContact CD2-CD1 3.6Å; L328-L332 HydrophobicContact CD2-CG 3.91Å; L328-L332 WeakPolarHBondContact O-CB 3.48Å; L328-L332 WeakPolarHBondContact O-CG 3.3Å; L328-L332 PolarHBondContact O-N 2.93Å
333	N	40.8	Very low	37.2	Very low	120 Å²	120	98.1 Å²	98.1	64%	0.642	59%	0.585	S	S	*	*			trans	-134.2	83.2	177.7	-68.2	-54.6	0	0	0	111.3	A329 G335	A329-N333 PolarHBondContact O-N 3.17Å; N333-G335 PolarHBondContact O-N 3.05Å
334	P	36.8	Very low	36.3	Very low	117 Å²	117	97.1 Å²	97.1	76%	0.76	60%	0.595	S	S	*	*			trans	-71.9	110.9	168	28.6	-29.7	0	0	0	108.8
335	G	33	Very low	35.4	Very low	74 Å²	74	101.5 Å²	101.5	76%	0.763	63%	0.631	S	S	*	*			trans	-63.7	142.7	179.3	0	0	0	0	0	113.1	N333 S337	N333-G335 PolarHBondContact O-N 3.05Å; G335-S337 PolarHBondContact O-N 2.94Å
336	E	33	Very low	34.1	Very low	195 Å²	195	104.6 Å²	104.6	91%	0.911	67%	0.668	S	S	*	*			trans	-53.6	122.1	171.3	-66.6	175.3	137.9	0	0	111.8
337	S	24.4	Very low	32.9	Very low	109 Å²	109	108.5 Å²	108.5	76%	0.762	69%	0.685	S	S	*	*			trans	-176.4	138.2	131.4	21.9	0	0	0	0	113.5	G335	G335-S337 PolarHBondContact O-N 2.94Å
338	T	25.6	Very low	31.5	Very low	144 Å²	144	115.4 Å²	115.4	88%	0.883	71%	0.714	S	S	*	*			trans	97.9	122.2	155.3	-16.7	0	0	0	0	118.8
339	A	25.4	Very low	30.2	Very low	89 Å²	89	118.7 Å²	118.7	74%	0.736	75%	0.749	S	S	*	*			trans	-68.7	151.7	-176.2	0	0	0	0	0	114.9
340	C	22	Very low	29.1	Very low	132 Å²	132	123.3 Å²	123.3	89%	0.892	78%	0.78	S	S	*	*				-172.1	152.6	124.8	-99.1	0	0	0	0	113.1
341	Q	25.3	Very low	28	Very low	187 Å²	187	121.4 Å²	121.4	87%	0.874	78%	0.782	S	S	*	*			trans	-71.6	151.5	-175.2	-61.7	162.4	-13.9	0	0	113.1
342	S	22.5	Very low	27.1	Very low	122 Å²	122	127.2 Å²	127.2	85%	0.853	80%	0.797	S	S	*	*				174.8	149.3	114.8	54.4	0	0	0	0	112.8
343	S	23.4	Very low	26.6	Very low	104 Å²	104	131.3 Å²	131.3	73%	0.727	82%	0.818	S	S	*	*			trans	-79.3	155.7	-177	46.3	0	0	0	0	115
344	V	24.5	Very low	26.4	Very low	132 Å²	132	133.1 Å²	133.1	80%	0.8	83%	0.826	S	S	*	*				162.9	126.3	111.2	164.7	0	0	0	0	112.3
345	A	24.2	Very low	26	Very low	102 Å²	102	134.3 Å²	134.3	84%	0.843	83%	0.832	S	S	*	*			trans	34.3	134.5	145.1	0	0	0	0	0	124.2
346	G	23.3	Very low	25.5	Very low	81 Å²	81	134 Å²	134	84%	0.835	83%	0.829	S	S	*	*			trans	-171.2	89.6	156.8	0	0	0	0	0	111.1
347	M	24.4	Very low	25.4	Very low	177 Å²	177	132.7 Å²	132.7	87%	0.872	83%	0.828	S	S	*	*			trans	-71.8	136.1	178.3	-179.9	105.4	90.5	0	0	111.3
348	E	23.9	Very low	25.5	Very low	199 Å²	199	132.6 Å²	132.6	93%	0.93	83%	0.827	S	S	*	*			trans	-162.9	121.7	132.4	-110.5	175.2	-157.2	0	0	110.8
349	G	22.5	Very low	25.8	Very low	75 Å²	75	130.2 Å²	130.2	77%	0.773	82%	0.817	S	S	*	*			trans	-96.4	145.6	179.5	0	0	0	0	0	111.8
350	S	23.7	Very low	26.5	Very low	120 Å²	120	130.4 Å²	130.4	84%	0.839	81%	0.805	S	S	*	*			trans	-133.5	118.9	151.5	61.1	0	0	0	0	109.1
351	V	26.4	Very low	27	Very low	126 Å²	126	131.1 Å²	131.1	76%	0.764	80%	0.799	S	S	*	*			trans	-84.1	126	174.4	169.7	0	0	0	0	107.3
352	H	25.1	Very low	28.1	Very low	191 Å²	191	126.9 Å²	126.9	88%	0.884	78%	0.776	S	S	*	*			trans	-134.5	125.4	156	-107	-63.7	0	0	0	111.4
353	L	27.7	Very low	29.5	Very low	161 Å²	161	124.6 Å²	124.6	84%	0.843	76%	0.757	S	S	*	*			trans	-68.5	147.6	-178	-83.9	136.3	0	0	0	113.3
354	I	37.4	Very low	30.8	Very low	158 Å²	158	128.4 Å²	128.4	81%	0.81	76%	0.764	S	S	*	*			trans	-56	135.1	170.1	-62.3	165.1	0	0	0	111.5
355	T	27.9	Very low	32.2	Very low	142 Å²	142	126.7 Å²	126.7	87%	0.871	75%	0.745	S	S	*	*				167.5	121.3	126	-60	0	0	0	0	109.9
356	G	24	Very low	33.3	Very low	69 Å²	69	131.3 Å²	131.3	71%	0.711	75%	0.749	S	S	*	*			trans	150.2	115.3	163.6	0	0	0	0	0	113.6	S358	G356-S358 PolarHBondContact O-N 3.24Å
357	D	29.2	Very low	35.3	Very low	167 Å²	167	129.4 Å²	129.4	89%	0.893	73%	0.73	S	S	*	*			trans	-21.6	110.6	172.9	-81.6	-38.3	0	0	0	115.5	S359	D357-S359 PolarHBondContact O-N 3.42Å
358	S	27.7	Very low	37.7	Very low	106 Å²	106	125.5 Å²	125.5	74%	0.741	72%	0.718	S	S	*	*			trans	-85.3	92.6	155.7	69.7	0	0	0	0	107.9	G356 I360	G356-S358 PolarHBondContact O-N 3.24Å; S358-I360 VanDerWaalsContact C-N 3.31Å; S358-I360 PolarHBondContact O-N 2.88Å
359	S	31.9	Very low	40.5	Very low	95 Å²	95	116.1 Å²	116.1	66%	0.664	67%	0.674	S	S	*	*			trans	-55.3	102.3	155.6	50	0	0	0	0	107.4	D357 N361	D357-S359 PolarHBondContact O-N 3.42Å; S359-N361 PolarHBondContact O-N 2.94Å
360	I	38.9	Very low	43.5	Very low	93 Å²	93	113.1 Å²	113.1	48%	0.477	64%	0.64	S	S	.	*			trans	-58.2	110.8	171	-61.7	169.6	0	0	0	105.4	S358 Y362	S358-I360 VanDerWaalsContact C-N 3.31Å; S358-I360 PolarHBondContact O-N 2.88Å; I360-Y362 HydrophobicContact CB-CE1 4.45Å; I360-Y362 HydrophobicContact CB-CE2 4.19Å; I360-Y362 HydrophobicContact CG2-CD1 4.15Å; I360-Y362 HydrophobicContact CG2-CE1 3.94Å; I360-Y362 HydrophobicContact CG2-CE2 4.44Å; I360-Y362 HydrophobicContact CG2-CG 4.49Å; I360-Y362 VanDerWaalsContact O-CD2 3.23Å; I360-Y362 WeakPolarHBondContact O-CD2 3.26Å; I360-Y362 PolarHBondContact O-N 3.39Å
361	N	33.5	Very low	46.2	Very low	146 Å²	146	109.9 Å²	109.9	78%	0.781	62%	0.617	S	S	*	*			trans	-66.6	88.4	172.8	-81.9	-27.1	0	0	0	107.5	S359 T363	S359-N361 PolarHBondContact O-N 2.94Å; N361-T363 PolarHBondContact O-N 3.5Å
362	Y	47.8	Very low	48.6	Very low	98 Å²	98	109.4 Å²	109.4	38%	0.384	61%	0.611	S	S	.	*			trans	-65	120.8	171.8	-62.9	-76.6	0	0	0	108.1	I360 E364 E520 K524	I360-Y362 HydrophobicContact CB-CE1 4.45Å; I360-Y362 HydrophobicContact CB-CE2 4.19Å; I360-Y362 HydrophobicContact CG2-CD1 4.15Å; I360-Y362 HydrophobicContact CG2-CE1 3.94Å; I360-Y362 HydrophobicContact CG2-CE2 4.44Å; I360-Y362 HydrophobicContact CG2-CG 4.49Å; I360-Y362 VanDerWaalsContact O-CD2 3.23Å; I360-Y362 WeakPolarHBondContact O-CD2 3.26Å; I360-Y362 PolarHBondContact O-N 3.39Å; Y362-E364 PolarHBondContact O-N 3.32Å; Y362-E520 PolarHBondContact OH-OE2 2.94Å; Y362-K524 HydrophobicContact CD1-CD 4.43Å; Y362-K524 VanDerWaalsContact CD1-NZ 3.32Å
363	T	52.7	Low	50.9	Low	75 Å²	75	104.4 Å²	104.4	46%	0.46	60%	0.597	S	S	.	*			trans	-72.9	80	171.9	-39.8	0	0	0	0	108.5	N361 K365 A417	N361-T363 PolarHBondContact O-N 3.5Å; T363-K365 PolarHBondContact O-N 3.07Å; T363-A417 HydrophobicContact CG2-CB 4.24Å
364	E	49.1	Very low	53.5	Low	184 Å²	184	97.2 Å²	97.2	86%	0.86	56%	0.559	S	S	*	*			trans	-72.7	93	173.8	-164.2	168.4	-153.2	0	0	108	Y362 E366	Y362-E364 PolarHBondContact O-N 3.32Å; E364-E366 PolarHBondContact O-N 3.07Å
365	K	54.1	Low	55.6	Low	95 Å²	95	90.9 Å²	90.9	41%	0.413	53%	0.528	S	S	.	.			trans	-77.8	107.7	174.7	-136.3	176.9	-169.9	163.1	0	108.3	T363 P413 K528	T363-K365 PolarHBondContact O-N 3.07Å; K365-P413 HydrophobicContact CD-CB 3.68Å; K365-P413 VanDerWaalsContact NZ-CB 3.3Å; K365-P413 PolarHBondContact NZ-O 3.07Å; K365-K528 PolarHBondContact O-NZ 3.42Å; K365-K528 VanDerWaalsContact O-NZ 3.17Å
366	E	47.6	Very low	57.8	Low	199 Å²	199	87.2 Å²	87.2	93%	0.93	51%	0.512	S	S	*	.			trans	-65.9	127.7	175.5	-159.7	171.1	-168.6	0	0	109.7	E364	E364-E366 PolarHBondContact O-N 3.07Å
367	G	66.6	Low	60.6	Low	42 Å²	42	84.7 Å²	84.7	43%	0.433	48%	0.481	S	S	.	.	S	Bend	trans	124	170.8	-175.8	0	0	0	0	0	114.3	K528	G367-K528 VanDerWaalsContact O-CE 3.29Å; G367-K528 WeakPolarHBondContact O-CE 3.24Å; G367-K528 PolarHBondContact O-NZ 3.11Å
368	P	75	Confident	62.9	Low	95 Å²	95	87 Å²	87	62%	0.617	48%	0.477	S	S	*	.			trans	-64.7	146.9	178.5	28.3	-34.5	0	0	0	111.1	L370 E532	P368-L370 VanDerWaalsContact C-N 3.28Å; P368-L370 PolarHBondContact O-N 2.87Å; P368-E532 WeakPolarHBondContact CA-OE1 3.48Å
369	L	81.9	Confident	65.4	Low	2 Å²	2	82.6 Å²	82.6	1%	0.01	45%	0.446	C	S	.	.	S	Bend	trans	-63.6	-38.3	178.7	-175.5	68.3	0	0	0	111.4	I412 S414 A505 F509 K528 A529 E532	L369-I412 HydrophobicContact CD1-CG2 4.49Å; L369-S414 VanDerWaalsContact CD1-OG 3.25Å; L369-S414 WeakPolarHBondContact CD1-OG 3.45Å; L369-A505 HydrophobicContact CD2-CB 4.37Å; L369-F509 HydrophobicContact CD1-CE2 4.29Å; L369-F509 HydrophobicContact CD2-CD2 4.35Å; L369-F509 HydrophobicContact CD2-CE2 4.12Å; L369-K528 HydrophobicContact CB-CD 4.37Å; L369-K528 HydrophobicContact CB-CG 4.37Å; L369-A529 HydrophobicContact CD2-CB 3.4Å; L369-A529 VanDerWaalsContact CD2-CB 3.4Å; L369-E532 WeakPolarHBondContact CB-OE2 3.32Å; L369-E532 VanDerWaalsContact N-CD 3.35Å; L369-E532 PolarHBondContact N-OE1 3.39Å; L369-E532 PolarHBondContact N-OE2 3.36Å
370	L	84.8	Confident	67.5	Low	12 Å²	12	82.1 Å²	82.1	6%	0.063	44%	0.439	C	S	.	.	S	Bend	trans	-121.4	133.4	179.1	-58.8	176.5	0	0	0	110	P368 H374 W408 I412 A501 Y502 A505	P368-L370 VanDerWaalsContact C-N 3.28Å; P368-L370 PolarHBondContact O-N 2.87Å; L370-H374 HydrophobicContact CB-CB 4.42Å; L370-H374 HydrophobicContact CD2-CB 4.17Å; L370-W408 HydrophobicContact CD2-CZ2 4.34Å; L370-I412 HydrophobicContact CD2-CD1 3.85Å; L370-I412 HydrophobicContact CD2-CG1 3.92Å; L370-A501 HydrophobicContact CD1-CB 3.91Å; L370-Y502 HydrophobicContact CD1-CD1 3.78Å; L370-Y502 HydrophobicContact CD1-CE1 3.91Å; L370-Y502 HydrophobicContact CD1-CG 4.29Å; L370-Y502 HydrophobicContact CG-CE1 4.47Å; L370-A505 HydrophobicContact CD1-CB 4.16Å
371	S	80.1	Confident	69.2	Low	51 Å²	51	79.4 Å²	79.4	36%	0.357	43%	0.425	S	S	.	.			trans	-94.9	164.3	166.3	57.8	0	0	0	0	111.6	S373 H374	S371-S373 PolarHBondContact O-N 3.31Å; S371-S373 PolarHBondContact OG-OG 3.41Å; S371-H374 PolarHBondContact N-ND1 3.49Å; S371-H374 VanDerWaalsContact N-ND1 3.19Å; S371-H374 WeakPolarHBondContact O-CB 3.28Å; S371-H374 PolarHBondContact O-N 3.33Å; S371-H374 PolarHBondContact O-ND1 2.95Å; S371-H374 PolarHBondContact OG-CE1 3.48Å; S371-H374 PolarHBondContact OG-ND1 3.44Å
372	D	78	Confident	70.8	Confident	117 Å²	117	73.1 Å²	73.1	63%	0.626	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-53.4	-26.8	178.7	-61	-8.8	0	0	0	113.7	H374 V375 Y498	D372-H374 PolarHBondContact O-N 2.92Å; D372-V375 WeakPolarHBondContact O-CB 3.18Å; D372-V375 PolarHBondContact O-N 3.2Å; D372-Y498 PolarHBondContact OD1-OH 3.33Å
373	S	73.5	Confident	71.1	Confident	85 Å²	85	74 Å²	74	59%	0.594	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-63.2	-27.6	173.9	57.5	0	0	0	0	113.6	S371 V375	S371-S373 PolarHBondContact O-N 3.31Å; S371-S373 PolarHBondContact OG-OG 3.41Å; S373-V375 VanDerWaalsContact C-N 3.3Å
374	H	82.7	Confident	71.1	Confident	10 Å²	10	75.9 Å²	75.9	5%	0.046	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-81.1	-11.6	179.3	-59	90.1	0	0	0	113.1	L370 S371 D372 W408 S411	L370-H374 HydrophobicContact CB-CB 4.42Å; L370-H374 HydrophobicContact CD2-CB 4.17Å; S371-H374 PolarHBondContact N-ND1 3.49Å; S371-H374 VanDerWaalsContact N-ND1 3.19Å; S371-H374 WeakPolarHBondContact O-CB 3.28Å; S371-H374 PolarHBondContact O-N 3.33Å; S371-H374 PolarHBondContact O-ND1 2.95Å; S371-H374 PolarHBondContact OG-CE1 3.48Å; S371-H374 PolarHBondContact OG-ND1 3.44Å; D372-H374 PolarHBondContact O-N 2.92Å; H374-W408 PolarHBondContact O-NE1 3.37Å; H374-S411 PolarHBondContact CD2-OG 3.15Å; H374-S411 VanDerWaalsContact NE2-C 3.33Å; H374-S411 PolarHBondContact NE2-O 3.35Å; H374-S411 VanDerWaalsContact NE2-O 3.15Å; H374-S411 PolarHBondContact NE2-OG 2.91Å
375	V	81.4	Confident	71.4	Confident	26 Å²	26	74.5 Å²	74.5	16%	0.158	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-31.6	175.5	-177	0	0	0	0	110.5	D372 S373 F377 Y498	D372-V375 WeakPolarHBondContact O-CB 3.18Å; D372-V375 PolarHBondContact O-N 3.2Å; S373-V375 VanDerWaalsContact C-N 3.3Å; V375-F377 PolarHBondContact O-N 3.39Å; V375-Y498 HydrophobicContact CG1-CD2 3.91Å; V375-Y498 HydrophobicContact CG1-CE2 3.99Å; V375-Y498 HydrophobicContact CG1-CG 4.17Å; V375-Y498 HydrophobicContact CG2-CD1 3.48Å; V375-Y498 VanDerWaalsContact CG2-CD1 3.48Å; V375-Y498 HydrophobicContact CG2-CD2 4.3Å; V375-Y498 HydrophobicContact CG2-CE1 3.4Å; V375-Y498 HydrophobicContact CG2-CE2 4.21Å; V375-Y498 HydrophobicContact CG2-CG 3.94Å
376	A	72.9	Confident	71.8	Confident	64 Å²	64	72.2 Å²	72.2	53%	0.529	42%	0.416	S	S	.	.			trans	-71.6	93.1	178.4	0	0	0	0	0	110.8
377	F	82.8	Confident	72	Confident	17 Å²	17	71.5 Å²	71.5	8%	0.075	41%	0.412	C	S	.	.			trans	-109.7	80.1	175.4	-162.3	-97.6	0	0	0	109.8	V375 L401 L404 W408 Q441 K504	V375-F377 PolarHBondContact O-N 3.39Å; F377-L401 HydrophobicContact CE1-CD1 3.63Å; F377-L401 HydrophobicContact CZ-CD1 3.87Å; F377-L404 HydrophobicContact CD1-CD2 4.06Å; F377-L404 HydrophobicContact CD2-CD2 4.24Å; F377-L404 HydrophobicContact CD2-CG 4.17Å; F377-L404 HydrophobicContact CE1-CD2 3.82Å; F377-L404 HydrophobicContact CE1-CG 4.39Å; F377-L404 HydrophobicContact CE2-CD2 4.02Å; F377-L404 HydrophobicContact CE2-CG 3.73Å; F377-L404 HydrophobicContact CG-CD2 4.27Å; F377-L404 HydrophobicContact CZ-CB 4.48Å; F377-L404 HydrophobicContact CZ-CD2 3.8Å; F377-L404 HydrophobicContact CZ-CG 3.85Å; F377-W408 HydrophobicContact CD2-CB 4.46Å; F377-W408 HydrophobicContact CD2-CG 4.33Å; F377-W408 HydrophobicContact CE2-CB 4.2Å; F377-W408 HydrophobicContact CE2-CG 4.37Å; F377-Q441 HydrophobicContact CD1-CG 4.38Å; F377-Q441 VanDerWaalsContact CG-OE1 3.32Å; F377-K504 VanDerWaalsContact CG-NZ 3.28Å; F377-K504 VanDerWaalsContact CZ-NZ 3.34Å
378	R	77.5	Confident	71.7	Confident	214 Å²	214	78.6 Å²	78.6	81%	0.808	43%	0.428	S	S	*	.			trans	-104.3	111.3	-174.8	-67.6	-173.1	180	-136.9	0.9	110.6
379	L	81.1	Confident	71.3	Confident	15 Å²	15	76.6 Å²	76.6	8%	0.079	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-86.5	126.5	171.9	-177.2	67.3	0	0	0	109.9	M381 R400 L401 L404 C442 M446	L379-M381 HydrophobicContact CD2-SD 3.81Å; L379-M381 HydrophobicContact CG-SD 4.27Å; L379-R400 HydrophobicContact CD1-CB 3.85Å; L379-L401 HydrophobicContact CD1-CB 4.19Å; L379-L401 HydrophobicContact CD2-CB 4.31Å; L379-L404 HydrophobicContact CB-CD2 4.22Å; L379-L404 HydrophobicContact CD1-CD2 4.35Å; L379-C442 HydrophobicContact CD2-CB 4.2Å; L379-M446 HydrophobicContact CD2-CG 3.37Å; L379-M446 HydrophobicContact CD2-SD 3.53Å; L379-M446 VanDerWaalsContact CD2-SD 3.53Å
380	T	75.2	Confident	70.9	Confident	84 Å²	84	80.9 Å²	80.9	52%	0.515	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-95.8	119.3	170.9	-52.3	0	0	0	0	108.7	R400	T380-R400 WeakPolarHBondContact O-CD 3.38Å
381	M	74.8	Confident	70.4	Confident	37 Å²	37	83.8 Å²	83.8	18%	0.182	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-78.5	152.1	179.7	-64.8	-62.9	-70.2	0	0	111.5	L379 Y393 S397 V445 M446	L379-M381 HydrophobicContact CD2-SD 3.81Å; L379-M381 HydrophobicContact CG-SD 4.27Å; M381-Y393 HydrophobicContact CE-CE1 3.8Å; M381-Y393 VanDerWaalsContact CE-OH 3.28Å; M381-Y393 WeakPolarHBondContact CE-OH 3.47Å; M381-S397 WeakPolarHBondContact CE-OG 3.4Å; M381-V445 HydrophobicContact CG-CG1 3.73Å; M381-V445 HydrophobicContact SD-CG1 4.23Å; M381-M446 HydrophobicContact CE-CG 4.37Å; M381-M446 HydrophobicContact SD-CG 3.87Å
382	P	66.6	Low	70.2	Confident	13 Å²	13	85.9 Å²	85.9	8%	0.084	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-58.2	137.5	171.4	-10.1	20.4	0	0	0	111.3	Y393 E396 S397 R400	P382-Y393 HydrophobicContact CB-CD2 4.06Å; P382-Y393 HydrophobicContact CB-CE2 3.74Å; P382-Y393 HydrophobicContact CG-CD2 3.89Å; P382-Y393 HydrophobicContact CG-CE2 3.63Å; P382-E396 HydrophobicContact CG-CB 4.4Å; P382-E396 HydrophobicContact CG-CG 4.1Å; P382-S397 WeakPolarHBondContact CD-OG 3.49Å; P382-R400 VanDerWaalsContact CA-NH1 3.25Å; P382-R400 VanDerWaalsContact CB-NH1 3.3Å; P382-R400 VanDerWaalsContact CG-NH1 3.29Å
383	S	55.7	Low	70.3	Confident	118 Å²	118	81.5 Å²	81.5	83%	0.825	43%	0.431	S	S	*	.	S	Bend	trans	-117.3	139.2	177	-176.6	0	0	0	0	109.8
384	P	51.1	Low	70.8	Confident	113 Å²	113	77.7 Å²	77.7	73%	0.734	40%	0.404	S	S	*	.	S	Bend	cis	-77.4	147.7	0.9	30.6	-33.6	0	0	0	112.8	P386	P384-P386 WeakPolarHBondContact O-CD 3.33Å
385	M	56.9	Low	70.8	Confident	156 Å²	156	77.3 Å²	77.3	77%	0.768	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-61.9	119.1	172.7	-172.6	166.4	79.6	0	0	108.5
386	P	62.8	Low	70.8	Confident	46 Å²	46	78.9 Å²	78.9	30%	0.299	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-67.9	147.3	-174.9	26.1	-32.7	0	0	0	110.9	P384 Y388 Y393	P384-P386 WeakPolarHBondContact O-CD 3.33Å; P386-Y388 WeakPolarHBondContact CB-O 3.38Å; P386-Y388 PolarHBondContact O-N 3.41Å; P386-Y388 VanDerWaalsContact O-N 3.17Å; P386-Y393 VanDerWaalsContact CD-CE2 3.43Å; P386-Y393 HydrophobicContact CG-CD1 4.2Å; P386-Y393 HydrophobicContact CG-CD2 3.73Å; P386-Y393 HydrophobicContact CG-CE2 4.15Å; P386-Y393 HydrophobicContact CG-CG 3.74Å
387	E	51.2	Low	71.3	Confident	184 Å²	184	76 Å²	76	86%	0.86	38%	0.384	S	S	*	.	S	Bend	trans	-60.4	-23.7	176.8	-72	-176.9	159.8	0	0	112.5
388	Y	60	Low	71.6	Confident	192 Å²	192	75.1 Å²	75.1	75%	0.753	38%	0.381	S	S	*	.	S	Bend	trans	-133.3	138.4	173.9	-58	-78.9	0	0	0	110.7	P386 N390	P386-Y388 WeakPolarHBondContact CB-O 3.38Å; P386-Y388 PolarHBondContact O-N 3.41Å; P386-Y388 VanDerWaalsContact O-N 3.17Å; Y388-N390 PolarHBondContact O-N 3.48Å
389	L	67.1	Low	72	Confident	52 Å²	52	65.1 Å²	65.1	27%	0.272	34%	0.343	S	S	.	.			trans	-67	107.5	177.2	-129.6	79.1	0	0	0	109.8	Y393 I394 T450 I451 T454	L389-Y393 HydrophobicContact CD1-CD1 4.29Å; L389-Y393 HydrophobicContact CD1-CE1 4.34Å; L389-Y393 HydrophobicContact CG-CD1 4.45Å; L389-I394 HydrophobicContact CD2-CD1 3.86Å; L389-I394 HydrophobicContact CD2-CG1 3.81Å; L389-I394 HydrophobicContact CG-CD1 4.33Å; L389-I394 HydrophobicContact CG-CG1 4.06Å; L389-T450 HydrophobicContact CD2-CG2 4.23Å; L389-I451 HydrophobicContact CD2-CB 4.21Å; L389-I451 HydrophobicContact CD2-CG1 3.51Å; L389-T454 HydrophobicContact CB-CG2 4.18Å; L389-T454 HydrophobicContact CD2-CG2 4.26Å
390	N	72.9	Confident	72.2	Confident	92 Å²	92	66.3 Å²	66.3	49%	0.492	35%	0.347	S	S	.	.			trans	-93.3	151.1	174.8	-161.8	0.6	0	0	0	110.7	Y388 H392 Y393 I394	Y388-N390 PolarHBondContact O-N 3.48Å; N390-H392 PolarHBondContact O-N 3.38Å; N390-Y393 WeakPolarHBondContact O-CB 3.39Å; N390-Y393 PolarHBondContact O-N 3.09Å; N390-I394 WeakPolarHBondContact O-CG1 3.17Å; N390-I394 PolarHBondContact O-N 3.21Å; N390-I394 VanDerWaalsContact O-N 3.07Å
391	V	74.6	Confident	72.9	Confident	73 Å²	73	62.3 Å²	62.3	44%	0.442	32%	0.322	S	S	.	.	H	α-helix	trans	-55.2	-37.1	177.4	177.6	0	0	0	0	111	I394 G395	V391-I394 PolarHBondContact O-N 3.06Å; V391-G395 PolarHBondContact O-N 3.01Å
392	H	75.1	Confident	73.6	Confident	96 Å²	96	60.6 Å²	60.6	44%	0.444	31%	0.314	S	S	.	.	H	α-helix	trans	-62.8	-42.7	175.3	-69.7	-74.7	0	0	0	113.1	N390 G395 E396	N390-H392 PolarHBondContact O-N 3.38Å; H392-G395 PolarHBondContact O-N 3.4Å; H392-E396 WeakPolarHBondContact O-CB 3.43Å; H392-E396 PolarHBondContact O-N 2.92Å
393	Y	81.3	Confident	74.6	Confident	24 Å²	24	60.2 Å²	60.2	9%	0.094	31%	0.311	C	S	.	.	H	α-helix	trans	-67	-39.8	178	179.8	-95.7	0	0	0	111.7	M381 P382 P386 L389 N390 S397	M381-Y393 HydrophobicContact CE-CE1 3.8Å; M381-Y393 VanDerWaalsContact CE-OH 3.28Å; M381-Y393 WeakPolarHBondContact CE-OH 3.47Å; P382-Y393 HydrophobicContact CB-CD2 4.06Å; P382-Y393 HydrophobicContact CB-CE2 3.74Å; P382-Y393 HydrophobicContact CG-CD2 3.89Å; P382-Y393 HydrophobicContact CG-CE2 3.63Å; P386-Y393 VanDerWaalsContact CD-CE2 3.43Å; P386-Y393 HydrophobicContact CG-CD1 4.2Å; P386-Y393 HydrophobicContact CG-CD2 3.73Å; P386-Y393 HydrophobicContact CG-CE2 4.15Å; P386-Y393 HydrophobicContact CG-CG 3.74Å; L389-Y393 HydrophobicContact CD1-CD1 4.29Å; L389-Y393 HydrophobicContact CD1-CE1 4.34Å; L389-Y393 HydrophobicContact CG-CD1 4.45Å; N390-Y393 WeakPolarHBondContact O-CB 3.39Å; N390-Y393 PolarHBondContact O-N 3.09Å; Y393-S397 VanDerWaalsContact O-CB 3.28Å; Y393-S397 WeakPolarHBondContact O-CB 3.26Å; Y393-S397 PolarHBondContact O-N 3.25Å; Y393-S397 PolarHBondContact O-OG 3.28Å
394	I	83.6	Confident	76.2	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.026	28%	0.28	C	S	.	.	H	α-helix	trans	-62.4	-47.5	175	-60.3	168.4	0	0	0	109.9	L389 N390 V391 S397 A398 I451 F455 F570	L389-I394 HydrophobicContact CD2-CD1 3.86Å; L389-I394 HydrophobicContact CD2-CG1 3.81Å; L389-I394 HydrophobicContact CG-CD1 4.33Å; L389-I394 HydrophobicContact CG-CG1 4.06Å; N390-I394 WeakPolarHBondContact O-CG1 3.17Å; N390-I394 PolarHBondContact O-N 3.21Å; N390-I394 VanDerWaalsContact O-N 3.07Å; V391-I394 PolarHBondContact O-N 3.06Å; I394-S397 PolarHBondContact O-N 2.88Å; I394-A398 VanDerWaalsContact O-CB 3.27Å; I394-A398 WeakPolarHBondContact O-CB 3.34Å; I394-A398 PolarHBondContact O-N 2.86Å; I394-I451 HydrophobicContact CD1-CG2 4.31Å; I394-I451 HydrophobicContact CG1-CG1 4.32Å; I394-I451 HydrophobicContact CG1-CG2 4.47Å; I394-I451 HydrophobicContact CG2-CG2 3.79Å; I394-F455 HydrophobicContact CD1-CE1 4.32Å; I394-F455 HydrophobicContact CG2-CE1 4.43Å; I394-F455 HydrophobicContact CG2-CZ 3.81Å; I394-F570 HydrophobicContact CG2-CD1 4.07Å; I394-F570 HydrophobicContact CG2-CE1 4.43Å
395	G	81.8	Confident	78.1	Confident	2 Å²	2	51 Å²	51	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-65.8	-39.6	179.4	0	0	0	0	0	113.6	V391 H392 S399 F570	V391-G395 PolarHBondContact O-N 3.01Å; H392-G395 PolarHBondContact O-N 3.4Å; G395-S399 VanDerWaalsContact O-CB 3.32Å; G395-S399 WeakPolarHBondContact O-CB 3.42Å; G395-S399 PolarHBondContact O-N 3.41Å; G395-S399 PolarHBondContact O-OG 3.37Å; G395-F570 VanDerWaalsContact CA-O 3.31Å; G395-F570 WeakPolarHBondContact CA-O 3.27Å
396	E	81.8	Confident	79.6	Confident	60 Å²	60	43.6 Å²	43.6	28%	0.28	21%	0.21	S	C	.	.	H	α-helix	trans	-65.1	-44.9	174.7	-170.9	-173	156.1	0	0	111.1	T272 P382 H392 S399 R400	T272-E396 HydrophobicContact CG2-CG 4.46Å; P382-E396 HydrophobicContact CG-CB 4.4Å; P382-E396 HydrophobicContact CG-CG 4.1Å; H392-E396 WeakPolarHBondContact O-CB 3.43Å; H392-E396 PolarHBondContact O-N 2.92Å; E396-S399 WeakPolarHBondContact O-CB 3.3Å; E396-S399 PolarHBondContact O-N 2.84Å; E396-R400 PolarHBondContact O-N 3.4Å; E396-R400 IonicContact OE1-CZ 3.76Å; E396-R400 IonicContact OE1-NH1 3.97Å; E396-R400 PolarHBondContact OE1-NH1 3.27Å; E396-R400 IonicContact OE1-NH2 3.58Å
397	S	84.3	Confident	80.7	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.014	20%	0.202	C	C	.	.	H	α-helix	trans	-64.5	-42	177.7	-56.6	0	0	0	0	111.9	M381 P382 Y393 I394 S399 R400 L401	M381-S397 WeakPolarHBondContact CE-OG 3.4Å; P382-S397 WeakPolarHBondContact CD-OG 3.49Å; Y393-S397 VanDerWaalsContact O-CB 3.28Å; Y393-S397 WeakPolarHBondContact O-CB 3.26Å; Y393-S397 PolarHBondContact O-N 3.25Å; Y393-S397 PolarHBondContact O-OG 3.28Å; I394-S397 PolarHBondContact O-N 2.88Å; S397-S399 VanDerWaalsContact C-N 3.33Å; S397-R400 PolarHBondContact O-N 3.07Å; S397-L401 PolarHBondContact O-N 3.35Å
398	A	87.5	Confident	82.6	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.4	-38.1	174.5	0	0	0	0	0	111.9	I394 L401 L402 F435 F570 F571	I394-A398 VanDerWaalsContact O-CB 3.27Å; I394-A398 WeakPolarHBondContact O-CB 3.34Å; I394-A398 PolarHBondContact O-N 2.86Å; A398-L401 PolarHBondContact O-N 2.95Å; A398-L402 WeakPolarHBondContact O-CB 3.3Å; A398-L402 PolarHBondContact O-N 2.83Å; A398-F435 HydrophobicContact CB-CE2 4.2Å; A398-F435 HydrophobicContact CB-CZ 4.05Å; A398-F435 WeakPolarHBondContact O-CE2 3.26Å; A398-F570 HydrophobicContact CB-CB 3.87Å; A398-F570 HydrophobicContact CB-CD1 3.9Å; A398-F570 HydrophobicContact CB-CG 4.27Å; A398-F571 HydrophobicContact CB-CE1 4.01Å; A398-F571 HydrophobicContact CB-CZ 4.03Å
399	S	85.9	Confident	84.1	Confident	4 Å²	4	25.6 Å²	25.6	3%	0.028	13%	0.128	C	C	.	.	H	α-helix	trans	-62.9	-48.6	174.2	-62.8	0	0	0	0	111.4	G395 E396 S397 L401 L402 F403 L574	G395-S399 VanDerWaalsContact O-CB 3.32Å; G395-S399 WeakPolarHBondContact O-CB 3.42Å; G395-S399 PolarHBondContact O-N 3.41Å; G395-S399 PolarHBondContact O-OG 3.37Å; E396-S399 WeakPolarHBondContact O-CB 3.3Å; E396-S399 PolarHBondContact O-N 2.84Å; S397-S399 VanDerWaalsContact C-N 3.33Å; S399-L401 VanDerWaalsContact C-N 3.27Å; S399-L401 PolarHBondContact O-N 2.91Å; S399-L402 WeakPolarHBondContact O-CB 3.48Å; S399-L402 PolarHBondContact O-N 2.84Å; S399-L402 VanDerWaalsContact O-N 3.07Å; S399-F403 VanDerWaalsContact O-CD2 3.25Å; S399-F403 WeakPolarHBondContact O-CD2 3.43Å; S399-F403 PolarHBondContact O-N 2.83Å; S399-L574 WeakPolarHBondContact OG-CD2 3.39Å
400	R	86.3	Confident	85	Confident	40 Å²	40	25 Å²	25	15%	0.151	12%	0.124	C	C	.	.	H	α-helix	trans	-55.9	-42.6	174.6	-76.6	-174.2	150.1	124.5	3.1	112.3	L379 T380 P382 E396 S397 F403 L404 Y595	L379-R400 HydrophobicContact CD1-CB 3.85Å; T380-R400 WeakPolarHBondContact O-CD 3.38Å; P382-R400 VanDerWaalsContact CA-NH1 3.25Å; P382-R400 VanDerWaalsContact CB-NH1 3.3Å; P382-R400 VanDerWaalsContact CG-NH1 3.29Å; E396-R400 PolarHBondContact O-N 3.4Å; E396-R400 IonicContact OE1-CZ 3.76Å; E396-R400 IonicContact OE1-NH1 3.97Å; E396-R400 PolarHBondContact OE1-NH1 3.27Å; E396-R400 IonicContact OE1-NH2 3.58Å; S397-R400 PolarHBondContact O-N 3.07Å; R400-F403 PolarHBondContact O-N 2.77Å; R400-L404 WeakPolarHBondContact O-CB 3.47Å; R400-L404 PolarHBondContact O-N 3Å; R400-Y595 WeakPolarHBondContact CB-OH 3.48Å; R400-Y595 HydrophobicContact CG-CE2 4.14Å; R400-Y595 WeakPolarHBondContact CG-OH 3.4Å
401	L	89.5	Confident	85.6	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.9	-40.5	176	177.9	63.2	0	0	0	112.3	F377 L379 S397 A398 S399 L404 S405 F435 L439 M446	F377-L401 HydrophobicContact CE1-CD1 3.63Å; F377-L401 HydrophobicContact CZ-CD1 3.87Å; L379-L401 HydrophobicContact CD1-CB 4.19Å; L379-L401 HydrophobicContact CD2-CB 4.31Å; S397-L401 PolarHBondContact O-N 3.35Å; A398-L401 PolarHBondContact O-N 2.95Å; S399-L401 VanDerWaalsContact C-N 3.27Å; S399-L401 PolarHBondContact O-N 2.91Å; L401-L404 PolarHBondContact O-N 3.06Å; L401-S405 WeakPolarHBondContact O-CB 3.49Å; L401-S405 PolarHBondContact O-N 3.35Å; L401-S405 PolarHBondContact O-OG 2.88Å; L401-F435 HydrophobicContact CB-CE2 4.17Å; L401-F435 HydrophobicContact CD2-CD2 3.99Å; L401-F435 HydrophobicContact CD2-CE2 3.66Å; L401-F435 HydrophobicContact CD2-CZ 4.23Å; L401-F435 HydrophobicContact CG-CD2 4.08Å; L401-F435 HydrophobicContact CG-CE2 3.99Å; L401-L439 HydrophobicContact CD2-CB 3.96Å; L401-L439 HydrophobicContact CD2-CD1 4.07Å; L401-M446 HydrophobicContact CB-SD 4.34Å; L401-M446 HydrophobicContact CD2-CE 4.36Å; L401-M446 HydrophobicContact CD2-SD 3.61Å; L401-M446 HydrophobicContact CG-SD 4.46Å
402	L	90	Very high	86.3	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.2	-51.6	176.6	-177.6	68.2	0	0	0	110.4	A398 S399 L404 S405 M406 W431 F435 F571 I580 I587	A398-L402 WeakPolarHBondContact O-CB 3.3Å; A398-L402 PolarHBondContact O-N 2.83Å; S399-L402 WeakPolarHBondContact O-CB 3.48Å; S399-L402 PolarHBondContact O-N 2.84Å; S399-L402 VanDerWaalsContact O-N 3.07Å; L402-L404 VanDerWaalsContact C-N 3.33Å; L402-L404 PolarHBondContact O-N 3.04Å; L402-S405 WeakPolarHBondContact O-CB 3.27Å; L402-S405 PolarHBondContact O-N 3.04Å; L402-S405 VanDerWaalsContact O-N 3.07Å; L402-M406 HydrophobicContact CD1-CE 3.93Å; L402-M406 HydrophobicContact CD1-SD 4.43Å; L402-M406 HydrophobicContact CG-CG 4.48Å; L402-M406 VanDerWaalsContact O-CG 3.3Å; L402-M406 WeakPolarHBondContact O-CG 3.1Å; L402-M406 PolarHBondContact O-N 2.94Å; L402-W431 HydrophobicContact CD1-CE3 3.78Å; L402-W431 HydrophobicContact CD1-CZ3 4.4Å; L402-F435 HydrophobicContact CB-CD2 4.35Å; L402-F435 HydrophobicContact CD1-CD2 4.44Å; L402-F571 HydrophobicContact CB-CE1 4.23Å; L402-F571 HydrophobicContact CB-CZ 4.12Å; L402-F571 HydrophobicContact CD2-CE1 3.99Å; L402-F571 HydrophobicContact CD2-CZ 4.1Å; L402-I580 HydrophobicContact CD1-CG2 4.5Å; L402-I580 HydrophobicContact CD2-CD1 3.95Å; L402-I580 HydrophobicContact CD2-CG2 3.85Å; L402-I587 HydrophobicContact CD2-CD1 4.21Å
403	F	88.2	Confident	86.8	Confident	5 Å²	5	17.1 Å²	17.1	2%	0.022	9%	0.09	C	C	.	.	H	α-helix	trans	-56.5	-46.9	176.4	-85.7	-107.6	0	0	0	111.7	L273 V276 S399 R400 S405 M406 H407 I587 M590 Y595	L273-F403 HydrophobicContact CB-CE2 4.18Å; L273-F403 HydrophobicContact CD1-CE2 3.79Å; L273-F403 HydrophobicContact CD1-CZ 4.44Å; V276-F403 HydrophobicContact CG2-CE1 4.42Å; V276-F403 HydrophobicContact CG2-CZ 3.92Å; S399-F403 VanDerWaalsContact O-CD2 3.25Å; S399-F403 WeakPolarHBondContact O-CD2 3.43Å; S399-F403 PolarHBondContact O-N 2.83Å; R400-F403 PolarHBondContact O-N 2.77Å; F403-S405 VanDerWaalsContact C-N 3.26Å; F403-S405 PolarHBondContact O-N 2.73Å; F403-M406 PolarHBondContact O-N 3.22Å; F403-H407 WeakPolarHBondContact O-CB 3.31Å; F403-H407 PolarHBondContact O-CD2 2.9Å; F403-H407 VanDerWaalsContact O-CD2 3.24Å; F403-H407 PolarHBondContact O-N 3.49Å; F403-I587 HydrophobicContact CD1-CG2 3.85Å; F403-I587 HydrophobicContact CD2-CD1 4.4Å; F403-I587 HydrophobicContact CE1-CB 4.47Å; F403-I587 HydrophobicContact CE1-CG1 4.09Å; F403-I587 HydrophobicContact CE1-CG2 4.01Å; F403-I587 HydrophobicContact CE2-CD1 4.07Å; F403-I587 HydrophobicContact CE2-CG1 4.13Å; F403-I587 HydrophobicContact CG-CG2 4.2Å; F403-I587 HydrophobicContact CZ-CD1 4.29Å; F403-I587 HydrophobicContact CZ-CG1 3.83Å; F403-M590 HydrophobicContact CE1-SD 3.9Å; F403-M590 HydrophobicContact CZ-SD 4.45Å; F403-Y595 HydrophobicContact CB-CD2 4.46Å; F403-Y595 HydrophobicContact CB-CE2 4.29Å
404	L	88.5	Confident	87	Confident	36 Å²	36	16.2 Å²	16.2	19%	0.188	9%	0.087	C	C	.	.	H	α-helix	trans	-57.8	-40.9	176.6	-178.2	63	0	0	0	111.9	F377 L379 R400 L401 L402 W408	F377-L404 HydrophobicContact CD1-CD2 4.06Å; F377-L404 HydrophobicContact CD2-CD2 4.24Å; F377-L404 HydrophobicContact CD2-CG 4.17Å; F377-L404 HydrophobicContact CE1-CD2 3.82Å; F377-L404 HydrophobicContact CE1-CG 4.39Å; F377-L404 HydrophobicContact CE2-CD2 4.02Å; F377-L404 HydrophobicContact CE2-CG 3.73Å; F377-L404 HydrophobicContact CG-CD2 4.27Å; F377-L404 HydrophobicContact CZ-CB 4.48Å; F377-L404 HydrophobicContact CZ-CD2 3.8Å; F377-L404 HydrophobicContact CZ-CG 3.85Å; L379-L404 HydrophobicContact CB-CD2 4.22Å; L379-L404 HydrophobicContact CD1-CD2 4.35Å; R400-L404 WeakPolarHBondContact O-CB 3.47Å; R400-L404 PolarHBondContact O-N 3Å; L401-L404 PolarHBondContact O-N 3.06Å; L402-L404 VanDerWaalsContact C-N 3.33Å; L402-L404 PolarHBondContact O-N 3.04Å; L404-W408 WeakPolarHBondContact O-CB 3.26Å; L404-W408 PolarHBondContact O-N 2.98Å
405	S	90.8	Very high	87.2	Confident	2 Å²	2	16 Å²	16	1%	0.014	9%	0.086	C	C	.	.	H	α-helix	trans	-68	-40.7	178.8	-54.9	0	0	0	0	112.1	L401 L402 F403 A409	L401-S405 WeakPolarHBondContact O-CB 3.49Å; L401-S405 PolarHBondContact O-N 3.35Å; L401-S405 PolarHBondContact O-OG 2.88Å; L402-S405 WeakPolarHBondContact O-CB 3.27Å; L402-S405 PolarHBondContact O-N 3.04Å; L402-S405 VanDerWaalsContact O-N 3.07Å; F403-S405 VanDerWaalsContact C-N 3.26Å; F403-S405 PolarHBondContact O-N 2.73Å; S405-A409 PolarHBondContact O-N 3.06Å
406	M	89.6	Confident	87.4	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-69.7	-43.4	178.2	-58.4	-52.7	93.1	0	0	111.7	L402 F403 W408 A409 L410 V427 W431 I587 L588	L402-M406 HydrophobicContact CD1-CE 3.93Å; L402-M406 HydrophobicContact CD1-SD 4.43Å; L402-M406 HydrophobicContact CG-CG 4.48Å; L402-M406 VanDerWaalsContact O-CG 3.3Å; L402-M406 WeakPolarHBondContact O-CG 3.1Å; L402-M406 PolarHBondContact O-N 2.94Å; F403-M406 PolarHBondContact O-N 3.22Å; M406-W408 VanDerWaalsContact C-N 3.33Å; M406-W408 PolarHBondContact O-N 3.17Å; M406-A409 WeakPolarHBondContact O-CB 3.44Å; M406-A409 PolarHBondContact O-N 3.38Å; M406-L410 PolarHBondContact O-N 3.43Å; M406-V427 HydrophobicContact CE-CG1 4.28Å; M406-V427 HydrophobicContact SD-CG1 3.14Å; M406-V427 WeakPolarHBondContact SD-CG1 3.44Å; M406-W431 HydrophobicContact CE-CB 3.95Å; M406-W431 HydrophobicContact SD-CB 4.2Å; M406-I587 HydrophobicContact CB-CG2 3.81Å; M406-I587 HydrophobicContact CG-CG2 3.95Å; M406-L588 HydrophobicContact CB-CD2 4.2Å
407	H	85.6	Confident	87.5	Confident	30 Å²	30	19.9 Å²	19.9	14%	0.139	11%	0.109	C	C	.	.	H	α-helix	trans	-67.9	-33.4	176.7	-79.8	-68.6	0	0	0	112.5	F403 A409 L410 S411 M590	F403-H407 WeakPolarHBondContact O-CB 3.31Å; F403-H407 PolarHBondContact O-CD2 2.9Å; F403-H407 VanDerWaalsContact O-CD2 3.24Å; F403-H407 PolarHBondContact O-N 3.49Å; H407-A409 VanDerWaalsContact C-N 3.31Å; H407-L410 PolarHBondContact O-N 2.94Å; H407-S411 PolarHBondContact O-N 2.92Å; H407-M590 PolarHBondContact CE1-O 2.95Å
408	W	91.3	Very high	87.4	Confident	14 Å²	14	20.1 Å²	20.1	5%	0.053	11%	0.11	C	C	.	.	H	α-helix	trans	-61.6	-39.5	170.9	175.7	90.2	0	0	0	111.8	L370 H374 F377 L404 M406 S411 I412 L434 A501 K504 A505 L508	L370-W408 HydrophobicContact CD2-CZ2 4.34Å; H374-W408 PolarHBondContact O-NE1 3.37Å; F377-W408 HydrophobicContact CD2-CB 4.46Å; F377-W408 HydrophobicContact CD2-CG 4.33Å; F377-W408 HydrophobicContact CE2-CB 4.2Å; F377-W408 HydrophobicContact CE2-CG 4.37Å; L404-W408 WeakPolarHBondContact O-CB 3.26Å; L404-W408 PolarHBondContact O-N 2.98Å; M406-W408 VanDerWaalsContact C-N 3.33Å; M406-W408 PolarHBondContact O-N 3.17Å; W408-S411 PolarHBondContact O-N 2.91Å; W408-S411 PolarHBondContact O-OG 3.01Å; W408-I412 HydrophobicContact CE3-CD1 4.29Å; W408-I412 HydrophobicContact CH2-CD1 3.63Å; W408-I412 HydrophobicContact CZ2-CD1 3.99Å; W408-I412 HydrophobicContact CZ3-CD1 3.81Å; W408-L434 HydrophobicContact CZ3-CD2 4.28Å; W408-A501 HydrophobicContact CZ2-CB 4.36Å; W408-K504 HydrophobicContact CD2-CD 4.43Å; W408-K504 HydrophobicContact CE3-CB 4.41Å; W408-K504 HydrophobicContact CE3-CD 4.37Å; W408-K504 HydrophobicContact CH2-CB 3.29Å; W408-K504 HydrophobicContact CH2-CD 4.29Å; W408-K504 HydrophobicContact CH2-CG 4.44Å; W408-K504 HydrophobicContact CZ2-CB 3.93Å; W408-K504 HydrophobicContact CZ2-CD 4.31Å; W408-K504 HydrophobicContact CZ3-CB 3.57Å; W408-K504 HydrophobicContact CZ3-CD 4.31Å; W408-A505 HydrophobicContact CH2-CB 4.36Å; W408-L508 HydrophobicContact CZ3-CD2 4.25Å
409	A	90	Very high	87.1	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-65.3	-41.9	174.1	0	0	0	0	0	111.2	S405 M406 H407 S411 I412 F415 V427 L508	S405-A409 PolarHBondContact O-N 3.06Å; M406-A409 WeakPolarHBondContact O-CB 3.44Å; M406-A409 PolarHBondContact O-N 3.38Å; H407-A409 VanDerWaalsContact C-N 3.31Å; A409-S411 VanDerWaalsContact C-N 3.33Å; A409-S411 PolarHBondContact O-N 3.17Å; A409-I412 PolarHBondContact O-N 3.24Å; A409-F415 WeakPolarHBondContact O-CB 3.49Å; A409-F415 WeakPolarHBondContact O-CD1 3.46Å; A409-F415 WeakPolarHBondContact O-CG 3.47Å; A409-V427 HydrophobicContact CB-CG2 4.44Å; A409-L508 HydrophobicContact CB-CD1 4.33Å; A409-L508 HydrophobicContact CB-CD2 3.82Å
410	L	86.4	Confident	86.9	Confident	39 Å²	39	27.1 Å²	27.1	20%	0.204	15%	0.152	C	C	.	.	H	α-helix	trans	-64.8	-31	177.1	-78.9	172	0	0	0	114.2	M406 H407 I412 F415 Q416 L588	M406-L410 PolarHBondContact O-N 3.43Å; H407-L410 PolarHBondContact O-N 2.94Å; L410-I412 PolarHBondContact O-N 3.1Å; L410-F415 HydrophobicContact CD2-CD1 4.37Å; L410-F415 HydrophobicContact CD2-CE1 3.88Å; L410-F415 HydrophobicContact CG-CE1 4.41Å; L410-Q416 VanDerWaalsContact O-CG 3.28Å; L410-Q416 WeakPolarHBondContact O-CG 2.98Å; L410-Q416 PolarHBondContact O-NE2 3.42Å; L410-L588 HydrophobicContact CD1-CB 4.21Å; L410-L588 HydrophobicContact CD1-CD2 3.53Å; L410-L588 HydrophobicContact CD1-CG 4.48Å; L410-L588 HydrophobicContact CD2-CD2 3.97Å; L410-L588 HydrophobicContact CG-CD2 3.56Å
411	S	86.1	Confident	86.7	Confident	52 Å²	52	31.6 Å²	31.6	36%	0.364	17%	0.174	S	C	.	.	H	α-helix	trans	-69.6	-18.7	179.9	59.9	0	0	0	0	112.5	H374 H407 W408 A409 P413	H374-S411 PolarHBondContact CD2-OG 3.15Å; H374-S411 VanDerWaalsContact NE2-C 3.33Å; H374-S411 PolarHBondContact NE2-O 3.35Å; H374-S411 VanDerWaalsContact NE2-O 3.15Å; H374-S411 PolarHBondContact NE2-OG 2.91Å; H407-S411 PolarHBondContact O-N 2.92Å; W408-S411 PolarHBondContact O-N 2.91Å; W408-S411 PolarHBondContact O-OG 3.01Å; A409-S411 VanDerWaalsContact C-N 3.33Å; A409-S411 PolarHBondContact O-N 3.17Å; S411-P413 VanDerWaalsContact O-CD 3.24Å; S411-P413 WeakPolarHBondContact O-CD 3.15Å
412	I	88.9	Confident	86.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.178	C	C	.	.			trans	-70.2	117.7	-179.5	-60.5	170.8	0	0	0	110.2	L369 L370 W408 A409 L410 S414 F415 Q416 L508 F509	L369-I412 HydrophobicContact CD1-CG2 4.49Å; L370-I412 HydrophobicContact CD2-CD1 3.85Å; L370-I412 HydrophobicContact CD2-CG1 3.92Å; W408-I412 HydrophobicContact CE3-CD1 4.29Å; W408-I412 HydrophobicContact CH2-CD1 3.63Å; W408-I412 HydrophobicContact CZ2-CD1 3.99Å; W408-I412 HydrophobicContact CZ3-CD1 3.81Å; A409-I412 PolarHBondContact O-N 3.24Å; L410-I412 PolarHBondContact O-N 3.1Å; I412-S414 VanDerWaalsContact C-N 3.26Å; I412-S414 PolarHBondContact O-N 3.12Å; I412-S414 VanDerWaalsContact O-N 3.17Å; I412-F415 HydrophobicContact CB-CB 3.91Å; I412-F415 HydrophobicContact CG2-CB 4.21Å; I412-F415 WeakPolarHBondContact O-CB 3.42Å; I412-F415 PolarHBondContact O-N 3.08Å; I412-Q416 PolarHBondContact O-N 2.91Å; I412-L508 HydrophobicContact CD1-CD2 4.04Å; I412-F509 HydrophobicContact CG2-CE2 4.38Å; I412-F509 HydrophobicContact CG2-CZ 4.07Å
413	P	85.3	Confident	86.2	Confident	45 Å²	45	32.8 Å²	32.8	29%	0.292	18%	0.181	S	C	.	.	H	α-helix	trans	-58.9	-32.5	-177	-28.8	38.1	0	0	0	114.6	K365 S411 A417	K365-P413 HydrophobicContact CD-CB 3.68Å; K365-P413 VanDerWaalsContact NZ-CB 3.3Å; K365-P413 PolarHBondContact NZ-O 3.07Å; S411-P413 VanDerWaalsContact O-CD 3.24Å; S411-P413 WeakPolarHBondContact O-CD 3.15Å; P413-A417 PolarHBondContact O-N 3.35Å
414	S	86.4	Confident	86.3	Confident	4 Å²	4	33.2 Å²	33.2	3%	0.028	18%	0.183	C	C	.	.	H	α-helix	trans	-75.7	-31.2	176.9	-59.9	0	0	0	0	112.7	L369 I412 A417 F525	L369-S414 VanDerWaalsContact CD1-OG 3.25Å; L369-S414 WeakPolarHBondContact CD1-OG 3.45Å; I412-S414 VanDerWaalsContact C-N 3.26Å; I412-S414 PolarHBondContact O-N 3.12Å; I412-S414 VanDerWaalsContact O-N 3.17Å; S414-A417 WeakPolarHBondContact O-CB 3.21Å; S414-A417 PolarHBondContact O-N 3.38Å; S414-F525 VanDerWaalsContact O-CE2 3.26Å; S414-F525 WeakPolarHBondContact O-CE2 3.32Å
415	F	86.7	Confident	86.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-67.7	-42.1	175.5	178.4	-95.4	0	0	0	110.9	A409 L410 I412 A417 L418 S423 L426 V427 L508 F509	A409-F415 WeakPolarHBondContact O-CB 3.49Å; A409-F415 WeakPolarHBondContact O-CD1 3.46Å; A409-F415 WeakPolarHBondContact O-CG 3.47Å; L410-F415 HydrophobicContact CD2-CD1 4.37Å; L410-F415 HydrophobicContact CD2-CE1 3.88Å; L410-F415 HydrophobicContact CG-CE1 4.41Å; I412-F415 HydrophobicContact CB-CB 3.91Å; I412-F415 HydrophobicContact CG2-CB 4.21Å; I412-F415 WeakPolarHBondContact O-CB 3.42Å; I412-F415 PolarHBondContact O-N 3.08Å; F415-A417 PolarHBondContact O-N 2.86Å; F415-L418 HydrophobicContact CD2-CD1 4.48Å; F415-L418 WeakPolarHBondContact O-CB 3.43Å; F415-L418 PolarHBondContact O-N 2.94Å; F415-S423 VanDerWaalsContact CE1-CB 3.49Å; F415-S423 WeakPolarHBondContact CZ-O 3.42Å; F415-S423 PolarHBondContact O-OG 2.67Å; F415-L426 HydrophobicContact CD2-CD2 4.13Å; F415-L426 HydrophobicContact CE2-CB 4.4Å; F415-L426 HydrophobicContact CE2-CD2 3.95Å; F415-V427 HydrophobicContact CE1-CG2 4.39Å; F415-V427 HydrophobicContact CE2-CG2 3.82Å; F415-V427 HydrophobicContact CZ-CG2 3.38Å; F415-L508 HydrophobicContact CD2-CD1 4.12Å; F415-L508 HydrophobicContact CD2-CD2 3.88Å; F415-L508 HydrophobicContact CD2-CG 4.22Å; F415-L508 HydrophobicContact CE2-CD1 3.87Å; F415-L508 HydrophobicContact CE2-CD2 4.4Å; F415-L508 HydrophobicContact CE2-CG 4.47Å; F415-L508 HydrophobicContact CG-CD2 4.5Å; F415-F509 HydrophobicContact CB-CE1 4.22Å; F415-F509 HydrophobicContact CB-CZ 4.03Å; F415-F509 HydrophobicContact CD2-CE1 4.3Å
416	Q	85.6	Confident	86.3	Confident	113 Å²	113	33.5 Å²	33.5	53%	0.528	19%	0.189	S	C	.	.	H	α-helix	trans	-62.2	-28.9	174.3	-63.3	-179.6	-7.4	0	0	112.8	L410 I412 L418	L410-Q416 VanDerWaalsContact O-CG 3.28Å; L410-Q416 WeakPolarHBondContact O-CG 2.98Å; L410-Q416 PolarHBondContact O-NE2 3.42Å; I412-Q416 PolarHBondContact O-N 2.91Å; Q416-L418 PolarHBondContact O-N 3.25Å
417	A	84.8	Confident	86.3	Confident	31 Å²	31	33.5 Å²	33.5	26%	0.256	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-11.7	-179.4	0	0	0	0	0	114	T363 P413 S414 F415 G419	T363-A417 HydrophobicContact CG2-CB 4.24Å; P413-A417 PolarHBondContact O-N 3.35Å; S414-A417 WeakPolarHBondContact O-CB 3.21Å; S414-A417 PolarHBondContact O-N 3.38Å; F415-A417 PolarHBondContact O-N 2.86Å; A417-G419 VanDerWaalsContact C-N 3.28Å
418	L	82.5	Confident	86.6	Confident	7 Å²	7	36 Å²	36	4%	0.037	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-15.7	178.2	-67.5	171.7	0	0	0	113.2	F415 Q416 N422 L426 F509 Q521 I522 F525	F415-L418 HydrophobicContact CD2-CD1 4.48Å; F415-L418 WeakPolarHBondContact O-CB 3.43Å; F415-L418 PolarHBondContact O-N 2.94Å; Q416-L418 PolarHBondContact O-N 3.25Å; L418-N422 HydrophobicContact CB-CB 4.08Å; L418-N422 WeakPolarHBondContact O-CB 3.34Å; L418-N422 PolarHBondContact O-ND2 3.18Å; L418-L426 HydrophobicContact CD1-CD2 3.88Å; L418-F509 HydrophobicContact CD1-CD1 4.42Å; L418-F509 HydrophobicContact CD1-CE1 4.1Å; L418-Q521 HydrophobicContact CD2-CB 4.31Å; L418-Q521 HydrophobicContact CD2-CG 3.9Å; L418-I522 HydrophobicContact CD1-CG1 4.27Å; L418-I522 HydrophobicContact CD2-CG1 4.09Å; L418-F525 HydrophobicContact CD2-CD2 4.08Å; L418-F525 HydrophobicContact CD2-CE2 3.7Å; L418-F525 HydrophobicContact CG-CD2 4.39Å; L418-F525 HydrophobicContact CG-CE2 3.99Å
419	G	81.8	Confident	86.5	Confident	35 Å²	35	36.3 Å²	36.3	36%	0.361	21%	0.205	S	C	.	.			trans	86.5	154.9	-173.5	0	0	0	0	0	112.9	A417 E421 N422 S423	A417-G419 VanDerWaalsContact C-N 3.28Å; G419-E421 PolarHBondContact O-N 3.26Å; G419-N422 PolarHBondContact O-N 2.84Å; G419-S423 WeakPolarHBondContact O-CB 3.34Å; G419-S423 PolarHBondContact O-N 3.3Å; G419-S423 PolarHBondContact O-OG 2.74Å; G419-S423 VanDerWaalsContact O-OG 3.06Å
420	Q	80.7	Confident	86.6	Confident	117 Å²	117	36.7 Å²	36.7	55%	0.547	21%	0.206	S	C	.	.	H	α-helix	trans	-60.6	-43.1	-167.9	-172.6	169.4	18.9	0	0	113.9	S423 I424	Q420-S423 PolarHBondContact O-N 3.31Å; Q420-I424 HydrophobicContact CG-CD1 3.98Å; Q420-I424 WeakPolarHBondContact O-CD1 3.17Å; Q420-I424 VanDerWaalsContact O-CG1 3.26Å; Q420-I424 WeakPolarHBondContact O-CG1 3.41Å; Q420-I424 PolarHBondContact O-N 2.91Å
421	E	81.3	Confident	86.9	Confident	133 Å²	133	35 Å²	35	62%	0.621	20%	0.197	S	C	*	.	H	α-helix	trans	-67.1	-39.4	-178.6	-63.9	-56.5	141.2	0	0	112.4	G419 I424 S425	G419-E421 PolarHBondContact O-N 3.26Å; E421-I424 PolarHBondContact O-N 3.42Å; E421-S425 WeakPolarHBondContact O-CB 3.49Å; E421-S425 PolarHBondContact O-N 2.92Å; E421-S425 PolarHBondContact O-OG 3.32Å
422	N	84.1	Confident	87.3	Confident	17 Å²	17	33 Å²	33	9%	0.091	18%	0.182	C	C	.	.	H	α-helix	trans	-70	-42.6	176.4	-69.4	-28.4	0	0	0	111.4	L418 G419 I424 S425 L426 E517 N518	L418-N422 HydrophobicContact CB-CB 4.08Å; L418-N422 WeakPolarHBondContact O-CB 3.34Å; L418-N422 PolarHBondContact O-ND2 3.18Å; G419-N422 PolarHBondContact O-N 2.84Å; N422-I424 VanDerWaalsContact C-N 3.33Å; N422-I424 PolarHBondContact O-N 3.44Å; N422-S425 PolarHBondContact O-N 3.18Å; N422-L426 WeakPolarHBondContact O-CB 3.42Å; N422-L426 PolarHBondContact O-N 3.05Å; N422-E517 WeakPolarHBondContact OD1-CB 3.39Å; N422-N518 PolarHBondContact ND2-ND2 3.08Å; N422-N518 VanDerWaalsContact ND2-ND2 3.13Å
423	S	86.8	Confident	87.6	Confident	9 Å²	9	34.1 Å²	34.1	6%	0.063	19%	0.187	C	C	.	.	H	α-helix	trans	-57.8	-44.7	174.4	-66.5	0	0	0	0	111.9	F415 G419 Q420 V427	F415-S423 VanDerWaalsContact CE1-CB 3.49Å; F415-S423 WeakPolarHBondContact CZ-O 3.42Å; F415-S423 PolarHBondContact O-OG 2.67Å; G419-S423 WeakPolarHBondContact O-CB 3.34Å; G419-S423 PolarHBondContact O-N 3.3Å; G419-S423 PolarHBondContact O-OG 2.74Å; G419-S423 VanDerWaalsContact O-OG 3.06Å; Q420-S423 PolarHBondContact O-N 3.31Å; S423-V427 WeakPolarHBondContact O-CB 3.42Å; S423-V427 VanDerWaalsContact O-CG2 3.31Å; S423-V427 WeakPolarHBondContact O-CG2 3.39Å; S423-V427 PolarHBondContact O-N 3.37Å
424	I	88.4	Confident	88	Confident	13 Å²	13	32 Å²	32	7%	0.067	17%	0.174	C	C	.	.	H	α-helix	trans	-63.7	-47.9	177.3	-69.9	164.6	0	0	0	110.6	Q420 E421 N422 L426 V427 K428 P585 L588	Q420-I424 HydrophobicContact CG-CD1 3.98Å; Q420-I424 WeakPolarHBondContact O-CD1 3.17Å; Q420-I424 VanDerWaalsContact O-CG1 3.26Å; Q420-I424 WeakPolarHBondContact O-CG1 3.41Å; Q420-I424 PolarHBondContact O-N 2.91Å; E421-I424 PolarHBondContact O-N 3.42Å; N422-I424 VanDerWaalsContact C-N 3.33Å; N422-I424 PolarHBondContact O-N 3.44Å; I424-L426 VanDerWaalsContact C-N 3.33Å; I424-L426 PolarHBondContact O-N 3.1Å; I424-V427 PolarHBondContact O-N 2.9Å; I424-K428 HydrophobicContact CG2-CD 3.98Å; I424-K428 HydrophobicContact CG2-CG 4.4Å; I424-K428 WeakPolarHBondContact O-CB 3.22Å; I424-K428 VanDerWaalsContact O-CG 3.28Å; I424-K428 WeakPolarHBondContact O-CG 3.28Å; I424-K428 PolarHBondContact O-N 3.17Å; I424-P585 HydrophobicContact CD1-CB 4.31Å; I424-P585 HydrophobicContact CG2-CB 4.39Å; I424-P585 HydrophobicContact CG2-CG 3.9Å; I424-L588 HydrophobicContact CB-CD1 4.44Å; I424-L588 HydrophobicContact CG1-CD1 3.82Å
425	S	88.4	Confident	88.4	Confident	45 Å²	45	31.9 Å²	31.9	32%	0.315	17%	0.173	S	C	.	.	H	α-helix	trans	-63.3	-40.5	-179	-60.8	0	0	0	0	112	E421 N422 K428 A429	E421-S425 WeakPolarHBondContact O-CB 3.49Å; E421-S425 PolarHBondContact O-N 2.92Å; E421-S425 PolarHBondContact O-OG 3.32Å; N422-S425 PolarHBondContact O-N 3.18Å; S425-K428 PolarHBondContact O-N 2.95Å; S425-A429 WeakPolarHBondContact O-CB 3.35Å; S425-A429 PolarHBondContact O-N 3.4Å
426	L	90.7	Very high	88.8	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.4	-43.6	178	-166.7	64.2	0	0	0	111.9	F415 L418 N422 I424 A429 Y430 L508 F509 L516 I522	F415-L426 HydrophobicContact CD2-CD2 4.13Å; F415-L426 HydrophobicContact CE2-CB 4.4Å; F415-L426 HydrophobicContact CE2-CD2 3.95Å; L418-L426 HydrophobicContact CD1-CD2 3.88Å; N422-L426 WeakPolarHBondContact O-CB 3.42Å; N422-L426 PolarHBondContact O-N 3.05Å; I424-L426 VanDerWaalsContact C-N 3.33Å; I424-L426 PolarHBondContact O-N 3.1Å; L426-A429 WeakPolarHBondContact O-CB 3.17Å; L426-A429 PolarHBondContact O-N 3.43Å; L426-Y430 HydrophobicContact CD1-CD2 3.83Å; L426-Y430 HydrophobicContact CD1-CE2 3.72Å; L426-Y430 HydrophobicContact CG-CD2 4.34Å; L426-Y430 VanDerWaalsContact O-CD2 3.32Å; L426-Y430 WeakPolarHBondContact O-CD2 3.42Å; L426-Y430 PolarHBondContact O-N 2.89Å; L426-Y430 VanDerWaalsContact O-N 3.14Å; L426-L508 VanDerWaalsContact CD1-O 3.26Å; L426-L508 WeakPolarHBondContact CD1-O 3.4Å; L426-L508 HydrophobicContact CD2-CD1 4.15Å; L426-L508 HydrophobicContact CD2-CG 4.4Å; L426-L508 VanDerWaalsContact CD2-O 3.3Å; L426-L508 WeakPolarHBondContact CD2-O 3.43Å; L426-L508 HydrophobicContact CG-CD1 4.15Å; L426-L508 VanDerWaalsContact CG-O 3.24Å; L426-L508 WeakPolarHBondContact CG-O 3.4Å; L426-F509 HydrophobicContact CD2-CD1 4.27Å; L426-L516 HydrophobicContact CB-CD2 4.36Å; L426-L516 HydrophobicContact CD1-CD1 3.79Å; L426-L516 HydrophobicContact CD1-CD2 3.97Å; L426-I522 HydrophobicContact CD1-CD1 4.24Å
427	V	91.5	Very high	89.2	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-68.1	-39.6	177.1	172	0	0	0	0	111.3	M406 A409 F415 S423 I424 A429 Y430 W431 L508 I584 L588	M406-V427 HydrophobicContact CE-CG1 4.28Å; M406-V427 HydrophobicContact SD-CG1 3.14Å; M406-V427 WeakPolarHBondContact SD-CG1 3.44Å; A409-V427 HydrophobicContact CB-CG2 4.44Å; F415-V427 HydrophobicContact CE1-CG2 4.39Å; F415-V427 HydrophobicContact CE2-CG2 3.82Å; F415-V427 HydrophobicContact CZ-CG2 3.38Å; S423-V427 WeakPolarHBondContact O-CB 3.42Å; S423-V427 VanDerWaalsContact O-CG2 3.31Å; S423-V427 WeakPolarHBondContact O-CG2 3.39Å; S423-V427 PolarHBondContact O-N 3.37Å; I424-V427 PolarHBondContact O-N 2.9Å; V427-A429 VanDerWaalsContact C-N 3.26Å; V427-A429 PolarHBondContact O-N 3.49Å; V427-Y430 PolarHBondContact O-N 3.31Å; V427-W431 WeakPolarHBondContact O-CA 3.32Å; V427-W431 VanDerWaalsContact O-CB 3.28Å; V427-W431 WeakPolarHBondContact O-CB 3.45Å; V427-W431 PolarHBondContact O-N 3.34Å; V427-L508 HydrophobicContact CG2-CD1 4.43Å; V427-I584 HydrophobicContact CB-CG2 4.14Å; V427-I584 HydrophobicContact CG1-CD1 4.28Å; V427-I584 HydrophobicContact CG1-CG1 4.44Å; V427-I584 HydrophobicContact CG1-CG2 3.61Å; V427-L588 HydrophobicContact CB-CD1 4.27Å; V427-L588 HydrophobicContact CG1-CD1 4.42Å; V427-L588 HydrophobicContact CG2-CD1 4.4Å; V427-L588 HydrophobicContact CG2-CD2 4.5Å
428	K	90.5	Very high	89.5	Confident	82 Å²	82	25.1 Å²	25.1	36%	0.357	14%	0.136	S	C	.	.	H	α-helix	trans	-58.4	-38.8	172.7	-76.4	176	177.8	-175.9	0	112.4	I424 S425 W431 D581 I584	I424-K428 HydrophobicContact CG2-CD 3.98Å; I424-K428 HydrophobicContact CG2-CG 4.4Å; I424-K428 WeakPolarHBondContact O-CB 3.22Å; I424-K428 VanDerWaalsContact O-CG 3.28Å; I424-K428 WeakPolarHBondContact O-CG 3.28Å; I424-K428 PolarHBondContact O-N 3.17Å; S425-K428 PolarHBondContact O-N 2.95Å; K428-W431 VanDerWaalsContact O-CD1 3.3Å; K428-D581 WeakPolarHBondContact CE-O 3.3Å; K428-I584 HydrophobicContact CB-CD1 4.46Å; K428-I584 HydrophobicContact CG-CB 4.27Å; K428-I584 HydrophobicContact CG-CD1 4Å; K428-I584 HydrophobicContact CG-CG2 4.06Å
429	A	89.8	Confident	90	Very high	20 Å²	20	24.8 Å²	24.8	17%	0.165	13%	0.134	C	C	.	.	H	α-helix	trans	-66.2	-39.8	177.5	0	0	0	0	0	113	S425 L426 V427 H513	S425-A429 WeakPolarHBondContact O-CB 3.35Å; S425-A429 PolarHBondContact O-N 3.4Å; L426-A429 WeakPolarHBondContact O-CB 3.17Å; L426-A429 PolarHBondContact O-N 3.43Å; V427-A429 VanDerWaalsContact C-N 3.26Å; V427-A429 PolarHBondContact O-N 3.49Å; A429-H513 HydrophobicContact CB-CB 3.73Å; A429-H513 WeakPolarHBondContact CB-CD2 3.33Å
430	Y	92.4	Very high	90.5	Very high	8 Å²	8	23.2 Å²	23.2	3%	0.031	12%	0.118	C	C	.	.	H	α-helix	trans	-119.2	8	-165.9	-61.5	-70.1	0	0	0	115.4	L426 V427 N432 E433 L434 V507 S510 D512 H513 L516	L426-Y430 HydrophobicContact CD1-CD2 3.83Å; L426-Y430 HydrophobicContact CD1-CE2 3.72Å; L426-Y430 HydrophobicContact CG-CD2 4.34Å; L426-Y430 VanDerWaalsContact O-CD2 3.32Å; L426-Y430 WeakPolarHBondContact O-CD2 3.42Å; L426-Y430 PolarHBondContact O-N 2.89Å; L426-Y430 VanDerWaalsContact O-N 3.14Å; V427-Y430 PolarHBondContact O-N 3.31Å; Y430-N432 VanDerWaalsContact C-N 3.26Å; Y430-N432 PolarHBondContact O-N 3.37Å; Y430-E433 PolarHBondContact O-N 2.94Å; Y430-L434 WeakPolarHBondContact O-CG 3.48Å; Y430-L434 PolarHBondContact O-N 2.95Å; Y430-V507 HydrophobicContact CD1-CG1 4.4Å; Y430-S510 WeakPolarHBondContact CE2-O 3.42Å; Y430-S510 VanDerWaalsContact OH-CB 3.27Å; Y430-S510 WeakPolarHBondContact OH-CB 3.38Å; Y430-S510 PolarHBondContact OH-O 3.09Å; Y430-S510 PolarHBondContact OH-OG 3.38Å; Y430-D512 PolarHBondContact OH-N 2.94Å; Y430-H513 HydrophobicContact CE2-CB 4.11Å; Y430-H513 WeakPolarHBondContact OH-CB 3.23Å; Y430-H513 PolarHBondContact OH-N 3.22Å; Y430-H513 VanDerWaalsContact OH-N 3.1Å; Y430-L516 HydrophobicContact CE2-CD1 4.29Å
431	W	93	Very high	91.1	Very high	4 Å²	4	19.8 Å²	19.8	2%	0.015	10%	0.102	C	C	.	.	H	α-helix	trans	-58.4	-38.2	-177.9	74.5	-96.1	0	0	0	112.6	L402 M406 V427 K428 L434 F435 A563 E567 F571 I580 D581 I584	L402-W431 HydrophobicContact CD1-CE3 3.78Å; L402-W431 HydrophobicContact CD1-CZ3 4.4Å; M406-W431 HydrophobicContact CE-CB 3.95Å; M406-W431 HydrophobicContact SD-CB 4.2Å; V427-W431 WeakPolarHBondContact O-CA 3.32Å; V427-W431 VanDerWaalsContact O-CB 3.28Å; V427-W431 WeakPolarHBondContact O-CB 3.45Å; V427-W431 PolarHBondContact O-N 3.34Å; K428-W431 VanDerWaalsContact O-CD1 3.3Å; W431-L434 PolarHBondContact O-N 3.15Å; W431-F435 HydrophobicContact CE3-CB 4.28Å; W431-F435 HydrophobicContact CZ3-CB 4.49Å; W431-F435 WeakPolarHBondContact O-CB 3.21Å; W431-F435 PolarHBondContact O-N 3.36Å; W431-A563 HydrophobicContact CZ2-CB 3.89Å; W431-E567 HydrophobicContact CH2-CG 3.5Å; W431-E567 HydrophobicContact CZ2-CG 3.54Å; W431-E567 WeakPolarHBondContact CZ2-OE1 3.25Å; W431-F571 HydrophobicContact CZ3-CE2 4.2Å; W431-I580 HydrophobicContact CD2-CG2 3.92Å; W431-I580 HydrophobicContact CE3-CG2 4.16Å; W431-I580 HydrophobicContact CG-CG2 4.37Å; W431-I580 HydrophobicContact CH2-CB 4.3Å; W431-I580 HydrophobicContact CH2-CG1 4.11Å; W431-I580 HydrophobicContact CZ2-CB 3.95Å; W431-I580 HydrophobicContact CZ2-CG1 4.21Å; W431-I580 HydrophobicContact CZ2-CG2 4.26Å; W431-I580 HydrophobicContact CZ3-CG2 4.46Å; W431-D581 PolarHBondContact NE1-OD1 3.39Å; W431-I584 HydrophobicContact CB-CD1 3.85Å; W431-I584 HydrophobicContact CG-CD1 3.77Å
432	N	94.1	Very high	91.5	Very high	10 Å²	10	13.7 Å²	13.7	5%	0.053	7%	0.074	C	C	.	.	H	α-helix	trans	-66.9	-43.8	-178.7	173.2	67.1	0	0	0	111	Y430 F435 T436 M561 A563 T566	Y430-N432 VanDerWaalsContact C-N 3.26Å; Y430-N432 PolarHBondContact O-N 3.37Å; N432-F435 PolarHBondContact O-N 2.88Å; N432-T436 WeakPolarHBondContact O-CB 3.18Å; N432-T436 PolarHBondContact O-N 3.19Å; N432-T436 PolarHBondContact O-OG1 2.86Å; N432-T436 VanDerWaalsContact O-OG1 3.1Å; N432-M561 PolarHBondContact ND2-O 3.33Å; N432-A563 HydrophobicContact CB-CB 3.77Å; N432-T566 VanDerWaalsContact OD1-CB 3.26Å; N432-T566 WeakPolarHBondContact OD1-CB 3.16Å; N432-T566 PolarHBondContact OD1-OG1 2.94Å
433	E	94.5	Very high	91.6	Very high	23 Å²	23	14.5 Å²	14.5	11%	0.107	8%	0.076	C	C	.	.	H	α-helix	trans	-64.9	-43	177.3	-62.4	-165.8	-138.8	0	0	111.4	Y430 T436 L437 V507 L558	Y430-E433 PolarHBondContact O-N 2.94Å; E433-T436 PolarHBondContact O-N 2.85Å; E433-L437 WeakPolarHBondContact O-CG 3.28Å; E433-L437 PolarHBondContact O-N 3.4Å; E433-V507 HydrophobicContact CB-CG1 3.5Å; E433-V507 HydrophobicContact CG-CG1 4.36Å; E433-L558 HydrophobicContact CB-CD1 4.38Å; E433-L558 HydrophobicContact CB-CD2 3.75Å; E433-L558 HydrophobicContact CB-CG 3.81Å; E433-L558 HydrophobicContact CG-CD2 4.28Å; E433-L558 HydrophobicContact CG-CG 3.91Å
434	L	94.1	Very high	91.5	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.01	11%	0.11	C	C	.	.	H	α-helix	trans	-63.4	-43	175	-71.1	175.6	0	0	0	112.4	W408 Y430 W431 L437 G438 K504 L508	W408-L434 HydrophobicContact CZ3-CD2 4.28Å; Y430-L434 WeakPolarHBondContact O-CG 3.48Å; Y430-L434 PolarHBondContact O-N 2.95Å; W431-L434 PolarHBondContact O-N 3.15Å; L434-L437 PolarHBondContact O-N 2.73Å; L434-G438 PolarHBondContact O-N 2.78Å; L434-K504 HydrophobicContact CD2-CB 3.85Å; L434-K504 HydrophobicContact CD2-CG 4.12Å; L434-L508 HydrophobicContact CD1-CD1 4.03Å; L434-L508 HydrophobicContact CD2-CB 4.37Å
435	F	94.6	Very high	91.3	Very high	1 Å²	1	25.2 Å²	25.2	0%	0.004	13%	0.13	C	C	.	.	H	α-helix	trans	-62.1	-45.8	176.4	174.2	-98.6	0	0	0	111	A398 L401 L402 W431 N432 G438 L439 T566 F570 F571	A398-F435 HydrophobicContact CB-CE2 4.2Å; A398-F435 HydrophobicContact CB-CZ 4.05Å; A398-F435 WeakPolarHBondContact O-CE2 3.26Å; L401-F435 HydrophobicContact CB-CE2 4.17Å; L401-F435 HydrophobicContact CD2-CD2 3.99Å; L401-F435 HydrophobicContact CD2-CE2 3.66Å; L401-F435 HydrophobicContact CD2-CZ 4.23Å; L401-F435 HydrophobicContact CG-CD2 4.08Å; L401-F435 HydrophobicContact CG-CE2 3.99Å; L402-F435 HydrophobicContact CB-CD2 4.35Å; L402-F435 HydrophobicContact CD1-CD2 4.44Å; W431-F435 HydrophobicContact CE3-CB 4.28Å; W431-F435 HydrophobicContact CZ3-CB 4.49Å; W431-F435 WeakPolarHBondContact O-CB 3.21Å; W431-F435 PolarHBondContact O-N 3.36Å; N432-F435 PolarHBondContact O-N 2.88Å; F435-G438 CarbonylContact O-C 3.58Å; F435-G438 PolarHBondContact O-N 3.21Å; F435-L439 WeakPolarHBondContact O-CB 3.46Å; F435-L439 PolarHBondContact O-N 2.93Å; F435-T566 HydrophobicContact CD1-CG2 3.81Å; F435-T566 HydrophobicContact CE1-CG2 3.79Å; F435-F570 HydrophobicContact CE1-CD2 4.05Å; F435-F570 HydrophobicContact CE1-CE2 4.29Å; F435-F570 HydrophobicContact CE1-CG 4.27Å; F435-F570 HydrophobicContact CZ-CB 4.45Å; F435-F570 HydrophobicContact CZ-CD1 4.32Å; F435-F570 HydrophobicContact CZ-CD2 4.37Å; F435-F570 HydrophobicContact CZ-CG 4.13Å; F435-F571 HydrophobicContact CD2-CZ 4.23Å; F435-F571 HydrophobicContact CE1-CE2 4.42Å; F435-F571 HydrophobicContact CE2-CE2 4.29Å; F435-F571 AromaticContact CE2-CZ 3.76Å; F435-F571 HydrophobicContact CE2-CZ 3.76Å; F435-F571 HydrophobicContact CZ-CE2 4.13Å; F435-F571 HydrophobicContact CZ-CZ 4.01Å
436	T	94.6	Very high	90.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-65.4	-38	177.7	-62.9	0	0	0	0	112.3	N432 E433 L439 A440 L483 F486 L558	N432-T436 WeakPolarHBondContact O-CB 3.18Å; N432-T436 PolarHBondContact O-N 3.19Å; N432-T436 PolarHBondContact O-OG1 2.86Å; N432-T436 VanDerWaalsContact O-OG1 3.1Å; E433-T436 PolarHBondContact O-N 2.85Å; T436-L439 PolarHBondContact O-N 3.37Å; T436-A440 PolarHBondContact O-N 3.24Å; T436-L483 HydrophobicContact CG2-CD1 3.63Å; T436-F486 HydrophobicContact CG2-CD1 3.63Å; T436-F486 HydrophobicContact CG2-CE1 3.65Å; T436-L558 HydrophobicContact CG2-CD1 3.51Å
437	L	94.6	Very high	90.5	Very high	1 Å²	1	27 Å²	27	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-65.3	-40.4	171.3	-75.7	173.6	0	0	0	112.2	E433 L434 L439 A440 Q441 F486 M490 K504 V507 L558	E433-L437 WeakPolarHBondContact O-CG 3.28Å; E433-L437 PolarHBondContact O-N 3.4Å; L434-L437 PolarHBondContact O-N 2.73Å; L437-L439 VanDerWaalsContact C-N 3.33Å; L437-A440 PolarHBondContact O-N 3.45Å; L437-Q441 WeakPolarHBondContact O-CB 3.24Å; L437-Q441 PolarHBondContact O-N 3.01Å; L437-F486 HydrophobicContact CD2-CE1 4.42Å; L437-F486 HydrophobicContact CD2-CZ 3.93Å; L437-M490 HydrophobicContact CD2-CE 3.68Å; L437-K504 HydrophobicContact CB-CG 3.99Å; L437-K504 HydrophobicContact CD1-CB 4.47Å; L437-K504 HydrophobicContact CD1-CG 3.86Å; L437-V507 HydrophobicContact CD1-CB 4.43Å; L437-V507 HydrophobicContact CD1-CG2 4.02Å; L437-L558 HydrophobicContact CD1-CD2 3.79Å; L437-L558 HydrophobicContact CD2-CD2 4.15Å; L437-L558 HydrophobicContact CG-CD2 3.7Å
438	G	92.1	Very high	90.2	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.4	-41.6	172.9	0	0	0	0	0	112.2	L434 F435 Q441 C442	L434-G438 PolarHBondContact O-N 2.78Å; F435-G438 CarbonylContact O-C 3.58Å; F435-G438 PolarHBondContact O-N 3.21Å; G438-Q441 PolarHBondContact O-N 3.03Å; G438-C442 WeakPolarHBondContact O-CB 3.22Å; G438-C442 PolarHBondContact O-N 3.48Å
439	L	92.1	Very high	89.9	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-64.1	-42.5	177.3	-173.4	70.5	0	0	0	111.3	L401 F435 T436 L437 C442 W443 M446 V448 L483 F570	L401-L439 HydrophobicContact CD2-CB 3.96Å; L401-L439 HydrophobicContact CD2-CD1 4.07Å; F435-L439 WeakPolarHBondContact O-CB 3.46Å; F435-L439 PolarHBondContact O-N 2.93Å; T436-L439 PolarHBondContact O-N 3.37Å; L437-L439 VanDerWaalsContact C-N 3.33Å; L439-C442 CarbonylContact O-C 3.52Å; L439-C442 PolarHBondContact O-N 3.44Å; L439-W443 WeakPolarHBondContact O-CA 3.46Å; L439-W443 PolarHBondContact O-N 2.62Å; L439-M446 HydrophobicContact CD1-CE 4Å; L439-M446 HydrophobicContact CD1-SD 3.67Å; L439-V448 HydrophobicContact CD1-CG1 4.22Å; L439-V448 HydrophobicContact CD1-CG2 3.5Å; L439-V448 VanDerWaalsContact CD1-CG2 3.5Å; L439-V448 HydrophobicContact CD2-CG1 4.1Å; L439-V448 HydrophobicContact CG-CG1 4.14Å; L439-V448 HydrophobicContact CG-CG2 3.93Å; L439-L483 HydrophobicContact CD2-CD1 4.02Å; L439-L483 HydrophobicContact CD2-CD2 3.94Å; L439-L483 HydrophobicContact CD2-CG 4.22Å; L439-F570 HydrophobicContact CD2-CZ 3.99Å
440	A	92.5	Very high	89.6	Confident	3 Å²	3	27 Å²	27	3%	0.025	15%	0.145	C	C	.	.	H	α-helix	trans	-64.1	-41.6	175.2	0	0	0	0	0	111.9	T436 L437 W443 F486 M490 Y500	T436-A440 PolarHBondContact O-N 3.24Å; L437-A440 PolarHBondContact O-N 3.45Å; A440-W443 VanDerWaalsContact O-CB 3.31Å; A440-W443 WeakPolarHBondContact O-CB 3.35Å; A440-W443 PolarHBondContact O-N 3.39Å; A440-F486 HydrophobicContact CB-CE1 4.11Å; A440-M490 HydrophobicContact CB-CB 4.1Å; A440-M490 HydrophobicContact CB-CG 4.08Å; A440-Y500 HydrophobicContact CB-CE1 4.21Å; A440-Y500 PolarHBondContact O-OH 3.3Å
441	Q	92.4	Very high	89.3	Confident	45 Å²	45	26.8 Å²	26.8	21%	0.21	14%	0.144	C	C	.	.	H	α-helix	trans	-65.8	-37.9	176.2	-170.5	173	16.9	0	0	112.3	F377 L437 G438 W443 Y500	F377-Q441 HydrophobicContact CD1-CG 4.38Å; F377-Q441 VanDerWaalsContact CG-OE1 3.32Å; L437-Q441 WeakPolarHBondContact O-CB 3.24Å; L437-Q441 PolarHBondContact O-N 3.01Å; G438-Q441 PolarHBondContact O-N 3.03Å; Q441-W443 VanDerWaalsContact C-N 3.34Å; Q441-Y500 HydrophobicContact CB-CD1 3.9Å; Q441-Y500 HydrophobicContact CB-CD2 4.09Å; Q441-Y500 HydrophobicContact CB-CE1 3.89Å; Q441-Y500 HydrophobicContact CB-CE2 4.1Å; Q441-Y500 HydrophobicContact CB-CG 4.01Å; Q441-Y500 HydrophobicContact CG-CD1 4.34Å; Q441-Y500 HydrophobicContact CG-CD2 3.75Å; Q441-Y500 HydrophobicContact CG-CE2 4.04Å; Q441-Y500 HydrophobicContact CG-CG 3.92Å
442	C	89.5	Confident	88.9	Confident	5 Å²	5	26.7 Å²	26.7	3%	0.034	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	17.6	179	-62.7	0	0	0	0	113.5	L379 G438 L439 Q444 V445 M446	L379-C442 HydrophobicContact CD2-CB 4.2Å; G438-C442 WeakPolarHBondContact O-CB 3.22Å; G438-C442 PolarHBondContact O-N 3.48Å; L439-C442 CarbonylContact O-C 3.52Å; L439-C442 PolarHBondContact O-N 3.44Å; C442-Q444 VanDerWaalsContact C-N 3.29Å; C442-Q444 PolarHBondContact O-N 3.23Å; C442-Q444 VanDerWaalsContact O-N 3.17Å; C442-V445 PolarHBondContact O-N 2.97Å; C442-M446 HydrophobicContact CB-CG 4.21Å; C442-M446 HydrophobicContact CB-SD 4.31Å; C442-M446 PolarHBondContact O-N 3.15Å
443	W	88	Confident	88.4	Confident	34 Å²	34	29 Å²	29	13%	0.129	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-45.9	-172.7	171	-92.1	0	0	0	113.6	L439 A440 Q441 N447 V448 A449 L452 C487 V491	L439-W443 WeakPolarHBondContact O-CA 3.46Å; L439-W443 PolarHBondContact O-N 2.62Å; A440-W443 VanDerWaalsContact O-CB 3.31Å; A440-W443 WeakPolarHBondContact O-CB 3.35Å; A440-W443 PolarHBondContact O-N 3.39Å; Q441-W443 VanDerWaalsContact C-N 3.34Å; W443-N447 PolarHBondContact O-N 3.17Å; W443-V448 HydrophobicContact CD2-CB 3.88Å; W443-V448 HydrophobicContact CD2-CG2 4.47Å; W443-V448 HydrophobicContact CE3-CB 3.29Å; W443-V448 HydrophobicContact CE3-CG1 3.5Å; W443-V448 HydrophobicContact CE3-CG2 4Å; W443-V448 HydrophobicContact CH2-CB 4.18Å; W443-V448 HydrophobicContact CH2-CG1 4.16Å; W443-V448 HydrophobicContact CZ3-CB 3.46Å; W443-V448 VanDerWaalsContact CZ3-CB 3.46Å; W443-V448 HydrophobicContact CZ3-CG1 3.26Å; W443-V448 PolarHBondContact O-N 3.08Å; W443-V448 VanDerWaalsContact O-N 3.16Å; W443-A449 HydrophobicContact CH2-CB 4.15Å; W443-A449 HydrophobicContact CZ2-CB 3.64Å; W443-L452 HydrophobicContact CH2-CD1 4.16Å; W443-L452 HydrophobicContact CZ3-CD1 4.01Å; W443-C487 HydrophobicContact CD2-CB 4.27Å; W443-C487 HydrophobicContact CE3-CB 3.29Å; W443-C487 HydrophobicContact CH2-CB 4.37Å; W443-C487 HydrophobicContact CZ3-CB 3.37Å; W443-V491 HydrophobicContact CB-CG2 4.29Å; W443-V491 HydrophobicContact CG-CG2 4.03Å
444	Q	83.9	Confident	87.9	Confident	168 Å²	168	29.5 Å²	29.5	79%	0.785	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-42.9	-179.9	-64.7	178.7	-6.1	0	0	111.8	C442 M446 N447	C442-Q444 VanDerWaalsContact C-N 3.29Å; C442-Q444 PolarHBondContact O-N 3.23Å; C442-Q444 VanDerWaalsContact O-N 3.17Å; Q444-M446 PolarHBondContact O-N 2.88Å; Q444-N447 PolarHBondContact O-N 3.35Å
445	V	83.7	Confident	87.5	Confident	79 Å²	79	30.2 Å²	30.2	48%	0.479	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-41.1	-176.9	178.6	0	0	0	0	111.3	M381 C442 N447	M381-V445 HydrophobicContact CG-CG1 3.73Å; M381-V445 HydrophobicContact SD-CG1 4.23Å; C442-V445 PolarHBondContact O-N 2.97Å; V445-N447 VanDerWaalsContact C-N 3.33Å
446	M	80.4	Confident	86.9	Confident	5 Å²	5	32.7 Å²	32.7	3%	0.025	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-6.9	178.5	-67.9	-174.3	72.9	0	0	113.6	L379 M381 L401 L439 C442 Q444 V448 I451	L379-M446 HydrophobicContact CD2-CG 3.37Å; L379-M446 HydrophobicContact CD2-SD 3.53Å; L379-M446 VanDerWaalsContact CD2-SD 3.53Å; M381-M446 HydrophobicContact CE-CG 4.37Å; M381-M446 HydrophobicContact SD-CG 3.87Å; L401-M446 HydrophobicContact CB-SD 4.34Å; L401-M446 HydrophobicContact CD2-CE 4.36Å; L401-M446 HydrophobicContact CD2-SD 3.61Å; L401-M446 HydrophobicContact CG-SD 4.46Å; L439-M446 HydrophobicContact CD1-CE 4Å; L439-M446 HydrophobicContact CD1-SD 3.67Å; C442-M446 HydrophobicContact CB-CG 4.21Å; C442-M446 HydrophobicContact CB-SD 4.31Å; C442-M446 PolarHBondContact O-N 3.15Å; Q444-M446 PolarHBondContact O-N 2.88Å; M446-V448 VanDerWaalsContact C-N 3.29Å; M446-V448 HydrophobicContact CB-CG2 3.72Å; M446-V448 PolarHBondContact O-N 3.43Å; M446-I451 HydrophobicContact CB-CD1 4.24Å; M446-I451 HydrophobicContact CE-CD1 4.36Å; M446-I451 WeakPolarHBondContact O-CD1 3.46Å
447	N	82.9	Confident	86.4	Confident	78 Å²	78	37 Å²	37	42%	0.417	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.2	55.6	-169.3	-167.9	-3	0	0	0	112	W443 Q444 V445 A449 T450 I451	W443-N447 PolarHBondContact O-N 3.17Å; Q444-N447 PolarHBondContact O-N 3.35Å; V445-N447 VanDerWaalsContact C-N 3.33Å; N447-A449 PolarHBondContact O-N 3.3Å; N447-A449 VanDerWaalsContact O-N 3.16Å; N447-T450 PolarHBondContact ND2-OG1 3.02Å; N447-T450 PolarHBondContact O-N 3.39Å; N447-T450 PolarHBondContact OD1-N 2.92Å; N447-T450 PolarHBondContact OD1-OG1 3.23Å; N447-I451 PolarHBondContact O-N 3.26Å; N447-I451 VanDerWaalsContact O-N 3.12Å
448	V	84.7	Confident	85.5	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.6	-28.5	-173.1	-179.4	0	0	0	0	111.4	L439 W443 M446 T450 I451 L452	L439-V448 HydrophobicContact CD1-CG1 4.22Å; L439-V448 HydrophobicContact CD1-CG2 3.5Å; L439-V448 VanDerWaalsContact CD1-CG2 3.5Å; L439-V448 HydrophobicContact CD2-CG1 4.1Å; L439-V448 HydrophobicContact CG-CG1 4.14Å; L439-V448 HydrophobicContact CG-CG2 3.93Å; W443-V448 HydrophobicContact CD2-CB 3.88Å; W443-V448 HydrophobicContact CD2-CG2 4.47Å; W443-V448 HydrophobicContact CE3-CB 3.29Å; W443-V448 HydrophobicContact CE3-CG1 3.5Å; W443-V448 HydrophobicContact CE3-CG2 4Å; W443-V448 HydrophobicContact CH2-CB 4.18Å; W443-V448 HydrophobicContact CH2-CG1 4.16Å; W443-V448 HydrophobicContact CZ3-CB 3.46Å; W443-V448 VanDerWaalsContact CZ3-CB 3.46Å; W443-V448 HydrophobicContact CZ3-CG1 3.26Å; W443-V448 PolarHBondContact O-N 3.08Å; W443-V448 VanDerWaalsContact O-N 3.16Å; M446-V448 VanDerWaalsContact C-N 3.29Å; M446-V448 HydrophobicContact CB-CG2 3.72Å; M446-V448 PolarHBondContact O-N 3.43Å; V448-T450 VanDerWaalsContact C-N 3.33Å; V448-T450 PolarHBondContact O-N 3.34Å; V448-I451 PolarHBondContact O-N 2.88Å; V448-L452 HydrophobicContact CG1-CD1 3.83Å; V448-L452 HydrophobicContact CG1-CG 3.95Å; V448-L452 WeakPolarHBondContact O-CB 3.21Å; V448-L452 VanDerWaalsContact O-CG 3.26Å; V448-L452 WeakPolarHBondContact O-CG 3.41Å; V448-L452 PolarHBondContact O-N 2.78Å
449	A	84.1	Confident	84.8	Confident	43 Å²	43	41.7 Å²	41.7	36%	0.355	24%	0.24	S	C	.	.	H	α-helix	trans	-54.4	-48.2	171.5	0	0	0	0	0	112.1	W443 N447 A453	W443-A449 HydrophobicContact CH2-CB 4.15Å; W443-A449 HydrophobicContact CZ2-CB 3.64Å; N447-A449 PolarHBondContact O-N 3.3Å; N447-A449 VanDerWaalsContact O-N 3.16Å; A449-A453 WeakPolarHBondContact O-CB 3.33Å; A449-A453 PolarHBondContact O-N 3.16Å
450	T	84.3	Confident	84	Confident	58 Å²	58	46.8 Å²	46.8	36%	0.356	26%	0.264	S	S	.	.	H	α-helix	trans	-69.3	-40.3	177.3	-58.2	0	0	0	0	111.3	L389 N447 V448 L452 A453 T454	L389-T450 HydrophobicContact CD2-CG2 4.23Å; N447-T450 PolarHBondContact ND2-OG1 3.02Å; N447-T450 PolarHBondContact O-N 3.39Å; N447-T450 PolarHBondContact OD1-N 2.92Å; N447-T450 PolarHBondContact OD1-OG1 3.23Å; V448-T450 VanDerWaalsContact C-N 3.33Å; V448-T450 PolarHBondContact O-N 3.34Å; T450-L452 PolarHBondContact O-N 3.37Å; T450-A453 PolarHBondContact O-N 2.96Å; T450-T454 WeakPolarHBondContact O-CG2 3.39Å; T450-T454 PolarHBondContact O-N 3.17Å; T450-T454 PolarHBondContact O-OG1 2.75Å
451	I	85.4	Confident	82.9	Confident	4 Å²	4	50.2 Å²	50.2	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-56.2	-51.2	174.9	-65.4	172.2	0	0	0	110.8	L389 I394 M446 N447 V448 A453 T454 F455 F570	L389-I451 HydrophobicContact CD2-CB 4.21Å; L389-I451 HydrophobicContact CD2-CG1 3.51Å; I394-I451 HydrophobicContact CD1-CG2 4.31Å; I394-I451 HydrophobicContact CG1-CG1 4.32Å; I394-I451 HydrophobicContact CG1-CG2 4.47Å; I394-I451 HydrophobicContact CG2-CG2 3.79Å; M446-I451 HydrophobicContact CB-CD1 4.24Å; M446-I451 HydrophobicContact CE-CD1 4.36Å; M446-I451 WeakPolarHBondContact O-CD1 3.46Å; N447-I451 PolarHBondContact O-N 3.26Å; N447-I451 VanDerWaalsContact O-N 3.12Å; V448-I451 PolarHBondContact O-N 2.88Å; I451-A453 VanDerWaalsContact C-N 3.34Å; I451-A453 PolarHBondContact O-N 2.87Å; I451-T454 WeakPolarHBondContact CA-OG1 3.33Å; I451-T454 PolarHBondContact O-N 2.93Å; I451-T454 VanDerWaalsContact O-N 3.15Å; I451-T454 PolarHBondContact O-OG1 3.36Å; I451-F455 HydrophobicContact CG2-CD2 4.03Å; I451-F455 HydrophobicContact CG2-CE2 3.49Å; I451-F455 VanDerWaalsContact CG2-CE2 3.49Å; I451-F455 HydrophobicContact CG2-CZ 3.9Å; I451-F455 PolarHBondContact O-N 2.94Å; I451-F570 HydrophobicContact CG2-CE1 3.99Å
452	L	84.4	Confident	81.7	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-65.1	-39.3	-178.6	-62.9	173.6	0	0	0	111.3	W443 V448 T450 T454 F455 V456 I480 L483 Q484	W443-L452 HydrophobicContact CH2-CD1 4.16Å; W443-L452 HydrophobicContact CZ3-CD1 4.01Å; V448-L452 HydrophobicContact CG1-CD1 3.83Å; V448-L452 HydrophobicContact CG1-CG 3.95Å; V448-L452 WeakPolarHBondContact O-CB 3.21Å; V448-L452 VanDerWaalsContact O-CG 3.26Å; V448-L452 WeakPolarHBondContact O-CG 3.41Å; V448-L452 PolarHBondContact O-N 2.78Å; T450-L452 PolarHBondContact O-N 3.37Å; L452-T454 VanDerWaalsContact C-N 3.32Å; L452-T454 PolarHBondContact O-N 3.2Å; L452-F455 HydrophobicContact CD2-CD2 4.33Å; L452-F455 PolarHBondContact O-N 3.38Å; L452-V456 WeakPolarHBondContact O-CG2 3.4Å; L452-V456 PolarHBondContact O-N 3.44Å; L452-I480 HydrophobicContact CB-CG2 4.3Å; L452-I480 HydrophobicContact CD2-CG2 4.15Å; L452-L483 HydrophobicContact CD2-CD2 3.97Å; L452-L483 HydrophobicContact CD2-CG 4.49Å; L452-Q484 HydrophobicContact CD1-CB 3.73Å; L452-Q484 HydrophobicContact CD1-CG 3.92Å
453	A	84.4	Confident	80	Confident	58 Å²	58	52.9 Å²	52.9	48%	0.479	30%	0.299	S	S	.	.	H	α-helix	trans	-61.2	-39.8	173.6	0	0	0	0	0	112.3	A449 T450 I451 V456 N457	A449-A453 WeakPolarHBondContact O-CB 3.33Å; A449-A453 PolarHBondContact O-N 3.16Å; T450-A453 PolarHBondContact O-N 2.96Å; I451-A453 VanDerWaalsContact C-N 3.34Å; I451-A453 PolarHBondContact O-N 2.87Å; A453-V456 PolarHBondContact O-N 3.36Å; A453-N457 WeakPolarHBondContact O-CB 3.43Å; A453-N457 PolarHBondContact O-N 3.1Å
454	T	83.4	Confident	78.6	Confident	34 Å²	34	59 Å²	59	21%	0.209	33%	0.328	C	S	.	.	H	α-helix	trans	-63.9	-41.2	174.9	56.8	0	0	0	0	111.9	L389 T450 I451 L452 V456 N457 C458	L389-T454 HydrophobicContact CB-CG2 4.18Å; L389-T454 HydrophobicContact CD2-CG2 4.26Å; T450-T454 WeakPolarHBondContact O-CG2 3.39Å; T450-T454 PolarHBondContact O-N 3.17Å; T450-T454 PolarHBondContact O-OG1 2.75Å; I451-T454 WeakPolarHBondContact CA-OG1 3.33Å; I451-T454 PolarHBondContact O-N 2.93Å; I451-T454 VanDerWaalsContact O-N 3.15Å; I451-T454 PolarHBondContact O-OG1 3.36Å; L452-T454 VanDerWaalsContact C-N 3.32Å; L452-T454 PolarHBondContact O-N 3.2Å; T454-V456 PolarHBondContact O-N 3.31Å; T454-N457 PolarHBondContact O-N 2.88Å; T454-C458 WeakPolarHBondContact O-CB 3.28Å; T454-C458 PolarHBondContact O-N 2.92Å; T454-C458 PolarHBondContact O-SG 3.21Å
455	F	84.8	Confident	77.3	Confident	18 Å²	18	57.2 Å²	57.2	8%	0.079	32%	0.32	C	S	.	.	H	α-helix	trans	-62.5	-43.5	175.1	-67.7	-36.9	0	0	0	112.7	I394 I451 L452 N457 C458 L459 I480 L569 F570	I394-F455 HydrophobicContact CD1-CE1 4.32Å; I394-F455 HydrophobicContact CG2-CE1 4.43Å; I394-F455 HydrophobicContact CG2-CZ 3.81Å; I451-F455 HydrophobicContact CG2-CD2 4.03Å; I451-F455 HydrophobicContact CG2-CE2 3.49Å; I451-F455 VanDerWaalsContact CG2-CE2 3.49Å; I451-F455 HydrophobicContact CG2-CZ 3.9Å; I451-F455 PolarHBondContact O-N 2.94Å; L452-F455 HydrophobicContact CD2-CD2 4.33Å; L452-F455 PolarHBondContact O-N 3.38Å; F455-N457 VanDerWaalsContact C-N 3.3Å; F455-N457 PolarHBondContact O-N 3.11Å; F455-C458 PolarHBondContact O-N 3.43Å; F455-L459 WeakPolarHBondContact O-CB 3.38Å; F455-L459 VanDerWaalsContact O-CG 3.26Å; F455-L459 WeakPolarHBondContact O-CG 3.21Å; F455-L459 PolarHBondContact O-N 3.03Å; F455-I480 HydrophobicContact CB-CD1 3.7Å; F455-I480 HydrophobicContact CB-CG1 4.5Å; F455-L569 HydrophobicContact CD2-CD2 4.49Å; F455-L569 VanDerWaalsContact CE1-O 3.31Å; F455-L569 WeakPolarHBondContact CE1-O 3.46Å; F455-L569 HydrophobicContact CE2-CB 4.17Å; F455-L569 HydrophobicContact CG-CD2 4.46Å; F455-L569 HydrophobicContact CZ-CB 4.3Å; F455-L569 WeakPolarHBondContact CZ-O 2.93Å; F455-F570 HydrophobicContact CE2-CD1 4.27Å; F455-F570 AromaticContact CE2-CE1 3.91Å; F455-F570 HydrophobicContact CE2-CE1 3.91Å; F455-F570 HydrophobicContact CE2-CE2 4.34Å; F455-F570 AromaticContact CE2-CZ 3.95Å; F455-F570 HydrophobicContact CE2-CZ 3.95Å; F455-F570 HydrophobicContact CZ-CD1 4.25Å; F455-F570 HydrophobicContact CZ-CE1 4.31Å
456	V	83.5	Confident	75.7	Confident	53 Å²	53	60.4 Å²	60.4	32%	0.321	34%	0.335	S	S	.	.	H	α-helix	trans	-59.1	-43.9	175	173.9	0	0	0	0	110.7	L452 A453 T454 L459 H460 M477 I480	L452-V456 WeakPolarHBondContact O-CG2 3.4Å; L452-V456 PolarHBondContact O-N 3.44Å; A453-V456 PolarHBondContact O-N 3.36Å; T454-V456 PolarHBondContact O-N 3.31Å; V456-L459 PolarHBondContact O-N 2.98Å; V456-H460 WeakPolarHBondContact O-CB 3.49Å; V456-H460 PolarHBondContact O-N 3.14Å; V456-M477 HydrophobicContact CB-CE 4.44Å; V456-M477 HydrophobicContact CB-SD 4.34Å; V456-M477 HydrophobicContact CG1-CE 3.8Å; V456-M477 HydrophobicContact CG1-SD 4.21Å; V456-M477 HydrophobicContact CG2-CE 4Å; V456-M477 HydrophobicContact CG2-SD 3.92Å; V456-I480 HydrophobicContact CG2-CG2 3.95Å
457	N	82.5	Confident	74.7	Confident	91 Å²	91	67.7 Å²	67.7	49%	0.487	37%	0.366	S	S	.	.	H	α-helix	trans	-67	-41.7	178.8	-165.7	30.2	0	0	0	112.4	A453 T454 F455 L459 H460 N461	A453-N457 WeakPolarHBondContact O-CB 3.43Å; A453-N457 PolarHBondContact O-N 3.1Å; T454-N457 PolarHBondContact O-N 2.88Å; F455-N457 VanDerWaalsContact C-N 3.3Å; F455-N457 PolarHBondContact O-N 3.11Å; N457-L459 PolarHBondContact O-N 2.91Å; N457-H460 PolarHBondContact O-N 3.15Å; N457-N461 VanDerWaalsContact O-CG 3.31Å; N457-N461 PolarHBondContact O-N 3.49Å; N457-N461 PolarHBondContact O-ND2 3.01Å
458	C	77.2	Confident	74	Confident	71 Å²	71	68.3 Å²	68.3	48%	0.48	37%	0.368	S	S	.	.	H	α-helix	trans	-61.2	-42.9	174.7	-71.6	0	0	0	0	111.9	T454 F455 H460 N461 S462	T454-C458 WeakPolarHBondContact O-CB 3.28Å; T454-C458 PolarHBondContact O-N 2.92Å; T454-C458 PolarHBondContact O-SG 3.21Å; F455-C458 PolarHBondContact O-N 3.43Å; C458-H460 VanDerWaalsContact C-N 3.3Å; C458-H460 PolarHBondContact O-N 3.29Å; C458-N461 PolarHBondContact O-N 3.17Å; C458-S462 WeakPolarHBondContact O-CB 3.38Å; C458-S462 PolarHBondContact O-N 3.46Å
459	L	76.6	Confident	73.8	Confident	28 Å²	28	71.8 Å²	71.8	15%	0.147	39%	0.392	C	S	.	.	H	α-helix	trans	-65.3	-36.4	175.4	-70.4	169.7	0	0	0	111.7	F455 V456 N457 S462 L463 L476 M477 I480	F455-L459 WeakPolarHBondContact O-CB 3.38Å; F455-L459 VanDerWaalsContact O-CG 3.26Å; F455-L459 WeakPolarHBondContact O-CG 3.21Å; F455-L459 PolarHBondContact O-N 3.03Å; V456-L459 PolarHBondContact O-N 2.98Å; N457-L459 PolarHBondContact O-N 2.91Å; L459-S462 PolarHBondContact O-N 3.47Å; L459-L463 PolarHBondContact O-N 3.34Å; L459-L476 HydrophobicContact CD1-CB 4.05Å; L459-L476 HydrophobicContact CD2-CB 4.3Å; L459-L476 HydrophobicContact CD2-CD1 3.87Å; L459-M477 HydrophobicContact CD1-CG 4.02Å; L459-M477 HydrophobicContact CD1-SD 3.75Å; L459-I480 HydrophobicContact CD1-CD1 3.44Å; L459-I480 VanDerWaalsContact CD1-CD1 3.44Å
460	H	75.3	Confident	73.5	Confident	107 Å²	107	73.8 Å²	73.8	50%	0.495	40%	0.4	S	S	.	.	H	α-helix	trans	-69.4	-41	175.9	-168.6	-84.6	0	0	0	112.1	V456 N457 C458 S462 L463	V456-H460 WeakPolarHBondContact O-CB 3.49Å; V456-H460 PolarHBondContact O-N 3.14Å; N457-H460 PolarHBondContact O-N 3.15Å; C458-H460 VanDerWaalsContact C-N 3.3Å; C458-H460 PolarHBondContact O-N 3.29Å; H460-S462 VanDerWaalsContact C-N 3.3Å; H460-S462 PolarHBondContact O-N 2.9Å; H460-L463 HydrophobicContact CB-CD1 4.4Å; H460-L463 WeakPolarHBondContact O-CB 3.49Å; H460-L463 PolarHBondContact O-N 3.23Å; H460-L463 VanDerWaalsContact O-N 3.09Å
461	N	70.3	Confident	73.3	Confident	75 Å²	75	78.8 Å²	78.8	40%	0.401	42%	0.419	S	S	.	.	H	α-helix	trans	-68.4	-31.7	175.8	-68.8	-25	0	0	0	112.1	N457 C458 L463 Q464	N457-N461 VanDerWaalsContact O-CG 3.31Å; N457-N461 PolarHBondContact O-N 3.49Å; N457-N461 PolarHBondContact O-ND2 3.01Å; C458-N461 PolarHBondContact O-N 3.17Å; N461-L463 PolarHBondContact O-N 3.48Å; N461-Q464 PolarHBondContact O-N 3.39Å; N461-Q464 VanDerWaalsContact O-N 3.07Å
462	S	65.8	Low	73.1	Confident	29 Å²	29	81.3 Å²	81.3	20%	0.203	43%	0.428	C	S	.	.	H	α-helix	trans	-65.6	-18.7	172	-168.8	0	0	0	0	113.1	C458 L459 H460 Q464 Q465 D466	C458-S462 WeakPolarHBondContact O-CB 3.38Å; C458-S462 PolarHBondContact O-N 3.46Å; L459-S462 PolarHBondContact O-N 3.47Å; H460-S462 VanDerWaalsContact C-N 3.3Å; H460-S462 PolarHBondContact O-N 2.9Å; S462-Q464 VanDerWaalsContact C-N 3.29Å; S462-Q464 PolarHBondContact O-N 2.69Å; S462-Q465 PolarHBondContact O-N 3.17Å; S462-D466 PolarHBondContact O-N 2.95Å
463	L	55.6	Low	72.9	Confident	77 Å²	77	82.9 Å²	82.9	40%	0.403	43%	0.434	S	S	.	.	H	α-helix	trans	-63.1	-34.8	168.9	-72.3	153.6	0	0	0	112.2	L459 H460 N461 Q465	L459-L463 PolarHBondContact O-N 3.34Å; H460-L463 HydrophobicContact CB-CD1 4.4Å; H460-L463 WeakPolarHBondContact O-CB 3.49Å; H460-L463 PolarHBondContact O-N 3.23Å; H460-L463 VanDerWaalsContact O-N 3.09Å; N461-L463 PolarHBondContact O-N 3.48Å; L463-Q465 VanDerWaalsContact C-N 3.31Å
464	Q	57.7	Low	73	Confident	161 Å²	161	87.1 Å²	87.1	75%	0.752	44%	0.442	S	S	*	.	H	α-helix	trans	-79.6	-16	-177.1	-64.7	-173.3	-2.3	0	0	112.7	N461 S462	N461-Q464 PolarHBondContact O-N 3.39Å; N461-Q464 VanDerWaalsContact O-N 3.07Å; S462-Q464 VanDerWaalsContact C-N 3.29Å; S462-Q464 PolarHBondContact O-N 2.69Å
465	Q	56.4	Low	73.2	Confident	132 Å²	132	89 Å²	89	62%	0.617	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	5.5	-176.9	-66.9	-169.9	2.4	0	0	114.6	S462 L463 K467	S462-Q465 PolarHBondContact O-N 3.17Å; L463-Q465 VanDerWaalsContact C-N 3.31Å; Q465-K467 WeakPolarHBondContact O-CG 3.45Å; Q465-K467 PolarHBondContact O-N 3.07Å
466	D	50.1	Low	73.4	Confident	145 Å²	145	88.6 Å²	88.6	78%	0.775	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	24.2	173.5	-143.5	19.6	0	0	0	117.3	S462	S462-D466 PolarHBondContact O-N 2.95Å
467	K	60.3	Low	73.5	Confident	158 Å²	158	89.5 Å²	89.5	69%	0.687	45%	0.451	S	S	*	.			trans	-87.4	-6.9	-174.5	-83	174.4	-178.5	175.1	0	115.4	Q465	Q465-K467 WeakPolarHBondContact O-CG 3.45Å; Q465-K467 PolarHBondContact O-N 3.07Å
468	M	67.6	Low	73.9	Confident	91 Å²	91	89.9 Å²	89.9	45%	0.448	45%	0.449	S	S	.	.	S	Bend	trans	-134.8	136.3	-171.2	-72.9	-68.1	153.6	0	0	112.6	R473	M468-R473 PolarHBondContact O-NH2 3.47Å
469	S	79.3	Confident	74.6	Confident	74 Å²	74	86.7 Å²	86.7	52%	0.517	43%	0.428	S	S	.	.			trans	-61.8	140.3	176.6	77.4	0	0	0	0	111.2	E471 R472 R473	S469-E471 PolarHBondContact O-N 3.44Å; S469-R472 PolarHBondContact O-N 3.45Å; S469-R472 WeakPolarHBondContact OG-CB 3.19Å; S469-R472 PolarHBondContact OG-N 3.43Å; S469-R473 PolarHBondContact O-N 2.95Å; S469-R473 VanDerWaalsContact O-N 3.15Å
470	T	77.8	Confident	75.3	Confident	84 Å²	84	85.5 Å²	85.5	52%	0.515	42%	0.421	S	S	.	.	H	α-helix	trans	-60.3	-29.8	-178.7	-61.2	0	0	0	0	112.5	K474	T470-K474 WeakPolarHBondContact O-CG 3.4Å; T470-K474 PolarHBondContact O-N 3.45Å
471	E	80.7	Confident	76	Confident	163 Å²	163	86.4 Å²	86.4	76%	0.762	42%	0.424	S	S	*	.	H	α-helix	trans	-70.6	-45.6	176.6	-171.2	171.3	-164.5	0	0	112.3	S469 R473 K474 L475	S469-E471 PolarHBondContact O-N 3.44Å; E471-R473 VanDerWaalsContact C-N 3.27Å; E471-R473 PolarHBondContact O-N 3.44Å; E471-K474 PolarHBondContact O-N 2.87Å; E471-L475 PolarHBondContact O-N 3.17Å; E471-L475 VanDerWaalsContact O-N 3.12Å
472	R	81.6	Confident	77.1	Confident	57 Å²	57	86.3 Å²	86.3	22%	0.215	42%	0.42	C	S	.	.	H	α-helix	trans	-60.4	-39.4	176	-178.2	57.8	177.6	166.1	-13.2	111.5	S469 L475 L476 E568	S469-R472 PolarHBondContact O-N 3.45Å; S469-R472 WeakPolarHBondContact OG-CB 3.19Å; S469-R472 PolarHBondContact OG-N 3.43Å; R472-L475 PolarHBondContact O-N 3.12Å; R472-L476 HydrophobicContact CG-CD1 4.12Å; R472-L476 WeakPolarHBondContact O-CG 3.28Å; R472-L476 PolarHBondContact O-N 3.35Å; R472-E568 IonicContact CZ-OE1 3.11Å; R472-E568 IonicContact CZ-OE2 3.38Å; R472-E568 IonicContact NE-OE1 3.63Å; R472-E568 PolarHBondContact NE-OE1 3.35Å; R472-E568 IonicContact NE-OE2 3.04Å; R472-E568 IonicContact NH2-OE1 2.7Å; R472-E568 PolarHBondContact NH2-OE1 3.22Å; R472-E568 VanDerWaalsContact NH2-OE1 3.11Å; R472-E568 IonicContact NH2-OE2 3.9Å; R472-E568 PolarHBondContact NH2-OE2 3.45Å
473	R	80.9	Confident	78.3	Confident	34 Å²	34	85 Å²	85	13%	0.128	41%	0.411	C	S	.	.	H	α-helix	trans	-63.3	-44.8	177.3	-167.2	-170.3	-55.1	120.6	3.8	112.5	M468 S469 E471 L475 L476 M477	M468-R473 PolarHBondContact O-NH2 3.47Å; S469-R473 PolarHBondContact O-N 2.95Å; S469-R473 VanDerWaalsContact O-N 3.15Å; E471-R473 VanDerWaalsContact C-N 3.27Å; E471-R473 PolarHBondContact O-N 3.44Å; R473-L475 VanDerWaalsContact C-N 3.31Å; R473-L475 PolarHBondContact O-N 3.37Å; R473-L476 PolarHBondContact O-N 2.86Å; R473-M477 PolarHBondContact O-N 2.95Å
474	K	85.4	Confident	80	Confident	147 Å²	147	84.6 Å²	84.6	64%	0.639	41%	0.407	S	S	*	.	H	α-helix	trans	-58.9	-45.7	176.6	-76.6	178.6	-179.2	-178	0	110.8	T470 E471 L476 M477 E478	T470-K474 WeakPolarHBondContact O-CG 3.4Å; T470-K474 PolarHBondContact O-N 3.45Å; E471-K474 PolarHBondContact O-N 2.87Å; K474-L476 PolarHBondContact O-N 3.24Å; K474-M477 PolarHBondContact O-N 2.88Å; K474-E478 WeakPolarHBondContact O-CB 3.36Å; K474-E478 PolarHBondContact O-N 3.41Å
475	L	88.3	Confident	81.6	Confident	73 Å²	73	82.4 Å²	82.4	38%	0.382	40%	0.396	S	S	.	.	H	α-helix	trans	-61.2	-42.8	179	-177.1	63.3	0	0	0	112.3	E471 R472 R473 H479 I565	E471-L475 PolarHBondContact O-N 3.17Å; E471-L475 VanDerWaalsContact O-N 3.12Å; R472-L475 PolarHBondContact O-N 3.12Å; R473-L475 VanDerWaalsContact C-N 3.31Å; R473-L475 PolarHBondContact O-N 3.37Å; L475-H479 WeakPolarHBondContact O-CB 3.39Å; L475-H479 PolarHBondContact O-N 3.41Å; L475-H479 VanDerWaalsContact O-N 3.08Å; L475-I565 HydrophobicContact CD1-CD1 3.7Å; L475-I565 HydrophobicContact CD2-CD1 3.94Å; L475-I565 HydrophobicContact CG-CD1 3.54Å
476	L	88.3	Confident	83.4	Confident	10 Å²	10	76.4 Å²	76.4	5%	0.052	37%	0.368	C	S	.	.	H	α-helix	trans	-65.4	-45.9	176.2	-73	162.9	0	0	0	112.3	L459 R472 R473 K474 H479 I480 I565 E568 L569	L459-L476 HydrophobicContact CD1-CB 4.05Å; L459-L476 HydrophobicContact CD2-CB 4.3Å; L459-L476 HydrophobicContact CD2-CD1 3.87Å; R472-L476 HydrophobicContact CG-CD1 4.12Å; R472-L476 WeakPolarHBondContact O-CG 3.28Å; R472-L476 PolarHBondContact O-N 3.35Å; R473-L476 PolarHBondContact O-N 2.86Å; K474-L476 PolarHBondContact O-N 3.24Å; L476-H479 PolarHBondContact O-N 2.99Å; L476-I480 VanDerWaalsContact O-CG1 3.3Å; L476-I480 WeakPolarHBondContact O-CG1 3.47Å; L476-I480 PolarHBondContact O-N 3.09Å; L476-I565 HydrophobicContact CD2-CG2 3.62Å; L476-E568 HydrophobicContact CD2-CG 4.14Å; L476-L569 HydrophobicContact CD2-CD2 3.83Å; L476-L569 HydrophobicContact CD2-CG 4.17Å
477	M	86.8	Confident	85.4	Confident	73 Å²	73	69.5 Å²	69.5	36%	0.36	33%	0.331	S	S	.	.	H	α-helix	trans	-63.8	-41.3	177.8	-80.6	-62.8	-75.5	0	0	112.4	V456 L459 R473 K474 H479 I480 F481	V456-M477 HydrophobicContact CB-CE 4.44Å; V456-M477 HydrophobicContact CB-SD 4.34Å; V456-M477 HydrophobicContact CG1-CE 3.8Å; V456-M477 HydrophobicContact CG1-SD 4.21Å; V456-M477 HydrophobicContact CG2-CE 4Å; V456-M477 HydrophobicContact CG2-SD 3.92Å; L459-M477 HydrophobicContact CD1-CG 4.02Å; L459-M477 HydrophobicContact CD1-SD 3.75Å; R473-M477 PolarHBondContact O-N 2.95Å; K474-M477 PolarHBondContact O-N 2.88Å; M477-H479 VanDerWaalsContact C-N 3.32Å; M477-H479 PolarHBondContact O-N 2.83Å; M477-I480 PolarHBondContact O-N 2.81Å; M477-I480 HydrophobicContact SD-CD1 4.46Å; M477-F481 WeakPolarHBondContact O-CB 3.36Å; M477-F481 PolarHBondContact O-N 3.27Å
478	E	90.8	Very high	86.9	Confident	98 Å²	98	65.4 Å²	65.4	46%	0.458	32%	0.317	S	S	.	.	H	α-helix	trans	-61.7	-42.5	176	-172.8	-175.4	161.5	0	0	111.2	K474 F481 K482	K474-E478 WeakPolarHBondContact O-CB 3.36Å; K474-E478 PolarHBondContact O-N 3.41Å; E478-F481 PolarHBondContact O-N 3.19Å; E478-K482 HydrophobicContact CG-CD 4.41Å; E478-K482 WeakPolarHBondContact O-CG 3.23Å; E478-K482 PolarHBondContact O-N 2.77Å; E478-K482 WeakPolarHBondContact OE1-CE 3.47Å; E478-K482 IonicContact OE1-NZ 2.74Å; E478-K482 PolarHBondContact OE1-NZ 2.97Å
479	H	91.8	Very high	88.1	Confident	5 Å²	5	62.3 Å²	62.3	2%	0.023	30%	0.304	C	S	.	.	H	α-helix	trans	-65.9	-42.7	176.9	-166.7	65.6	0	0	0	112.4	L475 L476 M477 F481 K482 L483 N562 I565 T566	L475-H479 WeakPolarHBondContact O-CB 3.39Å; L475-H479 PolarHBondContact O-N 3.41Å; L475-H479 VanDerWaalsContact O-N 3.08Å; L476-H479 PolarHBondContact O-N 2.99Å; M477-H479 VanDerWaalsContact C-N 3.32Å; M477-H479 PolarHBondContact O-N 2.83Å; H479-F481 VanDerWaalsContact C-N 3.31Å; H479-F481 PolarHBondContact O-N 2.86Å; H479-K482 PolarHBondContact O-N 3.22Å; H479-L483 WeakPolarHBondContact O-CB 3.34Å; H479-L483 PolarHBondContact O-N 3.33Å; H479-N562 PolarHBondContact CE1-N 3.19Å; H479-N562 VanDerWaalsContact CE1-N 3.31Å; H479-I565 HydrophobicContact CB-CB 4.37Å; H479-I565 HydrophobicContact CB-CD1 4.18Å; H479-I565 HydrophobicContact CB-CG2 3.67Å; H479-I565 VanDerWaalsContact CD2-CG2 3.4Å; H479-I565 WeakPolarHBondContact CD2-CG2 3.48Å; H479-T566 PolarHBondContact NE2-OG1 2.76Å
480	I	90.8	Very high	88.7	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-58.5	-45.1	174.4	-71	164.9	0	0	0	110.6	L452 F455 V456 L459 L476 M477 L483 Q484 L569	L452-I480 HydrophobicContact CB-CG2 4.3Å; L452-I480 HydrophobicContact CD2-CG2 4.15Å; F455-I480 HydrophobicContact CB-CD1 3.7Å; F455-I480 HydrophobicContact CB-CG1 4.5Å; V456-I480 HydrophobicContact CG2-CG2 3.95Å; L459-I480 HydrophobicContact CD1-CD1 3.44Å; L459-I480 VanDerWaalsContact CD1-CD1 3.44Å; L476-I480 VanDerWaalsContact O-CG1 3.3Å; L476-I480 WeakPolarHBondContact O-CG1 3.47Å; L476-I480 PolarHBondContact O-N 3.09Å; M477-I480 PolarHBondContact O-N 2.81Å; M477-I480 HydrophobicContact SD-CD1 4.46Å; I480-L483 PolarHBondContact O-N 3.36Å; I480-Q484 WeakPolarHBondContact O-CB 3.42Å; I480-Q484 PolarHBondContact O-N 2.89Å; I480-L569 HydrophobicContact CD1-CD1 4.48Å; I480-L569 HydrophobicContact CD1-CD2 4.03Å; I480-L569 HydrophobicContact CG1-CD1 3.75Å; I480-L569 HydrophobicContact CG1-CD2 4.19Å
481	F	90.8	Very high	89.3	Confident	127 Å²	127	57.8 Å²	57.8	56%	0.557	27%	0.273	S	S	*	.	H	α-helix	trans	-63.7	-46.6	178.8	-176.4	-94.2	0	0	0	111.8	M477 E478 H479 L483 Q484 E485	M477-F481 WeakPolarHBondContact O-CB 3.36Å; M477-F481 PolarHBondContact O-N 3.27Å; E478-F481 PolarHBondContact O-N 3.19Å; H479-F481 VanDerWaalsContact C-N 3.31Å; H479-F481 PolarHBondContact O-N 2.86Å; F481-L483 VanDerWaalsContact C-N 3.32Å; F481-L483 PolarHBondContact O-N 3.37Å; F481-Q484 WeakPolarHBondContact O-CB 3.47Å; F481-Q484 PolarHBondContact O-N 2.98Å; F481-E485 WeakPolarHBondContact O-CB 3.14Å; F481-E485 PolarHBondContact O-N 3.39Å
482	K	92.4	Very high	89.8	Confident	72 Å²	72	58.8 Å²	58.8	31%	0.313	28%	0.275	S	S	.	.	H	α-helix	trans	-57.4	-45.6	175.2	-74.8	173.6	-177.4	168.8	0	111.5	E478 H479 E485 F486 M561	E478-K482 HydrophobicContact CG-CD 4.41Å; E478-K482 WeakPolarHBondContact O-CG 3.23Å; E478-K482 PolarHBondContact O-N 2.77Å; E478-K482 WeakPolarHBondContact OE1-CE 3.47Å; E478-K482 IonicContact OE1-NZ 2.74Å; E478-K482 PolarHBondContact OE1-NZ 2.97Å; H479-K482 PolarHBondContact O-N 3.22Å; K482-E485 PolarHBondContact O-N 3.29Å; K482-F486 WeakPolarHBondContact O-CB 3.31Å; K482-F486 PolarHBondContact O-N 2.88Å; K482-M561 HydrophobicContact CB-CE 4.01Å; K482-M561 HydrophobicContact CB-SD 4.24Å
483	L	92	Very high	90.2	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-63	-44	178.6	-176	60.2	0	0	0	111.5	T436 L439 L452 H479 I480 F481 F486 C487 F570	T436-L483 HydrophobicContact CG2-CD1 3.63Å; L439-L483 HydrophobicContact CD2-CD1 4.02Å; L439-L483 HydrophobicContact CD2-CD2 3.94Å; L439-L483 HydrophobicContact CD2-CG 4.22Å; L452-L483 HydrophobicContact CD2-CD2 3.97Å; L452-L483 HydrophobicContact CD2-CG 4.49Å; H479-L483 WeakPolarHBondContact O-CB 3.34Å; H479-L483 PolarHBondContact O-N 3.33Å; I480-L483 PolarHBondContact O-N 3.36Å; F481-L483 VanDerWaalsContact C-N 3.32Å; F481-L483 PolarHBondContact O-N 3.37Å; L483-F486 PolarHBondContact O-N 3Å; L483-C487 PolarHBondContact O-N 3Å; L483-C487 PolarHBondContact O-SG 3.23Å; L483-C487 VanDerWaalsContact O-SG 3.37Å; L483-F570 HydrophobicContact CD2-CE2 3.74Å; L483-F570 HydrophobicContact CD2-CZ 3.95Å
484	Q	91.3	Very high	90.7	Very high	69 Å²	69	60.8 Å²	60.8	32%	0.322	30%	0.299	S	S	.	.	H	α-helix	trans	-61	-48.2	176	-166.9	177.9	-2.6	0	0	111.7	L452 I480 F481 C487 N488	L452-Q484 HydrophobicContact CD1-CB 3.73Å; L452-Q484 HydrophobicContact CD1-CG 3.92Å; I480-Q484 WeakPolarHBondContact O-CB 3.42Å; I480-Q484 PolarHBondContact O-N 2.89Å; F481-Q484 WeakPolarHBondContact O-CB 3.47Å; F481-Q484 PolarHBondContact O-N 2.98Å; Q484-C487 PolarHBondContact O-N 3.39Å; Q484-N488 VanDerWaalsContact O-CB 3.31Å; Q484-N488 WeakPolarHBondContact O-CB 3.28Å; Q484-N488 PolarHBondContact O-N 3.41Å; Q484-N488 PolarHBondContact O-ND2 3.29Å
485	E	91.5	Very high	91	Very high	115 Å²	115	54.7 Å²	54.7	54%	0.537	27%	0.273	S	S	.	.	H	α-helix	trans	-62.1	-43.7	179.2	-174.7	176.6	-168	0	0	111.3	F481 K482 N488 S489	F481-E485 WeakPolarHBondContact O-CB 3.14Å; F481-E485 PolarHBondContact O-N 3.39Å; K482-E485 PolarHBondContact O-N 3.29Å; E485-N488 PolarHBondContact O-N 2.96Å; E485-S489 WeakPolarHBondContact O-CB 3.29Å; E485-S489 PolarHBondContact O-N 3.05Å
486	F	93.9	Very high	91.1	Very high	6 Å²	6	52.8 Å²	52.8	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-57.5	-56.7	175.2	177.8	-97.4	0	0	0	111	T436 L437 A440 K482 L483 N488 S489 M490 R554 A557 L558 M561	T436-F486 HydrophobicContact CG2-CD1 3.63Å; T436-F486 HydrophobicContact CG2-CE1 3.65Å; L437-F486 HydrophobicContact CD2-CE1 4.42Å; L437-F486 HydrophobicContact CD2-CZ 3.93Å; A440-F486 HydrophobicContact CB-CE1 4.11Å; K482-F486 WeakPolarHBondContact O-CB 3.31Å; K482-F486 PolarHBondContact O-N 2.88Å; L483-F486 PolarHBondContact O-N 3Å; F486-N488 VanDerWaalsContact C-N 3.34Å; F486-N488 PolarHBondContact O-N 3.37Å; F486-S489 WeakPolarHBondContact O-CB 3.32Å; F486-S489 PolarHBondContact O-N 3.42Å; F486-S489 PolarHBondContact O-OG 3.06Å; F486-M490 HydrophobicContact CD1-CG 4.2Å; F486-M490 HydrophobicContact CE1-CG 3.79Å; F486-M490 HydrophobicContact CE1-SD 4.42Å; F486-M490 HydrophobicContact CE2-CG 4.26Å; F486-M490 HydrophobicContact CE2-SD 4.15Å; F486-M490 HydrophobicContact CZ-CE 4.14Å; F486-M490 HydrophobicContact CZ-CG 3.83Å; F486-M490 HydrophobicContact CZ-SD 3.87Å; F486-M490 WeakPolarHBondContact O-CG 3.29Å; F486-M490 PolarHBondContact O-N 3.17Å; F486-R554 HydrophobicContact CE2-CB 4.3Å; F486-A557 HydrophobicContact CD2-CB 4.33Å; F486-L558 HydrophobicContact CE1-CD1 4.15Å; F486-L558 HydrophobicContact CE2-CB 4.18Å; F486-L558 HydrophobicContact CE2-CD1 4.3Å; F486-L558 HydrophobicContact CZ-CB 4.45Å; F486-L558 HydrophobicContact CZ-CD1 3.88Å; F486-M561 HydrophobicContact CB-CE 3.76Å; F486-M561 HydrophobicContact CG-CE 4.24Å
487	C	92.3	Very high	91.2	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-58.8	-43.6	-179.6	-69.9	0	0	0	0	112.4	W443 L483 Q484 S489 M490 V491	W443-C487 HydrophobicContact CD2-CB 4.27Å; W443-C487 HydrophobicContact CE3-CB 3.29Å; W443-C487 HydrophobicContact CH2-CB 4.37Å; W443-C487 HydrophobicContact CZ3-CB 3.37Å; L483-C487 PolarHBondContact O-N 3Å; L483-C487 PolarHBondContact O-SG 3.23Å; L483-C487 VanDerWaalsContact O-SG 3.37Å; Q484-C487 PolarHBondContact O-N 3.39Å; C487-S489 VanDerWaalsContact C-N 3.3Å; C487-S489 PolarHBondContact O-N 2.93Å; C487-M490 WeakPolarHBondContact O-CB 3.48Å; C487-M490 PolarHBondContact O-N 3.37Å; C487-V491 WeakPolarHBondContact O-CG2 3.31Å; C487-V491 PolarHBondContact O-N 3.16Å
488	N	91	Very high	91.5	Very high	73 Å²	73	53.8 Å²	53.8	39%	0.39	27%	0.271	S	S	.	.	H	α-helix	trans	-60.9	-39.8	175.8	-75.7	-21.9	0	0	0	112	Q484 E485 F486 M490 V491 K492	Q484-N488 VanDerWaalsContact O-CB 3.31Å; Q484-N488 WeakPolarHBondContact O-CB 3.28Å; Q484-N488 PolarHBondContact O-N 3.41Å; Q484-N488 PolarHBondContact O-ND2 3.29Å; E485-N488 PolarHBondContact O-N 2.96Å; F486-N488 VanDerWaalsContact C-N 3.34Å; F486-N488 PolarHBondContact O-N 3.37Å; N488-M490 VanDerWaalsContact C-N 3.32Å; N488-M490 PolarHBondContact O-N 3.16Å; N488-V491 PolarHBondContact O-N 3.37Å; N488-K492 WeakPolarHBondContact O-CB 3.48Å; N488-K492 PolarHBondContact O-N 3.12Å
489	S	92.9	Very high	91.6	Very high	25 Å²	25	49.1 Å²	49.1	18%	0.175	25%	0.249	C	C	.	.	H	α-helix	trans	-65.5	-36.5	177.1	82.1	0	0	0	0	112.2	E485 F486 C487 K492 L493	E485-S489 WeakPolarHBondContact O-CB 3.29Å; E485-S489 PolarHBondContact O-N 3.05Å; F486-S489 WeakPolarHBondContact O-CB 3.32Å; F486-S489 PolarHBondContact O-N 3.42Å; F486-S489 PolarHBondContact O-OG 3.06Å; C487-S489 VanDerWaalsContact C-N 3.3Å; C487-S489 PolarHBondContact O-N 2.93Å; S489-K492 PolarHBondContact O-N 3.5Å; S489-L493 WeakPolarHBondContact O-CG 3.45Å; S489-L493 PolarHBondContact O-N 2.98Å
490	M	92.2	Very high	91.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-68	-43.9	176.2	-63.1	-66.4	-81.4	0	0	111.2	L437 A440 F486 C487 N488 K492 L493 I495 Y500 L503 R554	L437-M490 HydrophobicContact CD2-CE 3.68Å; A440-M490 HydrophobicContact CB-CB 4.1Å; A440-M490 HydrophobicContact CB-CG 4.08Å; F486-M490 HydrophobicContact CD1-CG 4.2Å; F486-M490 HydrophobicContact CE1-CG 3.79Å; F486-M490 HydrophobicContact CE1-SD 4.42Å; F486-M490 HydrophobicContact CE2-CG 4.26Å; F486-M490 HydrophobicContact CE2-SD 4.15Å; F486-M490 HydrophobicContact CZ-CE 4.14Å; F486-M490 HydrophobicContact CZ-CG 3.83Å; F486-M490 HydrophobicContact CZ-SD 3.87Å; F486-M490 WeakPolarHBondContact O-CG 3.29Å; F486-M490 PolarHBondContact O-N 3.17Å; C487-M490 WeakPolarHBondContact O-CB 3.48Å; C487-M490 PolarHBondContact O-N 3.37Å; N488-M490 VanDerWaalsContact C-N 3.32Å; N488-M490 PolarHBondContact O-N 3.16Å; M490-K492 VanDerWaalsContact C-N 3.34Å; M490-K492 PolarHBondContact O-N 2.99Å; M490-L493 PolarHBondContact O-N 3.23Å; M490-I495 HydrophobicContact CB-CD1 4.04Å; M490-I495 HydrophobicContact CE-CD1 3.28Å; M490-I495 HydrophobicContact CG-CD1 4.35Å; M490-I495 HydrophobicContact SD-CD1 3.41Å; M490-I495 WeakPolarHBondContact SD-CD1 3.42Å; M490-Y500 HydrophobicContact CE-CD1 4.3Å; M490-Y500 HydrophobicContact CE-CE1 3.59Å; M490-L503 HydrophobicContact CE-CD1 4.16Å; M490-R554 HydrophobicContact SD-CB 3.96Å; M490-R554 HydrophobicContact SD-CG 3.82Å
491	V	90.1	Very high	91.9	Very high	63 Å²	63	49.7 Å²	49.7	38%	0.382	25%	0.251	S	S	.	.	H	α-helix	trans	-61.4	-42.5	174.6	173.5	0	0	0	0	111	W443 C487 N488 L493 C494	W443-V491 HydrophobicContact CB-CG2 4.29Å; W443-V491 HydrophobicContact CG-CG2 4.03Å; C487-V491 WeakPolarHBondContact O-CG2 3.31Å; C487-V491 PolarHBondContact O-N 3.16Å; N488-V491 PolarHBondContact O-N 3.37Å; V491-L493 VanDerWaalsContact C-N 3.27Å; V491-L493 PolarHBondContact O-N 3.24Å; V491-C494 PolarHBondContact O-N 2.96Å; V491-C494 VanDerWaalsContact O-N 3.09Å
492	K	91.3	Very high	92.1	Very high	184 Å²	184	44.9 Å²	44.9	80%	0.8	23%	0.23	S	C	*	.	H	α-helix	trans	-63.8	-29.7	179	-174.6	177.3	179.3	180	0	113.4	N488 S489 M490 C494	N488-K492 WeakPolarHBondContact O-CB 3.48Å; N488-K492 PolarHBondContact O-N 3.12Å; S489-K492 PolarHBondContact O-N 3.5Å; M490-K492 VanDerWaalsContact C-N 3.34Å; M490-K492 PolarHBondContact O-N 2.99Å; K492-C494 PolarHBondContact O-N 3.04Å
493	L	90.5	Very high	92.3	Very high	37 Å²	37	41.4 Å²	41.4	19%	0.194	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-8.2	177.4	-75.2	170	0	0	0	113.3	S489 M490 V491 I495 R547 R550 L551 R554	S489-L493 WeakPolarHBondContact O-CG 3.45Å; S489-L493 PolarHBondContact O-N 2.98Å; M490-L493 PolarHBondContact O-N 3.23Å; V491-L493 VanDerWaalsContact C-N 3.27Å; V491-L493 PolarHBondContact O-N 3.24Å; L493-I495 HydrophobicContact CB-CD1 4.2Å; L493-I495 HydrophobicContact CB-CG1 3.8Å; L493-I495 HydrophobicContact CD1-CD1 4.48Å; L493-R547 PolarHBondContact O-NH1 3.38Å; L493-R550 HydrophobicContact CD2-CB 4.35Å; L493-L551 HydrophobicContact CD1-CD2 4.37Å; L493-R554 HydrophobicContact CD1-CG 3.8Å
494	C	89.9	Confident	92.4	Very high	96 Å²	96	41.6 Å²	41.6	65%	0.649	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.6	59.7	-176.8	-61.8	0	0	0	0	110.7	V491 K492 R547	V491-C494 PolarHBondContact O-N 2.96Å; V491-C494 VanDerWaalsContact O-N 3.09Å; K492-C494 PolarHBondContact O-N 3.04Å; C494-R547 PolarHBondContact O-NH2 2.88Å
495	I	92.5	Very high	92.6	Very high	20 Å²	20	38.3 Å²	38.3	10%	0.103	20%	0.2	C	C	.	.			trans	-75.5	129	-177.1	-57.3	178	0	0	0	109	M490 L493 E499 Y500 L503 L551	M490-I495 HydrophobicContact CB-CD1 4.04Å; M490-I495 HydrophobicContact CE-CD1 3.28Å; M490-I495 HydrophobicContact CG-CD1 4.35Å; M490-I495 HydrophobicContact SD-CD1 3.41Å; M490-I495 WeakPolarHBondContact SD-CD1 3.42Å; L493-I495 HydrophobicContact CB-CD1 4.2Å; L493-I495 HydrophobicContact CB-CG1 3.8Å; L493-I495 HydrophobicContact CD1-CD1 4.48Å; I495-E499 VanDerWaalsContact CA-OE2 3.25Å; I495-E499 WeakPolarHBondContact CA-OE2 3.27Å; I495-E499 HydrophobicContact CG2-CB 3.53Å; I495-Y500 HydrophobicContact CB-CD2 4.04Å; I495-Y500 HydrophobicContact CB-CE2 3.57Å; I495-Y500 HydrophobicContact CG2-CD1 4.3Å; I495-Y500 HydrophobicContact CG2-CD2 3.52Å; I495-Y500 HydrophobicContact CG2-CE1 4.35Å; I495-Y500 HydrophobicContact CG2-CE2 3.57Å; I495-Y500 HydrophobicContact CG2-CG 3.89Å; I495-Y500 WeakPolarHBondContact O-CE2 3.47Å; I495-L503 HydrophobicContact CD1-CD1 4.46Å; I495-L503 HydrophobicContact CG2-CD1 4.48Å; I495-L551 HydrophobicContact CD1-CD2 3.69Å; I495-L551 HydrophobicContact CG1-CD2 3.62Å
496	D	91.2	Very high	92.7	Very high	33 Å²	33	33.3 Å²	33.3	18%	0.176	18%	0.177	C	C	.	.			trans	-85	172.9	178.4	76.4	42.4	0	0	0	112.4	Y498 E499 Y500 Y536 Y541	D496-Y498 VanDerWaalsContact C-N 3.35Å; D496-Y498 PolarHBondContact O-N 2.89Å; D496-Y498 WeakPolarHBondContact OD1-CA 3.43Å; D496-Y498 WeakPolarHBondContact OD1-CB 3.41Å; D496-Y498 PolarHBondContact OD1-N 3.24Å; D496-E499 PolarHBondContact N-OE2 3.3Å; D496-E499 PolarHBondContact O-N 3.34Å; D496-E499 VanDerWaalsContact OD1-CG 3.3Å; D496-E499 WeakPolarHBondContact OD1-CG 3.47Å; D496-E499 PolarHBondContact OD1-N 3.41Å; D496-Y500 WeakPolarHBondContact O-CD2 3.48Å; D496-Y500 PolarHBondContact O-N 3.23Å; D496-Y536 VanDerWaalsContact CG-OH 3.23Å; D496-Y536 PolarHBondContact OD1-OH 3.45Å; D496-Y536 WeakPolarHBondContact OD2-CE1 3.21Å; D496-Y536 PolarHBondContact OD2-OH 3.3Å; D496-Y541 PolarHBondContact OD2-OH 3.46Å
497	G	90.1	Very high	92.8	Very high	24 Å²	24	33.3 Å²	33.3	25%	0.247	18%	0.178	C	C	.	.	H	α-helix	trans	-63.6	-35.4	-178.4	0	0	0	0	0	114.4	A501	G497-A501 WeakPolarHBondContact O-CB 3.25Å; G497-A501 PolarHBondContact O-N 2.82Å
498	Y	91.6	Very high	92.8	Very high	80 Å²	80	33.3 Å²	33.3	31%	0.314	18%	0.178	S	C	.	.	H	α-helix	trans	-70.1	-43.9	178.7	-75.8	-90.3	0	0	0	110.2	D372 V375 D496 Y500 A501 Y502 Y536	D372-Y498 PolarHBondContact OD1-OH 3.33Å; V375-Y498 HydrophobicContact CG1-CD2 3.91Å; V375-Y498 HydrophobicContact CG1-CE2 3.99Å; V375-Y498 HydrophobicContact CG1-CG 4.17Å; V375-Y498 HydrophobicContact CG2-CD1 3.48Å; V375-Y498 VanDerWaalsContact CG2-CD1 3.48Å; V375-Y498 HydrophobicContact CG2-CD2 4.3Å; V375-Y498 HydrophobicContact CG2-CE1 3.4Å; V375-Y498 HydrophobicContact CG2-CE2 4.21Å; V375-Y498 HydrophobicContact CG2-CG 3.94Å; D496-Y498 VanDerWaalsContact C-N 3.35Å; D496-Y498 PolarHBondContact O-N 2.89Å; D496-Y498 WeakPolarHBondContact OD1-CA 3.43Å; D496-Y498 WeakPolarHBondContact OD1-CB 3.41Å; D496-Y498 PolarHBondContact OD1-N 3.24Å; Y498-Y500 VanDerWaalsContact C-N 3.34Å; Y498-Y500 PolarHBondContact O-N 2.88Å; Y498-A501 WeakPolarHBondContact O-CB 3.29Å; Y498-A501 PolarHBondContact O-N 2.91Å; Y498-A501 VanDerWaalsContact O-N 3.11Å; Y498-Y502 WeakPolarHBondContact O-CD2 3.43Å; Y498-Y502 PolarHBondContact O-N 3.28Å; Y498-Y536 VanDerWaalsContact CB-CZ 3.5Å; Y498-Y536 HydrophobicContact CD1-CD2 4.48Å; Y498-Y536 HydrophobicContact CD1-CE2 4.21Å; Y498-Y536 AromaticContact CD2-CE2 3.95Å; Y498-Y536 HydrophobicContact CD2-CE2 3.95Å; Y498-Y536 HydrophobicContact CG-CD2 4.34Å; Y498-Y536 AromaticContact CG-CE2 3.71Å; Y498-Y536 HydrophobicContact CG-CE2 3.71Å; Y498-Y536 AromaticContact CG-CZ 3.9Å
499	E	94.2	Very high	92.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.5	-42.4	176.7	-61.7	175.9	139.7	0	0	111.4	I495 D496 A501 Y502 L503 F533 Y536 I537 Y541 R547 L551	I495-E499 VanDerWaalsContact CA-OE2 3.25Å; I495-E499 WeakPolarHBondContact CA-OE2 3.27Å; I495-E499 HydrophobicContact CG2-CB 3.53Å; D496-E499 PolarHBondContact N-OE2 3.3Å; D496-E499 PolarHBondContact O-N 3.34Å; D496-E499 VanDerWaalsContact OD1-CG 3.3Å; D496-E499 WeakPolarHBondContact OD1-CG 3.47Å; D496-E499 PolarHBondContact OD1-N 3.41Å; E499-A501 VanDerWaalsContact C-N 3.34Å; E499-A501 PolarHBondContact O-N 3.14Å; E499-Y502 PolarHBondContact O-N 3.44Å; E499-L503 WeakPolarHBondContact O-CB 3.17Å; E499-L503 WeakPolarHBondContact O-CG 3.41Å; E499-L503 PolarHBondContact O-N 3.34Å; E499-F533 HydrophobicContact CB-CE2 4.07Å; E499-F533 HydrophobicContact CB-CZ 4.47Å; E499-F533 HydrophobicContact CG-CE2 3.97Å; E499-Y536 HydrophobicContact CG-CD1 4.32Å; E499-Y536 HydrophobicContact CG-CE1 3.8Å; E499-I537 HydrophobicContact CG-CD1 3.98Å; E499-I537 WeakPolarHBondContact OE1-CD1 3.41Å; E499-Y541 WeakPolarHBondContact OE1-CE2 3.29Å; E499-R547 IonicContact OE1-CZ 3.69Å; E499-R547 IonicContact OE1-NE 3.94Å; E499-R547 PolarHBondContact OE1-NE 2.98Å; E499-R547 IonicContact OE1-NH2 2.69Å; E499-R547 PolarHBondContact OE1-NH2 3.11Å; E499-R547 IonicContact OE2-CZ 2.81Å; E499-R547 IonicContact OE2-NE 3.5Å; E499-R547 IonicContact OE2-NH2 3.07Å; E499-R547 PolarHBondContact OE2-NH2 3.38Å; E499-L551 HydrophobicContact CB-CD1 4.42Å; E499-L551 HydrophobicContact CG-CD1 4.23Å; E499-L551 WeakPolarHBondContact OE1-CD1 3.33Å
500	Y	94.6	Very high	92.8	Very high	14 Å²	14	28.8 Å²	28.8	6%	0.055	15%	0.151	C	C	.	.	H	α-helix	trans	-60.5	-42.7	171.7	-87.4	-68	0	0	0	112.2	A440 Q441 M490 I495 D496 Y498 L503 K504	A440-Y500 HydrophobicContact CB-CE1 4.21Å; A440-Y500 PolarHBondContact O-OH 3.3Å; Q441-Y500 HydrophobicContact CB-CD1 3.9Å; Q441-Y500 HydrophobicContact CB-CD2 4.09Å; Q441-Y500 HydrophobicContact CB-CE1 3.89Å; Q441-Y500 HydrophobicContact CB-CE2 4.1Å; Q441-Y500 HydrophobicContact CB-CG 4.01Å; Q441-Y500 HydrophobicContact CG-CD1 4.34Å; Q441-Y500 HydrophobicContact CG-CD2 3.75Å; Q441-Y500 HydrophobicContact CG-CE2 4.04Å; Q441-Y500 HydrophobicContact CG-CG 3.92Å; M490-Y500 HydrophobicContact CE-CD1 4.3Å; M490-Y500 HydrophobicContact CE-CE1 3.59Å; I495-Y500 HydrophobicContact CB-CD2 4.04Å; I495-Y500 HydrophobicContact CB-CE2 3.57Å; I495-Y500 HydrophobicContact CG2-CD1 4.3Å; I495-Y500 HydrophobicContact CG2-CD2 3.52Å; I495-Y500 HydrophobicContact CG2-CE1 4.35Å; I495-Y500 HydrophobicContact CG2-CE2 3.57Å; I495-Y500 HydrophobicContact CG2-CG 3.89Å; I495-Y500 WeakPolarHBondContact O-CE2 3.47Å; D496-Y500 WeakPolarHBondContact O-CD2 3.48Å; D496-Y500 PolarHBondContact O-N 3.23Å; Y498-Y500 VanDerWaalsContact C-N 3.34Å; Y498-Y500 PolarHBondContact O-N 2.88Å; Y500-L503 PolarHBondContact O-N 3.32Å; Y500-K504 WeakPolarHBondContact O-CB 3.39Å; Y500-K504 VanDerWaalsContact O-CG 3.25Å; Y500-K504 WeakPolarHBondContact O-CG 3.49Å; Y500-K504 PolarHBondContact O-N 3.01Å
501	A	94.1	Very high	92.6	Very high	4 Å²	4	29.7 Å²	29.7	3%	0.033	16%	0.158	C	C	.	.	H	α-helix	trans	-64.1	-43.9	-180	0	0	0	0	0	111.6	L370 W408 G497 Y498 E499 K504 A505	L370-A501 HydrophobicContact CD1-CB 3.91Å; W408-A501 HydrophobicContact CZ2-CB 4.36Å; G497-A501 WeakPolarHBondContact O-CB 3.25Å; G497-A501 PolarHBondContact O-N 2.82Å; Y498-A501 WeakPolarHBondContact O-CB 3.29Å; Y498-A501 PolarHBondContact O-N 2.91Å; Y498-A501 VanDerWaalsContact O-N 3.11Å; E499-A501 VanDerWaalsContact C-N 3.34Å; E499-A501 PolarHBondContact O-N 3.14Å; A501-K504 PolarHBondContact O-N 3.23Å; A501-A505 WeakPolarHBondContact O-CB 3.36Å; A501-A505 PolarHBondContact O-N 3.15Å
502	Y	95.1	Very high	92.3	Very high	26 Å²	26	31.5 Å²	31.5	10%	0.102	17%	0.165	C	C	.	.	H	α-helix	trans	-68.6	-40.7	176.1	-75	-62.4	0	0	0	113	L370 Y498 E499 K504 A505 I506 E532 F533 Y536	L370-Y502 HydrophobicContact CD1-CD1 3.78Å; L370-Y502 HydrophobicContact CD1-CE1 3.91Å; L370-Y502 HydrophobicContact CD1-CG 4.29Å; L370-Y502 HydrophobicContact CG-CE1 4.47Å; Y498-Y502 WeakPolarHBondContact O-CD2 3.43Å; Y498-Y502 PolarHBondContact O-N 3.28Å; E499-Y502 PolarHBondContact O-N 3.44Å; Y502-K504 VanDerWaalsContact C-N 3.32Å; Y502-K504 PolarHBondContact O-N 2.81Å; Y502-A505 PolarHBondContact O-N 3.26Å; Y502-A505 VanDerWaalsContact O-N 3.17Å; Y502-I506 VanDerWaalsContact O-CG1 3.29Å; Y502-I506 WeakPolarHBondContact O-CG1 3.5Å; Y502-I506 PolarHBondContact O-N 3.24Å; Y502-E532 HydrophobicContact CD1-CB 4.46Å; Y502-E532 HydrophobicContact CE1-CB 3.54Å; Y502-F533 HydrophobicContact CD1-CB 3.97Å; Y502-F533 HydrophobicContact CD2-CB 4.16Å; Y502-F533 AromaticContact CD2-CD2 3.74Å; Y502-F533 HydrophobicContact CD2-CD2 3.74Å; Y502-F533 HydrophobicContact CD2-CG 4.29Å; Y502-F533 HydrophobicContact CG-CB 3.69Å; Y502-F533 AromaticContact CG-CD2 3.86Å; Y502-F533 HydrophobicContact CG-CD2 3.86Å; Y502-F533 AromaticContact CG-CG 3.98Å; Y502-F533 HydrophobicContact CG-CG 3.98Å; Y502-Y536 HydrophobicContact CE2-CG 4.33Å
503	L	95.7	Very high	91.8	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.8	-42.8	174.7	-73	172.6	0	0	0	111.3	M490 I495 E499 Y500 A505 I506 V507 F533 L551 L552 L555	M490-L503 HydrophobicContact CE-CD1 4.16Å; I495-L503 HydrophobicContact CD1-CD1 4.46Å; I495-L503 HydrophobicContact CG2-CD1 4.48Å; E499-L503 WeakPolarHBondContact O-CB 3.17Å; E499-L503 WeakPolarHBondContact O-CG 3.41Å; E499-L503 PolarHBondContact O-N 3.34Å; Y500-L503 PolarHBondContact O-N 3.32Å; L503-A505 VanDerWaalsContact C-N 3.35Å; L503-I506 PolarHBondContact O-N 3.47Å; L503-V507 WeakPolarHBondContact O-CG2 3.34Å; L503-V507 PolarHBondContact O-N 3.34Å; L503-F533 HydrophobicContact CD2-CE1 4Å; L503-F533 HydrophobicContact CD2-CZ 4.32Å; L503-F533 HydrophobicContact CG-CE1 4.39Å; L503-F533 HydrophobicContact CG-CZ 4.3Å; L503-L551 HydrophobicContact CD2-CB 4.39Å; L503-L552 HydrophobicContact CD2-CD2 4.42Å; L503-L555 HydrophobicContact CD2-CD2 4.07Å; L503-L555 HydrophobicContact CD2-CG 4.42Å
504	K	94.9	Very high	91.2	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.017	17%	0.168	C	C	.	.	H	α-helix	trans	-62.4	-40.8	173.6	-72.3	174.3	-171.8	176.3	0	111.9	F377 W408 L434 L437 Y500 A501 Y502 V507 L508	F377-K504 VanDerWaalsContact CG-NZ 3.28Å; F377-K504 VanDerWaalsContact CZ-NZ 3.34Å; W408-K504 HydrophobicContact CD2-CD 4.43Å; W408-K504 HydrophobicContact CE3-CB 4.41Å; W408-K504 HydrophobicContact CE3-CD 4.37Å; W408-K504 HydrophobicContact CH2-CB 3.29Å; W408-K504 HydrophobicContact CH2-CD 4.29Å; W408-K504 HydrophobicContact CH2-CG 4.44Å; W408-K504 HydrophobicContact CZ2-CB 3.93Å; W408-K504 HydrophobicContact CZ2-CD 4.31Å; W408-K504 HydrophobicContact CZ3-CB 3.57Å; W408-K504 HydrophobicContact CZ3-CD 4.31Å; L434-K504 HydrophobicContact CD2-CB 3.85Å; L434-K504 HydrophobicContact CD2-CG 4.12Å; L437-K504 HydrophobicContact CB-CG 3.99Å; L437-K504 HydrophobicContact CD1-CB 4.47Å; L437-K504 HydrophobicContact CD1-CG 3.86Å; Y500-K504 WeakPolarHBondContact O-CB 3.39Å; Y500-K504 VanDerWaalsContact O-CG 3.25Å; Y500-K504 WeakPolarHBondContact O-CG 3.49Å; Y500-K504 PolarHBondContact O-N 3.01Å; A501-K504 PolarHBondContact O-N 3.23Å; Y502-K504 VanDerWaalsContact C-N 3.32Å; Y502-K504 PolarHBondContact O-N 2.81Å; K504-V507 PolarHBondContact O-N 3.4Å; K504-L508 VanDerWaalsContact O-CB 3.22Å; K504-L508 WeakPolarHBondContact O-CB 3.38Å; K504-L508 PolarHBondContact O-N 2.92Å
505	A	94.7	Very high	90.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-66	-42.6	178.4	0	0	0	0	0	112	L369 L370 W408 A501 Y502 L503 V507 L508 F509 A529	L369-A505 HydrophobicContact CD2-CB 4.37Å; L370-A505 HydrophobicContact CD1-CB 4.16Å; W408-A505 HydrophobicContact CH2-CB 4.36Å; A501-A505 WeakPolarHBondContact O-CB 3.36Å; A501-A505 PolarHBondContact O-N 3.15Å; Y502-A505 PolarHBondContact O-N 3.26Å; Y502-A505 VanDerWaalsContact O-N 3.17Å; L503-A505 VanDerWaalsContact C-N 3.35Å; A505-V507 VanDerWaalsContact C-N 3.31Å; A505-V507 PolarHBondContact O-N 3.14Å; A505-L508 PolarHBondContact O-N 3.44Å; A505-F509 HydrophobicContact CB-CD2 4.41Å; A505-F509 HydrophobicContact CB-CE2 4.48Å; A505-F509 WeakPolarHBondContact O-CD2 3.5Å; A505-F509 PolarHBondContact O-N 2.74Å; A505-A529 HydrophobicContact CB-CB 4.09Å
506	I	95.1	Very high	90	Very high	11 Å²	11	28.4 Å²	28.4	6%	0.056	17%	0.171	C	C	.	.	H	α-helix	trans	-63	-39.2	177.4	-69.5	166.4	0	0	0	111.3	Y502 L503 Q526 A529 F533 L552 L555	Y502-I506 VanDerWaalsContact O-CG1 3.29Å; Y502-I506 WeakPolarHBondContact O-CG1 3.5Å; Y502-I506 PolarHBondContact O-N 3.24Å; L503-I506 PolarHBondContact O-N 3.47Å; I506-Q526 HydrophobicContact CG2-CG 4.43Å; I506-Q526 PolarHBondContact O-NE2 2.89Å; I506-A529 HydrophobicContact CG1-CB 3.93Å; I506-F533 HydrophobicContact CD1-CD1 3.68Å; I506-F533 HydrophobicContact CD1-CE1 4.33Å; I506-F533 HydrophobicContact CD1-CG 4.48Å; I506-L552 HydrophobicContact CD1-CD2 4Å; I506-L555 HydrophobicContact CG2-CD1 3.83Å
507	V	94.6	Very high	89.4	Confident	6 Å²	6	33.3 Å²	33.3	4%	0.036	19%	0.193	C	C	.	.	H	α-helix	trans	-68.4	-48.1	174.7	166.9	0	0	0	0	111.1	Y430 E433 L437 L503 K504 A505 F509 S510 L555 L558	Y430-V507 HydrophobicContact CD1-CG1 4.4Å; E433-V507 HydrophobicContact CB-CG1 3.5Å; E433-V507 HydrophobicContact CG-CG1 4.36Å; L437-V507 HydrophobicContact CD1-CB 4.43Å; L437-V507 HydrophobicContact CD1-CG2 4.02Å; L503-V507 WeakPolarHBondContact O-CG2 3.34Å; L503-V507 PolarHBondContact O-N 3.34Å; K504-V507 PolarHBondContact O-N 3.4Å; A505-V507 VanDerWaalsContact C-N 3.31Å; A505-V507 PolarHBondContact O-N 3.14Å; V507-F509 VanDerWaalsContact C-N 3.34Å; V507-F509 PolarHBondContact O-N 3.02Å; V507-S510 WeakPolarHBondContact O-CB 3.4Å; V507-S510 PolarHBondContact O-N 3.47Å; V507-L555 HydrophobicContact CG2-CD1 4.49Å; V507-L555 HydrophobicContact CG2-CD2 3.59Å; V507-L558 HydrophobicContact CG2-CD2 3.98Å
508	L	93.6	Very high	89	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.7	-44.2	-178.7	175.1	62.7	0	0	0	111.6	W408 A409 I412 F415 L426 V427 L434 K504 A505 S510	W408-L508 HydrophobicContact CZ3-CD2 4.25Å; A409-L508 HydrophobicContact CB-CD1 4.33Å; A409-L508 HydrophobicContact CB-CD2 3.82Å; I412-L508 HydrophobicContact CD1-CD2 4.04Å; F415-L508 HydrophobicContact CD2-CD1 4.12Å; F415-L508 HydrophobicContact CD2-CD2 3.88Å; F415-L508 HydrophobicContact CD2-CG 4.22Å; F415-L508 HydrophobicContact CE2-CD1 3.87Å; F415-L508 HydrophobicContact CE2-CD2 4.4Å; F415-L508 HydrophobicContact CE2-CG 4.47Å; F415-L508 HydrophobicContact CG-CD2 4.5Å; L426-L508 VanDerWaalsContact CD1-O 3.26Å; L426-L508 WeakPolarHBondContact CD1-O 3.4Å; L426-L508 HydrophobicContact CD2-CD1 4.15Å; L426-L508 HydrophobicContact CD2-CG 4.4Å; L426-L508 VanDerWaalsContact CD2-O 3.3Å; L426-L508 WeakPolarHBondContact CD2-O 3.43Å; L426-L508 HydrophobicContact CG-CD1 4.15Å; L426-L508 VanDerWaalsContact CG-O 3.24Å; L426-L508 WeakPolarHBondContact CG-O 3.4Å; V427-L508 HydrophobicContact CG2-CD1 4.43Å; L434-L508 HydrophobicContact CD1-CD1 4.03Å; L434-L508 HydrophobicContact CD2-CB 4.37Å; K504-L508 VanDerWaalsContact O-CB 3.22Å; K504-L508 WeakPolarHBondContact O-CB 3.38Å; K504-L508 PolarHBondContact O-N 2.92Å; A505-L508 PolarHBondContact O-N 3.44Å; L508-S510 VanDerWaalsContact C-N 3.26Å; L508-S510 PolarHBondContact O-N 3.45Å
509	F	92.9	Very high	88.9	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	36	179.9	-60.8	-64.2	0	0	0	112.6	L369 I412 F415 L418 L426 A505 V507 I522 F525 Q526	L369-F509 HydrophobicContact CD1-CE2 4.29Å; L369-F509 HydrophobicContact CD2-CD2 4.35Å; L369-F509 HydrophobicContact CD2-CE2 4.12Å; I412-F509 HydrophobicContact CG2-CE2 4.38Å; I412-F509 HydrophobicContact CG2-CZ 4.07Å; F415-F509 HydrophobicContact CB-CE1 4.22Å; F415-F509 HydrophobicContact CB-CZ 4.03Å; F415-F509 HydrophobicContact CD2-CE1 4.3Å; L418-F509 HydrophobicContact CD1-CD1 4.42Å; L418-F509 HydrophobicContact CD1-CE1 4.1Å; L426-F509 HydrophobicContact CD2-CD1 4.27Å; A505-F509 HydrophobicContact CB-CD2 4.41Å; A505-F509 HydrophobicContact CB-CE2 4.48Å; A505-F509 WeakPolarHBondContact O-CD2 3.5Å; A505-F509 PolarHBondContact O-N 2.74Å; V507-F509 VanDerWaalsContact C-N 3.34Å; V507-F509 PolarHBondContact O-N 3.02Å; F509-I522 VanDerWaalsContact C-CG2 3.48Å; F509-I522 HydrophobicContact CB-CG2 4.27Å; F509-I522 VanDerWaalsContact O-CG2 3.31Å; F509-I522 WeakPolarHBondContact O-CG2 3.31Å; F509-F525 HydrophobicContact CB-CB 4.22Å; F509-F525 HydrophobicContact CD1-CB 3.79Å; F509-F525 HydrophobicContact CD1-CD2 4.11Å; F509-F525 HydrophobicContact CD1-CG 4.44Å; F509-F525 HydrophobicContact CD2-CB 4.11Å; F509-F525 HydrophobicContact CE1-CB 4.15Å; F509-F525 AromaticContact CE1-CD2 3.96Å; F509-F525 HydrophobicContact CE1-CD2 3.96Å; F509-F525 HydrophobicContact CE1-CG 4.44Å; F509-F525 HydrophobicContact CE2-CB 4.47Å; F509-F525 HydrophobicContact CG-CB 3.77Å; F509-F525 HydrophobicContact CZ-CB 4.48Å; F509-Q526 HydrophobicContact CB-CB 4.1Å; F509-Q526 HydrophobicContact CB-CG 4.38Å; F509-Q526 WeakPolarHBondContact O-CB 3.44Å; F509-Q526 VanDerWaalsContact O-CD 3.25Å; F509-Q526 WeakPolarHBondContact O-CG 3.26Å
510	S	90.8	Very high	88.5	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.014	23%	0.231	C	C	.	.			trans	-82.5	131.5	173.9	172.3	0	0	0	0	111	Y430 V507 L508 D512	Y430-S510 WeakPolarHBondContact CE2-O 3.42Å; Y430-S510 VanDerWaalsContact OH-CB 3.27Å; Y430-S510 WeakPolarHBondContact OH-CB 3.38Å; Y430-S510 PolarHBondContact OH-O 3.09Å; Y430-S510 PolarHBondContact OH-OG 3.38Å; V507-S510 WeakPolarHBondContact O-CB 3.4Å; V507-S510 PolarHBondContact O-N 3.47Å; L508-S510 VanDerWaalsContact C-N 3.26Å; L508-S510 PolarHBondContact O-N 3.45Å; S510-D512 PolarHBondContact O-N 3.01Å; S510-D512 WeakPolarHBondContact OG-CB 3.46Å; S510-D512 VanDerWaalsContact OG-CG 3.28Å; S510-D512 PolarHBondContact OG-N 3.29Å; S510-D512 PolarHBondContact OG-OD2 3.07Å
511	P	87.4	Confident	88.2	Confident	20 Å²	20	41.7 Å²	41.7	13%	0.13	23%	0.233	C	C	.	.			trans	-82.8	1.4	173.9	34.1	-35	0	0	0	112.6	H513 M519	P511-H513 VanDerWaalsContact C-N 3.28Å; P511-H513 PolarHBondContact O-N 3.5Å; P511-M519 HydrophobicContact CB-CE 4.23Å; P511-M519 WeakPolarHBondContact O-CE 3.32Å
512	D	83.4	Confident	88	Confident	101 Å²	101	41.6 Å²	41.6	54%	0.54	23%	0.232	S	C	.	.			trans	-74.1	-15.1	-166.5	-61	-38.9	0	0	0	114.1	Y430 S510 R559	Y430-D512 PolarHBondContact OH-N 2.94Å; S510-D512 PolarHBondContact O-N 3.01Å; S510-D512 WeakPolarHBondContact OG-CB 3.46Å; S510-D512 VanDerWaalsContact OG-CG 3.28Å; S510-D512 PolarHBondContact OG-N 3.29Å; S510-D512 PolarHBondContact OG-OD2 3.07Å; D512-R559 IonicContact OD2-CZ 2.77Å; D512-R559 IonicContact OD2-NE 2.64Å; D512-R559 IonicContact OD2-NH2 3.68Å; D512-R559 PolarHBondContact OD2-NH2 2.69Å
513	H	81.9	Confident	87.8	Confident	77 Å²	77	45 Å²	45	36%	0.356	25%	0.249	S	C	.	.	S	Bend	trans	-81.4	130.5	-175.4	-166.1	-76.5	0	0	0	112.2	A429 Y430 P511 L516	A429-H513 HydrophobicContact CB-CB 3.73Å; A429-H513 WeakPolarHBondContact CB-CD2 3.33Å; Y430-H513 HydrophobicContact CE2-CB 4.11Å; Y430-H513 WeakPolarHBondContact OH-CB 3.23Å; Y430-H513 PolarHBondContact OH-N 3.22Å; Y430-H513 VanDerWaalsContact OH-N 3.1Å; P511-H513 VanDerWaalsContact C-N 3.28Å; P511-H513 PolarHBondContact O-N 3.5Å; H513-L516 HydrophobicContact CB-CD1 3.89Å; H513-L516 HydrophobicContact CB-CG 4.21Å; H513-L516 WeakPolarHBondContact O-CG 3.4Å
514	P	77.6	Confident	87.6	Confident	107 Å²	107	49.5 Å²	49.5	70%	0.695	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	137.7	177.5	27	-34.1	0	0	0	111.3
515	G	74.7	Confident	87.4	Confident	72 Å²	72	50 Å²	50	74%	0.742	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.8	9.6	176.9	0	0	0	0	0	115.6
516	L	81.5	Confident	87.4	Confident	16 Å²	16	52 Å²	52	8%	0.084	28%	0.28	C	S	.	.			trans	-80.2	133	169.9	-64.5	175.5	0	0	0	111.1	L426 Y430 H513 M519 I522	L426-L516 HydrophobicContact CB-CD2 4.36Å; L426-L516 HydrophobicContact CD1-CD1 3.79Å; L426-L516 HydrophobicContact CD1-CD2 3.97Å; Y430-L516 HydrophobicContact CE2-CD1 4.29Å; H513-L516 HydrophobicContact CB-CD1 3.89Å; H513-L516 HydrophobicContact CB-CG 4.21Å; H513-L516 WeakPolarHBondContact O-CG 3.4Å; L516-M519 WeakPolarHBondContact O-CG 3.47Å; L516-I522 HydrophobicContact CB-CD1 4.37Å; L516-I522 HydrophobicContact CD1-CD1 4.35Å
517	E	79.6	Confident	87.4	Confident	135 Å²	135	56.9 Å²	56.9	63%	0.631	30%	0.302	S	S	*	.	S	Bend	trans	-90.4	163	167.6	-53.7	-175.7	167.6	0	0	110	N422 M519	N422-E517 WeakPolarHBondContact OD1-CB 3.39Å; E517-M519 VanDerWaalsContact C-N 3.33Å; E517-M519 PolarHBondContact O-N 3.37Å
518	N	82	Confident	87.3	Confident	82 Å²	82	59.4 Å²	59.4	44%	0.439	31%	0.313	S	S	.	.			trans	56.5	38.4	-179.3	-64.2	-20	0	0	0	115.2	N422 E520 Q521 I522	N422-N518 PolarHBondContact ND2-ND2 3.08Å; N422-N518 VanDerWaalsContact ND2-ND2 3.13Å; N518-E520 PolarHBondContact O-N 2.87Å; N518-E520 VanDerWaalsContact O-N 3.17Å; N518-Q521 HydrophobicContact CB-CB 4.45Å; N518-Q521 PolarHBondContact O-N 3.23Å; N518-I522 PolarHBondContact O-N 2.96Å
519	M	87.6	Confident	87.3	Confident	84 Å²	84	59.4 Å²	59.4	41%	0.414	31%	0.313	S	S	.	.	H	α-helix	trans	-54.2	-37.4	-178.3	-55.1	-174.8	89.8	0	0	113.2	P511 L516 E517 Q521 I522 E523	P511-M519 HydrophobicContact CB-CE 4.23Å; P511-M519 WeakPolarHBondContact O-CE 3.32Å; L516-M519 WeakPolarHBondContact O-CG 3.47Å; E517-M519 VanDerWaalsContact C-N 3.33Å; E517-M519 PolarHBondContact O-N 3.37Å; M519-Q521 VanDerWaalsContact C-N 3.31Å; M519-Q521 PolarHBondContact O-N 3.41Å; M519-I522 PolarHBondContact O-N 2.91Å; M519-E523 WeakPolarHBondContact O-CB 3.27Å; M519-E523 PolarHBondContact O-N 3.36Å
520	E	86.6	Confident	87.5	Confident	108 Å²	108	63.9 Å²	63.9	51%	0.505	33%	0.33	S	S	.	.	H	α-helix	trans	-61.4	-37	177.1	-65.2	-174.8	177.9	0	0	112.9	Y362 N518 K524	Y362-E520 PolarHBondContact OH-OE2 2.94Å; N518-E520 PolarHBondContact O-N 2.87Å; N518-E520 VanDerWaalsContact O-N 3.17Å; E520-K524 VanDerWaalsContact O-CG 3.32Å; E520-K524 WeakPolarHBondContact O-CG 3.23Å; E520-K524 PolarHBondContact O-N 3.33Å; E520-K524 VanDerWaalsContact O-N 3.15Å
521	Q	87.4	Confident	87.6	Confident	21 Å²	21	67.3 Å²	67.3	10%	0.098	35%	0.351	C	S	.	.	H	α-helix	trans	-75.6	-38.5	179.5	-172.7	178.2	-5.3	0	0	110.9	L418 N518 M519 K524 F525	L418-Q521 HydrophobicContact CD2-CB 4.31Å; L418-Q521 HydrophobicContact CD2-CG 3.9Å; N518-Q521 HydrophobicContact CB-CB 4.45Å; N518-Q521 PolarHBondContact O-N 3.23Å; M519-Q521 VanDerWaalsContact C-N 3.31Å; M519-Q521 PolarHBondContact O-N 3.41Å; Q521-K524 PolarHBondContact O-N 3.49Å; Q521-F525 HydrophobicContact CG-CD2 4.3Å; Q521-F525 HydrophobicContact CG-CE2 3.74Å; Q521-F525 HydrophobicContact CG-CZ 3.93Å; Q521-F525 WeakPolarHBondContact O-CD2 3.4Å; Q521-F525 WeakPolarHBondContact O-CG 3.41Å; Q521-F525 PolarHBondContact O-N 2.99Å; Q521-F525 VanDerWaalsContact O-N 3.07Å
522	I	90.3	Very high	88	Confident	2 Å²	2	68 Å²	68	1%	0.01	35%	0.353	C	S	.	.	H	α-helix	trans	-61.5	-47.1	174.8	-65.4	170.1	0	0	0	109.9	L418 L426 F509 L516 N518 M519 K524 F525 Q526	L418-I522 HydrophobicContact CD1-CG1 4.27Å; L418-I522 HydrophobicContact CD2-CG1 4.09Å; L426-I522 HydrophobicContact CD1-CD1 4.24Å; F509-I522 VanDerWaalsContact C-CG2 3.48Å; F509-I522 HydrophobicContact CB-CG2 4.27Å; F509-I522 VanDerWaalsContact O-CG2 3.31Å; F509-I522 WeakPolarHBondContact O-CG2 3.31Å; L516-I522 HydrophobicContact CB-CD1 4.37Å; L516-I522 HydrophobicContact CD1-CD1 4.35Å; N518-I522 PolarHBondContact O-N 2.96Å; M519-I522 PolarHBondContact O-N 2.91Å; I522-K524 PolarHBondContact O-N 3.08Å; I522-F525 PolarHBondContact O-N 2.89Å; I522-F525 VanDerWaalsContact O-N 3.12Å; I522-Q526 PolarHBondContact O-N 2.96Å
523	E	91.9	Very high	88.5	Confident	98 Å²	98	63.2 Å²	63.2	46%	0.458	33%	0.327	S	S	.	.	H	α-helix	trans	-58.3	-45.2	176.7	-173.6	174.6	-160.8	0	0	111.5	M519 F525 Q526 E527	M519-E523 WeakPolarHBondContact O-CB 3.27Å; M519-E523 PolarHBondContact O-N 3.36Å; E523-F525 VanDerWaalsContact C-N 3.32Å; E523-F525 PolarHBondContact O-N 3.02Å; E523-Q526 WeakPolarHBondContact O-CA 3.37Å; E523-Q526 VanDerWaalsContact O-CB 3.28Å; E523-Q526 WeakPolarHBondContact O-CB 3.33Å; E523-Q526 PolarHBondContact O-N 3.38Å; E523-Q526 VanDerWaalsContact O-N 3.08Å; E523-E527 WeakPolarHBondContact O-CG 3.41Å; E523-E527 PolarHBondContact O-N 3.35Å
524	K	90.9	Very high	89.1	Confident	93 Å²	93	63.2 Å²	63.2	40%	0.404	33%	0.327	S	S	.	.	H	α-helix	trans	-59.1	-40.1	174.6	-75.7	176.5	-176.7	-179.3	0	113.1	Y362 E520 Q521 I522 Q526 K528	Y362-K524 HydrophobicContact CD1-CD 4.43Å; Y362-K524 VanDerWaalsContact CD1-NZ 3.32Å; E520-K524 VanDerWaalsContact O-CG 3.32Å; E520-K524 WeakPolarHBondContact O-CG 3.23Å; E520-K524 PolarHBondContact O-N 3.33Å; E520-K524 VanDerWaalsContact O-N 3.15Å; Q521-K524 PolarHBondContact O-N 3.49Å; I522-K524 PolarHBondContact O-N 3.08Å; K524-Q526 VanDerWaalsContact C-N 3.34Å; K524-K528 WeakPolarHBondContact O-CB 3.36Å; K524-K528 PolarHBondContact O-N 3.05Å
525	F	92	Very high	89.9	Confident	16 Å²	16	61.9 Å²	61.9	7%	0.07	31%	0.314	C	S	.	.	H	α-helix	trans	-68.9	-34.8	175.6	-66.2	-30.3	0	0	0	112.1	S414 L418 F509 Q521 I522 E523 K528 A529	S414-F525 VanDerWaalsContact O-CE2 3.26Å; S414-F525 WeakPolarHBondContact O-CE2 3.32Å; L418-F525 HydrophobicContact CD2-CD2 4.08Å; L418-F525 HydrophobicContact CD2-CE2 3.7Å; L418-F525 HydrophobicContact CG-CD2 4.39Å; L418-F525 HydrophobicContact CG-CE2 3.99Å; F509-F525 HydrophobicContact CB-CB 4.22Å; F509-F525 HydrophobicContact CD1-CB 3.79Å; F509-F525 HydrophobicContact CD1-CD2 4.11Å; F509-F525 HydrophobicContact CD1-CG 4.44Å; F509-F525 HydrophobicContact CD2-CB 4.11Å; F509-F525 HydrophobicContact CE1-CB 4.15Å; F509-F525 AromaticContact CE1-CD2 3.96Å; F509-F525 HydrophobicContact CE1-CD2 3.96Å; F509-F525 HydrophobicContact CE1-CG 4.44Å; F509-F525 HydrophobicContact CE2-CB 4.47Å; F509-F525 HydrophobicContact CG-CB 3.77Å; F509-F525 HydrophobicContact CZ-CB 4.48Å; Q521-F525 HydrophobicContact CG-CD2 4.3Å; Q521-F525 HydrophobicContact CG-CE2 3.74Å; Q521-F525 HydrophobicContact CG-CZ 3.93Å; Q521-F525 WeakPolarHBondContact O-CD2 3.4Å; Q521-F525 WeakPolarHBondContact O-CG 3.41Å; Q521-F525 PolarHBondContact O-N 2.99Å; Q521-F525 VanDerWaalsContact O-N 3.07Å; I522-F525 PolarHBondContact O-N 2.89Å; I522-F525 VanDerWaalsContact O-N 3.12Å; E523-F525 VanDerWaalsContact C-N 3.32Å; E523-F525 PolarHBondContact O-N 3.02Å; F525-K528 PolarHBondContact O-N 2.9Å; F525-A529 WeakPolarHBondContact O-CB 3.42Å; F525-A529 PolarHBondContact O-N 3.46Å
526	Q	94.7	Very high	90.8	Very high	41 Å²	41	60.5 Å²	60.5	19%	0.192	29%	0.287	C	S	.	.	H	α-helix	trans	-63.5	-47.1	172.7	-150.7	-176.8	29.5	0	0	112.2	I506 F509 I522 E523 K524 K528 A529 Y530	I506-Q526 HydrophobicContact CG2-CG 4.43Å; I506-Q526 PolarHBondContact O-NE2 2.89Å; F509-Q526 HydrophobicContact CB-CB 4.1Å; F509-Q526 HydrophobicContact CB-CG 4.38Å; F509-Q526 WeakPolarHBondContact O-CB 3.44Å; F509-Q526 VanDerWaalsContact O-CD 3.25Å; F509-Q526 WeakPolarHBondContact O-CG 3.26Å; I522-Q526 PolarHBondContact O-N 2.96Å; E523-Q526 WeakPolarHBondContact O-CA 3.37Å; E523-Q526 VanDerWaalsContact O-CB 3.28Å; E523-Q526 WeakPolarHBondContact O-CB 3.33Å; E523-Q526 PolarHBondContact O-N 3.38Å; E523-Q526 VanDerWaalsContact O-N 3.08Å; K524-Q526 VanDerWaalsContact C-N 3.34Å; Q526-K528 VanDerWaalsContact C-N 3.32Å; Q526-K528 PolarHBondContact O-N 3.48Å; Q526-A529 WeakPolarHBondContact O-CB 3.42Å; Q526-A529 PolarHBondContact O-N 2.94Å; Q526-Y530 WeakPolarHBondContact O-CB 3.26Å; Q526-Y530 PolarHBondContact O-N 3.01Å
527	E	93.6	Very high	91.3	Very high	113 Å²	113	60.1 Å²	60.1	53%	0.528	29%	0.285	S	S	.	.	H	α-helix	trans	-59.9	-44.4	177.2	-73.2	-176.4	161.4	0	0	110.8	E523 A529 Y530 V531	E523-E527 WeakPolarHBondContact O-CG 3.41Å; E523-E527 PolarHBondContact O-N 3.35Å; E527-A529 PolarHBondContact O-N 3.45Å; E527-Y530 PolarHBondContact O-N 3.01Å; E527-V531 WeakPolarHBondContact O-CG2 3.32Å; E527-V531 PolarHBondContact O-N 3.07Å
528	K	92.9	Very high	91.9	Very high	60 Å²	60	57.9 Å²	57.9	26%	0.261	28%	0.281	S	S	.	.	H	α-helix	trans	-60.2	-45.8	175.4	-172.3	174.2	179.8	176.7	0	111.7	K365 G367 L369 K524 F525 Q526 Y530 V531 E532	K365-K528 PolarHBondContact O-NZ 3.42Å; K365-K528 VanDerWaalsContact O-NZ 3.17Å; G367-K528 VanDerWaalsContact O-CE 3.29Å; G367-K528 WeakPolarHBondContact O-CE 3.24Å; G367-K528 PolarHBondContact O-NZ 3.11Å; L369-K528 HydrophobicContact CB-CD 4.37Å; L369-K528 HydrophobicContact CB-CG 4.37Å; K524-K528 WeakPolarHBondContact O-CB 3.36Å; K524-K528 PolarHBondContact O-N 3.05Å; F525-K528 PolarHBondContact O-N 2.9Å; Q526-K528 VanDerWaalsContact C-N 3.32Å; Q526-K528 PolarHBondContact O-N 3.48Å; K528-Y530 VanDerWaalsContact C-N 3.3Å; K528-Y530 PolarHBondContact O-N 3.5Å; K528-V531 PolarHBondContact O-N 2.9Å; K528-E532 WeakPolarHBondContact CE-OE1 3.36Å; K528-E532 WeakPolarHBondContact O-CG 3.42Å; K528-E532 PolarHBondContact O-N 2.8Å
529	A	94.4	Very high	92.4	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-58.7	-43.1	175.7	0	0	0	0	0	111.7	L369 A505 I506 F525 Q526 E527 F533	L369-A529 HydrophobicContact CD2-CB 3.4Å; L369-A529 VanDerWaalsContact CD2-CB 3.4Å; A505-A529 HydrophobicContact CB-CB 4.09Å; I506-A529 HydrophobicContact CG1-CB 3.93Å; F525-A529 WeakPolarHBondContact O-CB 3.42Å; F525-A529 PolarHBondContact O-N 3.46Å; Q526-A529 WeakPolarHBondContact O-CB 3.42Å; Q526-A529 PolarHBondContact O-N 2.94Å; E527-A529 PolarHBondContact O-N 3.45Å; A529-F533 WeakPolarHBondContact O-CB 3.44Å; A529-F533 PolarHBondContact O-N 3.46Å
530	Y	95.3	Very high	92.6	Very high	94 Å²	94	60.6 Å²	60.6	37%	0.369	29%	0.292	S	S	.	.	H	α-helix	trans	-64.6	-45.6	179	175.1	-85.7	0	0	0	112.3	Q526 E527 K528 F533 Q534 L552	Q526-Y530 WeakPolarHBondContact O-CB 3.26Å; Q526-Y530 PolarHBondContact O-N 3.01Å; E527-Y530 PolarHBondContact O-N 3.01Å; K528-Y530 VanDerWaalsContact C-N 3.3Å; K528-Y530 PolarHBondContact O-N 3.5Å; Y530-F533 PolarHBondContact O-N 3.19Å; Y530-Q534 WeakPolarHBondContact O-CB 3.36Å; Y530-Q534 PolarHBondContact O-N 2.72Å; Y530-L552 HydrophobicContact CD2-CD1 4.19Å; Y530-L552 HydrophobicContact CE2-CD1 3.59Å
531	V	94.6	Very high	92.9	Very high	74 Å²	74	58.7 Å²	58.7	45%	0.448	28%	0.28	S	S	.	.	H	α-helix	trans	-64.8	-46.7	179.8	172.1	0	0	0	0	110.7	E527 K528 F533 Q534 D535	E527-V531 WeakPolarHBondContact O-CG2 3.32Å; E527-V531 PolarHBondContact O-N 3.07Å; K528-V531 PolarHBondContact O-N 2.9Å; V531-F533 VanDerWaalsContact C-N 3.27Å; V531-F533 PolarHBondContact O-N 3.31Å; V531-Q534 PolarHBondContact O-N 3.05Å; V531-D535 PolarHBondContact O-N 3.42Å
532	E	94.1	Very high	92.9	Very high	34 Å²	34	61.8 Å²	61.8	16%	0.159	30%	0.302	C	S	.	.	H	α-helix	trans	-61.7	-37.7	176.5	-71.6	-179.8	-161	0	0	111.7	P368 L369 Y502 K528 D535 Y536	P368-E532 WeakPolarHBondContact CA-OE1 3.48Å; L369-E532 WeakPolarHBondContact CB-OE2 3.32Å; L369-E532 VanDerWaalsContact N-CD 3.35Å; L369-E532 PolarHBondContact N-OE1 3.39Å; L369-E532 PolarHBondContact N-OE2 3.36Å; Y502-E532 HydrophobicContact CD1-CB 4.46Å; Y502-E532 HydrophobicContact CE1-CB 3.54Å; K528-E532 WeakPolarHBondContact CE-OE1 3.36Å; K528-E532 WeakPolarHBondContact O-CG 3.42Å; K528-E532 PolarHBondContact O-N 2.8Å; E532-D535 PolarHBondContact O-N 2.79Å; E532-Y536 WeakPolarHBondContact O-CB 3.49Å; E532-Y536 PolarHBondContact O-N 2.92Å
533	F	95.1	Very high	92.8	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-66.3	-44.2	175.6	-175.4	-150	0	0	0	112.6	E499 Y502 L503 I506 A529 Y530 V531 D535 Y536 I537 L548 L551 L552	E499-F533 HydrophobicContact CB-CE2 4.07Å; E499-F533 HydrophobicContact CB-CZ 4.47Å; E499-F533 HydrophobicContact CG-CE2 3.97Å; Y502-F533 HydrophobicContact CD1-CB 3.97Å; Y502-F533 HydrophobicContact CD2-CB 4.16Å; Y502-F533 AromaticContact CD2-CD2 3.74Å; Y502-F533 HydrophobicContact CD2-CD2 3.74Å; Y502-F533 HydrophobicContact CD2-CG 4.29Å; Y502-F533 HydrophobicContact CG-CB 3.69Å; Y502-F533 AromaticContact CG-CD2 3.86Å; Y502-F533 HydrophobicContact CG-CD2 3.86Å; Y502-F533 AromaticContact CG-CG 3.98Å; Y502-F533 HydrophobicContact CG-CG 3.98Å; L503-F533 HydrophobicContact CD2-CE1 4Å; L503-F533 HydrophobicContact CD2-CZ 4.32Å; L503-F533 HydrophobicContact CG-CE1 4.39Å; L503-F533 HydrophobicContact CG-CZ 4.3Å; I506-F533 HydrophobicContact CD1-CD1 3.68Å; I506-F533 HydrophobicContact CD1-CE1 4.33Å; I506-F533 HydrophobicContact CD1-CG 4.48Å; A529-F533 WeakPolarHBondContact O-CB 3.44Å; A529-F533 PolarHBondContact O-N 3.46Å; Y530-F533 PolarHBondContact O-N 3.19Å; V531-F533 VanDerWaalsContact C-N 3.27Å; V531-F533 PolarHBondContact O-N 3.31Å; F533-D535 VanDerWaalsContact C-N 3.31Å; F533-D535 PolarHBondContact O-N 3.48Å; F533-Y536 PolarHBondContact O-N 2.96Å; F533-I537 HydrophobicContact CD2-CD1 4.45Å; F533-I537 HydrophobicContact CD2-CG1 3.96Å; F533-I537 HydrophobicContact CE2-CD1 3.78Å; F533-I537 HydrophobicContact CE2-CG1 3.69Å; F533-I537 HydrophobicContact CZ-CD1 4.37Å; F533-I537 HydrophobicContact CZ-CG1 4.28Å; F533-I537 WeakPolarHBondContact O-CG1 3.19Å; F533-I537 PolarHBondContact O-N 3.19Å; F533-L548 HydrophobicContact CD1-CD1 3.41Å; F533-L548 VanDerWaalsContact CD1-CD1 3.41Å; F533-L548 HydrophobicContact CE1-CD1 3.45Å; F533-L548 VanDerWaalsContact CE1-CD1 3.45Å; F533-L548 HydrophobicContact CG-CD1 4.06Å; F533-L548 HydrophobicContact CZ-CD1 4.11Å; F533-L551 HydrophobicContact CE1-CB 4.5Å; F533-L551 HydrophobicContact CE2-CD1 4.21Å; F533-L551 HydrophobicContact CZ-CB 4.15Å; F533-L551 HydrophobicContact CZ-CD1 3.62Å; F533-L552 HydrophobicContact CD1-CD2 4.48Å; F533-L552 HydrophobicContact CE1-CD2 4.2Å
534	Q	94.9	Very high	92.7	Very high	77 Å²	77	67 Å²	67	36%	0.36	33%	0.333	S	S	.	.	H	α-helix	trans	-60.4	-43	175.9	178.6	173.4	19.5	0	0	111.3	Y530 V531 I537 T538 L548	Y530-Q534 WeakPolarHBondContact O-CB 3.36Å; Y530-Q534 PolarHBondContact O-N 2.72Å; V531-Q534 PolarHBondContact O-N 3.05Å; Q534-I537 PolarHBondContact O-N 2.77Å; Q534-T538 WeakPolarHBondContact O-CB 3.44Å; Q534-T538 PolarHBondContact O-N 3.02Å; Q534-T538 PolarHBondContact O-OG1 3.03Å; Q534-L548 HydrophobicContact CB-CD2 3.9Å; Q534-L548 HydrophobicContact CG-CD2 3.89Å
535	D	93	Very high	92.6	Very high	79 Å²	79	68 Å²	68	42%	0.422	35%	0.347	S	S	.	.	H	α-helix	trans	-63.1	-42.8	176.6	-82.2	-0.2	0	0	0	111.6	V531 E532 F533 T538 K539	V531-D535 PolarHBondContact O-N 3.42Å; E532-D535 PolarHBondContact O-N 2.79Å; F533-D535 VanDerWaalsContact C-N 3.31Å; F533-D535 PolarHBondContact O-N 3.48Å; D535-T538 PolarHBondContact O-N 3.14Å; D535-K539 WeakPolarHBondContact O-CB 3.26Å; D535-K539 WeakPolarHBondContact O-CD 3.16Å; D535-K539 VanDerWaalsContact O-CG 3.24Å; D535-K539 WeakPolarHBondContact O-CG 3.33Å; D535-K539 PolarHBondContact O-N 3.32Å
536	Y	93.5	Very high	92.6	Very high	43 Å²	43	75 Å²	75	17%	0.169	37%	0.374	C	S	.	.	H	α-helix	trans	-59.5	-50.9	174.9	175.2	-97.1	0	0	0	111.6	D496 Y498 E499 Y502 E532 F533 T538 K539 T540 Y541	D496-Y536 VanDerWaalsContact CG-OH 3.23Å; D496-Y536 PolarHBondContact OD1-OH 3.45Å; D496-Y536 WeakPolarHBondContact OD2-CE1 3.21Å; D496-Y536 PolarHBondContact OD2-OH 3.3Å; Y498-Y536 VanDerWaalsContact CB-CZ 3.5Å; Y498-Y536 HydrophobicContact CD1-CD2 4.48Å; Y498-Y536 HydrophobicContact CD1-CE2 4.21Å; Y498-Y536 AromaticContact CD2-CE2 3.95Å; Y498-Y536 HydrophobicContact CD2-CE2 3.95Å; Y498-Y536 HydrophobicContact CG-CD2 4.34Å; Y498-Y536 AromaticContact CG-CE2 3.71Å; Y498-Y536 HydrophobicContact CG-CE2 3.71Å; Y498-Y536 AromaticContact CG-CZ 3.9Å; E499-Y536 HydrophobicContact CG-CD1 4.32Å; E499-Y536 HydrophobicContact CG-CE1 3.8Å; Y502-Y536 HydrophobicContact CE2-CG 4.33Å; E532-Y536 WeakPolarHBondContact O-CB 3.49Å; E532-Y536 PolarHBondContact O-N 2.92Å; F533-Y536 PolarHBondContact O-N 2.96Å; Y536-T538 VanDerWaalsContact C-N 3.32Å; Y536-T538 PolarHBondContact O-N 2.96Å; Y536-K539 PolarHBondContact O-N 3.42Å; Y536-T540 WeakPolarHBondContact CE2-OG1 3.35Å; Y536-T540 WeakPolarHBondContact O-CB 3.47Å; Y536-T540 PolarHBondContact O-N 3.21Å; Y536-T540 PolarHBondContact O-OG1 2.84Å; Y536-T540 VanDerWaalsContact O-OG1 3.09Å; Y536-Y541 HydrophobicContact CE1-CE2 4.39Å
537	I	93.8	Very high	92.5	Very high	8 Å²	8	74.1 Å²	74.1	4%	0.041	37%	0.369	C	S	.	.	H	α-helix	trans	-61.1	-42.9	179.9	-66	-64.1	0	0	0	111.3	E499 F533 Q534 K539 T540 Y541 R547 L548 L551	E499-I537 HydrophobicContact CG-CD1 3.98Å; E499-I537 WeakPolarHBondContact OE1-CD1 3.41Å; F533-I537 HydrophobicContact CD2-CD1 4.45Å; F533-I537 HydrophobicContact CD2-CG1 3.96Å; F533-I537 HydrophobicContact CE2-CD1 3.78Å; F533-I537 HydrophobicContact CE2-CG1 3.69Å; F533-I537 HydrophobicContact CZ-CD1 4.37Å; F533-I537 HydrophobicContact CZ-CG1 4.28Å; F533-I537 WeakPolarHBondContact O-CG1 3.19Å; F533-I537 PolarHBondContact O-N 3.19Å; Q534-I537 PolarHBondContact O-N 2.77Å; I537-K539 VanDerWaalsContact C-N 3.29Å; I537-K539 PolarHBondContact O-N 2.93Å; I537-T540 PolarHBondContact O-N 3.27Å; I537-Y541 HydrophobicContact CD1-CD2 4.03Å; I537-Y541 HydrophobicContact CD1-CE2 4.29Å; I537-Y541 CarbonylContact O-C 3.31Å; I537-Y541 WeakPolarHBondContact O-CA 3.47Å; I537-Y541 PolarHBondContact O-N 3.1Å; I537-R547 HydrophobicContact CD1-CG 4.27Å; I537-R547 HydrophobicContact CG2-CB 4.04Å; I537-L548 HydrophobicContact CG1-CB 4.49Å; I537-L548 HydrophobicContact CG1-CD1 4.39Å; I537-L548 HydrophobicContact CG2-CB 4.23Å; I537-L551 HydrophobicContact CD1-CD1 3.88Å
538	T	92.3	Very high	92.6	Very high	89 Å²	89	69.5 Å²	69.5	55%	0.546	35%	0.348	S	S	.	.	H	α-helix	trans	-64.9	-34.7	-179.5	-53.7	0	0	0	0	111.9	Q534 D535 Y536	Q534-T538 WeakPolarHBondContact O-CB 3.44Å; Q534-T538 PolarHBondContact O-N 3.02Å; Q534-T538 PolarHBondContact O-OG1 3.03Å; D535-T538 PolarHBondContact O-N 3.14Å; Y536-T538 VanDerWaalsContact C-N 3.32Å; Y536-T538 PolarHBondContact O-N 2.96Å
539	K	91.9	Very high	92.6	Very high	160 Å²	160	69.6 Å²	69.6	70%	0.696	36%	0.356	S	S	*	.	H	α-helix	trans	-77.7	-43.4	178	-72.1	169.4	-174.9	167.9	0	112.7	D535 Y536 I537	D535-K539 WeakPolarHBondContact O-CB 3.26Å; D535-K539 WeakPolarHBondContact O-CD 3.16Å; D535-K539 VanDerWaalsContact O-CG 3.24Å; D535-K539 WeakPolarHBondContact O-CG 3.33Å; D535-K539 PolarHBondContact O-N 3.32Å; Y536-K539 PolarHBondContact O-N 3.42Å; I537-K539 VanDerWaalsContact C-N 3.29Å; I537-K539 PolarHBondContact O-N 2.93Å
540	T	92.1	Very high	92.6	Very high	63 Å²	63	73.7 Å²	73.7	39%	0.387	37%	0.372	S	S	.	.	H	α-helix	trans	-84	-33.1	-173.4	-54.7	0	0	0	0	112.4	Y536 I537 P542	Y536-T540 WeakPolarHBondContact CE2-OG1 3.35Å; Y536-T540 WeakPolarHBondContact O-CB 3.47Å; Y536-T540 PolarHBondContact O-N 3.21Å; Y536-T540 PolarHBondContact O-OG1 2.84Å; Y536-T540 VanDerWaalsContact O-OG1 3.09Å; I537-T540 PolarHBondContact O-N 3.27Å; T540-P542 VanDerWaalsContact C-CD 3.47Å
541	Y	91.3	Very high	92.6	Very high	67 Å²	67	69.2 Å²	69.2	26%	0.263	35%	0.354	S	S	.	.			trans	-129.1	62.1	-175.8	-54.7	-78.6	0	0	0	111.9	D496 E499 Y536 I537 D543 D544 R547	D496-Y541 PolarHBondContact OD2-OH 3.46Å; E499-Y541 WeakPolarHBondContact OE1-CE2 3.29Å; Y536-Y541 HydrophobicContact CE1-CE2 4.39Å; I537-Y541 HydrophobicContact CD1-CD2 4.03Å; I537-Y541 HydrophobicContact CD1-CE2 4.29Å; I537-Y541 CarbonylContact O-C 3.31Å; I537-Y541 WeakPolarHBondContact O-CA 3.47Å; I537-Y541 PolarHBondContact O-N 3.1Å; Y541-D543 PolarHBondContact O-N 3.19Å; Y541-D544 PolarHBondContact O-N 3.12Å; Y541-D544 VanDerWaalsContact O-N 3.14Å; Y541-R547 VanDerWaalsContact CD2-CD 3.42Å; Y541-R547 VanDerWaalsContact CE2-NE 3.27Å; Y541-R547 VanDerWaalsContact CG-CD 3.5Å
542	P	87.9	Confident	92.6	Very high	87 Å²	87	67.7 Å²	67.7	57%	0.565	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-30	-176	26	-35.1	0	0	0	113.2	T540	T540-P542 VanDerWaalsContact C-CD 3.47Å
543	D	89.4	Confident	92.7	Very high	160 Å²	160	71.2 Å²	71.2	86%	0.856	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-16.4	-179.1	-60.5	-41.7	0	0	0	113.4	Y541	Y541-D543 PolarHBondContact O-N 3.19Å
544	D	88.8	Confident	92.6	Very high	48 Å²	48	75 Å²	75	26%	0.257	38%	0.377	S	S	.	.			trans	-110.5	73.4	-175	-167.2	-8.2	0	0	0	111.9	Y541 Y546 R547 R550	Y541-D544 PolarHBondContact O-N 3.12Å; Y541-D544 VanDerWaalsContact O-N 3.14Å; D544-Y546 PolarHBondContact O-N 3.13Å; D544-R547 HydrophobicContact CB-CB 4.21Å; D544-R547 WeakPolarHBondContact O-CB 3.46Å; D544-R547 PolarHBondContact O-N 3.07Å; D544-R547 VanDerWaalsContact O-N 3.1Å; D544-R547 PolarHBondContact OD1-N 2.79Å; D544-R550 IonicContact OD1-CZ 3.32Å; D544-R550 IonicContact OD1-NH1 3.16Å; D544-R550 PolarHBondContact OD1-NH1 3.45Å; D544-R550 IonicContact OD1-NH2 2.82Å; D544-R550 PolarHBondContact OD1-NH2 3.46Å; D544-R550 IonicContact OD2-CZ 3.38Å; D544-R550 IonicContact OD2-NH1 2.85Å; D544-R550 IonicContact OD2-NH2 3Å; D544-R550 PolarHBondContact OD2-NH2 2.97Å
545	T	88.4	Confident	92.5	Very high	114 Å²	114	72.1 Å²	72.1	70%	0.699	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-20.5	-176.5	-44.5	0	0	0	0	114
546	Y	91.9	Very high	92.5	Very high	165 Å²	165	71.5 Å²	71.5	65%	0.647	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-0.5	-176.6	-60	-74.8	0	0	0	113.7	D544 L548 S549 R550	D544-Y546 PolarHBondContact O-N 3.13Å; Y546-L548 PolarHBondContact O-N 3.38Å; Y546-S549 PolarHBondContact O-N 2.7Å; Y546-R550 WeakPolarHBondContact O-CG 3.36Å; Y546-R550 PolarHBondContact O-N 3.24Å
547	R	93.9	Very high	92.4	Very high	21 Å²	21	71.2 Å²	71.2	8%	0.079	37%	0.371	C	S	.	.	H	α-helix	trans	-58	-49.8	-176.6	-171.3	168.8	176.8	82.4	4.4	112.3	L493 C494 E499 I537 Y541 D544 S549 R550 L551	L493-R547 PolarHBondContact O-NH1 3.38Å; C494-R547 PolarHBondContact O-NH2 2.88Å; E499-R547 IonicContact OE1-CZ 3.69Å; E499-R547 IonicContact OE1-NE 3.94Å; E499-R547 PolarHBondContact OE1-NE 2.98Å; E499-R547 IonicContact OE1-NH2 2.69Å; E499-R547 PolarHBondContact OE1-NH2 3.11Å; E499-R547 IonicContact OE2-CZ 2.81Å; E499-R547 IonicContact OE2-NE 3.5Å; E499-R547 IonicContact OE2-NH2 3.07Å; E499-R547 PolarHBondContact OE2-NH2 3.38Å; I537-R547 HydrophobicContact CD1-CG 4.27Å; I537-R547 HydrophobicContact CG2-CB 4.04Å; Y541-R547 VanDerWaalsContact CD2-CD 3.42Å; Y541-R547 VanDerWaalsContact CE2-NE 3.27Å; Y541-R547 VanDerWaalsContact CG-CD 3.5Å; D544-R547 HydrophobicContact CB-CB 4.21Å; D544-R547 WeakPolarHBondContact O-CB 3.46Å; D544-R547 PolarHBondContact O-N 3.07Å; D544-R547 VanDerWaalsContact O-N 3.1Å; D544-R547 PolarHBondContact OD1-N 2.79Å; R547-S549 VanDerWaalsContact C-N 3.33Å; R547-S549 PolarHBondContact O-N 3.26Å; R547-R550 PolarHBondContact O-N 3.29Å; R547-R550 VanDerWaalsContact O-N 3.14Å; R547-L551 HydrophobicContact CG-CD1 3.98Å; R547-L551 HydrophobicContact CG-CG 4.45Å; R547-L551 WeakPolarHBondContact O-CG 3.21Å; R547-L551 PolarHBondContact O-N 3.42Å
548	L	94.5	Very high	92.3	Very high	17 Å²	17	70.9 Å²	70.9	9%	0.089	37%	0.369	C	S	.	.	H	α-helix	trans	-53.2	-49.9	177.5	179.5	64	0	0	0	111.4	F533 Q534 I537 Y546 R550 L551 L552	F533-L548 HydrophobicContact CD1-CD1 3.41Å; F533-L548 VanDerWaalsContact CD1-CD1 3.41Å; F533-L548 HydrophobicContact CE1-CD1 3.45Å; F533-L548 VanDerWaalsContact CE1-CD1 3.45Å; F533-L548 HydrophobicContact CG-CD1 4.06Å; F533-L548 HydrophobicContact CZ-CD1 4.11Å; Q534-L548 HydrophobicContact CB-CD2 3.9Å; Q534-L548 HydrophobicContact CG-CD2 3.89Å; I537-L548 HydrophobicContact CG1-CB 4.49Å; I537-L548 HydrophobicContact CG1-CD1 4.39Å; I537-L548 HydrophobicContact CG2-CB 4.23Å; Y546-L548 PolarHBondContact O-N 3.38Å; L548-R550 PolarHBondContact O-N 3.34Å; L548-L551 PolarHBondContact O-N 2.96Å; L548-L552 HydrophobicContact CD1-CD1 3.96Å; L548-L552 HydrophobicContact CD1-CG 4.21Å; L548-L552 HydrophobicContact CG-CD1 3.92Å; L548-L552 HydrophobicContact CG-CG 4.49Å; L548-L552 WeakPolarHBondContact O-CG 3.4Å; L548-L552 PolarHBondContact O-N 2.96Å
549	S	94.6	Very high	92.2	Very high	61 Å²	61	72.6 Å²	72.6	43%	0.427	37%	0.365	S	S	.	.	H	α-helix	trans	-61.3	-42.6	179.6	-50.7	0	0	0	0	112.1	Y546 R547 L551 L552 L553	Y546-S549 PolarHBondContact O-N 2.7Å; R547-S549 VanDerWaalsContact C-N 3.33Å; R547-S549 PolarHBondContact O-N 3.26Å; S549-L551 VanDerWaalsContact C-N 3.32Å; S549-L551 PolarHBondContact O-N 3.42Å; S549-L552 PolarHBondContact O-N 3.32Å; S549-L553 VanDerWaalsContact O-CB 3.32Å; S549-L553 WeakPolarHBondContact O-CB 3.31Å; S549-L553 WeakPolarHBondContact O-CG 3.31Å; S549-L553 PolarHBondContact O-N 2.95Å
550	R	94.4	Very high	92.1	Very high	86 Å²	86	70.9 Å²	70.9	33%	0.325	36%	0.363	S	S	.	.	H	α-helix	trans	-64.7	-37.1	178.4	-68.1	-170.2	-51.5	-94.3	-3.1	112.3	L493 D544 Y546 R547 L548	L493-R550 HydrophobicContact CD2-CB 4.35Å; D544-R550 IonicContact OD1-CZ 3.32Å; D544-R550 IonicContact OD1-NH1 3.16Å; D544-R550 PolarHBondContact OD1-NH1 3.45Å; D544-R550 IonicContact OD1-NH2 2.82Å; D544-R550 PolarHBondContact OD1-NH2 3.46Å; D544-R550 IonicContact OD2-CZ 3.38Å; D544-R550 IonicContact OD2-NH1 2.85Å; D544-R550 IonicContact OD2-NH2 3Å; D544-R550 PolarHBondContact OD2-NH2 2.97Å; Y546-R550 WeakPolarHBondContact O-CG 3.36Å; Y546-R550 PolarHBondContact O-N 3.24Å; R547-R550 PolarHBondContact O-N 3.29Å; R547-R550 VanDerWaalsContact O-N 3.14Å; L548-R550 PolarHBondContact O-N 3.34Å
551	L	94.6	Very high	92	Very high	1 Å²	1	68.7 Å²	68.7	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-68	-48.6	176.3	-65.5	171.8	0	0	0	111.2	L493 I495 E499 L503 F533 I537 R547 L548 S549 L553 R554	L493-L551 HydrophobicContact CD1-CD2 4.37Å; I495-L551 HydrophobicContact CD1-CD2 3.69Å; I495-L551 HydrophobicContact CG1-CD2 3.62Å; E499-L551 HydrophobicContact CB-CD1 4.42Å; E499-L551 HydrophobicContact CG-CD1 4.23Å; E499-L551 WeakPolarHBondContact OE1-CD1 3.33Å; L503-L551 HydrophobicContact CD2-CB 4.39Å; F533-L551 HydrophobicContact CE1-CB 4.5Å; F533-L551 HydrophobicContact CE2-CD1 4.21Å; F533-L551 HydrophobicContact CZ-CB 4.15Å; F533-L551 HydrophobicContact CZ-CD1 3.62Å; I537-L551 HydrophobicContact CD1-CD1 3.88Å; R547-L551 HydrophobicContact CG-CD1 3.98Å; R547-L551 HydrophobicContact CG-CG 4.45Å; R547-L551 WeakPolarHBondContact O-CG 3.21Å; R547-L551 PolarHBondContact O-N 3.42Å; L548-L551 PolarHBondContact O-N 2.96Å; S549-L551 VanDerWaalsContact C-N 3.32Å; S549-L551 PolarHBondContact O-N 3.42Å; L551-L553 VanDerWaalsContact C-N 3.29Å; L551-L553 PolarHBondContact O-N 2.95Å; L551-R554 VanDerWaalsContact O-CB 3.26Å; L551-R554 WeakPolarHBondContact O-CB 3.36Å; L551-R554 WeakPolarHBondContact O-CG 3.37Å; L551-R554 PolarHBondContact O-N 3.28Å
552	L	94.9	Very high	91.9	Very high	41 Å²	41	68.9 Å²	68.9	22%	0.215	35%	0.354	C	S	.	.	H	α-helix	trans	-64.5	-33.2	178.4	-66.1	174	0	0	0	112.8	L503 I506 Y530 F533 L548 S549 R554 L555 P556	L503-L552 HydrophobicContact CD2-CD2 4.42Å; I506-L552 HydrophobicContact CD1-CD2 4Å; Y530-L552 HydrophobicContact CD2-CD1 4.19Å; Y530-L552 HydrophobicContact CE2-CD1 3.59Å; F533-L552 HydrophobicContact CD1-CD2 4.48Å; F533-L552 HydrophobicContact CE1-CD2 4.2Å; L548-L552 HydrophobicContact CD1-CD1 3.96Å; L548-L552 HydrophobicContact CD1-CG 4.21Å; L548-L552 HydrophobicContact CG-CD1 3.92Å; L548-L552 HydrophobicContact CG-CG 4.49Å; L548-L552 WeakPolarHBondContact O-CG 3.4Å; L548-L552 PolarHBondContact O-N 2.96Å; S549-L552 PolarHBondContact O-N 3.32Å; L552-R554 PolarHBondContact O-N 3.46Å; L552-R554 VanDerWaalsContact O-N 3.08Å; L552-L555 HydrophobicContact CD2-CD1 4.11Å; L552-L555 WeakPolarHBondContact O-CB 3.47Å; L552-L555 WeakPolarHBondContact O-CG 3.5Å; L552-L555 PolarHBondContact O-N 3.45Å; L552-P556 WeakPolarHBondContact O-CD 3.18Å
553	L	95	Very high	92.1	Very high	109 Å²	109	66.2 Å²	66.2	57%	0.571	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-2.6	173.5	-74.3	171.8	0	0	0	113.8	S549 L551	S549-L553 VanDerWaalsContact O-CB 3.32Å; S549-L553 WeakPolarHBondContact O-CB 3.31Å; S549-L553 WeakPolarHBondContact O-CG 3.31Å; S549-L553 PolarHBondContact O-N 2.95Å; L551-L553 VanDerWaalsContact C-N 3.29Å; L551-L553 PolarHBondContact O-N 2.95Å
554	R	93.4	Very high	92.1	Very high	79 Å²	79	62.7 Å²	62.7	30%	0.298	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-26.9	169.2	-57.7	-58.4	89.3	-166.3	-3.2	112.5	F486 M490 L493 L551 L552 A557 L558	F486-R554 HydrophobicContact CE2-CB 4.3Å; M490-R554 HydrophobicContact SD-CB 3.96Å; M490-R554 HydrophobicContact SD-CG 3.82Å; L493-R554 HydrophobicContact CD1-CG 3.8Å; L551-R554 VanDerWaalsContact O-CB 3.26Å; L551-R554 WeakPolarHBondContact O-CB 3.36Å; L551-R554 WeakPolarHBondContact O-CG 3.37Å; L551-R554 PolarHBondContact O-N 3.28Å; L552-R554 PolarHBondContact O-N 3.46Å; L552-R554 VanDerWaalsContact O-N 3.08Å; R554-A557 PolarHBondContact O-N 3.26Å; R554-L558 PolarHBondContact O-N 3.14Å
555	L	93.3	Very high	92.2	Very high	17 Å²	17	60.6 Å²	60.6	9%	0.089	31%	0.313	C	S	.	.	H	α-helix	trans	-62.1	-37.3	-177	-57	-176	0	0	0	114	L503 I506 V507 L552 A557 L558 R559	L503-L555 HydrophobicContact CD2-CD2 4.07Å; L503-L555 HydrophobicContact CD2-CG 4.42Å; I506-L555 HydrophobicContact CG2-CD1 3.83Å; V507-L555 HydrophobicContact CG2-CD1 4.49Å; V507-L555 HydrophobicContact CG2-CD2 3.59Å; L552-L555 HydrophobicContact CD2-CD1 4.11Å; L552-L555 WeakPolarHBondContact O-CB 3.47Å; L552-L555 WeakPolarHBondContact O-CG 3.5Å; L552-L555 PolarHBondContact O-N 3.45Å; L555-A557 VanDerWaalsContact C-N 3.3Å; L555-A557 PolarHBondContact O-N 3.24Å; L555-L558 HydrophobicContact CD2-CD2 4.41Å; L555-L558 VanDerWaalsContact O-CB 3.27Å; L555-L558 WeakPolarHBondContact O-CB 3.1Å; L555-L558 PolarHBondContact O-N 3.03Å; L555-L558 VanDerWaalsContact O-N 3.12Å; L555-R559 PolarHBondContact O-N 2.64Å
556	P	92.8	Very high	92.3	Very high	66 Å²	66	55.1 Å²	55.1	43%	0.429	28%	0.279	S	S	.	.	H	α-helix	trans	-61.1	-36.7	175.4	-26.1	35.9	0	0	0	113.7	L552 L558 R559	L552-P556 WeakPolarHBondContact O-CD 3.18Å; P556-L558 VanDerWaalsContact C-N 3.28Å; P556-L558 PolarHBondContact O-N 3.01Å; P556-R559 PolarHBondContact O-N 3.42Å
557	A	91.2	Very high	92.2	Very high	37 Å²	37	48.3 Å²	48.3	31%	0.306	25%	0.253	S	S	.	.	H	α-helix	trans	-67.8	-31.9	176.5	0	0	0	0	0	111.7	F486 R554 L555 L560	F486-A557 HydrophobicContact CD2-CB 4.33Å; R554-A557 PolarHBondContact O-N 3.26Å; L555-A557 VanDerWaalsContact C-N 3.3Å; L555-A557 PolarHBondContact O-N 3.24Å; A557-L560 PolarHBondContact O-N 2.82Å
558	L	91.5	Very high	91.9	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.5	-40.4	175.8	-170.1	61.7	0	0	0	111.9	E433 T436 L437 F486 V507 R554 L555 P556 L560 M561	E433-L558 HydrophobicContact CB-CD1 4.38Å; E433-L558 HydrophobicContact CB-CD2 3.75Å; E433-L558 HydrophobicContact CB-CG 3.81Å; E433-L558 HydrophobicContact CG-CD2 4.28Å; E433-L558 HydrophobicContact CG-CG 3.91Å; T436-L558 HydrophobicContact CG2-CD1 3.51Å; L437-L558 HydrophobicContact CD1-CD2 3.79Å; L437-L558 HydrophobicContact CD2-CD2 4.15Å; L437-L558 HydrophobicContact CG-CD2 3.7Å; F486-L558 HydrophobicContact CE1-CD1 4.15Å; F486-L558 HydrophobicContact CE2-CB 4.18Å; F486-L558 HydrophobicContact CE2-CD1 4.3Å; F486-L558 HydrophobicContact CZ-CB 4.45Å; F486-L558 HydrophobicContact CZ-CD1 3.88Å; V507-L558 HydrophobicContact CG2-CD2 3.98Å; R554-L558 PolarHBondContact O-N 3.14Å; L555-L558 HydrophobicContact CD2-CD2 4.41Å; L555-L558 VanDerWaalsContact O-CB 3.27Å; L555-L558 WeakPolarHBondContact O-CB 3.1Å; L555-L558 PolarHBondContact O-N 3.03Å; L555-L558 VanDerWaalsContact O-N 3.12Å; P556-L558 VanDerWaalsContact C-N 3.28Å; P556-L558 PolarHBondContact O-N 3.01Å; L558-L560 PolarHBondContact O-N 3.46Å; L558-M561 VanDerWaalsContact O-CB 3.26Å; L558-M561 WeakPolarHBondContact O-CB 3.48Å; L558-M561 VanDerWaalsContact O-CG 3.28Å; L558-M561 WeakPolarHBondContact O-CG 3.44Å; L558-M561 PolarHBondContact O-N 2.92Å
559	R	89.8	Confident	91.5	Very high	126 Å²	126	49.6 Å²	49.6	48%	0.475	26%	0.26	S	S	.	.	H	α-helix	trans	-64.1	-18.2	176	-67.6	-165.8	179.9	107.2	-13.4	114.4	D512 L555 P556 M561	D512-R559 IonicContact OD2-CZ 2.77Å; D512-R559 IonicContact OD2-NE 2.64Å; D512-R559 IonicContact OD2-NH2 3.68Å; D512-R559 PolarHBondContact OD2-NH2 2.69Å; L555-R559 PolarHBondContact O-N 2.64Å; P556-R559 PolarHBondContact O-N 3.42Å; R559-M561 VanDerWaalsContact C-N 3.26Å
560	L	89.6	Confident	91.1	Very high	124 Å²	124	46.9 Å²	46.9	65%	0.649	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-6.3	176	-64.1	174.3	0	0	0	112.9	A557 L558 N562	A557-L560 PolarHBondContact O-N 2.82Å; L558-L560 PolarHBondContact O-N 3.46Å; L560-N562 PolarHBondContact O-N 3.46Å
561	M	90.1	Very high	90.7	Very high	16 Å²	16	42.8 Å²	42.8	8%	0.079	23%	0.225	C	C	.	.			trans	-76.3	122.1	179.2	-61.6	-63	168.9	0	0	110.3	N432 K482 F486 L558 R559 A563	N432-M561 PolarHBondContact ND2-O 3.33Å; K482-M561 HydrophobicContact CB-CE 4.01Å; K482-M561 HydrophobicContact CB-SD 4.24Å; F486-M561 HydrophobicContact CB-CE 3.76Å; F486-M561 HydrophobicContact CG-CE 4.24Å; L558-M561 VanDerWaalsContact O-CB 3.26Å; L558-M561 WeakPolarHBondContact O-CB 3.48Å; L558-M561 VanDerWaalsContact O-CG 3.28Å; L558-M561 WeakPolarHBondContact O-CG 3.44Å; L558-M561 PolarHBondContact O-N 2.92Å; R559-M561 VanDerWaalsContact C-N 3.26Å; M561-A563 PolarHBondContact O-N 3.27Å
562	N	90.9	Very high	90.1	Very high	71 Å²	71	46.8 Å²	46.8	38%	0.38	24%	0.243	S	C	.	.			trans	-83.6	116.6	177.9	-172.6	-37.1	0	0	0	111.3	H479 L560 T564 I565 T566	H479-N562 PolarHBondContact CE1-N 3.19Å; H479-N562 VanDerWaalsContact CE1-N 3.31Å; L560-N562 PolarHBondContact O-N 3.46Å; N562-T564 VanDerWaalsContact C-N 3.32Å; N562-T564 PolarHBondContact O-N 3.46Å; N562-T564 WeakPolarHBondContact OD1-CB 3.43Å; N562-T564 PolarHBondContact OD1-N 3.4Å; N562-T564 PolarHBondContact OD1-OG1 3.17Å; N562-I565 HydrophobicContact CB-CB 4.3Å; N562-I565 HydrophobicContact CB-CD1 3.73Å; N562-I565 HydrophobicContact CB-CG1 3.87Å; N562-I565 PolarHBondContact O-N 3.3Å; N562-I565 VanDerWaalsContact O-N 3.16Å; N562-T566 PolarHBondContact O-N 2.56Å; N562-T566 VanDerWaalsContact O-N 3.09Å; N562-T566 PolarHBondContact O-OG1 2.84Å
563	A	91.2	Very high	89	Confident	31 Å²	31	46.9 Å²	46.9	26%	0.256	25%	0.254	S	S	.	.	H	α-helix	trans	-54.9	-43	178.3	0	0	0	0	0	113	W431 N432 M561 I565 T566 E567	W431-A563 HydrophobicContact CZ2-CB 3.89Å; N432-A563 HydrophobicContact CB-CB 3.77Å; M561-A563 PolarHBondContact O-N 3.27Å; A563-I565 VanDerWaalsContact C-N 3.26Å; A563-I565 PolarHBondContact O-N 3.09Å; A563-T566 WeakPolarHBondContact O-CB 3.41Å; A563-T566 PolarHBondContact O-N 3.48Å; A563-T566 VanDerWaalsContact O-N 3.14Å; A563-E567 WeakPolarHBondContact O-CG 3.37Å; A563-E567 PolarHBondContact O-N 3.43Å
564	T	89.5	Confident	88.1	Confident	86 Å²	86	43 Å²	43	53%	0.528	23%	0.234	S	C	.	.	H	α-helix	trans	-63.1	-34	-178.6	-47.4	0	0	0	0	112	N562 E568	N562-T564 VanDerWaalsContact C-N 3.32Å; N562-T564 PolarHBondContact O-N 3.46Å; N562-T564 WeakPolarHBondContact OD1-CB 3.43Å; N562-T564 PolarHBondContact OD1-N 3.4Å; N562-T564 PolarHBondContact OD1-OG1 3.17Å; T564-E568 PolarHBondContact O-N 2.94Å; T564-E568 VanDerWaalsContact O-N 3.13Å
565	I	89.8	Confident	87.1	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-77	-39.3	177.8	-52.9	175.8	0	0	0	110.1	L475 L476 H479 N562 A563 E567 E568 L569	L475-I565 HydrophobicContact CD1-CD1 3.7Å; L475-I565 HydrophobicContact CD2-CD1 3.94Å; L475-I565 HydrophobicContact CG-CD1 3.54Å; L476-I565 HydrophobicContact CD2-CG2 3.62Å; H479-I565 HydrophobicContact CB-CB 4.37Å; H479-I565 HydrophobicContact CB-CD1 4.18Å; H479-I565 HydrophobicContact CB-CG2 3.67Å; H479-I565 VanDerWaalsContact CD2-CG2 3.4Å; H479-I565 WeakPolarHBondContact CD2-CG2 3.48Å; N562-I565 HydrophobicContact CB-CB 4.3Å; N562-I565 HydrophobicContact CB-CD1 3.73Å; N562-I565 HydrophobicContact CB-CG1 3.87Å; N562-I565 PolarHBondContact O-N 3.3Å; N562-I565 VanDerWaalsContact O-N 3.16Å; A563-I565 VanDerWaalsContact C-N 3.26Å; A563-I565 PolarHBondContact O-N 3.09Å; I565-E567 VanDerWaalsContact C-N 3.3Å; I565-E567 PolarHBondContact O-N 2.83Å; I565-E568 PolarHBondContact O-N 2.81Å; I565-L569 HydrophobicContact CG2-CD1 4.31Å; I565-L569 HydrophobicContact CG2-CG 4.46Å; I565-L569 WeakPolarHBondContact O-CG 3.37Å; I565-L569 PolarHBondContact O-N 2.61Å
566	T	91.1	Very high	86.2	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.6	-42.3	172.9	-54.7	0	0	0	0	111.2	N432 F435 H479 N562 A563 L569 F570	N432-T566 VanDerWaalsContact OD1-CB 3.26Å; N432-T566 WeakPolarHBondContact OD1-CB 3.16Å; N432-T566 PolarHBondContact OD1-OG1 2.94Å; F435-T566 HydrophobicContact CD1-CG2 3.81Å; F435-T566 HydrophobicContact CE1-CG2 3.79Å; H479-T566 PolarHBondContact NE2-OG1 2.76Å; N562-T566 PolarHBondContact O-N 2.56Å; N562-T566 VanDerWaalsContact O-N 3.09Å; N562-T566 PolarHBondContact O-OG1 2.84Å; A563-T566 WeakPolarHBondContact O-CB 3.41Å; A563-T566 PolarHBondContact O-N 3.48Å; A563-T566 VanDerWaalsContact O-N 3.14Å; T566-L569 PolarHBondContact O-N 3.07Å; T566-F570 HydrophobicContact CG2-CD2 3.98Å; T566-F570 HydrophobicContact CG2-CE2 4.48Å; T566-F570 PolarHBondContact O-N 3.25Å
567	E	89.9	Confident	85.3	Confident	22 Å²	22	42.9 Å²	42.9	10%	0.103	24%	0.243	C	C	.	.	H	α-helix	trans	-56.6	-48.3	172	-71.3	-174.7	160.7	0	0	112	W431 A563 I565 L569 F571 K572 I580	W431-E567 HydrophobicContact CH2-CG 3.5Å; W431-E567 HydrophobicContact CZ2-CG 3.54Å; W431-E567 WeakPolarHBondContact CZ2-OE1 3.25Å; A563-E567 WeakPolarHBondContact O-CG 3.37Å; A563-E567 PolarHBondContact O-N 3.43Å; I565-E567 VanDerWaalsContact C-N 3.3Å; I565-E567 PolarHBondContact O-N 2.83Å; E567-L569 VanDerWaalsContact C-N 3.34Å; E567-L569 PolarHBondContact O-N 3.3Å; E567-F571 WeakPolarHBondContact O-CA 3.35Å; E567-F571 WeakPolarHBondContact O-CB 3.48Å; E567-F571 PolarHBondContact O-N 3.06Å; E567-K572 PolarHBondContact O-N 3.38Å; E567-I580 HydrophobicContact CG-CB 4.42Å; E567-I580 HydrophobicContact CG-CG1 3.79Å; E567-I580 WeakPolarHBondContact OE1-CB 3.34Å; E567-I580 WeakPolarHBondContact OE1-CG1 3.46Å; E567-I580 PolarHBondContact OE1-N 3.04Å
568	E	87.1	Confident	84.8	Confident	45 Å²	45	41.8 Å²	41.8	21%	0.21	23%	0.232	C	C	.	.	H	α-helix	trans	-60.9	-41.2	179.4	176.5	149.2	133.2	0	0	112.8	R472 L476 T564 I565 K572	R472-E568 IonicContact CZ-OE1 3.11Å; R472-E568 IonicContact CZ-OE2 3.38Å; R472-E568 IonicContact NE-OE1 3.63Å; R472-E568 PolarHBondContact NE-OE1 3.35Å; R472-E568 IonicContact NE-OE2 3.04Å; R472-E568 IonicContact NH2-OE1 2.7Å; R472-E568 PolarHBondContact NH2-OE1 3.22Å; R472-E568 VanDerWaalsContact NH2-OE1 3.11Å; R472-E568 IonicContact NH2-OE2 3.9Å; R472-E568 PolarHBondContact NH2-OE2 3.45Å; L476-E568 HydrophobicContact CD2-CG 4.14Å; T564-E568 PolarHBondContact O-N 2.94Å; T564-E568 VanDerWaalsContact O-N 3.13Å; I565-E568 PolarHBondContact O-N 2.81Å; E568-K572 HydrophobicContact CB-CD 4.41Å; E568-K572 HydrophobicContact CG-CD 3.77Å; E568-K572 VanDerWaalsContact O-CB 3.25Å; E568-K572 WeakPolarHBondContact O-CB 3.39Å; E568-K572 IonicContact OE1-NZ 2.89Å; E568-K572 IonicContact OE2-NZ 2.81Å; E568-K572 PolarHBondContact OE2-NZ 3.27Å
569	L	86.5	Confident	84.4	Confident	20 Å²	20	48.8 Å²	48.8	11%	0.105	26%	0.258	C	S	.	.	H	α-helix	trans	-73.5	-47.5	-176.7	-69.5	174.9	0	0	0	112.4	F455 L476 I480 I565 T566 E567	F455-L569 HydrophobicContact CD2-CD2 4.49Å; F455-L569 VanDerWaalsContact CE1-O 3.31Å; F455-L569 WeakPolarHBondContact CE1-O 3.46Å; F455-L569 HydrophobicContact CE2-CB 4.17Å; F455-L569 HydrophobicContact CG-CD2 4.46Å; F455-L569 HydrophobicContact CZ-CB 4.3Å; F455-L569 WeakPolarHBondContact CZ-O 2.93Å; L476-L569 HydrophobicContact CD2-CD2 3.83Å; L476-L569 HydrophobicContact CD2-CG 4.17Å; I480-L569 HydrophobicContact CD1-CD1 4.48Å; I480-L569 HydrophobicContact CD1-CD2 4.03Å; I480-L569 HydrophobicContact CG1-CD1 3.75Å; I480-L569 HydrophobicContact CG1-CD2 4.19Å; I565-L569 HydrophobicContact CG2-CD1 4.31Å; I565-L569 HydrophobicContact CG2-CG 4.46Å; I565-L569 WeakPolarHBondContact O-CG 3.37Å; I565-L569 PolarHBondContact O-N 2.61Å; T566-L569 PolarHBondContact O-N 3.07Å; E567-L569 VanDerWaalsContact C-N 3.34Å; E567-L569 PolarHBondContact O-N 3.3Å
570	F	86.7	Confident	84.3	Confident	4 Å²	4	42.8 Å²	42.8	2%	0.018	24%	0.235	C	C	.	.	H	α-helix	trans	-98.7	-27.7	-168.8	-72.2	-82.2	0	0	0	114.1	I394 G395 A398 F435 L439 I451 F455 L483 T566	I394-F570 HydrophobicContact CG2-CD1 4.07Å; I394-F570 HydrophobicContact CG2-CE1 4.43Å; G395-F570 VanDerWaalsContact CA-O 3.31Å; G395-F570 WeakPolarHBondContact CA-O 3.27Å; A398-F570 HydrophobicContact CB-CB 3.87Å; A398-F570 HydrophobicContact CB-CD1 3.9Å; A398-F570 HydrophobicContact CB-CG 4.27Å; F435-F570 HydrophobicContact CE1-CD2 4.05Å; F435-F570 HydrophobicContact CE1-CE2 4.29Å; F435-F570 HydrophobicContact CE1-CG 4.27Å; F435-F570 HydrophobicContact CZ-CB 4.45Å; F435-F570 HydrophobicContact CZ-CD1 4.32Å; F435-F570 HydrophobicContact CZ-CD2 4.37Å; F435-F570 HydrophobicContact CZ-CG 4.13Å; L439-F570 HydrophobicContact CD2-CZ 3.99Å; I451-F570 HydrophobicContact CG2-CE1 3.99Å; F455-F570 HydrophobicContact CE2-CD1 4.27Å; F455-F570 AromaticContact CE2-CE1 3.91Å; F455-F570 HydrophobicContact CE2-CE1 3.91Å; F455-F570 HydrophobicContact CE2-CE2 4.34Å; F455-F570 AromaticContact CE2-CZ 3.95Å; F455-F570 HydrophobicContact CE2-CZ 3.95Å; F455-F570 HydrophobicContact CZ-CD1 4.25Å; F455-F570 HydrophobicContact CZ-CE1 4.31Å; L483-F570 HydrophobicContact CD2-CE2 3.74Å; L483-F570 HydrophobicContact CD2-CZ 3.95Å; T566-F570 HydrophobicContact CG2-CD2 3.98Å; T566-F570 HydrophobicContact CG2-CE2 4.48Å; T566-F570 PolarHBondContact O-N 3.25Å
571	F	86.6	Confident	84.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118	-26.8	-166.5	-59.4	-81.6	0	0	0	113.6	L273 A398 L402 W431 F435 E567 G573 L574 I575 I580	L273-F571 HydrophobicContact CD2-CD1 3.85Å; L273-F571 HydrophobicContact CD2-CE1 4.43Å; A398-F571 HydrophobicContact CB-CE1 4.01Å; A398-F571 HydrophobicContact CB-CZ 4.03Å; L402-F571 HydrophobicContact CB-CE1 4.23Å; L402-F571 HydrophobicContact CB-CZ 4.12Å; L402-F571 HydrophobicContact CD2-CE1 3.99Å; L402-F571 HydrophobicContact CD2-CZ 4.1Å; W431-F571 HydrophobicContact CZ3-CE2 4.2Å; F435-F571 HydrophobicContact CD2-CZ 4.23Å; F435-F571 HydrophobicContact CE1-CE2 4.42Å; F435-F571 HydrophobicContact CE2-CE2 4.29Å; F435-F571 AromaticContact CE2-CZ 3.76Å; F435-F571 HydrophobicContact CE2-CZ 3.76Å; F435-F571 HydrophobicContact CZ-CE2 4.13Å; F435-F571 HydrophobicContact CZ-CZ 4.01Å; E567-F571 WeakPolarHBondContact O-CA 3.35Å; E567-F571 WeakPolarHBondContact O-CB 3.48Å; E567-F571 PolarHBondContact O-N 3.06Å; F571-G573 PolarHBondContact O-N 3.43Å; F571-G573 VanDerWaalsContact O-N 3.11Å; F571-L574 WeakPolarHBondContact O-CA 3.15Å; F571-L574 PolarHBondContact O-N 2.84Å; F571-I575 HydrophobicContact CB-CD1 3.81Å; F571-I575 HydrophobicContact CB-CG1 4.12Å; F571-I575 WeakPolarHBondContact O-CG1 3.33Å; F571-I575 PolarHBondContact O-N 2.82Å; F571-I580 HydrophobicContact CB-CD1 4.29Å; F571-I580 HydrophobicContact CD1-CD1 4.05Å; F571-I580 HydrophobicContact CD2-CD1 4.42Å; F571-I580 HydrophobicContact CD2-CG1 4.48Å; F571-I580 HydrophobicContact CE1-CD1 4.49Å; F571-I580 HydrophobicContact CG-CD1 3.99Å; F571-I580 HydrophobicContact CG-CG1 4.49Å
572	K	81.2	Confident	83.8	Confident	85 Å²	85	40.4 Å²	40.4	37%	0.37	23%	0.227	S	C	.	.	H	α-helix	trans	-53.6	-36.4	-178.1	-170.4	171.6	-170.9	172.7	0	114.4	E567 E568 L574 G576	E567-K572 PolarHBondContact O-N 3.38Å; E568-K572 HydrophobicContact CB-CD 4.41Å; E568-K572 HydrophobicContact CG-CD 3.77Å; E568-K572 VanDerWaalsContact O-CB 3.25Å; E568-K572 WeakPolarHBondContact O-CB 3.39Å; E568-K572 IonicContact OE1-NZ 2.89Å; E568-K572 IonicContact OE2-NZ 2.81Å; E568-K572 PolarHBondContact OE2-NZ 3.27Å; K572-L574 PolarHBondContact O-N 3.47Å; K572-G576 WeakPolarHBondContact O-CA 3.36Å; K572-G576 PolarHBondContact O-N 3.12Å; K572-G576 VanDerWaalsContact O-N 3.1Å
573	G	72.1	Confident	83.5	Confident	43 Å²	43	37.1 Å²	37.1	44%	0.443	21%	0.21	S	C	.	.	H	α-helix	trans	-69.8	-15	176.2	0	0	0	0	0	114.7	F571	F571-G573 PolarHBondContact O-N 3.43Å; F571-G573 VanDerWaalsContact O-N 3.11Å
574	L	76	Confident	83.3	Confident	28 Å²	28	35.7 Å²	35.7	15%	0.147	20%	0.197	C	C	.	.	H	α-helix	trans	-109.3	-42.5	-178.5	-171.5	70.1	0	0	0	112.9	L273 A274 F325 S399 F571 K572	L273-L574 HydrophobicContact CB-CD2 4.02Å; L273-L574 HydrophobicContact CD2-CD2 4.34Å; A274-L574 HydrophobicContact CB-CD1 4.16Å; A274-L574 HydrophobicContact CB-CG 4.42Å; F325-L574 WeakPolarHBondContact CE2-O 3.43Å; F325-L574 WeakPolarHBondContact CZ-O 3.27Å; S399-L574 WeakPolarHBondContact OG-CD2 3.39Å; F571-L574 WeakPolarHBondContact O-CA 3.15Å; F571-L574 PolarHBondContact O-N 2.84Å; K572-L574 PolarHBondContact O-N 3.47Å
575	I	72.4	Confident	83	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-107	-2.7	-175.7	64.5	-176.4	0	0	0	114.7	L273 V277 F325 F571 N577 I578 I580	L273-I575 HydrophobicContact CB-CG2 4.43Å; L273-I575 HydrophobicContact CD2-CD1 4.25Å; L273-I575 HydrophobicContact CD2-CG2 3.22Å; L273-I575 HydrophobicContact CG-CG2 3.59Å; V277-I575 HydrophobicContact CG2-CG2 4.45Å; F325-I575 WeakPolarHBondContact CD1-O 3.5Å; F325-I575 HydrophobicContact CE1-CB 4.06Å; F325-I575 HydrophobicContact CE1-CG2 4.1Å; F571-I575 HydrophobicContact CB-CD1 3.81Å; F571-I575 HydrophobicContact CB-CG1 4.12Å; F571-I575 WeakPolarHBondContact O-CG1 3.33Å; F571-I575 PolarHBondContact O-N 2.82Å; I575-N577 PolarHBondContact O-N 2.75Å; I575-I578 HydrophobicContact CB-CB 4.48Å; I575-I578 WeakPolarHBondContact CD1-O 3.09Å; I575-I578 PolarHBondContact O-N 3Å; I575-I580 HydrophobicContact CD1-CD1 3.54Å; I575-I580 HydrophobicContact CD1-CG1 4.32Å
576	G	75.2	Confident	82.7	Confident	33 Å²	33	35.5 Å²	35.5	34%	0.34	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	-123.3	-175	0	0	0	0	0	111.9	K572	K572-G576 WeakPolarHBondContact O-CA 3.36Å; K572-G576 PolarHBondContact O-N 3.12Å; K572-G576 VanDerWaalsContact O-N 3.1Å
577	N	73.9	Confident	82.3	Confident	124 Å²	124	35.5 Å²	35.5	66%	0.663	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.7	7.5	-172.9	-66	-31.9	0	0	0	114.3	I575	I575-N577 PolarHBondContact O-N 2.75Å
578	I	79.9	Confident	81.9	Confident	13 Å²	13	35.6 Å²	35.6	7%	0.067	19%	0.193	C	C	.	.			trans	-80.2	132.6	-179.6	-61.2	172	0	0	0	109.5	V277 F325 L328 I575 V583	V277-I578 HydrophobicContact CG1-CD1 3.34Å; F325-I578 HydrophobicContact CD1-CD1 3.79Å; F325-I578 HydrophobicContact CE1-CD1 4.47Å; L328-I578 HydrophobicContact CB-CD1 4Å; L328-I578 HydrophobicContact CD1-CD1 4.28Å; I575-I578 HydrophobicContact CB-CB 4.48Å; I575-I578 WeakPolarHBondContact CD1-O 3.09Å; I575-I578 PolarHBondContact O-N 3Å; I578-V583 HydrophobicContact CG2-CG2 3.82Å
579	R	83.8	Confident	81.4	Confident	147 Å²	147	40.3 Å²	40.3	56%	0.555	21%	0.213	S	C	*	.			trans	-79.8	142.9	175.7	-63.2	-166.6	-68.2	160.8	-4	111.2	D581 S582	R579-D581 PolarHBondContact O-N 3.22Å; R579-S582 PolarHBondContact O-N 3.46Å; R579-S582 VanDerWaalsContact O-N 3.12Å
580	I	86.4	Confident	80.7	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.1	-33.3	178.9	-63.5	-63.6	0	0	0	110.8	L273 L402 W431 E567 F571 I575 S582 V583 I584	L273-I580 HydrophobicContact CD2-CD1 4.14Å; L402-I580 HydrophobicContact CD1-CG2 4.5Å; L402-I580 HydrophobicContact CD2-CD1 3.95Å; L402-I580 HydrophobicContact CD2-CG2 3.85Å; W431-I580 HydrophobicContact CD2-CG2 3.92Å; W431-I580 HydrophobicContact CE3-CG2 4.16Å; W431-I580 HydrophobicContact CG-CG2 4.37Å; W431-I580 HydrophobicContact CH2-CB 4.3Å; W431-I580 HydrophobicContact CH2-CG1 4.11Å; W431-I580 HydrophobicContact CZ2-CB 3.95Å; W431-I580 HydrophobicContact CZ2-CG1 4.21Å; W431-I580 HydrophobicContact CZ2-CG2 4.26Å; W431-I580 HydrophobicContact CZ3-CG2 4.46Å; E567-I580 HydrophobicContact CG-CB 4.42Å; E567-I580 HydrophobicContact CG-CG1 3.79Å; E567-I580 WeakPolarHBondContact OE1-CB 3.34Å; E567-I580 WeakPolarHBondContact OE1-CG1 3.46Å; E567-I580 PolarHBondContact OE1-N 3.04Å; F571-I580 HydrophobicContact CB-CD1 4.29Å; F571-I580 HydrophobicContact CD1-CD1 4.05Å; F571-I580 HydrophobicContact CD2-CD1 4.42Å; F571-I580 HydrophobicContact CD2-CG1 4.48Å; F571-I580 HydrophobicContact CE1-CD1 4.49Å; F571-I580 HydrophobicContact CG-CD1 3.99Å; F571-I580 HydrophobicContact CG-CG1 4.49Å; I575-I580 HydrophobicContact CD1-CD1 3.54Å; I575-I580 HydrophobicContact CD1-CG1 4.32Å; I580-S582 PolarHBondContact O-N 3.39Å; I580-S582 VanDerWaalsContact O-N 3.12Å; I580-V583 WeakPolarHBondContact O-CA 3.41Å; I580-V583 PolarHBondContact O-N 2.84Å; I580-I584 HydrophobicContact CG2-CD1 4.07Å; I580-I584 HydrophobicContact CG2-CG1 3.98Å; I580-I584 WeakPolarHBondContact O-CG1 3.36Å; I580-I584 PolarHBondContact O-N 3.1Å
581	D	85.4	Confident	79.4	Confident	48 Å²	48	46.9 Å²	46.9	26%	0.257	24%	0.244	S	C	.	.	H	α-helix	trans	-52	-36.2	175.2	-61.8	-14.2	0	0	0	113.2	K428 W431 R579 V583 P585	K428-D581 WeakPolarHBondContact CE-O 3.3Å; W431-D581 PolarHBondContact NE1-OD1 3.39Å; R579-D581 PolarHBondContact O-N 3.22Å; D581-V583 VanDerWaalsContact C-N 3.33Å; D581-P585 WeakPolarHBondContact O-CD 3.25Å
582	S	84.9	Confident	77.9	Confident	42 Å²	42	50.4 Å²	50.4	29%	0.294	27%	0.267	S	S	.	.	H	α-helix	trans	-75.8	-24.3	178.2	-60	0	0	0	0	112.5	R579 I580 H586	R579-S582 PolarHBondContact O-N 3.46Å; R579-S582 VanDerWaalsContact O-N 3.12Å; I580-S582 PolarHBondContact O-N 3.39Å; I580-S582 VanDerWaalsContact O-N 3.12Å; S582-H586 PolarHBondContact O-CE1 2.88Å; S582-H586 PolarHBondContact O-ND1 3.09Å; S582-H586 VanDerWaalsContact O-ND1 3.1Å
583	V	84.5	Confident	76.2	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.018	27%	0.268	C	S	.	.	H	α-helix	trans	-91	-30.3	-176.2	-168.2	0	0	0	0	111.8	L273 V276 V277 I578 I580 D581 P585 H586 I587	L273-V583 HydrophobicContact CD1-CG1 3.68Å; V276-V583 HydrophobicContact CG1-CG1 4.4Å; V277-V583 HydrophobicContact CG2-CG2 4.36Å; I578-V583 HydrophobicContact CG2-CG2 3.82Å; I580-V583 WeakPolarHBondContact O-CA 3.41Å; I580-V583 PolarHBondContact O-N 2.84Å; D581-V583 VanDerWaalsContact C-N 3.33Å; V583-P585 VanDerWaalsContact C-CD 3.49Å; V583-H586 WeakPolarHBondContact O-CA 3.22Å; V583-H586 VanDerWaalsContact O-CB 3.32Å; V583-H586 WeakPolarHBondContact O-CB 3.37Å; V583-H586 PolarHBondContact O-N 3Å; V583-I587 HydrophobicContact CG1-CD1 4Å; V583-I587 HydrophobicContact CG1-CG1 4.02Å; V583-I587 PolarHBondContact O-N 3.49Å; V583-I587 VanDerWaalsContact O-N 3.09Å
584	I	86.2	Confident	75	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-47.7	-49	179.7	-75.4	167.9	0	0	0	113.9	V427 K428 W431 I580 H586 I587 L588	V427-I584 HydrophobicContact CB-CG2 4.14Å; V427-I584 HydrophobicContact CG1-CD1 4.28Å; V427-I584 HydrophobicContact CG1-CG1 4.44Å; V427-I584 HydrophobicContact CG1-CG2 3.61Å; K428-I584 HydrophobicContact CB-CD1 4.46Å; K428-I584 HydrophobicContact CG-CB 4.27Å; K428-I584 HydrophobicContact CG-CD1 4Å; K428-I584 HydrophobicContact CG-CG2 4.06Å; W431-I584 HydrophobicContact CB-CD1 3.85Å; W431-I584 HydrophobicContact CG-CD1 3.77Å; I580-I584 HydrophobicContact CG2-CD1 4.07Å; I580-I584 HydrophobicContact CG2-CG1 3.98Å; I580-I584 WeakPolarHBondContact O-CG1 3.36Å; I580-I584 PolarHBondContact O-N 3.1Å; I584-H586 PolarHBondContact O-N 2.85Å; I584-H586 VanDerWaalsContact O-N 3.1Å; I584-I587 PolarHBondContact O-N 3.34Å; I584-L588 HydrophobicContact CG2-CD1 3.76Å; I584-L588 HydrophobicContact CG2-CG 4.25Å; I584-L588 WeakPolarHBondContact O-CG 3.35Å; I584-L588 PolarHBondContact O-N 2.62Å
585	P	84.2	Confident	73.4	Confident	21 Å²	21	50.6 Å²	50.6	14%	0.136	27%	0.266	C	S	.	.	H	α-helix	trans	-59.6	-26.4	179.5	-23	32.7	0	0	0	113.8	I424 D581 V583 K589	I424-P585 HydrophobicContact CD1-CB 4.31Å; I424-P585 HydrophobicContact CG2-CB 4.39Å; I424-P585 HydrophobicContact CG2-CG 3.9Å; D581-P585 WeakPolarHBondContact O-CD 3.25Å; V583-P585 VanDerWaalsContact C-CD 3.49Å; P585-K589 WeakPolarHBondContact O-CD 3.18Å; P585-K589 VanDerWaalsContact O-CG 3.26Å; P585-K589 WeakPolarHBondContact O-CG 3.47Å
586	H	82.1	Confident	71.9	Confident	66 Å²	66	54.1 Å²	54.1	31%	0.306	29%	0.285	S	S	.	.	H	α-helix	trans	-82	-45.7	-179.8	-56.6	76.4	0	0	0	110	V276 L280 S582 V583 I584 L588 K589 M590	V276-H586 HydrophobicContact CG1-CB 4.19Å; L280-H586 VanDerWaalsContact CD1-NE2 3.31Å; L280-H586 WeakPolarHBondContact CD1-NE2 3.19Å; S582-H586 PolarHBondContact O-CE1 2.88Å; S582-H586 PolarHBondContact O-ND1 3.09Å; S582-H586 VanDerWaalsContact O-ND1 3.1Å; V583-H586 WeakPolarHBondContact O-CA 3.22Å; V583-H586 VanDerWaalsContact O-CB 3.32Å; V583-H586 WeakPolarHBondContact O-CB 3.37Å; V583-H586 PolarHBondContact O-N 3Å; I584-H586 PolarHBondContact O-N 2.85Å; I584-H586 VanDerWaalsContact O-N 3.1Å; H586-L588 PolarHBondContact O-N 2.97Å; H586-K589 PolarHBondContact O-N 3.27Å; H586-M590 WeakPolarHBondContact O-CG 3.36Å; H586-M590 PolarHBondContact O-N 3.12Å
587	I	83.3	Confident	70.1	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-54.9	-44	174.2	-61.2	171.3	0	0	0	110.2	L273 L402 F403 M406 V583 I584 K589 M590	L273-I587 HydrophobicContact CD1-CD1 4.18Å; L402-I587 HydrophobicContact CD2-CD1 4.21Å; F403-I587 HydrophobicContact CD1-CG2 3.85Å; F403-I587 HydrophobicContact CD2-CD1 4.4Å; F403-I587 HydrophobicContact CE1-CB 4.47Å; F403-I587 HydrophobicContact CE1-CG1 4.09Å; F403-I587 HydrophobicContact CE1-CG2 4.01Å; F403-I587 HydrophobicContact CE2-CD1 4.07Å; F403-I587 HydrophobicContact CE2-CG1 4.13Å; F403-I587 HydrophobicContact CG-CG2 4.2Å; F403-I587 HydrophobicContact CZ-CD1 4.29Å; F403-I587 HydrophobicContact CZ-CG1 3.83Å; M406-I587 HydrophobicContact CB-CG2 3.81Å; M406-I587 HydrophobicContact CG-CG2 3.95Å; V583-I587 HydrophobicContact CG1-CD1 4Å; V583-I587 HydrophobicContact CG1-CG1 4.02Å; V583-I587 PolarHBondContact O-N 3.49Å; V583-I587 VanDerWaalsContact O-N 3.09Å; I584-I587 PolarHBondContact O-N 3.34Å; I587-K589 PolarHBondContact O-N 3.26Å; I587-M590 PolarHBondContact O-N 3.32Å
588	L	81.2	Confident	68.6	Low	23 Å²	23	54.8 Å²	54.8	12%	0.12	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-17	-179	-64.7	174.3	0	0	0	114.2	M406 L410 I424 V427 I584 H586	M406-L588 HydrophobicContact CB-CD2 4.2Å; L410-L588 HydrophobicContact CD1-CB 4.21Å; L410-L588 HydrophobicContact CD1-CD2 3.53Å; L410-L588 HydrophobicContact CD1-CG 4.48Å; L410-L588 HydrophobicContact CD2-CD2 3.97Å; L410-L588 HydrophobicContact CG-CD2 3.56Å; I424-L588 HydrophobicContact CB-CD1 4.44Å; I424-L588 HydrophobicContact CG1-CD1 3.82Å; V427-L588 HydrophobicContact CB-CD1 4.27Å; V427-L588 HydrophobicContact CG1-CD1 4.42Å; V427-L588 HydrophobicContact CG2-CD1 4.4Å; V427-L588 HydrophobicContact CG2-CD2 4.5Å; I584-L588 HydrophobicContact CG2-CD1 3.76Å; I584-L588 HydrophobicContact CG2-CG 4.25Å; I584-L588 WeakPolarHBondContact O-CG 3.35Å; I584-L588 PolarHBondContact O-N 2.62Å; H586-L588 PolarHBondContact O-N 2.97Å
589	K	77.2	Confident	66.8	Low	145 Å²	145	58.8 Å²	58.8	63%	0.63	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-10.9	177.4	-74.3	175.8	-175.9	-176.4	0	113.1	P585 H586 I587	P585-K589 WeakPolarHBondContact O-CD 3.18Å; P585-K589 VanDerWaalsContact O-CG 3.26Å; P585-K589 WeakPolarHBondContact O-CG 3.47Å; H586-K589 PolarHBondContact O-N 3.27Å; I587-K589 PolarHBondContact O-N 3.26Å
590	M	72.6	Confident	64.4	Low	30 Å²	30	59 Å²	59	15%	0.148	32%	0.316	C	S	.	.	S	Bend	trans	-77.4	142.6	178.9	-68.3	177.4	81	0	0	110.5	L270 V276 F403 H407 H586 I587	L270-M590 HydrophobicContact CB-CE 3.74Å; L270-M590 HydrophobicContact CD2-CE 4.41Å; L270-M590 HydrophobicContact CG-CE 4.48Å; L270-M590 WeakPolarHBondContact O-CE 3.24Å; V276-M590 HydrophobicContact CG1-SD 4.29Å; V276-M590 HydrophobicContact CG2-CE 3.62Å; V276-M590 HydrophobicContact CG2-SD 3.4Å; V276-M590 WeakPolarHBondContact CG2-SD 3.33Å; F403-M590 HydrophobicContact CE1-SD 3.9Å; F403-M590 HydrophobicContact CZ-SD 4.45Å; H407-M590 PolarHBondContact CE1-O 2.95Å; H586-M590 WeakPolarHBondContact O-CG 3.36Å; H586-M590 PolarHBondContact O-N 3.12Å; I587-M590 PolarHBondContact O-N 3.32Å
591	E	58.1	Low	61.7	Low	132 Å²	132	61.8 Å²	61.8	62%	0.617	35%	0.345	S	S	*	.			trans	-76.7	144	174.8	-74.1	-158.6	158.6	0	0	110.5	A593 D594	E591-A593 PolarHBondContact O-N 2.76Å; E591-D594 PolarHBondContact N-OD2 3.08Å; E591-D594 PolarHBondContact O-N 3.22Å
592	P	54.7	Low	58.9	Low	74 Å²	74	68.5 Å²	68.5	48%	0.481	37%	0.374	S	S	.	.	H	α-helix	trans	-56.2	-24.5	175	-23.1	32.1	0	0	0	113.5	Y595 N596	P592-Y595 PolarHBondContact O-N 2.8Å; P592-N596 WeakPolarHBondContact O-CB 3.41Å; P592-N596 PolarHBondContact O-N 2.7Å; P592-N596 PolarHBondContact O-ND2 2.98Å
593	A	46.3	Very low	56.2	Low	48 Å²	48	72.2 Å²	72.2	40%	0.397	40%	0.4	S	S	.	.	H	α-helix	trans	-67	-32.2	177	0	0	0	0	0	112.9	E591 Y595 N596 S597	E591-A593 PolarHBondContact O-N 2.76Å; A593-Y595 PolarHBondContact O-N 2.91Å; A593-N596 PolarHBondContact O-N 2.84Å; A593-S597 VanDerWaalsContact O-CB 3.29Å; A593-S597 WeakPolarHBondContact O-CB 3.37Å; A593-S597 PolarHBondContact O-N 3.14Å; A593-S597 PolarHBondContact O-OG 3.23Å
594	D	45.7	Very low	53.6	Low	72 Å²	72	83 Å²	83	39%	0.385	46%	0.456	S	S	.	.	H	α-helix	trans	-70.5	-24.1	179.7	-61.2	-37.1	0	0	0	112.1	E591	E591-D594 PolarHBondContact N-OD2 3.08Å; E591-D594 PolarHBondContact O-N 3.22Å
595	Y	43.8	Very low	51.9	Low	39 Å²	39	87.2 Å²	87.2	15%	0.153	48%	0.478	C	S	.	.	H	α-helix	trans	-86.3	-41.3	172.8	-179.5	-99.2	0	0	0	112.4	R400 F403 P592 A593	R400-Y595 WeakPolarHBondContact CB-OH 3.48Å; R400-Y595 HydrophobicContact CG-CE2 4.14Å; R400-Y595 WeakPolarHBondContact CG-OH 3.4Å; F403-Y595 HydrophobicContact CB-CD2 4.46Å; F403-Y595 HydrophobicContact CB-CE2 4.29Å; P592-Y595 PolarHBondContact O-N 2.8Å; A593-Y595 PolarHBondContact O-N 2.91Å
596	N	40.7	Very low	50.2	Low	77 Å²	77	90.7 Å²	90.7	41%	0.412	50%	0.496	S	S	.	.	H	α-helix	trans	-80.7	-16	-177.4	-69.9	-31.1	0	0	0	114	P592 A593 Q598 I599	P592-N596 WeakPolarHBondContact O-CB 3.41Å; P592-N596 PolarHBondContact O-N 2.7Å; P592-N596 PolarHBondContact O-ND2 2.98Å; A593-N596 PolarHBondContact O-N 2.84Å; N596-Q598 PolarHBondContact O-N 2.86Å; N596-I599 HydrophobicContact CB-CD1 3.83Å; N596-I599 HydrophobicContact CB-CG1 4.41Å; N596-I599 WeakPolarHBondContact O-CB 3.43Å; N596-I599 WeakPolarHBondContact O-CG1 3.44Å; N596-I599 PolarHBondContact O-N 2.66Å; N596-I599 WeakPolarHBondContact OD1-CD1 3.39Å
597	S	37.9	Very low	48.5	Very low	92 Å²	92	92.1 Å²	92.1	64%	0.643	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-11.7	176.9	-65.5	0	0	0	0	113.6	A593	A593-S597 VanDerWaalsContact O-CB 3.29Å; A593-S597 WeakPolarHBondContact O-CB 3.37Å; A593-S597 PolarHBondContact O-N 3.14Å; A593-S597 PolarHBondContact O-OG 3.23Å
598	Q	41.6	Very low	46.4	Very low	78 Å²	78	97.5 Å²	97.5	36%	0.364	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	5.4	170	-68.5	-173.5	-10	0	0	114.3	S271 N596	S271-Q598 PolarHBondContact OG-NE2 3.27Å; S271-Q598 PolarHBondContact OG-OE1 2.89Å; N596-Q598 PolarHBondContact O-N 2.86Å
599	I	42.7	Very low	44.2	Very low	97 Å²	97	102.1 Å²	102.1	50%	0.497	56%	0.563	S	S	.	*	S	Bend	trans	-84.1	-17	179.3	-63.6	179.7	0	0	0	112.2	N596	N596-I599 HydrophobicContact CB-CD1 3.83Å; N596-I599 HydrophobicContact CB-CG1 4.41Å; N596-I599 WeakPolarHBondContact O-CB 3.43Å; N596-I599 WeakPolarHBondContact O-CG1 3.44Å; N596-I599 PolarHBondContact O-N 2.66Å; N596-I599 WeakPolarHBondContact OD1-CD1 3.39Å
600	I	32.3	Very low	42.1	Very low	152 Å²	152	99.3 Å²	99.3	78%	0.779	56%	0.558	S	S	*	*	S	Bend	trans	-129.5	4.6	-169.9	-51.3	-179.7	0	0	0	115.5
601	G	30.1	Very low	39.9	Very low	58 Å²	58	104.2 Å²	104.2	60%	0.598	59%	0.588	S	S	*	*			trans	-110.6	113.2	169	0	0	0	0	0	110.2
602	H	27.9	Very low	38.5	Very low	189 Å²	189	102.1 Å²	102.1	88%	0.875	59%	0.585	S	S	*	*			cis	-132.8	122.2	36.9	-83.1	-88.4	0	0	0	112.4
603	S	27.8	Very low	37.1	Very low	121 Å²	121	104.4 Å²	104.4	85%	0.846	59%	0.594	S	S	*	*			trans	-127.6	86.2	148	-153.4	0	0	0	0	107.2
604	I	28.8	Very low	36.3	Very low	230 Å²	230	109.5 Å²	109.5	100%	1.179	61%	0.612	S	S	*	*			trans	-131.9	0	153.1	-59.6	-178.3	0	0	0	105.8

Retrieved 604 of 604 residues in 2006.1 ms (Link to these results)

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