G4VE54_SCHMA Loading...

Sas10 domain-containing protein

AlphaFold DB , UniProt , Accession G4VE54, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 476 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.3	Very low	45.9	Very low	233 Å²	233	172 Å²	172	100%	1.148	87%	0.871	S	S	*	*				0	80.5	0	-74.3	-84.1	-164.5	0	0	106.3
2	D	41	Very low	46.5	Very low	160 Å²	160	163.3 Å²	163.3	86%	0.856	84%	0.835	S	S	*	*			trans	-129.5	109.9	-176.8	-76.7	-46.6	0	0	0	110.3	K4	D2-K4 PolarHBondContact O-N 3.49Å
3	V	41.9	Very low	47.5	Very low	140 Å²	140	156.2 Å²	156.2	85%	0.848	81%	0.809	S	S	*	*			trans	-83.4	107	178.2	177.7	0	0	0	0	108.4	V5	V3-V5 PolarHBondContact O-N 3.32Å
4	K	45.4	Very low	48.2	Very low	200 Å²	200	156.1 Å²	156.1	87%	0.87	80%	0.795	S	S	*	*			trans	-78.1	110.5	168.6	-76.8	-174	178	179.1	0	109.7	D2 G6	D2-K4 PolarHBondContact O-N 3.49Å; K4-G6 PolarHBondContact O-N 3.44Å
5	V	45.1	Very low	48.8	Very low	141 Å²	141	148.8 Å²	148.8	86%	0.855	75%	0.754	S	S	*	*			trans	-66.9	113.8	169.6	178.7	0	0	0	0	109.1	V3	V3-V5 PolarHBondContact O-N 3.32Å
6	G	45	Very low	49.2	Very low	67 Å²	67	144.5 Å²	144.5	69%	0.691	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-78.8	139.6	176.2	0	0	0	0	0	112.3	K4	K4-G6 PolarHBondContact O-N 3.44Å
7	K	50.1	Low	50	Low	201 Å²	201	139.7 Å²	139.7	87%	0.874	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-57.7	143	169	-78.5	-179.4	174.1	-176.8	0	110.4	R9	K7-R9 PolarHBondContact O-N 3.15Å
8	P	45.5	Very low	50.6	Low	121 Å²	121	138.8 Å²	138.8	79%	0.786	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-63.1	126.1	174.4	27.3	-31.6	0	0	0	109.1	E10	P8-E10 PolarHBondContact O-N 3.47Å
9	R	42.5	Very low	51.5	Low	243 Å²	243	139 Å²	139	92%	0.917	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-64.9	123.7	171.6	-72.8	178.5	174.4	172.5	-2.6	108.2	K7 K11	K7-R9 PolarHBondContact O-N 3.15Å; R9-K11 PolarHBondContact O-N 3.08Å
10	E	55	Low	52.3	Low	188 Å²	188	133.8 Å²	133.8	88%	0.879	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-56.6	131.8	172.4	-71.9	174.3	175.8	0	0	109.5	P8	P8-E10 PolarHBondContact O-N 3.47Å
11	K	51.2	Low	53.3	Low	198 Å²	198	131.5 Å²	131.5	86%	0.861	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-67.8	127.5	177.7	-69.5	-179.7	179.4	179.3	0	107.9	R9 S13	R9-K11 PolarHBondContact O-N 3.08Å; K11-S13 PolarHBondContact O-N 3.36Å
12	P	53.3	Low	54.6	Low	67 Å²	67	123.9 Å²	123.9	44%	0.435	68%	0.675	S	S	.	*	P	Polyproline II helix	trans	-59.3	126.9	174.5	23.1	-32	0	0	0	109.9	Y14 K19	P12-Y14 HydrophobicContact CB-CD2 4.38Å; P12-Y14 HydrophobicContact CB-CE2 3.91Å; P12-Y14 HydrophobicContact CG-CD2 4.41Å; P12-Y14 HydrophobicContact CG-CE2 3.68Å; P12-Y14 WeakPolarHBondContact O-CD2 3.48Å; P12-Y14 PolarHBondContact O-N 3.04Å; P12-K19 HydrophobicContact CB-CG 4.36Å
13	S	59.2	Low	56.3	Low	72 Å²	72	123.6 Å²	123.6	50%	0.503	67%	0.674	S	S	.	*	P	Polyproline II helix	trans	-72.1	120.3	169.6	171.8	0	0	0	0	108.2	K11 V20	K11-S13 PolarHBondContact O-N 3.36Å; S13-V20 PolarHBondContact O-N 2.99Å
14	Y	57.1	Low	58	Low	154 Å²	154	120 Å²	120	60%	0.604	65%	0.65	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-106.6	139.8	172.2	-74.5	-89.8	0	0	0	109.4	P12 D18 K19	P12-Y14 HydrophobicContact CB-CD2 4.38Å; P12-Y14 HydrophobicContact CB-CE2 3.91Å; P12-Y14 HydrophobicContact CG-CD2 4.41Å; P12-Y14 HydrophobicContact CG-CE2 3.68Å; P12-Y14 WeakPolarHBondContact O-CD2 3.48Å; P12-Y14 PolarHBondContact O-N 3.04Å; Y14-D18 CarbonylContact C-O 3.49Å; Y14-D18 VanDerWaalsContact CA-O 3.27Å; Y14-D18 WeakPolarHBondContact CA-O 3.48Å; Y14-K19 HydrophobicContact CD1-CB 4.44Å; Y14-K19 HydrophobicContact CE1-CB 4.22Å
15	Y	56.9	Low	59.5	Low	47 Å²	47	116.7 Å²	116.7	18%	0.184	64%	0.638	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-140.8	122.8	177.7	-164.7	-87.6	0	0	0	110	G17 D18 V20 C31 D34 C35	Y15-G17 PolarHBondContact O-N 3.4Å; Y15-D18 PolarHBondContact N-O 3.06Å; Y15-D18 PolarHBondContact O-N 3Å; Y15-D18 VanDerWaalsContact O-N 3.09Å; Y15-V20 HydrophobicContact CG-CG2 4.36Å; Y15-C31 HydrophobicContact CD1-CB 4.49Å; Y15-C31 HydrophobicContact CG-CB 4.45Å; Y15-D34 HydrophobicContact CE1-CB 3.53Å; Y15-D34 WeakPolarHBondContact CE1-OD2 3.37Å; Y15-D34 VanDerWaalsContact OH-C 3.25Å; Y15-D34 WeakPolarHBondContact OH-CB 3.37Å; Y15-D34 PolarHBondContact OH-OD2 3.49Å; Y15-C35 PolarHBondContact OH-N 2.92Å; Y15-C35 VanDerWaalsContact OH-N 3.15Å
16	G	56.3	Low	60.9	Low	80 Å²	80	116.9 Å²	116.9	83%	0.825	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.1	10.5	-177.2	0	0	0	0	0	115.5
17	G	63.1	Low	62.1	Low	63 Å²	63	115.2 Å²	115.2	65%	0.649	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	99.4	-13.9	-172.4	0	0	0	0	0	113.7	Y15	Y15-G17 PolarHBondContact O-N 3.4Å
18	D	60.4	Low	62.8	Low	123 Å²	123	109.9 Å²	109.9	66%	0.658	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-101.4	153.8	180	-67.2	-30	0	0	0	112	Y14 Y15 V20	Y14-D18 CarbonylContact C-O 3.49Å; Y14-D18 VanDerWaalsContact CA-O 3.27Å; Y14-D18 WeakPolarHBondContact CA-O 3.48Å; Y15-D18 PolarHBondContact N-O 3.06Å; Y15-D18 PolarHBondContact O-N 3Å; Y15-D18 VanDerWaalsContact O-N 3.09Å; D18-V20 PolarHBondContact O-N 3.34Å
19	K	68	Low	64.1	Low	143 Å²	143	109.6 Å²	109.6	62%	0.622	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.3	121.3	178.9	-170.3	-177.1	177.2	-165.5	0	108.9	P12 Y14 D21	P12-K19 HydrophobicContact CB-CG 4.36Å; Y14-K19 HydrophobicContact CD1-CB 4.44Å; Y14-K19 HydrophobicContact CE1-CB 4.22Å; K19-D21 PolarHBondContact O-N 3.25Å
20	V	66.9	Low	65.3	Low	35 Å²	35	103.8 Å²	103.8	21%	0.212	56%	0.558	C	S	.	*			trans	-74.9	113.5	174.5	-176.7	0	0	0	0	108.2	S13 Y15 D18	S13-V20 PolarHBondContact O-N 2.99Å; Y15-V20 HydrophobicContact CG-CG2 4.36Å; D18-V20 PolarHBondContact O-N 3.34Å
21	D	72.6	Confident	65.8	Low	85 Å²	85	96.4 Å²	96.4	46%	0.455	53%	0.527	S	S	.	.			trans	-85	127.1	168.9	-157.1	-24.8	0	0	0	109.3	K19 D23 D24	K19-D21 PolarHBondContact O-N 3.25Å; D21-D23 PolarHBondContact O-N 2.9Å; D21-D23 PolarHBondContact OD1-N 3.32Å; D21-D23 VanDerWaalsContact OD1-N 3.16Å; D21-D24 HydrophobicContact CB-CB 3.95Å
22	A	70	Confident	66.3	Low	73 Å²	73	91 Å²	91	60%	0.603	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-20.7	179.4	0	0	0	0	0	111.5	Q28	A22-Q28 PolarHBondContact O-NE2 3.34Å
23	D	76.3	Confident	66.8	Low	155 Å²	155	92 Å²	92	83%	0.829	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-5.9	-178.3	-63.7	-33.4	0	0	0	113	D21	D21-D23 PolarHBondContact O-N 2.9Å; D21-D23 PolarHBondContact OD1-N 3.32Å; D21-D23 VanDerWaalsContact OD1-N 3.16Å
24	D	78.3	Confident	66.7	Low	63 Å²	63	90.6 Å²	90.6	34%	0.337	50%	0.495	S	S	.	.			trans	-100.6	115.1	-179.9	176.8	33	0	0	0	112.3	D21 E26 S27 Q28	D21-D24 HydrophobicContact CB-CB 3.95Å; D24-E26 VanDerWaalsContact C-N 3.27Å; D24-E26 PolarHBondContact O-N 3.5Å; D24-E26 PolarHBondContact OD1-N 3.21Å; D24-S27 PolarHBondContact O-N 3.38Å; D24-S27 VanDerWaalsContact OD2-CB 3.28Å; D24-S27 WeakPolarHBondContact OD2-CB 3.4Å; D24-S27 PolarHBondContact OD2-N 3.04Å; D24-S27 PolarHBondContact OD2-OG 3.36Å; D24-Q28 WeakPolarHBondContact O-CG 3.32Å; D24-Q28 PolarHBondContact O-N 3.12Å
25	E	76.3	Confident	66.4	Low	131 Å²	131	85.5 Å²	85.5	61%	0.612	48%	0.482	S	S	*	.	H	α-helix	trans	-61.3	-32.3	178.7	-75.1	-168.1	-172.3	0	0	113.3	K29	E25-K29 WeakPolarHBondContact O-CB 3.37Å; E25-K29 VanDerWaalsContact O-CG 3.28Å; E25-K29 WeakPolarHBondContact O-CG 3.48Å; E25-K29 PolarHBondContact O-N 3.06Å; E25-K29 IonicContact OE2-NZ 3.4Å; E25-K29 PolarHBondContact OE2-NZ 2.66Å
26	E	75.5	Confident	66.1	Low	146 Å²	146	89.4 Å²	89.4	68%	0.682	50%	0.496	S	S	*	.	H	α-helix	trans	-70.3	-46.3	179.1	-77.5	-155.4	150.3	0	0	111.3	D24 Q28 K29 L30	D24-E26 VanDerWaalsContact C-N 3.27Å; D24-E26 PolarHBondContact O-N 3.5Å; D24-E26 PolarHBondContact OD1-N 3.21Å; E26-Q28 VanDerWaalsContact C-N 3.27Å; E26-Q28 PolarHBondContact O-N 3.49Å; E26-K29 PolarHBondContact O-N 3Å; E26-K29 VanDerWaalsContact O-N 3.13Å; E26-L30 PolarHBondContact O-N 3.15Å
27	S	69.1	Low	66	Low	31 Å²	31	92.3 Å²	92.3	22%	0.217	49%	0.488	C	S	.	.	H	α-helix	trans	-55	-42	173.8	-68.4	0	0	0	0	112.4	D24 C31	D24-S27 PolarHBondContact O-N 3.38Å; D24-S27 VanDerWaalsContact OD2-CB 3.28Å; D24-S27 WeakPolarHBondContact OD2-CB 3.4Å; D24-S27 PolarHBondContact OD2-N 3.04Å; D24-S27 PolarHBondContact OD2-OG 3.36Å; S27-C31 WeakPolarHBondContact O-CB 3.2Å; S27-C31 PolarHBondContact O-N 3Å; S27-C31 VanDerWaalsContact O-N 3.13Å
28	Q	66.4	Low	65.4	Low	90 Å²	90	94.7 Å²	94.7	42%	0.421	48%	0.481	S	S	.	.	H	α-helix	trans	-65.2	-46.1	175.2	-67.3	-178.2	19.1	0	0	112.3	A22 D24 E26 L30 C31 I32	A22-Q28 PolarHBondContact O-NE2 3.34Å; D24-Q28 WeakPolarHBondContact O-CG 3.32Å; D24-Q28 PolarHBondContact O-N 3.12Å; E26-Q28 VanDerWaalsContact C-N 3.27Å; E26-Q28 PolarHBondContact O-N 3.49Å; Q28-L30 VanDerWaalsContact C-N 3.32Å; Q28-L30 PolarHBondContact O-N 3.33Å; Q28-C31 PolarHBondContact O-N 3.01Å; Q28-I32 WeakPolarHBondContact O-CB 3.48Å; Q28-I32 WeakPolarHBondContact O-CD1 3.25Å; Q28-I32 VanDerWaalsContact O-CG1 3.23Å; Q28-I32 WeakPolarHBondContact O-CG1 3.4Å; Q28-I32 PolarHBondContact O-N 3.41Å
29	K	71.9	Confident	64.5	Low	114 Å²	114	91.4 Å²	91.4	50%	0.496	46%	0.461	S	S	.	.	H	α-helix	trans	-61.2	-40.1	178.3	-76.2	167.8	-170.6	156.1	0	111.8	E25 E26 I32 N33	E25-K29 WeakPolarHBondContact O-CB 3.37Å; E25-K29 VanDerWaalsContact O-CG 3.28Å; E25-K29 WeakPolarHBondContact O-CG 3.48Å; E25-K29 PolarHBondContact O-N 3.06Å; E25-K29 IonicContact OE2-NZ 3.4Å; E25-K29 PolarHBondContact OE2-NZ 2.66Å; E26-K29 PolarHBondContact O-N 3Å; E26-K29 VanDerWaalsContact O-N 3.13Å; K29-I32 PolarHBondContact O-N 3.29Å; K29-N33 WeakPolarHBondContact O-CB 3.49Å; K29-N33 PolarHBondContact O-N 3.44Å
30	L	68.2	Low	63.4	Low	121 Å²	121	87.3 Å²	87.3	63%	0.634	45%	0.454	S	S	*	.	H	α-helix	trans	-64.5	-47.5	178.2	-135.3	95.9	0	0	0	111.6	E26 Q28 I32 N33 D34	E26-L30 PolarHBondContact O-N 3.15Å; Q28-L30 VanDerWaalsContact C-N 3.32Å; Q28-L30 PolarHBondContact O-N 3.33Å; L30-I32 VanDerWaalsContact C-N 3.31Å; L30-I32 PolarHBondContact O-N 3.1Å; L30-N33 PolarHBondContact O-N 3.07Å; L30-D34 PolarHBondContact O-N 3.1Å
31	C	63.9	Low	62.6	Low	34 Å²	34	89.5 Å²	89.5	23%	0.23	48%	0.476	C	S	.	.	H	α-helix	trans	-57.6	-44.2	175.3	-179	0	0	0	0	111.3	Y15 S27 Q28 C35	Y15-C31 HydrophobicContact CD1-CB 4.49Å; Y15-C31 HydrophobicContact CG-CB 4.45Å; S27-C31 WeakPolarHBondContact O-CB 3.2Å; S27-C31 PolarHBondContact O-N 3Å; S27-C31 VanDerWaalsContact O-N 3.13Å; Q28-C31 PolarHBondContact O-N 3.01Å; C31-C35 WeakPolarHBondContact O-CB 3.38Å; C31-C35 PolarHBondContact O-N 3.22Å; C31-C35 PolarHBondContact O-SG 2.92Å
32	I	61.9	Low	61.1	Low	85 Å²	85	91.9 Å²	91.9	44%	0.436	49%	0.488	S	S	.	.	H	α-helix	trans	-64.3	-42.2	176.8	-68.7	165	0	0	0	111.5	Q28 K29 L30 C35 R36	Q28-I32 WeakPolarHBondContact O-CB 3.48Å; Q28-I32 WeakPolarHBondContact O-CD1 3.25Å; Q28-I32 VanDerWaalsContact O-CG1 3.23Å; Q28-I32 WeakPolarHBondContact O-CG1 3.4Å; Q28-I32 PolarHBondContact O-N 3.41Å; K29-I32 PolarHBondContact O-N 3.29Å; L30-I32 VanDerWaalsContact C-N 3.31Å; L30-I32 PolarHBondContact O-N 3.1Å; I32-C35 WeakPolarHBondContact O-CB 3.27Å; I32-C35 PolarHBondContact O-N 3.45Å; I32-R36 VanDerWaalsContact O-CG 3.29Å; I32-R36 WeakPolarHBondContact O-CG 3.38Å; I32-R36 PolarHBondContact O-N 3Å
33	N	63.9	Low	59.6	Low	88 Å²	88	96.2 Å²	96.2	47%	0.471	49%	0.49	S	S	.	.	H	α-helix	trans	-69.1	-39	-178.5	-86.1	-12.2	0	0	0	113.5	K29 L30 R36 Q37	K29-N33 WeakPolarHBondContact O-CB 3.49Å; K29-N33 PolarHBondContact O-N 3.44Å; L30-N33 PolarHBondContact O-N 3.07Å; N33-R36 WeakPolarHBondContact O-CB 3.41Å; N33-R36 PolarHBondContact O-N 2.93Å; N33-R36 PolarHBondContact OD1-NH1 3.13Å; N33-Q37 PolarHBondContact O-N 3.43Å
34	D	58.1	Low	57.7	Low	41 Å²	41	90.9 Å²	90.9	22%	0.219	46%	0.464	C	S	.	.	H	α-helix	trans	-77.5	-29.5	176.2	179	55.7	0	0	0	111.7	Y15 L30 R36 Q37 K38	Y15-D34 HydrophobicContact CE1-CB 3.53Å; Y15-D34 WeakPolarHBondContact CE1-OD2 3.37Å; Y15-D34 VanDerWaalsContact OH-C 3.25Å; Y15-D34 WeakPolarHBondContact OH-CB 3.37Å; Y15-D34 PolarHBondContact OH-OD2 3.49Å; L30-D34 PolarHBondContact O-N 3.1Å; D34-R36 VanDerWaalsContact C-N 3.26Å; D34-R36 PolarHBondContact O-N 3.21Å; D34-Q37 PolarHBondContact O-N 2.87Å; D34-K38 WeakPolarHBondContact O-CB 3.38Å; D34-K38 WeakPolarHBondContact O-CG 3.31Å; D34-K38 PolarHBondContact O-N 3.32Å; D34-K38 WeakPolarHBondContact OD2-CE 3.41Å; D34-K38 IonicContact OD2-NZ 2.79Å; D34-K38 PolarHBondContact OD2-NZ 3.17Å
35	C	50.7	Low	55.6	Low	48 Å²	48	94.3 Å²	94.3	32%	0.324	49%	0.489	S	S	.	.	H	α-helix	trans	-55.5	-44.6	163.6	-74.3	0	0	0	0	111	Y15 C31 I32 Q39	Y15-C35 PolarHBondContact OH-N 2.92Å; Y15-C35 VanDerWaalsContact OH-N 3.15Å; C31-C35 WeakPolarHBondContact O-CB 3.38Å; C31-C35 PolarHBondContact O-N 3.22Å; C31-C35 PolarHBondContact O-SG 2.92Å; I32-C35 WeakPolarHBondContact O-CB 3.27Å; I32-C35 PolarHBondContact O-N 3.45Å; C35-Q39 VanDerWaalsContact O-CB 3.27Å; C35-Q39 WeakPolarHBondContact O-CB 3.49Å; C35-Q39 WeakPolarHBondContact O-CG 3.38Å; C35-Q39 PolarHBondContact O-N 3.14Å; C35-Q39 PolarHBondContact O-OE1 3.16Å
36	R	49.6	Very low	53.6	Low	129 Å²	129	95.1 Å²	95.1	49%	0.487	49%	0.491	S	S	.	.	H	α-helix	trans	-63.8	-40.9	175.5	-71.7	167.4	175.3	177.8	-4.5	112.5	I32 N33 D34 Q39 A40	I32-R36 VanDerWaalsContact O-CG 3.29Å; I32-R36 WeakPolarHBondContact O-CG 3.38Å; I32-R36 PolarHBondContact O-N 3Å; N33-R36 WeakPolarHBondContact O-CB 3.41Å; N33-R36 PolarHBondContact O-N 2.93Å; N33-R36 PolarHBondContact OD1-NH1 3.13Å; D34-R36 VanDerWaalsContact C-N 3.26Å; D34-R36 PolarHBondContact O-N 3.21Å; R36-Q39 PolarHBondContact O-N 3.1Å; R36-A40 WeakPolarHBondContact O-CB 3.47Å; R36-A40 PolarHBondContact O-N 3.35Å
37	Q	54	Low	51.7	Low	141 Å²	141	93.6 Å²	93.6	66%	0.659	49%	0.487	S	S	*	.	H	α-helix	trans	-65.9	-46.6	177	-79.6	-173.6	-12.3	0	0	112.3	N33 D34 Q39 A40 A41	N33-Q37 PolarHBondContact O-N 3.43Å; D34-Q37 PolarHBondContact O-N 2.87Å; Q37-Q39 VanDerWaalsContact C-N 3.28Å; Q37-Q39 PolarHBondContact O-N 3.1Å; Q37-A40 PolarHBondContact O-N 3.33Å; Q37-A41 WeakPolarHBondContact O-CB 3.42Å; Q37-A41 PolarHBondContact O-N 3.48Å
38	K	52.3	Low	50	Low	113 Å²	113	100.6 Å²	100.6	49%	0.491	51%	0.514	S	S	.	.	H	α-helix	trans	-61.4	-37.6	175.1	-75.1	170.6	175.1	150.9	0	111.7	D34 A41 L42	D34-K38 WeakPolarHBondContact O-CB 3.38Å; D34-K38 WeakPolarHBondContact O-CG 3.31Å; D34-K38 PolarHBondContact O-N 3.32Å; D34-K38 WeakPolarHBondContact OD2-CE 3.41Å; D34-K38 IonicContact OD2-NZ 2.79Å; D34-K38 PolarHBondContact OD2-NZ 3.17Å; K38-A41 PolarHBondContact O-N 3.04Å; K38-L42 VanDerWaalsContact O-CG 3.31Å; K38-L42 WeakPolarHBondContact O-CG 3.48Å; K38-L42 PolarHBondContact O-N 3.18Å
39	Q	39.7	Very low	48.7	Very low	53 Å²	53	106.3 Å²	106.3	25%	0.248	54%	0.537	C	S	.	.	H	α-helix	trans	-67.3	-42.5	174.1	-76.3	159	9.3	0	0	112.8	C35 R36 Q37 A41 L42 Y43 F248	C35-Q39 VanDerWaalsContact O-CB 3.27Å; C35-Q39 WeakPolarHBondContact O-CB 3.49Å; C35-Q39 WeakPolarHBondContact O-CG 3.38Å; C35-Q39 PolarHBondContact O-N 3.14Å; C35-Q39 PolarHBondContact O-OE1 3.16Å; R36-Q39 PolarHBondContact O-N 3.1Å; Q37-Q39 VanDerWaalsContact C-N 3.28Å; Q37-Q39 PolarHBondContact O-N 3.1Å; Q39-A41 PolarHBondContact O-N 3.02Å; Q39-L42 PolarHBondContact O-N 3.33Å; Q39-Y43 PolarHBondContact O-N 3.41Å; Q39-F248 HydrophobicContact CG-CD1 4.46Å; Q39-F248 HydrophobicContact CG-CE1 4.2Å
40	A	45.7	Very low	47	Very low	57 Å²	57	103.8 Å²	103.8	47%	0.471	53%	0.534	S	S	.	.	H	α-helix	trans	-64.7	-29.6	174.9	0	0	0	0	0	112.5	R36 Q37 Y43	R36-A40 WeakPolarHBondContact O-CB 3.47Å; R36-A40 PolarHBondContact O-N 3.35Å; Q37-A40 PolarHBondContact O-N 3.33Å; A40-Y43 CarbonylContact O-C 2.87Å; A40-Y43 VanDerWaalsContact O-C 3.3Å
41	A	50.2	Low	45.4	Very low	82 Å²	82	102.7 Å²	102.7	68%	0.678	54%	0.537	S	S	*	.	H	α-helix	trans	-74.2	-32.9	173.9	0	0	0	0	0	113	Q37 K38 Q39	Q37-A41 WeakPolarHBondContact O-CB 3.42Å; Q37-A41 PolarHBondContact O-N 3.48Å; K38-A41 PolarHBondContact O-N 3.04Å; Q39-A41 PolarHBondContact O-N 3.02Å
42	L	41.7	Very low	44.1	Very low	134 Å²	134	104.9 Å²	104.9	70%	0.702	55%	0.552	S	S	*	*	H	α-helix	trans	-79.3	-28	175.6	-69.3	170.9	0	0	0	112.7	K38 Q39	K38-L42 VanDerWaalsContact O-CG 3.31Å; K38-L42 WeakPolarHBondContact O-CG 3.48Å; K38-L42 PolarHBondContact O-N 3.18Å; Q39-L42 PolarHBondContact O-N 3.33Å
43	Y	36.8	Very low	43	Very low	165 Å²	165	103.7 Å²	103.7	65%	0.647	56%	0.555	S	S	*	*	S	Bend	trans	-131.7	89.4	179	-66.2	-83.1	0	0	0	109.9	Q39 A40	Q39-Y43 PolarHBondContact O-N 3.41Å; A40-Y43 CarbonylContact O-C 2.87Å; A40-Y43 VanDerWaalsContact O-C 3.3Å
44	P	37.6	Very low	41.7	Very low	43 Å²	43	107.3 Å²	107.3	28%	0.279	57%	0.569	S	S	.	*			trans	-64.5	135.6	173.1	-11.4	24.5	0	0	0	109.5	F46	P44-F46 HydrophobicContact CB-CD1 3.43Å; P44-F46 VanDerWaalsContact CB-CD1 3.43Å; P44-F46 HydrophobicContact CB-CD2 4.04Å; P44-F46 HydrophobicContact CB-CE1 2.98Å; P44-F46 HydrophobicContact CB-CE2 3.62Å; P44-F46 HydrophobicContact CB-CG 3.97Å; P44-F46 HydrophobicContact CB-CZ 3.08Å; P44-F46 HydrophobicContact CG-CE1 3.92Å; P44-F46 HydrophobicContact CG-CE2 3.96Å; P44-F46 HydrophobicContact CG-CZ 3.51Å; P44-F46 PolarHBondContact O-N 3.31Å
45	P	33.9	Very low	40.5	Very low	135 Å²	135	110.5 Å²	110.5	88%	0.877	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	24.1	-172.9	27.3	-33.9	0	0	0	114.7
46	F	34.6	Very low	39.6	Very low	147 Å²	147	114.5 Å²	114.5	65%	0.645	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	9.2	-172	50.7	-112.9	0	0	0	115.8	P44	P44-F46 HydrophobicContact CB-CD1 3.43Å; P44-F46 VanDerWaalsContact CB-CD1 3.43Å; P44-F46 HydrophobicContact CB-CD2 4.04Å; P44-F46 HydrophobicContact CB-CE1 2.98Å; P44-F46 HydrophobicContact CB-CE2 3.62Å; P44-F46 HydrophobicContact CB-CG 3.97Å; P44-F46 HydrophobicContact CB-CZ 3.08Å; P44-F46 HydrophobicContact CG-CE1 3.92Å; P44-F46 HydrophobicContact CG-CE2 3.96Å; P44-F46 HydrophobicContact CG-CZ 3.51Å; P44-F46 PolarHBondContact O-N 3.31Å
47	L	35	Very low	38.7	Very low	115 Å²	115	116.5 Å²	116.5	60%	0.602	62%	0.623	S	S	*	*	S	Bend	trans	-93.3	-8.4	-171.5	-76.8	173.1	0	0	0	117.9
48	F	34.7	Very low	37.9	Very low	177 Å²	177	113.4 Å²	113.4	78%	0.776	62%	0.616	S	S	*	*			trans	-145.9	99.3	173.3	-59.9	-75.9	0	0	0	111.9	A53	F48-A53 HydrophobicContact CD1-CB 4.21Å
49	K	37.6	Very low	37.3	Very low	211 Å²	211	113 Å²	113	92%	0.917	63%	0.625	S	S	*	*			trans	-91.3	-5.4	172.3	-78.6	-175.7	178.6	178.7	0	113.7
50	S	36.6	Very low	37.4	Very low	60 Å²	60	112.4 Å²	112.4	42%	0.42	63%	0.626	S	S	.	*			trans	-100.5	117.6	177	69.2	0	0	0	0	110.9	S52 A53	S50-S52 PolarHBondContact O-N 3.46Å; S50-S52 VanDerWaalsContact O-N 3.11Å; S50-A53 PolarHBondContact O-N 3.41Å; S50-A53 VanDerWaalsContact O-N 3.09Å; S50-A53 WeakPolarHBondContact OG-CB 3.39Å; S50-A53 PolarHBondContact OG-N 2.97Å
51	S	34.7	Very low	37.2	Very low	99 Å²	99	113.2 Å²	113.2	69%	0.692	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-56	-20.5	164	-163.1	0	0	0	0	111.5	Q54	S51-Q54 WeakPolarHBondContact O-CB 3.35Å; S51-Q54 PolarHBondContact O-N 2.93Å
52	S	36.8	Very low	36.9	Very low	80 Å²	80	111.5 Å²	111.5	56%	0.559	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-77.3	-16.1	178	-22.3	0	0	0	0	113.8	S50 Q54 L55	S50-S52 PolarHBondContact O-N 3.46Å; S50-S52 VanDerWaalsContact O-N 3.11Å; S52-Q54 PolarHBondContact O-N 3.22Å; S52-L55 VanDerWaalsContact O-CB 3.25Å; S52-L55 WeakPolarHBondContact O-CB 3.4Å; S52-L55 WeakPolarHBondContact O-CD1 2.99Å; S52-L55 PolarHBondContact O-N 3.39Å
53	A	39.1	Very low	36.8	Very low	59 Å²	59	107.2 Å²	107.2	49%	0.488	59%	0.589	S	S	.	*	G	3₁₀ helix	trans	-80.4	1.8	172.1	0	0	0	0	0	113.2	F48 S50 L55	F48-A53 HydrophobicContact CD1-CB 4.21Å; S50-A53 PolarHBondContact O-N 3.41Å; S50-A53 VanDerWaalsContact O-N 3.09Å; S50-A53 WeakPolarHBondContact OG-CB 3.39Å; S50-A53 PolarHBondContact OG-N 2.97Å; A53-L55 PolarHBondContact O-N 3.43Å
54	Q	36.3	Very low	37.1	Very low	164 Å²	164	103.2 Å²	103.2	77%	0.766	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-80.3	5.1	163.8	-63.9	175.4	-16.7	0	0	112.3	S51 S52 L56	S51-Q54 WeakPolarHBondContact O-CB 3.35Å; S51-Q54 PolarHBondContact O-N 2.93Å; S52-Q54 PolarHBondContact O-N 3.22Å; Q54-L56 PolarHBondContact O-N 3.16Å
55	L	33	Very low	37.3	Very low	108 Å²	108	101.9 Å²	101.9	57%	0.565	57%	0.567	S	S	*	*			trans	-48.8	127	169.3	-114.5	79.2	0	0	0	109.9	S52 A53	S52-L55 VanDerWaalsContact O-CB 3.25Å; S52-L55 WeakPolarHBondContact O-CB 3.4Å; S52-L55 WeakPolarHBondContact O-CD1 2.99Å; S52-L55 PolarHBondContact O-N 3.39Å; A53-L55 PolarHBondContact O-N 3.43Å
56	L	31.2	Very low	37.5	Very low	132 Å²	132	98 Å²	98	69%	0.691	54%	0.539	S	S	*	.				-147.1	105	51.6	-74.7	159.9	0	0	0	111.3	Q54 S58	Q54-L56 PolarHBondContact O-N 3.16Å; L56-S58 VanDerWaalsContact C-N 3.27Å; L56-S58 PolarHBondContact O-N 3.01Å
57	L	30.2	Very low	37.6	Very low	172 Å²	172	94.7 Å²	94.7	90%	0.901	53%	0.531	S	S	*	.	S	Bend	trans	37	22.1	135	-78.6	153	0	0	0	122.5
58	S	37.3	Very low	37.7	Very low	75 Å²	75	94.8 Å²	94.8	52%	0.524	53%	0.531	S	S	.	.	S	Bend	trans	-158.8	150.6	160.2	55.6	0	0	0	0	109.1	L56 P60	L56-S58 VanDerWaalsContact C-N 3.27Å; L56-S58 PolarHBondContact O-N 3.01Å; S58-P60 WeakPolarHBondContact O-CD 3.47Å; S58-P60 VanDerWaalsContact O-N 3.16Å
59	P	40	Very low	37.7	Very low	104 Å²	104	87.3 Å²	87.3	68%	0.675	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-60.5	122.1	171.6	23.8	-31	0	0	0	108	D61	P59-D61 PolarHBondContact O-N 2.67Å
60	P	41.7	Very low	37.6	Very low	42 Å²	42	78.4 Å²	78.4	27%	0.273	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-56.6	132.7	-171.4	21.4	-33.6	0	0	0	110.3	S58 E64 L65 I68 K239	S58-P60 WeakPolarHBondContact O-CD 3.47Å; S58-P60 VanDerWaalsContact O-N 3.16Å; P60-E64 VanDerWaalsContact CA-OE2 3.3Å; P60-E64 WeakPolarHBondContact CA-OE2 3.36Å; P60-E64 HydrophobicContact CB-CB 4Å; P60-L65 HydrophobicContact CB-CD2 4.12Å; P60-L65 HydrophobicContact CB-CG 4Å; P60-L65 HydrophobicContact CG-CD2 3.63Å; P60-L65 HydrophobicContact CG-CG 3.96Å; P60-I68 HydrophobicContact CB-CD1 4.39Å; P60-K239 PolarHBondContact O-NZ 3.01Å
61	D	43	Very low	37.6	Very low	73 Å²	73	81.7 Å²	81.7	39%	0.39	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-61.6	161.1	177.2	-179.7	37.5	0	0	0	110.9	P59 S63 E64 L65	P59-D61 PolarHBondContact O-N 2.67Å; D61-S63 PolarHBondContact O-N 3.27Å; D61-S63 VanDerWaalsContact O-N 3.17Å; D61-S63 WeakPolarHBondContact OD2-CB 3.41Å; D61-S63 PolarHBondContact OD2-N 3.11Å; D61-S63 PolarHBondContact OD2-OG 2.96Å; D61-E64 HydrophobicContact CB-CB 4.34Å; D61-E64 HydrophobicContact CB-CG 4.15Å; D61-E64 PolarHBondContact N-OE2 3.11Å; D61-E64 CarbonylContact O-C 3.3Å; D61-E64 PolarHBondContact O-N 3.05Å; D61-L65 WeakPolarHBondContact O-CB 3.38Å; D61-L65 WeakPolarHBondContact O-CG 3.39Å; D61-L65 PolarHBondContact O-N 2.92Å
62	A	42.6	Very low	37.9	Very low	47 Å²	47	79 Å²	79	39%	0.388	46%	0.458	S	S	.	.	H	α-helix	trans	-54.8	-35.3	176.8	0	0	0	0	0	112	L66	A62-L66 WeakPolarHBondContact O-CB 3.37Å; A62-L66 WeakPolarHBondContact O-CD1 3.46Å; A62-L66 VanDerWaalsContact O-CG 3.31Å; A62-L66 WeakPolarHBondContact O-CG 3.19Å; A62-L66 PolarHBondContact O-N 3.4Å
63	S	39.6	Very low	38	Very low	43 Å²	43	81.7 Å²	81.7	30%	0.301	46%	0.455	S	S	.	.	H	α-helix	trans	-72.9	-31.5	175.9	69.1	0	0	0	0	113.7	D61 V67	D61-S63 PolarHBondContact O-N 3.27Å; D61-S63 VanDerWaalsContact O-N 3.17Å; D61-S63 WeakPolarHBondContact OD2-CB 3.41Å; D61-S63 PolarHBondContact OD2-N 3.11Å; D61-S63 PolarHBondContact OD2-OG 2.96Å; S63-V67 WeakPolarHBondContact O-CG2 3.44Å; S63-V67 PolarHBondContact O-N 3.14Å
64	E	43.8	Very low	37.9	Very low	81 Å²	81	81.8 Å²	81.8	38%	0.379	45%	0.447	S	S	.	.	H	α-helix	trans	-78.5	-41.9	175.8	-70.2	176.3	165.8	0	0	110.4	P60 D61 L66 V67 I68	P60-E64 VanDerWaalsContact CA-OE2 3.3Å; P60-E64 WeakPolarHBondContact CA-OE2 3.36Å; P60-E64 HydrophobicContact CB-CB 4Å; D61-E64 HydrophobicContact CB-CB 4.34Å; D61-E64 HydrophobicContact CB-CG 4.15Å; D61-E64 PolarHBondContact N-OE2 3.11Å; D61-E64 CarbonylContact O-C 3.3Å; D61-E64 PolarHBondContact O-N 3.05Å; E64-L66 VanDerWaalsContact C-N 3.31Å; E64-L66 PolarHBondContact O-N 3.06Å; E64-V67 CarbonylContact O-C 3.58Å; E64-V67 PolarHBondContact O-N 3.26Å; E64-I68 HydrophobicContact CB-CD1 3.81Å; E64-I68 WeakPolarHBondContact O-CA 3.31Å; E64-I68 WeakPolarHBondContact O-CB 3.26Å; E64-I68 WeakPolarHBondContact O-CD1 3.26Å; E64-I68 WeakPolarHBondContact O-CG1 3.45Å; E64-I68 PolarHBondContact O-N 3.16Å
65	L	41.4	Very low	38.1	Very low	16 Å²	16	80.5 Å²	80.5	8%	0.084	44%	0.441	C	S	.	.	H	α-helix	trans	-52.8	-51.8	167.1	-73.8	168.2	0	0	0	109.1	P60 D61 V67 I68 T69 K239 T243	P60-L65 HydrophobicContact CB-CD2 4.12Å; P60-L65 HydrophobicContact CB-CG 4Å; P60-L65 HydrophobicContact CG-CD2 3.63Å; P60-L65 HydrophobicContact CG-CG 3.96Å; D61-L65 WeakPolarHBondContact O-CB 3.38Å; D61-L65 WeakPolarHBondContact O-CG 3.39Å; D61-L65 PolarHBondContact O-N 2.92Å; L65-V67 PolarHBondContact O-N 2.94Å; L65-I68 PolarHBondContact O-N 2.82Å; L65-I68 VanDerWaalsContact O-N 3.14Å; L65-T69 VanDerWaalsContact C-CG2 3.48Å; L65-T69 HydrophobicContact CB-CG2 4.3Å; L65-T69 WeakPolarHBondContact O-CB 3.4Å; L65-T69 WeakPolarHBondContact O-CG2 3.49Å; L65-T69 PolarHBondContact O-N 3.22Å; L65-T69 PolarHBondContact O-OG1 3.21Å; L65-K239 HydrophobicContact CD1-CB 4.1Å; L65-K239 HydrophobicContact CD1-CD 3.67Å; L65-K239 HydrophobicContact CD1-CG 3.54Å; L65-T243 HydrophobicContact CD2-CG2 4.19Å
66	L	38.9	Very low	38.3	Very low	53 Å²	53	77.9 Å²	77.9	28%	0.277	43%	0.427	S	S	.	.	H	α-helix	trans	-53.4	-27.7	176.1	-84.2	159.1	0	0	0	115.4	A62 E64 W143 I152	A62-L66 WeakPolarHBondContact O-CB 3.37Å; A62-L66 WeakPolarHBondContact O-CD1 3.46Å; A62-L66 VanDerWaalsContact O-CG 3.31Å; A62-L66 WeakPolarHBondContact O-CG 3.19Å; A62-L66 PolarHBondContact O-N 3.4Å; E64-L66 VanDerWaalsContact C-N 3.31Å; E64-L66 PolarHBondContact O-N 3.06Å; L66-W143 HydrophobicContact CD2-CB 4.25Å; L66-I152 HydrophobicContact CD2-CD1 4.3Å
67	V	36.7	Very low	38.6	Very low	78 Å²	78	77 Å²	77	47%	0.473	42%	0.415	S	S	.	.	H	α-helix	trans	-95	-34.3	178.2	173.8	0	0	0	0	112.7	S63 E64 L65 K145	S63-V67 WeakPolarHBondContact O-CG2 3.44Å; S63-V67 PolarHBondContact O-N 3.14Å; E64-V67 CarbonylContact O-C 3.58Å; E64-V67 PolarHBondContact O-N 3.26Å; L65-V67 PolarHBondContact O-N 2.94Å; V67-K145 HydrophobicContact CG2-CD 4.14Å; V67-K145 HydrophobicContact CG2-CG 4.02Å
68	I	35.9	Very low	39	Very low	117 Å²	117	73.1 Å²	73.1	60%	0.6	39%	0.394	S	S	*	.	H	α-helix	trans	-89.5	-15.6	-173.6	-62.9	169.9	0	0	0	110.4	P60 E64 L65 G70	P60-I68 HydrophobicContact CB-CD1 4.39Å; E64-I68 HydrophobicContact CB-CD1 3.81Å; E64-I68 WeakPolarHBondContact O-CA 3.31Å; E64-I68 WeakPolarHBondContact O-CB 3.26Å; E64-I68 WeakPolarHBondContact O-CD1 3.26Å; E64-I68 WeakPolarHBondContact O-CG1 3.45Å; E64-I68 PolarHBondContact O-N 3.16Å; L65-I68 PolarHBondContact O-N 2.82Å; L65-I68 VanDerWaalsContact O-N 3.14Å; I68-G70 PolarHBondContact O-N 2.97Å
69	T	36.3	Very low	39.2	Very low	20 Å²	20	75.6 Å²	75.6	12%	0.123	40%	0.398	C	S	.	.	S	Bend	trans	-71.1	10.5	172.5	62.4	0	0	0	0	113.5	L65 L141 L246	L65-T69 VanDerWaalsContact C-CG2 3.48Å; L65-T69 HydrophobicContact CB-CG2 4.3Å; L65-T69 WeakPolarHBondContact O-CB 3.4Å; L65-T69 WeakPolarHBondContact O-CG2 3.49Å; L65-T69 PolarHBondContact O-N 3.22Å; L65-T69 PolarHBondContact O-OG1 3.21Å; T69-L141 PolarHBondContact OG1-O 2.93Å; T69-L246 VanDerWaalsContact CB-CD1 3.48Å; T69-L246 HydrophobicContact CG2-CD1 3.41Å; T69-L246 VanDerWaalsContact CG2-CD1 3.41Å; T69-L246 WeakPolarHBondContact O-CD2 3.26Å
70	G	35.7	Very low	39.2	Very low	24 Å²	24	76.6 Å²	76.6	25%	0.247	39%	0.393	C	S	.	.			trans	-133.9	94.7	-168.7	0	0	0	0	0	116.4	I68	I68-G70 PolarHBondContact O-N 2.97Å
71	Q	36.3	Very low	39.2	Very low	129 Å²	129	78.1 Å²	78.1	60%	0.603	40%	0.399	S	S	*	.			trans	-102.9	98.3	147.3	-77	-168.9	-5.4	0	0	110.1	L140	Q71-L140 WeakPolarHBondContact O-CD2 3.11Å
72	S	41.2	Very low	39.1	Very low	43 Å²	43	80.9 Å²	80.9	30%	0.301	41%	0.413	S	S	.	.			trans	-123.5	98.6	138.7	87.6	0	0	0	0	108.5	I74 H75	S72-I74 PolarHBondContact O-N 3.34Å; S72-H75 WeakPolarHBondContact O-CB 3.35Å; S72-H75 PolarHBondContact O-N 3.1Å; S72-H75 VanDerWaalsContact O-N 3.12Å
73	R	37.5	Very low	38.9	Very low	135 Å²	135	86 Å²	86	51%	0.509	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	26.8	-169.7	-69.8	-168.9	94.1	123.8	-9.6	114.5	L76 Y77	R73-L76 HydrophobicContact CB-CB 3.74Å; R73-L76 HydrophobicContact CB-CD1 4.48Å; R73-L76 HydrophobicContact CG-CB 3.59Å; R73-L76 HydrophobicContact CG-CD1 3.44Å; R73-L76 VanDerWaalsContact CG-CD1 3.44Å; R73-L76 HydrophobicContact CG-CG 4.02Å; R73-L76 VanDerWaalsContact CZ-CD1 3.46Å; R73-L76 VanDerWaalsContact NE-CD1 3.29Å; R73-L76 PolarHBondContact O-N 2.95Å; R73-Y77 VanDerWaalsContact O-CB 3.25Å; R73-Y77 WeakPolarHBondContact O-CB 3.48Å; R73-Y77 PolarHBondContact O-N 3.49Å
74	I	37.1	Very low	38.8	Very low	62 Å²	62	89.4 Å²	89.4	32%	0.318	45%	0.445	S	S	.	.	H	α-helix	trans	-62.3	-32.4	146.7	-72.8	110.7	0	0	0	108.7	S72 L76 Y77 I78 F122	S72-I74 PolarHBondContact O-N 3.34Å; I74-L76 VanDerWaalsContact C-N 3.32Å; I74-L76 PolarHBondContact O-N 3.38Å; I74-Y77 WeakPolarHBondContact O-CB 3.37Å; I74-Y77 PolarHBondContact O-N 3.03Å; I74-I78 HydrophobicContact CG2-CD1 3.63Å; I74-I78 HydrophobicContact CG2-CG1 4.14Å; I74-I78 WeakPolarHBondContact O-CG1 3.45Å; I74-I78 PolarHBondContact O-N 3.34Å; I74-F122 HydrophobicContact CB-CD2 3.66Å; I74-F122 HydrophobicContact CB-CE2 3.41Å; I74-F122 VanDerWaalsContact CB-CE2 3.41Å; I74-F122 HydrophobicContact CB-CZ 4.39Å; I74-F122 HydrophobicContact CD1-CD2 3.38Å; I74-F122 HydrophobicContact CD1-CE2 3.55Å; I74-F122 HydrophobicContact CG1-CD2 3.33Å; I74-F122 HydrophobicContact CG1-CE2 3.6Å; I74-F122 HydrophobicContact CG1-CG 4.45Å; I74-F122 HydrophobicContact CG2-CD2 3.42Å; I74-F122 VanDerWaalsContact CG2-CD2 3.42Å; I74-F122 HydrophobicContact CG2-CE2 3.25Å; I74-F122 HydrophobicContact CG2-CG 4.16Å; I74-F122 HydrophobicContact CG2-CZ 3.89Å
75	H	40.2	Very low	38.1	Very low	137 Å²	137	91 Å²	91	63%	0.634	46%	0.463	S	S	*	.	H	α-helix	trans	-68.8	-27	177.4	-148.8	71.6	0	0	0	113.9	S72 Q79	S72-H75 WeakPolarHBondContact O-CB 3.35Å; S72-H75 PolarHBondContact O-N 3.1Å; S72-H75 VanDerWaalsContact O-N 3.12Å; H75-Q79 PolarHBondContact O-N 2.96Å
76	L	38.4	Very low	37.7	Very low	53 Å²	53	93.7 Å²	93.7	28%	0.277	48%	0.483	S	S	.	.	H	α-helix	trans	-89	-24.8	170.8	-82.7	142.3	0	0	0	112.6	R73 I74 Q80	R73-L76 HydrophobicContact CB-CB 3.74Å; R73-L76 HydrophobicContact CB-CD1 4.48Å; R73-L76 HydrophobicContact CG-CB 3.59Å; R73-L76 HydrophobicContact CG-CD1 3.44Å; R73-L76 VanDerWaalsContact CG-CD1 3.44Å; R73-L76 HydrophobicContact CG-CG 4.02Å; R73-L76 VanDerWaalsContact CZ-CD1 3.46Å; R73-L76 VanDerWaalsContact NE-CD1 3.29Å; R73-L76 PolarHBondContact O-N 2.95Å; I74-L76 VanDerWaalsContact C-N 3.32Å; I74-L76 PolarHBondContact O-N 3.38Å; L76-Q80 PolarHBondContact O-N 2.94Å
77	Y	37.9	Very low	37.5	Very low	114 Å²	114	98.6 Å²	98.6	45%	0.447	51%	0.509	S	S	.	.	H	α-helix	trans	-66.2	-37.5	168.5	-176.8	-98.3	0	0	0	112.3	R73 I74 N81 I119	R73-Y77 VanDerWaalsContact O-CB 3.25Å; R73-Y77 WeakPolarHBondContact O-CB 3.48Å; R73-Y77 PolarHBondContact O-N 3.49Å; I74-Y77 WeakPolarHBondContact O-CB 3.37Å; I74-Y77 PolarHBondContact O-N 3.03Å; Y77-N81 WeakPolarHBondContact CE1-ND2 3.35Å; Y77-N81 VanDerWaalsContact CE2-ND2 3.33Å; Y77-N81 WeakPolarHBondContact CE2-ND2 3.49Å; Y77-N81 VanDerWaalsContact CZ-ND2 3.28Å; Y77-N81 WeakPolarHBondContact O-CB 3.33Å; Y77-N81 PolarHBondContact O-N 3.41Å; Y77-N81 PolarHBondContact O-ND2 2.91Å; Y77-I119 HydrophobicContact CE2-CD1 3.61Å; Y77-I119 WeakPolarHBondContact OH-CD1 3.48Å
78	I	36.7	Very low	37.1	Very low	89 Å²	89	102.7 Å²	102.7	46%	0.456	52%	0.52	S	S	.	.	H	α-helix	trans	-75.1	-30.6	176.8	-68.9	169.5	0	0	0	111.8	I74 L82	I74-I78 HydrophobicContact CG2-CD1 3.63Å; I74-I78 HydrophobicContact CG2-CG1 4.14Å; I74-I78 WeakPolarHBondContact O-CG1 3.45Å; I74-I78 PolarHBondContact O-N 3.34Å; I78-L82 HydrophobicContact CG2-CD1 4.47Å; I78-L82 WeakPolarHBondContact O-CD1 3.34Å; I78-L82 WeakPolarHBondContact O-CG 3.32Å
79	Q	41.8	Very low	36.7	Very low	128 Å²	128	103.3 Å²	103.3	60%	0.598	53%	0.529	S	S	*	.	H	α-helix	trans	-75.8	-31.8	175.6	-83.9	-175	-22.4	0	0	114.2	H75	H75-Q79 PolarHBondContact O-N 2.96Å
80	Q	41	Very low	36.4	Very low	124 Å²	124	107.5 Å²	107.5	58%	0.579	56%	0.558	S	S	*	*	H	α-helix	trans	-78.4	-29.8	175.1	-86.2	179.9	-28.5	0	0	113.7	L76 L82	L76-Q80 PolarHBondContact O-N 2.94Å; Q80-L82 VanDerWaalsContact C-N 3.34Å; Q80-L82 PolarHBondContact O-N 2.85Å
81	N	42.1	Very low	36	Very low	74 Å²	74	114.3 Å²	114.3	40%	0.396	58%	0.584	S	S	.	*	G	3₁₀ helix	trans	-87.6	7.1	-178.6	-72.3	-49.1	0	0	0	114.5	Y77	Y77-N81 WeakPolarHBondContact CE1-ND2 3.35Å; Y77-N81 VanDerWaalsContact CE2-ND2 3.33Å; Y77-N81 WeakPolarHBondContact CE2-ND2 3.49Å; Y77-N81 VanDerWaalsContact CZ-ND2 3.28Å; Y77-N81 WeakPolarHBondContact O-CB 3.33Å; Y77-N81 PolarHBondContact O-N 3.41Å; Y77-N81 PolarHBondContact O-ND2 2.91Å
82	L	41	Very low	35.7	Very low	131 Å²	131	114.1 Å²	114.1	69%	0.686	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-87.1	1.4	175	-90.4	161.2	0	0	0	114.2	I78 Q80	I78-L82 HydrophobicContact CG2-CD1 4.47Å; I78-L82 WeakPolarHBondContact O-CD1 3.34Å; I78-L82 WeakPolarHBondContact O-CG 3.32Å; Q80-L82 VanDerWaalsContact C-N 3.34Å; Q80-L82 PolarHBondContact O-N 2.85Å
83	N	38.2	Very low	35.2	Very low	155 Å²	155	121.3 Å²	121.3	83%	0.829	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-101.8	16.8	170.8	-82	-2	0	0	0	113.8
84	E	36.4	Very low	34.7	Very low	115 Å²	115	120.9 Å²	120.9	54%	0.537	62%	0.617	S	S	.	*			trans	-84.2	125.6	174.3	-75.5	-140.8	160.4	0	0	111.8
85	P	30.5	Very low	34.5	Very low	115 Å²	115	125.1 Å²	125.1	75%	0.747	64%	0.64	S	S	*	*				-122	134.1	101.2	34.6	-28.4	0	0	0	109.5
86	S	33.1	Very low	33.9	Very low	72 Å²	72	122.9 Å²	122.9	50%	0.503	64%	0.64	S	S	.	*			trans	88.1	117.9	170.9	89.5	0	0	0	0	114.4	K88	S86-K88 VanDerWaalsContact CB-N 3.27Å
87	L	33.2	Very low	33.4	Very low	156 Å²	156	127.3 Å²	127.3	82%	0.817	66%	0.663	S	S	*	*			cis	45.8	28.2	19	-95.6	169.2	0	0	0	114.1
88	K	28.7	Very low	33.2	Very low	163 Å²	163	130.1 Å²	130.1	71%	0.709	68%	0.68	S	S	*	*			trans	-146.7	116	166.7	-61.6	-177.8	-179.8	176.5	0	111.2	S86	S86-K88 VanDerWaalsContact CB-N 3.27Å
89	T	27.3	Very low	32.9	Very low	130 Å²	130	130 Å²	130	80%	0.798	69%	0.687	S	S	*	*			trans	81.4	132.8	137.2	31.1	0	0	0	0	121.1
90	C	30.1	Very low	32.3	Very low	108 Å²	108	130.8 Å²	130.8	73%	0.73	70%	0.696	S	S	*	*			trans	84.3	87.8	154.2	-54	0	0	0	0	114.6
91	E	28	Very low	32	Very low	168 Å²	168	133 Å²	133	79%	0.785	71%	0.71	S	S	*	*				49.7	129.5	73.2	-54.8	-168.7	167.4	0	0	113.2
92	N	30.2	Very low	31.5	Very low	124 Å²	124	134.2 Å²	134.2	66%	0.663	72%	0.724	S	S	*	*			trans	103.2	103.5	143.7	-67.9	-19.6	0	0	0	120.8
93	Y	29.3	Very low	31.2	Very low	195 Å²	195	134.7 Å²	134.7	77%	0.765	73%	0.727	S	S	*	*			trans	78.6	105.1	137.9	-73	-89.5	0	0	0	121.7
94	N	28.1	Very low	30.9	Very low	126 Å²	126	133.3 Å²	133.3	67%	0.674	73%	0.727	S	S	*	*				29.5	116.2	120.9	-55.5	-18.7	0	0	0	118.4
95	N	31.5	Very low	30.6	Very low	151 Å²	151	133.8 Å²	133.8	81%	0.807	74%	0.737	S	S	*	*				170	127	109.9	-87.1	-23.2	0	0	0	112.9
96	S	29.1	Very low	30.7	Very low	90 Å²	90	137.4 Å²	137.4	63%	0.629	75%	0.745	S	S	*	*			trans	28.7	130.7	141.7	63.2	0	0	0	0	122.5
97	N	27.7	Very low	30.7	Very low	145 Å²	145	140.7 Å²	140.7	78%	0.775	76%	0.761	S	S	*	*			trans	72.6	118	144.1	-55.4	-17	0	0	0	118.3
98	H	32.5	Very low	30.4	Very low	174 Å²	174	140.1 Å²	140.1	81%	0.806	76%	0.759	S	S	*	*			trans	174.9	104.2	145.2	-91.4	-59.8	0	0	0	105.4
99	S	30.3	Very low	30.6	Very low	86 Å²	86	138.9 Å²	138.9	60%	0.601	76%	0.759	S	S	*	*				33.7	123.4	79.5	76	0	0	0	0	113.2
100	D	30.7	Very low	30.8	Very low	145 Å²	145	138.4 Å²	138.4	78%	0.775	76%	0.756	S	S	*	*			trans	88.9	99.4	175.6	-47.5	-31.1	0	0	0	114.9
101	I	34.3	Very low	31	Very low	171 Å²	171	138.7 Å²	138.7	88%	0.877	75%	0.754	S	S	*	*			trans	-156.1	110.9	134.2	-84.9	131.3	0	0	0	107.8
102	S	31.1	Very low	31	Very low	99 Å²	99	135.5 Å²	135.5	69%	0.692	75%	0.749	S	S	*	*			trans	-76.1	123.1	163.5	48.8	0	0	0	0	110.3
103	N	35.2	Very low	31	Very low	141 Å²	141	139.3 Å²	139.3	75%	0.754	76%	0.76	S	S	*	*			trans	143	128.9	149.9	-74.7	-24.8	0	0	0	111.2	T105	N103-T105 PolarHBondContact O-N 3.46Å
104	P	31.5	Very low	31.2	Very low	125 Å²	125	136.4 Å²	136.4	81%	0.812	76%	0.757	S	S	*	*			trans	-95.1	81.6	-166	36.8	-30.8	0	0	0	111.5
105	T	30	Very low	31.3	Very low	125 Å²	125	135.6 Å²	135.6	77%	0.767	76%	0.761	S	S	*	*			trans	-158.5	62.9	175.4	-2.2	0	0	0	0	112.7	N103	N103-T105 PolarHBondContact O-N 3.46Å
106	E	32.1	Very low	31.3	Very low	192 Å²	192	135.6 Å²	135.6	90%	0.897	76%	0.761	S	S	*	*			trans	-167.8	114.9	161.1	-111.5	158.9	-160.3	0	0	108.8	D108	E106-D108 PolarHBondContact O-N 2.65Å
107	V	33.1	Very low	31.5	Very low	140 Å²	140	137.1 Å²	137.1	85%	0.848	76%	0.762	S	S	*	*			trans	-82	101.8	177.1	177.9	0	0	0	0	107.8	L109	V107-L109 PolarHBondContact O-N 3.11Å
108	D	28.2	Very low	31.9	Very low	145 Å²	145	135.7 Å²	135.7	78%	0.775	76%	0.763	S	S	*	*			trans	-69.2	100.2	-177.4	-148.4	3.1	0	0	0	111	E106 V110	E106-D108 PolarHBondContact O-N 2.65Å; D108-V110 PolarHBondContact O-N 2.92Å
109	L	33.2	Very low	32	Very low	137 Å²	137	132.5 Å²	132.5	72%	0.717	75%	0.751	S	S	*	*			trans	-84.8	84.4	174.5	-82.2	162.2	0	0	0	109.3	V107 V111	V107-L109 PolarHBondContact O-N 3.11Å; L109-V111 PolarHBondContact O-N 3.05Å
110	V	31.3	Very low	32.4	Very low	119 Å²	119	133.9 Å²	133.9	72%	0.721	76%	0.757	S	S	*	*			trans	-66.1	97.5	172.7	179.5	0	0	0	0	109.9	D108 C112	D108-V110 PolarHBondContact O-N 2.92Å; V110-C112 PolarHBondContact O-N 3.05Å
111	V	32.7	Very low	33	Very low	115 Å²	115	132.5 Å²	132.5	70%	0.697	76%	0.759	S	S	*	*			trans	-68.6	112.3	174.3	174	0	0	0	0	109.5	L109 K113	L109-V111 PolarHBondContact O-N 3.05Å; V111-K113 PolarHBondContact O-N 3.45Å
112	C	29.9	Very low	33.3	Very low	100 Å²	100	129.7 Å²	129.7	68%	0.676	74%	0.741	S	S	*	*			trans	-68.1	121.1	169.6	-73.7	0	0	0	0	110.3	V110 L114	V110-C112 PolarHBondContact O-N 3.05Å; C112-L114 PolarHBondContact O-N 3.38Å; C112-L114 VanDerWaalsContact O-N 3.08Å
113	K	28.7	Very low	34.1	Very low	205 Å²	205	126.3 Å²	126.3	89%	0.891	72%	0.716	S	S	*	*			trans	-51.7	106.2	171.9	-68.9	173.2	175.9	176.1	0	111.2	V111	V111-K113 PolarHBondContact O-N 3.45Å
114	L	35.2	Very low	34.7	Very low	133 Å²	133	128.3 Å²	128.3	70%	0.696	72%	0.721	S	S	*	*			trans	-109.4	76.2	174	-76	156.7	0	0	0	109.3	C112 N116 L117	C112-L114 PolarHBondContact O-N 3.38Å; C112-L114 VanDerWaalsContact O-N 3.08Å; L114-N116 VanDerWaalsContact C-N 3.29Å; L114-N116 PolarHBondContact O-N 2.96Å; L114-L117 HydrophobicContact CB-CD1 4.24Å; L114-L117 HydrophobicContact CD1-CD1 4.4Å; L114-L117 HydrophobicContact CD2-CD1 3.54Å; L114-L117 HydrophobicContact CG-CD1 4.26Å
115	S	29.2	Very low	35.4	Very low	109 Å²	109	126.8 Å²	126.8	76%	0.762	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-3.2	-175.1	54.4	0	0	0	0	115.1
116	N	31.9	Very low	36.1	Very low	152 Å²	152	126.4 Å²	126.4	81%	0.813	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.7	25.9	-168.8	-67.6	-3.6	0	0	0	115.4	L114	L114-N116 VanDerWaalsContact C-N 3.29Å; L114-N116 PolarHBondContact O-N 2.96Å
117	L	33	Very low	36.9	Very low	122 Å²	122	121.5 Å²	121.5	64%	0.639	69%	0.686	S	S	*	*			trans	-108.9	117	177.1	-85.3	152.5	0	0	0	111.5	L114 I119	L114-L117 HydrophobicContact CB-CD1 4.24Å; L114-L117 HydrophobicContact CD1-CD1 4.4Å; L114-L117 HydrophobicContact CD2-CD1 3.54Å; L114-L117 HydrophobicContact CG-CD1 4.26Å; L117-I119 PolarHBondContact O-N 3Å
118	S	35.2	Very low	37.8	Very low	114 Å²	114	116.3 Å²	116.3	80%	0.797	66%	0.656	S	S	*	*			trans	-70	108.8	164.7	69.4	0	0	0	0	108.5	P120	S118-P120 WeakPolarHBondContact O-CD 3.44Å
119	I	36.5	Very low	38.7	Very low	108 Å²	108	112.1 Å²	112.1	55%	0.554	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-67.8	122	176.3	-60.4	168.3	0	0	0	107.7	Y77 L117	Y77-I119 HydrophobicContact CE2-CD1 3.61Å; Y77-I119 WeakPolarHBondContact OH-CD1 3.48Å; L117-I119 PolarHBondContact O-N 3Å
120	P	38.1	Very low	39.3	Very low	114 Å²	114	106.9 Å²	106.9	74%	0.74	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-63.1	142.4	177.2	24.7	-31.5	0	0	0	110.3	S118	S118-P120 WeakPolarHBondContact O-CD 3.44Å
121	S	43	Very low	40.2	Very low	117 Å²	117	104.5 Å²	104.5	82%	0.818	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-63.6	142	-179.8	49.2	0	0	0	0	111.7
122	F	39.8	Very low	40.8	Very low	112 Å²	112	102.8 Å²	102.8	49%	0.491	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-67.7	132.6	-175.4	-174.3	-119	0	0	0	112.1	I74 Q124	I74-F122 HydrophobicContact CB-CD2 3.66Å; I74-F122 HydrophobicContact CB-CE2 3.41Å; I74-F122 VanDerWaalsContact CB-CE2 3.41Å; I74-F122 HydrophobicContact CB-CZ 4.39Å; I74-F122 HydrophobicContact CD1-CD2 3.38Å; I74-F122 HydrophobicContact CD1-CE2 3.55Å; I74-F122 HydrophobicContact CG1-CD2 3.33Å; I74-F122 HydrophobicContact CG1-CE2 3.6Å; I74-F122 HydrophobicContact CG1-CG 4.45Å; I74-F122 HydrophobicContact CG2-CD2 3.42Å; I74-F122 VanDerWaalsContact CG2-CD2 3.42Å; I74-F122 HydrophobicContact CG2-CE2 3.25Å; I74-F122 HydrophobicContact CG2-CG 4.16Å; I74-F122 HydrophobicContact CG2-CZ 3.89Å; F122-Q124 PolarHBondContact O-N 3.12Å
123	P	48.6	Very low	41.8	Very low	27 Å²	27	99.7 Å²	99.7	18%	0.175	56%	0.555	C	S	.	*	P	Polyproline II helix	trans	-62.7	124.3	171.2	21.2	-29.5	0	0	0	111.1	S128 E129 I132	P123-S128 WeakPolarHBondContact CA-OG 3.5Å; P123-S128 WeakPolarHBondContact CB-OG 3.31Å; P123-E129 HydrophobicContact CB-CB 4.47Å; P123-E129 HydrophobicContact CG-CB 4.5Å; P123-E129 HydrophobicContact CG-CG 4.06Å; P123-I132 HydrophobicContact CB-CD1 3.92Å; P123-I132 HydrophobicContact CG-CD1 3.98Å
124	Q	47.7	Very low	42.5	Very low	184 Å²	184	99.4 Å²	99.4	86%	0.86	55%	0.548	S	S	*	.			trans	-85.7	-9.6	-174.1	-66.4	-177.2	-7.6	0	0	114	F122	F122-Q124 PolarHBondContact O-N 3.12Å
125	N	46	Very low	42.9	Very low	92 Å²	92	96.8 Å²	96.8	49%	0.492	54%	0.542	S	S	.	.	S	Bend	trans	-147.3	148.4	-172.3	49.3	34.8	0	0	0	111.6	S127 S128 E129	N125-S127 PolarHBondContact O-N 3.03Å; N125-S128 PolarHBondContact N-OG 3.12Å; N125-S128 PolarHBondContact O-N 2.97Å; N125-S128 PolarHBondContact O-OG 3.3Å; N125-S128 WeakPolarHBondContact OD1-CB 3.11Å; N125-S128 PolarHBondContact OD1-N 2.97Å; N125-S128 PolarHBondContact OD1-OG 2.85Å; N125-E129 PolarHBondContact O-N 3.5Å; N125-E129 VanDerWaalsContact O-N 3.07Å
126	L	45.2	Very low	43.5	Very low	118 Å²	118	98 Å²	98	62%	0.618	54%	0.535	S	S	*	.	H	α-helix	trans	-53.1	-33.9	-178.4	-166.7	73.7	0	0	0	111.8	V130	L126-V130 VanDerWaalsContact O-CB 3.27Å; L126-V130 WeakPolarHBondContact O-CB 3.16Å; L126-V130 WeakPolarHBondContact O-CG2 3.46Å; L126-V130 PolarHBondContact O-N 3.42Å
127	S	49.2	Very low	43.6	Very low	88 Å²	88	93.6 Å²	93.6	62%	0.615	53%	0.526	S	S	*	.	H	α-helix	trans	-69.3	-34.3	176.1	-66.7	0	0	0	0	114.5	N125 S131	N125-S127 PolarHBondContact O-N 3.03Å; S127-S131 PolarHBondContact O-N 3.34Å; S127-S131 PolarHBondContact O-OG 3.49Å
128	S	52.4	Low	44.2	Very low	32 Å²	32	91.5 Å²	91.5	22%	0.224	51%	0.514	C	S	.	.	H	α-helix	trans	-74.6	-38.3	174.3	58	0	0	0	0	111.1	P123 N125 S131 I132	P123-S128 WeakPolarHBondContact CA-OG 3.5Å; P123-S128 WeakPolarHBondContact CB-OG 3.31Å; N125-S128 PolarHBondContact N-OG 3.12Å; N125-S128 PolarHBondContact O-N 2.97Å; N125-S128 PolarHBondContact O-OG 3.3Å; N125-S128 WeakPolarHBondContact OD1-CB 3.11Å; N125-S128 PolarHBondContact OD1-N 2.97Å; N125-S128 PolarHBondContact OD1-OG 2.85Å; S128-S131 PolarHBondContact O-N 2.88Å; S128-I132 VanDerWaalsContact O-CG1 3.31Å; S128-I132 WeakPolarHBondContact O-CG1 3.28Å; S128-I132 PolarHBondContact O-N 2.95Å
129	E	45.6	Very low	44.6	Very low	56 Å²	56	87.3 Å²	87.3	26%	0.262	48%	0.484	S	S	.	.	H	α-helix	trans	-57.2	-51.5	169.3	-136.5	-170.6	154.8	0	0	109.5	P123 N125 S131 I132 F133	P123-E129 HydrophobicContact CB-CB 4.47Å; P123-E129 HydrophobicContact CG-CB 4.5Å; P123-E129 HydrophobicContact CG-CG 4.06Å; N125-E129 PolarHBondContact O-N 3.5Å; N125-E129 VanDerWaalsContact O-N 3.07Å; E129-S131 PolarHBondContact O-N 2.94Å; E129-I132 CarbonylContact O-C 3.54Å; E129-I132 PolarHBondContact O-N 3.03Å; E129-I132 VanDerWaalsContact O-N 3.09Å; E129-F133 HydrophobicContact CB-CD2 4.02Å; E129-F133 HydrophobicContact CB-CE2 3.59Å; E129-F133 VanDerWaalsContact CD-CE2 3.44Å; E129-F133 HydrophobicContact CG-CD2 4.07Å; E129-F133 HydrophobicContact CG-CE2 3.25Å; E129-F133 HydrophobicContact CG-CZ 3.76Å; E129-F133 WeakPolarHBondContact O-CB 3.48Å; E129-F133 WeakPolarHBondContact O-CD2 3.31Å; E129-F133 WeakPolarHBondContact O-CG 3.26Å; E129-F133 PolarHBondContact O-N 2.99Å; E129-F133 WeakPolarHBondContact OE1-CE2 3.34Å; E129-F133 VanDerWaalsContact OE1-CZ 3.32Å; E129-F133 WeakPolarHBondContact OE1-CZ 3.31Å
130	V	45.3	Very low	45	Very low	27 Å²	27	84.6 Å²	84.6	16%	0.164	47%	0.471	C	S	.	.	H	α-helix	trans	-56.9	-31.5	176	170.1	0	0	0	0	113.2	L126 F133 R134	L126-V130 VanDerWaalsContact O-CB 3.27Å; L126-V130 WeakPolarHBondContact O-CB 3.16Å; L126-V130 WeakPolarHBondContact O-CG2 3.46Å; L126-V130 PolarHBondContact O-N 3.42Å; V130-F133 HydrophobicContact CG2-CD2 4.41Å; V130-F133 WeakPolarHBondContact O-CB 3.45Å; V130-R134 WeakPolarHBondContact O-CB 3.3Å; V130-R134 VanDerWaalsContact O-CG 3.23Å; V130-R134 WeakPolarHBondContact O-CG 3.12Å; V130-R134 PolarHBondContact O-N 3.31Å
131	S	50.7	Low	45.6	Very low	70 Å²	70	80 Å²	80	49%	0.49	44%	0.44	S	S	.	.	H	α-helix	trans	-76.3	-41	176.5	-61.7	0	0	0	0	112.2	S127 S128 E129 F133 R134 S135	S127-S131 PolarHBondContact O-N 3.34Å; S127-S131 PolarHBondContact O-OG 3.49Å; S128-S131 PolarHBondContact O-N 2.88Å; E129-S131 PolarHBondContact O-N 2.94Å; S131-F133 VanDerWaalsContact C-N 3.29Å; S131-R134 PolarHBondContact O-N 3.03Å; S131-S135 PolarHBondContact O-N 2.93Å
132	I	46.2	Very low	45.9	Very low	79 Å²	79	77.7 Å²	77.7	41%	0.405	42%	0.421	S	S	.	.	H	α-helix	trans	-67.2	-33.3	172.8	-64.7	167.5	0	0	0	110.2	P123 S128 E129 S135 H136	P123-I132 HydrophobicContact CB-CD1 3.92Å; P123-I132 HydrophobicContact CG-CD1 3.98Å; S128-I132 VanDerWaalsContact O-CG1 3.31Å; S128-I132 WeakPolarHBondContact O-CG1 3.28Å; S128-I132 PolarHBondContact O-N 2.95Å; E129-I132 CarbonylContact O-C 3.54Å; E129-I132 PolarHBondContact O-N 3.03Å; E129-I132 VanDerWaalsContact O-N 3.09Å; I132-S135 WeakPolarHBondContact CA-OG 3.13Å; I132-S135 PolarHBondContact O-N 3.12Å; I132-S135 PolarHBondContact O-OG 3.49Å; I132-H136 PolarHBondContact O-CD2 3.13Å; I132-H136 PolarHBondContact O-N 2.79Å
133	F	49.6	Very low	46.4	Very low	35 Å²	35	74.4 Å²	74.4	15%	0.154	41%	0.405	C	S	.	.	H	α-helix	trans	-62.8	-46.2	173.4	-78.2	-55.1	0	0	0	112.7	E129 V130 S131 S135 H136 G137 L138 L140	E129-F133 HydrophobicContact CB-CD2 4.02Å; E129-F133 HydrophobicContact CB-CE2 3.59Å; E129-F133 VanDerWaalsContact CD-CE2 3.44Å; E129-F133 HydrophobicContact CG-CD2 4.07Å; E129-F133 HydrophobicContact CG-CE2 3.25Å; E129-F133 HydrophobicContact CG-CZ 3.76Å; E129-F133 WeakPolarHBondContact O-CB 3.48Å; E129-F133 WeakPolarHBondContact O-CD2 3.31Å; E129-F133 WeakPolarHBondContact O-CG 3.26Å; E129-F133 PolarHBondContact O-N 2.99Å; E129-F133 WeakPolarHBondContact OE1-CE2 3.34Å; E129-F133 VanDerWaalsContact OE1-CZ 3.32Å; E129-F133 WeakPolarHBondContact OE1-CZ 3.31Å; V130-F133 HydrophobicContact CG2-CD2 4.41Å; V130-F133 WeakPolarHBondContact O-CB 3.45Å; S131-F133 VanDerWaalsContact C-N 3.29Å; F133-S135 PolarHBondContact O-N 3.45Å; F133-H136 PolarHBondContact O-N 3.42Å; F133-G137 PolarHBondContact O-N 2.92Å; F133-G137 VanDerWaalsContact O-N 3.14Å; F133-L138 WeakPolarHBondContact CD1-O 3.41Å; F133-L140 HydrophobicContact CD1-CG 4.5Å; F133-L140 HydrophobicContact CE1-CB 3.42Å; F133-L140 VanDerWaalsContact CE1-CB 3.42Å; F133-L140 HydrophobicContact CE1-CD1 3.2Å; F133-L140 HydrophobicContact CE1-CG 3.32Å; F133-L140 HydrophobicContact CZ-CB 3.47Å; F133-L140 VanDerWaalsContact CZ-CB 3.47Å; F133-L140 HydrophobicContact CZ-CD1 3.26Å; F133-L140 HydrophobicContact CZ-CG 3.68Å
134	R	43.9	Very low	46.2	Very low	198 Å²	198	77 Å²	77	75%	0.747	42%	0.422	S	S	*	.	H	α-helix	trans	-65.6	-24.4	178.4	-76.7	172.1	178.5	164.3	1.3	112.7	V130 S131	V130-R134 WeakPolarHBondContact O-CB 3.3Å; V130-R134 VanDerWaalsContact O-CG 3.23Å; V130-R134 WeakPolarHBondContact O-CG 3.12Å; V130-R134 PolarHBondContact O-N 3.31Å; S131-R134 PolarHBondContact O-N 3.03Å
135	S	44.1	Very low	46.4	Very low	79 Å²	79	75.1 Å²	75.1	55%	0.552	41%	0.411	S	S	*	.	H	α-helix	trans	-86.2	-21.1	176.2	57.2	0	0	0	0	114.6	S131 I132 F133	S131-S135 PolarHBondContact O-N 2.93Å; I132-S135 WeakPolarHBondContact CA-OG 3.13Å; I132-S135 PolarHBondContact O-N 3.12Å; I132-S135 PolarHBondContact O-OG 3.49Å; F133-S135 PolarHBondContact O-N 3.45Å
136	H	42	Very low	47	Very low	134 Å²	134	76 Å²	76	62%	0.62	42%	0.424	S	S	*	.	H	α-helix	trans	-117.4	-2.1	-171.9	-61.2	-56.9	0	0	0	115.7	I132 F133 L138	I132-H136 PolarHBondContact O-CD2 3.13Å; I132-H136 PolarHBondContact O-N 2.79Å; F133-H136 PolarHBondContact O-N 3.42Å; H136-L138 PolarHBondContact O-N 3.38Å
137	G	34.3	Very low	48	Very low	60 Å²	60	71.5 Å²	71.5	62%	0.619	40%	0.404	S	S	*	.			trans	74.3	16.8	162.4	0	0	0	0	0	116.8	F133	F133-G137 PolarHBondContact O-N 2.92Å; F133-G137 VanDerWaalsContact O-N 3.14Å
138	L	44.9	Very low	49.3	Very low	77 Å²	77	72.8 Å²	72.8	40%	0.403	40%	0.404	S	S	.	.			trans	-119.7	126.2	-177	-73.3	161.9	0	0	0	111.5	F133 H136 L140 F248	F133-L138 WeakPolarHBondContact CD1-O 3.41Å; H136-L138 PolarHBondContact O-N 3.38Å; L138-L140 PolarHBondContact O-N 2.9Å; L138-F248 HydrophobicContact CD2-CB 3.77Å; L138-F248 HydrophobicContact CD2-CD2 3.51Å; L138-F248 HydrophobicContact CD2-CG 4.01Å; L138-F248 HydrophobicContact CG-CD2 4.48Å
139	P	43	Very low	50.6	Low	26 Å²	26	75.7 Å²	75.7	17%	0.169	41%	0.413	C	S	.	.			trans	-80.8	108	175	30.6	-30.2	0	0	0	110.6	L141 Y160 R245	P139-L141 PolarHBondContact O-N 2.71Å; P139-Y160 HydrophobicContact CB-CE1 4.08Å; P139-Y160 HydrophobicContact CB-CE2 4.43Å; P139-R245 HydrophobicContact CG-CG 4.18Å
140	L	46.5	Very low	52.4	Low	51 Å²	51	79.8 Å²	79.8	27%	0.267	43%	0.434	S	S	.	.			trans	-79.3	107.3	163.6	-74	176.2	0	0	0	109	Q71 F133 L138 V142	Q71-L140 WeakPolarHBondContact O-CD2 3.11Å; F133-L140 HydrophobicContact CD1-CG 4.5Å; F133-L140 HydrophobicContact CE1-CB 3.42Å; F133-L140 VanDerWaalsContact CE1-CB 3.42Å; F133-L140 HydrophobicContact CE1-CD1 3.2Å; F133-L140 HydrophobicContact CE1-CG 3.32Å; F133-L140 HydrophobicContact CZ-CB 3.47Å; F133-L140 VanDerWaalsContact CZ-CB 3.47Å; F133-L140 HydrophobicContact CZ-CD1 3.26Å; F133-L140 HydrophobicContact CZ-CG 3.68Å; L138-L140 PolarHBondContact O-N 2.9Å; L140-V142 HydrophobicContact CD2-CG2 4.48Å
141	L	50.6	Low	54	Low	17 Å²	17	83.4 Å²	83.4	9%	0.089	45%	0.452	C	S	.	.			trans	-106	68.1	170	-67.6	174.8	0	0	0	108.9	T69 P139 Y155 L156	T69-L141 PolarHBondContact OG1-O 2.93Å; P139-L141 PolarHBondContact O-N 2.71Å; L141-Y155 HydrophobicContact CD2-CE1 4.42Å; L141-L156 HydrophobicContact CD1-CD2 3.97Å; L141-L156 HydrophobicContact CD2-CD2 3.48Å; L141-L156 VanDerWaalsContact CD2-CD2 3.48Å; L141-L156 HydrophobicContact CG-CD2 4.4Å
142	V	48.1	Very low	55.2	Low	70 Å²	70	80.5 Å²	80.5	42%	0.424	43%	0.43	S	S	.	.			trans	-108	110.3	171.6	-164.8	0	0	0	0	107.5	L140	L140-V142 HydrophobicContact CD2-CG2 4.48Å
143	W	50.9	Low	56.9	Low	43 Å²	43	78.1 Å²	78.1	16%	0.163	42%	0.418	C	S	.	.			trans	-111.3	136.6	176.7	-61.1	91.4	0	0	0	108	L66 A147 L151 I152 Y155	L66-W143 HydrophobicContact CD2-CB 4.25Å; W143-A147 HydrophobicContact CB-CB 3.96Å; W143-A147 HydrophobicContact CE3-CB 4.39Å; W143-L151 HydrophobicContact CE3-CD2 4.1Å; W143-L151 HydrophobicContact CH2-CD2 4.29Å; W143-L151 HydrophobicContact CZ3-CD2 3.5Å; W143-L151 VanDerWaalsContact CZ3-CD2 3.5Å; W143-I152 HydrophobicContact CB-CD1 3.75Å; W143-I152 HydrophobicContact CB-CG1 4.17Å; W143-I152 HydrophobicContact CD2-CB 4.42Å; W143-I152 HydrophobicContact CD2-CD1 4.27Å; W143-I152 HydrophobicContact CD2-CG1 3.7Å; W143-I152 HydrophobicContact CD2-CG2 4.31Å; W143-I152 HydrophobicContact CE3-CG1 3.96Å; W143-I152 HydrophobicContact CG-CD1 3.79Å; W143-I152 HydrophobicContact CG-CG1 3.78Å; W143-I152 HydrophobicContact CG-CG2 4.29Å; W143-Y155 AromaticContact CH2-CD1 3.75Å; W143-Y155 HydrophobicContact CH2-CD1 3.75Å; W143-Y155 AromaticContact CH2-CD2 3.69Å; W143-Y155 HydrophobicContact CH2-CD2 3.69Å; W143-Y155 HydrophobicContact CH2-CE1 4.33Å; W143-Y155 HydrophobicContact CH2-CE2 4.29Å; W143-Y155 AromaticContact CH2-CG 3.36Å; W143-Y155 HydrophobicContact CH2-CG 3.36Å; W143-Y155 AromaticContact CZ2-CD1 3.34Å; W143-Y155 HydrophobicContact CZ2-CD1 3.34Å; W143-Y155 HydrophobicContact CZ2-CD2 4.16Å; W143-Y155 AromaticContact CZ2-CE1 3.87Å; W143-Y155 HydrophobicContact CZ2-CE1 3.87Å; W143-Y155 AromaticContact CZ2-CG 3.49Å; W143-Y155 HydrophobicContact CZ2-CG 3.49Å; W143-Y155 VanDerWaalsContact CZ2-CG 3.49Å
144	P	43.5	Very low	58.5	Low	82 Å²	82	83 Å²	83	53%	0.532	44%	0.439	S	S	.	.			trans	-57.3	146.9	173.3	21.7	-29	0	0	0	109.6	S146 A147	P144-S146 PolarHBondContact O-N 2.75Å; P144-A147 HydrophobicContact CG-CB 4.01Å; P144-A147 WeakPolarHBondContact O-CB 3.5Å; P144-A147 PolarHBondContact O-N 2.87Å
145	K	51.6	Low	59.9	Low	144 Å²	144	75.7 Å²	75.7	63%	0.626	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-23.9	177.4	-71	-168.8	-179.1	-173.3	0	113.1	V67 A147	V67-K145 HydrophobicContact CG2-CD 4.14Å; V67-K145 HydrophobicContact CG2-CG 4.02Å; K145-A147 VanDerWaalsContact C-N 3.34Å
146	S	59	Low	61.4	Low	109 Å²	109	72 Å²	72	76%	0.762	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-5.1	176.2	54.5	0	0	0	0	114.2	P144 D148	P144-S146 PolarHBondContact O-N 2.75Å; S146-D148 PolarHBondContact O-N 3.38Å
147	A	66.6	Low	63.2	Low	25 Å²	25	69.6 Å²	69.6	21%	0.207	38%	0.377	C	S	.	.	S	Bend	trans	-66.6	128.2	-179.7	0	0	0	0	0	110.3	W143 P144 K145 K149 I152	W143-A147 HydrophobicContact CB-CB 3.96Å; W143-A147 HydrophobicContact CE3-CB 4.39Å; P144-A147 HydrophobicContact CG-CB 4.01Å; P144-A147 WeakPolarHBondContact O-CB 3.5Å; P144-A147 PolarHBondContact O-N 2.87Å; K145-A147 VanDerWaalsContact C-N 3.34Å; A147-K149 PolarHBondContact O-N 3.19Å; A147-I152 HydrophobicContact CB-CD1 3.95Å; A147-I152 HydrophobicContact CB-CG1 4.1Å
148	D	76.6	Confident	65.1	Low	114 Å²	114	72 Å²	72	61%	0.61	38%	0.376	S	S	*	.			trans	-66.9	129.5	-179.8	-156	2.5	0	0	0	109.8	S146 M150 L151 I152	S146-D148 PolarHBondContact O-N 3.38Å; D148-M150 PolarHBondContact O-N 2.94Å; D148-M150 VanDerWaalsContact O-N 3.11Å; D148-L151 HydrophobicContact CB-CB 4.39Å; D148-L151 WeakPolarHBondContact O-CA 3.31Å; D148-L151 WeakPolarHBondContact O-CB 3.5Å; D148-L151 PolarHBondContact O-N 2.91Å; D148-I152 PolarHBondContact O-N 2.98Å
149	K	79.6	Confident	66.2	Low	94 Å²	94	71.6 Å²	71.6	41%	0.409	37%	0.374	S	S	.	.	H	α-helix	trans	-56.3	-34.1	-175.1	173.6	-177.5	151	-166	0	112.3	A147 L151 I152 Q153 F167 D171	A147-K149 PolarHBondContact O-N 3.19Å; K149-L151 VanDerWaalsContact C-N 3.33Å; K149-I152 PolarHBondContact O-N 2.89Å; K149-Q153 WeakPolarHBondContact O-CB 3.37Å; K149-Q153 PolarHBondContact O-N 3.04Å; K149-F167 HydrophobicContact CG-CE1 4.32Å; K149-D171 WeakPolarHBondContact CE-OD1 3.41Å; K149-D171 WeakPolarHBondContact CE-OD2 3.43Å; K149-D171 IonicContact NZ-OD1 2.74Å; K149-D171 PolarHBondContact NZ-OD1 2.97Å; K149-D171 IonicContact NZ-OD2 2.63Å; K149-D171 PolarHBondContact NZ-OD2 3.48Å
150	M	83.7	Confident	67.5	Low	141 Å²	141	73 Å²	73	70%	0.695	38%	0.376	S	S	*	.	H	α-helix	trans	-64	-37.3	176.3	-69.5	-61.9	-66.5	0	0	112.4	D148 K154	D148-M150 PolarHBondContact O-N 2.94Å; D148-M150 VanDerWaalsContact O-N 3.11Å; M150-K154 WeakPolarHBondContact O-CB 3.35Å; M150-K154 PolarHBondContact O-N 3.27Å
151	L	79.5	Confident	69	Low	104 Å²	104	74.9 Å²	74.9	55%	0.545	39%	0.392	S	S	.	.	H	α-helix	trans	-70	-42.4	178.5	-175.1	143.8	0	0	0	110.9	W143 D148 K149 K154 Y155	W143-L151 HydrophobicContact CE3-CD2 4.1Å; W143-L151 HydrophobicContact CH2-CD2 4.29Å; W143-L151 HydrophobicContact CZ3-CD2 3.5Å; W143-L151 VanDerWaalsContact CZ3-CD2 3.5Å; D148-L151 HydrophobicContact CB-CB 4.39Å; D148-L151 WeakPolarHBondContact O-CA 3.31Å; D148-L151 WeakPolarHBondContact O-CB 3.5Å; D148-L151 PolarHBondContact O-N 2.91Å; K149-L151 VanDerWaalsContact C-N 3.33Å; L151-K154 PolarHBondContact O-N 2.82Å; L151-Y155 PolarHBondContact O-N 3.2Å
152	I	75.3	Confident	70.3	Confident	8 Å²	8	76.7 Å²	76.7	4%	0.041	40%	0.402	C	S	.	.	H	α-helix	trans	-60.5	-49.6	174.5	-57.7	178	0	0	0	110.2	L66 W143 A147 D148 K149 K154 Y155 L156 F167	L66-I152 HydrophobicContact CD2-CD1 4.3Å; W143-I152 HydrophobicContact CB-CD1 3.75Å; W143-I152 HydrophobicContact CB-CG1 4.17Å; W143-I152 HydrophobicContact CD2-CB 4.42Å; W143-I152 HydrophobicContact CD2-CD1 4.27Å; W143-I152 HydrophobicContact CD2-CG1 3.7Å; W143-I152 HydrophobicContact CD2-CG2 4.31Å; W143-I152 HydrophobicContact CE3-CG1 3.96Å; W143-I152 HydrophobicContact CG-CD1 3.79Å; W143-I152 HydrophobicContact CG-CG1 3.78Å; W143-I152 HydrophobicContact CG-CG2 4.29Å; A147-I152 HydrophobicContact CB-CD1 3.95Å; A147-I152 HydrophobicContact CB-CG1 4.1Å; D148-I152 PolarHBondContact O-N 2.98Å; K149-I152 PolarHBondContact O-N 2.89Å; I152-K154 VanDerWaalsContact C-N 3.31Å; I152-K154 PolarHBondContact O-N 2.91Å; I152-Y155 PolarHBondContact O-N 3.39Å; I152-L156 HydrophobicContact CG2-CD1 4.05Å; I152-L156 HydrophobicContact CG2-CG 4.35Å; I152-L156 WeakPolarHBondContact O-CB 3.3Å; I152-L156 WeakPolarHBondContact O-CG 3.26Å; I152-L156 PolarHBondContact O-N 3.05Å; I152-F167 HydrophobicContact CB-CE1 4.35Å; I152-F167 HydrophobicContact CB-CZ 4.37Å; I152-F167 HydrophobicContact CG2-CE1 3.96Å; I152-F167 HydrophobicContact CG2-CE2 4.33Å; I152-F167 HydrophobicContact CG2-CZ 3.81Å
153	Q	81.5	Confident	71.7	Confident	30 Å²	30	73.4 Å²	73.4	14%	0.14	38%	0.382	C	S	.	.	H	α-helix	trans	-59.2	-42.6	179.1	-178	68.5	72.4	0	0	111.8	K149 L156 N157 G164 F167	K149-Q153 WeakPolarHBondContact O-CB 3.37Å; K149-Q153 PolarHBondContact O-N 3.04Å; Q153-L156 PolarHBondContact O-N 3.04Å; Q153-N157 PolarHBondContact NE2-OD1 2.8Å; Q153-N157 WeakPolarHBondContact O-CB 3.5Å; Q153-N157 PolarHBondContact O-N 3.34Å; Q153-N157 PolarHBondContact O-ND2 3.15Å; Q153-N157 PolarHBondContact O-OD1 3.48Å; Q153-G164 PolarHBondContact NE2-O 3.04Å; Q153-F167 HydrophobicContact CB-CD1 4.44Å; Q153-F167 HydrophobicContact CB-CE1 4.46Å
154	K	82.3	Confident	73.2	Confident	137 Å²	137	71.3 Å²	71.3	60%	0.596	37%	0.374	S	S	*	.	H	α-helix	trans	-62.1	-49.1	177.4	-173.8	-179.6	178.9	-176.1	0	111.1	M150 L151 I152 L156 N157 D158	M150-K154 WeakPolarHBondContact O-CB 3.35Å; M150-K154 PolarHBondContact O-N 3.27Å; L151-K154 PolarHBondContact O-N 2.82Å; I152-K154 VanDerWaalsContact C-N 3.31Å; I152-K154 PolarHBondContact O-N 2.91Å; K154-L156 VanDerWaalsContact C-N 3.31Å; K154-L156 PolarHBondContact O-N 3.39Å; K154-N157 PolarHBondContact O-N 3.32Å; K154-D158 VanDerWaalsContact O-CG 3.24Å; K154-D158 PolarHBondContact O-N 2.92Å
155	Y	74.5	Confident	75.4	Confident	44 Å²	44	72.4 Å²	72.4	17%	0.173	37%	0.367	C	S	.	.	H	α-helix	trans	-59	-43.5	177.5	179.4	-83.9	0	0	0	112.2	L141 W143 L151 I152 D158 N159 Y160	L141-Y155 HydrophobicContact CD2-CE1 4.42Å; W143-Y155 AromaticContact CH2-CD1 3.75Å; W143-Y155 HydrophobicContact CH2-CD1 3.75Å; W143-Y155 AromaticContact CH2-CD2 3.69Å; W143-Y155 HydrophobicContact CH2-CD2 3.69Å; W143-Y155 HydrophobicContact CH2-CE1 4.33Å; W143-Y155 HydrophobicContact CH2-CE2 4.29Å; W143-Y155 AromaticContact CH2-CG 3.36Å; W143-Y155 HydrophobicContact CH2-CG 3.36Å; W143-Y155 AromaticContact CZ2-CD1 3.34Å; W143-Y155 HydrophobicContact CZ2-CD1 3.34Å; W143-Y155 HydrophobicContact CZ2-CD2 4.16Å; W143-Y155 AromaticContact CZ2-CE1 3.87Å; W143-Y155 HydrophobicContact CZ2-CE1 3.87Å; W143-Y155 AromaticContact CZ2-CG 3.49Å; W143-Y155 HydrophobicContact CZ2-CG 3.49Å; W143-Y155 VanDerWaalsContact CZ2-CG 3.49Å; L151-Y155 PolarHBondContact O-N 3.2Å; I152-Y155 PolarHBondContact O-N 3.39Å; Y155-D158 PolarHBondContact O-N 2.99Å; Y155-N159 WeakPolarHBondContact CD2-ND2 3.46Å; Y155-N159 HydrophobicContact CE1-CB 4.21Å; Y155-N159 WeakPolarHBondContact CE2-ND2 3.47Å; Y155-N159 WeakPolarHBondContact O-CB 3.47Å; Y155-N159 PolarHBondContact O-N 2.91Å; Y155-N159 PolarHBondContact O-ND2 3.11Å; Y155-Y160 HydrophobicContact CE1-CD2 4.19Å; Y155-Y160 AromaticContact CE1-CE2 3.97Å; Y155-Y160 HydrophobicContact CE1-CE2 3.97Å
156	L	75.7	Confident	77.1	Confident	3 Å²	3	66.2 Å²	66.2	2%	0.016	34%	0.34	C	S	.	.	H	α-helix	trans	-62.6	-44.3	177.1	-72.5	178.2	0	0	0	111	L141 I152 Q153 K154 D158 Y160 C163 F167	L141-L156 HydrophobicContact CD1-CD2 3.97Å; L141-L156 HydrophobicContact CD2-CD2 3.48Å; L141-L156 VanDerWaalsContact CD2-CD2 3.48Å; L141-L156 HydrophobicContact CG-CD2 4.4Å; I152-L156 HydrophobicContact CG2-CD1 4.05Å; I152-L156 HydrophobicContact CG2-CG 4.35Å; I152-L156 WeakPolarHBondContact O-CB 3.3Å; I152-L156 WeakPolarHBondContact O-CG 3.26Å; I152-L156 PolarHBondContact O-N 3.05Å; Q153-L156 PolarHBondContact O-N 3.04Å; K154-L156 VanDerWaalsContact C-N 3.31Å; K154-L156 PolarHBondContact O-N 3.39Å; L156-D158 VanDerWaalsContact C-N 3.28Å; L156-D158 PolarHBondContact O-N 2.81Å; L156-Y160 HydrophobicContact CD2-CD2 4.46Å; L156-Y160 CarbonylContact O-C 3.51Å; L156-Y160 VanDerWaalsContact O-CA 3.25Å; L156-Y160 WeakPolarHBondContact O-CA 3.36Å; L156-Y160 PolarHBondContact O-N 3.28Å; L156-C163 HydrophobicContact CD2-CB 3.84Å; L156-F167 HydrophobicContact CD1-CB 3.57Å; L156-F167 HydrophobicContact CD1-CD1 3.81Å; L156-F167 HydrophobicContact CD1-CD2 4.03Å; L156-F167 HydrophobicContact CD1-CG 3.53Å
157	N	79.1	Confident	78.4	Confident	82 Å²	82	63 Å²	63	44%	0.439	31%	0.312	S	S	.	.	H	α-helix	trans	-61	-39	177.2	-67.9	-13.1	0	0	0	112.4	Q153 K154 G164	Q153-N157 PolarHBondContact NE2-OD1 2.8Å; Q153-N157 WeakPolarHBondContact O-CB 3.5Å; Q153-N157 PolarHBondContact O-N 3.34Å; Q153-N157 PolarHBondContact O-ND2 3.15Å; Q153-N157 PolarHBondContact O-OD1 3.48Å; K154-N157 PolarHBondContact O-N 3.32Å; N157-G164 WeakPolarHBondContact OD1-CA 3.39Å
158	D	75.8	Confident	79.5	Confident	112 Å²	112	63.4 Å²	63.4	60%	0.599	31%	0.314	S	S	*	.	H	α-helix	trans	-75.8	-35.9	-176.2	-66.5	-16.7	0	0	0	112.7	K154 Y155 L156	K154-D158 VanDerWaalsContact O-CG 3.24Å; K154-D158 PolarHBondContact O-N 2.92Å; Y155-D158 PolarHBondContact O-N 2.99Å; L156-D158 VanDerWaalsContact C-N 3.28Å; L156-D158 PolarHBondContact O-N 2.81Å
159	N	67.6	Low	80.3	Confident	67 Å²	67	58.4 Å²	58.4	36%	0.358	29%	0.287	S	S	.	.	H	α-helix	trans	-108.8	-31.3	-172.5	-61.6	-83.7	0	0	0	114	Y155	Y155-N159 WeakPolarHBondContact CD2-ND2 3.46Å; Y155-N159 HydrophobicContact CE1-CB 4.21Å; Y155-N159 WeakPolarHBondContact CE2-ND2 3.47Å; Y155-N159 WeakPolarHBondContact O-CB 3.47Å; Y155-N159 PolarHBondContact O-N 2.91Å; Y155-N159 PolarHBondContact O-ND2 3.11Å
160	Y	70.3	Confident	80.8	Confident	55 Å²	55	55 Å²	55	22%	0.216	27%	0.273	C	S	.	.			trans	-143	71.6	-171.8	-56.8	-72.2	0	0	0	110.6	P139 Y155 L156 D162 C163 G164	P139-Y160 HydrophobicContact CB-CE1 4.08Å; P139-Y160 HydrophobicContact CB-CE2 4.43Å; Y155-Y160 HydrophobicContact CE1-CD2 4.19Å; Y155-Y160 AromaticContact CE1-CE2 3.97Å; Y155-Y160 HydrophobicContact CE1-CE2 3.97Å; L156-Y160 HydrophobicContact CD2-CD2 4.46Å; L156-Y160 CarbonylContact O-C 3.51Å; L156-Y160 VanDerWaalsContact O-CA 3.25Å; L156-Y160 WeakPolarHBondContact O-CA 3.36Å; L156-Y160 PolarHBondContact O-N 3.28Å; Y160-D162 PolarHBondContact O-N 3.33Å; Y160-D162 VanDerWaalsContact O-N 3.11Å; Y160-C163 WeakPolarHBondContact O-CA 3.4Å; Y160-C163 WeakPolarHBondContact O-CB 3.5Å; Y160-C163 PolarHBondContact O-N 3.41Å; Y160-G164 PolarHBondContact O-N 3.03Å
161	P	77.5	Confident	81.1	Confident	92 Å²	92	50.8 Å²	50.8	60%	0.597	25%	0.253	S	S	*	.	H	α-helix	trans	-60.3	-28.8	-169.2	22.7	-34.2	0	0	0	113.5	G164 R165	P161-G164 PolarHBondContact O-N 3.29Å; P161-R165 PolarHBondContact O-N 3.47Å
162	D	76.8	Confident	81.7	Confident	55 Å²	55	49.8 Å²	49.8	29%	0.294	25%	0.245	S	C	.	.	H	α-helix	trans	-65.8	-48.6	172.3	53.6	-7	0	0	0	112.4	Y160 G164 R165 W166 R245	Y160-D162 PolarHBondContact O-N 3.33Å; Y160-D162 VanDerWaalsContact O-N 3.11Å; D162-G164 VanDerWaalsContact C-N 3.32Å; D162-G164 PolarHBondContact O-N 3.21Å; D162-R165 PolarHBondContact O-N 3.44Å; D162-W166 PolarHBondContact O-N 3.37Å; D162-W166 VanDerWaalsContact O-N 3.16Å; D162-R245 VanDerWaalsContact CG-NH1 3.27Å; D162-R245 VanDerWaalsContact CG-NH2 3.34Å; D162-R245 IonicContact OD1-CZ 2.78Å; D162-R245 IonicContact OD1-NH1 3.75Å; D162-R245 IonicContact OD1-NH2 2.73Å; D162-R245 PolarHBondContact OD1-NH2 2.88Å; D162-R245 IonicContact OD2-CZ 3.99Å; D162-R245 VanDerWaalsContact OD2-CZ 3.24Å; D162-R245 IonicContact OD2-NH1 2.68Å; D162-R245 PolarHBondContact OD2-NH1 3.34Å; D162-R245 IonicContact OD2-NH2 3.35Å; D162-R245 PolarHBondContact OD2-NH2 2.91Å
163	C	79.3	Confident	82.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.6	-40.5	171.5	-69.9	0	0	0	0	111.9	L156 Y160 R165 W166 F167 F242 R245	L156-C163 HydrophobicContact CD2-CB 3.84Å; Y160-C163 WeakPolarHBondContact O-CA 3.4Å; Y160-C163 WeakPolarHBondContact O-CB 3.5Å; Y160-C163 PolarHBondContact O-N 3.41Å; C163-R165 VanDerWaalsContact C-N 3.31Å; C163-R165 PolarHBondContact O-N 2.91Å; C163-W166 PolarHBondContact O-N 3.47Å; C163-F167 WeakPolarHBondContact O-CB 3.48Å; C163-F167 PolarHBondContact O-N 2.92Å; C163-F242 HydrophobicContact CB-CE1 4.44Å; C163-R245 WeakPolarHBondContact SG-CD 2.86Å; C163-R245 PolarHBondContact SG-NE 3.12Å
164	G	81.9	Confident	82.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.5	-44.5	177.1	0	0	0	0	0	111.9	Q153 N157 Y160 P161 D162 F167 S168	Q153-G164 PolarHBondContact NE2-O 3.04Å; N157-G164 WeakPolarHBondContact OD1-CA 3.39Å; Y160-G164 PolarHBondContact O-N 3.03Å; P161-G164 PolarHBondContact O-N 3.29Å; D162-G164 VanDerWaalsContact C-N 3.32Å; D162-G164 PolarHBondContact O-N 3.21Å; G164-F167 PolarHBondContact O-N 2.85Å; G164-S168 PolarHBondContact O-N 3.43Å; G164-S168 VanDerWaalsContact O-N 3.09Å
165	R	88.8	Confident	83.1	Confident	105 Å²	105	43.7 Å²	43.7	40%	0.396	23%	0.225	S	C	.	.	H	α-helix	trans	-59	-53.7	174.2	179.8	-175.5	174.5	-155.9	-3	111.8	P161 D162 C163 F167 S168 E169 Y265	P161-R165 PolarHBondContact O-N 3.47Å; D162-R165 PolarHBondContact O-N 3.44Å; C163-R165 VanDerWaalsContact C-N 3.31Å; C163-R165 PolarHBondContact O-N 2.91Å; R165-F167 VanDerWaalsContact C-N 3.3Å; R165-F167 PolarHBondContact O-N 2.63Å; R165-S168 PolarHBondContact O-N 3.37Å; R165-E169 PolarHBondContact O-N 3.18Å; R165-E169 VanDerWaalsContact O-N 3.1Å; R165-Y265 VanDerWaalsContact NH2-CD1 3.34Å
166	W	88.5	Confident	83.8	Confident	13 Å²	13	44.7 Å²	44.7	5%	0.049	23%	0.228	C	C	.	.	H	α-helix	trans	-69.1	-29.1	-176.5	-61.5	122.9	0	0	0	113	D162 C163 E169 L170 L238 Y241 F242 L261	D162-W166 PolarHBondContact O-N 3.37Å; D162-W166 VanDerWaalsContact O-N 3.16Å; C163-W166 PolarHBondContact O-N 3.47Å; W166-E169 PolarHBondContact O-N 3.33Å; W166-L170 WeakPolarHBondContact O-CB 3.13Å; W166-L170 PolarHBondContact O-N 3.48Å; W166-L238 HydrophobicContact CB-CD2 4.24Å; W166-L238 HydrophobicContact CD2-CD2 4.46Å; W166-L238 HydrophobicContact CE3-CD2 3.8Å; W166-Y241 HydrophobicContact CB-CD1 4.17Å; W166-Y241 HydrophobicContact CB-CE1 4Å; W166-Y241 AromaticContact CD1-CE1 3.51Å; W166-Y241 AromaticContact CD1-CE2 3.91Å; W166-Y241 AromaticContact CD1-CZ 3.37Å; W166-Y241 HydrophobicContact CG-CD1 4.3Å; W166-Y241 HydrophobicContact CG-CE1 4.01Å; W166-Y241 AromaticContact NE1-CZ 3.96Å; W166-F242 HydrophobicContact CB-CE2 4.43Å; W166-F242 HydrophobicContact CB-CZ 4.02Å; W166-L261 HydrophobicContact CD2-CD1 3.96Å; W166-L261 HydrophobicContact CE3-CD1 4.31Å; W166-L261 HydrophobicContact CE3-CD2 4.16Å; W166-L261 HydrophobicContact CG-CD1 4.39Å; W166-L261 HydrophobicContact CH2-CB 3.66Å; W166-L261 HydrophobicContact CH2-CD1 4.42Å; W166-L261 HydrophobicContact CH2-CG 4.5Å; W166-L261 HydrophobicContact CZ2-CB 3.94Å; W166-L261 HydrophobicContact CZ2-CD1 4.06Å; W166-L261 HydrophobicContact CZ3-CB 3.98Å; W166-L261 HydrophobicContact CZ3-CD2 4.24Å
167	F	86.4	Confident	84.5	Confident	41 Å²	41	44.9 Å²	44.9	18%	0.18	23%	0.229	C	C	.	.	H	α-helix	trans	-70.1	-43.3	177.2	-175.1	-103.4	0	0	0	110.9	K149 I152 Q153 L156 C163 G164 R165 E169 L170 D171 F242	K149-F167 HydrophobicContact CG-CE1 4.32Å; I152-F167 HydrophobicContact CB-CE1 4.35Å; I152-F167 HydrophobicContact CB-CZ 4.37Å; I152-F167 HydrophobicContact CG2-CE1 3.96Å; I152-F167 HydrophobicContact CG2-CE2 4.33Å; I152-F167 HydrophobicContact CG2-CZ 3.81Å; Q153-F167 HydrophobicContact CB-CD1 4.44Å; Q153-F167 HydrophobicContact CB-CE1 4.46Å; L156-F167 HydrophobicContact CD1-CB 3.57Å; L156-F167 HydrophobicContact CD1-CD1 3.81Å; L156-F167 HydrophobicContact CD1-CD2 4.03Å; L156-F167 HydrophobicContact CD1-CG 3.53Å; C163-F167 WeakPolarHBondContact O-CB 3.48Å; C163-F167 PolarHBondContact O-N 2.92Å; G164-F167 PolarHBondContact O-N 2.85Å; R165-F167 VanDerWaalsContact C-N 3.3Å; R165-F167 PolarHBondContact O-N 2.63Å; F167-E169 VanDerWaalsContact C-N 3.29Å; F167-E169 PolarHBondContact O-N 2.95Å; F167-L170 PolarHBondContact O-N 3.12Å; F167-D171 WeakPolarHBondContact O-CB 3.44Å; F167-D171 PolarHBondContact O-N 3.48Å; F167-F242 HydrophobicContact CB-CZ 3.86Å; F167-F242 HydrophobicContact CD2-CZ 4.3Å
168	S	90	Very high	84.9	Confident	34 Å²	34	46.2 Å²	46.2	24%	0.238	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-39.8	172.6	-174	0	0	0	0	111.8	G164 R165 K172	G164-S168 PolarHBondContact O-N 3.43Å; G164-S168 VanDerWaalsContact O-N 3.09Å; R165-S168 PolarHBondContact O-N 3.37Å; S168-K172 VanDerWaalsContact O-CG 3.29Å; S168-K172 WeakPolarHBondContact O-CG 3.36Å; S168-K172 PolarHBondContact O-N 3.17Å; S168-K172 VanDerWaalsContact O-N 3.11Å; S168-K172 WeakPolarHBondContact OG-CE 3.36Å
169	E	92.2	Very high	85.5	Confident	9 Å²	9	47.3 Å²	47.3	4%	0.042	23%	0.234	C	C	.	.	H	α-helix	trans	-71.1	-41	177.6	-73.5	-56.8	133	0	0	112.9	R165 W166 F167 D171 K172 V173 Y265 R268	R165-E169 PolarHBondContact O-N 3.18Å; R165-E169 VanDerWaalsContact O-N 3.1Å; W166-E169 PolarHBondContact O-N 3.33Å; F167-E169 VanDerWaalsContact C-N 3.29Å; F167-E169 PolarHBondContact O-N 2.95Å; E169-D171 VanDerWaalsContact C-N 3.3Å; E169-D171 PolarHBondContact O-N 3.06Å; E169-K172 PolarHBondContact O-N 3.34Å; E169-K172 IonicContact OE1-NZ 3.59Å; E169-K172 PolarHBondContact OE1-NZ 3.28Å; E169-V173 WeakPolarHBondContact O-CB 3.26Å; E169-V173 WeakPolarHBondContact O-CG2 3.26Å; E169-V173 PolarHBondContact O-N 2.82Å; E169-Y265 HydrophobicContact CG-CD2 4.17Å; E169-Y265 HydrophobicContact CG-CE2 3.95Å; E169-R268 IonicContact OE2-CZ 3.29Å; E169-R268 IonicContact OE2-NH1 3.49Å; E169-R268 PolarHBondContact OE2-NH1 2.93Å; E169-R268 IonicContact OE2-NH2 2.75Å
170	L	90.3	Very high	86.4	Confident	22 Å²	22	46.3 Å²	46.3	12%	0.115	23%	0.227	C	C	.	.	H	α-helix	trans	-55.5	-49	173.4	176.9	63.2	0	0	0	110.6	W166 F167 K172 V173 T174 L238 K239 F242	W166-L170 WeakPolarHBondContact O-CB 3.13Å; W166-L170 PolarHBondContact O-N 3.48Å; F167-L170 PolarHBondContact O-N 3.12Å; L170-K172 PolarHBondContact O-N 3.46Å; L170-V173 PolarHBondContact O-N 2.85Å; L170-T174 HydrophobicContact CD1-CG2 3.81Å; L170-T174 HydrophobicContact CG-CG2 4.29Å; L170-T174 WeakPolarHBondContact O-CG2 3.39Å; L170-T174 PolarHBondContact O-N 2.84Å; L170-T174 PolarHBondContact O-OG1 3.24Å; L170-L238 HydrophobicContact CB-CB 4.29Å; L170-L238 HydrophobicContact CB-CD1 4.32Å; L170-L238 HydrophobicContact CD1-CB 3.8Å; L170-L238 HydrophobicContact CD1-CD1 4.39Å; L170-K239 HydrophobicContact CD1-CG 4.22Å; L170-F242 HydrophobicContact CB-CE2 4.3Å; L170-F242 HydrophobicContact CD2-CD2 3.95Å; L170-F242 HydrophobicContact CD2-CE2 3.76Å
171	D	89.5	Confident	87.3	Confident	54 Å²	54	43.8 Å²	43.8	29%	0.289	22%	0.217	S	C	.	.	H	α-helix	trans	-60.6	-44	178.5	174.5	64.2	0	0	0	113.8	K149 F167 E169 V173 T174 G175	K149-D171 WeakPolarHBondContact CE-OD1 3.41Å; K149-D171 WeakPolarHBondContact CE-OD2 3.43Å; K149-D171 IonicContact NZ-OD1 2.74Å; K149-D171 PolarHBondContact NZ-OD1 2.97Å; K149-D171 IonicContact NZ-OD2 2.63Å; K149-D171 PolarHBondContact NZ-OD2 3.48Å; F167-D171 WeakPolarHBondContact O-CB 3.44Å; F167-D171 PolarHBondContact O-N 3.48Å; E169-D171 VanDerWaalsContact C-N 3.3Å; E169-D171 PolarHBondContact O-N 3.06Å; D171-V173 VanDerWaalsContact C-N 3.31Å; D171-V173 PolarHBondContact O-N 3.49Å; D171-T174 WeakPolarHBondContact CA-OG1 3.44Å; D171-T174 PolarHBondContact O-OG1 2.96Å; D171-T174 VanDerWaalsContact O-OG1 3.11Å; D171-G175 PolarHBondContact O-N 3.45Å
172	K	91.7	Very high	87.7	Confident	83 Å²	83	42.9 Å²	42.9	36%	0.361	20%	0.202	S	C	.	.	H	α-helix	trans	-62	-42.9	175.6	-70.4	170.3	-160.4	167.1	0	111.2	S168 E169 L170 W176	S168-K172 VanDerWaalsContact O-CG 3.29Å; S168-K172 WeakPolarHBondContact O-CG 3.36Å; S168-K172 PolarHBondContact O-N 3.17Å; S168-K172 VanDerWaalsContact O-N 3.11Å; S168-K172 WeakPolarHBondContact OG-CE 3.36Å; E169-K172 PolarHBondContact O-N 3.34Å; E169-K172 IonicContact OE1-NZ 3.59Å; E169-K172 PolarHBondContact OE1-NZ 3.28Å; L170-K172 PolarHBondContact O-N 3.46Å; K172-W176 WeakPolarHBondContact O-CB 3.45Å; K172-W176 PolarHBondContact O-N 3Å
173	V	91.5	Very high	88.1	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-67.6	-49.3	-177.8	167.3	0	0	0	0	110.5	E169 L170 D171 W176 L177 Y231 Y234 A235 L238	E169-V173 WeakPolarHBondContact O-CB 3.26Å; E169-V173 WeakPolarHBondContact O-CG2 3.26Å; E169-V173 PolarHBondContact O-N 2.82Å; L170-V173 PolarHBondContact O-N 2.85Å; D171-V173 VanDerWaalsContact C-N 3.31Å; D171-V173 PolarHBondContact O-N 3.49Å; V173-W176 PolarHBondContact O-N 3.02Å; V173-L177 WeakPolarHBondContact O-CB 3.41Å; V173-L177 PolarHBondContact O-N 3.23Å; V173-Y231 HydrophobicContact CG1-CD1 4.17Å; V173-Y234 HydrophobicContact CG1-CD1 4.22Å; V173-Y234 HydrophobicContact CG2-CD1 3.56Å; V173-Y234 HydrophobicContact CG2-CE1 3.46Å; V173-Y234 VanDerWaalsContact CG2-CE1 3.46Å; V173-A235 HydrophobicContact CG1-CB 3.85Å; V173-L238 HydrophobicContact CB-CD1 4.4Å; V173-L238 HydrophobicContact CG2-CD1 4.19Å
174	T	88.7	Confident	88.4	Confident	28 Å²	28	41.8 Å²	41.8	17%	0.172	20%	0.197	C	C	.	.	H	α-helix	trans	-62.8	-44.3	178	53.4	0	0	0	0	111.1	L170 D171 W176 L177 E178	L170-T174 HydrophobicContact CD1-CG2 3.81Å; L170-T174 HydrophobicContact CG-CG2 4.29Å; L170-T174 WeakPolarHBondContact O-CG2 3.39Å; L170-T174 PolarHBondContact O-N 2.84Å; L170-T174 PolarHBondContact O-OG1 3.24Å; D171-T174 WeakPolarHBondContact CA-OG1 3.44Å; D171-T174 PolarHBondContact O-OG1 2.96Å; D171-T174 VanDerWaalsContact O-OG1 3.11Å; T174-W176 PolarHBondContact O-N 3.43Å; T174-L177 PolarHBondContact O-N 3.01Å; T174-E178 WeakPolarHBondContact O-CB 3.4Å; T174-E178 WeakPolarHBondContact O-CG 3.44Å; T174-E178 PolarHBondContact O-N 3.46Å
175	G	89.5	Confident	88.4	Confident	18 Å²	18	42.6 Å²	42.6	19%	0.186	20%	0.202	C	C	.	.	H	α-helix	trans	-58.4	-45.1	176.3	0	0	0	0	0	112.9	D171 Q179	D171-G175 PolarHBondContact O-N 3.45Å; G175-Q179 VanDerWaalsContact O-CB 3.22Å; G175-Q179 WeakPolarHBondContact O-CB 3.38Å; G175-Q179 WeakPolarHBondContact O-CG 3.27Å; G175-Q179 PolarHBondContact O-N 3.18Å
176	W	89.1	Confident	88	Confident	66 Å²	66	45.6 Å²	45.6	25%	0.25	21%	0.214	C	C	.	.	H	α-helix	trans	-65.7	-40.9	175.3	-88.2	63.3	0	0	0	112.8	K172 V173 T174 K180 W181 D275 F279	K172-W176 WeakPolarHBondContact O-CB 3.45Å; K172-W176 PolarHBondContact O-N 3Å; V173-W176 PolarHBondContact O-N 3.02Å; T174-W176 PolarHBondContact O-N 3.43Å; W176-K180 HydrophobicContact CD2-CD 4.46Å; W176-K180 HydrophobicContact CE3-CD 3.96Å; W176-K180 HydrophobicContact CZ3-CD 4.16Å; W176-K180 WeakPolarHBondContact O-CB 3.33Å; W176-K180 PolarHBondContact O-N 3.44Å; W176-W181 PolarHBondContact O-N 3.37Å; W176-D275 HydrophobicContact CZ3-CB 4.4Å; W176-F279 HydrophobicContact CZ3-CD2 4.28Å; W176-F279 HydrophobicContact CZ3-CE2 4.15Å
177	L	89.4	Confident	87.3	Confident	6 Å²	6	46 Å²	46	3%	0.031	22%	0.217	C	C	.	.	I	π-helix	trans	-63.9	-44.9	-179.2	-160.6	163.4	0	0	0	110.1	V173 T174 W181 R182 E232 A235	V173-L177 WeakPolarHBondContact O-CB 3.41Å; V173-L177 PolarHBondContact O-N 3.23Å; T174-L177 PolarHBondContact O-N 3.01Å; L177-W181 PolarHBondContact O-N 3.4Å; L177-R182 HydrophobicContact CD2-CB 4.48Å; L177-R182 VanDerWaalsContact CD2-CD 3.4Å; L177-R182 HydrophobicContact CD2-CG 3.45Å; L177-R182 VanDerWaalsContact CD2-CG 3.45Å; L177-R182 WeakPolarHBondContact O-CB 3.33Å; L177-R182 PolarHBondContact O-N 2.99Å; L177-E232 HydrophobicContact CD1-CG 3.94Å; L177-A235 HydrophobicContact CD1-CB 4.15Å
178	E	87.6	Confident	86.7	Confident	110 Å²	110	45.2 Å²	45.2	51%	0.514	21%	0.214	S	C	.	.	I	π-helix	trans	-73.6	-40.7	178.8	-72.4	173.5	-171.9	0	0	113.9	T174 P183	T174-E178 WeakPolarHBondContact O-CB 3.4Å; T174-E178 WeakPolarHBondContact O-CG 3.44Å; T174-E178 PolarHBondContact O-N 3.46Å; E178-P183 WeakPolarHBondContact O-CD 3.4Å; E178-P183 WeakPolarHBondContact O-CG 3.35Å
179	Q	88.1	Confident	85.6	Confident	136 Å²	136	45.1 Å²	45.1	64%	0.636	22%	0.219	S	C	*	.	I	π-helix	trans	-77.9	-32	-176.6	-70	175.6	1.4	0	0	113.3	G175	G175-Q179 VanDerWaalsContact O-CB 3.22Å; G175-Q179 WeakPolarHBondContact O-CB 3.38Å; G175-Q179 WeakPolarHBondContact O-CG 3.27Å; G175-Q179 PolarHBondContact O-N 3.18Å
180	K	88.1	Confident	84.3	Confident	45 Å²	45	45.6 Å²	45.6	20%	0.196	22%	0.222	C	C	.	.	I	π-helix	trans	-121.9	-56.9	-168.4	-62.1	-174.5	178.6	-180	0	113.6	W176 L184 F279	W176-K180 HydrophobicContact CD2-CD 4.46Å; W176-K180 HydrophobicContact CE3-CD 3.96Å; W176-K180 HydrophobicContact CZ3-CD 4.16Å; W176-K180 WeakPolarHBondContact O-CB 3.33Å; W176-K180 PolarHBondContact O-N 3.44Å; K180-L184 WeakPolarHBondContact O-CD1 3.12Å; K180-L184 VanDerWaalsContact O-CG 3.3Å; K180-L184 WeakPolarHBondContact O-CG 3.4Å; K180-L184 PolarHBondContact O-N 3.13Å; K180-F279 HydrophobicContact CB-CE1 3.65Å; K180-F279 HydrophobicContact CB-CE2 4.33Å; K180-F279 HydrophobicContact CB-CZ 3.5Å; K180-F279 HydrophobicContact CD-CD1 4.07Å; K180-F279 HydrophobicContact CD-CD2 4.01Å; K180-F279 HydrophobicContact CD-CE1 3.8Å; K180-F279 HydrophobicContact CD-CE2 3.75Å; K180-F279 HydrophobicContact CD-CG 4.21Å; K180-F279 HydrophobicContact CD-CZ 3.67Å; K180-F279 HydrophobicContact CG-CE1 4.06Å; K180-F279 HydrophobicContact CG-CZ 4.13Å
181	W	88.5	Confident	82.8	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.008	24%	0.244	C	C	.	.	I	π-helix	trans	-77.9	-44.7	-169.2	-60.1	112.6	0	0	0	113.7	W176 L177 L184 T185 Y223 L224 R227 Y231 D275 Y278 F279	W176-W181 PolarHBondContact O-N 3.37Å; L177-W181 PolarHBondContact O-N 3.4Å; W181-L184 PolarHBondContact O-N 3.3Å; W181-T185 WeakPolarHBondContact O-CB 3.2Å; W181-T185 WeakPolarHBondContact O-CG2 3.32Å; W181-T185 PolarHBondContact O-N 3.42Å; W181-T185 PolarHBondContact O-OG1 3.04Å; W181-Y223 HydrophobicContact CH2-CE1 4.02Å; W181-L224 HydrophobicContact CE3-CD1 3.69Å; W181-L224 HydrophobicContact CE3-CG 4.38Å; W181-L224 HydrophobicContact CZ3-CD1 3.8Å; W181-R227 HydrophobicContact CE3-CB 4.35Å; W181-R227 HydrophobicContact CH2-CB 3.69Å; W181-R227 HydrophobicContact CH2-CG 3.51Å; W181-R227 HydrophobicContact CZ2-CB 4.14Å; W181-R227 HydrophobicContact CZ2-CG 3.56Å; W181-R227 HydrophobicContact CZ3-CB 3.79Å; W181-R227 HydrophobicContact CZ3-CG 4.13Å; W181-Y231 AromaticContact CE2-CE2 3.96Å; W181-Y231 HydrophobicContact CZ2-CD2 4.5Å; W181-Y231 HydrophobicContact CZ2-CE2 4.06Å; W181-Y231 AromaticContact NE1-CD2 3.63Å; W181-Y231 AromaticContact NE1-CE2 3.53Å; W181-Y231 AromaticContact NE1-CZ 3.88Å; W181-D275 HydrophobicContact CZ2-CB 4.34Å; W181-Y278 HydrophobicContact CH2-CD1 4.24Å; W181-Y278 HydrophobicContact CZ3-CD1 4.32Å; W181-Y278 HydrophobicContact CZ3-CE1 4.19Å; W181-F279 HydrophobicContact CD2-CZ 4.06Å; W181-F279 AromaticContact CE2-CE2 3.9Å; W181-F279 AromaticContact CE2-CZ 3.91Å; W181-F279 HydrophobicContact CE3-CZ 4.14Å; W181-F279 AromaticContact CH2-CE2 3.74Å; W181-F279 HydrophobicContact CH2-CE2 3.74Å; W181-F279 AromaticContact CH2-CZ 3.91Å; W181-F279 HydrophobicContact CH2-CZ 3.91Å; W181-F279 AromaticContact CZ2-CE2 3.5Å; W181-F279 HydrophobicContact CZ2-CE2 3.5Å; W181-F279 AromaticContact CZ2-CZ 3.85Å; W181-F279 HydrophobicContact CZ2-CZ 3.85Å; W181-F279 HydrophobicContact CZ3-CE2 4.37Å; W181-F279 HydrophobicContact CZ3-CZ 4.06Å
182	R	86.2	Confident	81.1	Confident	74 Å²	74	50 Å²	50	28%	0.279	25%	0.248	S	C	.	.	H	α-helix	trans	-62.1	-45.3	176.1	-87.9	176.5	-169.4	-32	-9.8	112.8	L177 L184 T185 R186 E232	L177-R182 HydrophobicContact CD2-CB 4.48Å; L177-R182 VanDerWaalsContact CD2-CD 3.4Å; L177-R182 HydrophobicContact CD2-CG 3.45Å; L177-R182 VanDerWaalsContact CD2-CG 3.45Å; L177-R182 WeakPolarHBondContact O-CB 3.33Å; L177-R182 PolarHBondContact O-N 2.99Å; R182-L184 VanDerWaalsContact C-N 3.31Å; R182-L184 PolarHBondContact O-N 3.39Å; R182-T185 WeakPolarHBondContact CA-OG1 3.47Å; R182-T185 PolarHBondContact O-N 3.34Å; R182-T185 PolarHBondContact O-OG1 2.86Å; R182-T185 VanDerWaalsContact O-OG1 3.11Å; R182-R186 VanDerWaalsContact O-CB 3.29Å; R182-R186 WeakPolarHBondContact O-CB 3.29Å; R182-R186 VanDerWaalsContact O-CG 3.27Å; R182-R186 WeakPolarHBondContact O-CG 3.41Å; R182-R186 PolarHBondContact O-N 3.29Å; R182-E232 IonicContact CZ-OE1 3.24Å; R182-E232 IonicContact NH1-OE1 2.94Å; R182-E232 PolarHBondContact NH1-OE1 3.49Å; R182-E232 IonicContact NH2-OE1 3Å
183	P	85.2	Confident	78.9	Confident	31 Å²	31	50.9 Å²	50.9	20%	0.201	26%	0.257	C	S	.	.	H	α-helix	trans	-59.8	-41.9	175.8	-27.6	36.5	0	0	0	112.1	E178 N187	E178-P183 WeakPolarHBondContact O-CD 3.4Å; E178-P183 WeakPolarHBondContact O-CG 3.35Å; P183-N187 VanDerWaalsContact O-CB 3.31Å; P183-N187 WeakPolarHBondContact O-CB 3.42Å; P183-N187 PolarHBondContact O-N 3.04Å; P183-N187 PolarHBondContact O-ND2 3.39Å
184	L	85	Confident	76.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-66.2	-50.2	177.1	-72.2	172.4	0	0	0	111.7	K180 W181 R182 L188 L224 Y278 F279 L286 I287 I290	K180-L184 WeakPolarHBondContact O-CD1 3.12Å; K180-L184 VanDerWaalsContact O-CG 3.3Å; K180-L184 WeakPolarHBondContact O-CG 3.4Å; K180-L184 PolarHBondContact O-N 3.13Å; W181-L184 PolarHBondContact O-N 3.3Å; R182-L184 VanDerWaalsContact C-N 3.31Å; R182-L184 PolarHBondContact O-N 3.39Å; L184-L188 HydrophobicContact CB-CD1 4.31Å; L184-L188 HydrophobicContact CD2-CD1 4.41Å; L184-L188 WeakPolarHBondContact O-CB 3.42Å; L184-L188 VanDerWaalsContact O-CD1 3.3Å; L184-L188 WeakPolarHBondContact O-CD1 3.48Å; L184-L188 WeakPolarHBondContact O-CG 3.47Å; L184-L188 PolarHBondContact O-N 3.05Å; L184-L224 HydrophobicContact CB-CD1 3.62Å; L184-L224 HydrophobicContact CB-CD2 4.02Å; L184-L224 HydrophobicContact CB-CG 4.46Å; L184-L224 HydrophobicContact CD1-CD1 3.58Å; L184-L224 HydrophobicContact CG-CD1 4.21Å; L184-Y278 HydrophobicContact CD1-CE1 4.36Å; L184-F279 HydrophobicContact CD1-CE1 3.8Å; L184-F279 HydrophobicContact CD1-CZ 4.38Å; L184-L286 HydrophobicContact CD2-CB 3.61Å; L184-L286 HydrophobicContact CD2-CD1 4.28Å; L184-I287 HydrophobicContact CD1-CD1 4.46Å; L184-I287 HydrophobicContact CD1-CG1 4.43Å; L184-I287 HydrophobicContact CD2-CG1 3.88Å; L184-I287 HydrophobicContact CG-CD1 4.44Å; L184-I287 HydrophobicContact CG-CG1 4Å; L184-I290 HydrophobicContact CD2-CD1 3.82Å
185	T	82.5	Confident	74.3	Confident	18 Å²	18	66 Å²	66	11%	0.11	33%	0.331	C	S	.	.	H	α-helix	trans	-63.9	-46.1	-177.3	45.9	0	0	0	0	112.9	W181 R182 G189 I190 L224	W181-T185 WeakPolarHBondContact O-CB 3.2Å; W181-T185 WeakPolarHBondContact O-CG2 3.32Å; W181-T185 PolarHBondContact O-N 3.42Å; W181-T185 PolarHBondContact O-OG1 3.04Å; R182-T185 WeakPolarHBondContact CA-OG1 3.47Å; R182-T185 PolarHBondContact O-N 3.34Å; R182-T185 PolarHBondContact O-OG1 2.86Å; R182-T185 VanDerWaalsContact O-OG1 3.11Å; T185-G189 PolarHBondContact O-N 3.06Å; T185-I190 HydrophobicContact CG2-CG2 4.45Å; T185-I190 PolarHBondContact O-N 3.31Å; T185-L224 HydrophobicContact CG2-CD2 3.65Å; T185-L224 HydrophobicContact CG2-CG 4.14Å
186	R	79.9	Confident	71.7	Confident	168 Å²	168	71.4 Å²	71.4	63%	0.634	35%	0.354	S	S	*	.	H	α-helix	trans	-61.5	-50.4	178.2	-70.8	176.8	-177.7	162.8	-1.9	112	R182 L188 G189	R182-R186 VanDerWaalsContact O-CB 3.29Å; R182-R186 WeakPolarHBondContact O-CB 3.29Å; R182-R186 VanDerWaalsContact O-CG 3.27Å; R182-R186 WeakPolarHBondContact O-CG 3.41Å; R182-R186 PolarHBondContact O-N 3.29Å; R186-L188 PolarHBondContact O-N 3.17Å; R186-G189 PolarHBondContact O-N 3.29Å
187	N	74.8	Confident	69	Low	22 Å²	22	72.4 Å²	72.4	12%	0.118	37%	0.371	C	S	.	.	H	α-helix	trans	-80.1	-17.3	-173	-65.6	-65.5	0	0	0	113.9	P183 C210 I211 I290	P183-N187 VanDerWaalsContact O-CB 3.31Å; P183-N187 WeakPolarHBondContact O-CB 3.42Å; P183-N187 PolarHBondContact O-N 3.04Å; P183-N187 PolarHBondContact O-ND2 3.39Å; N187-C210 HydrophobicContact CB-CB 4.39Å; N187-C210 PolarHBondContact O-N 3.47Å; N187-I211 PolarHBondContact O-N 3.45Å; N187-I290 HydrophobicContact CB-CD1 3.87Å; N187-I290 HydrophobicContact CB-CG1 3.99Å; N187-I290 HydrophobicContact CB-CG2 3.87Å; N187-I290 WeakPolarHBondContact ND2-CG2 3.47Å
188	L	73.2	Confident	66.2	Low	24 Å²	24	79.2 Å²	79.2	13%	0.126	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-2.3	172.4	-68.4	168.9	0	0	0	113.1	L184 R186 I190 I211 L214 L224	L184-L188 HydrophobicContact CB-CD1 4.31Å; L184-L188 HydrophobicContact CD2-CD1 4.41Å; L184-L188 WeakPolarHBondContact O-CB 3.42Å; L184-L188 VanDerWaalsContact O-CD1 3.3Å; L184-L188 WeakPolarHBondContact O-CD1 3.48Å; L184-L188 WeakPolarHBondContact O-CG 3.47Å; L184-L188 PolarHBondContact O-N 3.05Å; R186-L188 PolarHBondContact O-N 3.17Å; L188-I190 VanDerWaalsContact C-N 3.26Å; L188-I190 HydrophobicContact CB-CD1 3.72Å; L188-I190 HydrophobicContact CB-CG1 4.01Å; L188-I190 HydrophobicContact CD1-CD1 4.02Å; L188-I190 PolarHBondContact O-N 2.98Å; L188-I211 HydrophobicContact CD2-CB 3.97Å; L188-I211 HydrophobicContact CD2-CD1 4.27Å; L188-I211 HydrophobicContact CD2-CG2 3.74Å; L188-L214 HydrophobicContact CD2-CD1 3.42Å; L188-L214 VanDerWaalsContact CD2-CD1 3.42Å; L188-L224 HydrophobicContact CD1-CD2 3.94Å
189	G	66.9	Low	63.7	Low	32 Å²	32	80.5 Å²	80.5	33%	0.33	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	28.2	-178.4	0	0	0	0	0	113.4	T185 R186 V191	T185-G189 PolarHBondContact O-N 3.06Å; R186-G189 PolarHBondContact O-N 3.29Å; G189-V191 PolarHBondContact O-N 2.83Å; G189-V191 VanDerWaalsContact O-N 3.12Å
190	I	64.7	Low	60.9	Low	19 Å²	19	82.1 Å²	82.1	10%	0.097	43%	0.431	C	S	.	.			trans	-85.4	86.7	179.5	-69.5	165.8	0	0	0	107.4	T185 L188 V221 L224 K225	T185-I190 HydrophobicContact CG2-CG2 4.45Å; T185-I190 PolarHBondContact O-N 3.31Å; L188-I190 VanDerWaalsContact C-N 3.26Å; L188-I190 HydrophobicContact CB-CD1 3.72Å; L188-I190 HydrophobicContact CB-CG1 4.01Å; L188-I190 HydrophobicContact CD1-CD1 4.02Å; L188-I190 PolarHBondContact O-N 2.98Å; I190-V221 HydrophobicContact CD1-CG1 3.81Å; I190-V221 HydrophobicContact CD1-CG2 4.46Å; I190-V221 HydrophobicContact CG1-CG1 4.24Å; I190-L224 HydrophobicContact CD1-CD2 3.34Å; I190-K225 HydrophobicContact CG2-CD 4.09Å; I190-K225 HydrophobicContact CG2-CG 3.35Å
191	V	59.8	Low	58.3	Low	96 Å²	96	86.5 Å²	86.5	58%	0.582	46%	0.457	S	S	*	.			trans	-82.4	131.3	172.7	-171.3	0	0	0	0	108.8	G189 N193	G189-V191 PolarHBondContact O-N 2.83Å; G189-V191 VanDerWaalsContact O-N 3.12Å; V191-N193 WeakPolarHBondContact CB-OD1 3.39Å; V191-N193 WeakPolarHBondContact CG1-OD1 3.5Å; V191-N193 PolarHBondContact O-N 3.06Å
192	N	52.8	Low	55.9	Low	71 Å²	71	98.4 Å²	98.4	38%	0.38	50%	0.502	S	S	.	.			trans	-72.8	82.8	169.2	-69.2	-21.3	0	0	0	107.7	D194 E232	N192-D194 PolarHBondContact O-N 2.87Å; N192-E232 PolarHBondContact ND2-OE2 3.43Å
193	N	45.5	Very low	53.3	Low	102 Å²	102	102.4 Å²	102.4	55%	0.545	53%	0.527	S	S	.	.			trans	-76.9	73	175.3	-71.5	-0.7	0	0	0	110.3	V191	V191-N193 WeakPolarHBondContact CB-OD1 3.39Å; V191-N193 WeakPolarHBondContact CG1-OD1 3.5Å; V191-N193 PolarHBondContact O-N 3.06Å
194	D	43.8	Very low	50.9	Low	161 Å²	161	108.3 Å²	108.3	86%	0.861	55%	0.552	S	S	*	*			trans	-111.7	3	162.8	-75.4	-23	0	0	0	112	N192	N192-D194 PolarHBondContact O-N 2.87Å
195	E	39	Very low	48.8	Very low	185 Å²	185	115.4 Å²	115.4	86%	0.864	59%	0.589	S	S	*	*			trans	-121.5	64.6	172.1	-67.9	-177.2	-176.3	0	0	110.4	S197	E195-S197 PolarHBondContact O-N 3.44Å
196	I	35.1	Very low	47.1	Very low	131 Å²	131	119.7 Å²	119.7	67%	0.672	61%	0.612	S	S	*	*			trans	-84.6	84.3	159.9	-58.9	176.4	0	0	0	106.4	N198	I196-N198 PolarHBondContact O-N 3.29Å
197	S	34	Very low	45.7	Very low	88 Å²	88	120.6 Å²	120.6	62%	0.615	62%	0.62	S	S	*	*			trans	-56.5	121.2	153.9	147.9	0	0	0	0	107.4	E195 N199	E195-S197 PolarHBondContact O-N 3.44Å; S197-N199 VanDerWaalsContact C-N 3.35Å; S197-N199 PolarHBondContact O-N 3.23Å
198	N	30.5	Very low	44.8	Very low	149 Å²	149	124.4 Å²	124.4	80%	0.797	64%	0.64	S	S	*	*	S	Bend	trans	-55.2	97	167.8	-64.3	-49.4	0	0	0	109.1	I196	I196-N198 PolarHBondContact O-N 3.29Å
199	N	35.2	Very low	44.3	Very low	137 Å²	137	125.5 Å²	125.5	73%	0.733	65%	0.646	S	S	*	*			trans	-156.6	115.6	155.1	-86.4	-33.4	0	0	0	106.5	S197 D201	S197-N199 VanDerWaalsContact C-N 3.35Å; S197-N199 PolarHBondContact O-N 3.23Å; N199-D201 PolarHBondContact O-N 2.98Å
200	D	28.8	Very low	44.1	Very low	170 Å²	170	125 Å²	125	91%	0.909	64%	0.637	S	S	*	*			trans	-59.3	96.1	169	-74.1	-44.8	0	0	0	108.9
201	D	33.9	Very low	44.2	Very low	137 Å²	137	124.3 Å²	124.3	73%	0.733	63%	0.634	S	S	*	*			trans	-142.1	129.4	161.6	-92.7	-33.5	0	0	0	108.1	N199 I203	N199-D201 PolarHBondContact O-N 2.98Å; D201-I203 PolarHBondContact O-N 3.27Å
202	W	36.4	Very low	44.4	Very low	252 Å²	252	127.1 Å²	127.1	96%	0.955	63%	0.633	S	S	*	*			trans	-43.3	108.6	-178.3	-64.3	82.9	0	0	0	111.8	E204	W202-E204 PolarHBondContact O-N 3.17Å
203	I	31.8	Very low	44.8	Very low	157 Å²	157	126.3 Å²	126.3	81%	0.805	64%	0.642	S	S	*	*			trans	-66.1	99	170.7	-60	173	0	0	0	106.8	D201 L205	D201-I203 PolarHBondContact O-N 3.27Å; I203-L205 PolarHBondContact O-N 3.3Å
204	E	35.3	Very low	45.9	Very low	156 Å²	156	123.3 Å²	123.3	73%	0.729	63%	0.626	S	S	*	*			trans	-52.5	113.4	162.4	-89.4	-167.2	133.3	0	0	107.2	W202 D206	W202-E204 PolarHBondContact O-N 3.17Å; E204-D206 PolarHBondContact O-N 2.87Å
205	L	40.9	Very low	47.1	Very low	148 Å²	148	117.9 Å²	117.9	78%	0.775	60%	0.599	S	S	*	*			trans	-52.8	109.2	167.3	-90.7	128.1	0	0	0	107.7	I203 K207 I209	I203-L205 PolarHBondContact O-N 3.3Å; L205-K207 PolarHBondContact O-N 3Å; L205-K207 VanDerWaalsContact O-N 3.15Å; L205-I209 HydrophobicContact CD2-CD1 4.48Å
206	D	47.8	Very low	48.6	Very low	109 Å²	109	113.3 Å²	113.3	58%	0.583	59%	0.588	S	S	*	*			trans	-49.6	122.1	-175.6	-156.5	4.3	0	0	0	109.5	E204 N208	E204-D206 PolarHBondContact O-N 2.87Å; D206-N208 PolarHBondContact O-N 2.97Å
207	K	49.8	Very low	50.4	Low	186 Å²	186	109.9 Å²	109.9	81%	0.809	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	2.5	-172	-74.6	170.3	-179.6	155.2	0	113.5	L205	L205-K207 PolarHBondContact O-N 3Å; L205-K207 VanDerWaalsContact O-N 3.15Å
208	N	56.4	Low	52.6	Low	103 Å²	103	105.7 Å²	105.7	55%	0.551	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	4	-171.2	-63.3	-36.8	0	0	0	115	D206 C210	D206-N208 PolarHBondContact O-N 2.97Å; N208-C210 PolarHBondContact O-N 3.46Å
209	I	62.8	Low	55.1	Low	47 Å²	47	102.1 Å²	102.1	24%	0.241	53%	0.53	C	S	.	.			trans	-75.4	99	178.3	-57.4	173	0	0	0	110.2	L205 I211	L205-I209 HydrophobicContact CD2-CD1 4.48Å; I209-I211 WeakPolarHBondContact CG2-O 3.28Å
210	C	61.5	Low	57.4	Low	20 Å²	20	95.8 Å²	95.8	14%	0.135	50%	0.496	C	S	.	.			trans	-79.1	-20.7	-179.2	-60.8	0	0	0	0	114	N187 N208 A293 L294 P299 Y300	N187-C210 HydrophobicContact CB-CB 4.39Å; N187-C210 PolarHBondContact O-N 3.47Å; N208-C210 PolarHBondContact O-N 3.46Å; C210-A293 HydrophobicContact CB-CB 4.2Å; C210-L294 VanDerWaalsContact SG-CD2 3.54Å; C210-P299 CarbonylContact O-C 3.52Å; C210-P299 WeakPolarHBondContact O-CA 3.36Å; C210-Y300 PolarHBondContact O-N 3.01Å
211	I	66.7	Low	60	Low	6 Å²	6	88.2 Å²	88.2	3%	0.031	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.5	-176.8	-68.8	-177.1	0	0	0	110.5	N187 L188 I209 L214 V289 I290 Y300 L302	N187-I211 PolarHBondContact O-N 3.45Å; L188-I211 HydrophobicContact CD2-CB 3.97Å; L188-I211 HydrophobicContact CD2-CD1 4.27Å; L188-I211 HydrophobicContact CD2-CG2 3.74Å; I209-I211 WeakPolarHBondContact CG2-O 3.28Å; I211-L214 HydrophobicContact CG2-CD1 4.05Å; I211-V289 HydrophobicContact CD1-CG1 4.11Å; I211-I290 HydrophobicContact CD1-CD1 4.19Å; I211-I290 HydrophobicContact CD1-CG1 3.39Å; I211-I290 HydrophobicContact CG1-CG1 4.2Å; I211-Y300 WeakPolarHBondContact CA-O 3.23Å; I211-L302 HydrophobicContact CD1-CD1 4.25Å; I211-L302 HydrophobicContact CG2-CB 4.49Å; I211-L302 HydrophobicContact CG2-CD1 3.28Å; I211-L302 HydrophobicContact CG2-CG 3.82Å
212	R	63.7	Low	62.4	Low	154 Å²	154	86.2 Å²	86.2	58%	0.581	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.5	149.8	176.7	-62	-174.7	-177.5	-176.1	-0.8	110.7	Y300 T301 L302	R212-Y300 PolarHBondContact N-O 3.23Å; R212-T301 WeakPolarHBondContact O-CA 3.36Å; R212-L302 PolarHBondContact O-N 3.22Å
213	G	62.8	Low	64.9	Low	54 Å²	54	76.5 Å²	76.5	56%	0.557	41%	0.408	S	S	*	.			trans	103	7.5	170.9	0	0	0	0	0	117	P215	G213-P215 WeakPolarHBondContact O-CD 3.18Å
214	L	68.5	Low	67.5	Low	39 Å²	39	69 Å²	69	20%	0.204	37%	0.37	C	S	.	.			trans	-89.8	121.1	172.9	-84.4	159.8	0	0	0	111	L188 I211 V221 L302 L324	L188-L214 HydrophobicContact CD2-CD1 3.42Å; L188-L214 VanDerWaalsContact CD2-CD1 3.42Å; I211-L214 HydrophobicContact CG2-CD1 4.05Å; L214-V221 HydrophobicContact CB-CG2 4.4Å; L214-L302 HydrophobicContact CD1-CD1 3.56Å; L214-L302 HydrophobicContact CG-CD1 4.06Å; L214-L324 HydrophobicContact CD2-CD2 3.54Å
215	P	68.7	Low	70	Confident	47 Å²	47	65.5 Å²	65.5	31%	0.305	35%	0.352	S	S	.	.			trans	-62.4	136.9	173.8	-24.1	36.6	0	0	0	110.9	G213 S217 C218 P326	G213-P215 WeakPolarHBondContact O-CD 3.18Å; P215-S217 PolarHBondContact O-N 2.95Å; P215-S217 VanDerWaalsContact O-N 3.11Å; P215-C218 WeakPolarHBondContact O-CB 3.35Å; P215-C218 PolarHBondContact O-N 3.48Å; P215-P326 HydrophobicContact CB-CG 3.88Å; P215-P326 HydrophobicContact CG-CG 3.7Å
216	S	70.2	Confident	72.3	Confident	90 Å²	90	64.8 Å²	64.8	63%	0.629	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-20	176.4	57.2	0	0	0	0	113.4	C218	S216-C218 VanDerWaalsContact C-N 3.34Å
217	S	73.2	Confident	74.3	Confident	58 Å²	58	60 Å²	60	41%	0.406	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	1.3	177.6	59.8	0	0	0	0	114.4	P215	P215-S217 PolarHBondContact O-N 2.95Å; P215-S217 VanDerWaalsContact O-N 3.11Å
218	C	80.1	Confident	76.2	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-64.7	138.4	176.7	177.4	0	0	0	0	111	P215 S216 A220 V221 I222 A323 L324	P215-C218 WeakPolarHBondContact O-CB 3.35Å; P215-C218 PolarHBondContact O-N 3.48Å; S216-C218 VanDerWaalsContact C-N 3.34Å; C218-A220 PolarHBondContact O-N 3.43Å; C218-V221 HydrophobicContact CB-CB 4.2Å; C218-V221 HydrophobicContact CB-CG2 3.98Å; C218-V221 PolarHBondContact O-N 2.88Å; C218-V221 VanDerWaalsContact O-N 3.11Å; C218-I222 WeakPolarHBondContact O-CG1 3.17Å; C218-I222 PolarHBondContact O-N 3.31Å; C218-A323 PolarHBondContact SG-O 3.24Å; C218-L324 WeakPolarHBondContact SG-CA 3.48Å; C218-L324 PolarHBondContact SG-O 2.77Å
219	V	82.5	Confident	77.7	Confident	75 Å²	75	48.4 Å²	48.4	46%	0.455	27%	0.265	S	S	.	.	H	α-helix	trans	-57.6	-40.7	-179	177.8	0	0	0	0	111	V221 I222 Y223	V219-V221 PolarHBondContact O-N 3.45Å; V219-I222 PolarHBondContact O-N 3.47Å; V219-Y223 VanDerWaalsContact O-CB 3.32Å; V219-Y223 WeakPolarHBondContact O-CB 3.32Å; V219-Y223 PolarHBondContact O-N 3.11Å
220	A	84.2	Confident	79.1	Confident	4 Å²	4	48.7 Å²	48.7	3%	0.033	27%	0.265	C	S	.	.	H	α-helix	trans	-63.5	-41	178.3	0	0	0	0	0	113	C218 Y223 L224 Y278 I282 A323	C218-A220 PolarHBondContact O-N 3.43Å; A220-Y223 PolarHBondContact O-N 2.82Å; A220-L224 VanDerWaalsContact O-CB 3.31Å; A220-L224 WeakPolarHBondContact O-CB 3.47Å; A220-L224 PolarHBondContact O-N 3.37Å; A220-Y278 HydrophobicContact CB-CE2 3.99Å; A220-I282 HydrophobicContact CB-CD1 3.7Å; A220-I282 HydrophobicContact CB-CG2 4.42Å; A220-A323 WeakPolarHBondContact CB-O 3.47Å; A220-A323 PolarHBondContact N-O 3.23Å
221	V	83.7	Confident	80.5	Confident	10 Å²	10	48 Å²	48	6%	0.061	26%	0.26	C	S	.	.	H	α-helix	trans	-69.4	-42.7	179.6	173.2	0	0	0	0	111.1	I190 L214 C218 V219 L224 K225	I190-V221 HydrophobicContact CD1-CG1 3.81Å; I190-V221 HydrophobicContact CD1-CG2 4.46Å; I190-V221 HydrophobicContact CG1-CG1 4.24Å; L214-V221 HydrophobicContact CB-CG2 4.4Å; C218-V221 HydrophobicContact CB-CB 4.2Å; C218-V221 HydrophobicContact CB-CG2 3.98Å; C218-V221 PolarHBondContact O-N 2.88Å; C218-V221 VanDerWaalsContact O-N 3.11Å; V219-V221 PolarHBondContact O-N 3.45Å; V221-L224 PolarHBondContact O-N 2.74Å; V221-K225 PolarHBondContact O-N 2.95Å
222	I	83.2	Confident	81.7	Confident	95 Å²	95	50.6 Å²	50.6	49%	0.487	27%	0.272	S	S	.	.	H	α-helix	trans	-61.8	-46.1	176.1	-65.4	167.9	0	0	0	110.2	C218 V219 K225 K226	C218-I222 WeakPolarHBondContact O-CG1 3.17Å; C218-I222 PolarHBondContact O-N 3.31Å; V219-I222 PolarHBondContact O-N 3.47Å; I222-K225 PolarHBondContact O-N 2.95Å; I222-K226 WeakPolarHBondContact O-CB 3.22Å; I222-K226 PolarHBondContact O-N 2.93Å
223	Y	88.2	Confident	83	Confident	48 Å²	48	49.7 Å²	49.7	19%	0.188	27%	0.272	C	S	.	.	H	α-helix	trans	-61.1	-46.6	177	-171.9	-95.5	0	0	0	111.1	W181 V219 A220 K225 K226 R227 E274 D275 Y278	W181-Y223 HydrophobicContact CH2-CE1 4.02Å; V219-Y223 VanDerWaalsContact O-CB 3.32Å; V219-Y223 WeakPolarHBondContact O-CB 3.32Å; V219-Y223 PolarHBondContact O-N 3.11Å; A220-Y223 PolarHBondContact O-N 2.82Å; Y223-K225 PolarHBondContact O-N 3.41Å; Y223-K226 PolarHBondContact O-N 3.25Å; Y223-R227 HydrophobicContact CE1-CB 4.42Å; Y223-R227 HydrophobicContact CE1-CG 4.39Å; Y223-R227 VanDerWaalsContact O-CB 3.31Å; Y223-R227 WeakPolarHBondContact O-CB 3.02Å; Y223-R227 PolarHBondContact O-N 3.36Å; Y223-E274 WeakPolarHBondContact OH-CB 3.41Å; Y223-D275 PolarHBondContact OH-N 2.8Å; Y223-D275 PolarHBondContact OH-OD1 3.48Å; Y223-Y278 HydrophobicContact CD1-CD1 4.29Å; Y223-Y278 AromaticContact CD1-CD2 3.44Å; Y223-Y278 HydrophobicContact CD1-CD2 3.44Å; Y223-Y278 VanDerWaalsContact CD1-CD2 3.44Å; Y223-Y278 AromaticContact CD1-CE2 3.86Å; Y223-Y278 HydrophobicContact CD1-CE2 3.86Å; Y223-Y278 AromaticContact CD1-CG 3.68Å; Y223-Y278 HydrophobicContact CD1-CG 3.68Å; Y223-Y278 HydrophobicContact CE1-CD1 4.32Å; Y223-Y278 AromaticContact CE1-CD2 3.95Å; Y223-Y278 HydrophobicContact CE1-CD2 3.95Å; Y223-Y278 AromaticContact CE1-CG 3.73Å; Y223-Y278 HydrophobicContact CE1-CG 3.73Å; Y223-Y278 HydrophobicContact CG-CD2 4.2Å
224	L	88.2	Confident	84.5	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-57.2	-48.9	177.7	-166.4	92.5	0	0	0	111.8	W181 L184 T185 L188 I190 A220 V221 R227 S228 Y278	W181-L224 HydrophobicContact CE3-CD1 3.69Å; W181-L224 HydrophobicContact CE3-CG 4.38Å; W181-L224 HydrophobicContact CZ3-CD1 3.8Å; L184-L224 HydrophobicContact CB-CD1 3.62Å; L184-L224 HydrophobicContact CB-CD2 4.02Å; L184-L224 HydrophobicContact CB-CG 4.46Å; L184-L224 HydrophobicContact CD1-CD1 3.58Å; L184-L224 HydrophobicContact CG-CD1 4.21Å; T185-L224 HydrophobicContact CG2-CD2 3.65Å; T185-L224 HydrophobicContact CG2-CG 4.14Å; L188-L224 HydrophobicContact CD1-CD2 3.94Å; I190-L224 HydrophobicContact CD1-CD2 3.34Å; A220-L224 VanDerWaalsContact O-CB 3.31Å; A220-L224 WeakPolarHBondContact O-CB 3.47Å; A220-L224 PolarHBondContact O-N 3.37Å; V221-L224 PolarHBondContact O-N 2.74Å; L224-R227 PolarHBondContact O-N 3.04Å; L224-S228 WeakPolarHBondContact O-CB 3.18Å; L224-S228 PolarHBondContact O-N 3.29Å; L224-S228 PolarHBondContact O-OG 3.12Å; L224-S228 VanDerWaalsContact O-OG 3.05Å; L224-Y278 HydrophobicContact CD1-CE1 4.21Å
225	K	86.6	Confident	85.5	Confident	82 Å²	82	46 Å²	46	36%	0.357	24%	0.24	S	C	.	.	H	α-helix	trans	-58.7	-48.8	177.8	-80.3	-176.9	170.5	-171.4	0	112.3	I190 V221 I222 Y223 R227 S228 T229	I190-K225 HydrophobicContact CG2-CD 4.09Å; I190-K225 HydrophobicContact CG2-CG 3.35Å; V221-K225 PolarHBondContact O-N 2.95Å; I222-K225 PolarHBondContact O-N 2.95Å; Y223-K225 PolarHBondContact O-N 3.41Å; K225-R227 VanDerWaalsContact C-N 3.27Å; K225-R227 PolarHBondContact O-N 3.29Å; K225-S228 PolarHBondContact O-OG 3.2Å; K225-S228 VanDerWaalsContact O-OG 3.11Å; K225-T229 WeakPolarHBondContact O-CB 3.47Å; K225-T229 VanDerWaalsContact O-CG2 3.28Å; K225-T229 WeakPolarHBondContact O-CG2 3.33Å; K225-T229 PolarHBondContact O-N 3.44Å; K225-T229 PolarHBondContact O-OG1 3.45Å
226	K	88.8	Confident	86.5	Confident	132 Å²	132	47 Å²	47	57%	0.574	25%	0.249	S	C	*	.	H	α-helix	trans	-59.7	-43.1	178.8	-177.5	-177.8	178.1	-174	0	110.7	I222 Y223 T229 Q230	I222-K226 WeakPolarHBondContact O-CB 3.22Å; I222-K226 PolarHBondContact O-N 2.93Å; Y223-K226 PolarHBondContact O-N 3.25Å; K226-T229 PolarHBondContact O-OG1 3.35Å; K226-Q230 VanDerWaalsContact O-CG 3.26Å; K226-Q230 WeakPolarHBondContact O-CG 3.35Å; K226-Q230 PolarHBondContact O-N 3.12Å
227	R	90.3	Very high	87.5	Confident	10 Å²	10	43.7 Å²	43.7	4%	0.038	22%	0.224	C	C	.	.	H	α-helix	trans	-78.2	-41.7	-174.2	-146.2	69.6	-179	138.4	14	112.6	W181 Y223 L224 K225 T229 Q230 Y231 C271 D275	W181-R227 HydrophobicContact CE3-CB 4.35Å; W181-R227 HydrophobicContact CH2-CB 3.69Å; W181-R227 HydrophobicContact CH2-CG 3.51Å; W181-R227 HydrophobicContact CZ2-CB 4.14Å; W181-R227 HydrophobicContact CZ2-CG 3.56Å; W181-R227 HydrophobicContact CZ3-CB 3.79Å; W181-R227 HydrophobicContact CZ3-CG 4.13Å; Y223-R227 HydrophobicContact CE1-CB 4.42Å; Y223-R227 HydrophobicContact CE1-CG 4.39Å; Y223-R227 VanDerWaalsContact O-CB 3.31Å; Y223-R227 WeakPolarHBondContact O-CB 3.02Å; Y223-R227 PolarHBondContact O-N 3.36Å; L224-R227 PolarHBondContact O-N 3.04Å; K225-R227 VanDerWaalsContact C-N 3.27Å; K225-R227 PolarHBondContact O-N 3.29Å; R227-T229 VanDerWaalsContact C-N 3.33Å; R227-T229 PolarHBondContact O-N 3.43Å; R227-Q230 PolarHBondContact O-N 3.48Å; R227-Y231 HydrophobicContact CG-CD2 3.97Å; R227-Y231 HydrophobicContact CG-CE2 3.86Å; R227-Y231 WeakPolarHBondContact O-CD2 3.45Å; R227-Y231 PolarHBondContact O-N 3.23Å; R227-C271 VanDerWaalsContact NH1-CB 3.25Å; R227-C271 PolarHBondContact NH1-SG 3.41Å; R227-D275 WeakPolarHBondContact CD-OD1 3.31Å; R227-D275 WeakPolarHBondContact CG-OD1 3.44Å; R227-D275 IonicContact CZ-OD1 3.22Å; R227-D275 IonicContact CZ-OD2 3.83Å; R227-D275 VanDerWaalsContact CZ-OD2 3.29Å; R227-D275 VanDerWaalsContact NE-CG 3.27Å; R227-D275 IonicContact NE-OD1 2.85Å; R227-D275 PolarHBondContact NE-OD1 3.4Å; R227-D275 IonicContact NE-OD2 3.53Å; R227-D275 PolarHBondContact NE-OD2 3.47Å; R227-D275 IonicContact NH2-OD1 3.65Å; R227-D275 IonicContact NH2-OD2 3.99Å; R227-D275 PolarHBondContact NH2-OD2 3.48Å
228	S	89	Confident	88.3	Confident	4 Å²	4	40.9 Å²	40.9	3%	0.028	21%	0.205	C	C	.	.	H	α-helix	trans	-58.3	-46.8	176.1	61.5	0	0	0	0	111.3	L224 K225 Q230 Y231 E232	L224-S228 WeakPolarHBondContact O-CB 3.18Å; L224-S228 PolarHBondContact O-N 3.29Å; L224-S228 PolarHBondContact O-OG 3.12Å; L224-S228 VanDerWaalsContact O-OG 3.05Å; K225-S228 PolarHBondContact O-OG 3.2Å; K225-S228 VanDerWaalsContact O-OG 3.11Å; S228-Q230 PolarHBondContact O-N 2.96Å; S228-Y231 PolarHBondContact O-N 3.11Å; S228-E232 WeakPolarHBondContact O-CB 3.41Å; S228-E232 WeakPolarHBondContact O-CG 3.4Å; S228-E232 PolarHBondContact O-N 2.75Å
229	T	89.5	Confident	88.5	Confident	40 Å²	40	42.9 Å²	42.9	25%	0.245	21%	0.213	C	C	.	.	H	α-helix	trans	-63.1	-39.7	177.7	53.3	0	0	0	0	112.4	K225 K226 R227 E232 K233	K225-T229 WeakPolarHBondContact O-CB 3.47Å; K225-T229 VanDerWaalsContact O-CG2 3.28Å; K225-T229 WeakPolarHBondContact O-CG2 3.33Å; K225-T229 PolarHBondContact O-N 3.44Å; K225-T229 PolarHBondContact O-OG1 3.45Å; K226-T229 PolarHBondContact O-OG1 3.35Å; R227-T229 VanDerWaalsContact C-N 3.33Å; R227-T229 PolarHBondContact O-N 3.43Å; T229-E232 PolarHBondContact O-N 3.39Å; T229-K233 WeakPolarHBondContact O-CB 3.47Å; T229-K233 VanDerWaalsContact O-CG 3.26Å; T229-K233 WeakPolarHBondContact O-CG 3.11Å; T229-K233 PolarHBondContact O-N 2.84Å
230	Q	91.1	Very high	88.5	Confident	54 Å²	54	41 Å²	41	25%	0.252	21%	0.206	S	C	.	.	H	α-helix	trans	-62.7	-47.2	174.2	-77.8	179.2	-30	0	0	112.5	K226 R227 S228 K233 Y234	K226-Q230 VanDerWaalsContact O-CG 3.26Å; K226-Q230 WeakPolarHBondContact O-CG 3.35Å; K226-Q230 PolarHBondContact O-N 3.12Å; R227-Q230 PolarHBondContact O-N 3.48Å; S228-Q230 PolarHBondContact O-N 2.96Å; Q230-K233 PolarHBondContact O-N 3.37Å; Q230-Y234 WeakPolarHBondContact O-CB 3.5Å; Q230-Y234 PolarHBondContact O-N 3.33Å
231	Y	91.8	Very high	88.5	Confident	5 Å²	5	40.8 Å²	40.8	2%	0.02	20%	0.204	C	C	.	.	H	α-helix	trans	-65.5	-37.6	177.9	-88	-89.1	0	0	0	112.1	V173 W181 R227 S228 A235 D275	V173-Y231 HydrophobicContact CG1-CD1 4.17Å; W181-Y231 AromaticContact CE2-CE2 3.96Å; W181-Y231 HydrophobicContact CZ2-CD2 4.5Å; W181-Y231 HydrophobicContact CZ2-CE2 4.06Å; W181-Y231 AromaticContact NE1-CD2 3.63Å; W181-Y231 AromaticContact NE1-CE2 3.53Å; W181-Y231 AromaticContact NE1-CZ 3.88Å; R227-Y231 HydrophobicContact CG-CD2 3.97Å; R227-Y231 HydrophobicContact CG-CE2 3.86Å; R227-Y231 WeakPolarHBondContact O-CD2 3.45Å; R227-Y231 PolarHBondContact O-N 3.23Å; S228-Y231 PolarHBondContact O-N 3.11Å; Y231-A235 VanDerWaalsContact O-CB 3.28Å; Y231-A235 WeakPolarHBondContact O-CB 3.36Å; Y231-A235 PolarHBondContact O-N 3.31Å; Y231-D275 PolarHBondContact OH-OD2 3.09Å; Y231-D275 VanDerWaalsContact OH-OD2 3.12Å
232	E	90.7	Very high	88.1	Confident	60 Å²	60	41.3 Å²	41.3	28%	0.28	21%	0.205	S	C	.	.	H	α-helix	trans	-66	-45.7	175.6	-76.8	-175.3	149.9	0	0	112.2	L177 R182 N192 S228 T229 Y234 A235 S236	L177-E232 HydrophobicContact CD1-CG 3.94Å; R182-E232 IonicContact CZ-OE1 3.24Å; R182-E232 IonicContact NH1-OE1 2.94Å; R182-E232 PolarHBondContact NH1-OE1 3.49Å; R182-E232 IonicContact NH2-OE1 3Å; N192-E232 PolarHBondContact ND2-OE2 3.43Å; S228-E232 WeakPolarHBondContact O-CB 3.41Å; S228-E232 WeakPolarHBondContact O-CG 3.4Å; S228-E232 PolarHBondContact O-N 2.75Å; T229-E232 PolarHBondContact O-N 3.39Å; E232-Y234 PolarHBondContact O-N 2.83Å; E232-A235 PolarHBondContact O-N 2.95Å; E232-S236 WeakPolarHBondContact O-CB 3.45Å; E232-S236 PolarHBondContact O-N 3.02Å
233	K	91.6	Very high	87.5	Confident	135 Å²	135	39.3 Å²	39.3	59%	0.587	20%	0.197	S	C	*	.	H	α-helix	trans	-58.1	-49	173.8	-74.7	176.1	-178.9	-175.6	0	111.1	T229 Q230 A235 S236 L237	T229-K233 WeakPolarHBondContact O-CB 3.47Å; T229-K233 VanDerWaalsContact O-CG 3.26Å; T229-K233 WeakPolarHBondContact O-CG 3.11Å; T229-K233 PolarHBondContact O-N 2.84Å; Q230-K233 PolarHBondContact O-N 3.37Å; K233-A235 PolarHBondContact O-N 2.89Å; K233-S236 PolarHBondContact O-N 3.03Å; K233-S236 PolarHBondContact O-OG 3.31Å; K233-L237 WeakPolarHBondContact O-CB 3.42Å; K233-L237 PolarHBondContact O-N 3Å
234	Y	93.7	Very high	86.6	Confident	6 Å²	6	37.9 Å²	37.9	2%	0.024	19%	0.193	C	C	.	.	H	α-helix	trans	-64.1	-40.8	179.6	-175.9	-135.4	0	0	0	112.7	V173 Q230 E232 S236 L237 L238 L261 H264	V173-Y234 HydrophobicContact CG1-CD1 4.22Å; V173-Y234 HydrophobicContact CG2-CD1 3.56Å; V173-Y234 HydrophobicContact CG2-CE1 3.46Å; V173-Y234 VanDerWaalsContact CG2-CE1 3.46Å; Q230-Y234 WeakPolarHBondContact O-CB 3.5Å; Q230-Y234 PolarHBondContact O-N 3.33Å; E232-Y234 PolarHBondContact O-N 2.83Å; Y234-S236 VanDerWaalsContact C-N 3.35Å; Y234-S236 PolarHBondContact O-N 2.98Å; Y234-L237 PolarHBondContact O-N 2.97Å; Y234-L238 HydrophobicContact CD1-CD1 4.04Å; Y234-L238 HydrophobicContact CD2-CD1 4.26Å; Y234-L238 HydrophobicContact CD2-CG 4.34Å; Y234-L238 HydrophobicContact CE1-CD1 3.75Å; Y234-L238 HydrophobicContact CE2-CD1 3.99Å; Y234-L238 HydrophobicContact CE2-CD2 4.39Å; Y234-L238 HydrophobicContact CE2-CG 4.02Å; Y234-L238 HydrophobicContact CG-CD1 4.29Å; Y234-L238 WeakPolarHBondContact O-CG 3.31Å; Y234-L238 PolarHBondContact O-N 3.4Å; Y234-L261 HydrophobicContact CE2-CD2 4.22Å; Y234-H264 HydrophobicContact CD2-CB 3.35Å; Y234-H264 HydrophobicContact CE2-CB 3.7Å; Y234-H264 HydrophobicContact CG-CB 4.08Å
235	A	91.2	Very high	85.5	Confident	9 Å²	9	39.6 Å²	39.6	7%	0.074	20%	0.199	C	C	.	.	H	α-helix	trans	-61.5	-42.7	174.3	0	0	0	0	0	111.8	V173 L177 Y231 E232 K233 L237 L238 K239	V173-A235 HydrophobicContact CG1-CB 3.85Å; L177-A235 HydrophobicContact CD1-CB 4.15Å; Y231-A235 VanDerWaalsContact O-CB 3.28Å; Y231-A235 WeakPolarHBondContact O-CB 3.36Å; Y231-A235 PolarHBondContact O-N 3.31Å; E232-A235 PolarHBondContact O-N 2.95Å; K233-A235 PolarHBondContact O-N 2.89Å; A235-L237 VanDerWaalsContact C-N 3.29Å; A235-L237 PolarHBondContact O-N 2.89Å; A235-L238 PolarHBondContact O-N 2.78Å; A235-K239 VanDerWaalsContact O-CG 3.31Å; A235-K239 WeakPolarHBondContact O-CG 3.26Å; A235-K239 PolarHBondContact O-N 2.65Å
236	S	89.8	Confident	84.2	Confident	69 Å²	69	38.4 Å²	38.4	48%	0.483	20%	0.196	S	C	.	.	H	α-helix	trans	-62.3	-37.8	176.5	75.1	0	0	0	0	112.1	E232 K233 Y234 K239 A240	E232-S236 WeakPolarHBondContact O-CB 3.45Å; E232-S236 PolarHBondContact O-N 3.02Å; K233-S236 PolarHBondContact O-N 3.03Å; K233-S236 PolarHBondContact O-OG 3.31Å; Y234-S236 VanDerWaalsContact C-N 3.35Å; Y234-S236 PolarHBondContact O-N 2.98Å; S236-K239 WeakPolarHBondContact O-CB 3.49Å; S236-K239 PolarHBondContact O-N 3.43Å; S236-A240 WeakPolarHBondContact O-CB 3.46Å; S236-A240 PolarHBondContact O-N 3.16Å
237	L	90.7	Very high	82.5	Confident	20 Å²	20	38.5 Å²	38.5	11%	0.105	20%	0.199	C	C	.	.	H	α-helix	trans	-71.7	-39.5	179.8	-159.5	151.6	0	0	0	112	K233 Y234 A235 A240 Y241 I257 E260 L261	K233-L237 WeakPolarHBondContact O-CB 3.42Å; K233-L237 PolarHBondContact O-N 3Å; Y234-L237 PolarHBondContact O-N 2.97Å; A235-L237 VanDerWaalsContact C-N 3.29Å; A235-L237 PolarHBondContact O-N 2.89Å; L237-A240 WeakPolarHBondContact O-CB 3.31Å; L237-A240 PolarHBondContact O-N 2.92Å; L237-Y241 PolarHBondContact O-N 3.33Å; L237-I257 HydrophobicContact CD2-CG2 4.22Å; L237-E260 HydrophobicContact CD1-CB 3.78Å; L237-E260 HydrophobicContact CD2-CB 4.39Å; L237-L261 HydrophobicContact CD2-CB 4.11Å; L237-L261 HydrophobicContact CD2-CD1 4.49Å; L237-L261 HydrophobicContact CD2-CD2 3.27Å; L237-L261 HydrophobicContact CD2-CG 3.29Å
238	L	88.9	Confident	80.6	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.5	-43	171.1	-75	162.6	0	0	0	111.7	W166 L170 V173 Y234 A235 Y241 F242 L261	W166-L238 HydrophobicContact CB-CD2 4.24Å; W166-L238 HydrophobicContact CD2-CD2 4.46Å; W166-L238 HydrophobicContact CE3-CD2 3.8Å; L170-L238 HydrophobicContact CB-CB 4.29Å; L170-L238 HydrophobicContact CB-CD1 4.32Å; L170-L238 HydrophobicContact CD1-CB 3.8Å; L170-L238 HydrophobicContact CD1-CD1 4.39Å; V173-L238 HydrophobicContact CB-CD1 4.4Å; V173-L238 HydrophobicContact CG2-CD1 4.19Å; Y234-L238 HydrophobicContact CD1-CD1 4.04Å; Y234-L238 HydrophobicContact CD2-CD1 4.26Å; Y234-L238 HydrophobicContact CD2-CG 4.34Å; Y234-L238 HydrophobicContact CE1-CD1 3.75Å; Y234-L238 HydrophobicContact CE2-CD1 3.99Å; Y234-L238 HydrophobicContact CE2-CD2 4.39Å; Y234-L238 HydrophobicContact CE2-CG 4.02Å; Y234-L238 HydrophobicContact CG-CD1 4.29Å; Y234-L238 WeakPolarHBondContact O-CG 3.31Å; Y234-L238 PolarHBondContact O-N 3.4Å; A235-L238 PolarHBondContact O-N 2.78Å; L238-Y241 WeakPolarHBondContact O-CB 3.2Å; L238-Y241 PolarHBondContact O-N 2.97Å; L238-F242 WeakPolarHBondContact O-CD2 3.45Å; L238-F242 PolarHBondContact O-N 3.49Å; L238-L261 HydrophobicContact CD2-CD2 3.49Å; L238-L261 VanDerWaalsContact CD2-CD2 3.49Å; L238-L261 HydrophobicContact CG-CD2 3.87Å
239	K	84.1	Confident	78.7	Confident	41 Å²	41	44.9 Å²	44.9	18%	0.178	23%	0.23	C	C	.	.	H	α-helix	trans	-61.4	-45.1	172.8	-69.3	178.5	169.8	-161.8	0	111	P60 L65 L170 A235 S236 Y241 F242 T243	P60-K239 PolarHBondContact O-NZ 3.01Å; L65-K239 HydrophobicContact CD1-CB 4.1Å; L65-K239 HydrophobicContact CD1-CD 3.67Å; L65-K239 HydrophobicContact CD1-CG 3.54Å; L170-K239 HydrophobicContact CD1-CG 4.22Å; A235-K239 VanDerWaalsContact O-CG 3.31Å; A235-K239 WeakPolarHBondContact O-CG 3.26Å; A235-K239 PolarHBondContact O-N 2.65Å; S236-K239 WeakPolarHBondContact O-CB 3.49Å; S236-K239 PolarHBondContact O-N 3.43Å; K239-Y241 VanDerWaalsContact C-N 3.32Å; K239-Y241 PolarHBondContact O-N 3.43Å; K239-F242 PolarHBondContact O-N 3.46Å; K239-F242 VanDerWaalsContact O-N 3.13Å; K239-T243 WeakPolarHBondContact O-CG2 3.27Å; K239-T243 PolarHBondContact O-N 2.99Å
240	A	83	Confident	76.8	Confident	36 Å²	36	46.2 Å²	46.2	30%	0.298	24%	0.24	S	C	.	.	H	α-helix	trans	-59.4	-41.1	178.2	0	0	0	0	0	112	S236 L237 F242 T243 H244	S236-A240 WeakPolarHBondContact O-CB 3.46Å; S236-A240 PolarHBondContact O-N 3.16Å; L237-A240 WeakPolarHBondContact O-CB 3.31Å; L237-A240 PolarHBondContact O-N 2.92Å; A240-F242 PolarHBondContact O-N 3.48Å; A240-T243 VanDerWaalsContact C-OG1 3.31Å; A240-T243 VanDerWaalsContact CA-OG1 3.25Å; A240-T243 WeakPolarHBondContact CA-OG1 3.42Å; A240-T243 PolarHBondContact O-N 3.21Å; A240-T243 PolarHBondContact O-OG1 3.44Å; A240-H244 VanDerWaalsContact O-CB 3.31Å; A240-H244 WeakPolarHBondContact O-CB 3.43Å; A240-H244 PolarHBondContact O-N 3.35Å
241	Y	83.5	Confident	75.3	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-56.4	-46.7	173.6	168.2	-93.6	0	0	0	112.6	W166 L237 L238 K239 H244 R245 F252 I257 H258 L261	W166-Y241 HydrophobicContact CB-CD1 4.17Å; W166-Y241 HydrophobicContact CB-CE1 4Å; W166-Y241 AromaticContact CD1-CE1 3.51Å; W166-Y241 AromaticContact CD1-CE2 3.91Å; W166-Y241 AromaticContact CD1-CZ 3.37Å; W166-Y241 HydrophobicContact CG-CD1 4.3Å; W166-Y241 HydrophobicContact CG-CE1 4.01Å; W166-Y241 AromaticContact NE1-CZ 3.96Å; L237-Y241 PolarHBondContact O-N 3.33Å; L238-Y241 WeakPolarHBondContact O-CB 3.2Å; L238-Y241 PolarHBondContact O-N 2.97Å; K239-Y241 VanDerWaalsContact C-N 3.32Å; K239-Y241 PolarHBondContact O-N 3.43Å; Y241-H244 PolarHBondContact O-N 2.9Å; Y241-R245 WeakPolarHBondContact O-CB 3.37Å; Y241-R245 PolarHBondContact O-N 3.38Å; Y241-R245 PolarHBondContact OH-NH1 2.92Å; Y241-F252 HydrophobicContact CD2-CZ 4.1Å; Y241-F252 HydrophobicContact CE2-CE1 4.24Å; Y241-F252 AromaticContact CE2-CZ 3.54Å; Y241-F252 HydrophobicContact CE2-CZ 3.54Å; Y241-I257 HydrophobicContact CD2-CG2 4.14Å; Y241-H258 AromaticContact CE2-CE1 3.61Å; Y241-H258 AromaticContact CE2-ND1 3.91Å; Y241-L261 HydrophobicContact CD2-CD1 3.43Å; Y241-L261 VanDerWaalsContact CD2-CD1 3.43Å; Y241-L261 HydrophobicContact CE2-CD1 4.13Å; Y241-L261 HydrophobicContact CG-CD1 3.66Å
242	F	76.3	Confident	74	Confident	21 Å²	21	47.3 Å²	47.3	9%	0.092	26%	0.255	C	S	.	.	H	α-helix	trans	-64.6	-42.7	176.2	-71.6	-67.2	0	0	0	111.1	C163 W166 F167 L170 L238 K239 A240 H244 R245 L246	C163-F242 HydrophobicContact CB-CE1 4.44Å; W166-F242 HydrophobicContact CB-CE2 4.43Å; W166-F242 HydrophobicContact CB-CZ 4.02Å; F167-F242 HydrophobicContact CB-CZ 3.86Å; F167-F242 HydrophobicContact CD2-CZ 4.3Å; L170-F242 HydrophobicContact CB-CE2 4.3Å; L170-F242 HydrophobicContact CD2-CD2 3.95Å; L170-F242 HydrophobicContact CD2-CE2 3.76Å; L238-F242 WeakPolarHBondContact O-CD2 3.45Å; L238-F242 PolarHBondContact O-N 3.49Å; K239-F242 PolarHBondContact O-N 3.46Å; K239-F242 VanDerWaalsContact O-N 3.13Å; A240-F242 PolarHBondContact O-N 3.48Å; F242-H244 VanDerWaalsContact C-N 3.31Å; F242-H244 PolarHBondContact O-N 2.9Å; F242-R245 PolarHBondContact O-N 3.02Å; F242-R245 VanDerWaalsContact O-N 3.16Å; F242-L246 VanDerWaalsContact O-CD1 3.31Å; F242-L246 WeakPolarHBondContact O-CD1 3.36Å; F242-L246 WeakPolarHBondContact O-CG 3.43Å; F242-L246 PolarHBondContact O-N 3.36Å; F242-L246 VanDerWaalsContact O-N 3.08Å
243	T	70.1	Confident	73	Confident	52 Å²	52	51.7 Å²	51.7	32%	0.319	28%	0.275	S	S	.	.	H	α-helix	trans	-60.1	-39.8	174.9	62	0	0	0	0	113	L65 K239 A240 R245 L246 Q247	L65-T243 HydrophobicContact CD2-CG2 4.19Å; K239-T243 WeakPolarHBondContact O-CG2 3.27Å; K239-T243 PolarHBondContact O-N 2.99Å; A240-T243 VanDerWaalsContact C-OG1 3.31Å; A240-T243 VanDerWaalsContact CA-OG1 3.25Å; A240-T243 WeakPolarHBondContact CA-OG1 3.42Å; A240-T243 PolarHBondContact O-N 3.21Å; A240-T243 PolarHBondContact O-OG1 3.44Å; T243-R245 VanDerWaalsContact C-N 3.32Å; T243-R245 PolarHBondContact O-N 3.44Å; T243-L246 WeakPolarHBondContact O-CB 3.44Å; T243-L246 PolarHBondContact O-N 2.84Å; T243-Q247 WeakPolarHBondContact O-CG 3.15Å; T243-Q247 PolarHBondContact O-N 3.34Å
244	H	69.2	Low	71.9	Confident	19 Å²	19	52.9 Å²	52.9	9%	0.088	28%	0.282	C	S	.	.	H	α-helix	trans	-73.8	-24.4	179	-174.2	-101.9	0	0	0	112.5	A240 Y241 F242 L246 T249 F252 N255 I257	A240-H244 VanDerWaalsContact O-CB 3.31Å; A240-H244 WeakPolarHBondContact O-CB 3.43Å; A240-H244 PolarHBondContact O-N 3.35Å; Y241-H244 PolarHBondContact O-N 2.9Å; F242-H244 VanDerWaalsContact C-N 3.31Å; F242-H244 PolarHBondContact O-N 2.9Å; H244-L246 VanDerWaalsContact C-N 3.35Å; H244-T249 PolarHBondContact CD2-OG1 2.88Å; H244-T249 WeakPolarHBondContact NE2-CB 3.44Å; H244-T249 VanDerWaalsContact NE2-CG2 3.26Å; H244-T249 WeakPolarHBondContact NE2-CG2 3.25Å; H244-T249 PolarHBondContact NE2-OG1 2.73Å; H244-T249 VanDerWaalsContact NE2-OG1 3.09Å; H244-F252 HydrophobicContact CB-CE2 4.35Å; H244-F252 AromaticContact CE1-CD2 3.35Å; H244-F252 WeakPolarHBondContact CE1-CD2 3.38Å; H244-F252 AromaticContact CE1-CE2 3.95Å; H244-F252 AromaticContact ND1-CD2 3Å; H244-F252 WeakPolarHBondContact ND1-CD2 3.29Å; H244-F252 AromaticContact ND1-CE2 3.14Å; H244-F252 WeakPolarHBondContact ND1-CE2 3.46Å; H244-F252 WeakPolarHBondContact O-CD2 3.14Å; H244-N255 PolarHBondContact CD2-ND2 3.04Å; H244-N255 PolarHBondContact CE1-ND2 3.33Å; H244-N255 PolarHBondContact NE2-ND2 3.01Å; H244-I257 HydrophobicContact CB-CD1 4.01Å
245	R	66	Low	71.1	Confident	37 Å²	37	54.3 Å²	54.3	14%	0.14	29%	0.29	C	S	.	.	H	α-helix	trans	-76.9	-26.7	171.9	-169.8	133.6	-178.9	165.1	-8.8	112.4	P139 D162 C163 Y241 F242 T243 F252	P139-R245 HydrophobicContact CG-CG 4.18Å; D162-R245 VanDerWaalsContact CG-NH1 3.27Å; D162-R245 VanDerWaalsContact CG-NH2 3.34Å; D162-R245 IonicContact OD1-CZ 2.78Å; D162-R245 IonicContact OD1-NH1 3.75Å; D162-R245 IonicContact OD1-NH2 2.73Å; D162-R245 PolarHBondContact OD1-NH2 2.88Å; D162-R245 IonicContact OD2-CZ 3.99Å; D162-R245 VanDerWaalsContact OD2-CZ 3.24Å; D162-R245 IonicContact OD2-NH1 2.68Å; D162-R245 PolarHBondContact OD2-NH1 3.34Å; D162-R245 IonicContact OD2-NH2 3.35Å; D162-R245 PolarHBondContact OD2-NH2 2.91Å; C163-R245 WeakPolarHBondContact SG-CD 2.86Å; C163-R245 PolarHBondContact SG-NE 3.12Å; Y241-R245 WeakPolarHBondContact O-CB 3.37Å; Y241-R245 PolarHBondContact O-N 3.38Å; Y241-R245 PolarHBondContact OH-NH1 2.92Å; F242-R245 PolarHBondContact O-N 3.02Å; F242-R245 VanDerWaalsContact O-N 3.16Å; T243-R245 VanDerWaalsContact C-N 3.32Å; T243-R245 PolarHBondContact O-N 3.44Å; R245-F252 HydrophobicContact CB-CE2 3.81Å; R245-F252 HydrophobicContact CB-CZ 3.98Å; R245-F252 HydrophobicContact CG-CE2 4.35Å; R245-F252 HydrophobicContact CG-CZ 4.2Å
246	L	58.3	Low	70.9	Confident	57 Å²	57	57.8 Å²	57.8	30%	0.298	31%	0.312	S	S	.	.	H	α-helix	trans	-81.5	-43	178	-67.9	162.4	0	0	0	112.3	T69 F242 T243 H244 F248	T69-L246 VanDerWaalsContact CB-CD1 3.48Å; T69-L246 HydrophobicContact CG2-CD1 3.41Å; T69-L246 VanDerWaalsContact CG2-CD1 3.41Å; T69-L246 WeakPolarHBondContact O-CD2 3.26Å; F242-L246 VanDerWaalsContact O-CD1 3.31Å; F242-L246 WeakPolarHBondContact O-CD1 3.36Å; F242-L246 WeakPolarHBondContact O-CG 3.43Å; F242-L246 PolarHBondContact O-N 3.36Å; F242-L246 VanDerWaalsContact O-N 3.08Å; T243-L246 WeakPolarHBondContact O-CB 3.44Å; T243-L246 PolarHBondContact O-N 2.84Å; H244-L246 VanDerWaalsContact C-N 3.35Å; L246-F248 PolarHBondContact O-N 2.98Å
247	Q	54.7	Low	70.7	Confident	134 Å²	134	55.7 Å²	55.7	63%	0.626	30%	0.295	S	S	*	.	S	Bend	trans	-74.3	111.2	170.2	-66.4	177.5	-10.1	0	0	107	T243 T249	T243-Q247 WeakPolarHBondContact O-CG 3.15Å; T243-Q247 PolarHBondContact O-N 3.34Å; Q247-T249 PolarHBondContact O-N 3.04Å; Q247-T249 PolarHBondContact O-OG1 2.68Å
248	F	49.2	Very low	70.4	Confident	101 Å²	101	57 Å²	57	44%	0.443	30%	0.3	S	S	.	.			trans	-58	103.3	176.4	-177.7	-87.9	0	0	0	109.2	Q39 L138 L246 P250	Q39-F248 HydrophobicContact CG-CD1 4.46Å; Q39-F248 HydrophobicContact CG-CE1 4.2Å; L138-F248 HydrophobicContact CD2-CB 3.77Å; L138-F248 HydrophobicContact CD2-CD2 3.51Å; L138-F248 HydrophobicContact CD2-CG 4.01Å; L138-F248 HydrophobicContact CG-CD2 4.48Å; L246-F248 PolarHBondContact O-N 2.98Å; F248-P250 HydrophobicContact CE1-CG 4.25Å
249	T	49.9	Very low	70.4	Confident	46 Å²	46	65.2 Å²	65.2	28%	0.282	33%	0.332	S	S	.	.			trans	-107.9	116.8	179.9	-41.1	0	0	0	0	108	H244 Q247 A251 F252	H244-T249 PolarHBondContact CD2-OG1 2.88Å; H244-T249 WeakPolarHBondContact NE2-CB 3.44Å; H244-T249 VanDerWaalsContact NE2-CG2 3.26Å; H244-T249 WeakPolarHBondContact NE2-CG2 3.25Å; H244-T249 PolarHBondContact NE2-OG1 2.73Å; H244-T249 VanDerWaalsContact NE2-OG1 3.09Å; Q247-T249 PolarHBondContact O-N 3.04Å; Q247-T249 PolarHBondContact O-OG1 2.68Å; T249-A251 PolarHBondContact O-N 3.03Å; T249-F252 PolarHBondContact O-N 3.33Å
250	P	48.2	Very low	70.8	Confident	68 Å²	68	67 Å²	67	44%	0.442	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	135.3	176.1	-24.9	32.5	0	0	0	110.2	F248 F252	F248-P250 HydrophobicContact CE1-CG 4.25Å; P250-F252 VanDerWaalsContact C-N 3.32Å; P250-F252 PolarHBondContact O-N 3.04Å
251	A	60.3	Low	71.2	Confident	59 Å²	59	65.3 Å²	65.3	49%	0.488	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	59	36.8	-175.3	0	0	0	0	0	114.3	T249 H253 H254	T249-A251 PolarHBondContact O-N 3.03Å; A251-H253 PolarHBondContact O-N 3.06Å; A251-H254 HydrophobicContact CB-CB 4.22Å; A251-H254 WeakPolarHBondContact O-CA 3.35Å; A251-H254 WeakPolarHBondContact O-CB 3.27Å; A251-H254 PolarHBondContact O-N 2.95Å
252	F	65	Low	71.6	Confident	23 Å²	23	69.2 Å²	69.2	10%	0.101	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-39.6	-48	172.2	174.4	-93.9	0	0	0	113.3	Y241 H244 R245 T249 P250 H254 N255 H258	Y241-F252 HydrophobicContact CD2-CZ 4.1Å; Y241-F252 HydrophobicContact CE2-CE1 4.24Å; Y241-F252 AromaticContact CE2-CZ 3.54Å; Y241-F252 HydrophobicContact CE2-CZ 3.54Å; H244-F252 HydrophobicContact CB-CE2 4.35Å; H244-F252 AromaticContact CE1-CD2 3.35Å; H244-F252 WeakPolarHBondContact CE1-CD2 3.38Å; H244-F252 AromaticContact CE1-CE2 3.95Å; H244-F252 AromaticContact ND1-CD2 3Å; H244-F252 WeakPolarHBondContact ND1-CD2 3.29Å; H244-F252 AromaticContact ND1-CE2 3.14Å; H244-F252 WeakPolarHBondContact ND1-CE2 3.46Å; H244-F252 WeakPolarHBondContact O-CD2 3.14Å; R245-F252 HydrophobicContact CB-CE2 3.81Å; R245-F252 HydrophobicContact CB-CZ 3.98Å; R245-F252 HydrophobicContact CG-CE2 4.35Å; R245-F252 HydrophobicContact CG-CZ 4.2Å; T249-F252 PolarHBondContact O-N 3.33Å; P250-F252 VanDerWaalsContact C-N 3.32Å; P250-F252 PolarHBondContact O-N 3.04Å; F252-H254 PolarHBondContact O-N 2.82Å; F252-N255 VanDerWaalsContact O-CB 3.27Å; F252-N255 WeakPolarHBondContact O-CB 3.25Å; F252-N255 PolarHBondContact O-N 3.43Å; F252-H258 AromaticContact CD1-NE2 3.58Å; F252-H258 AromaticContact CE1-CE1 3.33Å; F252-H258 WeakPolarHBondContact CE1-CE1 3Å; F252-H258 AromaticContact CE1-NE2 3.28Å; F252-H258 VanDerWaalsContact CE1-NE2 3.28Å; F252-H258 WeakPolarHBondContact CE1-NE2 3.31Å; F252-H258 AromaticContact CZ-CE1 3.68Å; F252-H258 AromaticContact CZ-NE2 3.68Å; F252-H258 PolarHBondContact O-CD2 3Å; F252-H258 VanDerWaalsContact O-CD2 3.29Å; F252-H258 PolarHBondContact O-NE2 3.26Å; F252-H258 VanDerWaalsContact O-NE2 3.1Å
253	H	69.3	Low	72.4	Confident	152 Å²	152	72.2 Å²	72.2	70%	0.704	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-57.1	-21.1	178.3	-58.7	95.5	0	0	0	115	A251	A251-H253 PolarHBondContact O-N 3.06Å
254	H	68.5	Low	73.6	Confident	160 Å²	160	72.2 Å²	72.2	74%	0.741	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-101.9	3.1	179.2	-58.7	82	0	0	0	112.7	A251 F252	A251-H254 HydrophobicContact CB-CB 4.22Å; A251-H254 WeakPolarHBondContact O-CA 3.35Å; A251-H254 WeakPolarHBondContact O-CB 3.27Å; A251-H254 PolarHBondContact O-N 2.95Å; F252-H254 PolarHBondContact O-N 2.82Å
255	N	77.6	Confident	74.8	Confident	36 Å²	36	73.7 Å²	73.7	19%	0.193	36%	0.361	C	S	.	.			trans	-68.2	133.3	177.5	-173.4	-47.9	0	0	0	110.1	H244 F252 I257 H258	H244-N255 PolarHBondContact CD2-ND2 3.04Å; H244-N255 PolarHBondContact CE1-ND2 3.33Å; H244-N255 PolarHBondContact NE2-ND2 3.01Å; F252-N255 VanDerWaalsContact O-CB 3.27Å; F252-N255 WeakPolarHBondContact O-CB 3.25Å; F252-N255 PolarHBondContact O-N 3.43Å; N255-I257 PolarHBondContact O-N 3.06Å; N255-I257 VanDerWaalsContact OD1-CB 3.31Å; N255-I257 WeakPolarHBondContact OD1-CB 3.45Å; N255-I257 WeakPolarHBondContact OD1-CD1 3.44Å; N255-I257 WeakPolarHBondContact OD1-CG1 3.48Å; N255-I257 PolarHBondContact OD1-N 2.88Å; N255-H258 PolarHBondContact O-CD2 3.16Å; N255-H258 PolarHBondContact O-N 3.45Å
256	P	85.7	Confident	76.1	Confident	82 Å²	82	77.9 Å²	77.9	53%	0.532	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-23.5	177.1	23.2	-36.1	0	0	0	114.6	H258 R259 E260	P256-H258 PolarHBondContact O-N 3.31Å; P256-R259 WeakPolarHBondContact O-CA 3.3Å; P256-R259 WeakPolarHBondContact O-CB 3.46Å; P256-R259 PolarHBondContact O-N 2.76Å; P256-E260 PolarHBondContact O-N 2.83Å
257	I	85.5	Confident	77.7	Confident	25 Å²	25	79.7 Å²	79.7	13%	0.128	39%	0.387	C	S	.	.	H	α-helix	trans	-48.7	-37.8	175.2	-70.8	166.3	0	0	0	111.3	L237 Y241 H244 N255 R259 E260 L261	L237-I257 HydrophobicContact CD2-CG2 4.22Å; Y241-I257 HydrophobicContact CD2-CG2 4.14Å; H244-I257 HydrophobicContact CB-CD1 4.01Å; N255-I257 PolarHBondContact O-N 3.06Å; N255-I257 VanDerWaalsContact OD1-CB 3.31Å; N255-I257 WeakPolarHBondContact OD1-CB 3.45Å; N255-I257 WeakPolarHBondContact OD1-CD1 3.44Å; N255-I257 WeakPolarHBondContact OD1-CG1 3.48Å; N255-I257 PolarHBondContact OD1-N 2.88Å; I257-R259 PolarHBondContact O-N 3.42Å; I257-E260 PolarHBondContact O-N 3.47Å; I257-L261 HydrophobicContact CG2-CD1 4.06Å; I257-L261 HydrophobicContact CG2-CG 4.2Å; I257-L261 VanDerWaalsContact O-CB 3.26Å; I257-L261 WeakPolarHBondContact O-CB 3.1Å; I257-L261 VanDerWaalsContact O-CG 3.27Å; I257-L261 WeakPolarHBondContact O-CG 3.45Å; I257-L261 PolarHBondContact O-N 2.96Å
258	H	85	Confident	79.5	Confident	47 Å²	47	74.3 Å²	74.3	22%	0.218	36%	0.361	C	S	.	.	H	α-helix	trans	-62.9	-41	178	-70	-73.5	0	0	0	112.8	Y241 F252 N255 P256 E262	Y241-H258 AromaticContact CE2-CE1 3.61Å; Y241-H258 AromaticContact CE2-ND1 3.91Å; F252-H258 AromaticContact CD1-NE2 3.58Å; F252-H258 AromaticContact CE1-CE1 3.33Å; F252-H258 WeakPolarHBondContact CE1-CE1 3Å; F252-H258 AromaticContact CE1-NE2 3.28Å; F252-H258 VanDerWaalsContact CE1-NE2 3.28Å; F252-H258 WeakPolarHBondContact CE1-NE2 3.31Å; F252-H258 AromaticContact CZ-CE1 3.68Å; F252-H258 AromaticContact CZ-NE2 3.68Å; F252-H258 PolarHBondContact O-CD2 3Å; F252-H258 VanDerWaalsContact O-CD2 3.29Å; F252-H258 PolarHBondContact O-NE2 3.26Å; F252-H258 VanDerWaalsContact O-NE2 3.1Å; N255-H258 PolarHBondContact O-CD2 3.16Å; N255-H258 PolarHBondContact O-N 3.45Å; P256-H258 PolarHBondContact O-N 3.31Å; H258-E262 PolarHBondContact O-N 3.07Å
259	R	89.3	Confident	81.6	Confident	173 Å²	173	73.3 Å²	73.3	65%	0.653	36%	0.36	S	S	*	.	H	α-helix	trans	-70	-45.7	178	-162	-173.4	98.1	-170.2	0.1	110.6	P256 I257 L261 E262 E263	P256-R259 WeakPolarHBondContact O-CA 3.3Å; P256-R259 WeakPolarHBondContact O-CB 3.46Å; P256-R259 PolarHBondContact O-N 2.76Å; I257-R259 PolarHBondContact O-N 3.42Å; R259-L261 PolarHBondContact O-N 3.17Å; R259-E262 PolarHBondContact O-N 2.82Å; R259-E262 VanDerWaalsContact O-N 3.16Å; R259-E263 IonicContact CZ-OE1 3.7Å; R259-E263 IonicContact NE-OE1 3.62Å; R259-E263 PolarHBondContact NE-OE1 3.36Å; R259-E263 IonicContact NH2-OE1 3Å; R259-E263 PolarHBondContact NH2-OE1 3.29Å; R259-E263 WeakPolarHBondContact O-CG 3.42Å; R259-E263 PolarHBondContact O-N 3.23Å
260	E	92.1	Very high	83.6	Confident	79 Å²	79	73.6 Å²	73.6	37%	0.369	37%	0.372	S	S	.	.	H	α-helix	trans	-63	-41	179.1	-64.4	174.7	-176.3	0	0	111.9	L237 P256 I257 E262 E263 H264	L237-E260 HydrophobicContact CD1-CB 3.78Å; L237-E260 HydrophobicContact CD2-CB 4.39Å; P256-E260 PolarHBondContact O-N 2.83Å; I257-E260 PolarHBondContact O-N 3.47Å; E260-E262 VanDerWaalsContact C-N 3.31Å; E260-E262 PolarHBondContact O-N 3.24Å; E260-E263 PolarHBondContact O-N 2.86Å; E260-H264 PolarHBondContact O-CD2 3.48Å; E260-H264 PolarHBondContact O-N 3Å
261	L	92	Very high	85.6	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-57.3	-45.2	172.5	-85.7	176	0	0	0	111.8	W166 Y234 L237 L238 Y241 I257 R259 Y265	W166-L261 HydrophobicContact CD2-CD1 3.96Å; W166-L261 HydrophobicContact CE3-CD1 4.31Å; W166-L261 HydrophobicContact CE3-CD2 4.16Å; W166-L261 HydrophobicContact CG-CD1 4.39Å; W166-L261 HydrophobicContact CH2-CB 3.66Å; W166-L261 HydrophobicContact CH2-CD1 4.42Å; W166-L261 HydrophobicContact CH2-CG 4.5Å; W166-L261 HydrophobicContact CZ2-CB 3.94Å; W166-L261 HydrophobicContact CZ2-CD1 4.06Å; W166-L261 HydrophobicContact CZ3-CB 3.98Å; W166-L261 HydrophobicContact CZ3-CD2 4.24Å; Y234-L261 HydrophobicContact CE2-CD2 4.22Å; L237-L261 HydrophobicContact CD2-CB 4.11Å; L237-L261 HydrophobicContact CD2-CD1 4.49Å; L237-L261 HydrophobicContact CD2-CD2 3.27Å; L237-L261 HydrophobicContact CD2-CG 3.29Å; L238-L261 HydrophobicContact CD2-CD2 3.49Å; L238-L261 VanDerWaalsContact CD2-CD2 3.49Å; L238-L261 HydrophobicContact CG-CD2 3.87Å; Y241-L261 HydrophobicContact CD2-CD1 3.43Å; Y241-L261 VanDerWaalsContact CD2-CD1 3.43Å; Y241-L261 HydrophobicContact CE2-CD1 4.13Å; Y241-L261 HydrophobicContact CG-CD1 3.66Å; I257-L261 HydrophobicContact CG2-CD1 4.06Å; I257-L261 HydrophobicContact CG2-CG 4.2Å; I257-L261 VanDerWaalsContact O-CB 3.26Å; I257-L261 WeakPolarHBondContact O-CB 3.1Å; I257-L261 VanDerWaalsContact O-CG 3.27Å; I257-L261 WeakPolarHBondContact O-CG 3.45Å; I257-L261 PolarHBondContact O-N 2.96Å; R259-L261 PolarHBondContact O-N 3.17Å; L261-Y265 WeakPolarHBondContact O-CB 3.44Å; L261-Y265 PolarHBondContact O-N 3.36Å
262	E	92	Very high	87	Confident	83 Å²	83	71.5 Å²	71.5	39%	0.388	35%	0.35	S	S	.	.	H	α-helix	trans	-70	-38.9	-178.6	-163.1	-176.2	153.9	0	0	112.1	H258 R259 E260 Y265 K266	H258-E262 PolarHBondContact O-N 3.07Å; R259-E262 PolarHBondContact O-N 2.82Å; R259-E262 VanDerWaalsContact O-N 3.16Å; E260-E262 VanDerWaalsContact C-N 3.31Å; E260-E262 PolarHBondContact O-N 3.24Å; E262-Y265 PolarHBondContact O-N 3.42Å; E262-K266 WeakPolarHBondContact O-CG 3.5Å; E262-K266 PolarHBondContact O-N 3.26Å; E262-K266 VanDerWaalsContact OE1-CE 3.23Å; E262-K266 WeakPolarHBondContact OE1-CE 3.08Å; E262-K266 IonicContact OE1-NZ 2.77Å; E262-K266 PolarHBondContact OE1-NZ 2.98Å
263	E	93.6	Very high	88.1	Confident	84 Å²	84	74.6 Å²	74.6	39%	0.393	38%	0.375	S	S	.	.	H	α-helix	trans	-60	-54.2	174.1	-74.2	172.5	-168	0	0	110.8	R259 E260 Y265 K266 E267	R259-E263 IonicContact CZ-OE1 3.7Å; R259-E263 IonicContact NE-OE1 3.62Å; R259-E263 PolarHBondContact NE-OE1 3.36Å; R259-E263 IonicContact NH2-OE1 3Å; R259-E263 PolarHBondContact NH2-OE1 3.29Å; R259-E263 WeakPolarHBondContact O-CG 3.42Å; R259-E263 PolarHBondContact O-N 3.23Å; E260-E263 PolarHBondContact O-N 2.86Å; E263-Y265 VanDerWaalsContact C-N 3.3Å; E263-Y265 PolarHBondContact O-N 2.83Å; E263-K266 WeakPolarHBondContact O-CB 3.36Å; E263-K266 PolarHBondContact O-N 3.21Å; E263-K266 VanDerWaalsContact O-N 3.12Å; E263-E267 WeakPolarHBondContact O-CG 3.5Å; E263-E267 PolarHBondContact O-N 3.11Å
264	H	93.8	Very high	89.1	Confident	51 Å²	51	72.6 Å²	72.6	24%	0.236	37%	0.366	C	S	.	.	H	α-helix	trans	-64.9	-32.3	178.1	-78.7	-60.5	0	0	0	113.5	Y234 E260 E267 R268	Y234-H264 HydrophobicContact CD2-CB 3.35Å; Y234-H264 HydrophobicContact CE2-CB 3.7Å; Y234-H264 HydrophobicContact CG-CB 4.08Å; E260-H264 PolarHBondContact O-CD2 3.48Å; E260-H264 PolarHBondContact O-N 3Å; H264-E267 IonicContact CE1-OE2 2.92Å; H264-E267 IonicContact CG-OE2 3.69Å; H264-E267 IonicContact ND1-OE2 2.85Å; H264-E267 PolarHBondContact ND1-OE2 2.83Å; H264-E267 PolarHBondContact O-N 3.17Å; H264-R268 WeakPolarHBondContact O-CB 3.04Å; H264-R268 PolarHBondContact O-N 3.44Å
265	Y	94	Very high	90.2	Very high	51 Å²	51	65 Å²	65	20%	0.2	33%	0.33	C	S	.	.	H	α-helix	trans	-62.2	-44.1	172.6	176.7	-106.5	0	0	0	111.6	R165 E169 L261 E262 E263 R268 L269	R165-Y265 VanDerWaalsContact NH2-CD1 3.34Å; E169-Y265 HydrophobicContact CG-CD2 4.17Å; E169-Y265 HydrophobicContact CG-CE2 3.95Å; L261-Y265 WeakPolarHBondContact O-CB 3.44Å; L261-Y265 PolarHBondContact O-N 3.36Å; E262-Y265 PolarHBondContact O-N 3.42Å; E263-Y265 VanDerWaalsContact C-N 3.3Å; E263-Y265 PolarHBondContact O-N 2.83Å; Y265-R268 PolarHBondContact O-N 3Å; Y265-L269 HydrophobicContact CD1-CD1 4.01Å; Y265-L269 HydrophobicContact CE1-CD1 3.44Å; Y265-L269 VanDerWaalsContact CE1-CD1 3.44Å; Y265-L269 HydrophobicContact CE1-CG 4.29Å; Y265-L269 HydrophobicContact CE2-CD1 4.33Å; Y265-L269 HydrophobicContact CE2-CG 4.37Å; Y265-L269 WeakPolarHBondContact O-CG 3.28Å; Y265-L269 PolarHBondContact O-N 3.29Å
266	K	93.8	Very high	90.7	Very high	124 Å²	124	65.2 Å²	65.2	54%	0.539	34%	0.337	S	S	.	.	H	α-helix	trans	-64.7	-43.8	175.8	-73.2	170.2	-176.3	162.7	0	111.7	E262 E263 R268 L269 G270	E262-K266 WeakPolarHBondContact O-CG 3.5Å; E262-K266 PolarHBondContact O-N 3.26Å; E262-K266 VanDerWaalsContact OE1-CE 3.23Å; E262-K266 WeakPolarHBondContact OE1-CE 3.08Å; E262-K266 IonicContact OE1-NZ 2.77Å; E262-K266 PolarHBondContact OE1-NZ 2.98Å; E263-K266 WeakPolarHBondContact O-CB 3.36Å; E263-K266 PolarHBondContact O-N 3.21Å; E263-K266 VanDerWaalsContact O-N 3.12Å; K266-R268 VanDerWaalsContact C-N 3.35Å; K266-R268 PolarHBondContact O-N 3.48Å; K266-L269 PolarHBondContact O-N 3.46Å; K266-G270 PolarHBondContact O-N 3.45Å
267	E	92.5	Very high	90.8	Very high	95 Å²	95	62.8 Å²	62.8	44%	0.444	33%	0.327	S	S	.	.	H	α-helix	trans	-58.8	-45.6	174.8	-70.9	-178.4	161.2	0	0	111.9	E263 H264 L269 G270 C271	E263-E267 WeakPolarHBondContact O-CG 3.5Å; E263-E267 PolarHBondContact O-N 3.11Å; H264-E267 IonicContact CE1-OE2 2.92Å; H264-E267 IonicContact CG-OE2 3.69Å; H264-E267 IonicContact ND1-OE2 2.85Å; H264-E267 PolarHBondContact ND1-OE2 2.83Å; H264-E267 PolarHBondContact O-N 3.17Å; E267-L269 PolarHBondContact O-N 3.41Å; E267-G270 PolarHBondContact O-N 3.11Å; E267-C271 PolarHBondContact O-N 3.45Å
268	R	92.7	Very high	91.1	Very high	22 Å²	22	62.6 Å²	62.6	8%	0.083	33%	0.325	C	S	.	.	H	α-helix	trans	-58	-50.3	176.5	177.3	176.4	166.5	-94	6.8	110.5	E169 H264 Y265 K266 G270 C271 L272	E169-R268 IonicContact OE2-CZ 3.29Å; E169-R268 IonicContact OE2-NH1 3.49Å; E169-R268 PolarHBondContact OE2-NH1 2.93Å; E169-R268 IonicContact OE2-NH2 2.75Å; H264-R268 WeakPolarHBondContact O-CB 3.04Å; H264-R268 PolarHBondContact O-N 3.44Å; Y265-R268 PolarHBondContact O-N 3Å; K266-R268 VanDerWaalsContact C-N 3.35Å; K266-R268 PolarHBondContact O-N 3.48Å; R268-G270 VanDerWaalsContact C-N 3.33Å; R268-G270 PolarHBondContact O-N 2.91Å; R268-C271 PolarHBondContact O-N 2.88Å; R268-L272 WeakPolarHBondContact O-CG 3.46Å; R268-L272 PolarHBondContact O-N 2.79Å; R268-L272 VanDerWaalsContact O-N 3.11Å
269	L	92.1	Very high	91.3	Very high	80 Å²	80	60.5 Å²	60.5	42%	0.419	32%	0.315	S	S	.	.	H	α-helix	trans	-57.9	-42.7	180	-75.3	176.6	0	0	0	112.7	Y265 K266 E267 C271 L272	Y265-L269 HydrophobicContact CD1-CD1 4.01Å; Y265-L269 HydrophobicContact CE1-CD1 3.44Å; Y265-L269 VanDerWaalsContact CE1-CD1 3.44Å; Y265-L269 HydrophobicContact CE1-CG 4.29Å; Y265-L269 HydrophobicContact CE2-CD1 4.33Å; Y265-L269 HydrophobicContact CE2-CG 4.37Å; Y265-L269 WeakPolarHBondContact O-CG 3.28Å; Y265-L269 PolarHBondContact O-N 3.29Å; K266-L269 PolarHBondContact O-N 3.46Å; E267-L269 PolarHBondContact O-N 3.41Å; L269-C271 VanDerWaalsContact C-N 3.33Å; L269-C271 PolarHBondContact O-N 3Å; L269-L272 HydrophobicContact CD2-CD1 3.97Å
270	G	92	Very high	91.2	Very high	52 Å²	52	56.9 Å²	56.9	54%	0.536	31%	0.309	S	S	.	.	H	α-helix	trans	-62.1	-39.8	178.9	0	0	0	0	0	113.1	K266 E267 R268 S273	K266-G270 PolarHBondContact O-N 3.45Å; E267-G270 PolarHBondContact O-N 3.11Å; R268-G270 VanDerWaalsContact C-N 3.33Å; R268-G270 PolarHBondContact O-N 2.91Å; G270-S273 PolarHBondContact O-OG 3.22Å
271	C	91.2	Very high	91	Very high	30 Å²	30	54.1 Å²	54.1	20%	0.203	30%	0.297	C	S	.	.	H	α-helix	trans	-92.1	-1.3	-174.9	-70.2	0	0	0	0	114.6	R227 E267 R268 L269 S273 E274 D275	R227-C271 VanDerWaalsContact NH1-CB 3.25Å; R227-C271 PolarHBondContact NH1-SG 3.41Å; E267-C271 PolarHBondContact O-N 3.45Å; R268-C271 PolarHBondContact O-N 2.88Å; L269-C271 VanDerWaalsContact C-N 3.33Å; L269-C271 PolarHBondContact O-N 3Å; C271-S273 PolarHBondContact O-N 2.99Å; C271-E274 PolarHBondContact O-N 3.34Å; C271-E274 VanDerWaalsContact O-N 3.17Å; C271-D275 PolarHBondContact O-N 3.45Å
272	L	89.7	Confident	90.8	Very high	53 Å²	53	54.2 Å²	54.2	28%	0.277	30%	0.297	S	S	.	.	H	α-helix	trans	-56.7	-35.2	175.7	-78.6	176.5	0	0	0	112.6	R268 L269 A276	R268-L272 WeakPolarHBondContact O-CG 3.46Å; R268-L272 PolarHBondContact O-N 2.79Å; R268-L272 VanDerWaalsContact O-N 3.11Å; L269-L272 HydrophobicContact CD2-CD1 3.97Å; L272-A276 WeakPolarHBondContact O-CB 3.33Å; L272-A276 PolarHBondContact O-N 2.93Å
273	S	88.6	Confident	90.5	Very high	88 Å²	88	50.2 Å²	50.2	62%	0.615	28%	0.279	S	S	*	.	H	α-helix	trans	-66.6	-43.6	178.1	61.5	0	0	0	0	112	G270 C271 A276 G277	G270-S273 PolarHBondContact O-OG 3.22Å; C271-S273 PolarHBondContact O-N 2.99Å; S273-A276 PolarHBondContact O-N 3.15Å; S273-G277 PolarHBondContact O-N 3.26Å
274	E	89.5	Confident	90.3	Very high	110 Å²	110	49.3 Å²	49.3	51%	0.514	28%	0.277	S	S	.	.	H	α-helix	trans	-65.6	-43.1	176.8	-59.1	-179.5	163.5	0	0	111.1	Y223 C271 G277 Y278	Y223-E274 WeakPolarHBondContact OH-CB 3.41Å; C271-E274 PolarHBondContact O-N 3.34Å; C271-E274 VanDerWaalsContact O-N 3.17Å; E274-G277 CarbonylContact O-C 3.56Å; E274-G277 WeakPolarHBondContact O-CA 3.46Å; E274-G277 PolarHBondContact O-N 2.9Å; E274-Y278 PolarHBondContact O-N 3.24Å
275	D	90.6	Very high	90	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62.3	-45.4	177.2	-69.5	-28.9	0	0	0	111.6	W176 W181 Y223 R227 Y231 C271 G277 Y278 F279	W176-D275 HydrophobicContact CZ3-CB 4.4Å; W181-D275 HydrophobicContact CZ2-CB 4.34Å; Y223-D275 PolarHBondContact OH-N 2.8Å; Y223-D275 PolarHBondContact OH-OD1 3.48Å; R227-D275 WeakPolarHBondContact CD-OD1 3.31Å; R227-D275 WeakPolarHBondContact CG-OD1 3.44Å; R227-D275 IonicContact CZ-OD1 3.22Å; R227-D275 IonicContact CZ-OD2 3.83Å; R227-D275 VanDerWaalsContact CZ-OD2 3.29Å; R227-D275 VanDerWaalsContact NE-CG 3.27Å; R227-D275 IonicContact NE-OD1 2.85Å; R227-D275 PolarHBondContact NE-OD1 3.4Å; R227-D275 IonicContact NE-OD2 3.53Å; R227-D275 PolarHBondContact NE-OD2 3.47Å; R227-D275 IonicContact NH2-OD1 3.65Å; R227-D275 IonicContact NH2-OD2 3.99Å; R227-D275 PolarHBondContact NH2-OD2 3.48Å; Y231-D275 PolarHBondContact OH-OD2 3.09Å; Y231-D275 VanDerWaalsContact OH-OD2 3.12Å; C271-D275 PolarHBondContact O-N 3.45Å; D275-G277 VanDerWaalsContact C-N 3.3Å; D275-G277 PolarHBondContact O-N 3.27Å; D275-Y278 PolarHBondContact O-N 3.46Å; D275-F279 WeakPolarHBondContact O-CD2 3.15Å; D275-F279 PolarHBondContact O-N 3.31Å
276	A	89.3	Confident	89.6	Confident	41 Å²	41	47.4 Å²	47.4	34%	0.339	27%	0.267	S	S	.	.	H	α-helix	trans	-59.4	-42.8	174.2	0	0	0	0	0	111.4	L272 S273 F279 N280	L272-A276 WeakPolarHBondContact O-CB 3.33Å; L272-A276 PolarHBondContact O-N 2.93Å; S273-A276 PolarHBondContact O-N 3.15Å; A276-F279 PolarHBondContact O-N 2.82Å; A276-N280 WeakPolarHBondContact O-CB 2.79Å; A276-N280 PolarHBondContact O-N 3.11Å; A276-N280 PolarHBondContact O-ND2 3.09Å
277	G	88.4	Confident	89.3	Confident	30 Å²	30	42.9 Å²	42.9	31%	0.309	25%	0.248	S	C	.	.	H	α-helix	trans	-57.4	-48.3	173.1	0	0	0	0	0	112.6	S273 E274 D275 F279 N280 V281	S273-G277 PolarHBondContact O-N 3.26Å; E274-G277 CarbonylContact O-C 3.56Å; E274-G277 WeakPolarHBondContact O-CA 3.46Å; E274-G277 PolarHBondContact O-N 2.9Å; D275-G277 VanDerWaalsContact C-N 3.3Å; D275-G277 PolarHBondContact O-N 3.27Å; G277-F279 PolarHBondContact O-N 3.06Å; G277-N280 PolarHBondContact O-N 3.35Å; G277-V281 VanDerWaalsContact O-CG2 3.31Å; G277-V281 WeakPolarHBondContact O-CG2 3.07Å; G277-V281 PolarHBondContact O-N 3.22Å
278	Y	90.6	Very high	89	Confident	22 Å²	22	44.7 Å²	44.7	9%	0.086	26%	0.257	C	S	.	.	H	α-helix	trans	-58.2	-47.2	177.7	176.8	-95.8	0	0	0	112.4	W181 L184 A220 Y223 L224 E274 D275 N280 V281 I282 G283	W181-Y278 HydrophobicContact CH2-CD1 4.24Å; W181-Y278 HydrophobicContact CZ3-CD1 4.32Å; W181-Y278 HydrophobicContact CZ3-CE1 4.19Å; L184-Y278 HydrophobicContact CD1-CE1 4.36Å; A220-Y278 HydrophobicContact CB-CE2 3.99Å; Y223-Y278 HydrophobicContact CD1-CD1 4.29Å; Y223-Y278 AromaticContact CD1-CD2 3.44Å; Y223-Y278 HydrophobicContact CD1-CD2 3.44Å; Y223-Y278 VanDerWaalsContact CD1-CD2 3.44Å; Y223-Y278 AromaticContact CD1-CE2 3.86Å; Y223-Y278 HydrophobicContact CD1-CE2 3.86Å; Y223-Y278 AromaticContact CD1-CG 3.68Å; Y223-Y278 HydrophobicContact CD1-CG 3.68Å; Y223-Y278 HydrophobicContact CE1-CD1 4.32Å; Y223-Y278 AromaticContact CE1-CD2 3.95Å; Y223-Y278 HydrophobicContact CE1-CD2 3.95Å; Y223-Y278 AromaticContact CE1-CG 3.73Å; Y223-Y278 HydrophobicContact CE1-CG 3.73Å; Y223-Y278 HydrophobicContact CG-CD2 4.2Å; L224-Y278 HydrophobicContact CD1-CE1 4.21Å; E274-Y278 PolarHBondContact O-N 3.24Å; D275-Y278 PolarHBondContact O-N 3.46Å; Y278-N280 VanDerWaalsContact C-N 3.33Å; Y278-N280 PolarHBondContact O-N 3.07Å; Y278-V281 PolarHBondContact O-N 2.77Å; Y278-I282 HydrophobicContact CD2-CG2 3.74Å; Y278-I282 HydrophobicContact CE1-CG2 4.29Å; Y278-I282 HydrophobicContact CE2-CG2 3.41Å; Y278-I282 VanDerWaalsContact CE2-CG2 3.41Å; Y278-I282 HydrophobicContact CG-CG2 4.3Å; Y278-I282 WeakPolarHBondContact O-CG2 3.45Å; Y278-I282 PolarHBondContact O-N 3.29Å; Y278-G283 PolarHBondContact O-N 2.94Å
279	F	89.5	Confident	88.7	Confident	3 Å²	3	44.8 Å²	44.8	1%	0.013	26%	0.26	C	S	.	.	I	π-helix	trans	-66.9	-34.6	178.6	-76.5	-70.3	0	0	0	112.9	W176 K180 W181 L184 D275 A276 G277 N284 I287	W176-F279 HydrophobicContact CZ3-CD2 4.28Å; W176-F279 HydrophobicContact CZ3-CE2 4.15Å; K180-F279 HydrophobicContact CB-CE1 3.65Å; K180-F279 HydrophobicContact CB-CE2 4.33Å; K180-F279 HydrophobicContact CB-CZ 3.5Å; K180-F279 HydrophobicContact CD-CD1 4.07Å; K180-F279 HydrophobicContact CD-CD2 4.01Å; K180-F279 HydrophobicContact CD-CE1 3.8Å; K180-F279 HydrophobicContact CD-CE2 3.75Å; K180-F279 HydrophobicContact CD-CG 4.21Å; K180-F279 HydrophobicContact CD-CZ 3.67Å; K180-F279 HydrophobicContact CG-CE1 4.06Å; K180-F279 HydrophobicContact CG-CZ 4.13Å; W181-F279 HydrophobicContact CD2-CZ 4.06Å; W181-F279 AromaticContact CE2-CE2 3.9Å; W181-F279 AromaticContact CE2-CZ 3.91Å; W181-F279 HydrophobicContact CE3-CZ 4.14Å; W181-F279 AromaticContact CH2-CE2 3.74Å; W181-F279 HydrophobicContact CH2-CE2 3.74Å; W181-F279 AromaticContact CH2-CZ 3.91Å; W181-F279 HydrophobicContact CH2-CZ 3.91Å; W181-F279 AromaticContact CZ2-CE2 3.5Å; W181-F279 HydrophobicContact CZ2-CE2 3.5Å; W181-F279 AromaticContact CZ2-CZ 3.85Å; W181-F279 HydrophobicContact CZ2-CZ 3.85Å; W181-F279 HydrophobicContact CZ3-CE2 4.37Å; W181-F279 HydrophobicContact CZ3-CZ 4.06Å; L184-F279 HydrophobicContact CD1-CE1 3.8Å; L184-F279 HydrophobicContact CD1-CZ 4.38Å; D275-F279 WeakPolarHBondContact O-CD2 3.15Å; D275-F279 PolarHBondContact O-N 3.31Å; A276-F279 PolarHBondContact O-N 2.82Å; G277-F279 PolarHBondContact O-N 3.06Å; F279-N284 WeakPolarHBondContact O-CB 3.19Å; F279-N284 PolarHBondContact O-N 3.33Å; F279-N284 PolarHBondContact O-ND2 3.42Å; F279-I287 HydrophobicContact CE1-CD1 4.31Å
280	N	87.9	Confident	88.3	Confident	97 Å²	97	41 Å²	41	52%	0.519	24%	0.24	S	C	.	.	I	π-helix	trans	-69.1	-36.5	176.1	-72.8	-15.5	0	0	0	112.8	A276 G277 Y278 R285 M316	A276-N280 WeakPolarHBondContact O-CB 2.79Å; A276-N280 PolarHBondContact O-N 3.11Å; A276-N280 PolarHBondContact O-ND2 3.09Å; G277-N280 PolarHBondContact O-N 3.35Å; Y278-N280 VanDerWaalsContact C-N 3.33Å; Y278-N280 PolarHBondContact O-N 3.07Å; N280-R285 PolarHBondContact O-NH1 2.92Å; N280-M316 VanDerWaalsContact O-CE 3.26Å; N280-M316 WeakPolarHBondContact O-CE 3.06Å
281	V	86.3	Confident	87.9	Confident	21 Å²	21	42.7 Å²	42.7	13%	0.127	24%	0.237	C	C	.	.	I	π-helix	trans	-80.9	-47.7	-179.3	175.2	0	0	0	0	111.5	G277 Y278 R285 M316 Q319 C320	G277-V281 VanDerWaalsContact O-CG2 3.31Å; G277-V281 WeakPolarHBondContact O-CG2 3.07Å; G277-V281 PolarHBondContact O-N 3.22Å; Y278-V281 PolarHBondContact O-N 2.77Å; V281-R285 PolarHBondContact O-NH1 3.05Å; V281-M316 HydrophobicContact CB-CE 4.46Å; V281-M316 HydrophobicContact CG2-CE 3.92Å; V281-M316 HydrophobicContact CG2-SD 4.3Å; V281-Q319 HydrophobicContact CG1-CB 4.08Å; V281-C320 HydrophobicContact CG1-CB 4.09Å
282	I	87.9	Confident	87.7	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	26%	0.26	C	S	.	.	I	π-helix	trans	-138.8	-39.9	-169.4	-166.5	174.9	0	0	0	114.4	A220 Y278 N284 R285 L286 F307 A323 L324	A220-I282 HydrophobicContact CB-CD1 3.7Å; A220-I282 HydrophobicContact CB-CG2 4.42Å; Y278-I282 HydrophobicContact CD2-CG2 3.74Å; Y278-I282 HydrophobicContact CE1-CG2 4.29Å; Y278-I282 HydrophobicContact CE2-CG2 3.41Å; Y278-I282 VanDerWaalsContact CE2-CG2 3.41Å; Y278-I282 HydrophobicContact CG-CG2 4.3Å; Y278-I282 WeakPolarHBondContact O-CG2 3.45Å; Y278-I282 PolarHBondContact O-N 3.29Å; I282-N284 PolarHBondContact O-N 2.8Å; I282-R285 PolarHBondContact O-N 3.17Å; I282-R285 VanDerWaalsContact O-N 3.13Å; I282-L286 HydrophobicContact CD1-CD1 4.03Å; I282-L286 HydrophobicContact CG1-CD1 3.77Å; I282-L286 HydrophobicContact CG1-CG 3.91Å; I282-L286 PolarHBondContact O-N 3.39Å; I282-F307 HydrophobicContact CG1-CE1 4.42Å; I282-A323 HydrophobicContact CD1-CB 4.34Å; I282-L324 HydrophobicContact CD1-CD1 4.37Å; I282-L324 HydrophobicContact CD1-CD2 3.51Å; I282-L324 HydrophobicContact CD1-CG 3.62Å
283	G	86.8	Confident	87.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.249	C	C	.	.	I	π-helix	trans	-59.4	-46.7	-167.9	0	0	0	0	0	114.1	Y278 R285 L286 I287	Y278-G283 PolarHBondContact O-N 2.94Å; G283-R285 VanDerWaalsContact C-N 3.31Å; G283-R285 PolarHBondContact O-N 2.97Å; G283-L286 PolarHBondContact O-N 3.4Å; G283-I287 WeakPolarHBondContact O-CG1 3.48Å; G283-I287 PolarHBondContact O-N 3.1Å
284	N	88.5	Confident	86.9	Confident	64 Å²	64	46.8 Å²	46.8	34%	0.342	24%	0.243	S	C	.	.	H	α-helix	trans	-65.3	-35.2	179.7	-70	-23.7	0	0	0	112.3	F279 I282 I287 Q288	F279-N284 WeakPolarHBondContact O-CB 3.19Å; F279-N284 PolarHBondContact O-N 3.33Å; F279-N284 PolarHBondContact O-ND2 3.42Å; I282-N284 PolarHBondContact O-N 2.8Å; N284-I287 PolarHBondContact O-N 3.37Å; N284-Q288 WeakPolarHBondContact O-CG 3.31Å; N284-Q288 PolarHBondContact O-N 2.67Å
285	R	87.9	Confident	86.6	Confident	60 Å²	60	46.9 Å²	46.9	23%	0.226	26%	0.256	C	S	.	.	H	α-helix	trans	-68.9	-40.7	177.7	-64.6	179.8	176.2	84.4	7.2	111.1	N280 V281 I282 G283 Q288 V289 F307	N280-R285 PolarHBondContact O-NH1 2.92Å; V281-R285 PolarHBondContact O-NH1 3.05Å; I282-R285 PolarHBondContact O-N 3.17Å; I282-R285 VanDerWaalsContact O-N 3.13Å; G283-R285 VanDerWaalsContact C-N 3.31Å; G283-R285 PolarHBondContact O-N 2.97Å; R285-Q288 PolarHBondContact O-N 3.42Å; R285-V289 WeakPolarHBondContact O-CG2 3.42Å; R285-V289 PolarHBondContact O-N 3.3Å; R285-F307 HydrophobicContact CB-CE1 4.27Å; R285-F307 HydrophobicContact CB-CE2 4.25Å; R285-F307 HydrophobicContact CB-CZ 3.54Å
286	L	86.6	Confident	86.2	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-61.6	-44.2	173.8	-72.4	175	0	0	0	111.3	L184 I282 G283 Q288 V289 I290 L302 F307	L184-L286 HydrophobicContact CD2-CB 3.61Å; L184-L286 HydrophobicContact CD2-CD1 4.28Å; I282-L286 HydrophobicContact CD1-CD1 4.03Å; I282-L286 HydrophobicContact CG1-CD1 3.77Å; I282-L286 HydrophobicContact CG1-CG 3.91Å; I282-L286 PolarHBondContact O-N 3.39Å; G283-L286 PolarHBondContact O-N 3.4Å; L286-Q288 VanDerWaalsContact C-N 3.31Å; L286-Q288 PolarHBondContact O-N 3.13Å; L286-V289 PolarHBondContact O-N 3Å; L286-I290 VanDerWaalsContact O-CG1 3.26Å; L286-I290 WeakPolarHBondContact O-CG1 3.42Å; L286-I290 PolarHBondContact O-N 3.46Å; L286-L302 HydrophobicContact CD2-CD1 3.72Å; L286-F307 HydrophobicContact CD2-CE2 4.33Å; L286-F307 HydrophobicContact CD2-CZ 4.06Å; L286-F307 HydrophobicContact CG-CZ 4.35Å
287	I	86.3	Confident	85.6	Confident	28 Å²	28	51.5 Å²	51.5	14%	0.144	30%	0.297	C	S	.	.	H	α-helix	trans	-59.6	-41.8	176	-67.4	169.1	0	0	0	111.3	L184 F279 G283 N284 V289 I290 N291	L184-I287 HydrophobicContact CD1-CD1 4.46Å; L184-I287 HydrophobicContact CD1-CG1 4.43Å; L184-I287 HydrophobicContact CD2-CG1 3.88Å; L184-I287 HydrophobicContact CG-CD1 4.44Å; L184-I287 HydrophobicContact CG-CG1 4Å; F279-I287 HydrophobicContact CE1-CD1 4.31Å; G283-I287 WeakPolarHBondContact O-CG1 3.48Å; G283-I287 PolarHBondContact O-N 3.1Å; N284-I287 PolarHBondContact O-N 3.37Å; I287-V289 PolarHBondContact O-N 3.17Å; I287-I290 WeakPolarHBondContact O-CB 3.36Å; I287-I290 PolarHBondContact O-N 3.16Å; I287-N291 VanDerWaalsContact O-CG 3.26Å; I287-N291 PolarHBondContact O-N 2.87Å; I287-N291 PolarHBondContact O-ND2 3.42Å
288	Q	86.6	Confident	84.9	Confident	134 Å²	134	59.5 Å²	59.5	63%	0.626	32%	0.318	S	S	*	.	H	α-helix	trans	-62.1	-41.7	175.9	-72.7	172.1	1.9	0	0	112.4	N284 R285 L286 N291 K292	N284-Q288 WeakPolarHBondContact O-CG 3.31Å; N284-Q288 PolarHBondContact O-N 2.67Å; R285-Q288 PolarHBondContact O-N 3.42Å; L286-Q288 VanDerWaalsContact C-N 3.31Å; L286-Q288 PolarHBondContact O-N 3.13Å; Q288-N291 PolarHBondContact O-N 2.96Å; Q288-K292 WeakPolarHBondContact O-CB 3.5Å; Q288-K292 PolarHBondContact O-N 2.79Å
289	V	85.6	Confident	83.9	Confident	23 Å²	23	61.9 Å²	61.9	14%	0.139	34%	0.336	C	S	.	.	H	α-helix	trans	-66.3	-40.8	175.8	172.5	0	0	0	0	111.3	I211 R285 L286 I287 K292 A293 Y300 L302 F307	I211-V289 HydrophobicContact CD1-CG1 4.11Å; R285-V289 WeakPolarHBondContact O-CG2 3.42Å; R285-V289 PolarHBondContact O-N 3.3Å; L286-V289 PolarHBondContact O-N 3Å; I287-V289 PolarHBondContact O-N 3.17Å; V289-K292 PolarHBondContact O-N 2.69Å; V289-A293 WeakPolarHBondContact O-CB 3.17Å; V289-A293 PolarHBondContact O-N 3.01Å; V289-Y300 HydrophobicContact CG1-CD1 3.46Å; V289-Y300 VanDerWaalsContact CG1-CD1 3.46Å; V289-Y300 HydrophobicContact CG1-CE1 3.88Å; V289-Y300 HydrophobicContact CG1-CG 3.88Å; V289-L302 HydrophobicContact CG1-CD2 4.41Å; V289-F307 HydrophobicContact CG2-CD2 4.19Å; V289-F307 HydrophobicContact CG2-CE2 3.71Å
290	I	84.2	Confident	83.1	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-58.3	-50.6	174.2	-70.2	165.9	0	0	0	110	L184 N187 I211 L286 I287 K292 A293 L294	L184-I290 HydrophobicContact CD2-CD1 3.82Å; N187-I290 HydrophobicContact CB-CD1 3.87Å; N187-I290 HydrophobicContact CB-CG1 3.99Å; N187-I290 HydrophobicContact CB-CG2 3.87Å; N187-I290 WeakPolarHBondContact ND2-CG2 3.47Å; I211-I290 HydrophobicContact CD1-CD1 4.19Å; I211-I290 HydrophobicContact CD1-CG1 3.39Å; I211-I290 HydrophobicContact CG1-CG1 4.2Å; L286-I290 VanDerWaalsContact O-CG1 3.26Å; L286-I290 WeakPolarHBondContact O-CG1 3.42Å; L286-I290 PolarHBondContact O-N 3.46Å; I287-I290 WeakPolarHBondContact O-CB 3.36Å; I287-I290 PolarHBondContact O-N 3.16Å; I290-K292 VanDerWaalsContact C-N 3.29Å; I290-K292 PolarHBondContact O-N 3.28Å; I290-A293 WeakPolarHBondContact O-CB 3.49Å; I290-A293 PolarHBondContact O-N 2.8Å; I290-A293 VanDerWaalsContact O-N 3.12Å; I290-L294 HydrophobicContact CG2-CD1 3.8Å; I290-L294 HydrophobicContact CG2-CG 4.26Å; I290-L294 WeakPolarHBondContact O-CB 3.43Å; I290-L294 WeakPolarHBondContact O-CG 3.27Å; I290-L294 PolarHBondContact O-N 3.41Å
291	N	84.9	Confident	82.4	Confident	87 Å²	87	66.3 Å²	66.3	47%	0.465	36%	0.357	S	S	.	.	H	α-helix	trans	-60.5	-40.8	179.9	-69.3	-15.4	0	0	0	111.5	I287 Q288 L294 S295	I287-N291 VanDerWaalsContact O-CG 3.26Å; I287-N291 PolarHBondContact O-N 2.87Å; I287-N291 PolarHBondContact O-ND2 3.42Å; Q288-N291 PolarHBondContact O-N 2.96Å; N291-L294 PolarHBondContact O-N 3.41Å; N291-S295 PolarHBondContact O-N 2.58Å; N291-S295 PolarHBondContact O-OG 3.5Å
292	K	85	Confident	81.8	Confident	159 Å²	159	65.8 Å²	65.8	69%	0.691	35%	0.353	S	S	*	.	H	α-helix	trans	-64.8	-41.1	174.9	-172.8	176.8	-179.4	177.4	0	112.3	Q288 V289 I290 S295 S296	Q288-K292 WeakPolarHBondContact O-CB 3.5Å; Q288-K292 PolarHBondContact O-N 2.79Å; V289-K292 PolarHBondContact O-N 2.69Å; I290-K292 VanDerWaalsContact C-N 3.29Å; I290-K292 PolarHBondContact O-N 3.28Å; K292-S295 PolarHBondContact O-N 2.6Å; K292-S296 WeakPolarHBondContact O-CB 3.5Å; K292-S296 PolarHBondContact O-N 3.38Å; K292-S296 PolarHBondContact O-OG 3.25Å
293	A	82.5	Confident	81.2	Confident	5 Å²	5	69.5 Å²	69.5	4%	0.041	37%	0.373	C	S	.	.	H	α-helix	trans	-63.6	-46.4	176.7	0	0	0	0	0	110.8	C210 V289 I290 S295 S296 G297	C210-A293 HydrophobicContact CB-CB 4.2Å; V289-A293 WeakPolarHBondContact O-CB 3.17Å; V289-A293 PolarHBondContact O-N 3.01Å; I290-A293 WeakPolarHBondContact O-CB 3.49Å; I290-A293 PolarHBondContact O-N 2.8Å; I290-A293 VanDerWaalsContact O-N 3.12Å; A293-S295 PolarHBondContact O-N 3.42Å; A293-S296 CarbonylContact O-C 3.6Å; A293-S296 PolarHBondContact O-N 3.1Å; A293-S296 VanDerWaalsContact O-N 3.12Å; A293-S296 PolarHBondContact O-OG 3.27Å; A293-G297 PolarHBondContact O-N 3.5Å
294	L	80.6	Confident	80.6	Confident	93 Å²	93	71 Å²	71	49%	0.487	38%	0.383	S	S	.	.	H	α-helix	trans	-58.9	-45.6	175.7	-71.4	171.9	0	0	0	111.9	C210 I290 N291 S296 G297	C210-L294 VanDerWaalsContact SG-CD2 3.54Å; I290-L294 HydrophobicContact CG2-CD1 3.8Å; I290-L294 HydrophobicContact CG2-CG 4.26Å; I290-L294 WeakPolarHBondContact O-CB 3.43Å; I290-L294 WeakPolarHBondContact O-CG 3.27Å; I290-L294 PolarHBondContact O-N 3.41Å; N291-L294 PolarHBondContact O-N 3.41Å; L294-S296 VanDerWaalsContact C-N 3.27Å; L294-S296 PolarHBondContact O-N 3.09Å; L294-G297 PolarHBondContact O-N 3.22Å
295	S	83.5	Confident	79.9	Confident	113 Å²	113	73.4 Å²	73.4	79%	0.79	39%	0.394	S	S	*	.	H	α-helix	trans	-64.7	-30.6	175.9	-58.1	0	0	0	0	113.3	N291 K292 A293	N291-S295 PolarHBondContact O-N 2.58Å; N291-S295 PolarHBondContact O-OG 3.5Å; K292-S295 PolarHBondContact O-N 2.6Å; A293-S295 PolarHBondContact O-N 3.42Å
296	S	82	Confident	79.4	Confident	68 Å²	68	74.3 Å²	74.3	48%	0.476	41%	0.407	S	S	.	.	H	α-helix	trans	-86.1	-15.1	179.9	72.8	0	0	0	0	114.2	K292 A293 L294 R298	K292-S296 WeakPolarHBondContact O-CB 3.5Å; K292-S296 PolarHBondContact O-N 3.38Å; K292-S296 PolarHBondContact O-OG 3.25Å; A293-S296 CarbonylContact O-C 3.6Å; A293-S296 PolarHBondContact O-N 3.1Å; A293-S296 VanDerWaalsContact O-N 3.12Å; A293-S296 PolarHBondContact O-OG 3.27Å; L294-S296 VanDerWaalsContact C-N 3.27Å; L294-S296 PolarHBondContact O-N 3.09Å; S296-R298 PolarHBondContact O-N 3.31Å; S296-R298 PolarHBondContact OG-N 3.44Å
297	G	75.2	Confident	79.2	Confident	70 Å²	70	74.8 Å²	74.8	72%	0.722	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	11.3	-173.5	0	0	0	0	0	114.8	A293 L294	A293-G297 PolarHBondContact O-N 3.5Å; L294-G297 PolarHBondContact O-N 3.22Å
298	R	73.7	Confident	78.9	Confident	198 Å²	198	73.6 Å²	73.6	75%	0.747	40%	0.403	S	S	*	.	S	Bend	trans	-116.7	135.5	-177.7	-66.5	-176.9	-176.4	-173.6	0.9	111.1	S296 Y300	S296-R298 PolarHBondContact O-N 3.31Å; S296-R298 PolarHBondContact OG-N 3.44Å; R298-Y300 PolarHBondContact O-N 3.34Å
299	P	70.9	Confident	78.6	Confident	72 Å²	72	71 Å²	71	47%	0.468	40%	0.4	S	S	.	.			trans	-66.2	131.2	175.5	27.7	-33.3	0	0	0	110.1	C210	C210-P299 CarbonylContact O-C 3.52Å; C210-P299 WeakPolarHBondContact O-CA 3.36Å
300	Y	72	Confident	78.3	Confident	93 Å²	93	74.4 Å²	74.4	37%	0.365	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	123.8	179.3	-169.2	-97	0	0	0	110	C210 I211 R212 V289 R298 L302	C210-Y300 PolarHBondContact O-N 3.01Å; I211-Y300 WeakPolarHBondContact CA-O 3.23Å; R212-Y300 PolarHBondContact N-O 3.23Å; V289-Y300 HydrophobicContact CG1-CD1 3.46Å; V289-Y300 VanDerWaalsContact CG1-CD1 3.46Å; V289-Y300 HydrophobicContact CG1-CE1 3.88Å; V289-Y300 HydrophobicContact CG1-CG 3.88Å; R298-Y300 PolarHBondContact O-N 3.34Å; Y300-L302 HydrophobicContact CD1-CD2 3.91Å; Y300-L302 HydrophobicContact CD1-CG 3.97Å; Y300-L302 HydrophobicContact CE1-CD2 3.61Å; Y300-L302 HydrophobicContact CE1-CG 4.11Å
301	T	73.7	Confident	78.3	Confident	100 Å²	100	74.7 Å²	74.7	61%	0.613	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	111.5	172.9	-54.1	0	0	0	0	108.6	R212 N303	R212-T301 WeakPolarHBondContact O-CA 3.36Å; T301-N303 PolarHBondContact O-N 2.93Å
302	L	73.4	Confident	78.3	Confident	10 Å²	10	76.1 Å²	76.1	5%	0.052	44%	0.442	C	S	.	.			trans	-75.9	118.3	-179.3	-82.9	170.2	0	0	0	110.3	I211 R212 L214 L286 V289 Y300 F307	I211-L302 HydrophobicContact CD1-CD1 4.25Å; I211-L302 HydrophobicContact CG2-CB 4.49Å; I211-L302 HydrophobicContact CG2-CD1 3.28Å; I211-L302 HydrophobicContact CG2-CG 3.82Å; R212-L302 PolarHBondContact O-N 3.22Å; L214-L302 HydrophobicContact CD1-CD1 3.56Å; L214-L302 HydrophobicContact CG-CD1 4.06Å; L286-L302 HydrophobicContact CD2-CD1 3.72Å; V289-L302 HydrophobicContact CG1-CD2 4.41Å; Y300-L302 HydrophobicContact CD1-CD2 3.91Å; Y300-L302 HydrophobicContact CD1-CG 3.97Å; Y300-L302 HydrophobicContact CE1-CD2 3.61Å; Y300-L302 HydrophobicContact CE1-CG 4.11Å; L302-F307 HydrophobicContact CD2-CB 4.27Å; L302-F307 HydrophobicContact CD2-CD2 3.4Å; L302-F307 HydrophobicContact CD2-CE2 3.9Å; L302-F307 HydrophobicContact CD2-CG 4.01Å
303	N	74.5	Confident	78.3	Confident	78 Å²	78	72.4 Å²	72.4	42%	0.417	43%	0.43	S	S	.	.			trans	-98.3	118.2	161.4	-177.5	-25.6	0	0	0	108.4	T301 I305 T306 F307	T301-N303 PolarHBondContact O-N 2.93Å; N303-I305 PolarHBondContact O-N 3.08Å; N303-I305 VanDerWaalsContact O-N 3.14Å; N303-I305 PolarHBondContact OD1-N 2.74Å; N303-T306 HydrophobicContact CB-CG2 4.31Å; N303-T306 WeakPolarHBondContact CB-OG1 3.28Å; N303-T306 PolarHBondContact O-N 2.78Å; N303-T306 PolarHBondContact O-OG1 2.94Å; N303-T306 VanDerWaalsContact O-OG1 3.1Å; N303-F307 WeakPolarHBondContact O-CB 3.29Å; N303-F307 PolarHBondContact O-N 3.48Å
304	P	75.5	Confident	78.4	Confident	31 Å²	31	77.2 Å²	77.2	20%	0.201	46%	0.455	C	S	.	.	H	α-helix	trans	-54.6	-34.1	-175.9	-28.1	34.9	0	0	0	114.3	T308 L324	P304-T308 WeakPolarHBondContact O-CB 3.49Å; P304-T308 WeakPolarHBondContact O-CG2 3.45Å; P304-T308 PolarHBondContact O-N 3.16Å; P304-T308 VanDerWaalsContact O-N 3.16Å; P304-T308 PolarHBondContact O-OG1 3.23Å; P304-L324 HydrophobicContact CB-CB 4.05Å; P304-L324 HydrophobicContact CB-CD1 4.33Å; P304-L324 HydrophobicContact CG-CB 4.42Å
305	I	73.6	Confident	78.6	Confident	115 Å²	115	75.8 Å²	75.8	59%	0.59	45%	0.453	S	S	*	.	H	α-helix	trans	-72.3	-48.5	-178.1	-58.8	173.3	0	0	0	109.9	N303 F307 T308 S309	N303-I305 PolarHBondContact O-N 3.08Å; N303-I305 VanDerWaalsContact O-N 3.14Å; N303-I305 PolarHBondContact OD1-N 2.74Å; I305-F307 VanDerWaalsContact C-N 3.3Å; I305-F307 PolarHBondContact O-N 3.03Å; I305-T308 PolarHBondContact O-N 3.14Å; I305-T308 PolarHBondContact O-OG1 3.03Å; I305-T308 VanDerWaalsContact O-OG1 3.04Å; I305-S309 PolarHBondContact O-N 2.7Å; I305-S309 PolarHBondContact O-OG 2.74Å
306	T	78.1	Confident	78.6	Confident	80 Å²	80	72.4 Å²	72.4	49%	0.491	43%	0.425	S	S	.	.	H	α-helix	trans	-68.6	-32.7	179.8	63.7	0	0	0	0	112.1	N303	N303-T306 HydrophobicContact CB-CG2 4.31Å; N303-T306 WeakPolarHBondContact CB-OG1 3.28Å; N303-T306 PolarHBondContact O-N 2.78Å; N303-T306 PolarHBondContact O-OG1 2.94Å; N303-T306 VanDerWaalsContact O-OG1 3.1Å
307	F	81.6	Confident	78.8	Confident	12 Å²	12	73 Å²	73	5%	0.053	42%	0.417	C	S	.	.	H	α-helix	trans	-64.1	-42.1	176.1	-178.8	-98.1	0	0	0	112	I282 R285 L286 V289 L302 N303 I305 S310 L324	I282-F307 HydrophobicContact CG1-CE1 4.42Å; R285-F307 HydrophobicContact CB-CE1 4.27Å; R285-F307 HydrophobicContact CB-CE2 4.25Å; R285-F307 HydrophobicContact CB-CZ 3.54Å; L286-F307 HydrophobicContact CD2-CE2 4.33Å; L286-F307 HydrophobicContact CD2-CZ 4.06Å; L286-F307 HydrophobicContact CG-CZ 4.35Å; V289-F307 HydrophobicContact CG2-CD2 4.19Å; V289-F307 HydrophobicContact CG2-CE2 3.71Å; L302-F307 HydrophobicContact CD2-CB 4.27Å; L302-F307 HydrophobicContact CD2-CD2 3.4Å; L302-F307 HydrophobicContact CD2-CE2 3.9Å; L302-F307 HydrophobicContact CD2-CG 4.01Å; N303-F307 WeakPolarHBondContact O-CB 3.29Å; N303-F307 PolarHBondContact O-N 3.48Å; I305-F307 VanDerWaalsContact C-N 3.3Å; I305-F307 PolarHBondContact O-N 3.03Å; F307-S310 PolarHBondContact O-OG 3.03Å; F307-L324 HydrophobicContact CD1-CD1 3.43Å; F307-L324 VanDerWaalsContact CD1-CD1 3.43Å; F307-L324 HydrophobicContact CE1-CD1 3.85Å; F307-L324 HydrophobicContact CG-CD1 4.34Å
308	T	80.7	Confident	79.2	Confident	4 Å²	4	73.7 Å²	73.7	3%	0.025	40%	0.401	C	S	.	.	H	α-helix	trans	-78.9	-24.6	-176.3	52.6	0	0	0	0	113.2	P304 I305 S310 I311 R317 C320 L321 L324	P304-T308 WeakPolarHBondContact O-CB 3.49Å; P304-T308 WeakPolarHBondContact O-CG2 3.45Å; P304-T308 PolarHBondContact O-N 3.16Å; P304-T308 VanDerWaalsContact O-N 3.16Å; P304-T308 PolarHBondContact O-OG1 3.23Å; I305-T308 PolarHBondContact O-N 3.14Å; I305-T308 PolarHBondContact O-OG1 3.03Å; I305-T308 VanDerWaalsContact O-OG1 3.04Å; T308-S310 PolarHBondContact O-N 3.03Å; T308-I311 WeakPolarHBondContact O-CB 3.35Å; T308-I311 PolarHBondContact O-N 3.35Å; T308-R317 WeakPolarHBondContact O-CG 3.5Å; T308-C320 HydrophobicContact CG2-CB 4.1Å; T308-L321 HydrophobicContact CG2-CB 3.92Å; T308-L324 HydrophobicContact CG2-CD1 4.07Å
309	S	79	Confident	79.7	Confident	79 Å²	79	68.5 Å²	68.5	55%	0.552	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-22.8	175.5	-62.8	0	0	0	0	114.5	I305 I311	I305-S309 PolarHBondContact O-N 2.7Å; I305-S309 PolarHBondContact O-OG 2.74Å; S309-I311 VanDerWaalsContact C-N 3.26Å; S309-I311 PolarHBondContact O-N 3.41Å
310	S	80.3	Confident	80.3	Confident	94 Å²	94	65 Å²	65	66%	0.657	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-14.2	177.5	65.4	0	0	0	0	114.6	F307 T308	F307-S310 PolarHBondContact O-OG 3.03Å; T308-S310 PolarHBondContact O-N 3.03Å
311	I	84.2	Confident	80.8	Confident	8 Å²	8	63 Å²	63	4%	0.041	36%	0.358	C	S	.	.			trans	-90	121.9	-175.5	-57	175.1	0	0	0	108.9	T308 S309 D313 M316 R317 C320	T308-I311 WeakPolarHBondContact O-CB 3.35Å; T308-I311 PolarHBondContact O-N 3.35Å; S309-I311 VanDerWaalsContact C-N 3.26Å; S309-I311 PolarHBondContact O-N 3.41Å; I311-D313 WeakPolarHBondContact CG2-O 3.47Å; I311-M316 HydrophobicContact CG2-CB 3.98Å; I311-R317 HydrophobicContact CB-CB 4.15Å; I311-R317 HydrophobicContact CB-CG 4.45Å; I311-R317 HydrophobicContact CG2-CB 4.18Å; I311-R317 PolarHBondContact O-NE 3.48Å; I311-R317 PolarHBondContact O-NH2 2.87Å; I311-C320 HydrophobicContact CD1-CB 3.65Å
312	S	83.6	Confident	81.2	Confident	116 Å²	116	60.6 Å²	60.6	81%	0.811	34%	0.34	S	S	*	.	S	Bend	trans	-69.4	-44.1	178.7	50.9	0	0	0	0	113.2	L314	S312-L314 PolarHBondContact O-N 3Å
313	D	86.8	Confident	81.5	Confident	81 Å²	81	60.9 Å²	60.9	43%	0.433	34%	0.344	S	S	.	.			trans	-72.2	122.5	-179.3	178.2	16.3	0	0	0	111.8	I311 S315 M316 R317	I311-D313 WeakPolarHBondContact CG2-O 3.47Å; D313-S315 PolarHBondContact O-N 2.83Å; D313-S315 PolarHBondContact OD1-N 2.63Å; D313-S315 VanDerWaalsContact OD1-N 3.11Å; D313-M316 HydrophobicContact CB-CB 4.14Å; D313-M316 HydrophobicContact CB-CG 4.34Å; D313-M316 WeakPolarHBondContact OD2-CG 3.23Å; D313-R317 VanDerWaalsContact O-CB 3.26Å; D313-R317 WeakPolarHBondContact O-CB 3.27Å; D313-R317 PolarHBondContact O-N 3.2Å
314	L	84.6	Confident	81.8	Confident	107 Å²	107	57.3 Å²	57.3	56%	0.56	33%	0.325	S	S	*	.	H	α-helix	trans	-63.1	-40.1	-178.1	-175.5	62.4	0	0	0	112	S312 R317 E318	S312-L314 PolarHBondContact O-N 3Å; L314-R317 WeakPolarHBondContact O-CB 3.46Å; L314-R317 PolarHBondContact O-N 2.94Å; L314-E318 PolarHBondContact O-N 3.47Å
315	S	83.9	Confident	81.8	Confident	63 Å²	63	57.3 Å²	57.3	44%	0.441	32%	0.322	S	S	.	.	H	α-helix	trans	-64.9	-49.5	-179	179.7	0	0	0	0	111	D313 R317 E318 Q319	D313-S315 PolarHBondContact O-N 2.83Å; D313-S315 PolarHBondContact OD1-N 2.63Å; D313-S315 VanDerWaalsContact OD1-N 3.11Å; S315-R317 VanDerWaalsContact C-N 3.3Å; S315-R317 PolarHBondContact O-N 2.99Å; S315-E318 PolarHBondContact O-N 2.99Å; S315-Q319 VanDerWaalsContact O-CG 3.31Å; S315-Q319 WeakPolarHBondContact O-CG 3.1Å; S315-Q319 PolarHBondContact O-N 3.41Å; S315-Q319 PolarHBondContact OG-NE2 2.86Å
316	M	83.9	Confident	81.6	Confident	42 Å²	42	53 Å²	53	21%	0.207	30%	0.302	C	S	.	.	H	α-helix	trans	-64.5	-34.3	176.1	-71.2	-67.7	-68.6	0	0	112.4	N280 V281 I311 D313 Q319 C320	N280-M316 VanDerWaalsContact O-CE 3.26Å; N280-M316 WeakPolarHBondContact O-CE 3.06Å; V281-M316 HydrophobicContact CB-CE 4.46Å; V281-M316 HydrophobicContact CG2-CE 3.92Å; V281-M316 HydrophobicContact CG2-SD 4.3Å; I311-M316 HydrophobicContact CG2-CB 3.98Å; D313-M316 HydrophobicContact CB-CB 4.14Å; D313-M316 HydrophobicContact CB-CG 4.34Å; D313-M316 WeakPolarHBondContact OD2-CG 3.23Å; M316-Q319 PolarHBondContact O-N 3.03Å; M316-C320 VanDerWaalsContact O-CB 3.26Å; M316-C320 WeakPolarHBondContact O-CB 3.46Å; M316-C320 PolarHBondContact O-N 2.87Å
317	R	85.2	Confident	80.8	Confident	81 Å²	81	50.4 Å²	50.4	31%	0.306	29%	0.291	S	S	.	.	H	α-helix	trans	-63.3	-48	175.1	-171	-174.9	-59.7	149.9	-3.1	111.4	T308 I311 D313 L314 S315 C320 L321	T308-R317 WeakPolarHBondContact O-CG 3.5Å; I311-R317 HydrophobicContact CB-CB 4.15Å; I311-R317 HydrophobicContact CB-CG 4.45Å; I311-R317 HydrophobicContact CG2-CB 4.18Å; I311-R317 PolarHBondContact O-NE 3.48Å; I311-R317 PolarHBondContact O-NH2 2.87Å; D313-R317 VanDerWaalsContact O-CB 3.26Å; D313-R317 WeakPolarHBondContact O-CB 3.27Å; D313-R317 PolarHBondContact O-N 3.2Å; L314-R317 WeakPolarHBondContact O-CB 3.46Å; L314-R317 PolarHBondContact O-N 2.94Å; S315-R317 VanDerWaalsContact C-N 3.3Å; S315-R317 PolarHBondContact O-N 2.99Å; R317-C320 PolarHBondContact O-N 3.34Å; R317-L321 WeakPolarHBondContact O-CB 3.25Å; R317-L321 PolarHBondContact O-N 2.97Å
318	E	83.3	Confident	79.8	Confident	83 Å²	83	55.7 Å²	55.7	39%	0.388	32%	0.32	S	S	.	.	H	α-helix	trans	-61.4	-44.6	176.5	-74.1	-165.4	-177.3	0	0	111.7	L314 S315 C320 L321 H322 K337	L314-E318 PolarHBondContact O-N 3.47Å; S315-E318 PolarHBondContact O-N 2.99Å; E318-C320 PolarHBondContact O-N 3.35Å; E318-L321 PolarHBondContact O-N 3.11Å; E318-H322 WeakPolarHBondContact O-CB 3.49Å; E318-H322 PolarHBondContact O-CD2 3.08Å; E318-H322 PolarHBondContact O-N 3.46Å; E318-K337 IonicContact OE1-NZ 3.77Å; E318-K337 IonicContact OE2-NZ 2.93Å; E318-K337 PolarHBondContact OE2-NZ 3.01Å
319	Q	84.5	Confident	78.7	Confident	89 Å²	89	60.3 Å²	60.3	42%	0.416	34%	0.341	S	S	.	.	H	α-helix	trans	-62.1	-42.9	178.1	-70.3	175.1	28.4	0	0	112.1	V281 S315 M316 H322 A323	V281-Q319 HydrophobicContact CG1-CB 4.08Å; S315-Q319 VanDerWaalsContact O-CG 3.31Å; S315-Q319 WeakPolarHBondContact O-CG 3.1Å; S315-Q319 PolarHBondContact O-N 3.41Å; S315-Q319 PolarHBondContact OG-NE2 2.86Å; M316-Q319 PolarHBondContact O-N 3.03Å; Q319-H322 PolarHBondContact O-N 2.99Å; Q319-A323 WeakPolarHBondContact O-CB 3.14Å; Q319-A323 PolarHBondContact O-N 3.27Å
320	C	83.9	Confident	77.6	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-64.4	-42.5	176.9	-173.5	0	0	0	0	111.6	V281 T308 I311 M316 R317 E318 A323 L324	V281-C320 HydrophobicContact CG1-CB 4.09Å; T308-C320 HydrophobicContact CG2-CB 4.1Å; I311-C320 HydrophobicContact CD1-CB 3.65Å; M316-C320 VanDerWaalsContact O-CB 3.26Å; M316-C320 WeakPolarHBondContact O-CB 3.46Å; M316-C320 PolarHBondContact O-N 2.87Å; R317-C320 PolarHBondContact O-N 3.34Å; E318-C320 PolarHBondContact O-N 3.35Å; C320-A323 PolarHBondContact O-N 2.76Å; C320-L324 WeakPolarHBondContact O-CG 3.37Å; C320-L324 PolarHBondContact O-N 3.18Å; C320-L324 VanDerWaalsContact O-N 3.14Å
321	L	83.4	Confident	76.3	Confident	51 Å²	51	59.5 Å²	59.5	27%	0.267	32%	0.317	S	S	.	.	H	α-helix	trans	-62.9	-47.1	175.7	-172.3	133.3	0	0	0	111.3	T308 R317 E318 A323 L324 L325	T308-L321 HydrophobicContact CG2-CB 3.92Å; R317-L321 WeakPolarHBondContact O-CB 3.25Å; R317-L321 PolarHBondContact O-N 2.97Å; E318-L321 PolarHBondContact O-N 3.11Å; L321-A323 VanDerWaalsContact C-N 3.26Å; L321-A323 PolarHBondContact O-N 3.44Å; L321-L324 PolarHBondContact O-N 3.49Å; L321-L324 VanDerWaalsContact O-N 3.1Å; L321-L325 HydrophobicContact CD2-CD1 3.55Å; L321-L325 HydrophobicContact CD2-CG 4.31Å; L321-L325 HydrophobicContact CG-CD1 4.29Å; L321-L325 WeakPolarHBondContact O-CG 3.34Å; L321-L325 PolarHBondContact O-N 2.87Å; L321-L325 VanDerWaalsContact O-N 3.13Å
322	H	81.1	Confident	74.7	Confident	48 Å²	48	63.7 Å²	63.7	22%	0.222	34%	0.34	C	S	.	.	H	α-helix	trans	-60.4	-34.6	175.2	-82.9	-59.8	0	0	0	113.2	E318 Q319 L324	E318-H322 WeakPolarHBondContact O-CB 3.49Å; E318-H322 PolarHBondContact O-CD2 3.08Å; E318-H322 PolarHBondContact O-N 3.46Å; Q319-H322 PolarHBondContact O-N 2.99Å; H322-L324 VanDerWaalsContact C-N 3.31Å
323	A	81	Confident	73.3	Confident	17 Å²	17	60.4 Å²	60.4	14%	0.14	32%	0.315	C	S	.	.	H	α-helix	trans	-70.3	-27.7	177.1	0	0	0	0	0	112.9	C218 A220 I282 Q319 C320 L321	C218-A323 PolarHBondContact SG-O 3.24Å; A220-A323 WeakPolarHBondContact CB-O 3.47Å; A220-A323 PolarHBondContact N-O 3.23Å; I282-A323 HydrophobicContact CD1-CB 4.34Å; Q319-A323 WeakPolarHBondContact O-CB 3.14Å; Q319-A323 PolarHBondContact O-N 3.27Å; C320-A323 PolarHBondContact O-N 2.76Å; L321-A323 VanDerWaalsContact C-N 3.26Å; L321-A323 PolarHBondContact O-N 3.44Å
324	L	80.1	Confident	71.6	Confident	3 Å²	3	62.9 Å²	62.9	2%	0.016	32%	0.322	C	S	.	.	H	α-helix	trans	-88.2	-23.2	-178.1	-76.5	167	0	0	0	114.3	L214 C218 I282 P304 F307 T308 C320 L321 H322	L214-L324 HydrophobicContact CD2-CD2 3.54Å; C218-L324 WeakPolarHBondContact SG-CA 3.48Å; C218-L324 PolarHBondContact SG-O 2.77Å; I282-L324 HydrophobicContact CD1-CD1 4.37Å; I282-L324 HydrophobicContact CD1-CD2 3.51Å; I282-L324 HydrophobicContact CD1-CG 3.62Å; P304-L324 HydrophobicContact CB-CB 4.05Å; P304-L324 HydrophobicContact CB-CD1 4.33Å; P304-L324 HydrophobicContact CG-CB 4.42Å; F307-L324 HydrophobicContact CD1-CD1 3.43Å; F307-L324 VanDerWaalsContact CD1-CD1 3.43Å; F307-L324 HydrophobicContact CE1-CD1 3.85Å; F307-L324 HydrophobicContact CG-CD1 4.34Å; T308-L324 HydrophobicContact CG2-CD1 4.07Å; C320-L324 WeakPolarHBondContact O-CG 3.37Å; C320-L324 PolarHBondContact O-N 3.18Å; C320-L324 VanDerWaalsContact O-N 3.14Å; L321-L324 PolarHBondContact O-N 3.49Å; L321-L324 VanDerWaalsContact O-N 3.1Å; H322-L324 VanDerWaalsContact C-N 3.31Å
325	L	74.5	Confident	70	Confident	30 Å²	30	62.1 Å²	62.1	16%	0.157	32%	0.317	C	S	.	.	S	Bend	trans	-80.8	147	-179.1	-68.1	176.5	0	0	0	112.5	L321 V330	L321-L325 HydrophobicContact CD2-CD1 3.55Å; L321-L325 HydrophobicContact CD2-CG 4.31Å; L321-L325 HydrophobicContact CG-CD1 4.29Å; L321-L325 WeakPolarHBondContact O-CG 3.34Å; L321-L325 PolarHBondContact O-N 2.87Å; L321-L325 VanDerWaalsContact O-N 3.13Å; L325-V330 HydrophobicContact CB-CG2 4.08Å
326	P	69	Low	68.5	Low	26 Å²	26	65.3 Å²	65.3	17%	0.169	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-55.1	140.8	168.5	-25.6	34.8	0	0	0	112	P215 N328 E329 V330	P215-P326 HydrophobicContact CB-CG 3.88Å; P215-P326 HydrophobicContact CG-CG 3.7Å; P326-N328 PolarHBondContact O-N 3.43Å; P326-E329 PolarHBondContact O-N 2.9Å; P326-V330 PolarHBondContact O-N 3.33Å
327	G	61.5	Low	66.9	Low	24 Å²	24	68.2 Å²	68.2	25%	0.247	34%	0.337	C	S	.	.	H	α-helix	trans	-54.8	-21.8	-177.8	0	0	0	0	0	115.4	K331	G327-K331 WeakPolarHBondContact O-CG 3.48Å; G327-K331 PolarHBondContact O-N 3.2Å
328	N	60.8	Low	65	Low	123 Å²	123	73.4 Å²	73.4	66%	0.658	36%	0.356	S	S	*	.	H	α-helix	trans	-70	-35.7	176.1	-63.9	-4	0	0	0	112.2	P326	P326-N328 PolarHBondContact O-N 3.43Å
329	E	58.1	Low	63.1	Low	102 Å²	102	76.2 Å²	76.2	48%	0.477	37%	0.367	S	S	.	.	H	α-helix	trans	-80.5	-28.9	179.7	-60.6	-165	169.6	0	0	112.4	P326 K331 N332 T333	P326-E329 PolarHBondContact O-N 2.9Å; E329-K331 VanDerWaalsContact C-N 3.31Å; E329-K331 PolarHBondContact O-N 3.4Å; E329-N332 PolarHBondContact O-N 3.5Å; E329-T333 PolarHBondContact O-N 3.43Å; E329-T333 VanDerWaalsContact O-N 3.1Å; E329-T333 PolarHBondContact O-OG1 3.13Å; E329-T333 VanDerWaalsContact O-OG1 3.07Å
330	V	56.1	Low	61.4	Low	17 Å²	17	75.6 Å²	75.6	10%	0.103	37%	0.37	C	S	.	.	H	α-helix	trans	-67.1	-32.4	174.8	-178.7	0	0	0	0	111.7	L325 P326 T333 K334	L325-V330 HydrophobicContact CB-CG2 4.08Å; P326-V330 PolarHBondContact O-N 3.33Å; V330-T333 WeakPolarHBondContact CA-OG1 3.33Å; V330-T333 PolarHBondContact O-OG1 2.92Å; V330-K334 WeakPolarHBondContact O-CG 3.05Å; V330-K334 PolarHBondContact O-N 3.23Å
331	K	52.3	Low	59.5	Low	139 Å²	139	79.1 Å²	79.1	60%	0.604	39%	0.391	S	S	*	.	H	α-helix	trans	-68.8	-41.8	174.5	-71.4	176.5	-176.5	177.5	0	111.3	G327 E329 T333 K334 I335	G327-K331 WeakPolarHBondContact O-CG 3.48Å; G327-K331 PolarHBondContact O-N 3.2Å; E329-K331 VanDerWaalsContact C-N 3.31Å; E329-K331 PolarHBondContact O-N 3.4Å; K331-T333 PolarHBondContact O-N 3Å; K331-K334 PolarHBondContact O-N 3.4Å; K331-I335 WeakPolarHBondContact O-CD1 3.45Å; K331-I335 WeakPolarHBondContact O-CG1 3.5Å; K331-I335 PolarHBondContact O-N 3.26Å
332	N	52.1	Low	57.7	Low	95 Å²	95	81.6 Å²	81.6	51%	0.508	41%	0.405	S	S	.	.	H	α-helix	trans	-64.8	-41	179.3	-67.8	-13.9	0	0	0	112.2	E329 I335 Q336	E329-N332 PolarHBondContact O-N 3.5Å; N332-I335 PolarHBondContact O-N 3.04Å; N332-Q336 WeakPolarHBondContact O-CG 3.4Å; N332-Q336 PolarHBondContact O-N 2.98Å
333	T	52.4	Low	56.1	Low	48 Å²	48	86 Å²	86	29%	0.294	43%	0.425	S	S	.	.	H	α-helix	trans	-67.8	-36.9	176.9	45.7	0	0	0	0	113.2	E329 V330 K331 Q336 K337	E329-T333 PolarHBondContact O-N 3.43Å; E329-T333 VanDerWaalsContact O-N 3.1Å; E329-T333 PolarHBondContact O-OG1 3.13Å; E329-T333 VanDerWaalsContact O-OG1 3.07Å; V330-T333 WeakPolarHBondContact CA-OG1 3.33Å; V330-T333 PolarHBondContact O-OG1 2.92Å; K331-T333 PolarHBondContact O-N 3Å; T333-Q336 PolarHBondContact O-N 3.3Å; T333-K337 PolarHBondContact O-N 3.44Å
334	K	52.3	Low	54.3	Low	133 Å²	133	91.2 Å²	91.2	58%	0.578	45%	0.45	S	S	*	.	H	α-helix	trans	-67.3	-36.5	173.1	-73.8	-179.7	-179.4	-177.5	0	112.8	V330 K331 R338	V330-K334 WeakPolarHBondContact O-CG 3.05Å; V330-K334 PolarHBondContact O-N 3.23Å; K331-K334 PolarHBondContact O-N 3.4Å; K334-R338 WeakPolarHBondContact O-CG 3.5Å; K334-R338 PolarHBondContact O-N 3.32Å
335	I	51.6	Low	52.4	Low	91 Å²	91	96 Å²	96	47%	0.467	48%	0.483	S	S	.	.	H	α-helix	trans	-69.2	-39.9	177	-67.4	163	0	0	0	110.7	K331 N332 R338 K339	K331-I335 WeakPolarHBondContact O-CD1 3.45Å; K331-I335 WeakPolarHBondContact O-CG1 3.5Å; K331-I335 PolarHBondContact O-N 3.26Å; N332-I335 PolarHBondContact O-N 3.04Å; I335-R338 PolarHBondContact O-N 3.18Å; I335-K339 PolarHBondContact O-N 3.39Å; I335-K339 VanDerWaalsContact O-N 3.12Å
336	Q	50.6	Low	50.9	Low	129 Å²	129	104.9 Å²	104.9	60%	0.603	51%	0.514	S	S	*	.	H	α-helix	trans	-66.5	-44	176.2	-72.5	179.4	10.4	0	0	112.5	N332 T333 R338 K339 T340	N332-Q336 WeakPolarHBondContact O-CG 3.4Å; N332-Q336 PolarHBondContact O-N 2.98Å; T333-Q336 PolarHBondContact O-N 3.3Å; Q336-R338 VanDerWaalsContact C-N 3.25Å; Q336-R338 PolarHBondContact O-N 2.77Å; Q336-K339 PolarHBondContact O-N 2.97Å; Q336-K339 VanDerWaalsContact O-N 3.08Å; Q336-T340 PolarHBondContact O-N 3.32Å; Q336-T340 PolarHBondContact O-OG1 3.16Å; Q336-T340 VanDerWaalsContact O-OG1 3.1Å
337	K	51.7	Low	49.9	Very low	104 Å²	104	109 Å²	109	45%	0.452	54%	0.539	S	S	.	.	H	α-helix	trans	-59.9	-33.1	174.4	-77.8	-172.8	174.9	-176.6	0	112.5	E318 T333 T340 T341	E318-K337 IonicContact OE1-NZ 3.77Å; E318-K337 IonicContact OE2-NZ 2.93Å; E318-K337 PolarHBondContact OE2-NZ 3.01Å; T333-K337 PolarHBondContact O-N 3.44Å; K337-T340 PolarHBondContact O-OG1 3.43Å; K337-T341 WeakPolarHBondContact O-CB 3.11Å; K337-T341 VanDerWaalsContact O-CG2 3.27Å; K337-T341 WeakPolarHBondContact O-CG2 3.31Å; K337-T341 PolarHBondContact O-N 2.72Å; K337-T341 VanDerWaalsContact O-N 3.15Å; K337-T341 PolarHBondContact O-OG1 3.37Å
338	R	45.1	Very low	48.6	Very low	190 Å²	190	114 Å²	114	72%	0.717	56%	0.56	S	S	*	*	H	α-helix	trans	-74.1	-28.4	174.8	-78.1	-179.6	169.2	175.1	-3.6	113.8	K334 I335 Q336 T341 N342	K334-R338 WeakPolarHBondContact O-CG 3.5Å; K334-R338 PolarHBondContact O-N 3.32Å; I335-R338 PolarHBondContact O-N 3.18Å; Q336-R338 VanDerWaalsContact C-N 3.25Å; Q336-R338 PolarHBondContact O-N 2.77Å; R338-T341 WeakPolarHBondContact CA-OG1 3.28Å; R338-T341 PolarHBondContact O-OG1 2.79Å; R338-N342 WeakPolarHBondContact O-CB 3.45Å; R338-N342 PolarHBondContact O-N 2.99Å; R338-N342 PolarHBondContact O-ND2 2.92Å
339	K	43.5	Very low	47.4	Very low	142 Å²	142	112.4 Å²	112.4	62%	0.617	55%	0.554	S	S	*	*	H	α-helix	trans	-75.4	-43.4	175	-75.7	-177	175.9	-174	0	111.6	I335 Q336 E343	I335-K339 PolarHBondContact O-N 3.39Å; I335-K339 VanDerWaalsContact O-N 3.12Å; Q336-K339 PolarHBondContact O-N 2.97Å; Q336-K339 VanDerWaalsContact O-N 3.08Å; K339-E343 WeakPolarHBondContact O-CG 3.44Å; K339-E343 PolarHBondContact O-N 3.36Å; K339-E343 VanDerWaalsContact O-N 3.15Å
340	T	47.3	Very low	46.5	Very low	76 Å²	76	116.2 Å²	116.2	47%	0.466	58%	0.577	S	S	.	*	H	α-helix	trans	-71.3	-35.2	178.6	45.9	0	0	0	0	113.6	Q336 K337 E343 L344	Q336-T340 PolarHBondContact O-N 3.32Å; Q336-T340 PolarHBondContact O-OG1 3.16Å; Q336-T340 VanDerWaalsContact O-OG1 3.1Å; K337-T340 PolarHBondContact O-OG1 3.43Å; T340-E343 PolarHBondContact O-N 3.38Å; T340-L344 WeakPolarHBondContact O-CD1 3.35Å; T340-L344 PolarHBondContact O-N 2.91Å
341	T	46	Very low	45.5	Very low	74 Å²	74	119.4 Å²	119.4	45%	0.454	60%	0.6	S	S	.	*	H	α-helix	trans	-70.8	-36	175.4	47.6	0	0	0	0	112.9	K337 R338 E343 C345	K337-T341 WeakPolarHBondContact O-CB 3.11Å; K337-T341 VanDerWaalsContact O-CG2 3.27Å; K337-T341 WeakPolarHBondContact O-CG2 3.31Å; K337-T341 PolarHBondContact O-N 2.72Å; K337-T341 VanDerWaalsContact O-N 3.15Å; K337-T341 PolarHBondContact O-OG1 3.37Å; R338-T341 WeakPolarHBondContact CA-OG1 3.28Å; R338-T341 PolarHBondContact O-OG1 2.79Å; T341-E343 VanDerWaalsContact C-N 3.31Å; T341-E343 PolarHBondContact O-N 3.41Å; T341-C345 VanDerWaalsContact O-CB 3.32Å; T341-C345 WeakPolarHBondContact O-CB 3.18Å; T341-C345 PolarHBondContact O-N 2.99Å; T341-C345 PolarHBondContact O-SG 3.19Å; T341-C345 VanDerWaalsContact O-SG 3.34Å
342	N	43.6	Very low	44.5	Very low	102 Å²	102	120.3 Å²	120.3	55%	0.545	61%	0.611	S	S	.	*	H	α-helix	trans	-74	-19.5	174.2	-81.2	-15.3	0	0	0	113.7	R338 R346	R338-N342 WeakPolarHBondContact O-CB 3.45Å; R338-N342 PolarHBondContact O-N 2.99Å; R338-N342 PolarHBondContact O-ND2 2.92Å; N342-R346 WeakPolarHBondContact O-CG 3.48Å
343	E	47.8	Very low	43.5	Very low	140 Å²	140	121.6 Å²	121.6	65%	0.654	62%	0.623	S	S	*	*	H	α-helix	trans	-87.3	-34.8	173.8	-77.6	-180	174.7	0	0	112.6	K339 T340 T341	K339-E343 WeakPolarHBondContact O-CG 3.44Å; K339-E343 PolarHBondContact O-N 3.36Å; K339-E343 VanDerWaalsContact O-N 3.15Å; T340-E343 PolarHBondContact O-N 3.38Å; T341-E343 VanDerWaalsContact C-N 3.31Å; T341-E343 PolarHBondContact O-N 3.41Å
344	L	44.5	Very low	42.5	Very low	127 Å²	127	125.8 Å²	125.8	67%	0.665	64%	0.643	S	S	*	*	H	α-helix	trans	-73.8	-36.9	173.4	-96.1	80.6	0	0	0	113	T340 R346 V347	T340-L344 WeakPolarHBondContact O-CD1 3.35Å; T340-L344 PolarHBondContact O-N 2.91Å; L344-R346 PolarHBondContact O-N 2.91Å; L344-V347 PolarHBondContact O-N 3.27Å
345	C	38.7	Very low	41.7	Very low	103 Å²	103	124.5 Å²	124.5	70%	0.696	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-0.2	-178.5	-68.6	0	0	0	0	114.9	T341	T341-C345 VanDerWaalsContact O-CB 3.32Å; T341-C345 WeakPolarHBondContact O-CB 3.18Å; T341-C345 PolarHBondContact O-N 2.99Å; T341-C345 PolarHBondContact O-SG 3.19Å; T341-C345 VanDerWaalsContact O-SG 3.34Å
346	R	44.4	Very low	41.1	Very low	217 Å²	217	128.4 Å²	128.4	82%	0.819	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-11.3	175.4	-82.6	-179.1	169.2	152.2	-3.2	114	N342 L344	N342-R346 WeakPolarHBondContact O-CG 3.48Å; L344-R346 PolarHBondContact O-N 2.91Å
347	V	47.4	Very low	40	Very low	113 Å²	113	131.8 Å²	131.8	69%	0.685	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	-22	-173.5	-175.3	0	0	0	0	111.8	L344 V349	L344-V347 PolarHBondContact O-N 3.27Å; V347-V349 PolarHBondContact O-N 2.99Å
348	D	33.6	Very low	39.1	Very low	130 Å²	130	134.6 Å²	134.6	70%	0.695	70%	0.699	S	S	*	*	S	Bend	trans	-96	85.5	178.4	-67.3	-29.8	0	0	0	112.7
349	V	37.2	Very low	38.2	Very low	88 Å²	88	132.8 Å²	132.8	53%	0.533	70%	0.703	S	S	.	*				58.8	97.9	119.2	-179.9	0	0	0	0	115	V347 S351	V347-V349 PolarHBondContact O-N 2.99Å; V349-S351 PolarHBondContact O-N 3.37Å
350	L	38.3	Very low	38	Very low	182 Å²	182	131.2 Å²	131.2	95%	0.953	71%	0.71	S	S	*	*				38.7	51.1	81	-68.2	116.7	0	0	0	113.3
351	S	34.4	Very low	37.3	Very low	84 Å²	84	136.6 Å²	136.6	59%	0.587	73%	0.73	S	S	*	*			trans	-154.4	119.1	160.1	56.9	0	0	0	0	111.7	V349	V349-S351 PolarHBondContact O-N 3.37Å
352	N	33	Very low	36.8	Very low	159 Å²	159	138.3 Å²	138.3	85%	0.85	75%	0.745	S	S	*	*			trans	81.9	94.3	152.4	-58.8	-10.2	0	0	0	118.9
353	T	30.2	Very low	36.5	Very low	121 Å²	121	140.6 Å²	140.6	74%	0.742	76%	0.757	S	S	*	*			trans	-60.8	166.6	154.4	41.4	0	0	0	0	113.8
354	D	30.7	Very low	36.1	Very low	137 Å²	137	143.6 Å²	143.6	73%	0.733	77%	0.768	S	S	*	*			trans	79.4	115.3	159.4	-52.1	-38.5	0	0	0	115.7
355	S	35.9	Very low	35.8	Very low	106 Å²	106	145.5 Å²	145.5	74%	0.741	78%	0.779	S	S	*	*				178.3	130.5	60.7	28	0	0	0	0	112.7
356	Q	38.7	Very low	35.6	Very low	172 Å²	172	144.2 Å²	144.2	80%	0.804	78%	0.783	S	S	*	*			trans	45.9	113.3	130	-55.1	-179.7	23.4	0	0	120.5
357	F	27.8	Very low	35.3	Very low	201 Å²	201	142.1 Å²	142.1	88%	0.882	79%	0.788	S	S	*	*				58	122.1	99.3	-88.9	-86.6	0	0	0	116.9
358	I	32.9	Very low	34.7	Very low	162 Å²	162	139.5 Å²	139.5	83%	0.831	78%	0.784	S	S	*	*			trans	-169.4	128.9	131	-90.1	147.7	0	0	0	110.3
359	D	26.3	Very low	34.8	Very low	153 Å²	153	138.7 Å²	138.7	82%	0.818	79%	0.789	S	S	*	*			trans	-91.5	140.5	172.4	-148.4	-0.8	0	0	0	108.2
360	S	38.4	Very low	34.8	Very low	108 Å²	108	143.2 Å²	143.2	76%	0.755	81%	0.808	S	S	*	*			trans	-153.5	110.4	171.4	-78.8	0	0	0	0	113.3
361	Q	34.5	Very low	34.8	Very low	189 Å²	189	138.7 Å²	138.7	88%	0.883	79%	0.791	S	S	*	*			trans	-63.1	137.3	167.6	-67.3	165.3	-12.5	0	0	111.1
362	S	35.6	Very low	34.8	Very low	111 Å²	111	138.3 Å²	138.3	78%	0.776	80%	0.801	S	S	*	*			trans	-134.1	122.7	155.2	75.2	0	0	0	0	111.1
363	N	36.1	Very low	35	Very low	149 Å²	149	138.9 Å²	138.9	80%	0.797	80%	0.797	S	S	*	*			trans	-75.6	127.9	174.6	-66.1	-58	0	0	0	109.1
364	K	39	Very low	35.7	Very low	204 Å²	204	139.5 Å²	139.5	89%	0.887	80%	0.795	S	S	*	*			trans	-111.1	100.8	164.2	-88.6	-176.1	175.2	174.9	0	108.9
365	D	38.1	Very low	36.1	Very low	167 Å²	167	138 Å²	138	89%	0.893	79%	0.787	S	S	*	*			trans	-75.2	115.1	163.9	-72.5	-49.2	0	0	0	108.9
366	G	34.7	Very low	36.5	Very low	76 Å²	76	138.6 Å²	138.6	78%	0.784	78%	0.782	S	S	*	*			trans	-128.8	104.1	174.8	0	0	0	0	0	109.7
367	D	38.9	Very low	36.6	Very low	172 Å²	172	134.2 Å²	134.2	92%	0.92	77%	0.77	S	S	*	*			trans	-66.2	147.1	166.7	-174.7	12.7	0	0	0	110.4
368	G	34.7	Very low	37.1	Very low	59 Å²	59	130.2 Å²	130.2	61%	0.608	76%	0.758	S	S	*	*			trans	109.3	76.3	169	0	0	0	0	0	116.1
369	S	36.5	Very low	37.5	Very low	112 Å²	112	130.4 Å²	130.4	78%	0.783	76%	0.755	S	S	*	*				172.3	117.1	125.8	-79.4	0	0	0	0	110.3	S371	S369-S371 PolarHBondContact O-N 2.99Å
370	I	35.5	Very low	38.1	Very low	183 Å²	183	133 Å²	133	94%	0.938	76%	0.76	S	S	*	*			trans	-75.3	74.8	166.4	-171.1	164.3	0	0	0	108
371	S	38.6	Very low	38.1	Very low	87 Å²	87	135.2 Å²	135.2	61%	0.608	76%	0.763	S	S	*	*			trans	-91.5	125.2	165	54.4	0	0	0	0	108.3	S369 F373	S369-S371 PolarHBondContact O-N 2.99Å; S371-F373 PolarHBondContact O-N 3.36Å
372	G	35.9	Very low	38.3	Very low	77 Å²	77	130.1 Å²	130.1	79%	0.794	75%	0.753	S	S	*	*			trans	-57.7	98.7	177.2	0	0	0	0	0	110	D374	G372-D374 PolarHBondContact O-N 3.37Å
373	F	36.8	Very low	38.6	Very low	171 Å²	171	130.4 Å²	130.4	75%	0.75	75%	0.752	S	S	*	*			trans	-97.3	56.4	167.9	-136.4	-81	0	0	0	108	S371 D375	S371-F373 PolarHBondContact O-N 3.36Å; F373-D375 HydrophobicContact CD1-CB 4.09Å; F373-D375 HydrophobicContact CE1-CB 3.98Å; F373-D375 PolarHBondContact O-N 3.19Å
374	D	44.2	Very low	38.7	Very low	133 Å²	133	129 Å²	129	71%	0.711	74%	0.744	S	S	*	*			trans	-90.7	71.4	155.6	-70.9	-35.5	0	0	0	105.6	G372 D376	G372-D374 PolarHBondContact O-N 3.37Å; D374-D376 PolarHBondContact O-N 3.11Å
375	D	38.6	Very low	39.1	Very low	107 Å²	107	127.9 Å²	127.9	57%	0.572	74%	0.742	S	S	*	*			trans	-78.8	71.5	166.5	-170.7	17.4	0	0	0	107.7	F373 S377	F373-D375 HydrophobicContact CD1-CB 4.09Å; F373-D375 HydrophobicContact CE1-CB 3.98Å; F373-D375 PolarHBondContact O-N 3.19Å; D375-S377 VanDerWaalsContact C-N 3.34Å; D375-S377 PolarHBondContact OD1-OG 2.89Å
376	D	45	Very low	39.5	Very low	117 Å²	117	129.4 Å²	129.4	63%	0.626	74%	0.735	S	S	*	*			trans	-102.6	45.6	164.4	-82.3	-33.1	0	0	0	108.2	D374	D374-D376 PolarHBondContact O-N 3.11Å
377	S	40.6	Very low	39.8	Very low	80 Å²	80	130.8 Å²	130.8	56%	0.559	73%	0.725	S	S	*	*			trans	-97.1	79.9	163.5	62.4	0	0	0	0	109.7	D375 Q379	D375-S377 VanDerWaalsContact C-N 3.34Å; D375-S377 PolarHBondContact OD1-OG 2.89Å; S377-Q379 PolarHBondContact O-N 3.36Å
378	D	37.4	Very low	40	Very low	117 Å²	117	129.4 Å²	129.4	63%	0.626	72%	0.716	S	S	*	*			trans	-63.8	82.9	160.2	-84.8	-36.6	0	0	0	108.1
379	Q	42.9	Very low	40.5	Very low	166 Å²	166	132.5 Å²	132.5	78%	0.776	72%	0.723	S	S	*	*			trans	-101.1	105	164.3	-108.2	171.7	37	0	0	108.5	S377 L381	S377-Q379 PolarHBondContact O-N 3.36Å; Q379-L381 PolarHBondContact O-N 3.37Å
380	F	37.2	Very low	40.6	Very low	209 Å²	209	133 Å²	133	92%	0.917	72%	0.717	S	S	*	*			trans	25.4	84.5	163.3	-84.7	-96.5	0	0	0	114.9	A382	F380-A382 VanDerWaalsContact C-N 3.3Å; F380-A382 PolarHBondContact O-N 3.35Å
381	L	39.2	Very low	41	Very low	154 Å²	154	130.4 Å²	130.4	81%	0.806	71%	0.712	S	S	*	*			trans	-65.3	96.2	164.4	-69.3	175.5	0	0	0	108.5	Q379	Q379-L381 PolarHBondContact O-N 3.37Å
382	A	39	Very low	41.1	Very low	82 Å²	82	132 Å²	132	68%	0.678	72%	0.718	S	S	*	*			trans	-50.9	144.3	160.5	0	0	0	0	0	109.1	F380 D384	F380-A382 VanDerWaalsContact C-N 3.3Å; F380-A382 PolarHBondContact O-N 3.35Å; A382-D384 PolarHBondContact O-N 3.42Å
383	P	41.9	Very low	41.3	Very low	117 Å²	117	133 Å²	133	76%	0.76	72%	0.719	S	S	*	*			trans	-57.1	128.7	-177.3	-19.4	30.5	0	0	0	110.9	E385	P383-E385 PolarHBondContact O-N 2.93Å
384	D	38.5	Very low	41.7	Very low	118 Å²	118	129 Å²	129	63%	0.631	72%	0.717	S	S	*	*			trans	-53	107.6	168.6	-111.2	-46	0	0	0	108.8	A382 R386	A382-D384 PolarHBondContact O-N 3.42Å; D384-R386 PolarHBondContact O-N 3.34Å; D384-R386 IonicContact OD1-CZ 2.58Å; D384-R386 IonicContact OD1-NE 3.3Å; D384-R386 PolarHBondContact OD1-NE 3.22Å; D384-R386 IonicContact OD1-NH2 2.6Å; D384-R386 PolarHBondContact OD1-NH2 3.33Å
385	E	46.4	Very low	41.6	Very low	182 Å²	182	130 Å²	130	85%	0.85	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	23.7	176.8	-71	-165.1	143.1	0	0	113.8	P383	P383-E385 PolarHBondContact O-N 2.93Å
386	R	46.6	Very low	41.8	Very low	198 Å²	198	134.1 Å²	134.1	75%	0.747	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	12.1	-170.7	-73	-175.2	-69.6	-178.6	-4.8	116.4	D384	D384-R386 PolarHBondContact O-N 3.34Å; D384-R386 IonicContact OD1-CZ 2.58Å; D384-R386 IonicContact OD1-NE 3.3Å; D384-R386 PolarHBondContact OD1-NE 3.22Å; D384-R386 IonicContact OD1-NH2 2.6Å; D384-R386 PolarHBondContact OD1-NH2 3.33Å
387	D	41.3	Very low	41.7	Very low	105 Å²	105	133.3 Å²	133.3	56%	0.561	74%	0.742	S	S	*	*			trans	-122.8	58.3	175.1	-69.3	-20.2	0	0	0	110.9	V389 K408	D387-V389 PolarHBondContact O-N 2.94Å; D387-K408 IonicContact OD2-NZ 2.67Å; D387-K408 PolarHBondContact OD2-NZ 3.4Å
388	I	42.9	Very low	42	Very low	143 Å²	143	135 Å²	135	73%	0.733	75%	0.749	S	S	*	*			trans	-81.9	96	154.3	-62.1	177.3	0	0	0	105.3	N390	I388-N390 PolarHBondContact O-N 2.93Å; I388-N390 VanDerWaalsContact O-N 3.1Å
389	V	44.8	Very low	42.5	Very low	125 Å²	125	139 Å²	139	76%	0.758	76%	0.764	S	S	*	*			trans	-65.1	107.1	167.5	176.2	0	0	0	0	106.2	D387 P391	D387-V389 PolarHBondContact O-N 2.94Å; V389-P391 VanDerWaalsContact O-CD 3.25Å; V389-P391 WeakPolarHBondContact O-CD 3.44Å
390	N	39.7	Very low	43.2	Very low	122 Å²	122	137.4 Å²	137.4	65%	0.652	76%	0.761	S	S	*	*			trans	-59.5	116.7	166.3	-73.3	-30.4	0	0	0	108.1	I388 T392	I388-N390 PolarHBondContact O-N 2.93Å; I388-N390 VanDerWaalsContact O-N 3.1Å; N390-T392 PolarHBondContact O-N 3.39Å
391	P	43.7	Very low	44.4	Very low	129 Å²	129	134.7 Å²	134.7	84%	0.838	76%	0.755	S	S	*	*			trans	-80.1	79.9	164.6	28.3	-17.3	0	0	0	106.5	V389	V389-P391 VanDerWaalsContact O-CD 3.25Å; V389-P391 WeakPolarHBondContact O-CD 3.44Å
392	T	40.8	Very low	46.1	Very low	120 Å²	120	133.2 Å²	133.2	74%	0.736	75%	0.754	S	S	*	*			trans	-82.3	123.9	167.7	-35.2	0	0	0	0	107.7	N390	N390-T392 PolarHBondContact O-N 3.39Å
393	A	40.4	Very low	48.2	Very low	97 Å²	97	136.8 Å²	136.8	80%	0.802	76%	0.762	S	S	*	*			trans	74.3	88.1	166.2	0	0	0	0	0	117
394	A	43.8	Very low	50.3	Low	87 Å²	87	142.7 Å²	142.7	72%	0.719	77%	0.769	S	S	*	*			trans	-162.2	116.9	131.7	0	0	0	0	0	109.7
395	D	42.8	Very low	52.8	Low	156 Å²	156	143 Å²	143	83%	0.834	78%	0.778	S	S	*	*			trans	73.6	105.3	143.5	-54.6	-19.9	0	0	0	120.1
396	Q	43.6	Very low	54.9	Low	192 Å²	192	139.6 Å²	139.6	90%	0.897	76%	0.764	S	S	*	*			trans	-61.1	120	158.8	-59.4	166.7	7.4	0	0	109.3
397	S	43	Very low	57	Low	101 Å²	101	132.6 Å²	132.6	71%	0.706	75%	0.746	S	S	*	*			trans	167.9	158.1	138.3	46.8	0	0	0	0	109.6
398	T	46	Very low	59.5	Low	115 Å²	115	132.1 Å²	132.1	71%	0.706	74%	0.738	S	S	*	*			trans	72.9	106.9	173.4	62	0	0	0	0	116.6	D400	T398-D400 VanDerWaalsContact C-N 3.32Å; T398-D400 PolarHBondContact O-N 3.39Å
399	H	47.7	Very low	61.9	Low	202 Å²	202	133.1 Å²	133.1	94%	0.935	74%	0.74	S	S	*	*			trans	-48.7	90.6	158.6	-104.1	-81.5	0	0	0	110.1
400	D	57.6	Low	64.2	Low	132 Å²	132	133 Å²	133	71%	0.706	73%	0.734	S	S	*	*			trans	-147.9	147.2	170.2	-81.5	-49.4	0	0	0	108.6	T398	T398-D400 VanDerWaalsContact C-N 3.32Å; T398-D400 PolarHBondContact O-N 3.39Å
401	L	63.2	Low	66.8	Low	151 Å²	151	132.5 Å²	132.5	79%	0.791	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-46.2	148.8	-172.9	-75.8	83.4	0	0	0	112.4	N403	L401-N403 PolarHBondContact O-N 3.23Å
402	P	73.7	Confident	69.3	Low	123 Å²	123	131.7 Å²	131.7	80%	0.799	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-55	117.1	177.2	23.1	-33.1	0	0	0	110.5	R404	P402-R404 PolarHBondContact O-N 2.88Å
403	N	84.1	Confident	71.9	Confident	158 Å²	158	132.6 Å²	132.6	85%	0.845	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-53.3	124.4	174.8	-84.7	-19.8	0	0	0	109.4	L401 P405	L401-N403 PolarHBondContact O-N 3.23Å; N403-P405 VanDerWaalsContact O-CD 3.31Å; N403-P405 WeakPolarHBondContact O-CD 3.4Å
404	R	85.9	Confident	74.2	Confident	241 Å²	241	134.8 Å²	134.8	91%	0.909	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-69.1	116.6	176.4	-63.8	175.1	71.5	-168.8	3.4	108.3	P402	P402-R404 PolarHBondContact O-N 2.88Å
405	P	89.8	Confident	76.5	Confident	125 Å²	125	133.6 Å²	133.6	81%	0.812	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-66.7	150	179.6	27.7	-34.2	0	0	0	111.1	N403	N403-P405 VanDerWaalsContact O-CD 3.31Å; N403-P405 WeakPolarHBondContact O-CD 3.4Å
406	I	90.9	Very high	78.8	Confident	110 Å²	110	135 Å²	135	56%	0.564	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-62.8	134.1	172.9	-172.3	171.6	0	0	0	110.5	I410 M411	I406-I410 HydrophobicContact CD1-CB 4.25Å; I406-I410 HydrophobicContact CD1-CG2 3.82Å; I406-I410 HydrophobicContact CG1-CB 3.93Å; I406-I410 HydrophobicContact CG1-CG2 3.95Å; I406-M411 HydrophobicContact CD1-CB 4.17Å; I406-M411 HydrophobicContact CG1-CB 4.34Å; I406-M411 HydrophobicContact CG2-CB 4.46Å
407	S	91.9	Very high	81	Confident	51 Å²	51	129.8 Å²	129.8	36%	0.357	69%	0.687	S	S	.	*	P	Polyproline II helix	trans	-71.6	151.4	176.5	77.5	0	0	0	0	111.1	E409 I410 M411	S407-E409 PolarHBondContact O-N 2.9Å; S407-E409 VanDerWaalsContact O-N 3.16Å; S407-I410 PolarHBondContact O-N 3.21Å; S407-I410 WeakPolarHBondContact OG-CD1 3.27Å; S407-I410 WeakPolarHBondContact OG-CG1 3.36Å; S407-I410 PolarHBondContact OG-N 3.07Å; S407-M411 WeakPolarHBondContact O-CB 3.13Å; S407-M411 PolarHBondContact O-N 3.38Å
408	K	92.9	Very high	83.4	Confident	94 Å²	94	133.3 Å²	133.3	41%	0.409	69%	0.69	S	S	.	*	H	α-helix	trans	-57.3	-29.6	176.8	-107	175.1	179.3	173	0	113.3	D387 M411 K412	D387-K408 IonicContact OD2-NZ 2.67Å; D387-K408 PolarHBondContact OD2-NZ 3.4Å; K408-M411 HydrophobicContact CG-CE 3.89Å; K408-K412 WeakPolarHBondContact O-CB 3.46Å; K408-K412 WeakPolarHBondContact O-CG 3.35Å; K408-K412 PolarHBondContact O-N 3.13Å
409	E	93.7	Very high	85.6	Confident	165 Å²	165	134.5 Å²	134.5	77%	0.771	68%	0.682	S	S	*	*	H	α-helix	trans	-67.8	-48.8	179.3	-65.5	179.7	173.3	0	0	111	S407 N413	S407-E409 PolarHBondContact O-N 2.9Å; S407-E409 VanDerWaalsContact O-N 3.16Å; E409-N413 PolarHBondContact O-N 3.42Å
410	I	93.6	Very high	87.5	Confident	122 Å²	122	132 Å²	132	63%	0.626	66%	0.664	S	S	*	*	H	α-helix	trans	-67.1	-44.8	177	-59.5	166.4	0	0	0	109.6	I406 S407 K412 N413	I406-I410 HydrophobicContact CD1-CB 4.25Å; I406-I410 HydrophobicContact CD1-CG2 3.82Å; I406-I410 HydrophobicContact CG1-CB 3.93Å; I406-I410 HydrophobicContact CG1-CG2 3.95Å; S407-I410 PolarHBondContact O-N 3.21Å; S407-I410 WeakPolarHBondContact OG-CD1 3.27Å; S407-I410 WeakPolarHBondContact OG-CG1 3.36Å; S407-I410 PolarHBondContact OG-N 3.07Å; I410-K412 PolarHBondContact O-N 3.03Å; I410-N413 PolarHBondContact O-N 3.15Å
411	M	94.5	Very high	89	Confident	112 Å²	112	128.6 Å²	128.6	55%	0.552	64%	0.644	S	S	*	*	H	α-helix	trans	-60.7	-41.4	-179.9	-177	-179.1	64.7	0	0	113.1	I406 S407 K408	I406-M411 HydrophobicContact CD1-CB 4.17Å; I406-M411 HydrophobicContact CG1-CB 4.34Å; I406-M411 HydrophobicContact CG2-CB 4.46Å; S407-M411 WeakPolarHBondContact O-CB 3.13Å; S407-M411 PolarHBondContact O-N 3.38Å; K408-M411 HydrophobicContact CG-CE 3.89Å
412	K	95.9	Very high	90.4	Very high	111 Å²	111	129.2 Å²	129.2	48%	0.483	64%	0.641	S	S	.	*	H	α-helix	trans	-89.1	-17.7	-178	-65.8	-174.3	-178.8	-178.9	0	113.7	K408 I410 K414	K408-K412 WeakPolarHBondContact O-CB 3.46Å; K408-K412 WeakPolarHBondContact O-CG 3.35Å; K408-K412 PolarHBondContact O-N 3.13Å; I410-K412 PolarHBondContact O-N 3.03Å; K412-K414 HydrophobicContact CB-CG 4.02Å; K412-K414 PolarHBondContact O-N 2.48Å; K412-K414 VanDerWaalsContact O-N 3.12Å
413	N	93.9	Very high	91	Very high	139 Å²	139	126.5 Å²	126.5	74%	0.743	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	41.5	48.5	-177.5	-167.3	20.2	0	0	0	113.7	E409 I410 G415	E409-N413 PolarHBondContact O-N 3.42Å; I410-N413 PolarHBondContact O-N 3.15Å; N413-G415 VanDerWaalsContact C-N 3.31Å; N413-G415 PolarHBondContact O-N 3Å
414	K	89.9	Confident	91.3	Very high	143 Å²	143	123.8 Å²	123.8	62%	0.622	60%	0.596	S	S	*	*			trans	-72.3	-24.4	-175.7	-73.6	-175.9	176.4	-178.5	0	113.2	K412 V417	K412-K414 HydrophobicContact CB-CG 4.02Å; K412-K414 PolarHBondContact O-N 2.48Å; K412-K414 VanDerWaalsContact O-N 3.12Å; K414-V417 WeakPolarHBondContact O-CG2 3.48Å
415	G	91.2	Very high	91.6	Very high	62 Å²	62	121.6 Å²	121.6	64%	0.639	59%	0.588	S	S	*	*			trans	57.8	-153.6	-173.8	0	0	0	0	0	113.3	N413 V417	N413-G415 VanDerWaalsContact C-N 3.31Å; N413-G415 PolarHBondContact O-N 3Å; G415-V417 VanDerWaalsContact C-N 3.28Å; G415-V417 PolarHBondContact O-N 2.93Å
416	I	92.2	Very high	91.8	Very high	186 Å²	186	118.9 Å²	118.9	95%	0.954	57%	0.567	S	S	*	*	S	Bend	trans	-85.9	63.8	-176.8	-47	173.8	0	0	0	110.2
417	V	89.4	Confident	92.1	Very high	83 Å²	83	118 Å²	118	50%	0.503	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-84.8	126.5	175.2	169.6	0	0	0	0	110	K414 G415	K414-V417 WeakPolarHBondContact O-CG2 3.48Å; G415-V417 VanDerWaalsContact C-N 3.28Å; G415-V417 PolarHBondContact O-N 2.93Å
418	K	92.5	Very high	92.4	Very high	174 Å²	174	123.8 Å²	123.8	76%	0.757	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-55.2	148.7	174.1	70.2	177.9	-178	179.4	0	112.1
419	Y	92.3	Very high	92.6	Very high	140 Å²	140	122.3 Å²	122.3	55%	0.549	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-57	141	172.9	176.2	-110.7	0	0	0	111.5
420	R	87.9	Confident	92.7	Very high	150 Å²	150	117.6 Å²	117.6	57%	0.566	56%	0.559	S	S	*	*			trans	-127.8	134.6	174.6	-58.9	-176.1	-166	133.8	2.4	108.9
421	H	89.9	Confident	92.9	Very high	61 Å²	61	117 Å²	117	28%	0.282	56%	0.556	S	S	.	*			trans	-63.4	143.8	-176.8	-169.4	-43.7	0	0	0	111.6	R423 E424	H421-R423 HydrophobicContact CB-CG 4.29Å; H421-R423 VanDerWaalsContact CD2-CZ 3.42Å; H421-R423 PolarHBondContact ND1-N 3.14Å; H421-R423 PolarHBondContact NE2-NH1 3.12Å; H421-R423 PolarHBondContact O-N 2.62Å; H421-E424 HydrophobicContact CB-CG 4.46Å; H421-E424 WeakPolarHBondContact O-CB 3.36Å; H421-E424 PolarHBondContact O-N 3Å
422	K	92.2	Very high	93	Very high	164 Å²	164	120.8 Å²	120.8	71%	0.713	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-46.9	-34.1	177.7	-169.4	174	-178.6	175.9	0	115	E424 R425	K422-E424 VanDerWaalsContact C-N 3.33Å; K422-E424 PolarHBondContact O-N 3.35Å; K422-R425 WeakPolarHBondContact O-CB 3.23Å; K422-R425 PolarHBondContact O-N 3.08Å
423	R	85.9	Confident	93	Very high	66 Å²	66	118.4 Å²	118.4	25%	0.249	55%	0.553	C	S	.	*	G	3₁₀ helix	trans	-70.1	-26	179.8	68.2	-167.4	174.6	-151	-6.4	113.7	H421 R425 H430	H421-R423 HydrophobicContact CB-CG 4.29Å; H421-R423 VanDerWaalsContact CD2-CZ 3.42Å; H421-R423 PolarHBondContact ND1-N 3.14Å; H421-R423 PolarHBondContact NE2-NH1 3.12Å; H421-R423 PolarHBondContact O-N 2.62Å; R423-R425 VanDerWaalsContact C-N 3.29Å; R423-H430 WeakPolarHBondContact O-CB 3.19Å; R423-H430 PolarHBondContact O-N 3.36Å
424	E	91.4	Very high	93.1	Very high	100 Å²	100	117.8 Å²	117.8	47%	0.467	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-79.3	-14.4	179.4	-62.6	179.2	178.9	0	0	112.3	H421 K422 N426	H421-E424 HydrophobicContact CB-CG 4.46Å; H421-E424 WeakPolarHBondContact O-CB 3.36Å; H421-E424 PolarHBondContact O-N 3Å; K422-E424 VanDerWaalsContact C-N 3.33Å; K422-E424 PolarHBondContact O-N 3.35Å; E424-N426 VanDerWaalsContact C-N 3.3Å; E424-N426 PolarHBondContact O-N 3.37Å
425	R	92	Very high	93.5	Very high	195 Å²	195	119 Å²	119	74%	0.736	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-67.6	-30	176.2	-60	-174.1	-176.7	-177.1	2.9	112.7	K422 R423	K422-R425 WeakPolarHBondContact O-CB 3.23Å; K422-R425 PolarHBondContact O-N 3.08Å; R423-R425 VanDerWaalsContact C-N 3.29Å
426	N	94.3	Very high	93.7	Very high	68 Å²	68	123 Å²	123	36%	0.364	54%	0.541	S	S	.	.	S	Bend	trans	-121.2	106.2	-179.9	-172.1	-35.4	0	0	0	109.8	E424 R428 V429 H430	E424-N426 VanDerWaalsContact C-N 3.3Å; E424-N426 PolarHBondContact O-N 3.37Å; N426-R428 PolarHBondContact O-N 2.74Å; N426-R428 VanDerWaalsContact O-N 3.12Å; N426-R428 WeakPolarHBondContact OD1-CB 3.32Å; N426-R428 PolarHBondContact OD1-N 2.8Å; N426-R428 VanDerWaalsContact OD1-N 3.13Å; N426-V429 HydrophobicContact CB-CB 4.08Å; N426-V429 HydrophobicContact CB-CG2 3.82Å; N426-V429 WeakPolarHBondContact O-CB 3.48Å; N426-V429 PolarHBondContact O-N 3.18Å; N426-H430 PolarHBondContact O-N 3.48Å
427	P	97.4	Very high	93.9	Very high	92 Å²	92	117.9 Å²	117.9	60%	0.597	51%	0.512	S	S	*	.	H	α-helix	trans	-53.2	-36	-177.1	-28.3	34.8	0	0	0	113.8	H430 L431	P427-H430 PolarHBondContact O-N 3.28Å; P427-L431 WeakPolarHBondContact O-CB 3.46Å; P427-L431 WeakPolarHBondContact O-CG 3.36Å; P427-L431 PolarHBondContact O-N 3.49Å
428	R	97.7	Very high	94.2	Very high	173 Å²	173	116.3 Å²	116.3	65%	0.653	51%	0.508	S	S	*	.	H	α-helix	trans	-63.7	-43.2	176.5	-176.7	-174.9	63.5	107.2	-1.4	111.7	N426 L431 R432	N426-R428 PolarHBondContact O-N 2.74Å; N426-R428 VanDerWaalsContact O-N 3.12Å; N426-R428 WeakPolarHBondContact OD1-CB 3.32Å; N426-R428 PolarHBondContact OD1-N 2.8Å; N426-R428 VanDerWaalsContact OD1-N 3.13Å; R428-L431 PolarHBondContact O-N 3.39Å; R428-R432 WeakPolarHBondContact O-CB 3.47Å; R428-R432 PolarHBondContact O-N 3.09Å
429	V	96.1	Very high	94.3	Very high	62 Å²	62	109.8 Å²	109.8	38%	0.376	48%	0.482	S	S	.	.	H	α-helix	trans	-67.2	-41.9	178.6	178.9	0	0	0	0	110.2	N426 R432 Y433	N426-V429 HydrophobicContact CB-CB 4.08Å; N426-V429 HydrophobicContact CB-CG2 3.82Å; N426-V429 WeakPolarHBondContact O-CB 3.48Å; N426-V429 PolarHBondContact O-N 3.18Å; V429-R432 PolarHBondContact O-N 3.05Å; V429-Y433 WeakPolarHBondContact O-CB 2.85Å; V429-Y433 PolarHBondContact O-N 3.12Å
430	H	96.5	Very high	94.4	Very high	67 Å²	67	107.8 Å²	107.8	31%	0.31	48%	0.48	S	S	.	.	H	α-helix	trans	-58.3	-50	173.9	-179.7	83.9	0	0	0	111.9	R423 N426 P427 R432 Y433 K434	R423-H430 WeakPolarHBondContact O-CB 3.19Å; R423-H430 PolarHBondContact O-N 3.36Å; N426-H430 PolarHBondContact O-N 3.48Å; P427-H430 PolarHBondContact O-N 3.28Å; H430-R432 PolarHBondContact O-N 2.88Å; H430-Y433 PolarHBondContact O-N 3.21Å; H430-K434 WeakPolarHBondContact O-CB 3.27Å; H430-K434 PolarHBondContact O-N 2.93Å
431	L	97.8	Very high	94.7	Very high	108 Å²	108	107.8 Å²	107.8	57%	0.565	48%	0.48	S	S	*	.	H	α-helix	trans	-64.2	-40	-179.6	-71.8	173.5	0	0	0	112.6	P427 R428 Y433 K434 Y435	P427-L431 WeakPolarHBondContact O-CB 3.46Å; P427-L431 WeakPolarHBondContact O-CG 3.36Å; P427-L431 PolarHBondContact O-N 3.49Å; R428-L431 PolarHBondContact O-N 3.39Å; L431-Y433 VanDerWaalsContact C-N 3.33Å; L431-Y433 PolarHBondContact O-N 3.48Å; L431-K434 PolarHBondContact O-N 3.49Å; L431-Y435 WeakPolarHBondContact O-CB 3.06Å; L431-Y435 PolarHBondContact O-N 3.46Å
432	R	96.6	Very high	95	Very high	193 Å²	193	111.6 Å²	111.6	73%	0.728	49%	0.493	S	S	*	.	H	α-helix	trans	-59.7	-44	174.2	-174.8	-179.8	180	-165.6	1.4	111.5	R428 V429 H430 R436	R428-R432 WeakPolarHBondContact O-CB 3.47Å; R428-R432 PolarHBondContact O-N 3.09Å; V429-R432 PolarHBondContact O-N 3.05Å; H430-R432 PolarHBondContact O-N 2.88Å; R432-R436 WeakPolarHBondContact O-CB 3.45Å; R432-R436 PolarHBondContact O-N 3.04Å
433	Y	95.7	Very high	95	Very high	60 Å²	60	111.2 Å²	111.2	24%	0.235	49%	0.487	C	S	.	.	H	α-helix	trans	-69.7	-40.3	178.3	-173.9	-95.5	0	0	0	112.1	V429 H430 L431 R436 K437	V429-Y433 WeakPolarHBondContact O-CB 2.85Å; V429-Y433 PolarHBondContact O-N 3.12Å; H430-Y433 PolarHBondContact O-N 3.21Å; L431-Y433 VanDerWaalsContact C-N 3.33Å; L431-Y433 PolarHBondContact O-N 3.48Å; Y433-R436 PolarHBondContact O-N 2.74Å; Y433-K437 HydrophobicContact CD1-CD 4.04Å; Y433-K437 HydrophobicContact CD1-CG 4.28Å; Y433-K437 HydrophobicContact CE1-CD 3.39Å; Y433-K437 HydrophobicContact CE1-CG 3.92Å; Y433-K437 PolarHBondContact O-N 2.87Å; Y433-K437 WeakPolarHBondContact OH-CE 3.46Å; Y433-K437 PolarHBondContact OH-NZ 2.84Å
434	K	96.8	Very high	95.2	Very high	127 Å²	127	112.8 Å²	112.8	55%	0.552	51%	0.508	S	S	*	.	H	α-helix	trans	-58.4	-46.8	173.7	-174.8	178.4	179.2	179.8	0	111.1	H430 L431 K437 A438	H430-K434 WeakPolarHBondContact O-CB 3.27Å; H430-K434 PolarHBondContact O-N 2.93Å; L431-K434 PolarHBondContact O-N 3.49Å; K434-K437 PolarHBondContact O-N 3.26Å; K434-A438 WeakPolarHBondContact O-CB 3.46Å; K434-A438 PolarHBondContact O-N 3.29Å
435	Y	97.1	Very high	95.3	Very high	169 Å²	169	118.1 Å²	118.1	66%	0.663	52%	0.524	S	S	*	.	H	α-helix	trans	-59.1	-51.9	174.2	177	-104.1	0	0	0	111.1	L431 K437 A438 T439	L431-Y435 WeakPolarHBondContact O-CB 3.06Å; L431-Y435 PolarHBondContact O-N 3.46Å; Y435-K437 VanDerWaalsContact C-N 3.35Å; Y435-K437 PolarHBondContact O-N 3.24Å; Y435-A438 CarbonylContact O-C 3.6Å; Y435-A438 WeakPolarHBondContact O-CA 3.33Å; Y435-A438 WeakPolarHBondContact O-CB 3.46Å; Y435-A438 PolarHBondContact O-N 3.31Å; Y435-T439 PolarHBondContact O-N 3.33Å; Y435-T439 PolarHBondContact O-OG1 3.33Å
436	R	95.9	Very high	95.3	Very high	146 Å²	146	112 Å²	112	55%	0.551	51%	0.508	S	S	*	.	H	α-helix	trans	-54	-47.9	177.5	-170.9	178.5	76.5	165.4	7.9	112.4	R432 Y433 A438 T439 I440	R432-R436 WeakPolarHBondContact O-CB 3.45Å; R432-R436 PolarHBondContact O-N 3.04Å; Y433-R436 PolarHBondContact O-N 2.74Å; R436-A438 VanDerWaalsContact C-N 3.33Å; R436-A438 PolarHBondContact O-N 3.09Å; R436-T439 PolarHBondContact O-N 2.83Å; R436-I440 HydrophobicContact CG-CD1 4.25Å; R436-I440 WeakPolarHBondContact O-CG1 3.25Å; R436-I440 PolarHBondContact O-N 3.06Å
437	K	96.4	Very high	95.1	Very high	78 Å²	78	112.5 Å²	112.5	34%	0.339	52%	0.522	S	S	.	.	H	α-helix	trans	-62.8	-36.4	176.3	-84.1	-167	161.2	172.7	0	112.5	Y433 K434 Y435 R441	Y433-K437 HydrophobicContact CD1-CD 4.04Å; Y433-K437 HydrophobicContact CD1-CG 4.28Å; Y433-K437 HydrophobicContact CE1-CD 3.39Å; Y433-K437 HydrophobicContact CE1-CG 3.92Å; Y433-K437 PolarHBondContact O-N 2.87Å; Y433-K437 WeakPolarHBondContact OH-CE 3.46Å; Y433-K437 PolarHBondContact OH-NZ 2.84Å; K434-K437 PolarHBondContact O-N 3.26Å; Y435-K437 VanDerWaalsContact C-N 3.35Å; Y435-K437 PolarHBondContact O-N 3.24Å; K437-R441 WeakPolarHBondContact O-CG 3.47Å; K437-R441 PolarHBondContact O-N 3.39Å; K437-R441 VanDerWaalsContact O-N 3.16Å; K437-R441 PolarHBondContact O-NE 2.97Å
438	A	96.7	Very high	94.7	Very high	49 Å²	49	110.4 Å²	110.4	41%	0.405	51%	0.508	S	S	.	.	H	α-helix	trans	-69.3	-42.6	175.8	0	0	0	0	0	111.4	K434 Y435 R436 I440 R441 Y442	K434-A438 WeakPolarHBondContact O-CB 3.46Å; K434-A438 PolarHBondContact O-N 3.29Å; Y435-A438 CarbonylContact O-C 3.6Å; Y435-A438 WeakPolarHBondContact O-CA 3.33Å; Y435-A438 WeakPolarHBondContact O-CB 3.46Å; Y435-A438 PolarHBondContact O-N 3.31Å; R436-A438 VanDerWaalsContact C-N 3.33Å; R436-A438 PolarHBondContact O-N 3.09Å; A438-I440 VanDerWaalsContact C-N 3.34Å; A438-I440 PolarHBondContact O-N 3.19Å; A438-R441 PolarHBondContact O-N 3.37Å; A438-Y442 WeakPolarHBondContact O-CB 3.46Å; A438-Y442 PolarHBondContact O-N 3.37Å
439	T	94.8	Very high	94.4	Very high	37 Å²	37	109.2 Å²	109.2	23%	0.227	52%	0.52	C	S	.	.	H	α-helix	trans	-60.9	-41.1	176.1	-48.9	0	0	0	0	111.9	Y435 R436 Y442 R443	Y435-T439 PolarHBondContact O-N 3.33Å; Y435-T439 PolarHBondContact O-OG1 3.33Å; R436-T439 PolarHBondContact O-N 2.83Å; T439-Y442 WeakPolarHBondContact O-CB 3.09Å; T439-Y442 PolarHBondContact O-N 3.17Å; T439-R443 WeakPolarHBondContact O-CG 3.31Å; T439-R443 PolarHBondContact O-N 2.9Å
440	I	93	Very high	94	Very high	98 Å²	98	114.4 Å²	114.4	50%	0.503	53%	0.532	S	S	.	.	H	α-helix	trans	-63.7	-47.5	175.7	-66.6	165	0	0	0	110.8	R436 A438 Y442 R443 S444	R436-I440 HydrophobicContact CG-CD1 4.25Å; R436-I440 WeakPolarHBondContact O-CG1 3.25Å; R436-I440 PolarHBondContact O-N 3.06Å; A438-I440 VanDerWaalsContact C-N 3.34Å; A438-I440 PolarHBondContact O-N 3.19Å; I440-Y442 PolarHBondContact O-N 2.87Å; I440-R443 PolarHBondContact O-N 3.07Å; I440-S444 PolarHBondContact O-N 2.82Å
441	R	95.4	Very high	93.8	Very high	151 Å²	151	120 Å²	120	57%	0.57	56%	0.556	S	S	*	*	H	α-helix	trans	-62.9	-30.3	175.5	-77.8	-175.7	-83.6	176.6	-8	113.1	K437 A438 S444	K437-R441 WeakPolarHBondContact O-CG 3.47Å; K437-R441 PolarHBondContact O-N 3.39Å; K437-R441 VanDerWaalsContact O-N 3.16Å; K437-R441 PolarHBondContact O-NE 2.97Å; A438-R441 PolarHBondContact O-N 3.37Å; R441-S444 PolarHBondContact O-OG 3.33Å
442	Y	94.7	Very high	93.4	Very high	141 Å²	141	123.2 Å²	123.2	55%	0.553	57%	0.568	S	S	*	*	H	α-helix	trans	-68.8	-46.6	174.2	-177.2	-102.6	0	0	0	111.1	A438 T439 I440 S444 R445 V446	A438-Y442 WeakPolarHBondContact O-CB 3.46Å; A438-Y442 PolarHBondContact O-N 3.37Å; T439-Y442 WeakPolarHBondContact O-CB 3.09Å; T439-Y442 PolarHBondContact O-N 3.17Å; I440-Y442 PolarHBondContact O-N 2.87Å; Y442-S444 PolarHBondContact O-N 3.01Å; Y442-S444 VanDerWaalsContact O-N 3.15Å; Y442-R445 PolarHBondContact O-N 3.18Å; Y442-V446 HydrophobicContact CE1-CB 4.37Å; Y442-V446 HydrophobicContact CE2-CB 4.35Å; Y442-V446 HydrophobicContact CE2-CG2 4.19Å; Y442-V446 PolarHBondContact O-N 2.59Å
443	R	92	Very high	93	Very high	156 Å²	156	121 Å²	121	59%	0.589	57%	0.571	S	S	*	*	H	α-helix	trans	-59.4	-24.5	177.3	-71.6	173.5	-179.9	-178.5	-0.9	113.9	T439 I440 V446 P448	T439-R443 WeakPolarHBondContact O-CG 3.31Å; T439-R443 PolarHBondContact O-N 2.9Å; I440-R443 PolarHBondContact O-N 3.07Å; R443-V446 CarbonylContact C-O 3.55Å; R443-V446 WeakPolarHBondContact CA-O 3.49Å; R443-P448 HydrophobicContact CG-CG 4.38Å
444	S	91.8	Very high	92.8	Very high	98 Å²	98	126.5 Å²	126.5	69%	0.685	60%	0.596	S	S	*	*	H	α-helix	trans	-80.9	-26.5	175.5	71.7	0	0	0	0	113.2	I440 R441 Y442	I440-S444 PolarHBondContact O-N 2.82Å; R441-S444 PolarHBondContact O-OG 3.33Å; Y442-S444 PolarHBondContact O-N 3.01Å; Y442-S444 VanDerWaalsContact O-N 3.15Å
445	R	93	Very high	92.5	Very high	212 Å²	212	126.4 Å²	126.4	80%	0.8	61%	0.608	S	S	*	*	H	α-helix	trans	-86.9	-45	178.4	-67	178	-179.3	-174.4	-1.7	111.9	Y442	Y442-R445 PolarHBondContact O-N 3.18Å
446	V	92.1	Very high	92.3	Very high	67 Å²	67	126 Å²	126	41%	0.406	61%	0.606	S	S	.	*	S	Bend	trans	-123.5	131.5	-176.5	-177.6	0	0	0	0	108.4	Y442 R443	Y442-V446 HydrophobicContact CE1-CB 4.37Å; Y442-V446 HydrophobicContact CE2-CB 4.35Å; Y442-V446 HydrophobicContact CE2-CG2 4.19Å; Y442-V446 PolarHBondContact O-N 2.59Å; R443-V446 CarbonylContact C-O 3.55Å; R443-V446 WeakPolarHBondContact CA-O 3.49Å
447	A	89.7	Confident	92.1	Very high	78 Å²	78	124 Å²	124	65%	0.645	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-66.5	127.7	175.9	0	0	0	0	0	109.6
448	P	89.7	Confident	91.9	Very high	48 Å²	48	121.8 Å²	121.8	31%	0.312	62%	0.621	S	S	.	*	P	Polyproline II helix	trans	-70.7	149.8	175.3	30.3	-34.4	0	0	0	110.6	R443 R450	R443-P448 HydrophobicContact CG-CG 4.38Å; P448-R450 PolarHBondContact O-N 3.38Å
449	V	91.4	Very high	91.7	Very high	149 Å²	149	125.2 Å²	125.2	90%	0.903	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-64.6	128.3	168.1	-177.9	0	0	0	0	108.3
450	R	87.7	Confident	91.4	Very high	170 Å²	170	130.4 Å²	130.4	64%	0.642	66%	0.66	S	S	*	*			trans	-110.8	147.7	176.3	-66.4	-174.3	175.2	79.5	3.7	109.5	P448	P448-R450 PolarHBondContact O-N 3.38Å
451	K	90.7	Very high	91.3	Very high	185 Å²	185	134.2 Å²	134.2	80%	0.804	67%	0.673	S	S	*	*			trans	-95.3	145.1	167.4	-65.2	-176	178.5	-176.5	0	108.7	D453	K451-D453 PolarHBondContact O-N 2.9Å
452	E	89.2	Confident	91.2	Very high	175 Å²	175	129.5 Å²	129.5	82%	0.818	67%	0.671	S	S	*	*			trans	-83.7	91.9	174.9	-67.4	-177.8	-179.5	0	0	109.1
453	D	89.9	Confident	91.2	Very high	146 Å²	146	128.9 Å²	128.9	78%	0.781	68%	0.676	S	S	*	*			trans	-84.1	-17.7	176.6	-59.5	-30.9	0	0	0	112.1	K451	K451-D453 PolarHBondContact O-N 2.9Å
454	K	90.5	Very high	91.4	Very high	176 Å²	176	131 Å²	131	77%	0.765	68%	0.684	S	S	*	*	S	Bend	trans	-133.9	151.2	-176.4	-67	-177.7	-176.8	178.3	0	110
455	P	90.9	Very high	91.6	Very high	125 Å²	125	132.7 Å²	132.7	81%	0.812	69%	0.69	S	S	*	*			trans	-55.4	144.6	175	23.6	-33.6	0	0	0	110.9	A457	P455-A457 PolarHBondContact O-N 2.99Å
456	Y	93.2	Very high	91.8	Very high	160 Å²	160	130.1 Å²	130.1	63%	0.627	69%	0.692	S	S	*	*			trans	-57.2	122.8	-176	178.9	-111.9	0	0	0	111.7	G458	Y456-G458 WeakPolarHBondContact OH-CA 2.95Å
457	A	91.5	Very high	91.9	Very high	105 Å²	105	131.2 Å²	131.2	87%	0.868	70%	0.695	S	S	*	*			trans	-110.9	8.4	179.5	0	0	0	0	0	113.1	P455	P455-A457 PolarHBondContact O-N 2.99Å
458	G	92	Very high	92.1	Very high	32 Å²	32	133.9 Å²	133.9	33%	0.33	70%	0.697	S	S	.	*			trans	101.3	170.5	-170.2	0	0	0	0	0	114.1	Y456 V460	Y456-G458 WeakPolarHBondContact OH-CA 2.95Å; G458-V460 PolarHBondContact O-N 3.05Å
459	E	91.4	Very high	92.2	Very high	120 Å²	120	140.2 Å²	140.2	56%	0.561	72%	0.72	S	S	*	*			trans	-75.4	104	175.6	-75.9	-69.5	166.6	0	0	111.6	K461 G462 I463	E459-K461 PolarHBondContact O-N 3.43Å; E459-K461 VanDerWaalsContact O-N 3.08Å; E459-G462 PolarHBondContact O-N 3.29Å; E459-I463 HydrophobicContact CB-CD1 4.23Å; E459-I463 HydrophobicContact CB-CG1 3.79Å; E459-I463 HydrophobicContact CG-CD1 3.97Å; E459-I463 HydrophobicContact CG-CG1 3.76Å
460	V	90.2	Very high	92.3	Very high	146 Å²	146	137.3 Å²	137.3	89%	0.885	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-32	-175.3	-177.7	0	0	0	0	113.5	G458	G458-V460 PolarHBondContact O-N 3.05Å
461	K	90.5	Very high	92.6	Very high	179 Å²	179	136.6 Å²	136.6	78%	0.778	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	2.2	-177.8	-65.3	-170.8	177.9	-168.7	0	114.1	E459	E459-K461 PolarHBondContact O-N 3.43Å; E459-K461 VanDerWaalsContact O-N 3.08Å
462	G	93.2	Very high	92.8	Very high	51 Å²	51	136 Å²	136	53%	0.526	71%	0.707	S	S	.	*			trans	77.2	157.4	-174.6	0	0	0	0	0	113.6	E459	E459-G462 PolarHBondContact O-N 3.29Å
463	I	95	Very high	93	Very high	129 Å²	129	136.7 Å²	136.7	66%	0.662	71%	0.708	S	S	*	*			trans	-103.3	130.3	-179.3	-61.3	171.8	0	0	0	108.8	E459	E459-I463 HydrophobicContact CB-CD1 4.23Å; E459-I463 HydrophobicContact CB-CG1 3.79Å; E459-I463 HydrophobicContact CG-CD1 3.97Å; E459-I463 HydrophobicContact CG-CG1 3.76Å
464	R	95.8	Very high	93	Very high	201 Å²	201	138.6 Å²	138.6	76%	0.758	71%	0.709	S	S	*	*			trans	-106.1	105.6	173.9	-70.6	-175.4	177.7	156.4	0.4	109.9	N466 L467	R464-N466 VanDerWaalsContact C-N 3.32Å; R464-N466 PolarHBondContact O-N 3.31Å; R464-L467 HydrophobicContact CB-CB 3.97Å; R464-L467 HydrophobicContact CB-CD2 4.5Å; R464-L467 PolarHBondContact O-N 3.4Å
465	V	96.2	Very high	92.8	Very high	133 Å²	133	140.1 Å²	140.1	81%	0.806	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-36.8	-174.1	-174.9	0	0	0	0	112.8	L467	V465-L467 VanDerWaalsContact C-N 3.34Å; V465-L467 PolarHBondContact O-N 3.18Å
466	N	96.4	Very high	92.1	Very high	157 Å²	157	148.3 Å²	148.3	84%	0.84	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	1.5	-174.1	-60.3	-9.7	0	0	0	114.2	R464	R464-N466 VanDerWaalsContact C-N 3.32Å; R464-N466 PolarHBondContact O-N 3.31Å
467	L	94.9	Very high	92.1	Very high	91 Å²	91	147.7 Å²	147.7	48%	0.476	74%	0.737	S	S	.	*			trans	-98.9	110	-172.2	-177.4	63	0	0	0	111.9	R464 V465 K469	R464-L467 HydrophobicContact CB-CB 3.97Å; R464-L467 HydrophobicContact CB-CD2 4.5Å; R464-L467 PolarHBondContact O-N 3.4Å; V465-L467 VanDerWaalsContact C-N 3.34Å; V465-L467 PolarHBondContact O-N 3.18Å; L467-K469 HydrophobicContact CG-CG 4.24Å
468	I	94.3	Very high	92.1	Very high	133 Å²	133	149.9 Å²	149.9	68%	0.682	73%	0.731	S	S	*	*			trans	-100.3	117.8	175.5	-55.8	173.6	0	0	0	109.4	S470	I468-S470 VanDerWaalsContact CG2-OG 3.27Å; I468-S470 WeakPolarHBondContact CG2-OG 3.49Å
469	K	92.1	Very high	92.1	Very high	182 Å²	182	156.5 Å²	156.5	79%	0.791	75%	0.753	S	S	*	*			trans	-106.2	2.7	178.5	-67.7	-172.6	179	179.2	0	114.6	L467	L467-K469 HydrophobicContact CG-CG 4.24Å
470	S	93.3	Very high	92.2	Very high	87 Å²	87	158.6 Å²	158.6	61%	0.608	76%	0.764	S	S	*	*	S	Bend	trans	-69.4	148	179	53.6	0	0	0	0	111.7	I468	I468-S470 VanDerWaalsContact CG2-OG 3.27Å; I468-S470 WeakPolarHBondContact CG2-OG 3.49Å
471	H	93.4	Very high	92.3	Very high	155 Å²	155	159.4 Å²	159.4	72%	0.718	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-76.9	121.9	172.1	-171.3	70.5	0	0	0	109.4	F473	H471-F473 PolarHBondContact O-N 3.46Å
472	K	94.4	Very high	92.4	Very high	173 Å²	173	158.1 Å²	158.1	75%	0.752	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-79.6	117.1	175	-73.1	-175.3	178.3	-178.9	0	109.6	K474	K472-K474 PolarHBondContact O-N 3.32Å
473	F	93	Very high	92.4	Very high	190 Å²	190	165.8 Å²	165.8	83%	0.833	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-68	130.1	171.3	-61.1	-75.4	0	0	0	109.9	H471	H471-F473 PolarHBondContact O-N 3.46Å
474	K	91.7	Very high	92.2	Very high	185 Å²	185	168.6 Å²	168.6	80%	0.804	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-85.5	137.2	168.1	-66.2	-176.8	179.5	-178.2	0	108	K472	K472-K474 PolarHBondContact O-N 3.32Å
475	K	85.3	Confident	91.9	Very high	209 Å²	209	165.9 Å²	165.9	91%	0.909	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-75.8	123.8	169.3	-157.2	176.9	-178	-176.5	0	107
476	Y	77	Confident	91.5	Very high	296 Å²	296	168.9 Å²	168.9	100%	1.161	78%	0.78	S	S	*	*			trans	-73.6	0	171.5	-72.6	-80.1	0	0	0	110.8

Retrieved 476 of 476 residues in 1653.1 ms (Link to these results)

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