A0A096M5E7_POEFO Loading...

NF-kappa-B inhibitor zeta-like

AlphaFold DB , UniProt , Accession A0A096M5E7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 574 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	31.2	Very low	37.2	Very low	133 Å²	133	109.6 Å²	109.6	66%	0.655	56%	0.555	S	S	*	*				0	-83.8	0	-66	-150.5	-69.6	0	0	112.8	I3 S4 I5 E87	M1-I3 VanDerWaalsContact C-N 3.31Å; M1-I3 PolarHBondContact O-N 2.99Å; M1-I3 VanDerWaalsContact O-N 3.11Å; M1-S4 PolarHBondContact N-OG 3.24Å; M1-S4 CarbonylContact O-C 3.54Å; M1-S4 WeakPolarHBondContact O-CA 3.08Å; M1-S4 WeakPolarHBondContact O-CB 3.48Å; M1-S4 PolarHBondContact O-N 3.18Å; M1-S4 PolarHBondContact O-OG 3.26Å; M1-I5 PolarHBondContact O-N 3.28Å; M1-E87 WeakPolarHBondContact CE-OE1 3.29Å
2	F	26.1	Very low	37.8	Very low	173 Å²	173	105.1 Å²	105.1	76%	0.759	53%	0.533	S	S	*	.	H	α-helix	trans	-52.4	-39.7	-171.9	-87.3	-81.9	0	0	0	115.8	K6	F2-K6 PolarHBondContact O-N 3.14Å
3	I	31.8	Very low	38.2	Very low	131 Å²	131	105.3 Å²	105.3	67%	0.672	53%	0.531	S	S	*	.	H	α-helix	trans	-64.8	-47.8	173.9	-63.4	171.6	0	0	0	110.6	M1 I5 K6 I7	M1-I3 VanDerWaalsContact C-N 3.31Å; M1-I3 PolarHBondContact O-N 2.99Å; M1-I3 VanDerWaalsContact O-N 3.11Å; I3-I5 VanDerWaalsContact C-N 3.32Å; I3-I5 PolarHBondContact O-N 3.44Å; I3-K6 PolarHBondContact O-N 2.54Å; I3-I7 HydrophobicContact CG2-CD1 3.83Å; I3-I7 HydrophobicContact CG2-CG1 4.48Å; I3-I7 WeakPolarHBondContact O-CG1 3.5Å; I3-I7 PolarHBondContact O-N 2.95Å
4	S	34.3	Very low	38.6	Very low	71 Å²	71	108 Å²	108	50%	0.497	54%	0.537	S	S	.	.	H	α-helix	trans	-57	-41.9	176.6	-34.5	0	0	0	0	112.5	M1 I7 L8	M1-S4 PolarHBondContact N-OG 3.24Å; M1-S4 CarbonylContact O-C 3.54Å; M1-S4 WeakPolarHBondContact O-CA 3.08Å; M1-S4 WeakPolarHBondContact O-CB 3.48Å; M1-S4 PolarHBondContact O-N 3.18Å; M1-S4 PolarHBondContact O-OG 3.26Å; S4-I7 PolarHBondContact O-N 3.13Å; S4-L8 WeakPolarHBondContact O-CB 3.47Å; S4-L8 PolarHBondContact O-N 3.21Å
5	I	38.4	Very low	38.7	Very low	95 Å²	95	107.4 Å²	107.4	49%	0.487	53%	0.534	S	S	.	.	H	α-helix	trans	-69.5	-42.2	177.8	-64.3	168.8	0	0	0	110.7	M1 I3 I7 L8 F9	M1-I5 PolarHBondContact O-N 3.28Å; I3-I5 VanDerWaalsContact C-N 3.32Å; I3-I5 PolarHBondContact O-N 3.44Å; I5-I7 VanDerWaalsContact C-N 3.34Å; I5-I7 PolarHBondContact O-N 3.38Å; I5-L8 PolarHBondContact O-N 3.27Å; I5-F9 PolarHBondContact O-N 3.18Å
6	K	37.9	Very low	38.9	Very low	164 Å²	164	103.6 Å²	103.6	71%	0.713	52%	0.521	S	S	*	.	H	α-helix	trans	-61.7	-39.3	172.8	-83.1	-168.8	171.4	-170.5	0	112.7	F2 I3 S10	F2-K6 PolarHBondContact O-N 3.14Å; I3-K6 PolarHBondContact O-N 2.54Å; K6-S10 VanDerWaalsContact O-CB 3.3Å; K6-S10 WeakPolarHBondContact O-CB 3.21Å; K6-S10 PolarHBondContact O-N 3.41Å
7	I	40.9	Very low	39.1	Very low	100 Å²	100	104.8 Å²	104.8	51%	0.513	52%	0.524	S	S	.	.	H	α-helix	trans	-63.2	-49.7	174.2	-70.1	166.4	0	0	0	109.7	I3 S4 I5 F9 S10 T11	I3-I7 HydrophobicContact CG2-CD1 3.83Å; I3-I7 HydrophobicContact CG2-CG1 4.48Å; I3-I7 WeakPolarHBondContact O-CG1 3.5Å; I3-I7 PolarHBondContact O-N 2.95Å; S4-I7 PolarHBondContact O-N 3.13Å; I5-I7 VanDerWaalsContact C-N 3.34Å; I5-I7 PolarHBondContact O-N 3.38Å; I7-F9 VanDerWaalsContact C-N 3.34Å; I7-F9 PolarHBondContact O-N 3.07Å; I7-S10 PolarHBondContact O-N 3.32Å; I7-T11 WeakPolarHBondContact O-CB 3.47Å; I7-T11 PolarHBondContact O-N 3.2Å; I7-T11 PolarHBondContact O-OG1 3.09Å
8	L	42	Very low	39.2	Very low	89 Å²	89	101.4 Å²	101.4	47%	0.466	51%	0.512	S	S	.	.	H	α-helix	trans	-56.3	-47.5	178.5	-164.2	76.1	0	0	0	111.6	S4 I5 T11 L12	S4-L8 WeakPolarHBondContact O-CB 3.47Å; S4-L8 PolarHBondContact O-N 3.21Å; I5-L8 PolarHBondContact O-N 3.27Å; L8-T11 PolarHBondContact O-N 3.23Å; L8-L12 HydrophobicContact CG-CD1 4.11Å; L8-L12 WeakPolarHBondContact O-CB 3.47Å; L8-L12 VanDerWaalsContact O-CG 3.23Å; L8-L12 WeakPolarHBondContact O-CG 3.37Å; L8-L12 PolarHBondContact O-N 3.1Å
9	F	42.7	Very low	39.1	Very low	133 Å²	133	102.2 Å²	102.2	58%	0.583	53%	0.525	S	S	*	.	H	α-helix	trans	-62.7	-44.5	176.8	-119.8	-90.3	0	0	0	112.6	I5 I7 L12 Q13	I5-F9 PolarHBondContact O-N 3.18Å; I7-F9 VanDerWaalsContact C-N 3.34Å; I7-F9 PolarHBondContact O-N 3.07Å; F9-L12 PolarHBondContact O-N 2.98Å; F9-Q13 WeakPolarHBondContact O-CB 3.23Å; F9-Q13 PolarHBondContact O-N 3.22Å
10	S	41	Very low	39.2	Very low	53 Å²	53	105.7 Å²	105.7	37%	0.371	54%	0.538	S	S	.	.	H	α-helix	trans	-65.8	-38.4	179	-174.2	0	0	0	0	112.3	K6 I7 K14	K6-S10 VanDerWaalsContact O-CB 3.3Å; K6-S10 WeakPolarHBondContact O-CB 3.21Å; K6-S10 PolarHBondContact O-N 3.41Å; I7-S10 PolarHBondContact O-N 3.32Å; S10-K14 WeakPolarHBondContact O-CB 3.45Å; S10-K14 VanDerWaalsContact O-CG 3.29Å; S10-K14 WeakPolarHBondContact O-CG 3.38Å; S10-K14 PolarHBondContact O-N 2.91Å
11	T	42.8	Very low	39.2	Very low	64 Å²	64	102.1 Å²	102.1	39%	0.393	52%	0.522	S	S	.	.	H	α-helix	trans	-69.6	-43	176.6	-57	0	0	0	0	111.2	I7 L8 Q13 K14 M15	I7-T11 WeakPolarHBondContact O-CB 3.47Å; I7-T11 PolarHBondContact O-N 3.2Å; I7-T11 PolarHBondContact O-OG1 3.09Å; L8-T11 PolarHBondContact O-N 3.23Å; T11-Q13 PolarHBondContact O-N 3.28Å; T11-K14 PolarHBondContact O-N 3.23Å; T11-M15 HydrophobicContact CG2-CE 4.05Å; T11-M15 WeakPolarHBondContact O-CG 3.17Å; T11-M15 PolarHBondContact O-N 3.2Å
12	L	44.6	Very low	39.8	Very low	55 Å²	55	99.5 Å²	99.5	29%	0.288	52%	0.515	S	S	.	.	H	α-helix	trans	-62.5	-40.3	175	-72.8	168.4	0	0	0	112.2	L8 F9 M15 S16 F29	L8-L12 HydrophobicContact CG-CD1 4.11Å; L8-L12 WeakPolarHBondContact O-CB 3.47Å; L8-L12 VanDerWaalsContact O-CG 3.23Å; L8-L12 WeakPolarHBondContact O-CG 3.37Å; L8-L12 PolarHBondContact O-N 3.1Å; F9-L12 PolarHBondContact O-N 2.98Å; L12-M15 PolarHBondContact O-N 3.1Å; L12-S16 PolarHBondContact O-N 3.32Å; L12-S16 VanDerWaalsContact O-N 3.12Å; L12-F29 HydrophobicContact CD2-CE1 3.8Å; L12-F29 HydrophobicContact CD2-CZ 4.42Å
13	Q	43.4	Very low	40.4	Very low	108 Å²	108	97.4 Å²	97.4	51%	0.505	51%	0.511	S	S	.	.	H	α-helix	trans	-64.9	-44.9	175.1	-178	171	-11.5	0	0	111.8	F9 T11 M15 S16 E17	F9-Q13 WeakPolarHBondContact O-CB 3.23Å; F9-Q13 PolarHBondContact O-N 3.22Å; T11-Q13 PolarHBondContact O-N 3.28Å; Q13-M15 PolarHBondContact O-N 3.45Å; Q13-S16 PolarHBondContact O-N 3.05Å; Q13-S16 VanDerWaalsContact O-N 3.1Å; Q13-S16 PolarHBondContact O-OG 3.44Å; Q13-E17 WeakPolarHBondContact CG-OE1 3.39Å; Q13-E17 PolarHBondContact NE2-OE1 3.49Å; Q13-E17 WeakPolarHBondContact O-CG 3.26Å; Q13-E17 PolarHBondContact O-N 2.74Å; Q13-E17 VanDerWaalsContact O-N 3.08Å
14	K	43.4	Very low	40.8	Very low	143 Å²	143	96.2 Å²	96.2	62%	0.622	51%	0.506	S	S	*	.	H	α-helix	trans	-60.6	-30.5	173.7	-74.3	172.4	179.6	179.8	0	113.2	S10 T11	S10-K14 WeakPolarHBondContact O-CB 3.45Å; S10-K14 VanDerWaalsContact O-CG 3.29Å; S10-K14 WeakPolarHBondContact O-CG 3.38Å; S10-K14 PolarHBondContact O-N 2.91Å; T11-K14 PolarHBondContact O-N 3.23Å
15	M	40.5	Very low	41	Very low	99 Å²	99	95.3 Å²	95.3	49%	0.488	50%	0.495	S	S	.	.	H	α-helix	trans	-69.4	-42.4	172.7	-70	-170.5	-169.9	0	0	112.1	T11 L12 Q13 E17 S18 T21	T11-M15 HydrophobicContact CG2-CE 4.05Å; T11-M15 WeakPolarHBondContact O-CG 3.17Å; T11-M15 PolarHBondContact O-N 3.2Å; L12-M15 PolarHBondContact O-N 3.1Å; Q13-M15 PolarHBondContact O-N 3.45Å; M15-E17 VanDerWaalsContact C-N 3.31Å; M15-E17 PolarHBondContact O-N 2.93Å; M15-S18 WeakPolarHBondContact O-CB 3.48Å; M15-S18 PolarHBondContact O-N 3.37Å; M15-T21 WeakPolarHBondContact O-CG2 3.39Å
16	S	42.1	Very low	41.1	Very low	46 Å²	46	94 Å²	94	32%	0.322	49%	0.485	S	S	.	.	H	α-helix	trans	-70.3	-27.4	-179.3	74.1	0	0	0	0	113.2	L12 Q13 S18 K26	L12-S16 PolarHBondContact O-N 3.32Å; L12-S16 VanDerWaalsContact O-N 3.12Å; Q13-S16 PolarHBondContact O-N 3.05Å; Q13-S16 VanDerWaalsContact O-N 3.1Å; Q13-S16 PolarHBondContact O-OG 3.44Å; S16-S18 VanDerWaalsContact C-N 3.33Å; S16-K26 PolarHBondContact O-NZ 3.27Å
17	E	41.5	Very low	41.1	Very low	125 Å²	125	90.3 Å²	90.3	58%	0.584	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-14.2	175.2	-70.3	167.5	-173.5	0	0	113.3	Q13 M15	Q13-E17 WeakPolarHBondContact CG-OE1 3.39Å; Q13-E17 PolarHBondContact NE2-OE1 3.49Å; Q13-E17 WeakPolarHBondContact O-CG 3.26Å; Q13-E17 PolarHBondContact O-N 2.74Å; Q13-E17 VanDerWaalsContact O-N 3.08Å; M15-E17 VanDerWaalsContact C-N 3.31Å; M15-E17 PolarHBondContact O-N 2.93Å
18	S	41.4	Very low	41.1	Very low	44 Å²	44	88.2 Å²	88.2	31%	0.308	47%	0.465	S	S	.	.			trans	-66.2	135	179.1	177.4	0	0	0	0	112.9	M15 S16 H20 T21 K26	M15-S18 WeakPolarHBondContact O-CB 3.48Å; M15-S18 PolarHBondContact O-N 3.37Å; S16-S18 VanDerWaalsContact C-N 3.33Å; S18-H20 VanDerWaalsContact C-N 3.25Å; S18-H20 PolarHBondContact O-N 3.3Å; S18-T21 PolarHBondContact O-N 3.09Å; S18-T21 PolarHBondContact O-OG1 3.41Å; S18-K26 PolarHBondContact O-NZ 2.67Å
19	P	37.4	Very low	41.1	Very low	115 Å²	115	86.3 Å²	86.3	75%	0.747	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-13	-179.2	30.2	-36.2	0	0	0	114.1
20	H	39.7	Very low	40.8	Very low	172 Å²	172	88.4 Å²	88.4	80%	0.796	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	4.9	179.8	-62.8	-58.5	0	0	0	114.1	S18	S18-H20 VanDerWaalsContact C-N 3.25Å; S18-H20 PolarHBondContact O-N 3.3Å
21	T	40.4	Very low	40.5	Very low	32 Å²	32	89.3 Å²	89.3	20%	0.196	46%	0.464	C	S	.	.	S	Bend	trans	-84.3	120.9	175.7	44.6	0	0	0	0	111.3	M15 S18 K26	M15-T21 WeakPolarHBondContact O-CG2 3.39Å; S18-T21 PolarHBondContact O-N 3.09Å; S18-T21 PolarHBondContact O-OG1 3.41Å; T21-K26 VanDerWaalsContact O-CE 3.32Å; T21-K26 WeakPolarHBondContact O-CE 3.49Å; T21-K26 WeakPolarHBondContact OG1-CE 3.46Å; T21-K26 PolarHBondContact OG1-NZ 3.42Å; T21-K26 VanDerWaalsContact OG1-NZ 3.16Å
22	P	42.3	Very low	40.2	Very low	77 Å²	77	89.7 Å²	89.7	50%	0.5	47%	0.469	S	S	.	.			trans	-64.9	140.5	179.6	26.5	-34.8	0	0	0	111.2	I24 L25	P22-I24 PolarHBondContact O-N 3.44Å; P22-L25 HydrophobicContact CG-CD1 3.99Å; P22-L25 HydrophobicContact CG-CG 4.31Å; P22-L25 PolarHBondContact O-N 2.84Å
23	N	39.8	Very low	39.9	Very low	129 Å²	129	91 Å²	91	69%	0.69	48%	0.479	S	S	*	.	H	α-helix	trans	-54.6	-30.9	-171.4	-73	-20.8	0	0	0	114.5	L25 K26 T27	N23-L25 VanDerWaalsContact C-N 3.28Å; N23-L25 PolarHBondContact O-N 2.82Å; N23-K26 WeakPolarHBondContact O-CB 3.5Å; N23-K26 PolarHBondContact O-N 3.47Å; N23-T27 PolarHBondContact O-N 3.07Å; N23-T27 VanDerWaalsContact O-N 3.08Å; N23-T27 PolarHBondContact O-OG1 3.21Å
24	I	40.1	Very low	39.3	Very low	107 Å²	107	91.7 Å²	91.7	55%	0.549	48%	0.482	S	S	.	.	H	α-helix	trans	-53.7	-44.7	175.5	-62.8	171.9	0	0	0	111.1	P22 K26 T27 E28	P22-I24 PolarHBondContact O-N 3.44Å; I24-K26 VanDerWaalsContact C-N 3.34Å; I24-K26 PolarHBondContact O-N 2.86Å; I24-T27 WeakPolarHBondContact CA-OG1 3.35Å; I24-T27 PolarHBondContact O-N 3.19Å; I24-T27 PolarHBondContact O-OG1 3.23Å; I24-E28 PolarHBondContact O-N 2.77Å
25	L	38.8	Very low	38.7	Very low	52 Å²	52	89 Å²	89	27%	0.272	47%	0.473	S	S	.	.	H	α-helix	trans	-68.3	-33.2	177.7	-70.5	175.5	0	0	0	111.8	P22 N23 T27 E28 F29 L70	P22-L25 HydrophobicContact CG-CD1 3.99Å; P22-L25 HydrophobicContact CG-CG 4.31Å; P22-L25 PolarHBondContact O-N 2.84Å; N23-L25 VanDerWaalsContact C-N 3.28Å; N23-L25 PolarHBondContact O-N 2.82Å; L25-T27 VanDerWaalsContact C-N 3.33Å; L25-T27 PolarHBondContact O-N 2.78Å; L25-E28 PolarHBondContact O-N 3.02Å; L25-F29 HydrophobicContact CB-CD2 4.42Å; L25-F29 HydrophobicContact CB-CE2 4.4Å; L25-F29 WeakPolarHBondContact O-CB 3.47Å; L25-F29 WeakPolarHBondContact O-CD2 3.4Å; L25-F29 PolarHBondContact O-N 3.3Å; L25-L70 HydrophobicContact CD2-CD1 4.35Å
26	K	39.7	Very low	38.4	Very low	67 Å²	67	87.6 Å²	87.6	29%	0.291	47%	0.473	S	S	.	.	H	α-helix	trans	-64.8	-38.7	176	-53.8	-163.7	-170.2	-140.7	0	111.3	S16 S18 T21 N23 I24 Y30	S16-K26 PolarHBondContact O-NZ 3.27Å; S18-K26 PolarHBondContact O-NZ 2.67Å; T21-K26 VanDerWaalsContact O-CE 3.32Å; T21-K26 WeakPolarHBondContact O-CE 3.49Å; T21-K26 WeakPolarHBondContact OG1-CE 3.46Å; T21-K26 PolarHBondContact OG1-NZ 3.42Å; T21-K26 VanDerWaalsContact OG1-NZ 3.16Å; N23-K26 WeakPolarHBondContact O-CB 3.5Å; N23-K26 PolarHBondContact O-N 3.47Å; I24-K26 VanDerWaalsContact C-N 3.34Å; I24-K26 PolarHBondContact O-N 2.86Å; K26-Y30 PolarHBondContact O-N 2.85Å
27	T	39.2	Very low	37.8	Very low	87 Å²	87	88.2 Å²	88.2	53%	0.534	48%	0.477	S	S	.	.	H	α-helix	trans	-66.7	-43.3	170.2	30.3	0	0	0	0	112.9	N23 I24 L25 F29 Y30 C31	N23-T27 PolarHBondContact O-N 3.07Å; N23-T27 VanDerWaalsContact O-N 3.08Å; N23-T27 PolarHBondContact O-OG1 3.21Å; I24-T27 WeakPolarHBondContact CA-OG1 3.35Å; I24-T27 PolarHBondContact O-N 3.19Å; I24-T27 PolarHBondContact O-OG1 3.23Å; L25-T27 VanDerWaalsContact C-N 3.33Å; L25-T27 PolarHBondContact O-N 2.78Å; T27-F29 PolarHBondContact O-N 3.28Å; T27-Y30 PolarHBondContact O-N 2.69Å; T27-C31 WeakPolarHBondContact O-CB 3.24Å; T27-C31 PolarHBondContact O-N 2.93Å; T27-C31 PolarHBondContact O-SG 3.43Å
28	E	40.2	Very low	37.1	Very low	55 Å²	55	85 Å²	85	26%	0.257	47%	0.468	S	S	.	.	H	α-helix	trans	-66.1	-35.9	177.7	-74	-168.2	140	0	0	112.9	I24 L25 S32	I24-E28 PolarHBondContact O-N 2.77Å; L25-E28 PolarHBondContact O-N 3.02Å; E28-S32 VanDerWaalsContact O-CB 3.23Å; E28-S32 WeakPolarHBondContact O-CB 3.31Å; E28-S32 PolarHBondContact O-N 2.77Å; E28-S32 PolarHBondContact O-OG 3.48Å
29	F	41.5	Very low	36.7	Very low	49 Å²	49	86.6 Å²	86.6	22%	0.215	48%	0.479	C	S	.	.	H	α-helix	trans	-64.2	-45	173.5	-82.9	-60.5	0	0	0	111.8	L12 L25 T27 S32 V33 L73	L12-F29 HydrophobicContact CD2-CE1 3.8Å; L12-F29 HydrophobicContact CD2-CZ 4.42Å; L25-F29 HydrophobicContact CB-CD2 4.42Å; L25-F29 HydrophobicContact CB-CE2 4.4Å; L25-F29 WeakPolarHBondContact O-CB 3.47Å; L25-F29 WeakPolarHBondContact O-CD2 3.4Å; L25-F29 PolarHBondContact O-N 3.3Å; T27-F29 PolarHBondContact O-N 3.28Å; F29-S32 PolarHBondContact O-N 2.86Å; F29-V33 WeakPolarHBondContact O-CG2 3.43Å; F29-V33 PolarHBondContact O-N 3.25Å; F29-V33 VanDerWaalsContact O-N 3.08Å; F29-L73 HydrophobicContact CE1-CD1 4.24Å; F29-L73 HydrophobicContact CZ-CD1 4.15Å
30	Y	36.6	Very low	36.3	Very low	178 Å²	178	87.4 Å²	87.4	70%	0.698	47%	0.474	S	S	*	.	H	α-helix	trans	-61.2	-49.9	175.3	-120.6	-90.9	0	0	0	111.2	K26 T27 S32 V33 Q34	K26-Y30 PolarHBondContact O-N 2.85Å; T27-Y30 PolarHBondContact O-N 2.69Å; Y30-S32 VanDerWaalsContact C-N 3.32Å; Y30-S32 PolarHBondContact O-N 2.86Å; Y30-V33 PolarHBondContact O-N 2.83Å; Y30-Q34 VanDerWaalsContact O-CB 3.29Å; Y30-Q34 WeakPolarHBondContact O-CB 3.17Å; Y30-Q34 PolarHBondContact O-N 2.87Å
31	C	35.1	Very low	35.7	Very low	72 Å²	72	87.1 Å²	87.1	49%	0.486	47%	0.466	S	S	.	.	H	α-helix	trans	-60.1	-38.4	177	-73.5	0	0	0	0	112.4	T27 Q34 M35	T27-C31 WeakPolarHBondContact O-CB 3.24Å; T27-C31 PolarHBondContact O-N 2.93Å; T27-C31 PolarHBondContact O-SG 3.43Å; C31-Q34 PolarHBondContact O-N 3.25Å; C31-M35 WeakPolarHBondContact O-CB 3.43Å; C31-M35 WeakPolarHBondContact O-CG 3.26Å; C31-M35 PolarHBondContact O-N 2.86Å
32	S	36.2	Very low	35.2	Very low	71 Å²	71	89 Å²	89	50%	0.497	47%	0.473	S	S	.	.	H	α-helix	trans	-69.6	-37.4	-180	-60.6	0	0	0	0	112.7	E28 F29 Y30 S36	E28-S32 VanDerWaalsContact O-CB 3.23Å; E28-S32 WeakPolarHBondContact O-CB 3.31Å; E28-S32 PolarHBondContact O-N 2.77Å; E28-S32 PolarHBondContact O-OG 3.48Å; F29-S32 PolarHBondContact O-N 2.86Å; Y30-S32 VanDerWaalsContact C-N 3.32Å; Y30-S32 PolarHBondContact O-N 2.86Å; S32-S36 WeakPolarHBondContact O-CB 3.43Å; S32-S36 PolarHBondContact O-N 3.2Å; S32-S36 PolarHBondContact O-OG 3.13Å
33	V	37.4	Very low	34.8	Very low	84 Å²	84	89.5 Å²	89.5	51%	0.509	49%	0.492	S	S	.	.	H	α-helix	trans	-69.8	-37.4	173.4	174.3	0	0	0	0	111.2	F29 Y30 S36 S37	F29-V33 WeakPolarHBondContact O-CG2 3.43Å; F29-V33 PolarHBondContact O-N 3.25Å; F29-V33 VanDerWaalsContact O-N 3.08Å; Y30-V33 PolarHBondContact O-N 2.83Å; V33-S36 WeakPolarHBondContact CA-OG 3.46Å; V33-S36 PolarHBondContact O-OG 2.93Å; V33-S37 PolarHBondContact O-N 3.18Å; V33-S37 PolarHBondContact O-OG 3.35Å
34	Q	32.5	Very low	34.4	Very low	122 Å²	122	89.1 Å²	89.1	57%	0.57	48%	0.484	S	S	*	.	H	α-helix	trans	-76.6	-30.4	179	-157.7	163.7	-1.9	0	0	112.6	Y30 C31 S37 S38	Y30-Q34 VanDerWaalsContact O-CB 3.29Å; Y30-Q34 WeakPolarHBondContact O-CB 3.17Å; Y30-Q34 PolarHBondContact O-N 2.87Å; C31-Q34 PolarHBondContact O-N 3.25Å; Q34-S37 WeakPolarHBondContact CA-OG 3.35Å; Q34-S37 PolarHBondContact O-OG 3.3Å; Q34-S37 VanDerWaalsContact O-OG 3.08Å; Q34-S38 WeakPolarHBondContact O-CB 3.25Å; Q34-S38 PolarHBondContact O-N 3.48Å; Q34-S38 PolarHBondContact O-OG 2.66Å
35	M	30.7	Very low	34	Very low	86 Å²	86	89 Å²	89	42%	0.424	49%	0.493	S	S	.	.	H	α-helix	trans	-75.3	-45.1	172.5	-73.6	-101.2	62	0	0	111.8	C31 S37 S38 C39 L47	C31-M35 WeakPolarHBondContact O-CB 3.43Å; C31-M35 WeakPolarHBondContact O-CG 3.26Å; C31-M35 PolarHBondContact O-N 2.86Å; M35-S37 VanDerWaalsContact C-N 3.26Å; M35-S37 PolarHBondContact O-N 3.06Å; M35-S38 CarbonylContact O-C 3.35Å; M35-S38 WeakPolarHBondContact O-CA 3.41Å; M35-S38 PolarHBondContact O-N 3.49Å; M35-C39 WeakPolarHBondContact O-CB 3.28Å; M35-C39 PolarHBondContact O-N 2.77Å; M35-C39 PolarHBondContact O-SG 3.38Å; M35-L47 HydrophobicContact CE-CD1 4.45Å
36	S	33.1	Very low	33.6	Very low	70 Å²	70	93.2 Å²	93.2	49%	0.49	52%	0.515	S	S	.	.	H	α-helix	trans	-62.5	-32.5	176.5	50.5	0	0	0	0	112.9	S32 V33	S32-S36 WeakPolarHBondContact O-CB 3.43Å; S32-S36 PolarHBondContact O-N 3.2Å; S32-S36 PolarHBondContact O-OG 3.13Å; V33-S36 WeakPolarHBondContact CA-OG 3.46Å; V33-S36 PolarHBondContact O-OG 2.93Å
37	S	29.4	Very low	33.1	Very low	58 Å²	58	94.6 Å²	94.6	41%	0.406	53%	0.525	S	S	.	.	H	α-helix	trans	-72.9	-23.4	169.6	46.5	0	0	0	0	114.2	V33 Q34 M35	V33-S37 PolarHBondContact O-N 3.18Å; V33-S37 PolarHBondContact O-OG 3.35Å; Q34-S37 WeakPolarHBondContact CA-OG 3.35Å; Q34-S37 PolarHBondContact O-OG 3.3Å; Q34-S37 VanDerWaalsContact O-OG 3.08Å; M35-S37 VanDerWaalsContact C-N 3.26Å; M35-S37 PolarHBondContact O-N 3.06Å
38	S	27.8	Very low	32.7	Very low	57 Å²	57	96.8 Å²	96.8	40%	0.399	53%	0.529	S	S	.	.	H	α-helix	trans	-86.4	-38.8	175.4	-58.9	0	0	0	0	113.3	Q34 M35 M40 W41 E42	Q34-S38 WeakPolarHBondContact O-CB 3.25Å; Q34-S38 PolarHBondContact O-N 3.48Å; Q34-S38 PolarHBondContact O-OG 2.66Å; M35-S38 CarbonylContact O-C 3.35Å; M35-S38 WeakPolarHBondContact O-CA 3.41Å; M35-S38 PolarHBondContact O-N 3.49Å; S38-M40 PolarHBondContact O-N 3.13Å; S38-W41 PolarHBondContact O-N 3.15Å; S38-E42 PolarHBondContact O-N 3.4Å
39	C	31.7	Very low	32.2	Very low	78 Å²	78	102 Å²	102	53%	0.527	55%	0.553	S	S	.	*	H	α-helix	trans	-66.5	-20.5	178.7	-66.7	0	0	0	0	113	M35 W41	M35-C39 WeakPolarHBondContact O-CB 3.28Å; M35-C39 PolarHBondContact O-N 2.77Å; M35-C39 PolarHBondContact O-SG 3.38Å; C39-W41 PolarHBondContact O-N 3.17Å
40	M	29.7	Very low	31.7	Very low	133 Å²	133	105.5 Å²	105.5	66%	0.655	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-10	167.2	-80.3	-170	-76	0	0	114.1	S38	S38-M40 PolarHBondContact O-N 3.13Å
41	W	28.5	Very low	31.6	Very low	166 Å²	166	103.8 Å²	103.8	63%	0.629	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.5	-15.7	-172.5	-71.2	95.1	0	0	0	115.9	S38 C39 Q282	S38-W41 PolarHBondContact O-N 3.15Å; C39-W41 PolarHBondContact O-N 3.17Å; W41-Q282 HydrophobicContact CH2-CG 4.16Å
42	E	29.3	Very low	31.6	Very low	72 Å²	72	103.7 Å²	103.7	34%	0.336	56%	0.561	S	S	.	*			trans	-122.1	88	176.6	-65.6	-125.1	153.7	0	0	112.1	S38 K44 R197	S38-E42 PolarHBondContact O-N 3.4Å; E42-K44 PolarHBondContact O-N 3.36Å; E42-K44 IonicContact OE2-NZ 2.64Å; E42-K44 PolarHBondContact OE2-NZ 2.84Å; E42-R197 IonicContact OE1-CZ 2.84Å; E42-R197 IonicContact OE1-NH1 2.74Å; E42-R197 PolarHBondContact OE1-NH1 3.37Å; E42-R197 IonicContact OE1-NH2 3.62Å; E42-R197 PolarHBondContact OE1-NH2 3.17Å
43	G	33.4	Very low	31.4	Very low	87 Å²	87	103.2 Å²	103.2	90%	0.897	56%	0.561	S	S	*	*			trans	-69.1	87.1	167.5	0	0	0	0	0	111.7
44	K	31	Very low	31.2	Very low	121 Å²	121	100.8 Å²	100.8	53%	0.526	55%	0.554	S	S	.	*			trans	-139.6	134.8	176.4	-75.4	179.2	-178.2	157	0	111.8	E42 L46	E42-K44 PolarHBondContact O-N 3.36Å; E42-K44 IonicContact OE2-NZ 2.64Å; E42-K44 PolarHBondContact OE2-NZ 2.84Å; K44-L46 VanDerWaalsContact C-N 3.25Å; K44-L46 PolarHBondContact O-N 3.05Å
45	S	31.6	Very low	31.2	Very low	104 Å²	104	102.1 Å²	102.1	73%	0.727	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-75.2	-4.5	175.2	48.1	0	0	0	0	115	L47	S45-L47 VanDerWaalsContact C-N 3.33Å; S45-L47 PolarHBondContact O-N 3.02Å
46	L	30.8	Very low	31.4	Very low	140 Å²	140	107.4 Å²	107.4	73%	0.733	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-75	-9.8	-168.7	-84.4	162.4	0	0	0	116	K44 Q48	K44-L46 VanDerWaalsContact C-N 3.25Å; K44-L46 PolarHBondContact O-N 3.05Å; L46-Q48 VanDerWaalsContact C-N 3.34Å
47	L	30.5	Very low	31.4	Very low	96 Å²	96	107.9 Å²	107.9	50%	0.503	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-82.1	-8.7	179.5	-76.8	166.7	0	0	0	114.1	M35 S45 W51	M35-L47 HydrophobicContact CE-CD1 4.45Å; S45-L47 VanDerWaalsContact C-N 3.33Å; S45-L47 PolarHBondContact O-N 3.02Å; L47-W51 WeakPolarHBondContact O-CB 3.44Å; L47-W51 PolarHBondContact O-N 3.38Å; L47-W51 VanDerWaalsContact O-N 3.08Å
48	Q	30.4	Very low	31.6	Very low	133 Å²	133	108.1 Å²	108.1	62%	0.621	57%	0.568	S	S	*	*	H	α-helix	trans	-72.8	-32.2	-169.2	-164.2	163.8	-4.3	0	0	113.4	L46 L52	L46-Q48 VanDerWaalsContact C-N 3.34Å; Q48-L52 HydrophobicContact CG-CD1 4.36Å; Q48-L52 WeakPolarHBondContact O-CB 3.4Å; Q48-L52 WeakPolarHBondContact O-CD1 3.41Å; Q48-L52 WeakPolarHBondContact O-CG 3.34Å; Q48-L52 PolarHBondContact O-N 3.33Å; Q48-L52 VanDerWaalsContact O-N 3.1Å
49	E	30	Very low	32.2	Very low	165 Å²	165	109 Å²	109	77%	0.771	58%	0.575	S	S	*	*	H	α-helix	trans	-76.4	-45.7	177.7	-62.6	-156.1	133.9	0	0	112.5	W51 L52 A53	E49-W51 VanDerWaalsContact C-N 3.29Å; E49-W51 PolarHBondContact O-N 3.31Å; E49-L52 CarbonylContact O-C 3.58Å; E49-L52 PolarHBondContact O-N 3.13Å; E49-L52 VanDerWaalsContact O-N 3.15Å; E49-A53 WeakPolarHBondContact O-CB 3.25Å; E49-A53 PolarHBondContact O-N 3.43Å
50	D	30.4	Very low	32.6	Very low	123 Å²	123	113.5 Å²	113.5	66%	0.658	59%	0.588	S	S	*	*	H	α-helix	trans	-59.5	-40.7	174.3	-75.1	-30.6	0	0	0	111.7	A53 G54	D50-A53 PolarHBondContact O-N 3.01Å; D50-G54 PolarHBondContact O-N 2.95Å
51	W	35	Very low	33	Very low	141 Å²	141	114.6 Å²	114.6	53%	0.534	59%	0.591	S	S	.	*	H	α-helix	trans	-64.5	-41.2	175.4	-171.8	83.1	0	0	0	112	L47 E49 R55	L47-W51 WeakPolarHBondContact O-CB 3.44Å; L47-W51 PolarHBondContact O-N 3.38Å; L47-W51 VanDerWaalsContact O-N 3.08Å; E49-W51 VanDerWaalsContact C-N 3.29Å; E49-W51 PolarHBondContact O-N 3.31Å; W51-R55 VanDerWaalsContact O-CB 3.29Å; W51-R55 WeakPolarHBondContact O-CB 3.44Å; W51-R55 PolarHBondContact O-N 2.95Å
52	L	33.3	Very low	33.5	Very low	70 Å²	70	109.3 Å²	109.3	37%	0.366	58%	0.575	S	S	.	*	H	α-helix	trans	-68.8	-32.5	174.7	-74.8	170.6	0	0	0	112.9	Q48 E49 R55 R56	Q48-L52 HydrophobicContact CG-CD1 4.36Å; Q48-L52 WeakPolarHBondContact O-CB 3.4Å; Q48-L52 WeakPolarHBondContact O-CD1 3.41Å; Q48-L52 WeakPolarHBondContact O-CG 3.34Å; Q48-L52 PolarHBondContact O-N 3.33Å; Q48-L52 VanDerWaalsContact O-N 3.1Å; E49-L52 CarbonylContact O-C 3.58Å; E49-L52 PolarHBondContact O-N 3.13Å; E49-L52 VanDerWaalsContact O-N 3.15Å; L52-R55 PolarHBondContact O-N 3.42Å; L52-R56 WeakPolarHBondContact O-CG 3.4Å; L52-R56 PolarHBondContact O-N 2.75Å; L52-R56 VanDerWaalsContact O-N 3.15Å
53	A	32	Very low	34.2	Very low	61 Å²	61	112 Å²	112	50%	0.504	59%	0.592	S	S	.	*	H	α-helix	trans	-65.1	-49.4	173.6	0	0	0	0	0	111.2	E49 D50 R55 R56 S57	E49-A53 WeakPolarHBondContact O-CB 3.25Å; E49-A53 PolarHBondContact O-N 3.43Å; D50-A53 PolarHBondContact O-N 3.01Å; A53-R55 VanDerWaalsContact C-N 3.3Å; A53-R55 PolarHBondContact O-N 3.5Å; A53-R56 PolarHBondContact O-N 3.21Å; A53-S57 PolarHBondContact O-N 2.91Å
54	G	34.2	Very low	34.4	Very low	34 Å²	34	116.4 Å²	116.4	35%	0.351	59%	0.586	S	S	.	*	H	α-helix	trans	-58	-41.1	173.2	0	0	0	0	0	112.7	D50 R56 S57 L58	D50-G54 PolarHBondContact O-N 2.95Å; G54-R56 VanDerWaalsContact C-N 3.34Å; G54-R56 PolarHBondContact O-N 2.84Å; G54-S57 PolarHBondContact O-N 3.3Å; G54-S57 VanDerWaalsContact O-N 3.17Å; G54-L58 PolarHBondContact O-N 3.4Å
55	R	32.9	Very low	34.5	Very low	150 Å²	150	115.6 Å²	115.6	57%	0.566	59%	0.591	S	S	*	*	H	α-helix	trans	-61.6	-36.1	178.8	-162.3	175	-171.4	-165	3.6	113.2	W51 L52 A53 S59	W51-R55 VanDerWaalsContact O-CB 3.29Å; W51-R55 WeakPolarHBondContact O-CB 3.44Å; W51-R55 PolarHBondContact O-N 2.95Å; L52-R55 PolarHBondContact O-N 3.42Å; A53-R55 VanDerWaalsContact C-N 3.3Å; A53-R55 PolarHBondContact O-N 3.5Å; R55-S59 WeakPolarHBondContact O-CB 3.44Å; R55-S59 PolarHBondContact O-N 3.15Å; R55-S59 VanDerWaalsContact O-N 3.14Å; R55-S59 PolarHBondContact O-OG 3.04Å
56	R	33.9	Very low	35	Very low	197 Å²	197	112.6 Å²	112.6	74%	0.743	57%	0.571	S	S	*	*	H	α-helix	trans	-67.7	-37.6	174.9	-72.1	179.3	-175	-178	4.4	112.4	L52 A53 G54 S59	L52-R56 WeakPolarHBondContact O-CG 3.4Å; L52-R56 PolarHBondContact O-N 2.75Å; L52-R56 VanDerWaalsContact O-N 3.15Å; A53-R56 PolarHBondContact O-N 3.21Å; G54-R56 VanDerWaalsContact C-N 3.34Å; G54-R56 PolarHBondContact O-N 2.84Å; R56-S59 PolarHBondContact O-OG 3.47Å
57	S	34.2	Very low	35.6	Very low	79 Å²	79	109.7 Å²	109.7	55%	0.552	56%	0.555	S	S	*	*	H	α-helix	trans	-67.7	-51.1	176.1	-172.4	0	0	0	0	111.7	A53 G54 S59 Q60	A53-S57 PolarHBondContact O-N 2.91Å; G54-S57 PolarHBondContact O-N 3.3Å; G54-S57 VanDerWaalsContact O-N 3.17Å; S57-S59 VanDerWaalsContact C-N 3.33Å; S57-S59 PolarHBondContact O-N 3.24Å; S57-Q60 PolarHBondContact O-N 3.1Å
58	L	34	Very low	36.1	Very low	64 Å²	64	110.6 Å²	110.6	34%	0.335	56%	0.56	S	S	.	*	H	α-helix	trans	-67.6	-28.6	-176.7	-74.9	163.4	0	0	0	113.9	G54 Q60 Q61	G54-L58 PolarHBondContact O-N 3.4Å; L58-Q60 PolarHBondContact O-N 3.41Å; L58-Q60 VanDerWaalsContact O-N 3.09Å; L58-Q61 PolarHBondContact O-N 3.16Å; L58-Q61 VanDerWaalsContact O-N 3.12Å
59	S	39.3	Very low	36.7	Very low	76 Å²	76	107.9 Å²	107.9	53%	0.531	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.6	-14.1	177	66	0	0	0	0	114.9	R55 R56 S57	R55-S59 WeakPolarHBondContact O-CB 3.44Å; R55-S59 PolarHBondContact O-N 3.15Å; R55-S59 VanDerWaalsContact O-N 3.14Å; R55-S59 PolarHBondContact O-OG 3.04Å; R56-S59 PolarHBondContact O-OG 3.47Å; S57-S59 VanDerWaalsContact C-N 3.33Å; S57-S59 PolarHBondContact O-N 3.24Å
60	Q	39.6	Very low	37.4	Very low	171 Å²	171	102.1 Å²	102.1	80%	0.799	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-6.6	177.4	-63.8	-173	-16.3	0	0	113.9	S57 L58	S57-Q60 PolarHBondContact O-N 3.1Å; L58-Q60 PolarHBondContact O-N 3.41Å; L58-Q60 VanDerWaalsContact O-N 3.09Å
61	Q	39.7	Very low	38	Very low	157 Å²	157	98.9 Å²	98.9	73%	0.734	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.4	-0.2	-170.6	-66.5	-169.8	-19.3	0	0	115.6	L58	L58-Q61 PolarHBondContact O-N 3.16Å; L58-Q61 VanDerWaalsContact O-N 3.12Å
62	L	37.6	Very low	38.4	Very low	54 Å²	54	95.2 Å²	95.2	28%	0.283	51%	0.509	S	S	.	.			trans	-115.3	129.4	-174.7	-70.3	174.1	0	0	0	113.5	L67	L62-L67 HydrophobicContact CB-CD2 4.41Å; L62-L67 HydrophobicContact CB-CG 4.23Å; L62-L67 HydrophobicContact CD1-CD2 4.47Å
63	N	43.6	Very low	39	Very low	129 Å²	129	95.2 Å²	95.2	69%	0.69	51%	0.509	S	S	*	.			trans	-66.4	152.1	172	-80.8	-28.7	0	0	0	111.9	T65 S66 L67	N63-T65 PolarHBondContact O-N 3.49Å; N63-S66 WeakPolarHBondContact O-CB 3.43Å; N63-S66 PolarHBondContact O-N 2.89Å; N63-L67 PolarHBondContact O-N 3.41Å
64	K	37.6	Very low	39.6	Very low	180 Å²	180	96.2 Å²	96.2	78%	0.783	51%	0.506	S	S	*	.	H	α-helix	trans	-51.8	-33.6	-173	-70.8	-177.8	176	178.6	0	114.9	L67 L68	K64-L67 PolarHBondContact O-N 3.43Å; K64-L68 PolarHBondContact O-N 2.81Å
65	T	34.5	Very low	40.2	Very low	103 Å²	103	97.9 Å²	97.9	63%	0.632	51%	0.505	S	S	*	.	H	α-helix	trans	-66.8	-38.7	177.3	38.9	0	0	0	0	113.1	N63 L67 L68 T69	N63-T65 PolarHBondContact O-N 3.49Å; T65-L67 VanDerWaalsContact C-N 3.35Å; T65-L68 PolarHBondContact O-N 3.4Å; T65-T69 PolarHBondContact O-N 3.33Å
66	S	42.2	Very low	40.8	Very low	42 Å²	42	94.9 Å²	94.9	29%	0.294	50%	0.5	S	S	.	.	H	α-helix	trans	-69.8	-31.9	177.5	-49.7	0	0	0	0	112.6	N63 T69 L70	N63-S66 WeakPolarHBondContact O-CB 3.43Å; N63-S66 PolarHBondContact O-N 2.89Å; S66-T69 PolarHBondContact O-OG1 2.96Å; S66-T69 VanDerWaalsContact O-OG1 3.04Å; S66-L70 WeakPolarHBondContact O-CD1 3.36Å; S66-L70 PolarHBondContact O-N 2.85Å; S66-L70 VanDerWaalsContact O-N 3.1Å
67	L	43.5	Very low	41.3	Very low	78 Å²	78	88.3 Å²	88.3	41%	0.408	49%	0.487	S	S	.	.	H	α-helix	trans	-69.5	-34.1	174.9	-70.9	165.4	0	0	0	111.9	L62 N63 K64 T65 S71	L62-L67 HydrophobicContact CB-CD2 4.41Å; L62-L67 HydrophobicContact CB-CG 4.23Å; L62-L67 HydrophobicContact CD1-CD2 4.47Å; N63-L67 PolarHBondContact O-N 3.41Å; K64-L67 PolarHBondContact O-N 3.43Å; T65-L67 VanDerWaalsContact C-N 3.35Å; L67-S71 WeakPolarHBondContact O-CB 3.5Å; L67-S71 PolarHBondContact O-N 3.48Å
68	L	40.8	Very low	41.8	Very low	115 Å²	115	88.5 Å²	88.5	60%	0.602	49%	0.485	S	S	*	.	H	α-helix	trans	-67.8	-43	174.7	-79.4	161.3	0	0	0	112.1	K64 T65 S71 C72	K64-L68 PolarHBondContact O-N 2.81Å; T65-L68 PolarHBondContact O-N 3.4Å; L68-S71 WeakPolarHBondContact O-CB 3.39Å; L68-S71 PolarHBondContact O-N 2.9Å; L68-C72 PolarHBondContact O-N 3.31Å; L68-C72 PolarHBondContact O-SG 3.01Å; L68-C72 VanDerWaalsContact O-SG 3.38Å
69	T	42	Very low	42.2	Very low	77 Å²	77	88.5 Å²	88.5	47%	0.472	49%	0.49	S	S	.	.	H	α-helix	trans	-67.5	-39.7	176.6	50.1	0	0	0	0	112.4	T65 S66 S71 C72 L73	T65-T69 PolarHBondContact O-N 3.33Å; S66-T69 PolarHBondContact O-OG1 2.96Å; S66-T69 VanDerWaalsContact O-OG1 3.04Å; T69-S71 VanDerWaalsContact C-N 3.3Å; T69-S71 PolarHBondContact O-N 2.89Å; T69-C72 PolarHBondContact O-N 3.48Å; T69-L73 WeakPolarHBondContact O-CB 3.47Å; T69-L73 WeakPolarHBondContact O-CG 3.26Å; T69-L73 PolarHBondContact O-N 2.76Å
70	L	44.9	Very low	42.4	Very low	43 Å²	43	87 Å²	87	23%	0.225	48%	0.482	C	S	.	.	H	α-helix	trans	-60.4	-38.1	169.8	-103.3	89.8	0	0	0	112.3	L25 S66 N74	L25-L70 HydrophobicContact CD2-CD1 4.35Å; S66-L70 WeakPolarHBondContact O-CD1 3.36Å; S66-L70 PolarHBondContact O-N 2.85Å; S66-L70 VanDerWaalsContact O-N 3.1Å; L70-N74 WeakPolarHBondContact O-CB 3.11Å; L70-N74 PolarHBondContact O-N 2.75Å; L70-N74 PolarHBondContact O-ND2 2.79Å
71	S	43.3	Very low	42.5	Very low	55 Å²	55	81.4 Å²	81.4	39%	0.385	47%	0.465	S	S	.	.	H	α-helix	trans	-63.4	-48.1	177.1	-167.3	0	0	0	0	111.5	L67 L68 T69 L73 N74 Q75	L67-S71 WeakPolarHBondContact O-CB 3.5Å; L67-S71 PolarHBondContact O-N 3.48Å; L68-S71 WeakPolarHBondContact O-CB 3.39Å; L68-S71 PolarHBondContact O-N 2.9Å; T69-S71 VanDerWaalsContact C-N 3.3Å; T69-S71 PolarHBondContact O-N 2.89Å; S71-L73 PolarHBondContact O-N 3.2Å; S71-N74 PolarHBondContact O-N 3.42Å; S71-Q75 WeakPolarHBondContact O-CG 3.15Å; S71-Q75 PolarHBondContact O-N 3.23Å
72	C	42.7	Very low	42.6	Very low	65 Å²	65	78.2 Å²	78.2	44%	0.439	45%	0.452	S	S	.	.	H	α-helix	trans	-64	-39.5	177.5	-64.7	0	0	0	0	112.6	L68 T69 Q75 L76	L68-C72 PolarHBondContact O-N 3.31Å; L68-C72 PolarHBondContact O-SG 3.01Å; L68-C72 VanDerWaalsContact O-SG 3.38Å; T69-C72 PolarHBondContact O-N 3.48Å; C72-Q75 PolarHBondContact O-N 3.09Å; C72-L76 WeakPolarHBondContact O-CB 3.29Å; C72-L76 WeakPolarHBondContact O-CG 3.32Å; C72-L76 PolarHBondContact O-N 2.95Å
73	L	46.2	Very low	42.7	Very low	70 Å²	70	79.9 Å²	79.9	37%	0.366	46%	0.461	S	S	.	.	H	α-helix	trans	-66.1	-40.6	176.5	-74.5	168.2	0	0	0	112.1	F29 T69 S71 L76 A77	F29-L73 HydrophobicContact CE1-CD1 4.24Å; F29-L73 HydrophobicContact CZ-CD1 4.15Å; T69-L73 WeakPolarHBondContact O-CB 3.47Å; T69-L73 WeakPolarHBondContact O-CG 3.26Å; T69-L73 PolarHBondContact O-N 2.76Å; S71-L73 PolarHBondContact O-N 3.2Å; L73-L76 PolarHBondContact O-N 3.31Å; L73-A77 WeakPolarHBondContact O-CB 3.44Å; L73-A77 PolarHBondContact O-N 3.31Å
74	N	45.2	Very low	42.5	Very low	82 Å²	82	78.4 Å²	78.4	44%	0.439	45%	0.452	S	S	.	.	H	α-helix	trans	-64.5	-41	173.1	-80.2	-59	0	0	0	112	L70 S71 A77 V78	L70-N74 WeakPolarHBondContact O-CB 3.11Å; L70-N74 PolarHBondContact O-N 2.75Å; L70-N74 PolarHBondContact O-ND2 2.79Å; S71-N74 PolarHBondContact O-N 3.42Å; N74-A77 PolarHBondContact O-N 3.08Å; N74-V78 WeakPolarHBondContact O-CG2 3.36Å; N74-V78 PolarHBondContact O-N 3.46Å
75	Q	46.2	Very low	42.4	Very low	69 Å²	69	76 Å²	76	32%	0.322	44%	0.444	S	S	.	.	H	α-helix	trans	-63.4	-41.6	175.7	-73.4	171	-10.2	0	0	111.8	S71 C72 A77 V78 C79	S71-Q75 WeakPolarHBondContact O-CG 3.15Å; S71-Q75 PolarHBondContact O-N 3.23Å; C72-Q75 PolarHBondContact O-N 3.09Å; Q75-A77 PolarHBondContact O-N 3.37Å; Q75-V78 PolarHBondContact O-N 2.91Å; Q75-C79 WeakPolarHBondContact O-CB 3.38Å; Q75-C79 PolarHBondContact O-N 2.91Å; Q75-C79 PolarHBondContact O-SG 3.08Å; Q75-C79 VanDerWaalsContact O-SG 3.33Å
76	L	45.8	Very low	42.5	Very low	87 Å²	87	76.6 Å²	76.6	46%	0.455	43%	0.434	S	S	.	.	H	α-helix	trans	-62.9	-39.1	172.9	-75.2	166.7	0	0	0	112.4	C72 L73 C79 A80	C72-L76 WeakPolarHBondContact O-CB 3.29Å; C72-L76 WeakPolarHBondContact O-CG 3.32Å; C72-L76 PolarHBondContact O-N 2.95Å; L73-L76 PolarHBondContact O-N 3.31Å; L76-C79 PolarHBondContact O-N 3.24Å; L76-A80 WeakPolarHBondContact O-CB 3.34Å; L76-A80 PolarHBondContact O-N 3.02Å
77	A	44.4	Very low	42.2	Very low	59 Å²	59	81.1 Å²	81.1	49%	0.488	45%	0.451	S	S	.	.	H	α-helix	trans	-66.1	-41.4	176	0	0	0	0	0	112.5	L73 N74 Q75 A80 A81	L73-A77 WeakPolarHBondContact O-CB 3.44Å; L73-A77 PolarHBondContact O-N 3.31Å; N74-A77 PolarHBondContact O-N 3.08Å; Q75-A77 PolarHBondContact O-N 3.37Å; A77-A80 PolarHBondContact O-N 3.22Å; A77-A81 WeakPolarHBondContact O-CB 3.41Å; A77-A81 PolarHBondContact O-N 3.16Å
78	V	43.8	Very low	41.8	Very low	82 Å²	82	83.4 Å²	83.4	50%	0.497	46%	0.462	S	S	.	.	H	α-helix	trans	-64.6	-45.3	174.2	171	0	0	0	0	111.1	N74 Q75 A80 A81 L82	N74-V78 WeakPolarHBondContact O-CG2 3.36Å; N74-V78 PolarHBondContact O-N 3.46Å; Q75-V78 PolarHBondContact O-N 2.91Å; V78-A80 VanDerWaalsContact C-N 3.31Å; V78-A80 PolarHBondContact O-N 3.19Å; V78-A81 PolarHBondContact O-N 3.13Å; V78-L82 HydrophobicContact CG1-CD1 3.98Å; V78-L82 HydrophobicContact CG1-CG 4.47Å; V78-L82 WeakPolarHBondContact O-CG 3.47Å; V78-L82 PolarHBondContact O-N 3.19Å
79	C	42.6	Very low	41.4	Very low	65 Å²	65	84.5 Å²	84.5	44%	0.439	46%	0.464	S	S	.	.	H	α-helix	trans	-61.5	-38.2	175.1	-71.9	0	0	0	0	112.4	Q75 L76 L83	Q75-C79 WeakPolarHBondContact O-CB 3.38Å; Q75-C79 PolarHBondContact O-N 2.91Å; Q75-C79 PolarHBondContact O-SG 3.08Å; Q75-C79 VanDerWaalsContact O-SG 3.33Å; L76-C79 PolarHBondContact O-N 3.24Å; C79-L83 WeakPolarHBondContact O-CB 3.35Å; C79-L83 VanDerWaalsContact O-CG 3.29Å; C79-L83 WeakPolarHBondContact O-CG 3.41Å; C79-L83 PolarHBondContact O-N 3.46Å
80	A	43.4	Very low	40.7	Very low	45 Å²	45	85.5 Å²	85.5	37%	0.372	47%	0.472	S	S	.	.	H	α-helix	trans	-65.3	-42.8	174.2	0	0	0	0	0	112.1	L76 A77 V78 L83 I84	L76-A80 WeakPolarHBondContact O-CB 3.34Å; L76-A80 PolarHBondContact O-N 3.02Å; A77-A80 PolarHBondContact O-N 3.22Å; V78-A80 VanDerWaalsContact C-N 3.31Å; V78-A80 PolarHBondContact O-N 3.19Å; A80-L83 PolarHBondContact O-N 3.47Å; A80-I84 VanDerWaalsContact O-CG1 3.3Å; A80-I84 WeakPolarHBondContact O-CG1 3.49Å; A80-I84 PolarHBondContact O-N 3.15Å
81	A	42.2	Very low	40	Very low	53 Å²	53	94.1 Å²	94.1	44%	0.438	50%	0.503	S	S	.	.	H	α-helix	trans	-61	-46.3	175.9	0	0	0	0	0	112	A77 V78 L83 I84 Q85	A77-A81 WeakPolarHBondContact O-CB 3.41Å; A77-A81 PolarHBondContact O-N 3.16Å; V78-A81 PolarHBondContact O-N 3.13Å; A81-L83 VanDerWaalsContact C-N 3.33Å; A81-L83 PolarHBondContact O-N 2.85Å; A81-I84 PolarHBondContact O-N 2.73Å; A81-Q85 WeakPolarHBondContact O-CB 3.29Å; A81-Q85 PolarHBondContact O-N 2.84Å
82	L	41.5	Very low	39.4	Very low	90 Å²	90	95.5 Å²	95.5	47%	0.471	51%	0.513	S	S	.	.	H	α-helix	trans	-63.3	-35.7	177.2	-69.5	169.5	0	0	0	112.7	V78 R86	V78-L82 HydrophobicContact CG1-CD1 3.98Å; V78-L82 HydrophobicContact CG1-CG 4.47Å; V78-L82 WeakPolarHBondContact O-CG 3.47Å; V78-L82 PolarHBondContact O-N 3.19Å; L82-R86 PolarHBondContact O-N 3.42Å; L82-R86 VanDerWaalsContact O-N 3.12Å
83	L	40.7	Very low	38.8	Very low	89 Å²	89	99 Å²	99	47%	0.466	53%	0.532	S	S	.	.	H	α-helix	trans	-69.5	-41.2	174.8	-74.5	168.8	0	0	0	112.3	C79 A80 A81 Q85 R86 E87	C79-L83 WeakPolarHBondContact O-CB 3.35Å; C79-L83 VanDerWaalsContact O-CG 3.29Å; C79-L83 WeakPolarHBondContact O-CG 3.41Å; C79-L83 PolarHBondContact O-N 3.46Å; A80-L83 PolarHBondContact O-N 3.47Å; A81-L83 VanDerWaalsContact C-N 3.33Å; A81-L83 PolarHBondContact O-N 2.85Å; L83-Q85 VanDerWaalsContact C-N 3.32Å; L83-R86 PolarHBondContact O-N 2.81Å; L83-R86 VanDerWaalsContact O-N 3.14Å; L83-E87 PolarHBondContact O-N 3.35Å
84	I	39.4	Very low	37.9	Very low	98 Å²	98	103.1 Å²	103.1	50%	0.503	56%	0.555	S	S	.	*	H	α-helix	trans	-63.2	-40.9	174.2	-68.9	163.5	0	0	0	110.4	A80 A81 R86 E87	A80-I84 VanDerWaalsContact O-CG1 3.3Å; A80-I84 WeakPolarHBondContact O-CG1 3.49Å; A80-I84 PolarHBondContact O-N 3.15Å; A81-I84 PolarHBondContact O-N 2.73Å; I84-R86 PolarHBondContact O-N 3.22Å; I84-E87 PolarHBondContact O-N 2.89Å
85	Q	34.9	Very low	37.1	Very low	130 Å²	130	105.5 Å²	105.5	61%	0.607	56%	0.561	S	S	*	*	H	α-helix	trans	-63.5	-26.6	175.7	-161.7	168.7	5	0	0	112.3	A81 L83 I88	A81-Q85 WeakPolarHBondContact O-CB 3.29Å; A81-Q85 PolarHBondContact O-N 2.84Å; L83-Q85 VanDerWaalsContact C-N 3.32Å; Q85-I88 WeakPolarHBondContact O-CB 3.47Å
86	R	36.8	Very low	36.4	Very low	115 Å²	115	106.7 Å²	106.7	43%	0.434	57%	0.573	S	S	.	*	H	α-helix	trans	-83.2	-20.1	176.6	-162.9	173.1	-177.8	-176.5	0.8	114.4	L82 L83 I84 I88 E89	L82-R86 PolarHBondContact O-N 3.42Å; L82-R86 VanDerWaalsContact O-N 3.12Å; L83-R86 PolarHBondContact O-N 2.81Å; L83-R86 VanDerWaalsContact O-N 3.14Å; I84-R86 PolarHBondContact O-N 3.22Å; R86-I88 PolarHBondContact O-N 3.43Å; R86-E89 PolarHBondContact O-N 2.95Å
87	E	35.4	Very low	35.6	Very low	136 Å²	136	109.9 Å²	109.9	64%	0.636	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-11.3	167.9	-76.5	-163.1	147.5	0	0	112.7	M1 L83 I84	M1-E87 WeakPolarHBondContact CE-OE1 3.29Å; L83-E87 PolarHBondContact O-N 3.35Å; I84-E87 PolarHBondContact O-N 2.89Å
88	I	36.2	Very low	35	Very low	127 Å²	127	114.2 Å²	114.2	65%	0.651	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-24.7	178.5	-56.2	175.9	0	0	0	112.2	Q85 R86	Q85-I88 WeakPolarHBondContact O-CB 3.47Å; R86-I88 PolarHBondContact O-N 3.43Å
89	E	30.9	Very low	34.5	Very low	138 Å²	138	114 Å²	114	65%	0.645	60%	0.596	S	S	*	*			trans	-129.5	88.3	-177.6	-66.3	-162.6	157.4	0	0	113	R86 Y91	R86-E89 PolarHBondContact O-N 2.95Å; E89-Y91 VanDerWaalsContact C-N 3.34Å; E89-Y91 PolarHBondContact O-N 3.13Å; E89-Y91 VanDerWaalsContact O-N 3.11Å
90	P	28.6	Very low	34.1	Very low	98 Å²	98	116.6 Å²	116.6	64%	0.636	61%	0.605	S	S	*	*			trans	-88.1	38.6	-167.3	36.2	-38.4	0	0	0	115.3
91	Y	29.1	Very low	33.7	Very low	224 Å²	224	117.6 Å²	117.6	88%	0.878	61%	0.609	S	S	*	*			trans	-139.3	70.5	-178.5	-73.6	-71.7	0	0	0	115.6	E89	E89-Y91 VanDerWaalsContact C-N 3.34Å; E89-Y91 PolarHBondContact O-N 3.13Å; E89-Y91 VanDerWaalsContact O-N 3.11Å
92	S	30.4	Very low	33.3	Very low	84 Å²	84	118.3 Å²	118.3	59%	0.587	61%	0.61	S	S	*	*			trans	-148.1	118.1	145.8	63.5	0	0	0	0	112.1
93	T	31.4	Very low	33	Very low	138 Å²	138	120.4 Å²	120.4	85%	0.847	62%	0.616	S	S	*	*			trans	-102.1	95.1	168.8	49.2	0	0	0	0	109
94	D	27.4	Very low	32.8	Very low	156 Å²	156	122.6 Å²	122.6	83%	0.834	62%	0.622	S	S	*	*			trans	-169.1	118.5	149.6	-96.2	-29.9	0	0	0	107.7
95	F	27.8	Very low	32.6	Very low	133 Å²	133	120.3 Å²	120.3	58%	0.583	61%	0.614	S	S	*	*			trans	-141.6	120.5	175.4	-114.5	-103	0	0	0	107.4	D99	F95-D99 HydrophobicContact CD1-CB 3.82Å; F95-D99 WeakPolarHBondContact CD1-OD2 3.41Å; F95-D99 HydrophobicContact CE1-CB 3.63Å
96	T	31.4	Very low	32.6	Very low	93 Å²	93	115.8 Å²	115.8	57%	0.571	60%	0.599	S	S	*	*			trans	-87.7	164.5	-177.7	63	0	0	0	0	110.9	Q98 D99	T96-Q98 PolarHBondContact O-N 3.15Å; T96-D99 PolarHBondContact O-N 3.3Å
97	L	28.5	Very low	32.6	Very low	154 Å²	154	114.7 Å²	114.7	81%	0.806	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-8.5	-174.4	-80.4	158.8	0	0	0	115
98	Q	32.3	Very low	32.7	Very low	150 Å²	150	112.7 Å²	112.7	70%	0.701	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-41.2	-179.6	-75	-177	-54.1	0	0	113	T96 L100 S101	T96-Q98 PolarHBondContact O-N 3.15Å; Q98-L100 VanDerWaalsContact C-N 3.27Å; Q98-L100 PolarHBondContact O-N 2.9Å; Q98-S101 VanDerWaalsContact O-CB 3.31Å; Q98-S101 WeakPolarHBondContact O-CB 2.95Å; Q98-S101 PolarHBondContact O-N 3.37Å; Q98-S101 PolarHBondContact O-OG 3.08Å
99	D	34	Very low	32.8	Very low	78 Å²	78	111.5 Å²	111.5	42%	0.417	59%	0.59	S	S	.	*	H	α-helix	trans	-67.4	-28.3	-173.8	-59	-63.6	0	0	0	113.3	F95 T96 S101	F95-D99 HydrophobicContact CD1-CB 3.82Å; F95-D99 WeakPolarHBondContact CD1-OD2 3.41Å; F95-D99 HydrophobicContact CE1-CB 3.63Å; T96-D99 PolarHBondContact O-N 3.3Å; D99-S101 VanDerWaalsContact C-N 3.26Å; D99-S101 PolarHBondContact O-N 3.01Å
100	L	33.6	Very low	33.1	Very low	120 Å²	120	110.9 Å²	110.9	63%	0.628	59%	0.591	S	S	*	*	H	α-helix	trans	-67.4	-24.4	173	-79.2	158.9	0	0	0	112.9	Q98 F103 K104	Q98-L100 VanDerWaalsContact C-N 3.27Å; Q98-L100 PolarHBondContact O-N 2.9Å; L100-F103 PolarHBondContact O-N 2.89Å; L100-K104 PolarHBondContact O-N 2.9Å
101	S	34.6	Very low	33.2	Very low	65 Å²	65	110.4 Å²	110.4	46%	0.455	58%	0.583	S	S	.	*	H	α-helix	trans	-69.2	-38.9	178.6	75.1	0	0	0	0	112.3	Q98 D99 F103 K104 C105	Q98-S101 VanDerWaalsContact O-CB 3.31Å; Q98-S101 WeakPolarHBondContact O-CB 2.95Å; Q98-S101 PolarHBondContact O-N 3.37Å; Q98-S101 PolarHBondContact O-OG 3.08Å; D99-S101 VanDerWaalsContact C-N 3.26Å; D99-S101 PolarHBondContact O-N 3.01Å; S101-F103 VanDerWaalsContact C-N 3.34Å; S101-F103 PolarHBondContact O-N 3.37Å; S101-K104 PolarHBondContact O-N 3.4Å; S101-C105 PolarHBondContact O-N 3.1Å
102	C	35.3	Very low	33.6	Very low	68 Å²	68	105.2 Å²	105.2	46%	0.459	58%	0.576	S	S	.	*	H	α-helix	trans	-62.6	-40.6	176	-64.3	0	0	0	0	111.9	A106	C102-A106 WeakPolarHBondContact O-CB 3.29Å; C102-A106 PolarHBondContact O-N 3.23Å
103	F	34.3	Very low	33.7	Very low	134 Å²	134	105.7 Å²	105.7	59%	0.588	58%	0.58	S	S	*	*	H	α-helix	trans	-62.6	-43	174.5	-99.2	-84.4	0	0	0	112.5	L100 S101 A106 T107	L100-F103 PolarHBondContact O-N 2.89Å; S101-F103 VanDerWaalsContact C-N 3.34Å; S101-F103 PolarHBondContact O-N 3.37Å; F103-A106 PolarHBondContact O-N 2.8Å; F103-T107 PolarHBondContact O-N 3.47Å; F103-T107 VanDerWaalsContact O-N 3.13Å; F103-T107 PolarHBondContact O-OG1 3.41Å
104	K	35.3	Very low	34	Very low	135 Å²	135	102.7 Å²	102.7	59%	0.587	57%	0.569	S	S	*	*	H	α-helix	trans	-65.7	-44.8	-179.5	-159.9	-176.7	179	-167	0	112.1	L100 S101 A106 T107 E108	L100-K104 PolarHBondContact O-N 2.9Å; S101-K104 PolarHBondContact O-N 3.4Å; K104-A106 VanDerWaalsContact C-N 3.31Å; K104-A106 PolarHBondContact O-N 3.02Å; K104-T107 PolarHBondContact O-N 3.43Å; K104-T107 PolarHBondContact O-OG1 2.92Å; K104-E108 VanDerWaalsContact CE-OE1 3.23Å; K104-E108 WeakPolarHBondContact CE-OE1 3.28Å; K104-E108 IonicContact NZ-OE1 2.73Å; K104-E108 WeakPolarHBondContact O-CG 3.37Å; K104-E108 PolarHBondContact O-N 3.4Å
105	C	35.9	Very low	34.3	Very low	50 Å²	50	102.3 Å²	102.3	34%	0.338	57%	0.567	S	S	.	*	H	α-helix	trans	-61.2	-37.1	173.5	-76.5	0	0	0	0	112.9	S101 T107 E108 L109	S101-C105 PolarHBondContact O-N 3.1Å; C105-T107 VanDerWaalsContact C-N 3.35Å; C105-E108 PolarHBondContact O-N 2.76Å; C105-L109 WeakPolarHBondContact O-CB 3.32Å; C105-L109 WeakPolarHBondContact O-CG 3.14Å; C105-L109 PolarHBondContact O-N 2.99Å
106	A	35.5	Very low	34.7	Very low	36 Å²	36	104.5 Å²	104.5	30%	0.298	58%	0.579	S	S	.	*	H	α-helix	trans	-65.8	-35.8	177.2	0	0	0	0	0	112.6	C102 F103 K104 L110	C102-A106 WeakPolarHBondContact O-CB 3.29Å; C102-A106 PolarHBondContact O-N 3.23Å; F103-A106 PolarHBondContact O-N 2.8Å; K104-A106 VanDerWaalsContact C-N 3.31Å; K104-A106 PolarHBondContact O-N 3.02Å; A106-L110 WeakPolarHBondContact O-CD1 3.15Å; A106-L110 WeakPolarHBondContact O-CG 3.42Å
107	T	35.6	Very low	34.6	Very low	92 Å²	92	109.3 Å²	109.3	56%	0.564	60%	0.595	S	S	*	*	H	α-helix	trans	-72.4	-40.5	172.6	43	0	0	0	0	113	F103 K104 C105 L109 L110	F103-T107 PolarHBondContact O-N 3.47Å; F103-T107 VanDerWaalsContact O-N 3.13Å; F103-T107 PolarHBondContact O-OG1 3.41Å; K104-T107 PolarHBondContact O-N 3.43Å; K104-T107 PolarHBondContact O-OG1 2.92Å; C105-T107 VanDerWaalsContact C-N 3.35Å; T107-L109 VanDerWaalsContact C-N 3.26Å; T107-L109 PolarHBondContact O-N 2.93Å; T107-L110 PolarHBondContact O-N 3.21Å; T107-L110 VanDerWaalsContact O-N 3.14Å
108	E	38.3	Very low	34.9	Very low	93 Å²	93	109.3 Å²	109.3	44%	0.435	60%	0.601	S	S	.	*	H	α-helix	trans	-66	-27	178.2	-71.8	172.8	-165	0	0	112.6	K104 C105 L110	K104-E108 VanDerWaalsContact CE-OE1 3.23Å; K104-E108 WeakPolarHBondContact CE-OE1 3.28Å; K104-E108 IonicContact NZ-OE1 2.73Å; K104-E108 WeakPolarHBondContact O-CG 3.37Å; K104-E108 PolarHBondContact O-N 3.4Å; C105-E108 PolarHBondContact O-N 2.76Å; E108-L110 VanDerWaalsContact C-N 3.31Å
109	L	39.2	Very low	34.8	Very low	102 Å²	102	104.6 Å²	104.6	53%	0.534	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.4	-6.5	174.6	-78.7	168	0	0	0	114.7	C105 T107	C105-L109 WeakPolarHBondContact O-CB 3.32Å; C105-L109 WeakPolarHBondContact O-CG 3.14Å; C105-L109 PolarHBondContact O-N 2.99Å; T107-L109 VanDerWaalsContact C-N 3.26Å; T107-L109 PolarHBondContact O-N 2.93Å
110	L	35.9	Very low	34.7	Very low	126 Å²	126	107.8 Å²	107.8	66%	0.66	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	-2.8	-178.1	-74.7	171.3	0	0	0	113.8	A106 T107 E108 P112	A106-L110 WeakPolarHBondContact O-CD1 3.15Å; A106-L110 WeakPolarHBondContact O-CG 3.42Å; T107-L110 PolarHBondContact O-N 3.21Å; T107-L110 VanDerWaalsContact O-N 3.14Å; E108-L110 VanDerWaalsContact C-N 3.31Å; L110-P112 WeakPolarHBondContact O-CD 3.4Å
111	D	32.3	Very low	34.9	Very low	88 Å²	88	105.8 Å²	105.8	47%	0.471	63%	0.626	S	S	.	*			trans	-85.5	114.3	178.9	-161.3	-37.5	0	0	0	111	S113	D111-S113 VanDerWaalsContact CG-OG 3.31Å; D111-S113 PolarHBondContact O-N 3.19Å; D111-S113 WeakPolarHBondContact OD1-CB 3.45Å; D111-S113 PolarHBondContact OD1-N 3.24Å; D111-S113 PolarHBondContact OD1-OG 2.76Å
112	P	35.8	Very low	35	Very low	114 Å²	114	109 Å²	109	74%	0.74	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-68.1	-15.9	-177.4	-19	33.4	0	0	0	114	L110 A114	L110-P112 WeakPolarHBondContact O-CD 3.4Å; P112-A114 PolarHBondContact O-N 2.92Å
113	S	34.1	Very low	35	Very low	94 Å²	94	112.4 Å²	112.4	66%	0.657	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-76.9	-16.7	-172.2	64.4	0	0	0	0	114.5	D111 N115	D111-S113 VanDerWaalsContact CG-OG 3.31Å; D111-S113 PolarHBondContact O-N 3.19Å; D111-S113 WeakPolarHBondContact OD1-CB 3.45Å; D111-S113 PolarHBondContact OD1-N 3.24Å; D111-S113 PolarHBondContact OD1-OG 2.76Å; S113-N115 VanDerWaalsContact C-N 3.29Å; S113-N115 PolarHBondContact O-N 2.84Å
114	A	37	Very low	35	Very low	76 Å²	76	109.6 Å²	109.6	63%	0.628	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-83.1	12.2	-175.1	0	0	0	0	0	115.5	P112	P112-A114 PolarHBondContact O-N 2.92Å
115	N	34.2	Very low	35.1	Very low	148 Å²	148	106.9 Å²	106.9	79%	0.791	64%	0.642	S	S	*	*	S	Bend	trans	-107.8	24.7	-173.2	-86.4	-42.4	0	0	0	114.6	S113	S113-N115 VanDerWaalsContact C-N 3.29Å; S113-N115 PolarHBondContact O-N 2.84Å
116	Q	34.8	Very low	35	Very low	179 Å²	179	111.2 Å²	111.2	84%	0.836	66%	0.657	S	S	*	*	S	Bend	trans	-129.6	153.4	170.1	-72.2	-171.5	-35	0	0	111.6
117	E	30	Very low	34.9	Very low	194 Å²	194	112.5 Å²	112.5	91%	0.907	66%	0.659	S	S	*	*			trans	68.3	103.6	-176.1	-52.8	-159.7	159.3	0	0	116.3
118	V	33.9	Very low	34.9	Very low	154 Å²	154	114 Å²	114	93%	0.933	66%	0.658	S	S	*	*			trans	-93.3	108.9	174.8	177	0	0	0	0	109.5
119	G	30.7	Very low	34.7	Very low	50 Å²	50	117 Å²	117	52%	0.515	67%	0.665	S	S	.	*			trans	-105.8	140.6	169.6	0	0	0	0	0	112.1	G121	G119-G121 PolarHBondContact O-N 2.97Å; G119-G121 VanDerWaalsContact O-N 3.12Å
120	P	31.4	Very low	34.3	Very low	145 Å²	145	120.5 Å²	120.5	94%	0.942	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	99.6	-179.8	30.8	-33.7	0	0	0	111.3
121	G	39.3	Very low	34.2	Very low	79 Å²	79	119.1 Å²	119.1	81%	0.814	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	166.9	4.4	176.1	0	0	0	0	0	117.7	G119	G119-G121 PolarHBondContact O-N 2.97Å; G119-G121 VanDerWaalsContact O-N 3.12Å
122	V	36.1	Very low	34.2	Very low	132 Å²	132	118.4 Å²	118.4	80%	0.8	66%	0.664	S	S	*	*	S	Bend	trans	-110.2	138	-177.5	-173.5	0	0	0	0	110.3
123	E	34.4	Very low	34	Very low	140 Å²	140	115.7 Å²	115.7	65%	0.654	65%	0.647	S	S	*	*			trans	-57.8	143.6	175.3	-79	-155.1	118.9	0	0	112.5	N127	E123-N127 PolarHBondContact OE1-ND2 3.18Å
124	P	34.3	Very low	34	Very low	74 Å²	74	115.9 Å²	115.9	48%	0.481	64%	0.641	S	S	.	*			trans	-65	139.5	-177.6	26.9	-34.6	0	0	0	112.2	E126 N127	P124-E126 PolarHBondContact O-N 3.48Å; P124-N127 PolarHBondContact O-N 3.11Å
125	V	37.6	Very low	33.9	Very low	79 Å²	79	114 Å²	114	48%	0.479	63%	0.629	S	S	.	*	H	α-helix	trans	-53.5	-23.3	178.8	176.7	0	0	0	0	112.9	K128 R129	V125-K128 PolarHBondContact O-N 2.82Å; V125-R129 HydrophobicContact CG1-CG 4.49Å; V125-R129 WeakPolarHBondContact O-CG 3.45Å; V125-R129 PolarHBondContact O-N 3.5Å
126	E	34.9	Very low	33.8	Very low	140 Å²	140	109 Å²	109	65%	0.654	60%	0.602	S	S	*	*	H	α-helix	trans	-65.7	-32.5	176.4	-59.6	-169.3	123.7	0	0	113.8	P124 R129 R130	P124-E126 PolarHBondContact O-N 3.48Å; E126-R129 PolarHBondContact O-N 2.87Å; E126-R130 PolarHBondContact O-N 2.81Å
127	N	32.4	Very low	33.6	Very low	64 Å²	64	105 Å²	105	34%	0.342	59%	0.587	S	S	.	*	H	α-helix	trans	-65.5	-45	173.4	-83.9	-1.9	0	0	0	110.8	E123 P124 R129 R130 C131	E123-N127 PolarHBondContact OE1-ND2 3.18Å; P124-N127 PolarHBondContact O-N 3.11Å; N127-R129 VanDerWaalsContact C-N 3.27Å; N127-R129 PolarHBondContact O-N 2.75Å; N127-R130 PolarHBondContact O-N 3.27Å; N127-C131 PolarHBondContact O-N 3.28Å
128	K	36.5	Very low	33.7	Very low	124 Å²	124	103.5 Å²	103.5	54%	0.539	58%	0.577	S	S	.	*	H	α-helix	trans	-59.7	-36.8	173.7	-67.8	-170.3	176.4	-172.2	0	112	V125 F132	V125-K128 PolarHBondContact O-N 2.82Å; K128-F132 PolarHBondContact O-N 3.07Å
129	R	33.1	Very low	33.5	Very low	156 Å²	156	100 Å²	100	59%	0.589	56%	0.556	S	S	*	*	H	α-helix	trans	-68.5	-37.7	175.8	-71.1	175	-176.8	176	4.4	113.1	V125 E126 N127 F132 S133	V125-R129 HydrophobicContact CG1-CG 4.49Å; V125-R129 WeakPolarHBondContact O-CG 3.45Å; V125-R129 PolarHBondContact O-N 3.5Å; E126-R129 PolarHBondContact O-N 2.87Å; N127-R129 VanDerWaalsContact C-N 3.27Å; N127-R129 PolarHBondContact O-N 2.75Å; R129-F132 PolarHBondContact O-N 3.42Å; R129-S133 WeakPolarHBondContact O-CB 3.35Å; R129-S133 PolarHBondContact O-N 2.71Å
130	R	31.8	Very low	33.4	Very low	175 Å²	175	101.1 Å²	101.1	66%	0.66	55%	0.552	S	S	*	*	H	α-helix	trans	-60.1	-51.9	173.3	-90.8	-176.4	169.5	159.6	-2.1	111.9	E126 N127 F132 S133 D134	E126-R130 PolarHBondContact O-N 2.81Å; N127-R130 PolarHBondContact O-N 3.27Å; R130-F132 PolarHBondContact O-N 3.1Å; R130-S133 WeakPolarHBondContact O-CB 3.45Å; R130-S133 PolarHBondContact O-N 3.01Å; R130-D134 PolarHBondContact O-N 2.8Å
131	C	33.3	Very low	33.2	Very low	97 Å²	97	97.5 Å²	97.5	66%	0.655	53%	0.531	S	S	*	.	H	α-helix	trans	-57.4	-36.1	179.2	-61.6	0	0	0	0	112.9	N127 G135	N127-C131 PolarHBondContact O-N 3.28Å; C131-G135 PolarHBondContact O-N 3.42Å; C131-G135 VanDerWaalsContact O-N 3.16Å
132	F	33.5	Very low	32.7	Very low	73 Å²	73	100.9 Å²	100.9	32%	0.32	53%	0.527	S	S	.	.	H	α-helix	trans	-70.3	-42.7	175.4	-158.4	-107.6	0	0	0	112.3	K128 R129 R130 G135 I136	K128-F132 PolarHBondContact O-N 3.07Å; R129-F132 PolarHBondContact O-N 3.42Å; R130-F132 PolarHBondContact O-N 3.1Å; F132-G135 PolarHBondContact O-N 3.47Å; F132-I136 HydrophobicContact CD1-CD1 3.59Å; F132-I136 HydrophobicContact CE1-CD1 3.49Å; F132-I136 VanDerWaalsContact CE1-CD1 3.49Å; F132-I136 HydrophobicContact CG-CD1 4.42Å; F132-I136 HydrophobicContact CZ-CD1 4.24Å; F132-I136 WeakPolarHBondContact O-CG1 3.34Å; F132-I136 PolarHBondContact O-N 2.94Å
133	S	31.8	Very low	32.4	Very low	57 Å²	57	100.3 Å²	100.3	40%	0.399	52%	0.519	S	S	.	.	H	α-helix	trans	-60.2	-46	174.9	-179.3	0	0	0	0	112.4	R129 R130 I136 N137	R129-S133 WeakPolarHBondContact O-CB 3.35Å; R129-S133 PolarHBondContact O-N 2.71Å; R130-S133 WeakPolarHBondContact O-CB 3.45Å; R130-S133 PolarHBondContact O-N 3.01Å; S133-I136 PolarHBondContact O-N 3.25Å; S133-N137 PolarHBondContact O-N 2.99Å; S133-N137 PolarHBondContact O-ND2 3.08Å
134	D	33.6	Very low	32	Very low	97 Å²	97	99.9 Å²	99.9	52%	0.519	52%	0.521	S	S	.	.	H	α-helix	trans	-72.2	-30.8	-177.1	-63.8	-29	0	0	0	112.2	R130 K138	R130-D134 PolarHBondContact O-N 2.8Å; D134-K138 PolarHBondContact O-N 3.14Å
135	G	33.9	Very low	31.7	Very low	37 Å²	37	102.3 Å²	102.3	38%	0.381	53%	0.526	S	S	.	.	H	α-helix	trans	-65.7	-40.3	168.4	0	0	0	0	0	113.2	C131 F132 K138 T139	C131-G135 PolarHBondContact O-N 3.42Å; C131-G135 VanDerWaalsContact O-N 3.16Å; F132-G135 PolarHBondContact O-N 3.47Å; G135-K138 WeakPolarHBondContact O-CB 3.41Å; G135-K138 PolarHBondContact O-N 2.8Å; G135-T139 PolarHBondContact O-N 3.39Å; G135-T139 PolarHBondContact O-OG1 3.49Å
136	I	32.6	Very low	31.2	Very low	43 Å²	43	101.6 Å²	101.6	22%	0.221	54%	0.535	C	S	.	.	H	α-helix	trans	-69.5	-42.9	177.7	-72.8	169.1	0	0	0	111.5	F132 S133 K138 T139 V140	F132-I136 HydrophobicContact CD1-CD1 3.59Å; F132-I136 HydrophobicContact CE1-CD1 3.49Å; F132-I136 VanDerWaalsContact CE1-CD1 3.49Å; F132-I136 HydrophobicContact CG-CD1 4.42Å; F132-I136 HydrophobicContact CZ-CD1 4.24Å; F132-I136 WeakPolarHBondContact O-CG1 3.34Å; F132-I136 PolarHBondContact O-N 2.94Å; S133-I136 PolarHBondContact O-N 3.25Å; I136-K138 PolarHBondContact O-N 2.88Å; I136-T139 WeakPolarHBondContact CA-OG1 3.22Å; I136-T139 PolarHBondContact O-N 3.11Å; I136-T139 PolarHBondContact O-OG1 3.45Å; I136-T139 VanDerWaalsContact O-OG1 3.13Å; I136-V140 HydrophobicContact CG2-CG2 4.06Å; I136-V140 WeakPolarHBondContact O-CG2 3.31Å; I136-V140 PolarHBondContact O-N 2.67Å
137	N	30.4	Very low	30.8	Very low	96 Å²	96	98.4 Å²	98.4	51%	0.513	54%	0.54	S	S	.	.	H	α-helix	trans	-60.5	-31.3	175.6	-71.1	-27.9	0	0	0	112.1	S133 S141	S133-N137 PolarHBondContact O-N 2.99Å; S133-N137 PolarHBondContact O-ND2 3.08Å; N137-S141 WeakPolarHBondContact O-CB 3.04Å; N137-S141 PolarHBondContact O-N 2.57Å; N137-S141 PolarHBondContact O-OG 3.44Å
138	K	31.5	Very low	30.5	Very low	161 Å²	161	102.6 Å²	102.6	70%	0.7	56%	0.56	S	S	*	*	H	α-helix	trans	-70.9	-27.3	171.3	-102.8	-177.9	174.8	179.5	0	114.7	D134 G135 I136 S141 M142	D134-K138 PolarHBondContact O-N 3.14Å; G135-K138 WeakPolarHBondContact O-CB 3.41Å; G135-K138 PolarHBondContact O-N 2.8Å; I136-K138 PolarHBondContact O-N 2.88Å; K138-S141 PolarHBondContact O-OG 2.93Å; K138-M142 WeakPolarHBondContact O-CG 3.46Å
139	T	30.4	Very low	29.9	Very low	82 Å²	82	104.6 Å²	104.6	50%	0.503	58%	0.577	S	S	.	*	H	α-helix	trans	-90.9	-34.4	178.7	23.5	0	0	0	0	112.7	G135 I136 M142	G135-T139 PolarHBondContact O-N 3.39Å; G135-T139 PolarHBondContact O-OG1 3.49Å; I136-T139 WeakPolarHBondContact CA-OG1 3.22Å; I136-T139 PolarHBondContact O-N 3.11Å; I136-T139 PolarHBondContact O-OG1 3.45Å; I136-T139 VanDerWaalsContact O-OG1 3.13Å; T139-M142 PolarHBondContact O-N 3.46Å
140	V	28.4	Very low	29.6	Very low	72 Å²	72	104.2 Å²	104.2	44%	0.436	59%	0.586	S	S	.	*	H	α-helix	trans	-65.7	-40.6	174.1	176.4	0	0	0	0	111.2	I136 M142 L143	I136-V140 HydrophobicContact CG2-CG2 4.06Å; I136-V140 WeakPolarHBondContact O-CG2 3.31Å; I136-V140 PolarHBondContact O-N 2.67Å; V140-M142 PolarHBondContact O-N 2.91Å; V140-M142 VanDerWaalsContact O-N 3.13Å; V140-L143 PolarHBondContact O-N 3.1Å
141	S	27.4	Very low	29.2	Very low	70 Å²	70	105.3 Å²	105.3	49%	0.49	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.9	-11.5	175.2	52.2	0	0	0	0	114.7	N137 K138	N137-S141 WeakPolarHBondContact O-CB 3.04Å; N137-S141 PolarHBondContact O-N 2.57Å; N137-S141 PolarHBondContact O-OG 3.44Å; K138-S141 PolarHBondContact O-OG 2.93Å
142	M	29.2	Very low	28.8	Very low	149 Å²	149	105 Å²	105	73%	0.734	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-8.5	170.9	-66.3	179.5	69.5	0	0	113.8	K138 T139 V140	K138-M142 WeakPolarHBondContact O-CG 3.46Å; T139-M142 PolarHBondContact O-N 3.46Å; V140-M142 PolarHBondContact O-N 2.91Å; V140-M142 VanDerWaalsContact O-N 3.13Å
143	L	29.2	Very low	28.3	Very low	121 Å²	121	105.1 Å²	105.1	63%	0.634	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	-32.3	-177.2	-64.3	171.8	0	0	0	113.1	V140 H145	V140-L143 PolarHBondContact O-N 3.1Å; L143-H145 PolarHBondContact O-N 3.29Å; L143-H145 VanDerWaalsContact O-N 3.08Å
144	D	26.1	Very low	27.9	Very low	130 Å²	130	111.8 Å²	111.8	70%	0.695	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	13.8	-175	-83.8	-20.7	0	0	0	115.4
145	H	28.1	Very low	27.4	Very low	125 Å²	125	114.1 Å²	114.1	58%	0.579	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.5	15.3	-178.4	-74.6	2.4	0	0	0	114.8	L143 G147	L143-H145 PolarHBondContact O-N 3.29Å; L143-H145 VanDerWaalsContact O-N 3.08Å; H145-G147 PolarHBondContact O-N 3.48Å
146	G	27.8	Very low	26.9	Very low	65 Å²	65	120.3 Å²	120.3	67%	0.67	69%	0.693	S	S	*	*			trans	-72.3	65.4	169.1	0	0	0	0	0	113.8	I148	G146-I148 PolarHBondContact O-N 2.74Å; G146-I148 VanDerWaalsContact O-N 3.11Å
147	G	25.9	Very low	26.3	Very low	73 Å²	73	124 Å²	124	75%	0.753	72%	0.722	S	S	*	*			trans	-69.9	98.7	-174.5	0	0	0	0	0	114.8	H145 N149	H145-G147 PolarHBondContact O-N 3.48Å; G147-N149 PolarHBondContact O-N 3.04Å
148	I	25.4	Very low	25.9	Very low	152 Å²	152	124.1 Å²	124.1	78%	0.779	74%	0.737	S	S	*	*			trans	-79.4	101.6	171.9	-57.5	174.1	0	0	0	109.5	G146 L150	G146-I148 PolarHBondContact O-N 2.74Å; G146-I148 VanDerWaalsContact O-N 3.11Å; I148-L150 PolarHBondContact O-N 3.26Å; I148-L150 VanDerWaalsContact O-N 3.16Å
149	N	24.4	Very low	25.4	Very low	165 Å²	165	121.5 Å²	121.5	88%	0.882	74%	0.739	S	S	*	*			trans	-81.1	92.8	176.6	-112.8	-16.9	0	0	0	111.5	G147	G147-N149 PolarHBondContact O-N 3.04Å
150	L	26.9	Very low	24.9	Very low	148 Å²	148	127.1 Å²	127.1	78%	0.775	76%	0.757	S	S	*	*			trans	-83.8	122.4	163.5	-85.9	159.8	0	0	0	109.5	I148 A152	I148-L150 PolarHBondContact O-N 3.26Å; I148-L150 VanDerWaalsContact O-N 3.16Å; L150-A152 PolarHBondContact O-N 3.4Å
151	M	22.8	Very low	24.5	Very low	198 Å²	198	132.8 Å²	132.8	98%	0.975	78%	0.775	S	S	*	*			trans	-69	98.5	169.9	-86.3	-72.6	-171.8	0	0	110.1
152	A	25.9	Very low	24.1	Very low	90 Å²	90	139.4 Å²	139.4	74%	0.744	80%	0.796	S	S	*	*			trans	-105.2	145.8	165.7	0	0	0	0	0	109.9	L150	L150-A152 PolarHBondContact O-N 3.4Å
153	G	23.1	Very low	23.7	Very low	77 Å²	77	137.6 Å²	137.6	79%	0.794	80%	0.798	S	S	*	*			trans	-68.4	159.7	-174.3	0	0	0	0	0	114.5	V155	G153-V155 PolarHBondContact O-N 2.92Å
154	Q	23.6	Very low	23.9	Very low	197 Å²	197	136.7 Å²	136.7	92%	0.921	80%	0.799	S	S	*	*			trans	-61.9	128.4	176.5	-62.8	167.9	-38.8	0	0	111.9
155	V	22.6	Very low	23.6	Very low	146 Å²	146	137.7 Å²	137.7	89%	0.885	81%	0.805	S	S	*	*			trans	-133.9	135.7	147.3	-177.7	0	0	0	0	107.5	G153	G153-V155 PolarHBondContact O-N 2.92Å
156	L	22.7	Very low	23.3	Very low	166 Å²	166	137.1 Å²	137.1	87%	0.869	81%	0.81	S	S	*	*			trans	-75.7	147.8	-173.4	-72.2	163.4	0	0	0	112.5
157	S	20	Very low	23.1	Very low	120 Å²	120	142.9 Å²	142.9	84%	0.839	82%	0.82	S	S	*	*			trans	-73.3	128.3	169.9	55.9	0	0	0	0	111.8
158	A	22.3	Very low	23	Very low	99 Å²	99	143.1 Å²	143.1	82%	0.818	82%	0.822	S	S	*	*			trans	-145.3	124.8	158.5	0	0	0	0	0	110.2
159	S	21.3	Very low	22.7	Very low	106 Å²	106	141.3 Å²	141.3	74%	0.741	82%	0.822	S	S	*	*			trans	-70.1	155.9	172.1	-49.6	0	0	0	0	111.1
160	F	20.1	Very low	22.6	Very low	201 Å²	201	140.8 Å²	140.8	88%	0.882	82%	0.816	S	S	*	*				-173.3	-175	118.5	-101.2	-64.5	0	0	0	112
161	K	19.7	Very low	22.3	Very low	190 Å²	190	139.5 Å²	139.5	83%	0.826	81%	0.808	S	S	*	*			trans	-100.7	162.3	-163	-60.3	171	-179.3	175.1	0	112.6
162	F	19.1	Very low	22.3	Very low	209 Å²	209	139.5 Å²	139.5	92%	0.917	80%	0.803	S	S	*	*			trans	-50.6	149	156.9	-86.7	-100.1	0	0	0	110.6
163	S	20.7	Very low	22.1	Very low	111 Å²	111	142 Å²	142	78%	0.776	80%	0.804	S	S	*	*				-150.2	179.8	64.2	64.2	0	0	0	0	113.8
164	P	32.9	Very low	22	Very low	102 Å²	102	143.2 Å²	143.2	66%	0.662	81%	0.806	S	S	*	*			trans	-105.6	167.1	-162.2	40.5	-35.5	0	0	0	115.6
165	N	20.9	Very low	22	Very low	151 Å²	151	143.4 Å²	143.4	81%	0.807	80%	0.804	S	S	*	*				-169.4	168.3	122.8	-101.8	-7.5	0	0	0	115
166	T	22.1	Very low	22.4	Very low	114 Å²	114	141.5 Å²	141.5	70%	0.699	80%	0.795	S	S	*	*			trans	-40.5	154.8	171.7	51.2	0	0	0	0	115.8
167	E	23	Very low	22.4	Very low	186 Å²	186	142.6 Å²	142.6	87%	0.869	80%	0.796	S	S	*	*				-172.2	153.8	63.2	-74.6	-176	151.3	0	0	113.1
168	G	22.4	Very low	22.6	Very low	77 Å²	77	141.3 Å²	141.3	79%	0.794	79%	0.792	S	S	*	*			trans	68.9	167.4	154.8	0	0	0	0	0	119.9
169	C	20.6	Very low	22.8	Very low	115 Å²	115	142.7 Å²	142.7	78%	0.777	79%	0.793	S	S	*	*			cis	-157	118.6	-24.7	-157.7	0	0	0	0	112.9
170	M	21.4	Very low	23.1	Very low	154 Å²	154	145.5 Å²	145.5	76%	0.759	80%	0.798	S	S	*	*			trans	44.7	122.7	150.1	-62.5	-159.3	-60.9	0	0	125.8
171	I	22	Very low	23.4	Very low	120 Å²	120	145 Å²	145	62%	0.615	80%	0.799	S	S	*	*				58.4	116.8	121	-50.6	168.6	0	0	0	120.3
172	F	21.6	Very low	23.9	Very low	198 Å²	198	144.8 Å²	144.8	87%	0.868	80%	0.8	S	S	*	*				-167	158.4	104	-109.5	-66.8	0	0	0	114.4
173	D	21.7	Very low	24.1	Very low	142 Å²	142	142.6 Å²	142.6	76%	0.759	80%	0.798	S	S	*	*			trans	-80	153.9	-169.8	-60.9	-92.7	0	0	0	116.7
174	A	21.4	Very low	24.6	Very low	103 Å²	103	145.7 Å²	145.7	85%	0.851	80%	0.799	S	S	*	*			trans	-153.6	115.2	143.9	0	0	0	0	0	112.9
175	K	23	Very low	24.6	Very low	202 Å²	202	151.4 Å²	151.4	88%	0.878	81%	0.808	S	S	*	*			trans	-116.3	161.5	151.4	-115.1	-175.9	179.5	174.5	0	105.8
176	P	31.1	Very low	25.3	Very low	105 Å²	105	153.6 Å²	153.6	68%	0.682	81%	0.81	S	S	*	*			cis	-150.1	-163.9	45.8	32	-5.4	0	0	0	116.1
177	Q	22.9	Very low	26.6	Very low	190 Å²	190	151 Å²	151	89%	0.888	79%	0.794	S	S	*	*			trans	88.7	146.7	159.7	-55.4	-170.2	-1.2	0	0	119.1
178	A	24	Very low	28.4	Very low	93 Å²	93	143.5 Å²	143.5	77%	0.769	76%	0.761	S	S	*	*			trans	-145.8	166	175.7	0	0	0	0	0	107.4
179	P	27.3	Very low	30.2	Very low	127 Å²	127	140 Å²	140	83%	0.825	72%	0.724	S	S	*	*			trans	-121.4	146.1	149.5	20.8	-3.1	0	0	0	112.3
180	L	27.9	Very low	31.7	Very low	165 Å²	165	139.6 Å²	139.6	86%	0.864	71%	0.709	S	S	*	*			trans	-77.9	138.6	170.6	-74.1	157.6	0	0	0	110.5
181	Q	26.3	Very low	33.3	Very low	190 Å²	190	136 Å²	136	89%	0.888	69%	0.69	S	S	*	*			trans	-134.2	127.2	154	-73	-165.9	-8.8	0	0	110.3	L183	Q181-L183 PolarHBondContact O-N 2.88Å; Q181-L183 VanDerWaalsContact O-N 3.14Å
182	H	30.2	Very low	35.1	Very low	186 Å²	186	132.9 Å²	132.9	86%	0.861	68%	0.675	S	S	*	*			trans	-78.1	91.1	176.9	-105.7	-100.7	0	0	0	110.2
183	L	23.2	Very low	36.8	Very low	164 Å²	164	124.7 Å²	124.7	86%	0.859	64%	0.64	S	S	*	*			trans	-78.3	129.8	171.6	-165.4	66.8	0	0	0	110.3	Q181 R185	Q181-L183 PolarHBondContact O-N 2.88Å; Q181-L183 VanDerWaalsContact O-N 3.14Å; L183-R185 PolarHBondContact O-N 3.32Å
184	H	30.4	Very low	38.5	Very low	175 Å²	175	122.1 Å²	122.1	81%	0.81	63%	0.625	S	S	*	*			trans	-63.5	119.2	173.5	-81.4	51.3	0	0	0	109.8	K186	H184-K186 PolarHBondContact O-N 3.38Å
185	R	32.4	Very low	39.7	Very low	222 Å²	222	122.7 Å²	122.7	84%	0.838	61%	0.612	S	S	*	*			trans	-66.9	100.2	174	-103.7	-176.2	167.3	165.8	-3.8	110	L183 T187	L183-R185 PolarHBondContact O-N 3.32Å; R185-T187 VanDerWaalsContact C-N 3.32Å; R185-T187 PolarHBondContact O-N 3Å; R185-T187 VanDerWaalsContact O-N 3.07Å
186	K	36.5	Very low	41.2	Very low	198 Å²	198	117 Å²	117	86%	0.861	59%	0.585	S	S	*	*			trans	-69.4	91.7	158.5	-69.4	-174.6	177.1	-175.1	0	107.9	H184 T188	H184-K186 PolarHBondContact O-N 3.38Å; K186-T188 PolarHBondContact O-N 3.1Å
187	T	48.4	Very low	41.8	Very low	59 Å²	59	116.6 Å²	116.6	36%	0.362	57%	0.57	S	S	.	*			trans	-66.5	118.4	177.4	-44	0	0	0	0	109.4	R185 E191 L192 M195	R185-T187 VanDerWaalsContact C-N 3.32Å; R185-T187 PolarHBondContact O-N 3Å; R185-T187 VanDerWaalsContact O-N 3.07Å; T187-E191 HydrophobicContact CG2-CB 3.67Å; T187-L192 HydrophobicContact CG2-CD2 3.76Å; T187-L192 HydrophobicContact CG2-CG 3.91Å; T187-M195 HydrophobicContact CG2-SD 4.38Å
188	T	62.3	Low	42.7	Very low	29 Å²	29	113.1 Å²	113.1	18%	0.178	55%	0.554	C	S	.	*			trans	-64.5	152.8	178.4	55	0	0	0	0	111.4	K186 K190 E191 L192 D302	K186-T188 PolarHBondContact O-N 3.1Å; T188-K190 PolarHBondContact O-N 2.86Å; T188-E191 WeakPolarHBondContact CB-OE2 3.38Å; T188-E191 PolarHBondContact N-OE2 3.47Å; T188-E191 CarbonylContact O-C 3.54Å; T188-E191 WeakPolarHBondContact O-CA 3.4Å; T188-E191 WeakPolarHBondContact O-CB 3.25Å; T188-E191 PolarHBondContact O-N 3.3Å; T188-E191 VanDerWaalsContact OG1-CB 3.29Å; T188-E191 WeakPolarHBondContact OG1-CB 3.44Å; T188-E191 VanDerWaalsContact OG1-CD 3.3Å; T188-E191 WeakPolarHBondContact OG1-CG 3.32Å; T188-E191 PolarHBondContact OG1-N 3.07Å; T188-E191 PolarHBondContact OG1-OE2 3.25Å; T188-L192 WeakPolarHBondContact O-CG 3.49Å; T188-L192 PolarHBondContact O-N 3.08Å; T188-D302 HydrophobicContact CG2-CB 4.19Å
189	V	60.5	Low	43.2	Very low	2 Å²	2	114.9 Å²	114.9	1%	0.012	54%	0.544	C	S	.	.	H	α-helix	trans	-56.6	-36.8	171.3	-176	0	0	0	0	110.8	L192 L193 M300 D302 F308 I311	V189-L192 PolarHBondContact O-N 3.01Å; V189-L193 WeakPolarHBondContact O-CB 3.12Å; V189-L193 PolarHBondContact O-N 3.5Å; V189-M300 HydrophobicContact CG2-CB 4.17Å; V189-M300 WeakPolarHBondContact CG2-O 3.4Å; V189-D302 HydrophobicContact CB-CB 3.9Å; V189-D302 HydrophobicContact CG2-CB 3.95Å; V189-D302 VanDerWaalsContact N-CB 3.33Å; V189-F308 HydrophobicContact CG1-CB 4.46Å; V189-F308 HydrophobicContact CG1-CD1 3.64Å; V189-F308 HydrophobicContact CG1-CD2 3.92Å; V189-F308 HydrophobicContact CG1-CE1 3.72Å; V189-F308 HydrophobicContact CG1-CE2 3.99Å; V189-F308 HydrophobicContact CG1-CG 3.74Å; V189-F308 HydrophobicContact CG1-CZ 3.9Å; V189-I311 HydrophobicContact CB-CD1 4.13Å; V189-I311 HydrophobicContact CG1-CD1 3.85Å
190	K	51.9	Low	43.7	Very low	108 Å²	108	112.4 Å²	112.4	47%	0.47	52%	0.518	S	S	.	.	H	α-helix	trans	-55.4	-50.5	168.1	-162.8	171.7	-168	163.6	0	113.1	T188 L193 I194 D302 D304 I311	T188-K190 PolarHBondContact O-N 2.86Å; K190-L193 PolarHBondContact O-N 3.14Å; K190-I194 WeakPolarHBondContact O-CD1 3.08Å; K190-I194 VanDerWaalsContact O-CG1 3.26Å; K190-I194 WeakPolarHBondContact O-CG1 3.22Å; K190-I194 PolarHBondContact O-N 3.36Å; K190-D302 PolarHBondContact N-OD2 3.42Å; K190-D304 IonicContact NZ-OD2 2.61Å; K190-I311 HydrophobicContact CB-CD1 4.43Å
191	E	55.2	Low	43.9	Very low	77 Å²	77	109.7 Å²	109.7	36%	0.36	50%	0.504	S	S	.	.	H	α-helix	trans	-65.8	-40.9	173.2	-75.5	164.2	123.9	0	0	112.5	T187 T188 L193 I194 M195	T187-E191 HydrophobicContact CG2-CB 3.67Å; T188-E191 WeakPolarHBondContact CB-OE2 3.38Å; T188-E191 PolarHBondContact N-OE2 3.47Å; T188-E191 CarbonylContact O-C 3.54Å; T188-E191 WeakPolarHBondContact O-CA 3.4Å; T188-E191 WeakPolarHBondContact O-CB 3.25Å; T188-E191 PolarHBondContact O-N 3.3Å; T188-E191 VanDerWaalsContact OG1-CB 3.29Å; T188-E191 WeakPolarHBondContact OG1-CB 3.44Å; T188-E191 VanDerWaalsContact OG1-CD 3.3Å; T188-E191 WeakPolarHBondContact OG1-CG 3.32Å; T188-E191 PolarHBondContact OG1-N 3.07Å; T188-E191 PolarHBondContact OG1-OE2 3.25Å; E191-L193 VanDerWaalsContact C-N 3.3Å; E191-L193 PolarHBondContact O-N 3.35Å; E191-I194 CarbonylContact O-C 3.57Å; E191-I194 PolarHBondContact O-N 2.97Å; E191-I194 VanDerWaalsContact O-N 3.1Å; E191-M195 WeakPolarHBondContact O-CB 3.38Å; E191-M195 WeakPolarHBondContact O-CG 3.2Å; E191-M195 PolarHBondContact O-N 2.88Å
192	L	59.3	Low	44.1	Very low	56 Å²	56	104.4 Å²	104.4	29%	0.293	49%	0.488	S	S	.	.	H	α-helix	trans	-60.9	-39.7	175.8	-69.9	174.3	0	0	0	111.1	T187 T188 V189 R196 M300 F308	T187-L192 HydrophobicContact CG2-CD2 3.76Å; T187-L192 HydrophobicContact CG2-CG 3.91Å; T188-L192 WeakPolarHBondContact O-CG 3.49Å; T188-L192 PolarHBondContact O-N 3.08Å; V189-L192 PolarHBondContact O-N 3.01Å; L192-R196 WeakPolarHBondContact O-CB 3.45Å; L192-R196 PolarHBondContact O-N 3.01Å; L192-M300 HydrophobicContact CD1-CE 3.6Å; L192-F308 HydrophobicContact CB-CE1 4.35Å; L192-F308 HydrophobicContact CB-CZ 4.18Å; L192-F308 HydrophobicContact CD1-CZ 4.26Å
193	L	56.2	Low	44.4	Very low	26 Å²	26	101 Å²	101	14%	0.136	47%	0.472	C	S	.	.	H	α-helix	trans	-65.6	-42	171.4	-84.7	174.8	0	0	0	111.9	V189 K190 E191 R197 F308 I311	V189-L193 WeakPolarHBondContact O-CB 3.12Å; V189-L193 PolarHBondContact O-N 3.5Å; K190-L193 PolarHBondContact O-N 3.14Å; E191-L193 VanDerWaalsContact C-N 3.3Å; E191-L193 PolarHBondContact O-N 3.35Å; L193-R197 WeakPolarHBondContact O-CB 3.05Å; L193-R197 PolarHBondContact O-N 3.39Å; L193-F308 HydrophobicContact CD1-CD1 4.11Å; L193-F308 HydrophobicContact CD2-CD1 3.73Å; L193-F308 HydrophobicContact CD2-CE1 4.02Å; L193-F308 HydrophobicContact CG-CD1 3.66Å; L193-F308 HydrophobicContact CG-CE1 3.81Å; L193-I311 HydrophobicContact CD1-CB 3.72Å; L193-I311 HydrophobicContact CD1-CD1 3.83Å; L193-I311 HydrophobicContact CD1-CG1 4.37Å; L193-I311 HydrophobicContact CD1-CG2 3.47Å; L193-I311 VanDerWaalsContact CD1-CG2 3.47Å
194	I	58.8	Low	44.9	Very low	88 Å²	88	101.5 Å²	101.5	45%	0.451	47%	0.471	S	S	.	.	H	α-helix	trans	-64.9	-46.4	177.3	-70.4	162.6	0	0	0	111	K190 E191 R197 Q198	K190-I194 WeakPolarHBondContact O-CD1 3.08Å; K190-I194 VanDerWaalsContact O-CG1 3.26Å; K190-I194 WeakPolarHBondContact O-CG1 3.22Å; K190-I194 PolarHBondContact O-N 3.36Å; E191-I194 CarbonylContact O-C 3.57Å; E191-I194 PolarHBondContact O-N 2.97Å; E191-I194 VanDerWaalsContact O-N 3.1Å; I194-R197 CarbonylContact O-C 3.54Å; I194-R197 PolarHBondContact O-N 3.24Å; I194-Q198 WeakPolarHBondContact O-CG 3.32Å; I194-Q198 PolarHBondContact O-N 2.87Å
195	M	45.5	Very low	44.7	Very low	114 Å²	114	102.3 Å²	102.3	56%	0.562	47%	0.472	S	S	*	.	H	α-helix	trans	-65.9	-41.7	177.1	-67.1	-177	81.3	0	0	111.7	T187 E191 R197 Q198 K199	T187-M195 HydrophobicContact CG2-SD 4.38Å; E191-M195 WeakPolarHBondContact O-CB 3.38Å; E191-M195 WeakPolarHBondContact O-CG 3.2Å; E191-M195 PolarHBondContact O-N 2.88Å; M195-R197 VanDerWaalsContact C-N 3.32Å; M195-R197 PolarHBondContact O-N 3.34Å; M195-Q198 PolarHBondContact O-N 3.48Å; M195-K199 PolarHBondContact O-N 3.29Å
196	R	54.6	Low	44.3	Very low	83 Å²	83	102.6 Å²	102.6	31%	0.313	47%	0.473	S	S	.	.	H	α-helix	trans	-67.8	-32	175	-162.9	165	-178.5	143.3	-3.1	111.3	L192 K199 W200 K289 G292 L293	L192-R196 WeakPolarHBondContact O-CB 3.45Å; L192-R196 PolarHBondContact O-N 3.01Å; R196-K199 PolarHBondContact O-N 2.84Å; R196-W200 WeakPolarHBondContact O-CB 3.32Å; R196-W200 PolarHBondContact O-N 2.72Å; R196-K289 PolarHBondContact NH2-O 3.17Å; R196-G292 PolarHBondContact NH1-O 3.41Å; R196-G292 PolarHBondContact NH2-O 2.9Å; R196-L293 VanDerWaalsContact NH1-CD2 3.34Å
197	R	44.8	Very low	43.8	Very low	96 Å²	96	99.5 Å²	99.5	36%	0.362	47%	0.466	S	S	.	.	H	α-helix	trans	-73.6	-31.6	172.6	-168.5	176	-160.1	-96	2.3	113.2	E42 L193 I194 M195 W200 N201	E42-R197 IonicContact OE1-CZ 2.84Å; E42-R197 IonicContact OE1-NH1 2.74Å; E42-R197 PolarHBondContact OE1-NH1 3.37Å; E42-R197 IonicContact OE1-NH2 3.62Å; E42-R197 PolarHBondContact OE1-NH2 3.17Å; L193-R197 WeakPolarHBondContact O-CB 3.05Å; L193-R197 PolarHBondContact O-N 3.39Å; I194-R197 CarbonylContact O-C 3.54Å; I194-R197 PolarHBondContact O-N 3.24Å; M195-R197 VanDerWaalsContact C-N 3.32Å; M195-R197 PolarHBondContact O-N 3.34Å; R197-W200 WeakPolarHBondContact O-CB 3.34Å; R197-N201 WeakPolarHBondContact O-CB 3.47Å; R197-N201 PolarHBondContact O-N 2.97Å; R197-N201 PolarHBondContact O-OD1 3.5Å
198	Q	40.7	Very low	42.7	Very low	118 Å²	118	104.9 Å²	104.9	55%	0.551	49%	0.492	S	S	*	.	H	α-helix	trans	-68	-45.4	168.8	-75	169.6	-14.9	0	0	110.6	I194 M195 W200 N201 S202	I194-Q198 WeakPolarHBondContact O-CG 3.32Å; I194-Q198 PolarHBondContact O-N 2.87Å; M195-Q198 PolarHBondContact O-N 3.48Å; Q198-W200 PolarHBondContact O-N 3.34Å; Q198-N201 PolarHBondContact O-N 3.14Å; Q198-S202 WeakPolarHBondContact O-CB 3.49Å; Q198-S202 PolarHBondContact O-N 2.98Å; Q198-S202 PolarHBondContact O-OG 2.8Å
199	K	35.9	Very low	41.1	Very low	129 Å²	129	111.1 Å²	111.1	56%	0.561	52%	0.519	S	S	*	.	H	α-helix	trans	-58.8	-46.3	174.1	-167.3	-178.7	-172.1	-102.8	0	112	M195 R196 N201 S202 E203	M195-K199 PolarHBondContact O-N 3.29Å; R196-K199 PolarHBondContact O-N 2.84Å; K199-N201 PolarHBondContact O-N 3.28Å; K199-S202 CarbonylContact O-C 3.52Å; K199-S202 WeakPolarHBondContact O-CA 3.34Å; K199-S202 WeakPolarHBondContact O-CB 3.41Å; K199-S202 PolarHBondContact O-N 2.99Å; K199-E203 WeakPolarHBondContact CE-OE1 3.46Å; K199-E203 HydrophobicContact CG-CG 4.49Å; K199-E203 IonicContact NZ-OE1 2.67Å; K199-E203 PolarHBondContact NZ-OE1 2.91Å; K199-E203 WeakPolarHBondContact O-CG 3.39Å; K199-E203 PolarHBondContact O-N 2.83Å
200	W	36.8	Very low	39.5	Very low	76 Å²	76	116.8 Å²	116.8	29%	0.288	56%	0.555	S	S	.	*	H	α-helix	trans	-56.2	-42.1	174.8	-177.1	-64.2	0	0	0	113.9	R196 R197 Q198 S202 E286 K289	R196-W200 WeakPolarHBondContact O-CB 3.32Å; R196-W200 PolarHBondContact O-N 2.72Å; R197-W200 WeakPolarHBondContact O-CB 3.34Å; Q198-W200 PolarHBondContact O-N 3.34Å; W200-S202 VanDerWaalsContact C-N 3.26Å; W200-S202 PolarHBondContact O-N 3.49Å; W200-E286 WeakPolarHBondContact CH2-OE1 3.28Å; W200-E286 VanDerWaalsContact CH2-OE2 3.22Å; W200-E286 WeakPolarHBondContact CH2-OE2 3.37Å; W200-E286 WeakPolarHBondContact CZ2-OE1 3.42Å; W200-K289 HydrophobicContact CD2-CD 3.69Å; W200-K289 HydrophobicContact CE3-CB 3.91Å; W200-K289 HydrophobicContact CE3-CD 3.65Å; W200-K289 HydrophobicContact CE3-CG 4.24Å; W200-K289 HydrophobicContact CG-CD 4.49Å; W200-K289 HydrophobicContact CH2-CB 3.96Å; W200-K289 HydrophobicContact CH2-CD 3.72Å; W200-K289 HydrophobicContact CH2-CG 3.9Å; W200-K289 HydrophobicContact CZ2-CD 3.77Å; W200-K289 HydrophobicContact CZ2-CG 4.4Å; W200-K289 HydrophobicContact CZ3-CB 3.42Å; W200-K289 VanDerWaalsContact CZ3-CB 3.42Å; W200-K289 HydrophobicContact CZ3-CD 3.67Å; W200-K289 HydrophobicContact CZ3-CG 3.82Å
201	N	31.6	Very low	38.5	Very low	108 Å²	108	120.2 Å²	120.2	58%	0.578	57%	0.57	S	S	*	*	H	α-helix	trans	-75.3	-14.7	172.7	-70.6	7.5	0	0	0	112.7	R197 Q198 K199	R197-N201 WeakPolarHBondContact O-CB 3.47Å; R197-N201 PolarHBondContact O-N 2.97Å; R197-N201 PolarHBondContact O-OD1 3.5Å; Q198-N201 PolarHBondContact O-N 3.14Å; K199-N201 PolarHBondContact O-N 3.28Å
202	S	30	Very low	37	Very low	78 Å²	78	124.7 Å²	124.7	55%	0.545	60%	0.596	S	S	.	*	H	α-helix	trans	-92.7	-23.3	178.6	-53.4	0	0	0	0	113.6	Q198 K199 W200 Q204 K205	Q198-S202 WeakPolarHBondContact O-CB 3.49Å; Q198-S202 PolarHBondContact O-N 2.98Å; Q198-S202 PolarHBondContact O-OG 2.8Å; K199-S202 CarbonylContact O-C 3.52Å; K199-S202 WeakPolarHBondContact O-CA 3.34Å; K199-S202 WeakPolarHBondContact O-CB 3.41Å; K199-S202 PolarHBondContact O-N 2.99Å; W200-S202 VanDerWaalsContact C-N 3.26Å; W200-S202 PolarHBondContact O-N 3.49Å; S202-Q204 PolarHBondContact O-N 3.22Å; S202-K205 PolarHBondContact O-N 3.41Å
203	E	37.3	Very low	35.3	Very low	114 Å²	114	131.6 Å²	131.6	53%	0.533	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70	16.2	-178.6	-77.5	170.1	178	0	0	114.2	K199	K199-E203 WeakPolarHBondContact CE-OE1 3.46Å; K199-E203 HydrophobicContact CG-CG 4.49Å; K199-E203 IonicContact NZ-OE1 2.67Å; K199-E203 PolarHBondContact NZ-OE1 2.91Å; K199-E203 WeakPolarHBondContact O-CG 3.39Å; K199-E203 PolarHBondContact O-N 2.83Å
204	Q	34.7	Very low	33.8	Very low	175 Å²	175	135.9 Å²	135.9	82%	0.818	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	14.3	169.1	-76.7	-71.9	-10.6	0	0	113.2	S202	S202-Q204 PolarHBondContact O-N 3.22Å
205	K	24.5	Very low	32.2	Very low	192 Å²	192	137.4 Å²	137.4	84%	0.835	67%	0.671	S	S	*	*	S	Bend	trans	-140.2	141.6	171.3	-131.5	171.3	-176.3	176.9	0	111.9	S202	S202-K205 PolarHBondContact O-N 3.41Å
206	W	24.5	Very low	31	Very low	229 Å²	229	140.9 Å²	140.9	87%	0.867	68%	0.683	S	S	*	*			trans	-73.5	148.9	-161.6	-75.9	89.7	0	0	0	116
207	N	25.8	Very low	29.4	Very low	132 Å²	132	144.9 Å²	144.9	71%	0.706	70%	0.7	S	S	*	*			trans	22.9	122.1	150.4	-65.2	-0.6	0	0	0	120.1
208	L	25.9	Very low	28.4	Very low	173 Å²	173	147.8 Å²	147.8	91%	0.906	72%	0.717	S	S	*	*			trans	-159	139.1	132.7	-106.4	151.4	0	0	0	110
209	E	29.5	Very low	28	Very low	160 Å²	160	147.4 Å²	147.4	75%	0.748	73%	0.725	S	S	*	*			trans	-73.7	147.1	179.4	-62.2	-174.8	150.4	0	0	112.9
210	P	26.9	Very low	27.3	Very low	120 Å²	120	149.3 Å²	149.3	78%	0.779	74%	0.74	S	S	*	*			trans	-112.4	116.3	145.2	-0.5	21.6	0	0	0	110.9
211	K	29.2	Very low	26.6	Very low	180 Å²	180	150.2 Å²	150.2	78%	0.783	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-65.1	129.4	177	-62.5	168	-179.1	173.8	0	111.3
212	L	23.7	Very low	26.2	Very low	171 Å²	171	149.2 Å²	149.2	90%	0.895	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-98.6	137.6	156.1	-107.3	75.8	0	0	0	110
213	K	24	Very low	25.9	Very low	202 Å²	202	151.8 Å²	151.8	88%	0.878	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-88.2	140.2	179.1	-63	178.2	-179.7	178.3	0	110.6
214	S	25.9	Very low	25.3	Very low	115 Å²	115	153.8 Å²	153.8	80%	0.804	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-88.3	149.4	164.4	50.5	0	0	0	0	111.3
215	P	23.9	Very low	24.7	Very low	121 Å²	121	150.7 Å²	150.7	79%	0.786	79%	0.787	S	S	*	*			trans	-106.4	147	169	35.9	-29.9	0	0	0	113.5
216	K	20.5	Very low	25.2	Very low	186 Å²	186	146.5 Å²	146.5	81%	0.809	78%	0.779	S	S	*	*			trans	-163.4	150.4	177.6	-91.5	-143.8	174.5	-165.7	0	109.9
217	Y	21.9	Very low	25.1	Very low	168 Å²	168	143.8 Å²	143.8	66%	0.659	78%	0.776	S	S	*	*			cis	-166.1	125	-15	-158.5	-115.7	0	0	0	108.9
218	E	23.1	Very low	24.9	Very low	156 Å²	156	145.6 Å²	145.6	73%	0.729	78%	0.782	S	S	*	*			trans	58.3	-174.6	164.7	-60.6	-175.4	147.6	0	0	116.4
219	P	31.4	Very low	24.8	Very low	111 Å²	111	141.3 Å²	141.3	72%	0.721	77%	0.771	S	S	*	*			cis	-127.3	178	-14.4	39.6	-24.3	0	0	0	114.8
220	I	22.1	Very low	24.4	Very low	169 Å²	169	140.5 Å²	140.5	87%	0.867	78%	0.778	S	S	*	*				-177.5	150.1	126.6	-94.3	160	0	0	0	110.4
221	A	21.9	Very low	24.2	Very low	94 Å²	94	140 Å²	140	78%	0.777	78%	0.777	S	S	*	*			trans	-88.5	-178.2	-173.4	0	0	0	0	0	112.7
222	A	24.6	Very low	24.4	Very low	87 Å²	87	136.7 Å²	136.7	72%	0.719	77%	0.774	S	S	*	*			cis	-153	-165.1	14.6	0	0	0	0	0	109.7
223	D	22.1	Very low	24.3	Very low	132 Å²	132	134.9 Å²	134.9	71%	0.706	77%	0.77	S	S	*	*			cis	-162	-179.6	8.4	-149.8	-12.2	0	0	0	112.6
224	M	24.8	Very low	24.3	Very low	156 Å²	156	129.9 Å²	129.9	77%	0.768	76%	0.76	S	S	*	*			trans	64.6	103.9	157.1	-65.1	-64.6	149.5	0	0	120.8
225	S	22.7	Very low	24.2	Very low	111 Å²	111	132.6 Å²	132.6	78%	0.776	77%	0.765	S	S	*	*			trans	-82	-167	155.4	-58.3	0	0	0	0	109.8
226	P	35.3	Very low	24.1	Very low	103 Å²	103	133.6 Å²	133.6	67%	0.669	76%	0.759	S	S	*	*			cis	-148.4	-170.4	9.4	40.6	-16.7	0	0	0	118.3
227	Q	22.6	Very low	24.3	Very low	173 Å²	173	132.7 Å²	132.7	81%	0.808	76%	0.762	S	S	*	*			trans	77.8	152.9	160	-63	179.5	26.7	0	0	119.3
228	M	22.1	Very low	24.3	Very low	169 Å²	169	130.3 Å²	130.3	83%	0.833	76%	0.761	S	S	*	*			cis	-165.5	143.1	-40	-114.9	-153.3	-160.2	0	0	110.5
229	A	21.9	Very low	24.4	Very low	83 Å²	83	127.4 Å²	127.4	69%	0.686	76%	0.758	S	S	*	*			trans	64.1	161	147.1	0	0	0	0	0	122.7
230	T	21.9	Very low	24	Very low	144 Å²	144	128.2 Å²	128.2	88%	0.883	76%	0.761	S	S	*	*			trans	75.2	122.8	165.7	62.6	0	0	0	0	120.6
231	S	23.5	Very low	24.1	Very low	109 Å²	109	123.8 Å²	123.8	76%	0.762	75%	0.75	S	S	*	*			trans	-100.1	-172.8	151.9	62.4	0	0	0	0	107.9
232	P	33.1	Very low	24.1	Very low	110 Å²	110	124.2 Å²	124.2	71%	0.714	75%	0.745	S	S	*	*			cis	-141.6	-154.8	5.9	40.4	-18	0	0	0	114.7
233	T	22.2	Very low	24	Very low	134 Å²	134	129.6 Å²	129.6	82%	0.822	75%	0.753	S	S	*	*			trans	108	154.1	153.9	-31.6	0	0	0	0	116.8
234	S	22.9	Very low	24.1	Very low	96 Å²	96	130.5 Å²	130.5	67%	0.671	76%	0.756	S	S	*	*			trans	-121.9	153.3	-159.2	53.1	0	0	0	0	115.2
235	L	23.2	Very low	24.2	Very low	172 Å²	172	128.3 Å²	128.3	90%	0.901	75%	0.754	S	S	*	*			trans	-145.4	127.2	153.7	-65.7	176.2	0	0	0	105.8
236	H	22.5	Very low	24.1	Very low	142 Å²	142	130.4 Å²	130.4	66%	0.657	76%	0.756	S	S	*	*			cis	97.3	92.1	22.2	-149.4	-46.1	0	0	0	115.4	N238	H236-N238 PolarHBondContact CE1-OD1 3.34Å; H236-N238 VanDerWaalsContact CE1-OD1 3.24Å
237	L	24.3	Very low	23.5	Very low	168 Å²	168	132.5 Å²	132.5	88%	0.88	76%	0.761	S	S	*	*			trans	-145.1	128.7	156.4	-91.5	109.9	0	0	0	105.9
238	N	23	Very low	23.6	Very low	118 Å²	118	129.6 Å²	129.6	63%	0.631	76%	0.757	S	S	*	*			cis	62.9	133.4	40.6	-67.2	4.3	0	0	0	113.8	H236	H236-N238 PolarHBondContact CE1-OD1 3.34Å; H236-N238 VanDerWaalsContact CE1-OD1 3.24Å
239	S	23.8	Very low	23.5	Very low	94 Å²	94	129 Å²	129	66%	0.657	75%	0.752	S	S	*	*			cis	-159.2	-177	-13.9	-71.4	0	0	0	0	106.6
240	T	23.9	Very low	23.6	Very low	129 Å²	129	132.7 Å²	132.7	79%	0.791	76%	0.761	S	S	*	*			cis	-162.4	177	11.8	-17.3	0	0	0	0	105.4
241	A	24.5	Very low	23.6	Very low	76 Å²	76	130.5 Å²	130.5	63%	0.628	76%	0.757	S	S	*	*			cis	-151.3	156.3	5	0	0	0	0	0	108.5
242	C	21.7	Very low	23.6	Very low	102 Å²	102	132 Å²	132	69%	0.689	76%	0.762	S	S	*	*				61.2	134.7	88.9	-46.9	0	0	0	0	115.2
243	F	22.6	Very low	23.2	Very low	200 Å²	200	135.7 Å²	135.7	88%	0.877	77%	0.771	S	S	*	*			cis	-139	165.9	33.7	-87.4	-96.4	0	0	0	115.9
244	I	23.8	Very low	23.3	Very low	151 Å²	151	132.3 Å²	132.3	77%	0.774	76%	0.763	S	S	*	*			trans	-128.2	152.6	165.1	-27.4	175.2	0	0	0	107.4
245	P	26.6	Very low	23.3	Very low	110 Å²	110	137.1 Å²	137.1	71%	0.714	78%	0.78	S	S	*	*				-145.1	171.7	101.9	25.2	-3.4	0	0	0	113
246	N	21.7	Very low	23.3	Very low	155 Å²	155	136.5 Å²	136.5	83%	0.829	77%	0.773	S	S	*	*			cis	-156.8	167	-11.4	-108.4	-1.8	0	0	0	109.8
247	L	22.5	Very low	23.4	Very low	148 Å²	148	138.8 Å²	138.8	78%	0.775	78%	0.784	S	S	*	*			trans	-100.7	168.6	168.9	-149.3	76	0	0	0	111.1
248	P	23.8	Very low	23.3	Very low	112 Å²	112	137.5 Å²	137.5	73%	0.727	78%	0.775	S	S	*	*				-132.8	121.8	116.3	34.4	-24.2	0	0	0	111.9
249	E	20.8	Very low	23.2	Very low	156 Å²	156	136.9 Å²	136.9	73%	0.729	78%	0.778	S	S	*	*				70.3	97.9	91.4	-71	-170.1	156.1	0	0	115.2
250	N	22.9	Very low	23.2	Very low	161 Å²	161	139 Å²	139	86%	0.861	79%	0.786	S	S	*	*				-173.2	170.9	105.6	-104	-72.3	0	0	0	113.4
251	A	23.3	Very low	23.1	Very low	98 Å²	98	141.4 Å²	141.4	81%	0.81	79%	0.788	S	S	*	*			trans	77.2	114.2	176.5	0	0	0	0	0	117.6
252	V	22.8	Very low	23.1	Very low	141 Å²	141	144.8 Å²	144.8	86%	0.855	80%	0.795	S	S	*	*			trans	-97.8	141.4	173	173.1	0	0	0	0	109.3
253	M	24.1	Very low	23.2	Very low	186 Å²	186	145.9 Å²	145.9	92%	0.916	80%	0.801	S	S	*	*			trans	-174.9	156.9	138.5	-101.5	-68.2	-98.2	0	0	112.2
254	G	24.3	Very low	23.1	Very low	64 Å²	64	140.3 Å²	140.3	66%	0.66	79%	0.792	S	S	*	*			trans	-59.6	146.9	-161.8	0	0	0	0	0	118.1	Q256	G254-Q256 PolarHBondContact O-N 3.06Å
255	L	23.3	Very low	23.8	Very low	196 Å²	196	142 Å²	142	100%	1.026	80%	0.797	S	S	*	*			trans	-67.1	104.6	157.7	-76.3	168.9	0	0	0	108.8
256	Q	23.3	Very low	23.6	Very low	159 Å²	159	144.6 Å²	144.6	74%	0.743	80%	0.799	S	S	*	*			trans	-116.9	129	169.5	-165.7	171.6	16.5	0	0	108.5	G254 M258	G254-Q256 PolarHBondContact O-N 3.06Å; Q256-M258 HydrophobicContact CB-CE 4.32Å; Q256-M258 HydrophobicContact CG-CE 3.97Å; Q256-M258 PolarHBondContact O-N 3.34Å
257	E	23.6	Very low	24.3	Very low	191 Å²	191	146 Å²	146	89%	0.893	80%	0.8	S	S	*	*			trans	-60.9	124	178	-61.4	-179.7	137.3	0	0	109.8
258	M	22.3	Very low	24.4	Very low	141 Å²	141	145.4 Å²	145.4	70%	0.695	80%	0.798	S	S	*	*			trans	-114	120.8	174	-73.9	-67.2	139.6	0	0	109	Q256	Q256-M258 HydrophobicContact CB-CE 4.32Å; Q256-M258 HydrophobicContact CG-CE 3.97Å; Q256-M258 PolarHBondContact O-N 3.34Å
259	P	22.5	Very low	25	Very low	105 Å²	105	145.9 Å²	145.9	68%	0.682	80%	0.799	S	S	*	*			trans	-73.8	138.1	-170.2	29.1	-35	0	0	0	111.5	Q261	P259-Q261 PolarHBondContact O-N 3.41Å
260	V	23	Very low	25.7	Very low	138 Å²	138	143.6 Å²	143.6	84%	0.836	80%	0.798	S	S	*	*			trans	-66.9	103	164.4	178.2	0	0	0	0	107.7	L262	V260-L262 PolarHBondContact O-N 2.71Å
261	Q	22.1	Very low	26.6	Very low	179 Å²	179	140.8 Å²	140.8	84%	0.836	80%	0.796	S	S	*	*			trans	-67.3	98.1	175.9	-72.6	-177.8	-28.5	0	0	109.9	P259	P259-Q261 PolarHBondContact O-N 3.41Å
262	L	25.2	Very low	27.8	Very low	147 Å²	147	140.8 Å²	140.8	77%	0.77	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-56.7	141.4	159.4	-72	159.6	0	0	0	109	V260 A264	V260-L262 PolarHBondContact O-N 2.71Å; L262-A264 PolarHBondContact O-N 2.99Å
263	P	22.3	Very low	29.4	Very low	126 Å²	126	137.7 Å²	137.7	82%	0.818	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-53.5	131.8	162.4	-22.5	33.6	0	0	0	109.1
264	A	22.1	Very low	31.3	Very low	83 Å²	83	133.8 Å²	133.8	69%	0.686	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-63.3	156.8	-173.4	0	0	0	0	0	112.1	L262 E266	L262-A264 PolarHBondContact O-N 2.99Å; A264-E266 PolarHBondContact O-N 3.43Å
265	Q	36.8	Very low	33.6	Very low	187 Å²	187	140.4 Å²	140.4	87%	0.874	78%	0.784	S	S	*	*			trans	-71.9	82.6	164.7	-67.5	-174.1	-90.5	0	0	109.5	H267	Q265-H267 PolarHBondContact O-N 2.9Å
266	E	22.6	Very low	36.4	Very low	164 Å²	164	136.1 Å²	136.1	77%	0.766	76%	0.76	S	S	*	*			trans	-67.5	114.7	167	-72.6	-175.6	142.6	0	0	108.8	A264 D268	A264-E266 PolarHBondContact O-N 3.43Å; E266-D268 PolarHBondContact O-N 3.18Å
267	H	36.3	Very low	39.7	Very low	183 Å²	183	132 Å²	132	85%	0.847	75%	0.746	S	S	*	*			trans	-81.6	43.4	-176.5	-130.6	-66.5	0	0	0	111.2	Q265 V269	Q265-H267 PolarHBondContact O-N 2.9Å; H267-V269 PolarHBondContact O-N 3.44Å
268	D	26.1	Very low	43	Very low	136 Å²	136	128.6 Å²	128.6	73%	0.727	73%	0.733	S	S	*	*			trans	-78.2	119.2	-169	-112.3	18.1	0	0	0	111.6	E266 P270	E266-D268 PolarHBondContact O-N 3.18Å; D268-P270 WeakPolarHBondContact O-CD 3.46Å
269	V	34.8	Very low	46.3	Very low	123 Å²	123	123.8 Å²	123.8	75%	0.745	71%	0.709	S	S	*	*			trans	-75.3	117.5	169	178.3	0	0	0	0	107.3	H267 A271	H267-V269 PolarHBondContact O-N 3.44Å; V269-A271 PolarHBondContact O-N 3.32Å
270	P	36.6	Very low	49.7	Very low	108 Å²	108	123.8 Å²	123.8	70%	0.701	70%	0.699	S	S	*	*			trans	-75.2	76.7	-175.2	30.5	-35.5	0	0	0	111.3	D268 S272	D268-P270 WeakPolarHBondContact O-CD 3.46Å; P270-S272 PolarHBondContact O-N 2.97Å
271	A	41.7	Very low	53.1	Low	101 Å²	101	123.3 Å²	123.3	84%	0.835	68%	0.682	S	S	*	*			trans	-77.7	50	176.4	0	0	0	0	0	112.1	V269	V269-A271 PolarHBondContact O-N 3.32Å
272	S	48.9	Very low	56.5	Low	99 Å²	99	116.6 Å²	116.6	69%	0.692	65%	0.651	S	S	*	*	S	Bend	trans	-154.1	152	169.6	-172.8	0	0	0	0	110.2	P270 V274	P270-S272 PolarHBondContact O-N 2.97Å; S272-V274 VanDerWaalsContact C-N 3.27Å; S272-V274 PolarHBondContact O-N 2.84Å
273	G	55	Low	59.8	Low	76 Å²	76	110.9 Å²	110.9	78%	0.784	62%	0.621	S	S	*	*			trans	-73.1	66.2	-170.9	0	0	0	0	0	114.6	K275	G273-K275 PolarHBondContact O-N 3.25Å
274	V	65.4	Low	63.2	Low	104 Å²	104	109.2 Å²	109.2	63%	0.63	60%	0.602	S	S	*	*			trans	-57.8	112.1	173	-179.8	0	0	0	0	109	S272 M276	S272-V274 VanDerWaalsContact C-N 3.27Å; S272-V274 PolarHBondContact O-N 2.84Å; V274-M276 PolarHBondContact O-N 2.64Å
275	K	71.6	Confident	66.6	Low	203 Å²	203	107.8 Å²	107.8	88%	0.883	58%	0.581	S	S	*	*			trans	-76	72.5	-176.2	-165.4	178.9	-177.2	-178.8	0	110.9	G273 T277	G273-K275 PolarHBondContact O-N 3.25Å; K275-T277 PolarHBondContact O-N 2.95Å
276	M	82.5	Confident	69.3	Low	105 Å²	105	100 Å²	100	52%	0.517	55%	0.545	S	S	.	.			trans	-53.6	127.6	-176.8	-162.4	65.5	71.7	0	0	111.3	V274 H280 W281	V274-M276 PolarHBondContact O-N 2.64Å; M276-H280 HydrophobicContact CG-CB 4.04Å; M276-H280 HydrophobicContact SD-CB 3.39Å; M276-H280 WeakPolarHBondContact SD-CB 3.24Å; M276-W281 HydrophobicContact CG-CB 4.29Å
277	T	92.8	Very high	72.6	Confident	72 Å²	72	93.7 Å²	93.7	44%	0.442	52%	0.521	S	S	.	.			trans	-77.8	155.1	174.3	78.9	0	0	0	0	110.3	K275 F279 H280 W281	K275-T277 PolarHBondContact O-N 2.95Å; T277-F279 PolarHBondContact O-N 2.76Å; T277-F279 VanDerWaalsContact O-N 3.17Å; T277-H280 PolarHBondContact O-N 3.03Å; T277-H280 VanDerWaalsContact O-N 3.09Å; T277-H280 PolarHBondContact OG1-N 2.81Å; T277-H280 PolarHBondContact OG1-ND1 3.05Å; T277-W281 PolarHBondContact O-N 2.87Å
278	L	92.4	Very high	75.3	Confident	120 Å²	120	90.2 Å²	90.2	63%	0.628	50%	0.503	S	S	*	.	H	α-helix	trans	-52.4	-39.5	177.3	179.2	61.6	0	0	0	111.9	W281 Q282	L278-W281 HydrophobicContact CD1-CE3 4.37Å; L278-W281 PolarHBondContact O-N 3.09Å; L278-Q282 HydrophobicContact CD1-CG 4.42Å; L278-Q282 HydrophobicContact CG-CG 4.48Å; L278-Q282 WeakPolarHBondContact O-CB 3.39Å; L278-Q282 VanDerWaalsContact O-CG 3.24Å; L278-Q282 WeakPolarHBondContact O-CG 3.2Å; L278-Q282 PolarHBondContact O-N 3.38Å
279	F	92.3	Very high	78.2	Confident	41 Å²	41	86.7 Å²	86.7	18%	0.18	48%	0.482	C	S	.	.	H	α-helix	trans	-67	-41.6	179.1	-174.5	-125.9	0	0	0	113.1	T277 Q282 I283 R318 A319 Y322	T277-F279 PolarHBondContact O-N 2.76Å; T277-F279 VanDerWaalsContact O-N 3.17Å; F279-Q282 PolarHBondContact O-N 2.84Å; F279-I283 HydrophobicContact CD1-CD1 3.88Å; F279-I283 HydrophobicContact CD2-CD1 4.4Å; F279-I283 HydrophobicContact CE1-CD1 3.54Å; F279-I283 HydrophobicContact CE2-CD1 4.08Å; F279-I283 HydrophobicContact CE2-CG1 4.23Å; F279-I283 HydrophobicContact CG-CD1 4.3Å; F279-I283 HydrophobicContact CZ-CD1 3.65Å; F279-I283 HydrophobicContact CZ-CG1 4.23Å; F279-I283 WeakPolarHBondContact O-CG1 3.34Å; F279-I283 PolarHBondContact O-N 3.32Å; F279-R318 HydrophobicContact CE2-CB 4.2Å; F279-R318 HydrophobicContact CE2-CG 3.58Å; F279-R318 HydrophobicContact CZ-CG 3.78Å; F279-R318 VanDerWaalsContact CZ-CZ 3.5Å; F279-R318 VanDerWaalsContact CZ-NE 3.27Å; F279-A319 HydrophobicContact CD2-CB 4.44Å; F279-A319 HydrophobicContact CE2-CB 4.12Å; F279-Y322 HydrophobicContact CE1-CD2 4.47Å; F279-Y322 HydrophobicContact CZ-CD2 4.22Å; F279-Y322 HydrophobicContact CZ-CG 4.48Å
280	H	92.9	Very high	80.7	Confident	105 Å²	105	81 Å²	81	49%	0.486	45%	0.447	S	S	.	.	H	α-helix	trans	-66.7	-37.6	174.6	-70.2	98	0	0	0	112	M276 T277 I283 Q284	M276-H280 HydrophobicContact CG-CB 4.04Å; M276-H280 HydrophobicContact SD-CB 3.39Å; M276-H280 WeakPolarHBondContact SD-CB 3.24Å; T277-H280 PolarHBondContact O-N 3.03Å; T277-H280 VanDerWaalsContact O-N 3.09Å; T277-H280 PolarHBondContact OG1-N 2.81Å; T277-H280 PolarHBondContact OG1-ND1 3.05Å; H280-I283 PolarHBondContact O-N 2.69Å; H280-Q284 PolarHBondContact O-N 2.67Å
281	W	94.1	Very high	83	Confident	127 Å²	127	82 Å²	82	48%	0.481	44%	0.443	S	S	.	.	H	α-helix	trans	-63.3	-44.5	172.8	179.8	89.8	0	0	0	111.4	M276 T277 L278 I283 Q284 Q285	M276-W281 HydrophobicContact CG-CB 4.29Å; T277-W281 PolarHBondContact O-N 2.87Å; L278-W281 HydrophobicContact CD1-CE3 4.37Å; L278-W281 PolarHBondContact O-N 3.09Å; W281-I283 PolarHBondContact O-N 3.48Å; W281-Q284 WeakPolarHBondContact O-CB 3.31Å; W281-Q284 PolarHBondContact O-N 3.01Å; W281-Q285 HydrophobicContact CD2-CG 3.98Å; W281-Q285 HydrophobicContact CE3-CG 4.04Å; W281-Q285 HydrophobicContact CH2-CG 3.74Å; W281-Q285 HydrophobicContact CZ2-CG 3.66Å; W281-Q285 HydrophobicContact CZ3-CG 3.93Å; W281-Q285 WeakPolarHBondContact O-CG 3.27Å; W281-Q285 PolarHBondContact O-N 3.26Å
282	Q	94.8	Very high	84.9	Confident	39 Å²	39	79.9 Å²	79.9	18%	0.182	43%	0.431	C	S	.	.	H	α-helix	trans	-58.7	-47.6	174.2	-73	168.5	-23.4	0	0	111.2	W41 L278 F279 Q284 Q285 E286 A319	W41-Q282 HydrophobicContact CH2-CG 4.16Å; L278-Q282 HydrophobicContact CD1-CG 4.42Å; L278-Q282 HydrophobicContact CG-CG 4.48Å; L278-Q282 WeakPolarHBondContact O-CB 3.39Å; L278-Q282 VanDerWaalsContact O-CG 3.24Å; L278-Q282 WeakPolarHBondContact O-CG 3.2Å; L278-Q282 PolarHBondContact O-N 3.38Å; F279-Q282 PolarHBondContact O-N 2.84Å; Q282-Q284 VanDerWaalsContact C-N 3.3Å; Q282-Q284 PolarHBondContact O-N 2.96Å; Q282-Q285 PolarHBondContact O-N 3.47Å; Q282-Q285 VanDerWaalsContact O-N 3.13Å; Q282-E286 WeakPolarHBondContact O-CG 3.37Å; Q282-E286 PolarHBondContact O-N 2.93Å; Q282-A319 HydrophobicContact CB-CB 3.61Å
283	I	94.3	Very high	86.7	Confident	26 Å²	26	76.2 Å²	76.2	13%	0.133	40%	0.403	C	S	.	.	H	α-helix	trans	-55.6	-44.9	174.2	-73.8	165.3	0	0	0	110.7	F279 H280 W281 Q285 E286 A287 A319 Y322 V323	F279-I283 HydrophobicContact CD1-CD1 3.88Å; F279-I283 HydrophobicContact CD2-CD1 4.4Å; F279-I283 HydrophobicContact CE1-CD1 3.54Å; F279-I283 HydrophobicContact CE2-CD1 4.08Å; F279-I283 HydrophobicContact CE2-CG1 4.23Å; F279-I283 HydrophobicContact CG-CD1 4.3Å; F279-I283 HydrophobicContact CZ-CD1 3.65Å; F279-I283 HydrophobicContact CZ-CG1 4.23Å; F279-I283 WeakPolarHBondContact O-CG1 3.34Å; F279-I283 PolarHBondContact O-N 3.32Å; H280-I283 PolarHBondContact O-N 2.69Å; W281-I283 PolarHBondContact O-N 3.48Å; I283-Q285 VanDerWaalsContact C-N 3.33Å; I283-Q285 PolarHBondContact O-N 3.39Å; I283-E286 PolarHBondContact O-N 3.1Å; I283-A287 WeakPolarHBondContact O-CB 3.42Å; I283-A287 PolarHBondContact O-N 2.93Å; I283-A319 HydrophobicContact CG1-CB 4.22Å; I283-Y322 HydrophobicContact CD1-CD1 3.62Å; I283-Y322 HydrophobicContact CD1-CD2 4.21Å; I283-Y322 HydrophobicContact CD1-CE1 3.86Å; I283-Y322 HydrophobicContact CD1-CE2 4.42Å; I283-Y322 HydrophobicContact CD1-CG 3.84Å; I283-Y322 HydrophobicContact CG1-CD1 3.9Å; I283-Y322 HydrophobicContact CG1-CG 4.2Å; I283-Y322 HydrophobicContact CG2-CD1 4.11Å; I283-Y322 HydrophobicContact CG2-CE1 4.29Å; I283-V323 HydrophobicContact CG2-CG2 3.95Å
284	Q	93.6	Very high	88.1	Confident	92 Å²	92	74.4 Å²	74.4	43%	0.43	38%	0.378	S	S	.	.	H	α-helix	trans	-63.3	-38	178.2	-164.6	-171.4	39.1	0	0	112.4	H280 W281 Q282 K288	H280-Q284 PolarHBondContact O-N 2.67Å; W281-Q284 WeakPolarHBondContact O-CB 3.31Å; W281-Q284 PolarHBondContact O-N 3.01Å; Q282-Q284 VanDerWaalsContact C-N 3.3Å; Q282-Q284 PolarHBondContact O-N 2.96Å; Q284-K288 WeakPolarHBondContact O-CG 3.23Å; Q284-K288 PolarHBondContact O-N 2.85Å
285	Q	93	Very high	88.8	Confident	52 Å²	52	71.9 Å²	71.9	24%	0.243	36%	0.364	C	S	.	.	H	α-helix	trans	-67.9	-46.5	175.1	-63.6	-52.6	-37.1	0	0	111.7	W281 Q282 I283 K288 K289	W281-Q285 HydrophobicContact CD2-CG 3.98Å; W281-Q285 HydrophobicContact CE3-CG 4.04Å; W281-Q285 HydrophobicContact CH2-CG 3.74Å; W281-Q285 HydrophobicContact CZ2-CG 3.66Å; W281-Q285 HydrophobicContact CZ3-CG 3.93Å; W281-Q285 WeakPolarHBondContact O-CG 3.27Å; W281-Q285 PolarHBondContact O-N 3.26Å; Q282-Q285 PolarHBondContact O-N 3.47Å; Q282-Q285 VanDerWaalsContact O-N 3.13Å; I283-Q285 VanDerWaalsContact C-N 3.33Å; I283-Q285 PolarHBondContact O-N 3.39Å; Q285-K288 PolarHBondContact O-N 3.01Å; Q285-K289 WeakPolarHBondContact O-CG 3.39Å; Q285-K289 PolarHBondContact O-N 2.8Å; Q285-K289 PolarHBondContact O-NZ 2.7Å
286	E	94.1	Very high	89.4	Confident	24 Å²	24	68.6 Å²	68.6	11%	0.112	35%	0.352	C	S	.	.	H	α-helix	trans	-68.7	-36	-179.3	-61.5	-54	84.5	0	0	111.7	W200 Q282 I283 K288 K289 A290 A319 L320 V323	W200-E286 WeakPolarHBondContact CH2-OE1 3.28Å; W200-E286 VanDerWaalsContact CH2-OE2 3.22Å; W200-E286 WeakPolarHBondContact CH2-OE2 3.37Å; W200-E286 WeakPolarHBondContact CZ2-OE1 3.42Å; Q282-E286 WeakPolarHBondContact O-CG 3.37Å; Q282-E286 PolarHBondContact O-N 2.93Å; I283-E286 PolarHBondContact O-N 3.1Å; E286-K288 PolarHBondContact O-N 2.87Å; E286-K289 PolarHBondContact O-N 3.38Å; E286-K289 IonicContact OE1-NZ 3.55Å; E286-K289 PolarHBondContact OE1-NZ 3.17Å; E286-A290 VanDerWaalsContact O-CB 3.25Å; E286-A290 WeakPolarHBondContact O-CB 3.28Å; E286-A290 PolarHBondContact O-N 3.23Å; E286-A319 HydrophobicContact CG-CB 4.06Å; E286-L320 HydrophobicContact CB-CD1 4.38Å; E286-L320 HydrophobicContact CG-CB 4.29Å; E286-V323 HydrophobicContact CB-CB 4.47Å; E286-V323 HydrophobicContact CB-CG2 4.07Å
287	A	92.3	Very high	89.5	Confident	32 Å²	32	67 Å²	67	26%	0.264	34%	0.343	S	S	.	.	H	α-helix	trans	-56	-51.7	174.2	0	0	0	0	0	111.2	I283 K289 A290 E291 V323	I283-A287 WeakPolarHBondContact O-CB 3.42Å; I283-A287 PolarHBondContact O-N 2.93Å; A287-K289 VanDerWaalsContact C-N 3.34Å; A287-K289 PolarHBondContact O-N 3.24Å; A287-A290 CarbonylContact O-C 3.53Å; A287-A290 VanDerWaalsContact O-C 3.32Å; A287-A290 WeakPolarHBondContact O-CA 3.33Å; A287-A290 PolarHBondContact O-N 2.94Å; A287-E291 PolarHBondContact O-N 3.24Å; A287-V323 HydrophobicContact CB-CG1 4.4Å; A287-V323 HydrophobicContact CB-CG2 4.06Å
288	K	91.5	Very high	89.1	Confident	109 Å²	109	63.8 Å²	63.8	47%	0.474	32%	0.323	S	S	.	.	H	α-helix	trans	-55.2	-45.8	178	-75.1	176	176.7	-174.4	0	112.8	Q284 Q285 E286 A290 E291	Q284-K288 WeakPolarHBondContact O-CG 3.23Å; Q284-K288 PolarHBondContact O-N 2.85Å; Q285-K288 PolarHBondContact O-N 3.01Å; E286-K288 PolarHBondContact O-N 2.87Å; K288-A290 PolarHBondContact O-N 3.48Å; K288-E291 WeakPolarHBondContact CA-OE1 3.48Å; K288-E291 WeakPolarHBondContact O-CB 3.43Å; K288-E291 PolarHBondContact O-N 3.21Å
289	K	88	Confident	88.9	Confident	63 Å²	63	60.1 Å²	60.1	27%	0.274	31%	0.307	S	S	.	.	H	α-helix	trans	-76.3	-16.8	-177.2	-25.4	-144.7	-163.5	61.1	0	112.2	R196 W200 Q285 E286 A287	R196-K289 PolarHBondContact NH2-O 3.17Å; W200-K289 HydrophobicContact CD2-CD 3.69Å; W200-K289 HydrophobicContact CE3-CB 3.91Å; W200-K289 HydrophobicContact CE3-CD 3.65Å; W200-K289 HydrophobicContact CE3-CG 4.24Å; W200-K289 HydrophobicContact CG-CD 4.49Å; W200-K289 HydrophobicContact CH2-CB 3.96Å; W200-K289 HydrophobicContact CH2-CD 3.72Å; W200-K289 HydrophobicContact CH2-CG 3.9Å; W200-K289 HydrophobicContact CZ2-CD 3.77Å; W200-K289 HydrophobicContact CZ2-CG 4.4Å; W200-K289 HydrophobicContact CZ3-CB 3.42Å; W200-K289 VanDerWaalsContact CZ3-CB 3.42Å; W200-K289 HydrophobicContact CZ3-CD 3.67Å; W200-K289 HydrophobicContact CZ3-CG 3.82Å; Q285-K289 WeakPolarHBondContact O-CG 3.39Å; Q285-K289 PolarHBondContact O-N 2.8Å; Q285-K289 PolarHBondContact O-NZ 2.7Å; E286-K289 PolarHBondContact O-N 3.38Å; E286-K289 IonicContact OE1-NZ 3.55Å; E286-K289 PolarHBondContact OE1-NZ 3.17Å; A287-K289 VanDerWaalsContact C-N 3.34Å; A287-K289 PolarHBondContact O-N 3.24Å
290	A	86.5	Confident	88.8	Confident	2 Å²	2	61.5 Å²	61.5	2%	0.017	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-0.4	172	0	0	0	0	0	114	E286 A287 K288 L293 V323 K327	E286-A290 VanDerWaalsContact O-CB 3.25Å; E286-A290 WeakPolarHBondContact O-CB 3.28Å; E286-A290 PolarHBondContact O-N 3.23Å; A287-A290 CarbonylContact O-C 3.53Å; A287-A290 VanDerWaalsContact O-C 3.32Å; A287-A290 WeakPolarHBondContact O-CA 3.33Å; A287-A290 PolarHBondContact O-N 2.94Å; K288-A290 PolarHBondContact O-N 3.48Å; A290-L293 HydrophobicContact CB-CD1 3.98Å; A290-L293 PolarHBondContact O-N 3.27Å; A290-V323 HydrophobicContact CB-CG1 3.69Å; A290-K327 HydrophobicContact CB-CD 4.36Å; A290-K327 WeakPolarHBondContact O-CE 3.4Å; A290-K327 PolarHBondContact O-NZ 3.04Å
291	E	85.8	Confident	88.7	Confident	131 Å²	131	61 Å²	61	61%	0.612	31%	0.313	S	S	*	.	S	Bend	trans	-57.7	-55.7	-179.9	-84.7	164.7	-161	0	0	110.6	A287 K288 L293 K327	A287-E291 PolarHBondContact O-N 3.24Å; K288-E291 WeakPolarHBondContact CA-OE1 3.48Å; K288-E291 WeakPolarHBondContact O-CB 3.43Å; K288-E291 PolarHBondContact O-N 3.21Å; E291-L293 PolarHBondContact O-N 2.79Å; E291-K327 PolarHBondContact O-NZ 3.13Å
292	G	82.1	Confident	88.6	Confident	56 Å²	56	55.8 Å²	55.8	58%	0.577	29%	0.294	S	S	*	.	S	Bend	trans	-75.8	63.7	170.5	0	0	0	0	0	113.5	R196	R196-G292 PolarHBondContact NH1-O 3.41Å; R196-G292 PolarHBondContact NH2-O 2.9Å
293	L	85.2	Confident	88.4	Confident	22 Å²	22	57.5 Å²	57.5	12%	0.115	31%	0.311	C	S	.	.			trans	-128.9	121.9	162.8	-79	170.3	0	0	0	107.7	R196 A290 E291 Q297 L298 L324	R196-L293 VanDerWaalsContact NH1-CD2 3.34Å; A290-L293 HydrophobicContact CB-CD1 3.98Å; A290-L293 PolarHBondContact O-N 3.27Å; E291-L293 PolarHBondContact O-N 2.79Å; L293-Q297 HydrophobicContact CD2-CB 4.27Å; L293-L298 HydrophobicContact CB-CD2 4.21Å; L293-L298 HydrophobicContact CB-CG 4.42Å; L293-L298 HydrophobicContact CD1-CD2 4Å; L293-L324 HydrophobicContact CD1-CD2 3.97Å
294	S	85.2	Confident	88.1	Confident	38 Å²	38	59.7 Å²	59.7	27%	0.266	32%	0.323	S	S	.	.			trans	-77.6	163.3	176.9	79.1	0	0	0	0	111.9	E296 Q297 L298	S294-E296 VanDerWaalsContact C-N 3.32Å; S294-E296 WeakPolarHBondContact CB-OE2 3.5Å; S294-E296 PolarHBondContact O-N 2.93Å; S294-E296 PolarHBondContact OG-OE2 3.42Å; S294-Q297 WeakPolarHBondContact O-CB 3.35Å; S294-Q297 PolarHBondContact O-N 3.09Å; S294-Q297 VanDerWaalsContact OG-CG 3.29Å; S294-Q297 WeakPolarHBondContact OG-CG 3.21Å; S294-Q297 PolarHBondContact OG-N 3.17Å; S294-L298 WeakPolarHBondContact O-CG 3.46Å; S294-L298 PolarHBondContact O-N 2.95Å; S294-L298 VanDerWaalsContact O-N 3.09Å
295	P	80.8	Confident	88	Confident	51 Å²	51	55.3 Å²	55.3	33%	0.331	30%	0.302	S	S	.	.	H	α-helix	trans	-60.5	-39.3	178.4	-22.5	34.7	0	0	0	112.8	Q297 L298 C299 Y331	P295-Q297 VanDerWaalsContact C-N 3.34Å; P295-L298 PolarHBondContact O-N 3.36Å; P295-C299 PolarHBondContact O-N 3.21Å; P295-C299 PolarHBondContact O-SG 2.94Å; P295-Y331 HydrophobicContact CB-CD1 4.26Å; P295-Y331 HydrophobicContact CB-CD2 4.18Å; P295-Y331 HydrophobicContact CB-CE1 4.26Å; P295-Y331 HydrophobicContact CB-CE2 4.18Å; P295-Y331 HydrophobicContact CB-CG 4.23Å; P295-Y331 HydrophobicContact CG-CD1 4.39Å; P295-Y331 HydrophobicContact CG-CE1 3.89Å; P295-Y331 HydrophobicContact CG-CE2 4.09Å
296	E	82.6	Confident	88	Confident	133 Å²	133	54.2 Å²	54.2	62%	0.621	30%	0.298	S	S	*	.	H	α-helix	trans	-65.1	-41.1	176.1	-42.4	84.1	169.8	0	0	110.5	S294 L298 C299 M300	S294-E296 VanDerWaalsContact C-N 3.32Å; S294-E296 WeakPolarHBondContact CB-OE2 3.5Å; S294-E296 PolarHBondContact O-N 2.93Å; S294-E296 PolarHBondContact OG-OE2 3.42Å; E296-L298 VanDerWaalsContact C-N 3.33Å; E296-L298 PolarHBondContact O-N 3.05Å; E296-C299 CarbonylContact O-C 3.56Å; E296-C299 PolarHBondContact O-N 3.33Å; E296-C299 VanDerWaalsContact O-N 3.09Å; E296-M300 WeakPolarHBondContact O-CG 3.41Å; E296-M300 PolarHBondContact O-N 3.39Å; E296-M300 VanDerWaalsContact O-N 3.1Å
297	Q	85.6	Confident	88	Confident	73 Å²	73	53.1 Å²	53.1	34%	0.341	29%	0.293	S	S	.	.	H	α-helix	trans	-61.6	-39.1	178	-75.1	174.4	-4.2	0	0	112.6	L293 S294 P295 C299 M300 F308	L293-Q297 HydrophobicContact CD2-CB 4.27Å; S294-Q297 WeakPolarHBondContact O-CB 3.35Å; S294-Q297 PolarHBondContact O-N 3.09Å; S294-Q297 VanDerWaalsContact OG-CG 3.29Å; S294-Q297 WeakPolarHBondContact OG-CG 3.21Å; S294-Q297 PolarHBondContact OG-N 3.17Å; P295-Q297 VanDerWaalsContact C-N 3.34Å; Q297-C299 PolarHBondContact O-N 3.12Å; Q297-M300 HydrophobicContact CB-CE 4.08Å; Q297-M300 HydrophobicContact CG-CE 3.97Å; Q297-M300 HydrophobicContact CG-SD 4.42Å; Q297-M300 PolarHBondContact O-N 2.85Å; Q297-F308 VanDerWaalsContact O-CD2 3.26Å; Q297-F308 WeakPolarHBondContact O-CD2 3.4Å; Q297-F308 WeakPolarHBondContact O-CE2 3.22Å
298	L	85.1	Confident	88.1	Confident	3 Å²	3	52 Å²	52	2%	0.016	28%	0.282	C	S	.	.	H	α-helix	trans	-62.7	-28.5	176.1	-68.3	168.7	0	0	0	112.7	L293 S294 P295 E296 L324 K327 M328 Y331	L293-L298 HydrophobicContact CB-CD2 4.21Å; L293-L298 HydrophobicContact CB-CG 4.42Å; L293-L298 HydrophobicContact CD1-CD2 4Å; S294-L298 WeakPolarHBondContact O-CG 3.46Å; S294-L298 PolarHBondContact O-N 2.95Å; S294-L298 VanDerWaalsContact O-N 3.09Å; P295-L298 PolarHBondContact O-N 3.36Å; E296-L298 VanDerWaalsContact C-N 3.33Å; E296-L298 PolarHBondContact O-N 3.05Å; L298-L324 HydrophobicContact CD2-CD2 3.7Å; L298-K327 HydrophobicContact CD1-CB 3.82Å; L298-M328 HydrophobicContact CB-CG 3.94Å; L298-M328 HydrophobicContact CD1-CG 4.31Å; L298-M328 HydrophobicContact CD2-CG 4.37Å; L298-M328 HydrophobicContact CG-CG 4.44Å; L298-Y331 HydrophobicContact CD1-CD2 4.31Å; L298-Y331 HydrophobicContact CD1-CE2 4.21Å
299	C	87	Confident	88.3	Confident	43 Å²	43	46.9 Å²	46.9	29%	0.291	26%	0.26	S	S	.	.	H	α-helix	trans	-94.1	-4.6	-179.1	-54.7	0	0	0	0	113.7	P295 E296 Q297 Q301 S333	P295-C299 PolarHBondContact O-N 3.21Å; P295-C299 PolarHBondContact O-SG 2.94Å; E296-C299 CarbonylContact O-C 3.56Å; E296-C299 PolarHBondContact O-N 3.33Å; E296-C299 VanDerWaalsContact O-N 3.09Å; Q297-C299 PolarHBondContact O-N 3.12Å; C299-Q301 PolarHBondContact O-N 3.37Å; C299-S333 VanDerWaalsContact SG-CB 3.5Å; C299-S333 PolarHBondContact SG-OG 3.29Å
300	M	89.5	Confident	88.6	Confident	70 Å²	70	43.9 Å²	43.9	35%	0.345	25%	0.247	S	C	.	.			trans	-61.7	137.2	175.4	-69.2	-172.4	-47.3	0	0	110.6	V189 L192 E296 Q297 T307 F308	V189-M300 HydrophobicContact CG2-CB 4.17Å; V189-M300 WeakPolarHBondContact CG2-O 3.4Å; L192-M300 HydrophobicContact CD1-CE 3.6Å; E296-M300 WeakPolarHBondContact O-CG 3.41Å; E296-M300 PolarHBondContact O-N 3.39Å; E296-M300 VanDerWaalsContact O-N 3.1Å; Q297-M300 HydrophobicContact CB-CE 4.08Å; Q297-M300 HydrophobicContact CG-CE 3.97Å; Q297-M300 HydrophobicContact CG-SD 4.42Å; Q297-M300 PolarHBondContact O-N 2.85Å; M300-T307 WeakPolarHBondContact O-CA 3.47Å; M300-F308 HydrophobicContact CE-CE2 3.82Å; M300-F308 HydrophobicContact CE-CZ 4.21Å
301	Q	91.5	Very high	88.9	Confident	95 Å²	95	44.2 Å²	44.2	44%	0.444	25%	0.248	S	C	.	.			trans	-114.5	154.5	176.1	-62.1	-177.6	-88.2	0	0	109.5	C299 G305 D306 T307 V336 K337	C299-Q301 PolarHBondContact O-N 3.37Å; Q301-G305 WeakPolarHBondContact CG-O 3.47Å; Q301-G305 PolarHBondContact NE2-O 2.79Å; Q301-D306 WeakPolarHBondContact CA-O 3.43Å; Q301-T307 HydrophobicContact CG-CG2 3.79Å; Q301-V336 HydrophobicContact CG-CG1 4.39Å; Q301-K337 PolarHBondContact NE2-O 3.17Å
302	D	91.6	Very high	89.3	Confident	17 Å²	17	38 Å²	38	9%	0.091	22%	0.219	C	C	.	.			trans	-101.5	-161.4	174.8	71.7	14.1	0	0	0	114	T188 V189 K190 D304 G305 D306	T188-D302 HydrophobicContact CG2-CB 4.19Å; V189-D302 HydrophobicContact CB-CB 3.9Å; V189-D302 HydrophobicContact CG2-CB 3.95Å; V189-D302 VanDerWaalsContact N-CB 3.33Å; K190-D302 PolarHBondContact N-OD2 3.42Å; D302-D304 PolarHBondContact O-N 3.24Å; D302-D304 WeakPolarHBondContact OD1-CB 3.37Å; D302-D304 PolarHBondContact OD1-N 2.87Å; D302-G305 PolarHBondContact O-N 3.25Å; D302-G305 PolarHBondContact OD1-N 3.1Å; D302-D306 PolarHBondContact N-O 2.99Å; D302-D306 PolarHBondContact OD1-N 3.17Å
303	S	92	Very high	90	Very high	76 Å²	76	35.3 Å²	35.3	53%	0.531	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-22.4	178.8	54.2	0	0	0	0	113.7	H339	S303-H339 PolarHBondContact O-CE1 2.93Å; S303-H339 PolarHBondContact O-ND1 3.26Å; S303-H339 VanDerWaalsContact O-ND1 3.1Å
304	D	87.7	Confident	90.3	Very high	71 Å²	71	36.7 Å²	36.7	38%	0.38	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	0.1	-174.4	-50.1	-17.5	0	0	0	110	K190 D302 D306 H339	K190-D304 IonicContact NZ-OD2 2.61Å; D302-D304 PolarHBondContact O-N 3.24Å; D302-D304 WeakPolarHBondContact OD1-CB 3.37Å; D302-D304 PolarHBondContact OD1-N 2.87Å; D304-D306 VanDerWaalsContact C-N 3.29Å; D304-H339 WeakPolarHBondContact O-CB 3.45Å; D304-H339 PolarHBondContact O-N 3.34Å; D304-H339 VanDerWaalsContact O-N 3.16Å; D304-H339 PolarHBondContact O-ND1 3.48Å
305	G	92	Very high	90.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.218	C	C	.	.	S	Bend	trans	83.7	2.4	-175.3	0	0	0	0	0	113.3	Q301 D302 T307 E338 H339	Q301-G305 WeakPolarHBondContact CG-O 3.47Å; Q301-G305 PolarHBondContact NE2-O 2.79Å; D302-G305 PolarHBondContact O-N 3.25Å; D302-G305 PolarHBondContact OD1-N 3.1Å; G305-T307 PolarHBondContact O-N 3.36Å; G305-E338 WeakPolarHBondContact O-CA 3.45Å; G305-H339 PolarHBondContact N-CE1 3.4Å; G305-H339 PolarHBondContact N-ND1 2.89Å
306	D	92.8	Very high	91.2	Very high	30 Å²	30	39.3 Å²	39.3	16%	0.16	22%	0.219	C	C	.	.			trans	-76.9	125.3	-169.9	-107.1	-2.2	0	0	0	111.6	Q301 D302 D304 H310 I311	Q301-D306 WeakPolarHBondContact CA-O 3.43Å; D302-D306 PolarHBondContact N-O 2.99Å; D302-D306 PolarHBondContact OD1-N 3.17Å; D304-D306 VanDerWaalsContact C-N 3.29Å; D306-H310 HydrophobicContact CB-CB 4.34Å; D306-H310 WeakPolarHBondContact OD1-CB 3.18Å; D306-H310 IonicContact OD1-CG 3.75Å; D306-I311 HydrophobicContact CB-CD1 4.05Å; D306-I311 HydrophobicContact CB-CG1 3.75Å; D306-I311 WeakPolarHBondContact OD2-CG1 3.45Å
307	T	94.1	Very high	91.7	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.201	C	C	.	.			trans	-85.6	168.5	166.8	77.5	0	0	0	0	111.4	M300 Q301 G305 L309 H310 I311 V336	M300-T307 WeakPolarHBondContact O-CA 3.47Å; Q301-T307 HydrophobicContact CG-CG2 3.79Å; G305-T307 PolarHBondContact O-N 3.36Å; T307-L309 PolarHBondContact O-N 3.27Å; T307-L309 PolarHBondContact OG1-N 3.19Å; T307-H310 PolarHBondContact N-ND1 3.11Å; T307-H310 PolarHBondContact O-N 3.04Å; T307-H310 PolarHBondContact OG1-ND1 3.41Å; T307-I311 PolarHBondContact O-N 2.92Å; T307-I311 VanDerWaalsContact O-N 3.15Å; T307-V336 HydrophobicContact CG2-CB 4.29Å; T307-V336 HydrophobicContact CG2-CG1 3.66Å
308	F	92.8	Very high	92.2	Very high	10 Å²	10	36 Å²	36	4%	0.044	20%	0.198	C	C	.	.	H	α-helix	trans	-50	-34.7	174.1	-73.4	-75.4	0	0	0	113.5	V189 L192 L193 Q297 M300 A312 L324	V189-F308 HydrophobicContact CG1-CB 4.46Å; V189-F308 HydrophobicContact CG1-CD1 3.64Å; V189-F308 HydrophobicContact CG1-CD2 3.92Å; V189-F308 HydrophobicContact CG1-CE1 3.72Å; V189-F308 HydrophobicContact CG1-CE2 3.99Å; V189-F308 HydrophobicContact CG1-CG 3.74Å; V189-F308 HydrophobicContact CG1-CZ 3.9Å; L192-F308 HydrophobicContact CB-CE1 4.35Å; L192-F308 HydrophobicContact CB-CZ 4.18Å; L192-F308 HydrophobicContact CD1-CZ 4.26Å; L193-F308 HydrophobicContact CD1-CD1 4.11Å; L193-F308 HydrophobicContact CD2-CD1 3.73Å; L193-F308 HydrophobicContact CD2-CE1 4.02Å; L193-F308 HydrophobicContact CG-CD1 3.66Å; L193-F308 HydrophobicContact CG-CE1 3.81Å; Q297-F308 VanDerWaalsContact O-CD2 3.26Å; Q297-F308 WeakPolarHBondContact O-CD2 3.4Å; Q297-F308 WeakPolarHBondContact O-CE2 3.22Å; M300-F308 HydrophobicContact CE-CE2 3.82Å; M300-F308 HydrophobicContact CE-CZ 4.21Å; F308-A312 WeakPolarHBondContact O-CB 3.32Å; F308-A312 PolarHBondContact O-N 2.98Å; F308-A312 VanDerWaalsContact O-N 3.11Å; F308-L324 HydrophobicContact CB-CD1 3.99Å; F308-L324 HydrophobicContact CB-CD2 4.41Å; F308-L324 WeakPolarHBondContact O-CD1 3.11Å
309	L	95.7	Very high	92.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-74.2	-43.1	178.6	179.8	63.1	0	0	0	112.1	T307 I311 A312 V313 S321 L324 A325 M328 L334 A344 L360	T307-L309 PolarHBondContact O-N 3.27Å; T307-L309 PolarHBondContact OG1-N 3.19Å; L309-I311 VanDerWaalsContact C-N 3.31Å; L309-I311 PolarHBondContact O-N 2.85Å; L309-A312 PolarHBondContact O-N 3.01Å; L309-V313 HydrophobicContact CD1-CG2 4.1Å; L309-V313 HydrophobicContact CG-CG2 4.43Å; L309-V313 VanDerWaalsContact O-CG2 3.31Å; L309-V313 WeakPolarHBondContact O-CG2 3.37Å; L309-V313 PolarHBondContact O-N 2.9Å; L309-S321 WeakPolarHBondContact CD1-O 3.37Å; L309-L324 HydrophobicContact CB-CB 4.3Å; L309-L324 HydrophobicContact CD1-CB 3.87Å; L309-A325 HydrophobicContact CD1-CB 4.37Å; L309-A325 HydrophobicContact CD2-CB 4.46Å; L309-M328 HydrophobicContact CB-CE 4.24Å; L309-M328 HydrophobicContact CB-SD 3.6Å; L309-M328 HydrophobicContact CD2-CE 4.3Å; L309-M328 HydrophobicContact CD2-SD 3.84Å; L309-M328 HydrophobicContact CG-SD 4.33Å; L309-L334 HydrophobicContact CD2-CD1 3.6Å; L309-A344 HydrophobicContact CD2-CB 3.73Å; L309-A344 HydrophobicContact CG-CB 3.66Å; L309-L360 HydrophobicContact CD1-CD2 4.3Å; L309-L360 HydrophobicContact CD2-CD2 4.03Å
310	H	95	Very high	93.1	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-56.9	-47.1	176.6	-65.3	82.8	0	0	0	110.7	D306 T307 A312 V313 A314 V336 Q342 A344 I347	D306-H310 HydrophobicContact CB-CB 4.34Å; D306-H310 WeakPolarHBondContact OD1-CB 3.18Å; D306-H310 IonicContact OD1-CG 3.75Å; T307-H310 PolarHBondContact N-ND1 3.11Å; T307-H310 PolarHBondContact O-N 3.04Å; T307-H310 PolarHBondContact OG1-ND1 3.41Å; H310-A312 PolarHBondContact O-N 2.86Å; H310-V313 PolarHBondContact O-N 3.18Å; H310-A314 WeakPolarHBondContact O-CB 3.42Å; H310-A314 PolarHBondContact O-N 2.87Å; H310-V336 PolarHBondContact CE1-O 3.21Å; H310-V336 PolarHBondContact NE2-O 3.21Å; H310-V336 VanDerWaalsContact NE2-O 3.13Å; H310-Q342 PolarHBondContact NE2-O 3.2Å; H310-A344 PolarHBondContact CD2-N 2.96Å; H310-A344 PolarHBondContact NE2-N 3.49Å; H310-A344 VanDerWaalsContact NE2-N 3.17Å; H310-I347 HydrophobicContact CB-CD1 3.95Å
311	I	92.7	Very high	93.5	Very high	9 Å²	9	31.6 Å²	31.6	5%	0.046	17%	0.174	C	C	.	.	H	α-helix	trans	-67.3	-37.3	178.5	-56.6	170.4	0	0	0	111.9	V189 K190 L193 D306 T307 L309 Q315	V189-I311 HydrophobicContact CB-CD1 4.13Å; V189-I311 HydrophobicContact CG1-CD1 3.85Å; K190-I311 HydrophobicContact CB-CD1 4.43Å; L193-I311 HydrophobicContact CD1-CB 3.72Å; L193-I311 HydrophobicContact CD1-CD1 3.83Å; L193-I311 HydrophobicContact CD1-CG1 4.37Å; L193-I311 HydrophobicContact CD1-CG2 3.47Å; L193-I311 VanDerWaalsContact CD1-CG2 3.47Å; D306-I311 HydrophobicContact CB-CD1 4.05Å; D306-I311 HydrophobicContact CB-CG1 3.75Å; D306-I311 WeakPolarHBondContact OD2-CG1 3.45Å; T307-I311 PolarHBondContact O-N 2.92Å; T307-I311 VanDerWaalsContact O-N 3.15Å; L309-I311 VanDerWaalsContact C-N 3.31Å; L309-I311 PolarHBondContact O-N 2.85Å; I311-Q315 VanDerWaalsContact CG2-NE2 3.34Å; I311-Q315 WeakPolarHBondContact O-CB 3.49Å; I311-Q315 WeakPolarHBondContact O-CG 3.37Å; I311-Q315 PolarHBondContact O-N 3.43Å
312	A	95	Very high	93.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.6	-40.5	176.1	0	0	0	0	0	112.1	F308 L309 H310 G316 R317 L320 S321 L324	F308-A312 WeakPolarHBondContact O-CB 3.32Å; F308-A312 PolarHBondContact O-N 2.98Å; F308-A312 VanDerWaalsContact O-N 3.11Å; L309-A312 PolarHBondContact O-N 3.01Å; H310-A312 PolarHBondContact O-N 2.86Å; A312-G316 PolarHBondContact O-N 2.82Å; A312-R317 PolarHBondContact O-N 3.38Å; A312-L320 HydrophobicContact CB-CB 4.49Å; A312-L320 HydrophobicContact CB-CD2 3.94Å; A312-L320 HydrophobicContact CB-CG 4.04Å; A312-S321 PolarHBondContact O-OG 3.2Å; A312-L324 HydrophobicContact CB-CD1 3.95Å
313	V	95.6	Very high	93.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-69.6	-48.5	175	173.7	0	0	0	0	111.4	L309 H310 Q315 G316 S321 A344 I347 A348 Q353 I356 L360	L309-V313 HydrophobicContact CD1-CG2 4.1Å; L309-V313 HydrophobicContact CG-CG2 4.43Å; L309-V313 VanDerWaalsContact O-CG2 3.31Å; L309-V313 WeakPolarHBondContact O-CG2 3.37Å; L309-V313 PolarHBondContact O-N 2.9Å; H310-V313 PolarHBondContact O-N 3.18Å; V313-Q315 PolarHBondContact O-N 2.59Å; V313-G316 PolarHBondContact O-N 3.08Å; V313-S321 PolarHBondContact N-OG 3.15Å; V313-A344 HydrophobicContact CG2-CB 4.3Å; V313-I347 HydrophobicContact CG1-CB 4.2Å; V313-I347 HydrophobicContact CG1-CG2 4Å; V313-A348 HydrophobicContact CG1-CB 3.59Å; V313-Q353 VanDerWaalsContact O-CD 3.28Å; V313-Q353 PolarHBondContact O-NE2 2.89Å; V313-Q353 PolarHBondContact O-OE1 3.02Å; V313-I356 HydrophobicContact CG1-CG2 4.16Å; V313-I356 HydrophobicContact CG2-CG2 3.86Å; V313-L360 HydrophobicContact CG2-CD1 4.3Å
314	A	93	Very high	94	Very high	51 Å²	51	26.7 Å²	26.7	42%	0.421	14%	0.141	S	C	.	.	H	α-helix	trans	-54.9	-29.6	177	0	0	0	0	0	112.6	H310 I347	H310-A314 WeakPolarHBondContact O-CB 3.42Å; H310-A314 PolarHBondContact O-N 2.87Å; A314-I347 HydrophobicContact CB-CG2 4.09Å
315	Q	92.1	Very high	94.4	Very high	109 Å²	109	23.4 Å²	23.4	51%	0.509	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	2	176.9	-66.1	169.9	-3.5	0	0	114.7	I311 V313 R317	I311-Q315 VanDerWaalsContact CG2-NE2 3.34Å; I311-Q315 WeakPolarHBondContact O-CB 3.49Å; I311-Q315 WeakPolarHBondContact O-CG 3.37Å; I311-Q315 PolarHBondContact O-N 3.43Å; V313-Q315 PolarHBondContact O-N 2.59Å; Q315-R317 HydrophobicContact CB-CG 4.11Å; Q315-R317 PolarHBondContact O-N 3.18Å
316	G	91.6	Very high	94.6	Very high	35 Å²	35	24.7 Å²	24.7	36%	0.361	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.8	17.2	180	0	0	0	0	0	114.9	A312 V313 R318	A312-G316 PolarHBondContact O-N 2.82Å; V313-G316 PolarHBondContact O-N 3.08Å; G316-R318 VanDerWaalsContact C-N 3.25Å; G316-R318 PolarHBondContact O-N 3.45Å
317	R	94.1	Very high	94.6	Very high	62 Å²	62	25.6 Å²	25.6	23%	0.234	14%	0.136	C	C	.	.			trans	-79	69.1	-173.8	-69.1	-163.9	-76.2	147	-1	111.9	A312 Q315 A319 L320 S321	A312-R317 PolarHBondContact O-N 3.38Å; Q315-R317 HydrophobicContact CB-CG 4.11Å; Q315-R317 PolarHBondContact O-N 3.18Å; R317-A319 PolarHBondContact O-N 3.24Å; R317-L320 HydrophobicContact CB-CB 4.23Å; R317-L320 VanDerWaalsContact CZ-CD2 3.49Å; R317-L320 PolarHBondContact O-N 3.29Å; R317-S321 PolarHBondContact O-N 2.87Å; R317-S321 PolarHBondContact O-OG 3.24Å
318	R	95.5	Very high	94.6	Very high	73 Å²	73	25.6 Å²	25.6	28%	0.275	14%	0.136	S	C	.	.	H	α-helix	trans	-44.1	-52.9	-171.2	-171.4	-175.4	178.6	-162.4	-3.1	114.6	F279 G316 L320 S321 Y322 I356 D359	F279-R318 HydrophobicContact CE2-CB 4.2Å; F279-R318 HydrophobicContact CE2-CG 3.58Å; F279-R318 HydrophobicContact CZ-CG 3.78Å; F279-R318 VanDerWaalsContact CZ-CZ 3.5Å; F279-R318 VanDerWaalsContact CZ-NE 3.27Å; G316-R318 VanDerWaalsContact C-N 3.25Å; G316-R318 PolarHBondContact O-N 3.45Å; R318-L320 VanDerWaalsContact C-N 3.33Å; R318-L320 PolarHBondContact O-N 2.86Å; R318-S321 PolarHBondContact O-N 3.12Å; R318-Y322 WeakPolarHBondContact O-CB 3.49Å; R318-Y322 PolarHBondContact O-N 2.83Å; R318-I356 HydrophobicContact CB-CD1 3.91Å; R318-I356 HydrophobicContact CB-CG1 3.78Å; R318-I356 HydrophobicContact CG-CD1 4.37Å; R318-I356 HydrophobicContact CG-CG1 3.66Å; R318-D359 WeakPolarHBondContact CG-OD2 3.4Å; R318-D359 IonicContact CZ-OD1 2.92Å; R318-D359 IonicContact CZ-OD2 3.63Å; R318-D359 IonicContact NE-OD1 3.14Å; R318-D359 IonicContact NE-OD2 2.68Å; R318-D359 PolarHBondContact NE-OD2 3.32Å; R318-D359 IonicContact NH2-OD1 3.8Å; R318-D359 PolarHBondContact NH2-OD1 3.23Å; R318-D359 IonicContact NH2-OD2 2.72Å; R318-D359 PolarHBondContact NH2-OD2 3.17Å
319	A	95.8	Very high	94.6	Very high	9 Å²	9	26.9 Å²	26.9	7%	0.074	15%	0.149	C	C	.	.	H	α-helix	trans	-64.4	-35.4	-177.2	0	0	0	0	0	113.1	F279 Q282 I283 E286 R317 V323	F279-A319 HydrophobicContact CD2-CB 4.44Å; F279-A319 HydrophobicContact CE2-CB 4.12Å; Q282-A319 HydrophobicContact CB-CB 3.61Å; I283-A319 HydrophobicContact CG1-CB 4.22Å; E286-A319 HydrophobicContact CG-CB 4.06Å; R317-A319 PolarHBondContact O-N 3.24Å; A319-V323 WeakPolarHBondContact O-CG2 3.33Å; A319-V323 PolarHBondContact O-N 3.48Å; A319-V323 VanDerWaalsContact O-N 3.15Å
320	L	95.2	Very high	94.3	Very high	14 Å²	14	36.7 Å²	36.7	7%	0.073	19%	0.186	C	C	.	.	H	α-helix	trans	-72.5	-42.6	173.9	-179.4	62.4	0	0	0	111.1	E286 A312 R317 R318 Y322 V323 L324	E286-L320 HydrophobicContact CB-CD1 4.38Å; E286-L320 HydrophobicContact CG-CB 4.29Å; A312-L320 HydrophobicContact CB-CB 4.49Å; A312-L320 HydrophobicContact CB-CD2 3.94Å; A312-L320 HydrophobicContact CB-CG 4.04Å; R317-L320 HydrophobicContact CB-CB 4.23Å; R317-L320 VanDerWaalsContact CZ-CD2 3.49Å; R317-L320 PolarHBondContact O-N 3.29Å; R318-L320 VanDerWaalsContact C-N 3.33Å; R318-L320 PolarHBondContact O-N 2.86Å; L320-Y322 VanDerWaalsContact C-N 3.3Å; L320-Y322 PolarHBondContact O-N 3.04Å; L320-V323 PolarHBondContact O-N 2.96Å; L320-L324 HydrophobicContact CD1-CD1 3.99Å; L320-L324 HydrophobicContact CD1-CG 3.96Å; L320-L324 HydrophobicContact CD2-CD1 4.34Å; L320-L324 HydrophobicContact CG-CD1 3.79Å; L320-L324 HydrophobicContact CG-CG 4.2Å; L320-L324 WeakPolarHBondContact O-CB 3.48Å; L320-L324 WeakPolarHBondContact O-CG 3.18Å; L320-L324 PolarHBondContact O-N 3.13Å
321	S	96.8	Very high	93.9	Very high	2 Å²	2	43 Å²	43	1%	0.014	21%	0.21	C	C	.	.	H	α-helix	trans	-59.3	-42	176	-53.9	0	0	0	0	111.6	L309 A312 V313 R317 R318 A325	L309-S321 WeakPolarHBondContact CD1-O 3.37Å; A312-S321 PolarHBondContact O-OG 3.2Å; V313-S321 PolarHBondContact N-OG 3.15Å; R317-S321 PolarHBondContact O-N 2.87Å; R317-S321 PolarHBondContact O-OG 3.24Å; R318-S321 PolarHBondContact O-N 3.12Å; S321-A325 WeakPolarHBondContact O-CB 2.96Å; S321-A325 PolarHBondContact O-N 3.2Å
322	Y	96.8	Very high	93.6	Very high	73 Å²	73	45.6 Å²	45.6	29%	0.286	24%	0.24	S	C	.	.	H	α-helix	trans	-58.1	-51.7	172.8	-173.8	-79.3	0	0	0	111.5	F279 I283 R318 L320 L324 A325 A326 D359 H363	F279-Y322 HydrophobicContact CE1-CD2 4.47Å; F279-Y322 HydrophobicContact CZ-CD2 4.22Å; F279-Y322 HydrophobicContact CZ-CG 4.48Å; I283-Y322 HydrophobicContact CD1-CD1 3.62Å; I283-Y322 HydrophobicContact CD1-CD2 4.21Å; I283-Y322 HydrophobicContact CD1-CE1 3.86Å; I283-Y322 HydrophobicContact CD1-CE2 4.42Å; I283-Y322 HydrophobicContact CD1-CG 3.84Å; I283-Y322 HydrophobicContact CG1-CD1 3.9Å; I283-Y322 HydrophobicContact CG1-CG 4.2Å; I283-Y322 HydrophobicContact CG2-CD1 4.11Å; I283-Y322 HydrophobicContact CG2-CE1 4.29Å; R318-Y322 WeakPolarHBondContact O-CB 3.49Å; R318-Y322 PolarHBondContact O-N 2.83Å; L320-Y322 VanDerWaalsContact C-N 3.3Å; L320-Y322 PolarHBondContact O-N 3.04Å; Y322-L324 PolarHBondContact O-N 3.17Å; Y322-A325 PolarHBondContact O-N 3.23Å; Y322-A326 VanDerWaalsContact O-CB 3.26Å; Y322-A326 WeakPolarHBondContact O-CB 3.42Å; Y322-A326 PolarHBondContact O-N 3.42Å; Y322-D359 HydrophobicContact CD2-CB 3.89Å; Y322-H363 AromaticContact CD1-NE2 3.98Å; Y322-H363 AromaticContact CD2-NE2 3.74Å; Y322-H363 AromaticContact CE1-NE2 3.67Å; Y322-H363 AromaticContact CE2-NE2 3.41Å; Y322-H363 WeakPolarHBondContact CE2-NE2 3.42Å; Y322-H363 AromaticContact CG-NE2 3.99Å; Y322-H363 AromaticContact CZ-CE1 3.81Å; Y322-H363 AromaticContact CZ-NE2 3.34Å; Y322-H363 VanDerWaalsContact CZ-NE2 3.34Å
323	V	95.8	Very high	93.4	Very high	8 Å²	8	46.7 Å²	46.7	5%	0.048	25%	0.248	C	C	.	.	H	α-helix	trans	-62.5	-42.4	-179.9	163.3	0	0	0	0	112.7	I283 E286 A287 A290 A319 L320 K327	I283-V323 HydrophobicContact CG2-CG2 3.95Å; E286-V323 HydrophobicContact CB-CB 4.47Å; E286-V323 HydrophobicContact CB-CG2 4.07Å; A287-V323 HydrophobicContact CB-CG1 4.4Å; A287-V323 HydrophobicContact CB-CG2 4.06Å; A290-V323 HydrophobicContact CB-CG1 3.69Å; A319-V323 WeakPolarHBondContact O-CG2 3.33Å; A319-V323 PolarHBondContact O-N 3.48Å; A319-V323 VanDerWaalsContact O-N 3.15Å; L320-V323 PolarHBondContact O-N 2.96Å; V323-K327 HydrophobicContact CG1-CD 4.42Å; V323-K327 PolarHBondContact O-N 2.7Å; V323-K327 VanDerWaalsContact O-N 3.13Å
324	L	94.8	Very high	93.3	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.021	25%	0.25	C	C	.	.	H	α-helix	trans	-69.3	-43	177.9	-70.5	174.7	0	0	0	111.1	L293 L298 F308 L309 A312 L320 Y322 K327 M328	L293-L324 HydrophobicContact CD1-CD2 3.97Å; L298-L324 HydrophobicContact CD2-CD2 3.7Å; F308-L324 HydrophobicContact CB-CD1 3.99Å; F308-L324 HydrophobicContact CB-CD2 4.41Å; F308-L324 WeakPolarHBondContact O-CD1 3.11Å; L309-L324 HydrophobicContact CB-CB 4.3Å; L309-L324 HydrophobicContact CD1-CB 3.87Å; A312-L324 HydrophobicContact CB-CD1 3.95Å; L320-L324 HydrophobicContact CD1-CD1 3.99Å; L320-L324 HydrophobicContact CD1-CG 3.96Å; L320-L324 HydrophobicContact CD2-CD1 4.34Å; L320-L324 HydrophobicContact CG-CD1 3.79Å; L320-L324 HydrophobicContact CG-CG 4.2Å; L320-L324 WeakPolarHBondContact O-CB 3.48Å; L320-L324 WeakPolarHBondContact O-CG 3.18Å; L320-L324 PolarHBondContact O-N 3.13Å; Y322-L324 PolarHBondContact O-N 3.17Å; L324-K327 PolarHBondContact O-N 3.21Å; L324-M328 WeakPolarHBondContact O-CB 3.19Å; L324-M328 VanDerWaalsContact O-CG 3.31Å; L324-M328 WeakPolarHBondContact O-CG 3.43Å; L324-M328 PolarHBondContact O-N 3.16Å
325	A	95.9	Very high	93.4	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.008	24%	0.237	C	C	.	.	H	α-helix	trans	-60.9	-47	175	0	0	0	0	0	111.9	L309 S321 Y322 K327 M328 A329 L334 L360 H363	L309-A325 HydrophobicContact CD1-CB 4.37Å; L309-A325 HydrophobicContact CD2-CB 4.46Å; S321-A325 WeakPolarHBondContact O-CB 2.96Å; S321-A325 PolarHBondContact O-N 3.2Å; Y322-A325 PolarHBondContact O-N 3.23Å; A325-K327 PolarHBondContact O-N 2.95Å; A325-M328 PolarHBondContact O-N 3.24Å; A325-A329 VanDerWaalsContact O-CB 3.24Å; A325-A329 WeakPolarHBondContact O-CB 3.47Å; A325-A329 PolarHBondContact O-N 3.49Å; A325-L334 HydrophobicContact CB-CD1 3.8Å; A325-L360 HydrophobicContact CB-CD2 3.76Å; A325-H363 HydrophobicContact CB-CB 4.37Å
326	A	94.6	Very high	93.5	Very high	27 Å²	27	42.7 Å²	42.7	22%	0.223	22%	0.224	C	C	.	.	H	α-helix	trans	-61.6	-27.1	176.6	0	0	0	0	0	113.6	Y322 R330	Y322-A326 VanDerWaalsContact O-CB 3.26Å; Y322-A326 WeakPolarHBondContact O-CB 3.42Å; Y322-A326 PolarHBondContact O-N 3.42Å; A326-R330 WeakPolarHBondContact O-CG 3.38Å
327	K	92.9	Very high	93.6	Very high	49 Å²	49	44.9 Å²	44.9	21%	0.213	22%	0.223	C	C	.	.	H	α-helix	trans	-80.4	-48.4	172.1	-82.2	171.3	166.2	-97.3	0	111.8	A290 E291 L298 V323 L324 A325 A329 R330 Y331	A290-K327 HydrophobicContact CB-CD 4.36Å; A290-K327 WeakPolarHBondContact O-CE 3.4Å; A290-K327 PolarHBondContact O-NZ 3.04Å; E291-K327 PolarHBondContact O-NZ 3.13Å; L298-K327 HydrophobicContact CD1-CB 3.82Å; V323-K327 HydrophobicContact CG1-CD 4.42Å; V323-K327 PolarHBondContact O-N 2.7Å; V323-K327 VanDerWaalsContact O-N 3.13Å; L324-K327 PolarHBondContact O-N 3.21Å; A325-K327 PolarHBondContact O-N 2.95Å; K327-A329 PolarHBondContact O-N 3.44Å; K327-R330 WeakPolarHBondContact O-CB 3.31Å; K327-R330 PolarHBondContact O-N 3.05Å; K327-Y331 WeakPolarHBondContact O-CD2 3.3Å
328	M	94	Very high	93.6	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-68	-33.5	-177.3	-69.9	169.3	75.2	0	0	112.9	L298 L309 L324 A325 R330 Y331 G332 S333 L334	L298-M328 HydrophobicContact CB-CG 3.94Å; L298-M328 HydrophobicContact CD1-CG 4.31Å; L298-M328 HydrophobicContact CD2-CG 4.37Å; L298-M328 HydrophobicContact CG-CG 4.44Å; L309-M328 HydrophobicContact CB-CE 4.24Å; L309-M328 HydrophobicContact CB-SD 3.6Å; L309-M328 HydrophobicContact CD2-CE 4.3Å; L309-M328 HydrophobicContact CD2-SD 3.84Å; L309-M328 HydrophobicContact CG-SD 4.33Å; L324-M328 WeakPolarHBondContact O-CB 3.19Å; L324-M328 VanDerWaalsContact O-CG 3.31Å; L324-M328 WeakPolarHBondContact O-CG 3.43Å; L324-M328 PolarHBondContact O-N 3.16Å; A325-M328 PolarHBondContact O-N 3.24Å; M328-R330 VanDerWaalsContact C-N 3.26Å; M328-R330 PolarHBondContact O-N 3.47Å; M328-Y331 PolarHBondContact O-N 2.89Å; M328-Y331 VanDerWaalsContact O-N 3.1Å; M328-G332 PolarHBondContact O-N 3.48Å; M328-S333 VanDerWaalsContact CE-O 3.23Å; M328-S333 WeakPolarHBondContact CE-O 3.41Å; M328-S333 PolarHBondContact O-N 3.5Å; M328-L334 HydrophobicContact CB-CD1 4.48Å
329	A	93.1	Very high	93.3	Very high	37 Å²	37	45 Å²	45	31%	0.306	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-57.4	-36.9	173.7	0	0	0	0	0	112.8	A325 K327 Y331 G332 L334 H363	A325-A329 VanDerWaalsContact O-CB 3.24Å; A325-A329 WeakPolarHBondContact O-CB 3.47Å; A325-A329 PolarHBondContact O-N 3.49Å; K327-A329 PolarHBondContact O-N 3.44Å; A329-Y331 PolarHBondContact O-N 3.48Å; A329-G332 PolarHBondContact O-N 2.66Å; A329-L334 HydrophobicContact CB-CD2 4.26Å; A329-H363 HydrophobicContact CB-CB 4.33Å; A329-H363 WeakPolarHBondContact CB-O 3.24Å
330	R	89.3	Confident	92.9	Very high	206 Å²	206	48.3 Å²	48.3	78%	0.777	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-65.5	-18.2	178.5	-64.1	176	-177.9	-150.5	-3.4	113.7	A326 K327 M328	A326-R330 WeakPolarHBondContact O-CG 3.38Å; K327-R330 WeakPolarHBondContact O-CB 3.31Å; K327-R330 PolarHBondContact O-N 3.05Å; M328-R330 VanDerWaalsContact C-N 3.26Å; M328-R330 PolarHBondContact O-N 3.47Å
331	Y	87.1	Confident	92.7	Very high	132 Å²	132	48.1 Å²	48.1	52%	0.518	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-114.6	8.5	-179.4	-53.5	-64.9	0	0	0	112.5	P295 L298 K327 M328 A329 S333	P295-Y331 HydrophobicContact CB-CD1 4.26Å; P295-Y331 HydrophobicContact CB-CD2 4.18Å; P295-Y331 HydrophobicContact CB-CE1 4.26Å; P295-Y331 HydrophobicContact CB-CE2 4.18Å; P295-Y331 HydrophobicContact CB-CG 4.23Å; P295-Y331 HydrophobicContact CG-CD1 4.39Å; P295-Y331 HydrophobicContact CG-CE1 3.89Å; P295-Y331 HydrophobicContact CG-CE2 4.09Å; L298-Y331 HydrophobicContact CD1-CD2 4.31Å; L298-Y331 HydrophobicContact CD1-CE2 4.21Å; K327-Y331 WeakPolarHBondContact O-CD2 3.3Å; M328-Y331 PolarHBondContact O-N 2.89Å; M328-Y331 VanDerWaalsContact O-N 3.1Å; A329-Y331 PolarHBondContact O-N 3.48Å; Y331-S333 PolarHBondContact O-N 3.26Å; Y331-S333 PolarHBondContact O-OG 2.91Å; Y331-S333 VanDerWaalsContact O-OG 3.13Å
332	G	86.6	Confident	92.6	Very high	65 Å²	65	49.4 Å²	49.4	67%	0.67	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	8.5	-177.5	0	0	0	0	0	115	M328 A329 L334	M328-G332 PolarHBondContact O-N 3.48Å; A329-G332 PolarHBondContact O-N 2.66Å; G332-L334 PolarHBondContact O-N 3.03Å
333	S	90.9	Very high	92.5	Very high	23 Å²	23	46 Å²	46	16%	0.161	24%	0.24	C	C	.	.			trans	-95	13.6	-169.5	-31.2	0	0	0	0	113.8	C299 M328 Y331 D335 V336	C299-S333 VanDerWaalsContact SG-CB 3.5Å; C299-S333 PolarHBondContact SG-OG 3.29Å; M328-S333 VanDerWaalsContact CE-O 3.23Å; M328-S333 WeakPolarHBondContact CE-O 3.41Å; M328-S333 PolarHBondContact O-N 3.5Å; Y331-S333 PolarHBondContact O-N 3.26Å; Y331-S333 PolarHBondContact O-OG 2.91Å; Y331-S333 VanDerWaalsContact O-OG 3.13Å; S333-D335 VanDerWaalsContact C-N 3.28Å; S333-D335 PolarHBondContact O-N 2.9Å; S333-V336 WeakPolarHBondContact O-CG2 3.27Å
334	L	93.3	Very high	92.6	Very high	9 Å²	9	45.7 Å²	45.7	5%	0.047	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-27.7	-173.7	-174.1	55.7	0	0	0	113.2	L309 A325 M328 A329 G332 L360 H363 A365	L309-L334 HydrophobicContact CD2-CD1 3.6Å; A325-L334 HydrophobicContact CB-CD1 3.8Å; M328-L334 HydrophobicContact CB-CD1 4.48Å; A329-L334 HydrophobicContact CB-CD2 4.26Å; G332-L334 PolarHBondContact O-N 3.03Å; L334-L360 HydrophobicContact CD1-CD2 4.08Å; L334-H363 HydrophobicContact CD2-CB 4.16Å; L334-H363 WeakPolarHBondContact CD2-O 3.37Å; L334-A365 HydrophobicContact CD2-CB 3.81Å; L334-A365 HydrophobicContact CG-CB 4.04Å
335	D	94.3	Very high	92.6	Very high	30 Å²	30	45.6 Å²	45.6	16%	0.16	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	22.7	-173.1	-61.7	-56.6	0	0	0	114	S333 T343 Q366 I369	S333-D335 VanDerWaalsContact C-N 3.28Å; S333-D335 PolarHBondContact O-N 2.9Å; D335-T343 HydrophobicContact CB-CG2 4.43Å; D335-T343 WeakPolarHBondContact O-CG2 3.32Å; D335-Q366 PolarHBondContact OD1-N 3.27Å; D335-Q366 WeakPolarHBondContact OD2-CG 3.37Å; D335-Q366 PolarHBondContact OD2-NE2 2.76Å; D335-I369 HydrophobicContact CB-CD1 3.57Å
336	V	94.2	Very high	92.6	Very high	36 Å²	36	45.6 Å²	45.6	22%	0.218	24%	0.237	C	C	.	.			trans	-57.4	148	168.2	173.3	0	0	0	0	109.7	Q301 T307 H310 S333	Q301-V336 HydrophobicContact CG-CG1 4.39Å; T307-V336 HydrophobicContact CG2-CB 4.29Å; T307-V336 HydrophobicContact CG2-CG1 3.66Å; H310-V336 PolarHBondContact CE1-O 3.21Å; H310-V336 PolarHBondContact NE2-O 3.21Å; H310-V336 VanDerWaalsContact NE2-O 3.13Å; S333-V336 WeakPolarHBondContact O-CG2 3.27Å
337	K	94.5	Very high	92.6	Very high	81 Å²	81	45.1 Å²	45.1	35%	0.352	23%	0.231	S	C	.	.	B	Isolated β-bridge	trans	-115.4	139.4	-176.3	-70	166.1	163.2	-106.4	0	112.3	Q301 G341 Q342 T343 I369 R370	Q301-K337 PolarHBondContact NE2-O 3.17Å; K337-G341 PolarHBondContact NZ-O 3.27Å; K337-Q342 CarbonylContact C-O 3.32Å; K337-Q342 VanDerWaalsContact CA-O 3.25Å; K337-Q342 WeakPolarHBondContact CA-O 3.14Å; K337-T343 HydrophobicContact CG-CG2 3.88Å; K337-I369 VanDerWaalsContact CE-CG2 3.44Å; K337-R370 PolarHBondContact NZ-O 2.89Å
338	E	93.3	Very high	92.8	Very high	16 Å²	16	42.8 Å²	42.8	8%	0.075	22%	0.221	C	C	.	.			trans	-78.3	-177.7	166.6	60.8	61.7	-105.8	0	0	112.5	G305 N340 G341 Q342 I347	G305-E338 WeakPolarHBondContact O-CA 3.45Å; E338-N340 VanDerWaalsContact C-N 3.32Å; E338-N340 PolarHBondContact O-N 3.18Å; E338-N340 VanDerWaalsContact OE1-CA 3.22Å; E338-N340 WeakPolarHBondContact OE1-CA 3.19Å; E338-N340 VanDerWaalsContact OE1-CB 3.32Å; E338-N340 WeakPolarHBondContact OE1-CB 3.41Å; E338-N340 PolarHBondContact OE1-N 3.46Å; E338-N340 VanDerWaalsContact OE2-CB 3.32Å; E338-N340 WeakPolarHBondContact OE2-CB 3.32Å; E338-N340 PolarHBondContact OE2-N 3.13Å; E338-N340 PolarHBondContact OE2-ND2 3.14Å; E338-G341 WeakPolarHBondContact O-CA 3.4Å; E338-G341 PolarHBondContact O-N 2.95Å; E338-G341 PolarHBondContact OE1-N 3.43Å; E338-Q342 HydrophobicContact CG-CB 4.34Å; E338-Q342 PolarHBondContact N-O 2.95Å; E338-Q342 WeakPolarHBondContact OE1-CA 3.33Å; E338-Q342 VanDerWaalsContact OE1-CB 3.25Å; E338-Q342 WeakPolarHBondContact OE1-CB 3.46Å; E338-Q342 PolarHBondContact OE1-N 3.46Å; E338-I347 HydrophobicContact CG-CD1 4.2Å
339	H	90.9	Very high	92.8	Very high	121 Å²	121	42.8 Å²	42.8	56%	0.56	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-21.3	-170	-72.3	164.3	0	0	0	115.4	S303 D304 G305 G341 L372	S303-H339 PolarHBondContact O-CE1 2.93Å; S303-H339 PolarHBondContact O-ND1 3.26Å; S303-H339 VanDerWaalsContact O-ND1 3.1Å; D304-H339 WeakPolarHBondContact O-CB 3.45Å; D304-H339 PolarHBondContact O-N 3.34Å; D304-H339 VanDerWaalsContact O-N 3.16Å; D304-H339 PolarHBondContact O-ND1 3.48Å; G305-H339 PolarHBondContact N-CE1 3.4Å; G305-H339 PolarHBondContact N-ND1 2.89Å; H339-G341 PolarHBondContact O-N 3.03Å; H339-L372 WeakPolarHBondContact O-CD1 3.32Å
340	N	86.9	Confident	92.8	Very high	80 Å²	80	42.9 Å²	42.9	43%	0.428	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	7.7	169.2	-56.3	-88.6	0	0	0	112.8	E338 Q342 L372 W373	E338-N340 VanDerWaalsContact C-N 3.32Å; E338-N340 PolarHBondContact O-N 3.18Å; E338-N340 VanDerWaalsContact OE1-CA 3.22Å; E338-N340 WeakPolarHBondContact OE1-CA 3.19Å; E338-N340 VanDerWaalsContact OE1-CB 3.32Å; E338-N340 WeakPolarHBondContact OE1-CB 3.41Å; E338-N340 PolarHBondContact OE1-N 3.46Å; E338-N340 VanDerWaalsContact OE2-CB 3.32Å; E338-N340 WeakPolarHBondContact OE2-CB 3.32Å; E338-N340 PolarHBondContact OE2-N 3.13Å; E338-N340 PolarHBondContact OE2-ND2 3.14Å; N340-Q342 VanDerWaalsContact C-N 3.28Å; N340-Q342 HydrophobicContact CB-CG 4.4Å; N340-Q342 PolarHBondContact O-N 3.19Å; N340-L372 WeakPolarHBondContact O-CB 3.37Å; N340-L372 WeakPolarHBondContact O-CG 3.28Å; N340-L372 PolarHBondContact O-N 2.93Å; N340-W373 HydrophobicContact CB-CH2 4.19Å; N340-W373 HydrophobicContact CB-CZ3 4.13Å
341	G	91.6	Very high	93	Very high	9 Å²	9	36 Å²	36	9%	0.093	20%	0.202	C	C	.	.	S	Bend	trans	75.2	11.4	177.4	0	0	0	0	0	114.5	K337 E338 H339	K337-G341 PolarHBondContact NZ-O 3.27Å; E338-G341 WeakPolarHBondContact O-CA 3.4Å; E338-G341 PolarHBondContact O-N 2.95Å; E338-G341 PolarHBondContact OE1-N 3.43Å; H339-G341 PolarHBondContact O-N 3.03Å
342	Q	93.8	Very high	93.3	Very high	30 Å²	30	31.9 Å²	31.9	14%	0.14	19%	0.189	C	C	.	.			trans	-86.5	140.6	179.9	-57	-169.3	-7.8	0	0	111.1	H310 K337 E338 N340 Q346 I347 D371	H310-Q342 PolarHBondContact NE2-O 3.2Å; K337-Q342 CarbonylContact C-O 3.32Å; K337-Q342 VanDerWaalsContact CA-O 3.25Å; K337-Q342 WeakPolarHBondContact CA-O 3.14Å; E338-Q342 HydrophobicContact CG-CB 4.34Å; E338-Q342 PolarHBondContact N-O 2.95Å; E338-Q342 WeakPolarHBondContact OE1-CA 3.33Å; E338-Q342 VanDerWaalsContact OE1-CB 3.25Å; E338-Q342 WeakPolarHBondContact OE1-CB 3.46Å; E338-Q342 PolarHBondContact OE1-N 3.46Å; N340-Q342 VanDerWaalsContact C-N 3.28Å; N340-Q342 HydrophobicContact CB-CG 4.4Å; N340-Q342 PolarHBondContact O-N 3.19Å; Q342-Q346 HydrophobicContact CB-CB 3.91Å; Q342-Q346 HydrophobicContact CG-CB 4.38Å; Q342-I347 HydrophobicContact CB-CG1 4.37Å; Q342-D371 HydrophobicContact CG-CB 3.94Å
343	T	95.7	Very high	93.6	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.006	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-85.8	167.2	164.8	68.3	0	0	0	0	111.2	D335 K337 L345 Q346 I347 I369	D335-T343 HydrophobicContact CB-CG2 4.43Å; D335-T343 WeakPolarHBondContact O-CG2 3.32Å; K337-T343 HydrophobicContact CG-CG2 3.88Å; T343-L345 PolarHBondContact O-N 3.42Å; T343-L345 VanDerWaalsContact O-N 3.1Å; T343-L345 PolarHBondContact OG1-N 3.42Å; T343-Q346 WeakPolarHBondContact O-CA 3.33Å; T343-Q346 WeakPolarHBondContact O-CB 3.49Å; T343-Q346 PolarHBondContact O-N 3.13Å; T343-I347 PolarHBondContact O-N 3.39Å; T343-I369 HydrophobicContact CG2-CB 4.41Å; T343-I369 HydrophobicContact CG2-CD1 3.99Å; T343-I369 HydrophobicContact CG2-CG2 3.84Å
344	A	96.1	Very high	93.8	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-52.3	-31.8	171.2	0	0	0	0	0	113.5	L309 H310 V313 I347 A348	L309-A344 HydrophobicContact CD2-CB 3.73Å; L309-A344 HydrophobicContact CG-CB 3.66Å; H310-A344 PolarHBondContact CD2-N 2.96Å; H310-A344 PolarHBondContact NE2-N 3.49Å; H310-A344 VanDerWaalsContact NE2-N 3.17Å; V313-A344 HydrophobicContact CG2-CB 4.3Å; A344-I347 PolarHBondContact O-N 3.24Å; A344-A348 PolarHBondContact O-N 3.27Å
345	L	96.7	Very high	93.9	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-67.2	-39.1	174	-178.9	65.7	0	0	0	112.2	T343 A348 V349 I357 L360 L361 A365 I367	T343-L345 PolarHBondContact O-N 3.42Å; T343-L345 VanDerWaalsContact O-N 3.1Å; T343-L345 PolarHBondContact OG1-N 3.42Å; L345-A348 PolarHBondContact O-N 2.85Å; L345-V349 PolarHBondContact O-N 3.21Å; L345-I357 HydrophobicContact CD1-CG2 4.05Å; L345-L360 HydrophobicContact CB-CD1 4.36Å; L345-L360 HydrophobicContact CD1-CB 4.03Å; L345-L360 HydrophobicContact CD1-CD1 4.26Å; L345-L361 HydrophobicContact CD1-CD2 4.14Å; L345-L361 HydrophobicContact CD1-CG 4.02Å; L345-L361 HydrophobicContact CD2-CD2 3.73Å; L345-A365 HydrophobicContact CB-CB 4.33Å; L345-A365 HydrophobicContact CD2-CB 4.07Å; L345-I367 HydrophobicContact CD2-CD1 4.14Å
346	Q	94.3	Very high	94.1	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-69.3	-36.6	175.8	-72.8	170.1	-68.1	0	0	111.7	Q342 T343 V349 A350 I369 D371 R375 P377	Q342-Q346 HydrophobicContact CB-CB 3.91Å; Q342-Q346 HydrophobicContact CG-CB 4.38Å; T343-Q346 WeakPolarHBondContact O-CA 3.33Å; T343-Q346 WeakPolarHBondContact O-CB 3.49Å; T343-Q346 PolarHBondContact O-N 3.13Å; Q346-V349 PolarHBondContact O-N 2.73Å; Q346-A350 WeakPolarHBondContact O-CB 3.47Å; Q346-A350 PolarHBondContact O-N 3.41Å; Q346-I369 PolarHBondContact NE2-O 3.45Å; Q346-D371 VanDerWaalsContact NE2-N 3.13Å; Q346-R375 PolarHBondContact NE2-O 2.74Å; Q346-P377 HydrophobicContact CG-CB 4.42Å; Q346-P377 HydrophobicContact CG-CG 3.84Å
347	I	94.9	Very high	94.2	Very high	18 Å²	18	33 Å²	33	9%	0.092	17%	0.173	C	C	.	.	H	α-helix	trans	-64.5	-43.2	171.8	-60.8	-174.5	0	0	0	111.1	H310 V313 A314 E338 Q342 T343 A344 V349 A350 T351	H310-I347 HydrophobicContact CB-CD1 3.95Å; V313-I347 HydrophobicContact CG1-CB 4.2Å; V313-I347 HydrophobicContact CG1-CG2 4Å; A314-I347 HydrophobicContact CB-CG2 4.09Å; E338-I347 HydrophobicContact CG-CD1 4.2Å; Q342-I347 HydrophobicContact CB-CG1 4.37Å; T343-I347 PolarHBondContact O-N 3.39Å; A344-I347 PolarHBondContact O-N 3.24Å; I347-V349 VanDerWaalsContact C-N 3.26Å; I347-V349 PolarHBondContact O-N 3.04Å; I347-A350 PolarHBondContact O-N 2.97Å; I347-T351 HydrophobicContact CG2-CG2 4.47Å; I347-T351 WeakPolarHBondContact O-CB 3.47Å; I347-T351 WeakPolarHBondContact O-CG2 3.46Å; I347-T351 PolarHBondContact O-N 2.79Å; I347-T351 PolarHBondContact O-OG1 2.92Å
348	A	96.6	Very high	94.2	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59.4	-39.5	176.5	0	0	0	0	0	111.6	V313 A344 L345 T351 N352 Q353 I356 I357 L360	V313-A348 HydrophobicContact CG1-CB 3.59Å; A344-A348 PolarHBondContact O-N 3.27Å; L345-A348 PolarHBondContact O-N 2.85Å; A348-T351 PolarHBondContact O-OG1 3.33Å; A348-N352 PolarHBondContact O-N 3.48Å; A348-Q353 PolarHBondContact O-N 3.36Å; A348-I356 HydrophobicContact CB-CG2 3.94Å; A348-I357 HydrophobicContact CB-CG1 3.6Å; A348-L360 HydrophobicContact CB-CD1 4Å
349	V	95.5	Very high	94.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-67.2	-46.1	173.5	154.4	0	0	0	0	112.8	L345 Q346 I347 T351 N352 I357 P377 V380 C381 H386 I393	L345-V349 PolarHBondContact O-N 3.21Å; Q346-V349 PolarHBondContact O-N 2.73Å; I347-V349 VanDerWaalsContact C-N 3.26Å; I347-V349 PolarHBondContact O-N 3.04Å; V349-T351 PolarHBondContact O-N 2.97Å; V349-N352 PolarHBondContact O-N 3.45Å; V349-N352 VanDerWaalsContact O-N 3.12Å; V349-I357 HydrophobicContact CB-CD1 4.28Å; V349-I357 HydrophobicContact CG2-CD1 3.5Å; V349-I357 HydrophobicContact CG2-CG1 4.05Å; V349-P377 HydrophobicContact CB-CB 4.31Å; V349-P377 HydrophobicContact CG1-CB 4.19Å; V349-P377 WeakPolarHBondContact CG1-O 3.35Å; V349-P377 HydrophobicContact CG2-CB 3.9Å; V349-V380 HydrophobicContact CG1-CB 3.7Å; V349-V380 HydrophobicContact CG1-CG1 3.76Å; V349-C381 VanDerWaalsContact CG1-SG 3.53Å; V349-H386 PolarHBondContact O-ND1 3.33Å; V349-I393 HydrophobicContact CG2-CD1 4.22Å
350	A	93	Very high	94.6	Very high	39 Å²	39	24.7 Å²	24.7	32%	0.322	14%	0.139	S	C	.	.	H	α-helix	trans	-62.8	-26.2	178.5	0	0	0	0	0	112.5	Q346 I347 V380 H386	Q346-A350 WeakPolarHBondContact O-CB 3.47Å; Q346-A350 PolarHBondContact O-N 3.41Å; I347-A350 PolarHBondContact O-N 2.97Å; A350-V380 HydrophobicContact CB-CG1 4.12Å; A350-H386 PolarHBondContact O-CE1 3.1Å
351	T	92.1	Very high	94.9	Very high	62 Å²	62	21.1 Å²	21.1	38%	0.38	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	6.3	177.6	54.8	0	0	0	0	114.2	I347 A348 V349 Q353	I347-T351 HydrophobicContact CG2-CG2 4.47Å; I347-T351 WeakPolarHBondContact O-CB 3.47Å; I347-T351 WeakPolarHBondContact O-CG2 3.46Å; I347-T351 PolarHBondContact O-N 2.79Å; I347-T351 PolarHBondContact O-OG1 2.92Å; A348-T351 PolarHBondContact O-OG1 3.33Å; V349-T351 PolarHBondContact O-N 2.97Å; T351-Q353 VanDerWaalsContact C-N 3.26Å; T351-Q353 PolarHBondContact O-N 2.93Å; T351-Q353 WeakPolarHBondContact OG1-CG 3.5Å; T351-Q353 PolarHBondContact OG1-NE2 2.98Å; T351-Q353 VanDerWaalsContact OG1-NE2 3.15Å
352	N	93.6	Very high	95	Very high	46 Å²	46	23 Å²	23	25%	0.246	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	26.2	-179.8	-162.9	34.9	0	0	0	115.6	A348 V349 H354 H386 S389	A348-N352 PolarHBondContact O-N 3.48Å; V349-N352 PolarHBondContact O-N 3.45Å; V349-N352 VanDerWaalsContact O-N 3.12Å; N352-H354 PolarHBondContact O-N 3Å; N352-H386 WeakPolarHBondContact OD1-CB 3.46Å; N352-S389 PolarHBondContact OD1-OG 2.96Å
353	Q	94.6	Very high	95	Very high	33 Å²	33	23.7 Å²	23.7	15%	0.154	14%	0.135	C	C	.	.			trans	-82.5	62.4	-174	-63.7	175.5	10.5	0	0	112	V313 A348 T351 L355 I356 I357	V313-Q353 VanDerWaalsContact O-CD 3.28Å; V313-Q353 PolarHBondContact O-NE2 2.89Å; V313-Q353 PolarHBondContact O-OE1 3.02Å; A348-Q353 PolarHBondContact O-N 3.36Å; T351-Q353 VanDerWaalsContact C-N 3.26Å; T351-Q353 PolarHBondContact O-N 2.93Å; T351-Q353 WeakPolarHBondContact OG1-CG 3.5Å; T351-Q353 PolarHBondContact OG1-NE2 2.98Å; T351-Q353 VanDerWaalsContact OG1-NE2 3.15Å; Q353-L355 PolarHBondContact O-N 3.43Å; Q353-I356 HydrophobicContact CB-CB 4.07Å; Q353-I356 HydrophobicContact CB-CD1 4.22Å; Q353-I356 WeakPolarHBondContact O-CA 3.32Å; Q353-I356 PolarHBondContact O-N 3.05Å; Q353-I357 WeakPolarHBondContact O-CG1 3.4Å; Q353-I357 PolarHBondContact O-N 3.34Å
354	H	95.1	Very high	94.8	Very high	65 Å²	65	26.1 Å²	26.1	30%	0.301	16%	0.16	S	C	.	.	H	α-helix	trans	-46.1	-37.6	-174.8	65.7	-87	0	0	0	115.1	N352 I357 S358 L388 S392	N352-H354 PolarHBondContact O-N 3Å; H354-I357 PolarHBondContact O-N 2.91Å; H354-S358 PolarHBondContact O-N 3.26Å; H354-S358 VanDerWaalsContact O-N 3.1Å; H354-L388 HydrophobicContact CB-CB 4.5Å; H354-S392 PolarHBondContact O-OG 3.41Å
355	L	95.5	Very high	94.7	Very high	82 Å²	82	26.4 Å²	26.4	43%	0.429	16%	0.163	S	C	.	.	H	α-helix	trans	-66.6	-42.9	175.2	-61.7	177.9	0	0	0	113.5	Q353 I357 S358 D359	Q353-L355 PolarHBondContact O-N 3.43Å; L355-I357 VanDerWaalsContact C-N 3.34Å; L355-S358 WeakPolarHBondContact O-CB 3.35Å; L355-S358 PolarHBondContact O-N 2.94Å; L355-D359 PolarHBondContact O-N 3.27Å
356	I	96.5	Very high	94.5	Very high	7 Å²	7	31.7 Å²	31.7	4%	0.036	19%	0.187	C	C	.	.	H	α-helix	trans	-70.4	-33.8	178.4	-72.2	166.4	0	0	0	110.6	V313 R318 A348 Q353 D359 L360	V313-I356 HydrophobicContact CG1-CG2 4.16Å; V313-I356 HydrophobicContact CG2-CG2 3.86Å; R318-I356 HydrophobicContact CB-CD1 3.91Å; R318-I356 HydrophobicContact CB-CG1 3.78Å; R318-I356 HydrophobicContact CG-CD1 4.37Å; R318-I356 HydrophobicContact CG-CG1 3.66Å; A348-I356 HydrophobicContact CB-CG2 3.94Å; Q353-I356 HydrophobicContact CB-CB 4.07Å; Q353-I356 HydrophobicContact CB-CD1 4.22Å; Q353-I356 WeakPolarHBondContact O-CA 3.32Å; Q353-I356 PolarHBondContact O-N 3.05Å; I356-D359 PolarHBondContact O-N 2.93Å; I356-L360 HydrophobicContact CG2-CD1 3.86Å; I356-L360 HydrophobicContact CG2-CG 4.3Å; I356-L360 WeakPolarHBondContact O-CB 3.44Å; I356-L360 VanDerWaalsContact O-CG 3.28Å; I356-L360 WeakPolarHBondContact O-CG 3.11Å; I356-L360 PolarHBondContact O-N 3.22Å
357	I	96.7	Very high	94.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.1	-47.1	171.1	-64.2	168.9	0	0	0	110.3	L345 A348 V349 Q353 H354 L355 D359 L360 L361 S389 I393	L345-I357 HydrophobicContact CD1-CG2 4.05Å; A348-I357 HydrophobicContact CB-CG1 3.6Å; V349-I357 HydrophobicContact CB-CD1 4.28Å; V349-I357 HydrophobicContact CG2-CD1 3.5Å; V349-I357 HydrophobicContact CG2-CG1 4.05Å; Q353-I357 WeakPolarHBondContact O-CG1 3.4Å; Q353-I357 PolarHBondContact O-N 3.34Å; H354-I357 PolarHBondContact O-N 2.91Å; L355-I357 VanDerWaalsContact C-N 3.34Å; I357-D359 PolarHBondContact O-N 2.97Å; I357-L360 PolarHBondContact O-N 2.76Å; I357-L361 HydrophobicContact CG2-CD1 3.89Å; I357-L361 WeakPolarHBondContact O-CB 3.31Å; I357-L361 VanDerWaalsContact O-CG 3.28Å; I357-L361 WeakPolarHBondContact O-CG 3.37Å; I357-L361 PolarHBondContact O-N 2.93Å; I357-S389 WeakPolarHBondContact CD1-OG 3.41Å; I357-I393 HydrophobicContact CG2-CD1 4.37Å; I357-I393 HydrophobicContact CG2-CG1 3.61Å
358	S	95.2	Very high	94.4	Very high	30 Å²	30	33.6 Å²	33.6	21%	0.21	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-41.4	175.1	-174.8	0	0	0	0	112.5	H354 L355 S362 T396	H354-S358 PolarHBondContact O-N 3.26Å; H354-S358 VanDerWaalsContact O-N 3.1Å; L355-S358 WeakPolarHBondContact O-CB 3.35Å; L355-S358 PolarHBondContact O-N 2.94Å; S358-S362 VanDerWaalsContact O-CB 3.24Å; S358-S362 WeakPolarHBondContact O-CB 3.33Å; S358-S362 PolarHBondContact O-N 3.27Å; S358-S362 PolarHBondContact O-OG 3.02Å; S358-T396 WeakPolarHBondContact CB-OG1 3.45Å; S358-T396 PolarHBondContact OG-OG1 2.61Å
359	D	95.8	Very high	94.2	Very high	10 Å²	10	34.9 Å²	34.9	5%	0.053	20%	0.204	C	C	.	.	H	α-helix	trans	-63.3	-47.3	178.8	-63.5	-21	0	0	0	111.4	R318 Y322 L355 I356 I357 S362 H363	R318-D359 WeakPolarHBondContact CG-OD2 3.4Å; R318-D359 IonicContact CZ-OD1 2.92Å; R318-D359 IonicContact CZ-OD2 3.63Å; R318-D359 IonicContact NE-OD1 3.14Å; R318-D359 IonicContact NE-OD2 2.68Å; R318-D359 PolarHBondContact NE-OD2 3.32Å; R318-D359 IonicContact NH2-OD1 3.8Å; R318-D359 PolarHBondContact NH2-OD1 3.23Å; R318-D359 IonicContact NH2-OD2 2.72Å; R318-D359 PolarHBondContact NH2-OD2 3.17Å; Y322-D359 HydrophobicContact CD2-CB 3.89Å; L355-D359 PolarHBondContact O-N 3.27Å; I356-D359 PolarHBondContact O-N 2.93Å; I357-D359 PolarHBondContact O-N 2.97Å; D359-S362 WeakPolarHBondContact O-CB 3.47Å; D359-S362 PolarHBondContact O-N 2.74Å; D359-H363 PolarHBondContact O-CD2 3.29Å; D359-H363 PolarHBondContact O-N 3.16Å; D359-H363 VanDerWaalsContact O-N 3.13Å
360	L	96	Very high	94.1	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-61.9	-46.7	178.4	-72.7	168.1	0	0	0	112.3	L309 V313 A325 L334 L345 A348 I356 I357 S362 H363 G364 A365	L309-L360 HydrophobicContact CD1-CD2 4.3Å; L309-L360 HydrophobicContact CD2-CD2 4.03Å; V313-L360 HydrophobicContact CG2-CD1 4.3Å; A325-L360 HydrophobicContact CB-CD2 3.76Å; L334-L360 HydrophobicContact CD1-CD2 4.08Å; L345-L360 HydrophobicContact CB-CD1 4.36Å; L345-L360 HydrophobicContact CD1-CB 4.03Å; L345-L360 HydrophobicContact CD1-CD1 4.26Å; A348-L360 HydrophobicContact CB-CD1 4Å; I356-L360 HydrophobicContact CG2-CD1 3.86Å; I356-L360 HydrophobicContact CG2-CG 4.3Å; I356-L360 WeakPolarHBondContact O-CB 3.44Å; I356-L360 VanDerWaalsContact O-CG 3.28Å; I356-L360 WeakPolarHBondContact O-CG 3.11Å; I356-L360 PolarHBondContact O-N 3.22Å; I357-L360 PolarHBondContact O-N 2.76Å; L360-S362 VanDerWaalsContact C-N 3.3Å; L360-S362 PolarHBondContact O-N 3.34Å; L360-H363 CarbonylContact O-C 3.56Å; L360-H363 PolarHBondContact O-N 3.08Å; L360-G364 PolarHBondContact O-N 3.45Å; L360-A365 HydrophobicContact CB-CB 4.08Å; L360-A365 WeakPolarHBondContact O-CB 3.48Å; L360-A365 PolarHBondContact O-N 3.41Å; L360-A365 VanDerWaalsContact O-N 3.08Å
361	L	94.8	Very high	94.1	Very high	6 Å²	6	37.1 Å²	37.1	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-65.7	-33.6	175.9	-68.6	173.6	0	0	0	112.1	L345 I357 H363 G364 A365 I367 I393 T396 L397	L345-L361 HydrophobicContact CD1-CD2 4.14Å; L345-L361 HydrophobicContact CD1-CG 4.02Å; L345-L361 HydrophobicContact CD2-CD2 3.73Å; I357-L361 HydrophobicContact CG2-CD1 3.89Å; I357-L361 WeakPolarHBondContact O-CB 3.31Å; I357-L361 VanDerWaalsContact O-CG 3.28Å; I357-L361 WeakPolarHBondContact O-CG 3.37Å; I357-L361 PolarHBondContact O-N 2.93Å; L361-H363 PolarHBondContact O-N 2.76Å; L361-G364 PolarHBondContact O-N 2.78Å; L361-G364 VanDerWaalsContact O-N 3.09Å; L361-A365 WeakPolarHBondContact CD2-O 3.32Å; L361-I367 HydrophobicContact CD2-CB 4.09Å; L361-I367 HydrophobicContact CD2-CD1 4.28Å; L361-I393 HydrophobicContact CD1-CB 4.25Å; L361-I393 HydrophobicContact CD1-CG1 4.01Å; L361-I393 HydrophobicContact CD1-CG2 4.27Å; L361-T396 HydrophobicContact CB-CG2 3.8Å; L361-L397 HydrophobicContact CB-CD2 4.23Å; L361-L397 HydrophobicContact CD1-CD1 4.27Å; L361-L397 HydrophobicContact CD1-CG 4.2Å; L361-L397 HydrophobicContact CD2-CD1 4.25Å; L361-L397 HydrophobicContact CD2-CD2 4.32Å
362	S	93.2	Very high	94.1	Very high	47 Å²	47	39.3 Å²	39.3	33%	0.329	21%	0.213	S	C	.	.	H	α-helix	trans	-65.7	-28.4	175.1	-62.9	0	0	0	0	112.7	S358 D359 L360 R400	S358-S362 VanDerWaalsContact O-CB 3.24Å; S358-S362 WeakPolarHBondContact O-CB 3.33Å; S358-S362 PolarHBondContact O-N 3.27Å; S358-S362 PolarHBondContact O-OG 3.02Å; D359-S362 WeakPolarHBondContact O-CB 3.47Å; D359-S362 PolarHBondContact O-N 2.74Å; L360-S362 VanDerWaalsContact C-N 3.3Å; L360-S362 PolarHBondContact O-N 3.34Å; S362-R400 PolarHBondContact O-NH1 2.85Å
363	H	93.6	Very high	94	Very high	45 Å²	45	43.2 Å²	43.2	21%	0.208	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	4.2	172.7	-69.4	-55.5	0	0	0	114.5	Y322 A325 A329 L334 D359 L360 L361	Y322-H363 AromaticContact CD1-NE2 3.98Å; Y322-H363 AromaticContact CD2-NE2 3.74Å; Y322-H363 AromaticContact CE1-NE2 3.67Å; Y322-H363 AromaticContact CE2-NE2 3.41Å; Y322-H363 WeakPolarHBondContact CE2-NE2 3.42Å; Y322-H363 AromaticContact CG-NE2 3.99Å; Y322-H363 AromaticContact CZ-CE1 3.81Å; Y322-H363 AromaticContact CZ-NE2 3.34Å; Y322-H363 VanDerWaalsContact CZ-NE2 3.34Å; A325-H363 HydrophobicContact CB-CB 4.37Å; A329-H363 HydrophobicContact CB-CB 4.33Å; A329-H363 WeakPolarHBondContact CB-O 3.24Å; L334-H363 HydrophobicContact CD2-CB 4.16Å; L334-H363 WeakPolarHBondContact CD2-O 3.37Å; D359-H363 PolarHBondContact O-CD2 3.29Å; D359-H363 PolarHBondContact O-N 3.16Å; D359-H363 VanDerWaalsContact O-N 3.13Å; L360-H363 CarbonylContact O-C 3.56Å; L360-H363 PolarHBondContact O-N 3.08Å; L361-H363 PolarHBondContact O-N 2.76Å
364	G	91.5	Very high	93.9	Very high	52 Å²	52	41.6 Å²	41.6	54%	0.536	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.5	17.2	171	0	0	0	0	0	116.3	L360 L361	L360-G364 PolarHBondContact O-N 3.45Å; L361-G364 PolarHBondContact O-N 2.78Å; L361-G364 VanDerWaalsContact O-N 3.09Å
365	A	94.1	Very high	93.9	Very high	7 Å²	7	40.3 Å²	40.3	6%	0.058	21%	0.21	C	C	.	.			trans	-58.9	139.3	175.2	0	0	0	0	0	111.8	L334 L345 L360 L361 I367	L334-A365 HydrophobicContact CD2-CB 3.81Å; L334-A365 HydrophobicContact CG-CB 4.04Å; L345-A365 HydrophobicContact CB-CB 4.33Å; L345-A365 HydrophobicContact CD2-CB 4.07Å; L360-A365 HydrophobicContact CB-CB 4.08Å; L360-A365 WeakPolarHBondContact O-CB 3.48Å; L360-A365 PolarHBondContact O-N 3.41Å; L360-A365 VanDerWaalsContact O-N 3.08Å; L361-A365 WeakPolarHBondContact CD2-O 3.32Å; A365-I367 PolarHBondContact O-N 3.14Å
366	Q	92.9	Very high	93.9	Very high	114 Å²	114	36.5 Å²	36.5	53%	0.533	19%	0.19	S	C	.	.			trans	-81.5	109.5	-173.7	-74.5	174.5	75.9	0	0	112.3	D335 N368 I369	D335-Q366 PolarHBondContact OD1-N 3.27Å; D335-Q366 WeakPolarHBondContact OD2-CG 3.37Å; D335-Q366 PolarHBondContact OD2-NE2 2.76Å; Q366-N368 VanDerWaalsContact C-N 3.29Å; Q366-N368 PolarHBondContact O-N 2.84Å; Q366-I369 HydrophobicContact CB-CD1 3.64Å; Q366-I369 HydrophobicContact CB-CG1 3.81Å
367	I	92.9	Very high	93.8	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.021	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-24.8	-179	-170.5	63.1	0	0	0	114.2	L345 L361 A365 I369 P377 I393 L397 I404	L345-I367 HydrophobicContact CD2-CD1 4.14Å; L361-I367 HydrophobicContact CD2-CB 4.09Å; L361-I367 HydrophobicContact CD2-CD1 4.28Å; A365-I367 PolarHBondContact O-N 3.14Å; I367-I369 PolarHBondContact O-N 3.3Å; I367-P377 HydrophobicContact CD1-CB 4.2Å; I367-P377 HydrophobicContact CD1-CG 4.08Å; I367-P377 WeakPolarHBondContact O-CD 3.16Å; I367-P377 VanDerWaalsContact O-CG 3.29Å; I367-P377 WeakPolarHBondContact O-CG 3.43Å; I367-I393 HydrophobicContact CD1-CD1 4.01Å; I367-I393 HydrophobicContact CD1-CG1 4.05Å; I367-I393 HydrophobicContact CD1-CG2 3.62Å; I367-I393 HydrophobicContact CG1-CG2 3.92Å; I367-L397 HydrophobicContact CB-CD1 4.09Å; I367-L397 HydrophobicContact CG1-CD1 4.17Å; I367-L397 HydrophobicContact CG2-CD1 3.92Å; I367-I404 HydrophobicContact CG1-CG2 4.48Å; I367-I404 HydrophobicContact CG2-CG1 4.4Å
368	N	92.6	Very high	93.8	Very high	54 Å²	54	36.3 Å²	36.3	29%	0.289	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	7.4	-174.4	-64.6	-23.3	0	0	0	114.2	Q366 S403 D405 M408	Q366-N368 VanDerWaalsContact C-N 3.29Å; Q366-N368 PolarHBondContact O-N 2.84Å; N368-S403 PolarHBondContact ND2-O 3.46Å; N368-D405 PolarHBondContact OD1-N 2.72Å; N368-M408 HydrophobicContact CB-CE 3.98Å; N368-M408 WeakPolarHBondContact O-CE 3.48Å
369	I	93.3	Very high	93.9	Very high	27 Å²	27	34.9 Å²	34.9	14%	0.138	18%	0.179	C	C	.	.			trans	-72.6	136.8	-179.8	-66.8	179.4	0	0	0	111.2	D335 K337 T343 Q346 Q366 I367	D335-I369 HydrophobicContact CB-CD1 3.57Å; K337-I369 VanDerWaalsContact CE-CG2 3.44Å; T343-I369 HydrophobicContact CG2-CB 4.41Å; T343-I369 HydrophobicContact CG2-CD1 3.99Å; T343-I369 HydrophobicContact CG2-CG2 3.84Å; Q346-I369 PolarHBondContact NE2-O 3.45Å; Q366-I369 HydrophobicContact CB-CD1 3.64Å; Q366-I369 HydrophobicContact CB-CG1 3.81Å; I367-I369 PolarHBondContact O-N 3.3Å
370	R	93.7	Very high	93.9	Very high	82 Å²	82	34.6 Å²	34.6	31%	0.309	18%	0.177	S	C	.	.			trans	-101.7	139.4	-178.3	-60.5	172.1	79.7	-151.1	7.6	111.1	K337 G374 R375 M408 F409	K337-R370 PolarHBondContact NZ-O 2.89Å; R370-G374 PolarHBondContact NE-O 3.35Å; R370-G374 PolarHBondContact NH2-O 3.38Å; R370-R375 WeakPolarHBondContact CA-O 3.49Å; R370-M408 VanDerWaalsContact CD-SD 3.52Å; R370-M408 HydrophobicContact CG-SD 3.41Å; R370-M408 WeakPolarHBondContact CG-SD 3.47Å; R370-F409 PolarHBondContact NH2-O 2.82Å
371	D	92.6	Very high	93.9	Very high	5 Å²	5	34.5 Å²	34.5	3%	0.027	18%	0.177	C	C	.	.			trans	-79.3	-174.3	172.5	68.6	7.7	0	0	0	112.9	Q342 Q346 W373 G374 R375	Q342-D371 HydrophobicContact CG-CB 3.94Å; Q346-D371 VanDerWaalsContact NE2-N 3.13Å; D371-W373 HydrophobicContact CB-CE3 4.33Å; D371-W373 PolarHBondContact O-N 3.44Å; D371-W373 VanDerWaalsContact O-N 3.13Å; D371-W373 WeakPolarHBondContact OD1-CA 3.5Å; D371-W373 PolarHBondContact OD1-N 3Å; D371-G374 PolarHBondContact O-N 2.79Å; D371-G374 PolarHBondContact OD1-N 3.21Å; D371-R375 PolarHBondContact N-O 3.41Å; D371-R375 VanDerWaalsContact N-O 3.08Å; D371-R375 WeakPolarHBondContact OD1-CB 3.45Å; D371-R375 PolarHBondContact OD1-N 2.91Å; D371-R375 IonicContact OD1-NE 3.48Å; D371-R375 IonicContact OD2-CZ 2.72Å; D371-R375 VanDerWaalsContact OD2-CZ 3.24Å; D371-R375 IonicContact OD2-NE 3.23Å; D371-R375 PolarHBondContact OD2-NE 2.97Å; D371-R375 IonicContact OD2-NH2 3.46Å; D371-R375 PolarHBondContact OD2-NH2 3.11Å
372	L	92.6	Very high	94	Very high	107 Å²	107	34.2 Å²	34.2	56%	0.56	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-12.4	176.3	-78.9	-174.8	0	0	0	115.1	H339 N340 Y411	H339-L372 WeakPolarHBondContact O-CD1 3.32Å; N340-L372 WeakPolarHBondContact O-CB 3.37Å; N340-L372 WeakPolarHBondContact O-CG 3.28Å; N340-L372 PolarHBondContact O-N 2.93Å; L372-Y411 VanDerWaalsContact O-CE2 3.28Å; L372-Y411 WeakPolarHBondContact O-CE2 3.47Å
373	W	90.8	Very high	94.1	Very high	128 Å²	128	34.2 Å²	34.2	49%	0.485	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	8.3	173.6	-59	-88.8	0	0	0	112.1	N340 D371 R375 Y411	N340-W373 HydrophobicContact CB-CH2 4.19Å; N340-W373 HydrophobicContact CB-CZ3 4.13Å; D371-W373 HydrophobicContact CB-CE3 4.33Å; D371-W373 PolarHBondContact O-N 3.44Å; D371-W373 VanDerWaalsContact O-N 3.13Å; D371-W373 WeakPolarHBondContact OD1-CA 3.5Å; D371-W373 PolarHBondContact OD1-N 3Å; W373-R375 HydrophobicContact CB-CG 4.14Å; W373-R375 PolarHBondContact O-N 2.73Å; W373-Y411 WeakPolarHBondContact O-CD2 3.4Å; W373-Y411 PolarHBondContact O-N 3.34Å; W373-Y411 VanDerWaalsContact O-N 3.15Å
374	G	93.4	Very high	94	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.185	C	C	.	.			trans	74.5	9.4	-178	0	0	0	0	0	113.4	R370 D371 N410	R370-G374 PolarHBondContact NE-O 3.35Å; R370-G374 PolarHBondContact NH2-O 3.38Å; D371-G374 PolarHBondContact O-N 2.79Å; D371-G374 PolarHBondContact OD1-N 3.21Å; G374-N410 WeakPolarHBondContact O-CA 3.45Å
375	R	94.8	Very high	94.1	Very high	38 Å²	38	35.3 Å²	35.3	14%	0.143	16%	0.16	C	C	.	.			trans	-81.9	124	-175	-63.8	-178.5	-59.4	-162.6	-7.3	111.1	Q346 R370 D371 W373 H379 V380 E383 N410	Q346-R375 PolarHBondContact NE2-O 2.74Å; R370-R375 WeakPolarHBondContact CA-O 3.49Å; D371-R375 PolarHBondContact N-O 3.41Å; D371-R375 VanDerWaalsContact N-O 3.08Å; D371-R375 WeakPolarHBondContact OD1-CB 3.45Å; D371-R375 PolarHBondContact OD1-N 2.91Å; D371-R375 IonicContact OD1-NE 3.48Å; D371-R375 IonicContact OD2-CZ 2.72Å; D371-R375 VanDerWaalsContact OD2-CZ 3.24Å; D371-R375 IonicContact OD2-NE 3.23Å; D371-R375 PolarHBondContact OD2-NE 2.97Å; D371-R375 IonicContact OD2-NH2 3.46Å; D371-R375 PolarHBondContact OD2-NH2 3.11Å; W373-R375 HydrophobicContact CB-CG 4.14Å; W373-R375 PolarHBondContact O-N 2.73Å; R375-H379 HydrophobicContact CB-CB 3.83Å; R375-H379 HydrophobicContact CG-CB 4.07Å; R375-V380 HydrophobicContact CB-CG2 4.22Å; R375-E383 WeakPolarHBondContact CD-OE1 3.43Å; R375-E383 WeakPolarHBondContact CD-OE2 3.43Å; R375-E383 IonicContact CZ-OE2 3.7Å; R375-E383 IonicContact NE-OE2 3.24Å; R375-E383 IonicContact NH1-OE2 2.76Å; R375-E383 PolarHBondContact NH1-OE2 3.37Å; R375-N410 HydrophobicContact CG-CB 4.11Å
376	S	94.9	Very high	94.2	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.007	16%	0.162	C	C	.	.			trans	-68.1	163.7	160.1	73.6	0	0	0	0	110.7	L378 H379 V380	S376-L378 PolarHBondContact O-N 3.4Å; S376-L378 VanDerWaalsContact O-N 3.14Å; S376-H379 PolarHBondContact N-ND1 3.48Å; S376-H379 WeakPolarHBondContact O-CB 3.46Å; S376-H379 PolarHBondContact O-N 3.31Å; S376-H379 PolarHBondContact OG-ND1 3.28Å; S376-V380 PolarHBondContact O-N 3.48Å
377	P	95.1	Very high	94.3	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-60.2	-26.5	178.1	-17.1	30.4	0	0	0	112.7	Q346 V349 I367 H379 V380 C381	Q346-P377 HydrophobicContact CG-CB 4.42Å; Q346-P377 HydrophobicContact CG-CG 3.84Å; V349-P377 HydrophobicContact CB-CB 4.31Å; V349-P377 HydrophobicContact CG1-CB 4.19Å; V349-P377 WeakPolarHBondContact CG1-O 3.35Å; V349-P377 HydrophobicContact CG2-CB 3.9Å; I367-P377 HydrophobicContact CD1-CB 4.2Å; I367-P377 HydrophobicContact CD1-CG 4.08Å; I367-P377 WeakPolarHBondContact O-CD 3.16Å; I367-P377 VanDerWaalsContact O-CG 3.29Å; I367-P377 WeakPolarHBondContact O-CG 3.43Å; P377-H379 PolarHBondContact O-N 3.17Å; P377-V380 PolarHBondContact O-N 3.15Å; P377-C381 PolarHBondContact O-N 2.87Å; P377-C381 PolarHBondContact O-SG 3Å; P377-C381 VanDerWaalsContact O-SG 3.35Å
378	L	96.6	Very high	94.4	Very high	2 Å²	2	36 Å²	36	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-64.5	-37.6	174.3	-55.8	-175.4	0	0	0	112.3	S376 C381 A382 L390 I393 I404 V406 P416 L459 M462	S376-L378 PolarHBondContact O-N 3.4Å; S376-L378 VanDerWaalsContact O-N 3.14Å; L378-C381 PolarHBondContact O-N 3.16Å; L378-A382 VanDerWaalsContact O-CB 3.31Å; L378-A382 WeakPolarHBondContact O-CB 3.3Å; L378-A382 PolarHBondContact O-N 3.04Å; L378-L390 HydrophobicContact CB-CD2 4.43Å; L378-L390 HydrophobicContact CD2-CD2 3.63Å; L378-I393 HydrophobicContact CD2-CD1 4.06Å; L378-I393 HydrophobicContact CD2-CG2 4.32Å; L378-I404 HydrophobicContact CD1-CG2 3.74Å; L378-V406 HydrophobicContact CD1-CB 4.37Å; L378-V406 HydrophobicContact CD1-CG1 4.44Å; L378-V406 HydrophobicContact CD1-CG2 4.08Å; L378-P416 HydrophobicContact CB-CB 3.82Å; L378-P416 HydrophobicContact CB-CG 3.65Å; L378-P416 HydrophobicContact CD1-CG 4.43Å; L378-L459 HydrophobicContact CB-CD2 4.41Å; L378-M462 HydrophobicContact CD1-CE 4.29Å; L378-M462 HydrophobicContact CD2-CE 3.82Å
379	H	97	Very high	94.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.8	-45.6	174.1	-67	85	0	0	0	111	R375 S376 P377 C381 A382 E383 M408 N410 L414	R375-H379 HydrophobicContact CB-CB 3.83Å; R375-H379 HydrophobicContact CG-CB 4.07Å; S376-H379 PolarHBondContact N-ND1 3.48Å; S376-H379 WeakPolarHBondContact O-CB 3.46Å; S376-H379 PolarHBondContact O-N 3.31Å; S376-H379 PolarHBondContact OG-ND1 3.28Å; P377-H379 PolarHBondContact O-N 3.17Å; H379-C381 VanDerWaalsContact C-N 3.29Å; H379-C381 PolarHBondContact O-N 2.94Å; H379-A382 WeakPolarHBondContact O-CB 3.47Å; H379-A382 PolarHBondContact O-N 3.09Å; H379-A382 VanDerWaalsContact O-N 3.08Å; H379-E383 WeakPolarHBondContact O-CB 3.3Å; H379-E383 WeakPolarHBondContact O-CG 3.35Å; H379-E383 PolarHBondContact O-N 3.05Å; H379-M408 PolarHBondContact CE1-O 3.32Å; H379-M408 PolarHBondContact NE2-O 3.08Å; H379-N410 PolarHBondContact NE2-N 3.44Å; H379-L414 PolarHBondContact NE2-O 2.95Å
380	V	95.1	Very high	94.6	Very high	4 Å²	4	32.1 Å²	32.1	2%	0.024	14%	0.141	C	C	.	.	H	α-helix	trans	-63.2	-38.4	178.9	-177.9	0	0	0	0	110.7	V349 A350 R375 S376 P377 K384	V349-V380 HydrophobicContact CG1-CB 3.7Å; V349-V380 HydrophobicContact CG1-CG1 3.76Å; A350-V380 HydrophobicContact CB-CG1 4.12Å; R375-V380 HydrophobicContact CB-CG2 4.22Å; S376-V380 PolarHBondContact O-N 3.48Å; P377-V380 PolarHBondContact O-N 3.15Å; V380-K384 HydrophobicContact CG1-CG 4.46Å; V380-K384 WeakPolarHBondContact O-CB 3.49Å; V380-K384 VanDerWaalsContact O-CG 3.28Å; V380-K384 WeakPolarHBondContact O-CG 3.42Å; V380-K384 PolarHBondContact O-N 3.42Å
381	C	96.3	Very high	94.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.8	-40	171.9	-70.3	0	0	0	0	113.3	V349 P377 L378 H379 G385 H386 L390	V349-C381 VanDerWaalsContact CG1-SG 3.53Å; P377-C381 PolarHBondContact O-N 2.87Å; P377-C381 PolarHBondContact O-SG 3Å; P377-C381 VanDerWaalsContact O-SG 3.35Å; L378-C381 PolarHBondContact O-N 3.16Å; H379-C381 VanDerWaalsContact C-N 3.29Å; H379-C381 PolarHBondContact O-N 2.94Å; C381-G385 PolarHBondContact O-N 3.35Å; C381-H386 HydrophobicContact CB-CB 4.29Å; C381-H386 PolarHBondContact O-N 3.2Å; C381-L390 HydrophobicContact CB-CD1 4.18Å; C381-L390 HydrophobicContact CB-CD2 3.51Å; C381-L390 HydrophobicContact CB-CG 3.57Å
382	A	96.8	Very high	94.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-66.5	-50.1	179.1	0	0	0	0	0	111.9	L378 H379 K384 G385 P416 A419 A420 F452 L459	L378-A382 VanDerWaalsContact O-CB 3.31Å; L378-A382 WeakPolarHBondContact O-CB 3.3Å; L378-A382 PolarHBondContact O-N 3.04Å; H379-A382 WeakPolarHBondContact O-CB 3.47Å; H379-A382 PolarHBondContact O-N 3.09Å; H379-A382 VanDerWaalsContact O-N 3.08Å; A382-K384 VanDerWaalsContact C-N 3.31Å; A382-K384 PolarHBondContact O-N 3.07Å; A382-G385 PolarHBondContact O-N 3.2Å; A382-P416 WeakPolarHBondContact CB-O 3.37Å; A382-A419 HydrophobicContact CB-CB 4.06Å; A382-A420 HydrophobicContact CB-CB 3.88Å; A382-F452 VanDerWaalsContact O-CE1 3.31Å; A382-F452 WeakPolarHBondContact O-CE1 3.46Å; A382-L459 HydrophobicContact CB-CD1 4.14Å
383	E	95.3	Very high	94.8	Very high	48 Å²	48	26.5 Å²	26.5	22%	0.224	12%	0.116	C	C	.	.	H	α-helix	trans	-57.8	-40.6	178.4	-74.3	168	-157.8	0	0	112.2	R375 H379 A419 S423 F452	R375-E383 WeakPolarHBondContact CD-OE1 3.43Å; R375-E383 WeakPolarHBondContact CD-OE2 3.43Å; R375-E383 IonicContact CZ-OE2 3.7Å; R375-E383 IonicContact NE-OE2 3.24Å; R375-E383 IonicContact NH1-OE2 2.76Å; R375-E383 PolarHBondContact NH1-OE2 3.37Å; H379-E383 WeakPolarHBondContact O-CB 3.3Å; H379-E383 WeakPolarHBondContact O-CG 3.35Å; H379-E383 PolarHBondContact O-N 3.05Å; E383-A419 HydrophobicContact CG-CB 4.15Å; E383-S423 PolarHBondContact O-OG 2.91Å; E383-F452 WeakPolarHBondContact O-CE1 3.2Å
384	K	92.2	Very high	94.8	Very high	118 Å²	118	22.1 Å²	22.1	51%	0.513	11%	0.105	S	C	.	.	H	α-helix	trans	-95.7	-7	-174.8	-58.5	-65.6	-173.8	179.1	0	115.2	V380 A382 H386 R451	V380-K384 HydrophobicContact CG1-CG 4.46Å; V380-K384 WeakPolarHBondContact O-CB 3.49Å; V380-K384 VanDerWaalsContact O-CG 3.28Å; V380-K384 WeakPolarHBondContact O-CG 3.42Å; V380-K384 PolarHBondContact O-N 3.42Å; A382-K384 VanDerWaalsContact C-N 3.31Å; A382-K384 PolarHBondContact O-N 3.07Å; K384-H386 WeakPolarHBondContact CB-NE2 3.27Å; K384-H386 PolarHBondContact O-CD2 3.42Å; K384-R451 PolarHBondContact O-NH2 3.27Å
385	G	94.1	Very high	94.7	Very high	1 Å²	1	29 Å²	29	1%	0.01	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	41.4	-178.8	0	0	0	0	0	112.5	C381 A382 Y387 R451 F452	C381-G385 PolarHBondContact O-N 3.35Å; A382-G385 PolarHBondContact O-N 3.2Å; G385-Y387 PolarHBondContact O-N 3.41Å; G385-R451 PolarHBondContact O-NE 2.94Å; G385-R451 PolarHBondContact O-NH2 3.09Å; G385-F452 VanDerWaalsContact CA-CE1 3.44Å
386	H	95.5	Very high	94.4	Very high	20 Å²	20	28.1 Å²	28.1	9%	0.093	13%	0.133	C	C	.	.			trans	-94.7	56.7	-178.1	-66.1	178.3	0	0	0	111.3	V349 A350 N352 C381 K384 L388 S389 L390	V349-H386 PolarHBondContact O-ND1 3.33Å; A350-H386 PolarHBondContact O-CE1 3.1Å; N352-H386 WeakPolarHBondContact OD1-CB 3.46Å; C381-H386 HydrophobicContact CB-CB 4.29Å; C381-H386 PolarHBondContact O-N 3.2Å; K384-H386 WeakPolarHBondContact CB-NE2 3.27Å; K384-H386 PolarHBondContact O-CD2 3.42Å; H386-L388 VanDerWaalsContact C-N 3.27Å; H386-L388 PolarHBondContact O-N 3.27Å; H386-S389 WeakPolarHBondContact O-CA 3.44Å; H386-S389 WeakPolarHBondContact O-CB 3.07Å; H386-S389 PolarHBondContact O-N 3.14Å; H386-L390 PolarHBondContact O-N 2.73Å
387	Y	94.9	Very high	94	Very high	69 Å²	69	28.7 Å²	28.7	27%	0.271	14%	0.136	S	C	.	.	H	α-helix	trans	-60.3	-33	-173.9	78.9	-83.2	0	0	0	113.5	G385 S389 L390 Q391 R451 E454 C455	G385-Y387 PolarHBondContact O-N 3.41Å; Y387-S389 VanDerWaalsContact C-N 3.29Å; Y387-S389 PolarHBondContact O-N 3.05Å; Y387-L390 WeakPolarHBondContact O-CB 3.16Å; Y387-L390 PolarHBondContact O-N 2.85Å; Y387-Q391 WeakPolarHBondContact O-CG 3.44Å; Y387-Q391 PolarHBondContact O-N 2.87Å; Y387-R451 HydrophobicContact CD1-CB 4.37Å; Y387-R451 HydrophobicContact CD1-CG 4.17Å; Y387-R451 HydrophobicContact CE1-CG 4.07Å; Y387-E454 HydrophobicContact CD1-CB 4.27Å; Y387-E454 HydrophobicContact CD2-CB 3.72Å; Y387-E454 HydrophobicContact CD2-CG 4.32Å; Y387-E454 HydrophobicContact CE2-CB 4.38Å; Y387-E454 HydrophobicContact CG-CB 3.66Å; Y387-E454 HydrophobicContact CG-CG 4.45Å; Y387-C455 PolarHBondContact N-SG 3.11Å; Y387-C455 VanDerWaalsContact N-SG 3.42Å
388	L	94.5	Very high	93.3	Very high	51 Å²	51	32.1 Å²	32.1	27%	0.267	17%	0.165	S	C	.	.	H	α-helix	trans	-62.9	-35.2	173.5	-66	176.8	0	0	0	112.3	H354 H386 Q391 S392	H354-L388 HydrophobicContact CB-CB 4.5Å; H386-L388 VanDerWaalsContact C-N 3.27Å; H386-L388 PolarHBondContact O-N 3.27Å; L388-Q391 PolarHBondContact O-N 3.28Å; L388-S392 WeakPolarHBondContact O-CB 3.44Å; L388-S392 PolarHBondContact O-N 2.99Å
389	S	95.2	Very high	91.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-68.9	-42.4	175	-65	0	0	0	0	111.2	N352 I357 H386 Y387 S392 I393	N352-S389 PolarHBondContact OD1-OG 2.96Å; I357-S389 WeakPolarHBondContact CD1-OG 3.41Å; H386-S389 WeakPolarHBondContact O-CA 3.44Å; H386-S389 WeakPolarHBondContact O-CB 3.07Å; H386-S389 PolarHBondContact O-N 3.14Å; Y387-S389 VanDerWaalsContact C-N 3.29Å; Y387-S389 PolarHBondContact O-N 3.05Å; S389-S392 WeakPolarHBondContact O-CB 3.44Å; S389-S392 PolarHBondContact O-N 3.03Å; S389-I393 WeakPolarHBondContact O-CD1 3.41Å; S389-I393 VanDerWaalsContact O-CG1 3.27Å; S389-I393 WeakPolarHBondContact O-CG1 3.39Å; S389-I393 PolarHBondContact O-N 3.36Å
390	L	95.4	Very high	90.3	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.1	-46.8	171.3	-67.8	171.8	0	0	0	112.3	L378 C381 H386 Y387 S392 I393 C394 C455 T458 L459	L378-L390 HydrophobicContact CB-CD2 4.43Å; L378-L390 HydrophobicContact CD2-CD2 3.63Å; C381-L390 HydrophobicContact CB-CD1 4.18Å; C381-L390 HydrophobicContact CB-CD2 3.51Å; C381-L390 HydrophobicContact CB-CG 3.57Å; H386-L390 PolarHBondContact O-N 2.73Å; Y387-L390 WeakPolarHBondContact O-CB 3.16Å; Y387-L390 PolarHBondContact O-N 2.85Å; L390-S392 VanDerWaalsContact C-N 3.26Å; L390-S392 PolarHBondContact O-N 3.12Å; L390-I393 PolarHBondContact O-N 3.48Å; L390-C394 WeakPolarHBondContact O-CB 3.45Å; L390-C394 PolarHBondContact O-N 3.45Å; L390-C455 HydrophobicContact CD1-CB 3.99Å; L390-T458 HydrophobicContact CB-CG2 3.63Å; L390-L459 HydrophobicContact CD1-CD1 4.48Å; L390-L459 HydrophobicContact CD1-CD2 4.14Å; L390-L459 HydrophobicContact CD1-CG 3.94Å; L390-L459 HydrophobicContact CD2-CD2 3.86Å
391	Q	94.6	Very high	88.2	Confident	61 Å²	61	46.6 Å²	46.6	29%	0.285	27%	0.272	S	S	.	.	H	α-helix	trans	-62.3	-35.4	177	-73.1	-171.2	13.1	0	0	111.9	Y387 L388 K395 T458	Y387-Q391 WeakPolarHBondContact O-CG 3.44Å; Y387-Q391 PolarHBondContact O-N 2.87Å; L388-Q391 PolarHBondContact O-N 3.28Å; Q391-K395 VanDerWaalsContact O-CB 3.3Å; Q391-K395 WeakPolarHBondContact O-CB 3.35Å; Q391-K395 WeakPolarHBondContact O-CD 3.48Å; Q391-K395 WeakPolarHBondContact O-CG 3.4Å; Q391-K395 PolarHBondContact O-N 3.27Å; Q391-T458 HydrophobicContact CG-CG2 3.89Å
392	S	93.8	Very high	86.6	Confident	15 Å²	15	49.9 Å²	49.9	11%	0.105	29%	0.294	C	S	.	.	H	α-helix	trans	-66.3	-47.9	174.8	-161.6	0	0	0	0	111.7	H354 L388 S389 L390 C394 K395 T396	H354-S392 PolarHBondContact O-OG 3.41Å; L388-S392 WeakPolarHBondContact O-CB 3.44Å; L388-S392 PolarHBondContact O-N 2.99Å; S389-S392 WeakPolarHBondContact O-CB 3.44Å; S389-S392 PolarHBondContact O-N 3.03Å; L390-S392 VanDerWaalsContact C-N 3.26Å; L390-S392 PolarHBondContact O-N 3.12Å; S392-C394 VanDerWaalsContact C-N 3.32Å; S392-C394 PolarHBondContact O-N 2.92Å; S392-K395 PolarHBondContact O-N 3.29Å; S392-T396 WeakPolarHBondContact O-CB 3.5Å; S392-T396 PolarHBondContact O-N 3.26Å; S392-T396 PolarHBondContact O-OG1 3.37Å
393	I	93.8	Very high	85.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-54.8	-50	175.1	-64.5	159.1	0	0	0	110.2	V349 I357 L361 I367 L378 S389 L390 K395 T396 L397 I404 M462	V349-I393 HydrophobicContact CG2-CD1 4.22Å; I357-I393 HydrophobicContact CG2-CD1 4.37Å; I357-I393 HydrophobicContact CG2-CG1 3.61Å; L361-I393 HydrophobicContact CD1-CB 4.25Å; L361-I393 HydrophobicContact CD1-CG1 4.01Å; L361-I393 HydrophobicContact CD1-CG2 4.27Å; I367-I393 HydrophobicContact CD1-CD1 4.01Å; I367-I393 HydrophobicContact CD1-CG1 4.05Å; I367-I393 HydrophobicContact CD1-CG2 3.62Å; I367-I393 HydrophobicContact CG1-CG2 3.92Å; L378-I393 HydrophobicContact CD2-CD1 4.06Å; L378-I393 HydrophobicContact CD2-CG2 4.32Å; S389-I393 WeakPolarHBondContact O-CD1 3.41Å; S389-I393 VanDerWaalsContact O-CG1 3.27Å; S389-I393 WeakPolarHBondContact O-CG1 3.39Å; S389-I393 PolarHBondContact O-N 3.36Å; L390-I393 PolarHBondContact O-N 3.48Å; I393-K395 PolarHBondContact O-N 3.01Å; I393-T396 PolarHBondContact O-N 3.23Å; I393-L397 HydrophobicContact CG2-CD1 3.98Å; I393-L397 WeakPolarHBondContact O-CB 3.46Å; I393-L397 WeakPolarHBondContact O-CG 3.15Å; I393-L397 PolarHBondContact O-N 3.36Å; I393-L397 VanDerWaalsContact O-N 3.11Å; I393-I404 HydrophobicContact CG2-CD1 4.17Å; I393-M462 HydrophobicContact CG2-CE 4.25Å
394	C	91.5	Very high	85.4	Confident	36 Å²	36	54.6 Å²	54.6	24%	0.243	33%	0.327	C	S	.	.	H	α-helix	trans	-60.9	-42.1	179.2	-171.5	0	0	0	0	112.8	L390 S392 A398 M462	L390-C394 WeakPolarHBondContact O-CB 3.45Å; L390-C394 PolarHBondContact O-N 3.45Å; S392-C394 VanDerWaalsContact C-N 3.32Å; S392-C394 PolarHBondContact O-N 2.92Å; C394-A398 WeakPolarHBondContact O-CB 3.35Å; C394-A398 PolarHBondContact O-N 3.4Å; C394-A398 VanDerWaalsContact O-N 3.14Å; C394-M462 HydrophobicContact CB-CE 4.46Å; C394-M462 HydrophobicContact CB-CG 3.98Å; C394-M462 HydrophobicContact CB-SD 4.08Å
395	K	91.3	Very high	85.4	Confident	145 Å²	145	52 Å²	52	63%	0.63	32%	0.319	S	S	*	.	H	α-helix	trans	-71.1	-41.5	-179.8	-75	164.8	-175.5	166.8	0	112.6	Q391 S392 I393	Q391-K395 VanDerWaalsContact O-CB 3.3Å; Q391-K395 WeakPolarHBondContact O-CB 3.35Å; Q391-K395 WeakPolarHBondContact O-CD 3.48Å; Q391-K395 WeakPolarHBondContact O-CG 3.4Å; Q391-K395 PolarHBondContact O-N 3.27Å; S392-K395 PolarHBondContact O-N 3.29Å; I393-K395 PolarHBondContact O-N 3.01Å
396	T	89.4	Confident	85.4	Confident	18 Å²	18	52.6 Å²	52.6	11%	0.11	32%	0.323	C	S	.	.	H	α-helix	trans	-75.3	-27.6	-176.6	-53.4	0	0	0	0	112.6	S358 L361 S392 I393 R400	S358-T396 WeakPolarHBondContact CB-OG1 3.45Å; S358-T396 PolarHBondContact OG-OG1 2.61Å; L361-T396 HydrophobicContact CB-CG2 3.8Å; S392-T396 WeakPolarHBondContact O-CB 3.5Å; S392-T396 PolarHBondContact O-N 3.26Å; S392-T396 PolarHBondContact O-OG1 3.37Å; I393-T396 PolarHBondContact O-N 3.23Å; T396-R400 WeakPolarHBondContact O-CD 3.43Å
397	L	86.4	Confident	85.4	Confident	13 Å²	13	54 Å²	54	7%	0.068	33%	0.329	C	S	.	.	H	α-helix	trans	-96.5	-9.7	179.3	-60.5	-177.3	0	0	0	114	L361 I367 I393 G399 R400 P402 I404	L361-L397 HydrophobicContact CB-CD2 4.23Å; L361-L397 HydrophobicContact CD1-CD1 4.27Å; L361-L397 HydrophobicContact CD1-CG 4.2Å; L361-L397 HydrophobicContact CD2-CD1 4.25Å; L361-L397 HydrophobicContact CD2-CD2 4.32Å; I367-L397 HydrophobicContact CB-CD1 4.09Å; I367-L397 HydrophobicContact CG1-CD1 4.17Å; I367-L397 HydrophobicContact CG2-CD1 3.92Å; I393-L397 HydrophobicContact CG2-CD1 3.98Å; I393-L397 WeakPolarHBondContact O-CB 3.46Å; I393-L397 WeakPolarHBondContact O-CG 3.15Å; I393-L397 PolarHBondContact O-N 3.36Å; I393-L397 VanDerWaalsContact O-N 3.11Å; L397-G399 PolarHBondContact O-N 2.86Å; L397-G399 VanDerWaalsContact O-N 3.08Å; L397-R400 PolarHBondContact O-N 3.48Å; L397-P402 HydrophobicContact CD2-CG 3.98Å; L397-I404 HydrophobicContact CB-CD1 4.06Å; L397-I404 HydrophobicContact CB-CG1 4.41Å; L397-I404 HydrophobicContact CD1-CD1 3.78Å; L397-I404 HydrophobicContact CD1-CG1 3.67Å
398	A	80.6	Confident	85.4	Confident	74 Å²	74	51.9 Å²	51.9	61%	0.612	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	114.7	172.1	0	0	0	0	0	110.9	C394	C394-A398 WeakPolarHBondContact O-CB 3.35Å; C394-A398 PolarHBondContact O-N 3.4Å; C394-A398 VanDerWaalsContact O-N 3.14Å
399	G	66.6	Low	85.5	Confident	91 Å²	91	52.2 Å²	52.2	94%	0.938	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	13.1	-178	0	0	0	0	0	115.5	L397	L397-G399 PolarHBondContact O-N 2.86Å; L397-G399 VanDerWaalsContact O-N 3.08Å
400	R	62.9	Low	85.6	Confident	138 Å²	138	52.7 Å²	52.7	52%	0.521	32%	0.324	S	S	.	.	S	Bend	trans	-105.8	156	170.9	-66.3	-165.5	173.2	-147.8	-2.5	111.7	S362 T396 L397 P402	S362-R400 PolarHBondContact O-NH1 2.85Å; T396-R400 WeakPolarHBondContact O-CD 3.43Å; L397-R400 PolarHBondContact O-N 3.48Å; R400-P402 VanDerWaalsContact C-CD 3.42Å
401	G	52.2	Low	85.6	Confident	80 Å²	80	59.7 Å²	59.7	83%	0.825	35%	0.352	S	S	*	.	S	Bend	trans	-65.9	-28	-172.3	0	0	0	0	0	119.5	S403	G401-S403 PolarHBondContact O-N 3.16Å
402	P	62.4	Low	85.5	Confident	70 Å²	70	60.9 Å²	60.9	46%	0.455	36%	0.36	S	S	.	.	S	Bend	trans	-76.2	112.1	-178.9	29.8	-32.6	0	0	0	110.5	L397 R400 I404	L397-P402 HydrophobicContact CD2-CG 3.98Å; R400-P402 VanDerWaalsContact C-CD 3.42Å; P402-I404 PolarHBondContact O-N 2.73Å
403	S	79.1	Confident	85.7	Confident	98 Å²	98	60.3 Å²	60.3	69%	0.685	36%	0.357	S	S	*	.			trans	-63.6	127.3	175.1	46	0	0	0	0	111	N368 G401	N368-S403 PolarHBondContact ND2-O 3.46Å; G401-S403 PolarHBondContact O-N 3.16Å
404	I	87.8	Confident	85.8	Confident	48 Å²	48	61.6 Å²	61.6	25%	0.246	36%	0.363	C	S	.	.			trans	-79	123.7	173	-49.4	175.9	0	0	0	108.1	I367 L378 I393 L397 P402 V406 M462	I367-I404 HydrophobicContact CG1-CG2 4.48Å; I367-I404 HydrophobicContact CG2-CG1 4.4Å; L378-I404 HydrophobicContact CD1-CG2 3.74Å; I393-I404 HydrophobicContact CG2-CD1 4.17Å; L397-I404 HydrophobicContact CB-CD1 4.06Å; L397-I404 HydrophobicContact CB-CG1 4.41Å; L397-I404 HydrophobicContact CD1-CD1 3.78Å; L397-I404 HydrophobicContact CD1-CG1 3.67Å; P402-I404 PolarHBondContact O-N 2.73Å; I404-V406 HydrophobicContact CB-CG2 4.21Å; I404-V406 HydrophobicContact CG2-CG2 3.75Å; I404-V406 PolarHBondContact O-N 3.15Å; I404-M462 HydrophobicContact CD1-CE 3.76Å; I404-M462 HydrophobicContact CG2-CE 4.17Å
405	D	92.1	Very high	86.1	Confident	63 Å²	63	59.9 Å²	59.9	34%	0.337	35%	0.352	S	S	.	.			trans	-86	102.7	166.8	-177.8	4.7	0	0	0	109.7	N368 E407 M408	N368-D405 PolarHBondContact OD1-N 2.72Å; D405-E407 PolarHBondContact OD1-N 3.23Å; D405-E407 VanDerWaalsContact OD1-N 3.08Å; D405-M408 HydrophobicContact CB-CB 4.39Å; D405-M408 HydrophobicContact CB-CE 3.92Å; D405-M408 PolarHBondContact OD1-N 2.94Å; D405-M408 WeakPolarHBondContact OD2-CB 3.31Å; D405-M408 WeakPolarHBondContact OD2-CE 3.41Å
406	V	94.3	Very high	86.4	Confident	14 Å²	14	53 Å²	53	9%	0.085	32%	0.322	C	S	.	.	S	Bend	trans	-89.2	-19.2	-178.5	-174.9	0	0	0	0	111.9	L378 I404 P416 M462 A464	L378-V406 HydrophobicContact CD1-CB 4.37Å; L378-V406 HydrophobicContact CD1-CG1 4.44Å; L378-V406 HydrophobicContact CD1-CG2 4.08Å; I404-V406 HydrophobicContact CB-CG2 4.21Å; I404-V406 HydrophobicContact CG2-CG2 3.75Å; I404-V406 PolarHBondContact O-N 3.15Å; V406-P416 VanDerWaalsContact O-CD 3.31Å; V406-P416 WeakPolarHBondContact O-CD 3.44Å; V406-M462 HydrophobicContact CG1-CB 4.45Å; V406-M462 HydrophobicContact CG2-CB 4.19Å; V406-A464 HydrophobicContact CG1-CB 3.6Å
407	E	95.3	Very high	86.8	Confident	50 Å²	50	52.1 Å²	52.1	23%	0.234	32%	0.317	C	S	.	.	S	Bend	trans	-100.4	0.7	-178.8	-67.9	-64	116.3	0	0	113.1	D405 F409 T415 A464 S465 T468	D405-E407 PolarHBondContact OD1-N 3.23Å; D405-E407 VanDerWaalsContact OD1-N 3.08Å; E407-F409 PolarHBondContact O-N 3.37Å; E407-T415 WeakPolarHBondContact O-CG2 3.33Å; E407-A464 WeakPolarHBondContact OE1-CA 3.11Å; E407-S465 PolarHBondContact OE1-N 3.45Å; E407-T468 WeakPolarHBondContact OE2-CB 3.39Å; E407-T468 WeakPolarHBondContact OE2-CG2 3.49Å; E407-T468 PolarHBondContact OE2-OG1 2.95Å
408	M	95.3	Very high	87.4	Confident	25 Å²	25	51.5 Å²	51.5	12%	0.123	31%	0.313	C	S	.	.			trans	-46.1	135.6	173.8	-168.5	174.3	-65.5	0	0	112.3	N368 R370 H379 D405 T415 P416	N368-M408 HydrophobicContact CB-CE 3.98Å; N368-M408 WeakPolarHBondContact O-CE 3.48Å; R370-M408 VanDerWaalsContact CD-SD 3.52Å; R370-M408 HydrophobicContact CG-SD 3.41Å; R370-M408 WeakPolarHBondContact CG-SD 3.47Å; H379-M408 PolarHBondContact CE1-O 3.32Å; H379-M408 PolarHBondContact NE2-O 3.08Å; D405-M408 HydrophobicContact CB-CB 4.39Å; D405-M408 HydrophobicContact CB-CE 3.92Å; D405-M408 PolarHBondContact OD1-N 2.94Å; D405-M408 WeakPolarHBondContact OD2-CB 3.31Å; D405-M408 WeakPolarHBondContact OD2-CE 3.41Å; M408-T415 WeakPolarHBondContact O-CA 3.09Å; M408-P416 WeakPolarHBondContact O-CD 3.44Å
409	F	96.6	Very high	88.2	Confident	57 Å²	57	48.2 Å²	48.2	25%	0.25	29%	0.286	C	S	.	.			trans	-92.1	142.8	173.8	-65	-80.8	0	0	0	112.6	R370 E407 G413 L414 T415 T468 K469 L471	R370-F409 PolarHBondContact NH2-O 2.82Å; E407-F409 PolarHBondContact O-N 3.37Å; F409-G413 VanDerWaalsContact CD1-O 3.28Å; F409-G413 WeakPolarHBondContact CD1-O 3.29Å; F409-L414 CarbonylContact C-O 3.5Å; F409-L414 VanDerWaalsContact CA-O 3.29Å; F409-L414 WeakPolarHBondContact CA-O 3.44Å; F409-T415 HydrophobicContact CD1-CG2 3.66Å; F409-T415 HydrophobicContact CE1-CG2 3.41Å; F409-T415 VanDerWaalsContact CE1-CG2 3.41Å; F409-T415 HydrophobicContact CG-CG2 4.39Å; F409-T415 HydrophobicContact CZ-CG2 3.93Å; F409-T468 HydrophobicContact CE1-CG2 4.36Å; F409-T468 HydrophobicContact CZ-CG2 3.91Å; F409-K469 WeakPolarHBondContact CE1-O 3.39Å; F409-L471 HydrophobicContact CB-CD1 4.05Å; F409-L471 HydrophobicContact CD1-CD1 4.06Å; F409-L471 HydrophobicContact CD1-CD2 4.26Å; F409-L471 HydrophobicContact CD1-CG 3.79Å; F409-L471 HydrophobicContact CD2-CD1 4.07Å; F409-L471 HydrophobicContact CD2-CD2 4.35Å; F409-L471 HydrophobicContact CD2-CG 4.37Å; F409-L471 HydrophobicContact CE1-CD2 3.9Å; F409-L471 HydrophobicContact CE1-CG 3.88Å; F409-L471 HydrophobicContact CE2-CD2 4.02Å; F409-L471 HydrophobicContact CE2-CG 4.47Å; F409-L471 HydrophobicContact CG-CD1 3.79Å; F409-L471 HydrophobicContact CG-CD2 4.46Å; F409-L471 HydrophobicContact CG-CG 4.04Å; F409-L471 HydrophobicContact CZ-CD2 3.77Å; F409-L471 HydrophobicContact CZ-CG 4.23Å
410	N	95.8	Very high	89.7	Confident	10 Å²	10	43.9 Å²	43.9	5%	0.053	24%	0.242	C	C	.	.			trans	-81.1	-179.5	163.4	71.5	2.4	0	0	0	111.8	G374 R375 H379 D412 G413 L414	G374-N410 WeakPolarHBondContact O-CA 3.45Å; R375-N410 HydrophobicContact CG-CB 4.11Å; H379-N410 PolarHBondContact NE2-N 3.44Å; N410-D412 PolarHBondContact O-N 3.35Å; N410-D412 WeakPolarHBondContact OD1-CA 3.2Å; N410-D412 WeakPolarHBondContact OD1-CB 3.33Å; N410-D412 PolarHBondContact OD1-N 3.2Å; N410-G413 PolarHBondContact O-N 2.91Å; N410-G413 PolarHBondContact OD1-N 3.28Å; N410-G413 VanDerWaalsContact OD1-N 3.14Å; N410-L414 PolarHBondContact N-O 3.36Å; N410-L414 WeakPolarHBondContact OD1-CB 3.44Å; N410-L414 PolarHBondContact OD1-N 3.11Å; N410-L414 PolarHBondContact OD1-O 2.73Å
411	Y	95.2	Very high	91.4	Very high	148 Å²	148	37.3 Å²	37.3	58%	0.58	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-10.3	176.1	-63.3	-32.6	0	0	0	114.2	L372 W373 G413	L372-Y411 VanDerWaalsContact O-CE2 3.28Å; L372-Y411 WeakPolarHBondContact O-CE2 3.47Å; W373-Y411 WeakPolarHBondContact O-CD2 3.4Å; W373-Y411 PolarHBondContact O-N 3.34Å; W373-Y411 VanDerWaalsContact O-N 3.15Å; Y411-G413 VanDerWaalsContact C-N 3.26Å
412	D	93.9	Very high	93.5	Very high	85 Å²	85	36 Å²	36	46%	0.455	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-3.1	166.3	-79.8	-59	0	0	0	113.8	N410 L414 K472	N410-D412 PolarHBondContact O-N 3.35Å; N410-D412 WeakPolarHBondContact OD1-CA 3.2Å; N410-D412 WeakPolarHBondContact OD1-CB 3.33Å; N410-D412 PolarHBondContact OD1-N 3.2Å; D412-L414 HydrophobicContact CB-CD1 3.91Å; D412-L414 HydrophobicContact CB-CG 3.98Å; D412-L414 PolarHBondContact O-N 3.42Å; D412-K472 WeakPolarHBondContact O-CD 3.47Å; D412-K472 WeakPolarHBondContact O-CE 3.16Å; D412-K472 WeakPolarHBondContact O-CG 3.42Å; D412-K472 IonicContact OD1-NZ 2.76Å; D412-K472 PolarHBondContact OD1-NZ 3.45Å
413	G	96.4	Very high	95.1	Very high	4 Å²	4	34 Å²	34	4%	0.041	18%	0.178	C	C	.	.	S	Bend	trans	73	19.2	-177.2	0	0	0	0	0	113.3	F409 N410 Y411 D470 L471	F409-G413 VanDerWaalsContact CD1-O 3.28Å; F409-G413 WeakPolarHBondContact CD1-O 3.29Å; N410-G413 PolarHBondContact O-N 2.91Å; N410-G413 PolarHBondContact OD1-N 3.28Å; N410-G413 VanDerWaalsContact OD1-N 3.14Å; Y411-G413 VanDerWaalsContact C-N 3.26Å; G413-D470 CarbonylContact O-C 3.54Å; G413-D470 VanDerWaalsContact O-CA 3.23Å; G413-D470 WeakPolarHBondContact O-CA 3.4Å; G413-D470 WeakPolarHBondContact O-CB 3.4Å; G413-L471 PolarHBondContact O-N 3.37Å
414	L	97.7	Very high	96	Very high	27 Å²	27	29.3 Å²	29.3	14%	0.141	15%	0.145	C	C	.	.			trans	-99.2	146.7	177.1	-55.3	171.2	0	0	0	109.5	H379 F409 N410 D412 H418 L422 D470 M480	H379-L414 PolarHBondContact NE2-O 2.95Å; F409-L414 CarbonylContact C-O 3.5Å; F409-L414 VanDerWaalsContact CA-O 3.29Å; F409-L414 WeakPolarHBondContact CA-O 3.44Å; N410-L414 PolarHBondContact N-O 3.36Å; N410-L414 WeakPolarHBondContact OD1-CB 3.44Å; N410-L414 PolarHBondContact OD1-N 3.11Å; N410-L414 PolarHBondContact OD1-O 2.73Å; D412-L414 HydrophobicContact CB-CD1 3.91Å; D412-L414 HydrophobicContact CB-CG 3.98Å; D412-L414 PolarHBondContact O-N 3.42Å; L414-H418 HydrophobicContact CB-CB 4.06Å; L414-H418 HydrophobicContact CD2-CB 4.07Å; L414-L422 HydrophobicContact CD1-CD1 3.73Å; L414-L422 HydrophobicContact CD2-CD1 3.9Å; L414-L422 HydrophobicContact CG-CD1 4.48Å; L414-D470 HydrophobicContact CD2-CB 4.14Å; L414-M480 HydrophobicContact CD2-CE 3.89Å
415	T	97.8	Very high	96.3	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.135	C	C	.	.			trans	-90	169	165	75.6	0	0	0	0	110.3	E407 M408 F409 L417 H418 A419 T468	E407-T415 WeakPolarHBondContact O-CG2 3.33Å; M408-T415 WeakPolarHBondContact O-CA 3.09Å; F409-T415 HydrophobicContact CD1-CG2 3.66Å; F409-T415 HydrophobicContact CE1-CG2 3.41Å; F409-T415 VanDerWaalsContact CE1-CG2 3.41Å; F409-T415 HydrophobicContact CG-CG2 4.39Å; F409-T415 HydrophobicContact CZ-CG2 3.93Å; T415-L417 PolarHBondContact O-N 3.1Å; T415-H418 WeakPolarHBondContact O-CB 3.25Å; T415-H418 PolarHBondContact O-N 2.99Å; T415-H418 VanDerWaalsContact O-N 3.1Å; T415-H418 PolarHBondContact OG1-ND1 3.16Å; T415-A419 PolarHBondContact O-N 3.19Å; T415-T468 HydrophobicContact CG2-CG2 4.08Å
416	P	97.6	Very high	96.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-53.8	-36.7	176	-26.4	34.6	0	0	0	113.3	L378 A382 V406 M408 A419 A420 L459	L378-P416 HydrophobicContact CB-CB 3.82Å; L378-P416 HydrophobicContact CB-CG 3.65Å; L378-P416 HydrophobicContact CD1-CG 4.43Å; A382-P416 WeakPolarHBondContact CB-O 3.37Å; V406-P416 VanDerWaalsContact O-CD 3.31Å; V406-P416 WeakPolarHBondContact O-CD 3.44Å; M408-P416 WeakPolarHBondContact O-CD 3.44Å; P416-A419 PolarHBondContact O-N 3.08Å; P416-A420 PolarHBondContact O-N 3.38Å; P416-L459 HydrophobicContact CB-CD1 4.11Å; P416-L459 HydrophobicContact CB-CD2 3.98Å
417	L	97.9	Very high	96.4	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-68.7	-41	179.4	-168.4	67.2	0	0	0	111.7	T415 A419 A420 V421 V456 L459 M460 A464	T415-L417 PolarHBondContact O-N 3.1Å; L417-A419 VanDerWaalsContact C-N 3.33Å; L417-A419 PolarHBondContact O-N 2.83Å; L417-A420 PolarHBondContact O-N 3.31Å; L417-V421 WeakPolarHBondContact O-CG2 3.39Å; L417-V421 PolarHBondContact O-N 3.15Å; L417-V456 HydrophobicContact CD1-CB 4.49Å; L417-V456 HydrophobicContact CD1-CG1 4.06Å; L417-L459 HydrophobicContact CD1-CB 3.86Å; L417-L459 HydrophobicContact CD1-CD1 4.28Å; L417-M460 HydrophobicContact CD1-CG 4Å; L417-M460 HydrophobicContact CD2-CG 4.16Å; L417-A464 HydrophobicContact CB-CB 4.05Å; L417-A464 HydrophobicContact CD1-CB 4.34Å; L417-A464 HydrophobicContact CD2-CB 3.91Å; L417-A464 HydrophobicContact CG-CB 4.33Å
418	H	98.2	Very high	96.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-61	-42.3	173.3	-67.8	96.9	0	0	0	111.4	L414 T415 A420 V421 L422 T468 C477 M480	L414-H418 HydrophobicContact CB-CB 4.06Å; L414-H418 HydrophobicContact CD2-CB 4.07Å; T415-H418 WeakPolarHBondContact O-CB 3.25Å; T415-H418 PolarHBondContact O-N 2.99Å; T415-H418 VanDerWaalsContact O-N 3.1Å; T415-H418 PolarHBondContact OG1-ND1 3.16Å; H418-A420 PolarHBondContact O-N 3.14Å; H418-V421 PolarHBondContact O-N 3.17Å; H418-L422 WeakPolarHBondContact O-CG 3.35Å; H418-L422 PolarHBondContact O-N 2.74Å; H418-T468 PolarHBondContact CE1-O 3.28Å; H418-T468 VanDerWaalsContact CE1-O 3.23Å; H418-T468 PolarHBondContact NE2-O 2.87Å; H418-T468 VanDerWaalsContact NE2-O 3.17Å; H418-C477 PolarHBondContact CD2-SG 3.01Å; H418-C477 PolarHBondContact NE2-N 3.29Å; H418-M480 HydrophobicContact CB-CE 4.28Å; H418-M480 HydrophobicContact CB-SD 4.13Å
419	A	97.3	Very high	96.1	Very high	5 Å²	5	27.8 Å²	27.8	4%	0.041	14%	0.143	C	C	.	.	H	α-helix	trans	-62.4	-41.2	176.1	0	0	0	0	0	112.4	A382 E383 T415 P416 L417 L422 S423	A382-A419 HydrophobicContact CB-CB 4.06Å; E383-A419 HydrophobicContact CG-CB 4.15Å; T415-A419 PolarHBondContact O-N 3.19Å; P416-A419 PolarHBondContact O-N 3.08Å; L417-A419 VanDerWaalsContact C-N 3.33Å; L417-A419 PolarHBondContact O-N 2.83Å; A419-L422 PolarHBondContact O-N 2.85Å; A419-S423 PolarHBondContact O-N 3.43Å
420	A	97.8	Very high	95.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-64	-41	176.6	0	0	0	0	0	112.2	A382 P416 L417 H418 H424 C455 V456 L459	A382-A420 HydrophobicContact CB-CB 3.88Å; P416-A420 PolarHBondContact O-N 3.38Å; L417-A420 PolarHBondContact O-N 3.31Å; H418-A420 PolarHBondContact O-N 3.14Å; A420-H424 WeakPolarHBondContact O-CB 3.47Å; A420-H424 PolarHBondContact O-N 3Å; A420-C455 HydrophobicContact CB-CB 4.41Å; A420-V456 HydrophobicContact CB-CG2 3.75Å; A420-L459 HydrophobicContact CB-CD1 3.95Å
421	V	97.9	Very high	95.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-65.2	-44.1	176.5	172.4	0	0	0	0	111.4	L417 H418 H424 N425 V456 C477 M480 L489 F493	L417-V421 WeakPolarHBondContact O-CG2 3.39Å; L417-V421 PolarHBondContact O-N 3.15Å; H418-V421 PolarHBondContact O-N 3.17Å; V421-H424 PolarHBondContact O-N 3.3Å; V421-N425 WeakPolarHBondContact O-CB 3.35Å; V421-N425 PolarHBondContact O-N 3.01Å; V421-V456 HydrophobicContact CG2-CG2 4.3Å; V421-C477 HydrophobicContact CG2-CB 4.11Å; V421-M480 HydrophobicContact CG1-CB 3.62Å; V421-L489 HydrophobicContact CB-CD1 4.32Å; V421-L489 HydrophobicContact CG1-CD1 3.9Å; V421-L489 HydrophobicContact CG2-CD1 4.21Å; V421-F493 HydrophobicContact CG2-CE2 3.94Å; V421-F493 HydrophobicContact CG2-CZ 3.55Å
422	L	97.1	Very high	95.1	Very high	52 Å²	52	29 Å²	29	27%	0.272	16%	0.155	S	C	.	.	H	α-helix	trans	-64.6	-44.5	177.9	-71.3	168.9	0	0	0	111.8	L414 H418 A419 H424 N425 A426 M480	L414-L422 HydrophobicContact CD1-CD1 3.73Å; L414-L422 HydrophobicContact CD2-CD1 3.9Å; L414-L422 HydrophobicContact CG-CD1 4.48Å; H418-L422 WeakPolarHBondContact O-CG 3.35Å; H418-L422 PolarHBondContact O-N 2.74Å; A419-L422 PolarHBondContact O-N 2.85Å; L422-H424 PolarHBondContact O-N 3.04Å; L422-N425 PolarHBondContact O-N 3.1Å; L422-A426 PolarHBondContact O-N 3.1Å; L422-M480 HydrophobicContact CD1-CE 4.43Å; L422-M480 HydrophobicContact CD1-SD 3.97Å; L422-M480 HydrophobicContact CD2-CG 4.3Å; L422-M480 HydrophobicContact CD2-SD 3.87Å; L422-M480 HydrophobicContact CG-SD 3.72Å
423	S	96.6	Very high	94.8	Very high	27 Å²	27	30.9 Å²	30.9	19%	0.189	16%	0.16	C	C	.	.	H	α-helix	trans	-63.9	-37.6	174.6	-79.6	0	0	0	0	113	E383 A419 A426 V427	E383-S423 PolarHBondContact O-OG 2.91Å; A419-S423 PolarHBondContact O-N 3.43Å; S423-A426 PolarHBondContact O-N 2.95Å; S423-V427 PolarHBondContact O-N 3.17Å
424	H	96.8	Very high	94.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-46	172.5	-174.7	-66.4	0	0	0	111.7	A420 V421 L422 A426 V427 V428 R449 F452 V453 N486 E488 L489	A420-H424 WeakPolarHBondContact O-CB 3.47Å; A420-H424 PolarHBondContact O-N 3Å; V421-H424 PolarHBondContact O-N 3.3Å; L422-H424 PolarHBondContact O-N 3.04Å; H424-A426 VanDerWaalsContact C-N 3.28Å; H424-A426 PolarHBondContact O-N 2.86Å; H424-V427 PolarHBondContact O-N 3.05Å; H424-V427 VanDerWaalsContact O-N 3.12Å; H424-V428 VanDerWaalsContact CE1-CG2 3.44Å; H424-V428 WeakPolarHBondContact CE1-CG2 3.42Å; H424-V428 WeakPolarHBondContact ND1-CG2 3.48Å; H424-V428 PolarHBondContact O-N 2.92Å; H424-R449 WeakPolarHBondContact NE2-CG 3.22Å; H424-F452 HydrophobicContact CB-CB 3.8Å; H424-F452 HydrophobicContact CB-CG 4.47Å; H424-V453 VanDerWaalsContact CD2-CG2 3.46Å; H424-V453 WeakPolarHBondContact CD2-CG2 3.39Å; H424-V453 WeakPolarHBondContact NE2-CG2 3.45Å; H424-N486 PolarHBondContact CE1-ND2 3.37Å; H424-N486 PolarHBondContact ND1-ND2 3.11Å; H424-E488 IonicContact NE2-OE2 3.47Å; H424-L489 HydrophobicContact CB-CD1 4.03Å
425	N	95.6	Very high	93.7	Very high	8 Å²	8	40.7 Å²	40.7	4%	0.043	21%	0.206	C	C	.	.	H	α-helix	trans	-59.9	-39.4	177.9	-85.9	5.6	0	0	0	111.7	V421 L422 V427 V428 K429 M480 E484 N486	V421-N425 WeakPolarHBondContact O-CB 3.35Å; V421-N425 PolarHBondContact O-N 3.01Å; L422-N425 PolarHBondContact O-N 3.1Å; N425-V427 VanDerWaalsContact C-N 3.3Å; N425-V427 PolarHBondContact O-N 2.68Å; N425-V428 PolarHBondContact O-N 2.64Å; N425-V428 VanDerWaalsContact O-N 3.16Å; N425-K429 WeakPolarHBondContact O-CB 3.47Å; N425-K429 PolarHBondContact O-N 3.07Å; N425-M480 PolarHBondContact ND2-O 3.42Å; N425-E484 HydrophobicContact CB-CG 4.01Å; N425-N486 PolarHBondContact OD1-ND2 3.42Å
426	A	95.3	Very high	93	Very high	49 Å²	49	48.6 Å²	48.6	41%	0.405	25%	0.248	S	C	.	.	H	α-helix	trans	-56.9	-42	173.9	0	0	0	0	0	112	L422 S423 H424 K429 E430	L422-A426 PolarHBondContact O-N 3.1Å; S423-A426 PolarHBondContact O-N 2.95Å; H424-A426 VanDerWaalsContact C-N 3.28Å; H424-A426 PolarHBondContact O-N 2.86Å; A426-K429 PolarHBondContact O-N 3.13Å; A426-E430 VanDerWaalsContact O-CB 3.27Å; A426-E430 WeakPolarHBondContact O-CB 3.5Å; A426-E430 PolarHBondContact O-N 2.97Å
427	V	93.6	Very high	92.5	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-68.5	-38.7	175.5	-179.1	0	0	0	0	112.2	S423 H424 N425 K429 E430 V431 L445 R448 R449 F452	S423-V427 PolarHBondContact O-N 3.17Å; H424-V427 PolarHBondContact O-N 3.05Å; H424-V427 VanDerWaalsContact O-N 3.12Å; N425-V427 VanDerWaalsContact C-N 3.3Å; N425-V427 PolarHBondContact O-N 2.68Å; V427-K429 VanDerWaalsContact C-N 3.31Å; V427-K429 PolarHBondContact O-N 3.24Å; V427-E430 PolarHBondContact O-N 2.78Å; V427-V431 HydrophobicContact CG1-CG2 4.47Å; V427-V431 WeakPolarHBondContact O-CB 3.44Å; V427-V431 VanDerWaalsContact O-CG2 3.29Å; V427-V431 WeakPolarHBondContact O-CG2 3.36Å; V427-V431 PolarHBondContact O-N 3.34Å; V427-L445 HydrophobicContact CG1-CD2 4.12Å; V427-R448 HydrophobicContact CG2-CG 3.97Å; V427-R449 HydrophobicContact CG1-CB 3.96Å; V427-F452 HydrophobicContact CG2-CD2 3.9Å; V427-F452 HydrophobicContact CG2-CE2 3.69Å
428	V	92.6	Very high	92.1	Very high	23 Å²	23	53.1 Å²	53.1	14%	0.139	28%	0.278	C	S	.	.	H	α-helix	trans	-64	-39.2	175.3	172.2	0	0	0	0	111.2	H424 N425 R432	H424-V428 VanDerWaalsContact CE1-CG2 3.44Å; H424-V428 WeakPolarHBondContact CE1-CG2 3.42Å; H424-V428 WeakPolarHBondContact ND1-CG2 3.48Å; H424-V428 PolarHBondContact O-N 2.92Å; N425-V428 PolarHBondContact O-N 2.64Å; N425-V428 VanDerWaalsContact O-N 3.16Å; V428-R432 WeakPolarHBondContact O-CB 3.35Å; V428-R432 PolarHBondContact O-N 3.25Å
429	K	91.4	Very high	91.7	Very high	89 Å²	89	58.3 Å²	58.3	39%	0.387	31%	0.312	S	S	.	.	H	α-helix	trans	-66.7	-45.1	175.2	-162.4	-172.1	-165.2	96.9	0	111.6	N425 A426 V427 R432 H433 E484	N425-K429 WeakPolarHBondContact O-CB 3.47Å; N425-K429 PolarHBondContact O-N 3.07Å; A426-K429 PolarHBondContact O-N 3.13Å; V427-K429 VanDerWaalsContact C-N 3.31Å; V427-K429 PolarHBondContact O-N 3.24Å; K429-R432 WeakPolarHBondContact O-CB 3.35Å; K429-R432 PolarHBondContact O-N 3.3Å; K429-R432 VanDerWaalsContact O-N 3.11Å; K429-H433 PolarHBondContact O-CD2 3.35Å; K429-H433 PolarHBondContact O-N 3.48Å; K429-H433 VanDerWaalsContact O-N 3.11Å; K429-E484 WeakPolarHBondContact CD-OE1 3.29Å; K429-E484 IonicContact NZ-OE1 3.77Å; K429-E484 PolarHBondContact NZ-OE1 3.22Å
430	E	91.3	Very high	91.3	Very high	77 Å²	77	63.1 Å²	63.1	36%	0.36	33%	0.332	S	S	.	.	H	α-helix	trans	-56.6	-50.2	174.3	-170.9	174.4	168	0	0	110.9	A426 V427 R432 H433 L434 L445 R448	A426-E430 VanDerWaalsContact O-CB 3.27Å; A426-E430 WeakPolarHBondContact O-CB 3.5Å; A426-E430 PolarHBondContact O-N 2.97Å; V427-E430 PolarHBondContact O-N 2.78Å; E430-R432 VanDerWaalsContact C-N 3.27Å; E430-R432 PolarHBondContact O-N 2.94Å; E430-H433 PolarHBondContact O-N 3.06Å; E430-L434 HydrophobicContact CG-CD1 4.42Å; E430-L434 WeakPolarHBondContact O-CG 3.5Å; E430-L434 PolarHBondContact O-N 3.45Å; E430-L445 HydrophobicContact CG-CD2 4.07Å; E430-L445 WeakPolarHBondContact OE1-CD2 3.27Å; E430-R448 IonicContact OE1-NH1 3.49Å; E430-R448 PolarHBondContact OE1-NH1 2.99Å; E430-R448 IonicContact OE2-CZ 3.13Å; E430-R448 IonicContact OE2-NH1 2.67Å; E430-R448 PolarHBondContact OE2-NH1 2.92Å; E430-R448 IonicContact OE2-NH2 2.69Å; E430-R448 PolarHBondContact OE2-NH2 3.43Å
431	V	88.8	Confident	90.8	Very high	68 Å²	68	66.9 Å²	66.9	41%	0.412	35%	0.351	S	S	.	.	H	α-helix	trans	-60.4	-32	174.6	170	0	0	0	0	113	V427 L445	V427-V431 HydrophobicContact CG1-CG2 4.47Å; V427-V431 WeakPolarHBondContact O-CB 3.44Å; V427-V431 VanDerWaalsContact O-CG2 3.29Å; V427-V431 WeakPolarHBondContact O-CG2 3.36Å; V427-V431 PolarHBondContact O-N 3.34Å; V431-L445 HydrophobicContact CG2-CB 3.74Å; V431-L445 HydrophobicContact CG2-CD1 3.92Å; V431-L445 HydrophobicContact CG2-CG 4.28Å
432	R	86.6	Confident	90.4	Very high	96 Å²	96	71.3 Å²	71.3	36%	0.362	37%	0.374	S	S	.	.	H	α-helix	trans	-74	-30.5	178.3	-178.3	-177.4	176.1	-150.3	4.9	113.3	V428 K429 E430 Q521 N522 Y523	V428-R432 WeakPolarHBondContact O-CB 3.35Å; V428-R432 PolarHBondContact O-N 3.25Å; K429-R432 WeakPolarHBondContact O-CB 3.35Å; K429-R432 PolarHBondContact O-N 3.3Å; K429-R432 VanDerWaalsContact O-N 3.11Å; E430-R432 VanDerWaalsContact C-N 3.27Å; E430-R432 PolarHBondContact O-N 2.94Å; R432-Q521 PolarHBondContact NH2-O 2.94Å; R432-N522 PolarHBondContact NH2-O 3.41Å; R432-Y523 VanDerWaalsContact NH1-CE2 3.34Å; R432-Y523 PolarHBondContact NH1-OH 2.77Å
433	H	87.1	Confident	90.1	Very high	123 Å²	123	71.6 Å²	71.6	57%	0.569	38%	0.38	S	S	*	.	H	α-helix	trans	-95.5	-2.9	-177.2	-68	-63.6	0	0	0	114.2	K429 E430 E435	K429-H433 PolarHBondContact O-CD2 3.35Å; K429-H433 PolarHBondContact O-N 3.48Å; K429-H433 VanDerWaalsContact O-N 3.11Å; E430-H433 PolarHBondContact O-N 3.06Å; H433-E435 PolarHBondContact O-N 2.93Å
434	L	87.4	Confident	89.9	Confident	61 Å²	61	74.5 Å²	74.5	32%	0.319	39%	0.39	S	S	.	.			trans	-81.5	114.8	178.4	-81.7	163.7	0	0	0	112.4	E430 P437 L445	E430-L434 HydrophobicContact CG-CD1 4.42Å; E430-L434 WeakPolarHBondContact O-CG 3.5Å; E430-L434 PolarHBondContact O-N 3.45Å; L434-P437 HydrophobicContact CB-CB 4.28Å; L434-P437 HydrophobicContact CB-CG 4.27Å; L434-L445 HydrophobicContact CD1-CD1 3.23Å
435	E	84	Confident	89.7	Confident	177 Å²	177	75.1 Å²	75.1	83%	0.827	39%	0.394	S	S	*	.	S	Bend	trans	-89.4	132.9	169.4	-60.1	-172.4	165.7	0	0	110.2	H433 P437	H433-E435 PolarHBondContact O-N 2.93Å; E435-P437 VanDerWaalsContact C-CD 3.43Å
436	N	82.8	Confident	89.5	Confident	165 Å²	165	77.4 Å²	77.4	88%	0.882	41%	0.414	S	S	*	.	S	Bend	trans	45.3	48.1	179.3	-58.9	-36.1	0	0	0	116.2
437	P	86.4	Confident	89.4	Confident	40 Å²	40	80.1 Å²	80.1	26%	0.26	42%	0.418	S	S	.	.			trans	-64.4	138.6	179.7	27.9	-35	0	0	0	112	L434 E435 M441 I442	L434-P437 HydrophobicContact CB-CB 4.28Å; L434-P437 HydrophobicContact CB-CG 4.27Å; E435-P437 VanDerWaalsContact C-CD 3.43Å; P437-M441 HydrophobicContact CB-CB 4.46Å; P437-M441 HydrophobicContact CB-CE 4.08Å; P437-I442 HydrophobicContact CB-CG1 3.99Å; P437-I442 HydrophobicContact CG-CD1 4.17Å; P437-I442 HydrophobicContact CG-CG1 3.86Å
438	C	89.4	Confident	89.4	Confident	55 Å²	55	83.9 Å²	83.9	37%	0.372	43%	0.432	S	S	.	.			trans	-70.2	157.3	175.8	71.7	0	0	0	0	111.6	F440 M441 I442	C438-F440 PolarHBondContact O-N 3.35Å; C438-F440 VanDerWaalsContact O-N 3.08Å; C438-M441 PolarHBondContact O-N 3.14Å; C438-I442 PolarHBondContact O-N 2.9Å; C438-I442 VanDerWaalsContact O-N 3.11Å
439	P	89.7	Confident	89.5	Confident	110 Å²	110	87 Å²	87	71%	0.714	44%	0.441	S	S	*	.	H	α-helix	trans	-55.6	-31.7	-176.7	-28.1	36	0	0	0	114.5	S443	P439-S443 WeakPolarHBondContact O-CB 3.1Å; P439-S443 PolarHBondContact O-N 3.43Å
440	F	89.8	Confident	89.6	Confident	105 Å²	105	90.7 Å²	90.7	46%	0.461	45%	0.453	S	S	.	.	H	α-helix	trans	-63.3	-48.4	174.9	177.2	-101.6	0	0	0	112.3	C438 I442 S443 E444	C438-F440 PolarHBondContact O-N 3.35Å; C438-F440 VanDerWaalsContact O-N 3.08Å; F440-I442 PolarHBondContact O-N 2.85Å; F440-S443 WeakPolarHBondContact O-CB 3.33Å; F440-S443 PolarHBondContact O-N 3.24Å; F440-E444 PolarHBondContact O-N 3.3Å
441	M	87.9	Confident	89.9	Confident	79 Å²	79	91.1 Å²	91.1	39%	0.389	45%	0.451	S	S	.	.	H	α-helix	trans	-65.9	-38.2	177.3	-70.3	-166.7	-59.7	0	0	112.2	P437 C438 S443 E444 L445	P437-M441 HydrophobicContact CB-CB 4.46Å; P437-M441 HydrophobicContact CB-CE 4.08Å; C438-M441 PolarHBondContact O-N 3.14Å; M441-S443 VanDerWaalsContact C-N 3.3Å; M441-S443 PolarHBondContact O-N 3.39Å; M441-E444 PolarHBondContact O-N 2.97Å; M441-L445 WeakPolarHBondContact O-CB 3.41Å; M441-L445 WeakPolarHBondContact O-CD1 3.48Å; M441-L445 VanDerWaalsContact O-CG 3.26Å; M441-L445 WeakPolarHBondContact O-CG 3.28Å; M441-L445 PolarHBondContact O-N 2.79Å
442	I	89.1	Confident	90.2	Very high	94 Å²	94	88.2 Å²	88.2	48%	0.482	43%	0.433	S	S	.	.	H	α-helix	trans	-59.3	-44.7	173.8	-61	172.7	0	0	0	110.2	P437 C438 F440 A446	P437-I442 HydrophobicContact CB-CG1 3.99Å; P437-I442 HydrophobicContact CG-CD1 4.17Å; P437-I442 HydrophobicContact CG-CG1 3.86Å; C438-I442 PolarHBondContact O-N 2.9Å; C438-I442 VanDerWaalsContact O-N 3.11Å; F440-I442 PolarHBondContact O-N 2.85Å; I442-A446 WeakPolarHBondContact O-CB 3.33Å; I442-A446 PolarHBondContact O-N 3.21Å; I442-A446 VanDerWaalsContact O-N 3.07Å
443	S	91	Very high	90.7	Very high	57 Å²	57	83.7 Å²	83.7	40%	0.399	42%	0.416	S	S	.	.	H	α-helix	trans	-63.1	-52.2	177.6	-171.7	0	0	0	0	112.1	P439 F440 M441 L445 A446 H447	P439-S443 WeakPolarHBondContact O-CB 3.1Å; P439-S443 PolarHBondContact O-N 3.43Å; F440-S443 WeakPolarHBondContact O-CB 3.33Å; F440-S443 PolarHBondContact O-N 3.24Å; M441-S443 VanDerWaalsContact C-N 3.3Å; M441-S443 PolarHBondContact O-N 3.39Å; S443-L445 VanDerWaalsContact C-N 3.35Å; S443-L445 PolarHBondContact O-N 2.94Å; S443-A446 WeakPolarHBondContact O-CB 3.45Å; S443-A446 PolarHBondContact O-N 3.14Å; S443-H447 PolarHBondContact O-N 3.12Å; S443-H447 PolarHBondContact O-ND1 3.42Å; S443-H447 PolarHBondContact OG-CE1 3.33Å; S443-H447 PolarHBondContact OG-ND1 3.06Å
444	E	91.7	Very high	91.2	Very high	89 Å²	89	79.8 Å²	79.8	42%	0.416	40%	0.398	S	S	.	.	H	α-helix	trans	-61.4	-42.4	-178.6	175.5	51.1	-148.7	0	0	111.6	F440 M441 A446 H447 R448	F440-E444 PolarHBondContact O-N 3.3Å; M441-E444 PolarHBondContact O-N 2.97Å; E444-A446 VanDerWaalsContact C-N 3.33Å; E444-A446 PolarHBondContact O-N 2.88Å; E444-H447 PolarHBondContact O-N 2.9Å; E444-R448 VanDerWaalsContact O-CB 3.24Å; E444-R448 WeakPolarHBondContact O-CB 3.34Å; E444-R448 PolarHBondContact O-N 3.28Å
445	L	91.6	Very high	91.7	Very high	13 Å²	13	76.9 Å²	76.9	7%	0.068	38%	0.382	C	S	.	.	H	α-helix	trans	-66.3	-34.2	177.5	-67.9	166.4	0	0	0	112.5	V427 E430 V431 L434 M441 S443 R449	V427-L445 HydrophobicContact CG1-CD2 4.12Å; E430-L445 HydrophobicContact CG-CD2 4.07Å; E430-L445 WeakPolarHBondContact OE1-CD2 3.27Å; V431-L445 HydrophobicContact CG2-CB 3.74Å; V431-L445 HydrophobicContact CG2-CD1 3.92Å; V431-L445 HydrophobicContact CG2-CG 4.28Å; L434-L445 HydrophobicContact CD1-CD1 3.23Å; M441-L445 WeakPolarHBondContact O-CB 3.41Å; M441-L445 WeakPolarHBondContact O-CD1 3.48Å; M441-L445 VanDerWaalsContact O-CG 3.26Å; M441-L445 WeakPolarHBondContact O-CG 3.28Å; M441-L445 PolarHBondContact O-N 2.79Å; S443-L445 VanDerWaalsContact C-N 3.35Å; S443-L445 PolarHBondContact O-N 2.94Å; L445-R449 WeakPolarHBondContact O-CB 3.41Å; L445-R449 PolarHBondContact O-N 2.85Å
446	A	92.4	Very high	92.3	Very high	56 Å²	56	68.4 Å²	68.4	46%	0.463	34%	0.343	S	S	.	.	H	α-helix	trans	-66.4	-42	171.9	0	0	0	0	0	112.2	I442 S443 E444 R450	I442-A446 WeakPolarHBondContact O-CB 3.33Å; I442-A446 PolarHBondContact O-N 3.21Å; I442-A446 VanDerWaalsContact O-N 3.07Å; S443-A446 WeakPolarHBondContact O-CB 3.45Å; S443-A446 PolarHBondContact O-N 3.14Å; E444-A446 VanDerWaalsContact C-N 3.33Å; E444-A446 PolarHBondContact O-N 2.88Å; A446-R450 WeakPolarHBondContact O-CB 3.15Å; A446-R450 PolarHBondContact O-N 2.78Å
447	H	92.7	Very high	92.9	Very high	106 Å²	106	65.8 Å²	65.8	49%	0.491	32%	0.321	S	S	.	.	H	α-helix	trans	-65.4	-47.3	175.5	-74.1	86.6	0	0	0	111.8	S443 E444 R450 R451	S443-H447 PolarHBondContact O-N 3.12Å; S443-H447 PolarHBondContact O-ND1 3.42Å; S443-H447 PolarHBondContact OG-CE1 3.33Å; S443-H447 PolarHBondContact OG-ND1 3.06Å; E444-H447 PolarHBondContact O-N 2.9Å; H447-R450 PolarHBondContact O-N 3.39Å; H447-R451 WeakPolarHBondContact O-CG 3.07Å; H447-R451 PolarHBondContact O-N 3.25Å
448	R	93.6	Very high	93.4	Very high	79 Å²	79	64.5 Å²	64.5	30%	0.298	31%	0.312	S	S	.	.	H	α-helix	trans	-62.4	-42.3	177.6	-172.8	175.5	162.4	-140.3	-11.5	111.7	V427 E430 E444 R451 F452	V427-R448 HydrophobicContact CG2-CG 3.97Å; E430-R448 IonicContact OE1-NH1 3.49Å; E430-R448 PolarHBondContact OE1-NH1 2.99Å; E430-R448 IonicContact OE2-CZ 3.13Å; E430-R448 IonicContact OE2-NH1 2.67Å; E430-R448 PolarHBondContact OE2-NH1 2.92Å; E430-R448 IonicContact OE2-NH2 2.69Å; E430-R448 PolarHBondContact OE2-NH2 3.43Å; E444-R448 VanDerWaalsContact O-CB 3.24Å; E444-R448 WeakPolarHBondContact O-CB 3.34Å; E444-R448 PolarHBondContact O-N 3.28Å; R448-R451 PolarHBondContact O-N 3.48Å; R448-F452 HydrophobicContact CG-CD2 4.33Å; R448-F452 HydrophobicContact CG-CE2 3.77Å; R448-F452 WeakPolarHBondContact O-CD2 3.41Å; R448-F452 PolarHBondContact O-N 2.93Å
449	R	94.2	Very high	93.7	Very high	88 Å²	88	61.9 Å²	61.9	33%	0.332	29%	0.294	S	S	.	.	H	α-helix	trans	-57.1	-56.1	170.8	-179.2	179.2	167.6	172.3	-5.8	111	H424 V427 L445 R451 F452 V453 E488	H424-R449 WeakPolarHBondContact NE2-CG 3.22Å; V427-R449 HydrophobicContact CG1-CB 3.96Å; L445-R449 WeakPolarHBondContact O-CB 3.41Å; L445-R449 PolarHBondContact O-N 2.85Å; R449-R451 VanDerWaalsContact C-N 3.3Å; R449-R451 PolarHBondContact O-N 3.06Å; R449-F452 PolarHBondContact O-N 3.4Å; R449-V453 PolarHBondContact O-N 2.98Å; R449-V453 VanDerWaalsContact O-N 3.09Å; R449-E488 IonicContact CZ-OE2 3.59Å; R449-E488 IonicContact NE-OE2 3.55Å; R449-E488 PolarHBondContact NE-OE2 3.45Å; R449-E488 IonicContact NH2-OE2 3.46Å; R449-E488 PolarHBondContact NH2-OE2 2.86Å
450	R	95.3	Very high	93.9	Very high	166 Å²	166	58.1 Å²	58.1	63%	0.626	27%	0.268	S	S	*	.	H	α-helix	trans	-53.3	-45.4	179.1	-177.1	179.9	177.8	-174.9	0.6	111.9	A446 H447 F452 V453 E454	A446-R450 WeakPolarHBondContact O-CB 3.15Å; A446-R450 PolarHBondContact O-N 2.78Å; H447-R450 PolarHBondContact O-N 3.39Å; R450-F452 VanDerWaalsContact C-N 3.3Å; R450-F452 PolarHBondContact O-N 3.42Å; R450-V453 WeakPolarHBondContact O-CB 3.19Å; R450-V453 PolarHBondContact O-N 3.41Å; R450-E454 IonicContact NE-OE1 2.73Å; R450-E454 WeakPolarHBondContact O-CG 3.49Å; R450-E454 PolarHBondContact O-N 2.94Å
451	R	95.8	Very high	94.1	Very high	86 Å²	86	60.8 Å²	60.8	33%	0.325	28%	0.281	S	S	.	.	H	α-helix	trans	-56.2	-40.3	176.4	-76.1	173.2	58.2	174.5	-4.7	113	K384 G385 Y387 H447 R448 R449 E454 C455	K384-R451 PolarHBondContact O-NH2 3.27Å; G385-R451 PolarHBondContact O-NE 2.94Å; G385-R451 PolarHBondContact O-NH2 3.09Å; Y387-R451 HydrophobicContact CD1-CB 4.37Å; Y387-R451 HydrophobicContact CD1-CG 4.17Å; Y387-R451 HydrophobicContact CE1-CG 4.07Å; H447-R451 WeakPolarHBondContact O-CG 3.07Å; H447-R451 PolarHBondContact O-N 3.25Å; R448-R451 PolarHBondContact O-N 3.48Å; R449-R451 VanDerWaalsContact C-N 3.3Å; R449-R451 PolarHBondContact O-N 3.06Å; R451-E454 PolarHBondContact O-N 3.22Å; R451-C455 PolarHBondContact O-N 3Å
452	F	96.9	Very high	94.3	Very high	8 Å²	8	58.4 Å²	58.4	4%	0.035	27%	0.27	C	S	.	.	H	α-helix	trans	-70.9	-35.2	175	-69.7	-61.5	0	0	0	112.8	A382 E383 G385 H424 V427 R448 R449 R450 E454 C455 V456	A382-F452 VanDerWaalsContact O-CE1 3.31Å; A382-F452 WeakPolarHBondContact O-CE1 3.46Å; E383-F452 WeakPolarHBondContact O-CE1 3.2Å; G385-F452 VanDerWaalsContact CA-CE1 3.44Å; H424-F452 HydrophobicContact CB-CB 3.8Å; H424-F452 HydrophobicContact CB-CG 4.47Å; V427-F452 HydrophobicContact CG2-CD2 3.9Å; V427-F452 HydrophobicContact CG2-CE2 3.69Å; R448-F452 HydrophobicContact CG-CD2 4.33Å; R448-F452 HydrophobicContact CG-CE2 3.77Å; R448-F452 WeakPolarHBondContact O-CD2 3.41Å; R448-F452 PolarHBondContact O-N 2.93Å; R449-F452 PolarHBondContact O-N 3.4Å; R450-F452 VanDerWaalsContact C-N 3.3Å; R450-F452 PolarHBondContact O-N 3.42Å; F452-E454 VanDerWaalsContact C-N 3.34Å; F452-C455 WeakPolarHBondContact O-CB 3.44Å; F452-C455 PolarHBondContact O-N 3.4Å; F452-V456 WeakPolarHBondContact O-CG2 3.23Å; F452-V456 PolarHBondContact O-N 3.26Å
453	V	96.9	Very high	94.4	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.006	27%	0.274	C	S	.	.	H	α-helix	trans	-62.4	-43	172.7	-168.7	0	0	0	0	110.8	H424 R449 R450 C455 V456 R457 E488 L492	H424-V453 VanDerWaalsContact CD2-CG2 3.46Å; H424-V453 WeakPolarHBondContact CD2-CG2 3.39Å; H424-V453 WeakPolarHBondContact NE2-CG2 3.45Å; R449-V453 PolarHBondContact O-N 2.98Å; R449-V453 VanDerWaalsContact O-N 3.09Å; R450-V453 WeakPolarHBondContact O-CB 3.19Å; R450-V453 PolarHBondContact O-N 3.41Å; V453-C455 VanDerWaalsContact C-N 3.31Å; V453-C455 PolarHBondContact O-N 2.95Å; V453-V456 PolarHBondContact O-N 3.21Å; V453-R457 VanDerWaalsContact CG1-CZ 3.44Å; V453-R457 WeakPolarHBondContact O-CG 3.4Å; V453-R457 PolarHBondContact O-N 3.29Å; V453-E488 HydrophobicContact CG2-CG 4.37Å; V453-L492 HydrophobicContact CG1-CD1 3.67Å
454	E	97	Very high	94.6	Very high	40 Å²	40	54.2 Å²	54.2	19%	0.187	26%	0.258	C	S	.	.	H	α-helix	trans	-65.6	-32.2	175.2	-52.7	-47	163.6	0	0	112.4	Y387 R450 R451 F452 R457 T458	Y387-E454 HydrophobicContact CD1-CB 4.27Å; Y387-E454 HydrophobicContact CD2-CB 3.72Å; Y387-E454 HydrophobicContact CD2-CG 4.32Å; Y387-E454 HydrophobicContact CE2-CB 4.38Å; Y387-E454 HydrophobicContact CG-CB 3.66Å; Y387-E454 HydrophobicContact CG-CG 4.45Å; R450-E454 IonicContact NE-OE1 2.73Å; R450-E454 WeakPolarHBondContact O-CG 3.49Å; R450-E454 PolarHBondContact O-N 2.94Å; R451-E454 PolarHBondContact O-N 3.22Å; F452-E454 VanDerWaalsContact C-N 3.34Å; E454-R457 IonicContact OE1-NH1 3.39Å; E454-R457 PolarHBondContact OE1-NH1 3.11Å; E454-R457 IonicContact OE2-CZ 2.78Å; E454-R457 IonicContact OE2-NH1 3.75Å; E454-R457 PolarHBondContact OE2-NH1 3.36Å; E454-T458 VanDerWaalsContact O-CB 3.27Å; E454-T458 WeakPolarHBondContact O-CB 3.17Å; E454-T458 PolarHBondContact O-N 3.11Å; E454-T458 PolarHBondContact O-OG1 3.48Å
455	C	96.8	Very high	94.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.8	-48.6	168.7	-78.2	0	0	0	0	111.8	Y387 L390 A420 R451 F452 V453 R457 T458 L459	Y387-C455 PolarHBondContact N-SG 3.11Å; Y387-C455 VanDerWaalsContact N-SG 3.42Å; L390-C455 HydrophobicContact CD1-CB 3.99Å; A420-C455 HydrophobicContact CB-CB 4.41Å; R451-C455 PolarHBondContact O-N 3Å; F452-C455 WeakPolarHBondContact O-CB 3.44Å; F452-C455 PolarHBondContact O-N 3.4Å; V453-C455 VanDerWaalsContact C-N 3.31Å; V453-C455 PolarHBondContact O-N 2.95Å; C455-R457 PolarHBondContact O-N 3.27Å; C455-T458 PolarHBondContact O-N 2.71Å; C455-L459 WeakPolarHBondContact O-CB 3.34Å; C455-L459 WeakPolarHBondContact O-CG 3.31Å; C455-L459 PolarHBondContact O-N 2.77Å
456	V	97.4	Very high	94.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.7	-47.8	178.1	172.1	0	0	0	0	110.8	L417 A420 V421 F452 V453 T458 L459 M460 L489 L492 F493	L417-V456 HydrophobicContact CD1-CB 4.49Å; L417-V456 HydrophobicContact CD1-CG1 4.06Å; A420-V456 HydrophobicContact CB-CG2 3.75Å; V421-V456 HydrophobicContact CG2-CG2 4.3Å; F452-V456 WeakPolarHBondContact O-CG2 3.23Å; F452-V456 PolarHBondContact O-N 3.26Å; V453-V456 PolarHBondContact O-N 3.21Å; V456-T458 PolarHBondContact O-N 2.84Å; V456-L459 PolarHBondContact O-N 3.19Å; V456-M460 HydrophobicContact CG1-SD 4.06Å; V456-M460 WeakPolarHBondContact O-CG 3.32Å; V456-M460 PolarHBondContact O-N 3.16Å; V456-L489 HydrophobicContact CG1-CD2 4.34Å; V456-L489 HydrophobicContact CG2-CD2 4.23Å; V456-L492 HydrophobicContact CG1-CD1 4.01Å; V456-L492 HydrophobicContact CG1-CD2 3.77Å; V456-F493 HydrophobicContact CG1-CE1 3.75Å; V456-F493 HydrophobicContact CG1-CZ 3.88Å
457	R	96.1	Very high	94.8	Very high	109 Å²	109	50.6 Å²	50.6	41%	0.411	24%	0.241	S	C	.	.	H	α-helix	trans	-60.3	-44.7	175.8	-67.8	-174.9	-170.5	118.7	2.8	112.3	V453 E454 C455 M460 H461 L492	V453-R457 VanDerWaalsContact CG1-CZ 3.44Å; V453-R457 WeakPolarHBondContact O-CG 3.4Å; V453-R457 PolarHBondContact O-N 3.29Å; E454-R457 IonicContact OE1-NH1 3.39Å; E454-R457 PolarHBondContact OE1-NH1 3.11Å; E454-R457 IonicContact OE2-CZ 2.78Å; E454-R457 IonicContact OE2-NH1 3.75Å; E454-R457 PolarHBondContact OE2-NH1 3.36Å; C455-R457 PolarHBondContact O-N 3.27Å; R457-M460 PolarHBondContact O-N 2.89Å; R457-H461 WeakPolarHBondContact O-CB 3.43Å; R457-H461 PolarHBondContact O-N 3.28Å; R457-L492 HydrophobicContact CG-CD1 3.9Å
458	T	95.8	Very high	94.9	Very high	13 Å²	13	47 Å²	47	8%	0.08	23%	0.227	C	C	.	.	H	α-helix	trans	-66.6	-42.5	-178.3	-53.8	0	0	0	0	111.2	L390 Q391 E454 C455 V456 H461 M462	L390-T458 HydrophobicContact CB-CG2 3.63Å; Q391-T458 HydrophobicContact CG-CG2 3.89Å; E454-T458 VanDerWaalsContact O-CB 3.27Å; E454-T458 WeakPolarHBondContact O-CB 3.17Å; E454-T458 PolarHBondContact O-N 3.11Å; E454-T458 PolarHBondContact O-OG1 3.48Å; C455-T458 PolarHBondContact O-N 2.71Å; V456-T458 PolarHBondContact O-N 2.84Å; T458-H461 PolarHBondContact O-N 2.97Å; T458-M462 HydrophobicContact CG2-SD 4.31Å; T458-M462 VanDerWaalsContact O-CG 3.31Å; T458-M462 WeakPolarHBondContact O-CG 3.06Å; T458-M462 PolarHBondContact O-N 2.96Å
459	L	96.2	Very high	95	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.8	-44.1	176	-71.6	169.9	0	0	0	111.9	L378 A382 L390 P416 L417 A420 C455 V456 H461 M462 G463 A464	L378-L459 HydrophobicContact CB-CD2 4.41Å; A382-L459 HydrophobicContact CB-CD1 4.14Å; L390-L459 HydrophobicContact CD1-CD1 4.48Å; L390-L459 HydrophobicContact CD1-CD2 4.14Å; L390-L459 HydrophobicContact CD1-CG 3.94Å; L390-L459 HydrophobicContact CD2-CD2 3.86Å; P416-L459 HydrophobicContact CB-CD1 4.11Å; P416-L459 HydrophobicContact CB-CD2 3.98Å; L417-L459 HydrophobicContact CD1-CB 3.86Å; L417-L459 HydrophobicContact CD1-CD1 4.28Å; A420-L459 HydrophobicContact CB-CD1 3.95Å; C455-L459 WeakPolarHBondContact O-CB 3.34Å; C455-L459 WeakPolarHBondContact O-CG 3.31Å; C455-L459 PolarHBondContact O-N 2.77Å; V456-L459 PolarHBondContact O-N 3.19Å; L459-H461 VanDerWaalsContact C-N 3.31Å; L459-H461 PolarHBondContact O-N 3.49Å; L459-M462 CarbonylContact O-C 3.57Å; L459-M462 WeakPolarHBondContact O-CA 3.4Å; L459-M462 WeakPolarHBondContact O-CB 3.4Å; L459-M462 PolarHBondContact O-N 3.33Å; L459-M462 VanDerWaalsContact O-N 3.1Å; L459-G463 PolarHBondContact O-N 3.46Å; L459-A464 VanDerWaalsContact C-CB 3.49Å; L459-A464 HydrophobicContact CB-CB 4.01Å; L459-A464 WeakPolarHBondContact O-CB 3.46Å; L459-A464 PolarHBondContact O-N 3.15Å
460	M	94.3	Very high	95.1	Very high	31 Å²	31	43 Å²	43	15%	0.153	21%	0.214	C	C	.	.	H	α-helix	trans	-62.9	-36.6	174.4	-73	173.2	61.3	0	0	112.4	L417 V456 R457 M462 G463 Y466 L492 F493 Q496	L417-M460 HydrophobicContact CD1-CG 4Å; L417-M460 HydrophobicContact CD2-CG 4.16Å; V456-M460 HydrophobicContact CG1-SD 4.06Å; V456-M460 WeakPolarHBondContact O-CG 3.32Å; V456-M460 PolarHBondContact O-N 3.16Å; R457-M460 PolarHBondContact O-N 2.89Å; M460-M462 VanDerWaalsContact C-N 3.3Å; M460-M462 PolarHBondContact O-N 3.31Å; M460-G463 PolarHBondContact O-N 3.08Å; M460-Y466 HydrophobicContact CE-CD1 3.98Å; M460-Y466 HydrophobicContact CE-CE1 4.37Å; M460-L492 HydrophobicContact CE-CD2 3.92Å; M460-L492 HydrophobicContact SD-CD2 3.35Å; M460-L492 WeakPolarHBondContact SD-CD2 3.21Å; M460-F493 HydrophobicContact CE-CD1 4.2Å; M460-F493 HydrophobicContact SD-CD1 3.73Å; M460-F493 HydrophobicContact SD-CE1 3.55Å; M460-F493 VanDerWaalsContact SD-CE1 3.55Å; M460-Q496 HydrophobicContact CE-CG 3.62Å
461	H	92.7	Very high	95.2	Very high	162 Å²	162	40.1 Å²	40.1	75%	0.75	21%	0.211	S	C	*	.	H	α-helix	trans	-68.3	-28.2	173.7	-168.9	67	0	0	0	112.9	R457 T458 L459 G463	R457-H461 WeakPolarHBondContact O-CB 3.43Å; R457-H461 PolarHBondContact O-N 3.28Å; T458-H461 PolarHBondContact O-N 2.97Å; L459-H461 VanDerWaalsContact C-N 3.31Å; L459-H461 PolarHBondContact O-N 3.49Å; H461-G463 PolarHBondContact O-N 3Å
462	M	91.8	Very high	95.1	Very high	29 Å²	29	42.1 Å²	42.1	14%	0.143	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-0.7	168.8	-65.5	172.6	69.8	0	0	113.3	L378 I393 C394 I404 V406 T458 L459 M460	L378-M462 HydrophobicContact CD1-CE 4.29Å; L378-M462 HydrophobicContact CD2-CE 3.82Å; I393-M462 HydrophobicContact CG2-CE 4.25Å; C394-M462 HydrophobicContact CB-CE 4.46Å; C394-M462 HydrophobicContact CB-CG 3.98Å; C394-M462 HydrophobicContact CB-SD 4.08Å; I404-M462 HydrophobicContact CD1-CE 3.76Å; I404-M462 HydrophobicContact CG2-CE 4.17Å; V406-M462 HydrophobicContact CG1-CB 4.45Å; V406-M462 HydrophobicContact CG2-CB 4.19Å; T458-M462 HydrophobicContact CG2-SD 4.31Å; T458-M462 VanDerWaalsContact O-CG 3.31Å; T458-M462 WeakPolarHBondContact O-CG 3.06Å; T458-M462 PolarHBondContact O-N 2.96Å; L459-M462 CarbonylContact O-C 3.57Å; L459-M462 WeakPolarHBondContact O-CA 3.4Å; L459-M462 WeakPolarHBondContact O-CB 3.4Å; L459-M462 PolarHBondContact O-N 3.33Å; L459-M462 VanDerWaalsContact O-N 3.1Å; M460-M462 VanDerWaalsContact C-N 3.3Å; M460-M462 PolarHBondContact O-N 3.31Å
463	G	91.8	Very high	95	Very high	56 Å²	56	43.5 Å²	43.5	58%	0.577	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	101.9	7.1	177.4	0	0	0	0	0	115.7	L459 M460 H461 S465	L459-G463 PolarHBondContact O-N 3.46Å; M460-G463 PolarHBondContact O-N 3.08Å; H461-G463 PolarHBondContact O-N 3Å; G463-S465 PolarHBondContact O-N 2.98Å
464	A	94.8	Very high	94.9	Very high	7 Å²	7	43.4 Å²	43.4	6%	0.058	23%	0.232	C	C	.	.			trans	-62.8	133.5	-177.6	0	0	0	0	0	113.2	V406 E407 L417 L459	V406-A464 HydrophobicContact CG1-CB 3.6Å; E407-A464 WeakPolarHBondContact OE1-CA 3.11Å; L417-A464 HydrophobicContact CB-CB 4.05Å; L417-A464 HydrophobicContact CD1-CB 4.34Å; L417-A464 HydrophobicContact CD2-CB 3.91Å; L417-A464 HydrophobicContact CG-CB 4.33Å; L459-A464 VanDerWaalsContact C-CB 3.49Å; L459-A464 HydrophobicContact CB-CB 4.01Å; L459-A464 WeakPolarHBondContact O-CB 3.46Å; L459-A464 PolarHBondContact O-N 3.15Å
465	S	93.8	Very high	94.9	Very high	46 Å²	46	44 Å²	44	32%	0.322	23%	0.233	S	C	.	.			trans	-92.6	109.2	-177.3	163.1	0	0	0	0	111.6	E407 G463 G467 T468	E407-S465 PolarHBondContact OE1-N 3.45Å; G463-S465 PolarHBondContact O-N 2.98Å; S465-G467 PolarHBondContact O-N 3.39Å; S465-G467 PolarHBondContact OG-N 3.37Å; S465-T468 WeakPolarHBondContact CB-OG1 3.36Å; S465-T468 WeakPolarHBondContact O-CB 3.36Å; S465-T468 PolarHBondContact O-N 2.92Å; S465-T468 PolarHBondContact O-OG1 3.46Å; S465-T468 PolarHBondContact OG-N 3.26Å; S465-T468 VanDerWaalsContact OG-N 3.09Å; S465-T468 PolarHBondContact OG-OG1 3.38Å
466	Y	93.4	Very high	94.9	Very high	14 Å²	14	44 Å²	44	6%	0.055	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-6.7	171.2	66.3	-87.9	0	0	0	113.5	M460 T476 C477 F493 Q496 M498 S499 V502	M460-Y466 HydrophobicContact CE-CD1 3.98Å; M460-Y466 HydrophobicContact CE-CE1 4.37Å; Y466-T476 WeakPolarHBondContact O-CB 3.21Å; Y466-C477 PolarHBondContact O-N 3.17Å; Y466-F493 HydrophobicContact CD1-CD1 4.36Å; Y466-F493 HydrophobicContact CD2-CB 4Å; Y466-F493 HydrophobicContact CD2-CD1 4.27Å; Y466-F493 HydrophobicContact CD2-CG 4.28Å; Y466-F493 HydrophobicContact CE2-CB 4.38Å; Y466-F493 HydrophobicContact CG-CB 4.39Å; Y466-F493 AromaticContact CG-CD1 3.83Å; Y466-F493 HydrophobicContact CG-CD1 3.83Å; Y466-F493 HydrophobicContact CG-CE1 4.48Å; Y466-F493 HydrophobicContact CG-CG 4.29Å; Y466-Q496 HydrophobicContact CE1-CB 3.99Å; Y466-Q496 HydrophobicContact CE1-CG 3.91Å; Y466-Q496 WeakPolarHBondContact OH-CB 3.48Å; Y466-M498 VanDerWaalsContact OH-C 3.27Å; Y466-S499 WeakPolarHBondContact OH-CA 3.26Å; Y466-S499 PolarHBondContact OH-N 3.01Å; Y466-V502 HydrophobicContact CD2-CB 4.32Å; Y466-V502 HydrophobicContact CD2-CG1 4.01Å; Y466-V502 HydrophobicContact CD2-CG2 4.19Å; Y466-V502 HydrophobicContact CE2-CB 3.87Å; Y466-V502 HydrophobicContact CE2-CG1 4.08Å; Y466-V502 HydrophobicContact CE2-CG2 3.66Å
467	G	93.3	Very high	94.9	Very high	21 Å²	21	44 Å²	44	22%	0.216	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-12	173.6	0	0	0	0	0	114.5	S465 T476	S465-G467 PolarHBondContact O-N 3.39Å; S465-G467 PolarHBondContact OG-N 3.37Å; G467-T476 VanDerWaalsContact O-CG2 3.32Å; G467-T476 WeakPolarHBondContact O-CG2 3.3Å
468	T	95.3	Very high	94.9	Very high	32 Å²	32	38.9 Å²	38.9	20%	0.196	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-62.6	147.7	174.2	-61.2	0	0	0	0	110.1	E407 F409 T415 H418 S465 T476	E407-T468 WeakPolarHBondContact OE2-CB 3.39Å; E407-T468 WeakPolarHBondContact OE2-CG2 3.49Å; E407-T468 PolarHBondContact OE2-OG1 2.95Å; F409-T468 HydrophobicContact CE1-CG2 4.36Å; F409-T468 HydrophobicContact CZ-CG2 3.91Å; T415-T468 HydrophobicContact CG2-CG2 4.08Å; H418-T468 PolarHBondContact CE1-O 3.28Å; H418-T468 VanDerWaalsContact CE1-O 3.23Å; H418-T468 PolarHBondContact NE2-O 2.87Å; H418-T468 VanDerWaalsContact NE2-O 3.17Å; S465-T468 WeakPolarHBondContact CB-OG1 3.36Å; S465-T468 WeakPolarHBondContact O-CB 3.36Å; S465-T468 PolarHBondContact O-N 2.92Å; S465-T468 PolarHBondContact O-OG1 3.46Å; S465-T468 PolarHBondContact OG-N 3.26Å; S465-T468 VanDerWaalsContact OG-N 3.09Å; S465-T468 PolarHBondContact OG-OG1 3.38Å; T468-T476 WeakPolarHBondContact O-CA 3.46Å; T468-T476 WeakPolarHBondContact O-CB 3.2Å; T468-T476 WeakPolarHBondContact O-CG2 3.36Å
469	K	96.3	Very high	94.9	Very high	77 Å²	77	38.2 Å²	38.2	34%	0.335	21%	0.209	S	C	.	.	B	Isolated β-bridge	trans	-100.6	142.4	179.4	-72.3	-175.9	164.5	-172.3	0	111.5	F409 G474 R475 T476 V505 K506	F409-K469 WeakPolarHBondContact CE1-O 3.39Å; K469-G474 WeakPolarHBondContact CD-O 3.32Å; K469-G474 WeakPolarHBondContact CE-O 3.21Å; K469-G474 WeakPolarHBondContact CG-O 3.44Å; K469-R475 WeakPolarHBondContact CA-O 3.13Å; K469-T476 HydrophobicContact CG-CG2 3.9Å; K469-V505 VanDerWaalsContact CE-CG1 3.41Å; K469-K506 WeakPolarHBondContact CE-O 3.29Å; K469-K506 PolarHBondContact NZ-O 2.73Å
470	D	96.5	Very high	94.9	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.021	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-68.7	149	166.2	95.3	-85.6	0	0	0	111.7	G413 L414 K472 S473 G474 R475 M480	G413-D470 CarbonylContact O-C 3.54Å; G413-D470 VanDerWaalsContact O-CA 3.23Å; G413-D470 WeakPolarHBondContact O-CA 3.4Å; G413-D470 WeakPolarHBondContact O-CB 3.4Å; L414-D470 HydrophobicContact CD2-CB 4.14Å; D470-K472 PolarHBondContact O-N 3.03Å; D470-K472 WeakPolarHBondContact OD2-CA 3.48Å; D470-K472 WeakPolarHBondContact OD2-CB 3.49Å; D470-K472 PolarHBondContact OD2-N 2.83Å; D470-S473 VanDerWaalsContact CG-OG 3.3Å; D470-S473 WeakPolarHBondContact OD1-CA 3.48Å; D470-S473 PolarHBondContact OD1-N 3.3Å; D470-S473 PolarHBondContact OD1-OG 3.11Å; D470-S473 PolarHBondContact OD2-N 3.45Å; D470-S473 PolarHBondContact OD2-OG 3.32Å; D470-G474 WeakPolarHBondContact O-CA 3.37Å; D470-G474 PolarHBondContact O-N 3.29Å; D470-G474 VanDerWaalsContact O-N 3.1Å; D470-G474 PolarHBondContact OD1-N 3.15Å; D470-R475 PolarHBondContact N-O 3.36Å; D470-R475 WeakPolarHBondContact OD1-CB 3.39Å; D470-R475 PolarHBondContact OD1-N 3.44Å; D470-M480 HydrophobicContact CB-CE 4.13Å
471	L	96.5	Very high	95	Very high	106 Å²	106	36.8 Å²	36.8	56%	0.555	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-14	-174.3	-51.7	-178.4	0	0	0	114.3	F409 G413	F409-L471 HydrophobicContact CB-CD1 4.05Å; F409-L471 HydrophobicContact CD1-CD1 4.06Å; F409-L471 HydrophobicContact CD1-CD2 4.26Å; F409-L471 HydrophobicContact CD1-CG 3.79Å; F409-L471 HydrophobicContact CD2-CD1 4.07Å; F409-L471 HydrophobicContact CD2-CD2 4.35Å; F409-L471 HydrophobicContact CD2-CG 4.37Å; F409-L471 HydrophobicContact CE1-CD2 3.9Å; F409-L471 HydrophobicContact CE1-CG 3.88Å; F409-L471 HydrophobicContact CE2-CD2 4.02Å; F409-L471 HydrophobicContact CE2-CG 4.47Å; F409-L471 HydrophobicContact CG-CD1 3.79Å; F409-L471 HydrophobicContact CG-CD2 4.46Å; F409-L471 HydrophobicContact CG-CG 4.04Å; F409-L471 HydrophobicContact CZ-CD2 3.77Å; F409-L471 HydrophobicContact CZ-CG 4.23Å; G413-L471 PolarHBondContact O-N 3.37Å
472	K	94.4	Very high	95.2	Very high	129 Å²	129	29 Å²	29	56%	0.561	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95	-42.6	-178.2	-68.6	-175.9	177.5	179.9	0	112.8	D412 D470	D412-K472 WeakPolarHBondContact O-CD 3.47Å; D412-K472 WeakPolarHBondContact O-CE 3.16Å; D412-K472 WeakPolarHBondContact O-CG 3.42Å; D412-K472 IonicContact OD1-NZ 2.76Å; D412-K472 PolarHBondContact OD1-NZ 3.45Å; D470-K472 PolarHBondContact O-N 3.03Å; D470-K472 WeakPolarHBondContact OD2-CA 3.48Å; D470-K472 WeakPolarHBondContact OD2-CB 3.49Å; D470-K472 PolarHBondContact OD2-N 2.83Å
473	S	93.9	Very high	95.3	Very high	36 Å²	36	31 Å²	31	25%	0.252	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-6.9	-174.3	61.2	0	0	0	0	115.2	D470 R475 F508	D470-S473 VanDerWaalsContact CG-OG 3.3Å; D470-S473 WeakPolarHBondContact OD1-CA 3.48Å; D470-S473 PolarHBondContact OD1-N 3.3Å; D470-S473 PolarHBondContact OD1-OG 3.11Å; D470-S473 PolarHBondContact OD2-N 3.45Å; D470-S473 PolarHBondContact OD2-OG 3.32Å; S473-R475 PolarHBondContact O-N 2.95Å; S473-R475 WeakPolarHBondContact OG-CG 3.36Å; S473-R475 PolarHBondContact OG-NE 3.25Å; S473-F508 PolarHBondContact O-N 3.49Å; S473-F508 VanDerWaalsContact O-N 3.12Å
474	G	95.9	Very high	95.4	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.15	C	C	.	.			trans	66.7	15.7	-177.8	0	0	0	0	0	113.4	K469 D470 F508	K469-G474 WeakPolarHBondContact CD-O 3.32Å; K469-G474 WeakPolarHBondContact CE-O 3.21Å; K469-G474 WeakPolarHBondContact CG-O 3.44Å; D470-G474 WeakPolarHBondContact O-CA 3.37Å; D470-G474 PolarHBondContact O-N 3.29Å; D470-G474 VanDerWaalsContact O-N 3.1Å; D470-G474 PolarHBondContact OD1-N 3.15Å; G474-F508 VanDerWaalsContact N-CD2 3.28Å; G474-F508 VanDerWaalsContact N-CE2 3.27Å
475	R	96.3	Very high	95.4	Very high	53 Å²	53	28.6 Å²	28.6	20%	0.2	15%	0.148	C	C	.	.			trans	-77.5	141.8	176.9	-71.3	-171.5	-63.2	164	3.3	109.2	K469 D470 S473 H479 M480 E483 T507	K469-R475 WeakPolarHBondContact CA-O 3.13Å; D470-R475 PolarHBondContact N-O 3.36Å; D470-R475 WeakPolarHBondContact OD1-CB 3.39Å; D470-R475 PolarHBondContact OD1-N 3.44Å; S473-R475 PolarHBondContact O-N 2.95Å; S473-R475 WeakPolarHBondContact OG-CG 3.36Å; S473-R475 PolarHBondContact OG-NE 3.25Å; R475-H479 HydrophobicContact CB-CB 3.84Å; R475-H479 HydrophobicContact CG-CB 4.03Å; R475-M480 HydrophobicContact CB-CE 4.18Å; R475-E483 IonicContact CZ-OE2 3.71Å; R475-E483 IonicContact NH1-OE1 3.93Å; R475-E483 PolarHBondContact NH1-OE1 3.4Å; R475-E483 IonicContact NH1-OE2 2.76Å; R475-E483 PolarHBondContact NH1-OE2 3.08Å; R475-T507 HydrophobicContact CG-CG2 3.65Å
476	T	96.7	Very high	95.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.133	C	C	.	.	B	Isolated β-bridge	trans	-95.5	171.2	168.8	71.4	0	0	0	0	110.5	Y466 G467 T468 K469 L478 H479 M480 V505	Y466-T476 WeakPolarHBondContact O-CB 3.21Å; G467-T476 VanDerWaalsContact O-CG2 3.32Å; G467-T476 WeakPolarHBondContact O-CG2 3.3Å; T468-T476 WeakPolarHBondContact O-CA 3.46Å; T468-T476 WeakPolarHBondContact O-CB 3.2Å; T468-T476 WeakPolarHBondContact O-CG2 3.36Å; K469-T476 HydrophobicContact CG-CG2 3.9Å; T476-L478 PolarHBondContact O-N 2.95Å; T476-L478 VanDerWaalsContact O-N 3.14Å; T476-L478 PolarHBondContact OG1-N 3.33Å; T476-H479 PolarHBondContact N-ND1 3.37Å; T476-H479 WeakPolarHBondContact O-CB 3.21Å; T476-H479 PolarHBondContact O-N 2.89Å; T476-H479 PolarHBondContact OG1-ND1 3.38Å; T476-M480 PolarHBondContact O-N 2.98Å; T476-M480 VanDerWaalsContact O-N 3.13Å; T476-V505 HydrophobicContact CG2-CG1 3.93Å
477	C	96.4	Very high	95.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-53.6	-32.7	172.9	-71.2	0	0	0	0	113	H418 V421 Y466 M480 A481 F493	H418-C477 PolarHBondContact CD2-SG 3.01Å; H418-C477 PolarHBondContact NE2-N 3.29Å; V421-C477 HydrophobicContact CG2-CB 4.11Å; Y466-C477 PolarHBondContact O-N 3.17Å; C477-M480 PolarHBondContact O-N 3.09Å; C477-A481 PolarHBondContact O-N 3.38Å; C477-F493 HydrophobicContact CB-CE1 4.46Å; C477-F493 HydrophobicContact CB-CE2 3.94Å; C477-F493 HydrophobicContact CB-CZ 3.86Å
478	L	96.4	Very high	95.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-67.4	-37.3	174.4	-170.1	72.3	0	0	0	112.7	T476 M480 A481 A482 L490 F493 L494 V502 V503 A513 L533	T476-L478 PolarHBondContact O-N 2.95Å; T476-L478 VanDerWaalsContact O-N 3.14Å; T476-L478 PolarHBondContact OG1-N 3.33Å; L478-M480 VanDerWaalsContact C-N 3.35Å; L478-A481 PolarHBondContact O-N 3.39Å; L478-A482 WeakPolarHBondContact O-CB 3.48Å; L478-A482 PolarHBondContact O-N 2.93Å; L478-L490 HydrophobicContact CD1-CD2 3.73Å; L478-L490 HydrophobicContact CG-CD2 4.5Å; L478-F493 HydrophobicContact CD1-CB 4.17Å; L478-F493 HydrophobicContact CD1-CD2 4.46Å; L478-L494 HydrophobicContact CD1-CD1 4.32Å; L478-L494 HydrophobicContact CD1-CD2 3.83Å; L478-L494 HydrophobicContact CD1-CG 3.93Å; L478-L494 HydrophobicContact CD2-CD2 4.16Å; L478-V502 HydrophobicContact CB-CG1 4.29Å; L478-V502 HydrophobicContact CD2-CG1 4.3Å; L478-V503 HydrophobicContact CD2-CG2 4.27Å; L478-A513 HydrophobicContact CD2-CB 4.07Å; L478-A513 HydrophobicContact CG-CB 4.13Å; L478-L533 HydrophobicContact CD2-CD2 4.44Å
479	H	96.9	Very high	95.6	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-68.3	-35.4	176.3	-69	82.2	0	0	0	111.9	R475 T476 A482 E483 V505 T507 N511 A513 I516	R475-H479 HydrophobicContact CB-CB 3.84Å; R475-H479 HydrophobicContact CG-CB 4.03Å; T476-H479 PolarHBondContact N-ND1 3.37Å; T476-H479 WeakPolarHBondContact O-CB 3.21Å; T476-H479 PolarHBondContact O-N 2.89Å; T476-H479 PolarHBondContact OG1-ND1 3.38Å; H479-A482 WeakPolarHBondContact O-CB 3.47Å; H479-A482 PolarHBondContact O-N 3.2Å; H479-E483 PolarHBondContact O-N 2.89Å; H479-V505 PolarHBondContact CE1-O 3.33Å; H479-V505 PolarHBondContact NE2-O 3.08Å; H479-T507 VanDerWaalsContact CD2-CG2 3.44Å; H479-T507 WeakPolarHBondContact CD2-CG2 3.48Å; H479-N511 PolarHBondContact NE2-O 3.37Å; H479-A513 PolarHBondContact CD2-N 3.22Å; H479-A513 PolarHBondContact NE2-N 2.92Å; H479-I516 HydrophobicContact CB-CD1 3.88Å
480	M	96.4	Very high	95.6	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-70.8	-43.8	173.8	-62.9	178.1	-174.2	0	0	110.8	L414 H418 V421 L422 N425 D470 R475 T476 C477 L478 A482 E483	L414-M480 HydrophobicContact CD2-CE 3.89Å; H418-M480 HydrophobicContact CB-CE 4.28Å; H418-M480 HydrophobicContact CB-SD 4.13Å; V421-M480 HydrophobicContact CG1-CB 3.62Å; L422-M480 HydrophobicContact CD1-CE 4.43Å; L422-M480 HydrophobicContact CD1-SD 3.97Å; L422-M480 HydrophobicContact CD2-CG 4.3Å; L422-M480 HydrophobicContact CD2-SD 3.87Å; L422-M480 HydrophobicContact CG-SD 3.72Å; N425-M480 PolarHBondContact ND2-O 3.42Å; D470-M480 HydrophobicContact CB-CE 4.13Å; R475-M480 HydrophobicContact CB-CE 4.18Å; T476-M480 PolarHBondContact O-N 2.98Å; T476-M480 VanDerWaalsContact O-N 3.13Å; C477-M480 PolarHBondContact O-N 3.09Å; L478-M480 VanDerWaalsContact C-N 3.35Å; M480-A482 PolarHBondContact O-N 3.46Å; M480-E483 WeakPolarHBondContact O-CB 3.12Å; M480-E483 PolarHBondContact O-N 3.3Å; M480-E483 VanDerWaalsContact O-N 3.14Å
481	A	96.4	Very high	95.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.1	-33.3	173.1	0	0	0	0	0	113	C477 L478 N486 L489 L490 F493	C477-A481 PolarHBondContact O-N 3.38Å; L478-A481 PolarHBondContact O-N 3.39Å; A481-N486 WeakPolarHBondContact O-CB 3.35Å; A481-N486 PolarHBondContact O-N 2.87Å; A481-L489 HydrophobicContact CB-CB 3.8Å; A481-L490 HydrophobicContact CB-CD2 3.88Å; A481-L490 HydrophobicContact CB-CG 4.15Å; A481-F493 HydrophobicContact CB-CD2 4.31Å; A481-F493 HydrophobicContact CB-CE2 4.18Å
482	A	95.9	Very high	95.5	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-65.9	-36.8	174	0	0	0	0	0	113.5	L478 H479 M480 E484 A485 A513 I516 V517	L478-A482 WeakPolarHBondContact O-CB 3.48Å; L478-A482 PolarHBondContact O-N 2.93Å; H479-A482 WeakPolarHBondContact O-CB 3.47Å; H479-A482 PolarHBondContact O-N 3.2Å; M480-A482 PolarHBondContact O-N 3.46Å; A482-E484 VanDerWaalsContact C-N 3.31Å; A482-E484 PolarHBondContact O-N 3.27Å; A482-A485 PolarHBondContact O-N 2.81Å; A482-A513 HydrophobicContact CB-CB 4.22Å; A482-I516 HydrophobicContact CB-CB 4.21Å; A482-I516 HydrophobicContact CB-CG2 4.02Å; A482-V517 HydrophobicContact CB-CG2 3.57Å
483	E	94.8	Very high	95.5	Very high	70 Å²	70	17.3 Å²	17.3	33%	0.327	8%	0.084	S	C	.	.	H	α-helix	trans	-58.1	-35	-175.3	-174.8	171.5	-142.6	0	0	114.3	R475 H479 M480 I516 L520 Y523	R475-E483 IonicContact CZ-OE2 3.71Å; R475-E483 IonicContact NH1-OE1 3.93Å; R475-E483 PolarHBondContact NH1-OE1 3.4Å; R475-E483 IonicContact NH1-OE2 2.76Å; R475-E483 PolarHBondContact NH1-OE2 3.08Å; H479-E483 PolarHBondContact O-N 2.89Å; M480-E483 WeakPolarHBondContact O-CB 3.12Å; M480-E483 PolarHBondContact O-N 3.3Å; M480-E483 VanDerWaalsContact O-N 3.14Å; E483-I516 HydrophobicContact CB-CG2 4.28Å; E483-L520 VanDerWaalsContact O-CD2 3.28Å; E483-L520 WeakPolarHBondContact O-CD2 3.48Å; E483-Y523 PolarHBondContact O-OH 3.04Å
484	E	93	Very high	95.4	Very high	13 Å²	13	15.6 Å²	15.6	6%	0.061	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	13.4	177.2	-68.9	-68.9	159.8	0	0	113.1	N425 K429 A482 N486 Y523	N425-E484 HydrophobicContact CB-CG 4.01Å; K429-E484 WeakPolarHBondContact CD-OE1 3.29Å; K429-E484 IonicContact NZ-OE1 3.77Å; K429-E484 PolarHBondContact NZ-OE1 3.22Å; A482-E484 VanDerWaalsContact C-N 3.31Å; A482-E484 PolarHBondContact O-N 3.27Å; E484-N486 PolarHBondContact O-N 3.12Å; E484-Y523 HydrophobicContact CB-CE1 4.42Å; E484-Y523 WeakPolarHBondContact O-CE1 3.46Å; E484-Y523 WeakPolarHBondContact OE2-CE1 3.29Å; E484-Y523 PolarHBondContact OE2-OH 2.83Å
485	A	94.4	Very high	95.2	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.2	42.3	-171.3	0	0	0	0	0	113.2	A482 I487 L520 Y523 N525 A529	A482-A485 PolarHBondContact O-N 2.81Å; A485-I487 PolarHBondContact O-N 3.4Å; A485-L520 HydrophobicContact CB-CD1 3.8Å; A485-Y523 HydrophobicContact CB-CD1 3.95Å; A485-Y523 HydrophobicContact CB-CG 4.33Å; A485-N525 HydrophobicContact CB-CB 4.05Å; A485-A529 HydrophobicContact CB-CB 4.34Å
486	N	95	Very high	94.8	Very high	4 Å²	4	22.1 Å²	22.1	2%	0.021	11%	0.105	C	C	.	.			trans	-80.9	83.2	-169.2	-176.7	-4.8	0	0	0	111.7	H424 N425 A481 E484 E488 L489 L490	H424-N486 PolarHBondContact CE1-ND2 3.37Å; H424-N486 PolarHBondContact ND1-ND2 3.11Å; N425-N486 PolarHBondContact OD1-ND2 3.42Å; A481-N486 WeakPolarHBondContact O-CB 3.35Å; A481-N486 PolarHBondContact O-N 2.87Å; E484-N486 PolarHBondContact O-N 3.12Å; N486-E488 PolarHBondContact O-N 2.78Å; N486-E488 VanDerWaalsContact O-N 3.13Å; N486-L489 WeakPolarHBondContact ND2-CD1 3.24Å; N486-L489 VanDerWaalsContact ND2-CG 3.35Å; N486-L489 WeakPolarHBondContact ND2-CG 3.36Å; N486-L489 PolarHBondContact O-N 3.13Å; N486-L490 WeakPolarHBondContact O-CG 3.5Å; N486-L490 PolarHBondContact O-N 3.37Å
487	I	94.9	Very high	94.1	Very high	38 Å²	38	27.9 Å²	27.9	20%	0.195	14%	0.142	C	C	.	.	H	α-helix	trans	-47.9	-39.8	-178.5	-56.5	-60	0	0	0	113.1	A485 L490 H491 N525 E528 A529	A485-I487 PolarHBondContact O-N 3.4Å; I487-L490 PolarHBondContact O-N 2.95Å; I487-H491 WeakPolarHBondContact O-CB 3.36Å; I487-H491 PolarHBondContact O-CD2 2.99Å; I487-H491 VanDerWaalsContact O-CD2 3.3Å; I487-H491 PolarHBondContact O-N 3.03Å; I487-N525 HydrophobicContact CD1-CB 4.14Å; I487-N525 HydrophobicContact CG1-CB 3.84Å; I487-E528 HydrophobicContact CD1-CB 4.24Å; I487-A529 HydrophobicContact CD1-CB 3.72Å
488	E	95.1	Very high	93.2	Very high	60 Å²	60	34.4 Å²	34.4	28%	0.28	17%	0.174	S	C	.	.	H	α-helix	trans	-66.4	-45.6	-177.3	-178.5	168.3	-154.9	0	0	112.3	H424 R449 V453 N486 L492	H424-E488 IonicContact NE2-OE2 3.47Å; R449-E488 IonicContact CZ-OE2 3.59Å; R449-E488 IonicContact NE-OE2 3.55Å; R449-E488 PolarHBondContact NE-OE2 3.45Å; R449-E488 IonicContact NH2-OE2 3.46Å; R449-E488 PolarHBondContact NH2-OE2 2.86Å; V453-E488 HydrophobicContact CG2-CG 4.37Å; N486-E488 PolarHBondContact O-N 2.78Å; N486-E488 VanDerWaalsContact O-N 3.13Å; E488-L492 WeakPolarHBondContact O-CB 3.45Å; E488-L492 PolarHBondContact O-N 3.2Å
489	L	96.1	Very high	92.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-73.1	-34.4	175.6	-64.2	-173.1	0	0	0	112.1	V421 H424 V456 A481 N486 L492 F493	V421-L489 HydrophobicContact CB-CD1 4.32Å; V421-L489 HydrophobicContact CG1-CD1 3.9Å; V421-L489 HydrophobicContact CG2-CD1 4.21Å; H424-L489 HydrophobicContact CB-CD1 4.03Å; V456-L489 HydrophobicContact CG1-CD2 4.34Å; V456-L489 HydrophobicContact CG2-CD2 4.23Å; A481-L489 HydrophobicContact CB-CB 3.8Å; N486-L489 WeakPolarHBondContact ND2-CD1 3.24Å; N486-L489 VanDerWaalsContact ND2-CG 3.35Å; N486-L489 WeakPolarHBondContact ND2-CG 3.36Å; N486-L489 PolarHBondContact O-N 3.13Å; L489-L492 HydrophobicContact CD2-CD1 4.31Å; L489-L492 PolarHBondContact O-N 3.2Å; L489-F493 HydrophobicContact CB-CD2 4.45Å; L489-F493 HydrophobicContact CB-CE2 4.06Å; L489-F493 WeakPolarHBondContact O-CD2 3.44Å; L489-F493 WeakPolarHBondContact O-CG 3.37Å; L489-F493 PolarHBondContact O-N 3.19Å
490	L	96	Very high	91.8	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61	-45.1	173.1	-68.7	173.1	0	0	0	111.1	L478 A481 N486 I487 L494 A529 L532	L478-L490 HydrophobicContact CD1-CD2 3.73Å; L478-L490 HydrophobicContact CG-CD2 4.5Å; A481-L490 HydrophobicContact CB-CD2 3.88Å; A481-L490 HydrophobicContact CB-CG 4.15Å; N486-L490 WeakPolarHBondContact O-CG 3.5Å; N486-L490 PolarHBondContact O-N 3.37Å; I487-L490 PolarHBondContact O-N 2.95Å; L490-L494 HydrophobicContact CB-CD1 4.34Å; L490-L494 WeakPolarHBondContact O-CB 3.46Å; L490-L494 WeakPolarHBondContact O-CD1 3.26Å; L490-L494 WeakPolarHBondContact O-CG 3.44Å; L490-L494 PolarHBondContact O-N 3.07Å; L490-A529 HydrophobicContact CD1-CB 3.73Å; L490-L532 HydrophobicContact CB-CD2 3.68Å
491	H	94.9	Very high	91.2	Very high	72 Å²	72	44.5 Å²	44.5	33%	0.333	24%	0.239	S	C	.	.	H	α-helix	trans	-59.3	-52.4	172.5	-92.3	-94.4	0	0	0	111.5	I487 F493 L494 E495 L532	I487-H491 WeakPolarHBondContact O-CB 3.36Å; I487-H491 PolarHBondContact O-CD2 2.99Å; I487-H491 VanDerWaalsContact O-CD2 3.3Å; I487-H491 PolarHBondContact O-N 3.03Å; H491-F493 VanDerWaalsContact C-N 3.29Å; H491-F493 PolarHBondContact O-N 3.17Å; H491-L494 PolarHBondContact O-N 3.46Å; H491-L494 VanDerWaalsContact O-N 3.11Å; H491-E495 IonicContact CE1-OE1 2.72Å; H491-E495 IonicContact CG-OE1 3.88Å; H491-E495 IonicContact ND1-OE1 2.77Å; H491-E495 PolarHBondContact ND1-OE1 2.99Å; H491-E495 WeakPolarHBondContact O-CB 3.46Å; H491-E495 VanDerWaalsContact O-CG 3.31Å; H491-E495 WeakPolarHBondContact O-CG 3.23Å; H491-E495 PolarHBondContact O-N 2.92Å; H491-L532 VanDerWaalsContact CD2-CD2 3.4Å; H491-L532 WeakPolarHBondContact CD2-CD2 3.48Å
492	L	95.1	Very high	90.9	Very high	17 Å²	17	45.1 Å²	45.1	9%	0.089	24%	0.243	C	C	.	.	H	α-helix	trans	-54.2	-41.8	-177.3	-166.5	163.5	0	0	0	112.7	V453 V456 R457 M460 E488 L489 Q496	V453-L492 HydrophobicContact CG1-CD1 3.67Å; V456-L492 HydrophobicContact CG1-CD1 4.01Å; V456-L492 HydrophobicContact CG1-CD2 3.77Å; R457-L492 HydrophobicContact CG-CD1 3.9Å; M460-L492 HydrophobicContact CE-CD2 3.92Å; M460-L492 HydrophobicContact SD-CD2 3.35Å; M460-L492 WeakPolarHBondContact SD-CD2 3.21Å; E488-L492 WeakPolarHBondContact O-CB 3.45Å; E488-L492 PolarHBondContact O-N 3.2Å; L489-L492 HydrophobicContact CD2-CD1 4.31Å; L489-L492 PolarHBondContact O-N 3.2Å; L492-Q496 WeakPolarHBondContact O-CG 3.32Å; L492-Q496 PolarHBondContact O-NE2 2.91Å
493	F	94.6	Very high	90.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-79.9	-36.6	176.4	-60.1	-42.3	0	0	0	113.7	V421 V456 M460 Y466 C477 L478 A481 L489 H491 Q496	V421-F493 HydrophobicContact CG2-CE2 3.94Å; V421-F493 HydrophobicContact CG2-CZ 3.55Å; V456-F493 HydrophobicContact CG1-CE1 3.75Å; V456-F493 HydrophobicContact CG1-CZ 3.88Å; M460-F493 HydrophobicContact CE-CD1 4.2Å; M460-F493 HydrophobicContact SD-CD1 3.73Å; M460-F493 HydrophobicContact SD-CE1 3.55Å; M460-F493 VanDerWaalsContact SD-CE1 3.55Å; Y466-F493 HydrophobicContact CD1-CD1 4.36Å; Y466-F493 HydrophobicContact CD2-CB 4Å; Y466-F493 HydrophobicContact CD2-CD1 4.27Å; Y466-F493 HydrophobicContact CD2-CG 4.28Å; Y466-F493 HydrophobicContact CE2-CB 4.38Å; Y466-F493 HydrophobicContact CG-CB 4.39Å; Y466-F493 AromaticContact CG-CD1 3.83Å; Y466-F493 HydrophobicContact CG-CD1 3.83Å; Y466-F493 HydrophobicContact CG-CE1 4.48Å; Y466-F493 HydrophobicContact CG-CG 4.29Å; C477-F493 HydrophobicContact CB-CE1 4.46Å; C477-F493 HydrophobicContact CB-CE2 3.94Å; C477-F493 HydrophobicContact CB-CZ 3.86Å; L478-F493 HydrophobicContact CD1-CB 4.17Å; L478-F493 HydrophobicContact CD1-CD2 4.46Å; A481-F493 HydrophobicContact CB-CD2 4.31Å; A481-F493 HydrophobicContact CB-CE2 4.18Å; L489-F493 HydrophobicContact CB-CD2 4.45Å; L489-F493 HydrophobicContact CB-CE2 4.06Å; L489-F493 WeakPolarHBondContact O-CD2 3.44Å; L489-F493 WeakPolarHBondContact O-CG 3.37Å; L489-F493 PolarHBondContact O-N 3.19Å; H491-F493 VanDerWaalsContact C-N 3.29Å; H491-F493 PolarHBondContact O-N 3.17Å; F493-Q496 WeakPolarHBondContact O-CB 3.11Å; F493-Q496 WeakPolarHBondContact O-CG 3.01Å; F493-Q496 PolarHBondContact O-N 3.45Å
494	L	92.6	Very high	90.6	Very high	1 Å²	1	44 Å²	44	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-85	-12.4	-175	-62.4	173	0	0	0	113.8	L478 L490 H491 Q496 S499 V503 L532 L533 K536	L478-L494 HydrophobicContact CD1-CD1 4.32Å; L478-L494 HydrophobicContact CD1-CD2 3.83Å; L478-L494 HydrophobicContact CD1-CG 3.93Å; L478-L494 HydrophobicContact CD2-CD2 4.16Å; L490-L494 HydrophobicContact CB-CD1 4.34Å; L490-L494 WeakPolarHBondContact O-CB 3.46Å; L490-L494 WeakPolarHBondContact O-CD1 3.26Å; L490-L494 WeakPolarHBondContact O-CG 3.44Å; L490-L494 PolarHBondContact O-N 3.07Å; H491-L494 PolarHBondContact O-N 3.46Å; H491-L494 VanDerWaalsContact O-N 3.11Å; L494-Q496 VanDerWaalsContact C-N 3.29Å; L494-S499 PolarHBondContact O-OG 3.39Å; L494-V503 HydrophobicContact CD2-CG2 3.28Å; L494-L532 HydrophobicContact CD1-CD2 4.21Å; L494-L532 HydrophobicContact CD1-CG 3.89Å; L494-L533 HydrophobicContact CD1-CD2 3.96Å; L494-K536 HydrophobicContact CB-CD 4.12Å; L494-K536 HydrophobicContact CB-CG 3.98Å; L494-K536 HydrophobicContact CD1-CB 4.43Å; L494-K536 HydrophobicContact CD1-CG 4.33Å; L494-K536 HydrophobicContact CD2-CB 4.34Å; L494-K536 WeakPolarHBondContact O-CD 3.36Å; L494-K536 VanDerWaalsContact O-CE 3.23Å; L494-K536 WeakPolarHBondContact O-CE 3.45Å; L494-K536 PolarHBondContact O-NZ 3.34Å
495	E	90.4	Very high	90.7	Very high	120 Å²	120	45.1 Å²	45.1	56%	0.561	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-10.9	170	-73.7	166.8	-173.4	0	0	112.7	H491	H491-E495 IonicContact CE1-OE1 2.72Å; H491-E495 IonicContact CG-OE1 3.88Å; H491-E495 IonicContact ND1-OE1 2.77Å; H491-E495 PolarHBondContact ND1-OE1 2.99Å; H491-E495 WeakPolarHBondContact O-CB 3.46Å; H491-E495 VanDerWaalsContact O-CG 3.31Å; H491-E495 WeakPolarHBondContact O-CG 3.23Å; H491-E495 PolarHBondContact O-N 2.92Å
496	Q	88.3	Confident	90.7	Very high	69 Å²	69	48.1 Å²	48.1	32%	0.322	26%	0.26	S	S	.	.	S	Bend	trans	-71	146.2	174.4	-54.3	-51.9	-43.2	0	0	112	M460 Y466 L492 F493 L494 M498 S499	M460-Q496 HydrophobicContact CE-CG 3.62Å; Y466-Q496 HydrophobicContact CE1-CB 3.99Å; Y466-Q496 HydrophobicContact CE1-CG 3.91Å; Y466-Q496 WeakPolarHBondContact OH-CB 3.48Å; L492-Q496 WeakPolarHBondContact O-CG 3.32Å; L492-Q496 PolarHBondContact O-NE2 2.91Å; F493-Q496 WeakPolarHBondContact O-CB 3.11Å; F493-Q496 WeakPolarHBondContact O-CG 3.01Å; F493-Q496 PolarHBondContact O-N 3.45Å; L494-Q496 VanDerWaalsContact C-N 3.29Å; Q496-M498 VanDerWaalsContact C-N 3.28Å; Q496-M498 PolarHBondContact O-N 3.49Å; Q496-S499 WeakPolarHBondContact O-CB 3.46Å; Q496-S499 PolarHBondContact O-N 3.23Å; Q496-S499 VanDerWaalsContact O-N 3.14Å; Q496-S499 PolarHBondContact O-OG 3.4Å
497	P	81.8	Confident	90.8	Very high	121 Å²	121	48.2 Å²	48.2	79%	0.786	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-28.6	-177.5	24.7	-34.4	0	0	0	113.6	S499	P497-S499 VanDerWaalsContact C-N 3.27Å; P497-S499 PolarHBondContact O-N 2.94Å
498	M	78.6	Confident	90.8	Very high	138 Å²	138	51.9 Å²	51.9	68%	0.68	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	4.6	178.3	-58	-164.9	-62	0	0	114.2	Y466 Q496 L500 A501	Y466-M498 VanDerWaalsContact OH-C 3.27Å; Q496-M498 VanDerWaalsContact C-N 3.28Å; Q496-M498 PolarHBondContact O-N 3.49Å; M498-L500 VanDerWaalsContact C-N 3.31Å; M498-L500 PolarHBondContact O-N 3.33Å; M498-A501 PolarHBondContact O-N 2.94Å; M498-A501 VanDerWaalsContact O-N 3.13Å
499	S	82.2	Confident	90.7	Very high	9 Å²	9	52 Å²	52	6%	0.063	28%	0.283	C	S	.	.	H	α-helix	trans	-55.7	-40	-171.5	48	0	0	0	0	114	Y466 L494 Q496 P497 A501 V502 V503	Y466-S499 WeakPolarHBondContact OH-CA 3.26Å; Y466-S499 PolarHBondContact OH-N 3.01Å; L494-S499 PolarHBondContact O-OG 3.39Å; Q496-S499 WeakPolarHBondContact O-CB 3.46Å; Q496-S499 PolarHBondContact O-N 3.23Å; Q496-S499 VanDerWaalsContact O-N 3.14Å; Q496-S499 PolarHBondContact O-OG 3.4Å; P497-S499 VanDerWaalsContact C-N 3.27Å; P497-S499 PolarHBondContact O-N 2.94Å; S499-A501 PolarHBondContact O-N 3.24Å; S499-A501 VanDerWaalsContact O-N 3.17Å; S499-V502 PolarHBondContact O-N 3.48Å; S499-V503 WeakPolarHBondContact O-CG2 3.49Å; S499-V503 PolarHBondContact O-N 3.12Å
500	L	81.1	Confident	90.6	Very high	123 Å²	123	52 Å²	52	64%	0.644	28%	0.283	S	S	*	.	H	α-helix	trans	-54.6	-34.6	179.5	-63.6	177.7	0	0	0	113.5	M498 V502 K536	M498-L500 VanDerWaalsContact C-N 3.31Å; M498-L500 PolarHBondContact O-N 3.33Å; L500-V502 VanDerWaalsContact C-N 3.31Å; L500-V502 PolarHBondContact O-N 3.49Å; L500-K536 WeakPolarHBondContact CD2-O 3.46Å
501	A	83.8	Confident	90.6	Very high	80 Å²	80	53.7 Å²	53.7	66%	0.661	29%	0.292	S	S	*	.	H	α-helix	trans	-73.4	-22.5	179.3	0	0	0	0	0	113.1	M498 S499 V505	M498-A501 PolarHBondContact O-N 2.94Å; M498-A501 VanDerWaalsContact O-N 3.13Å; S499-A501 PolarHBondContact O-N 3.24Å; S499-A501 VanDerWaalsContact O-N 3.17Å; A501-V505 WeakPolarHBondContact O-CG2 3.29Å
502	V	89.8	Confident	90.6	Very high	13 Å²	13	50.2 Å²	50.2	8%	0.079	28%	0.276	C	S	.	.	H	α-helix	trans	-100	-30.2	-174.9	-176.4	0	0	0	0	112.4	Y466 L478 S499 L500 N504 V505	Y466-V502 HydrophobicContact CD2-CB 4.32Å; Y466-V502 HydrophobicContact CD2-CG1 4.01Å; Y466-V502 HydrophobicContact CD2-CG2 4.19Å; Y466-V502 HydrophobicContact CE2-CB 3.87Å; Y466-V502 HydrophobicContact CE2-CG1 4.08Å; Y466-V502 HydrophobicContact CE2-CG2 3.66Å; L478-V502 HydrophobicContact CB-CG1 4.29Å; L478-V502 HydrophobicContact CD2-CG1 4.3Å; S499-V502 PolarHBondContact O-N 3.48Å; L500-V502 VanDerWaalsContact C-N 3.31Å; L500-V502 PolarHBondContact O-N 3.49Å; V502-N504 VanDerWaalsContact C-N 3.31Å; V502-N504 PolarHBondContact O-N 3.28Å; V502-V505 WeakPolarHBondContact O-CB 3.3Å; V502-V505 WeakPolarHBondContact O-CG2 3.22Å; V502-V505 PolarHBondContact O-N 3Å; V502-V505 VanDerWaalsContact O-N 3.16Å
503	V	91.5	Very high	90.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-53.3	-42.3	-175.6	164	0	0	0	0	113.9	L478 L494 S499 K536 A538	L478-V503 HydrophobicContact CD2-CG2 4.27Å; L494-V503 HydrophobicContact CD2-CG2 3.28Å; S499-V503 WeakPolarHBondContact O-CG2 3.49Å; S499-V503 PolarHBondContact O-N 3.12Å; V503-K536 HydrophobicContact CG2-CB 4.49Å; V503-A538 VanDerWaalsContact CG1-CA 3.45Å; V503-A538 HydrophobicContact CG1-CB 3.58Å
504	N	93.4	Very high	90.7	Very high	47 Å²	47	49.5 Å²	49.5	25%	0.251	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	13.2	-176.2	-67.1	-50.5	0	0	0	113.8	V502 G537 A538 D539 M542	V502-N504 VanDerWaalsContact C-N 3.31Å; V502-N504 PolarHBondContact O-N 3.28Å; N504-G537 PolarHBondContact ND2-O 3.5Å; N504-A538 WeakPolarHBondContact OD1-CA 3.18Å; N504-D539 PolarHBondContact OD1-N 3.04Å; N504-M542 HydrophobicContact CB-CE 3.88Å
505	V	94.9	Very high	90.8	Very high	35 Å²	35	49.5 Å²	49.5	21%	0.212	27%	0.272	C	S	.	.			trans	-61.7	141.1	171.1	172.5	0	0	0	0	109.4	K469 T476 H479 A501 V502 T512	K469-V505 VanDerWaalsContact CE-CG1 3.41Å; T476-V505 HydrophobicContact CG2-CG1 3.93Å; H479-V505 PolarHBondContact CE1-O 3.33Å; H479-V505 PolarHBondContact NE2-O 3.08Å; A501-V505 WeakPolarHBondContact O-CG2 3.29Å; V502-V505 WeakPolarHBondContact O-CB 3.3Å; V502-V505 WeakPolarHBondContact O-CG2 3.22Å; V502-V505 PolarHBondContact O-N 3Å; V502-V505 VanDerWaalsContact O-N 3.16Å; V505-T512 WeakPolarHBondContact O-CA 3.27Å
506	K	95.1	Very high	91.1	Very high	63 Å²	63	44.9 Å²	44.9	27%	0.274	25%	0.251	S	S	.	.	B	Isolated β-bridge	trans	-100.8	144.1	175.3	-64.2	-175.7	179.4	-166.8	0	112.1	K469 G510 N511 T512 M542 R543 F545	K469-K506 WeakPolarHBondContact CE-O 3.29Å; K469-K506 PolarHBondContact NZ-O 2.73Å; K506-G510 VanDerWaalsContact CD-O 3.27Å; K506-G510 WeakPolarHBondContact CD-O 3.33Å; K506-G510 VanDerWaalsContact CG-O 3.3Å; K506-G510 WeakPolarHBondContact CG-O 3.33Å; K506-N511 CarbonylContact C-O 3.53Å; K506-N511 WeakPolarHBondContact CA-O 3.25Å; K506-T512 HydrophobicContact CG-CG2 3.87Å; K506-M542 HydrophobicContact CD-SD 4.48Å; K506-M542 WeakPolarHBondContact CE-SD 3.39Å; K506-M542 HydrophobicContact CG-SD 4.4Å; K506-R543 WeakPolarHBondContact CE-O 3.39Å; K506-R543 PolarHBondContact NZ-O 3.44Å; K506-F545 HydrophobicContact CD-CE1 4.49Å
507	T	95.9	Very high	91.4	Very high	7 Å²	7	41.6 Å²	41.6	4%	0.043	24%	0.236	C	C	.	.			trans	-66.9	178.9	166.4	63.6	0	0	0	0	112.4	R475 H479 S509 G510 N511 I516	R475-T507 HydrophobicContact CG-CG2 3.65Å; H479-T507 VanDerWaalsContact CD2-CG2 3.44Å; H479-T507 WeakPolarHBondContact CD2-CG2 3.48Å; T507-S509 PolarHBondContact O-N 3.26Å; T507-S509 PolarHBondContact OG1-N 3.11Å; T507-S509 PolarHBondContact OG1-OG 3.02Å; T507-G510 PolarHBondContact O-N 2.86Å; T507-G510 PolarHBondContact OG1-N 2.93Å; T507-N511 WeakPolarHBondContact CG2-O 3.21Å; T507-N511 PolarHBondContact N-O 3.1Å; T507-N511 PolarHBondContact OG1-N 3.4Å; T507-N511 PolarHBondContact OG1-O 2.95Å; T507-I516 HydrophobicContact CG2-CD1 4.46Å
508	F	94.8	Very high	92	Very high	115 Å²	115	35.9 Å²	35.9	50%	0.504	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-17.3	168.9	-61.2	-26.8	0	0	0	113.6	S473 G474 G510 F545	S473-F508 PolarHBondContact O-N 3.49Å; S473-F508 VanDerWaalsContact O-N 3.12Å; G474-F508 VanDerWaalsContact N-CD2 3.28Å; G474-F508 VanDerWaalsContact N-CE2 3.27Å; F508-G510 VanDerWaalsContact C-N 3.32Å; F508-F545 WeakPolarHBondContact O-CD2 3.46Å; F508-F545 WeakPolarHBondContact O-CE2 3.43Å
509	S	93.1	Very high	92.7	Very high	62 Å²	62	31.8 Å²	31.8	43%	0.434	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	7.5	169.8	72.9	0	0	0	0	113.4	T507 N511 F545	T507-S509 PolarHBondContact O-N 3.26Å; T507-S509 PolarHBondContact OG1-N 3.11Å; T507-S509 PolarHBondContact OG1-OG 3.02Å; S509-N511 PolarHBondContact O-N 2.92Å; S509-N511 VanDerWaalsContact O-N 3.17Å; S509-N511 PolarHBondContact OG-ND2 2.99Å; S509-F545 VanDerWaalsContact C-CD2 3.46Å; S509-F545 PolarHBondContact O-N 3.13Å
510	G	94.4	Very high	93.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.185	C	C	.	.	S	Bend	trans	75.8	-5.5	-178.7	0	0	0	0	0	115.1	K506 T507 F508 N544	K506-G510 VanDerWaalsContact CD-O 3.27Å; K506-G510 WeakPolarHBondContact CD-O 3.33Å; K506-G510 VanDerWaalsContact CG-O 3.3Å; K506-G510 WeakPolarHBondContact CG-O 3.33Å; T507-G510 PolarHBondContact O-N 2.86Å; T507-G510 PolarHBondContact OG1-N 2.93Å; F508-G510 VanDerWaalsContact C-N 3.32Å; G510-N544 WeakPolarHBondContact O-CA 3.41Å
511	N	95.6	Very high	93.5	Very high	35 Å²	35	32.4 Å²	32.4	19%	0.187	18%	0.182	C	C	.	.			trans	-69.8	136.9	-179.9	-72.2	-35.7	0	0	0	110.6	H479 K506 T507 S509 H515 N544	H479-N511 PolarHBondContact NE2-O 3.37Å; K506-N511 CarbonylContact C-O 3.53Å; K506-N511 WeakPolarHBondContact CA-O 3.25Å; T507-N511 WeakPolarHBondContact CG2-O 3.21Å; T507-N511 PolarHBondContact N-O 3.1Å; T507-N511 PolarHBondContact OG1-N 3.4Å; T507-N511 PolarHBondContact OG1-O 2.95Å; S509-N511 PolarHBondContact O-N 2.92Å; S509-N511 VanDerWaalsContact O-N 3.17Å; S509-N511 PolarHBondContact OG-ND2 2.99Å; N511-H515 HydrophobicContact CB-CB 3.9Å; N511-N544 WeakPolarHBondContact OD1-CB 3.29Å; N511-N544 PolarHBondContact OD1-ND2 2.79Å
512	T	95.8	Very high	93.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-89.8	170.9	165.9	66.8	0	0	0	0	110.9	V505 K506 L514 H515 I516 M542	V505-T512 WeakPolarHBondContact O-CA 3.27Å; K506-T512 HydrophobicContact CG-CG2 3.87Å; T512-L514 PolarHBondContact O-N 3.48Å; T512-L514 VanDerWaalsContact O-N 3.16Å; T512-L514 PolarHBondContact OG1-N 2.83Å; T512-H515 PolarHBondContact N-ND1 3.36Å; T512-H515 WeakPolarHBondContact O-CB 3.36Å; T512-H515 PolarHBondContact O-N 2.86Å; T512-H515 PolarHBondContact OG1-ND1 3.14Å; T512-I516 PolarHBondContact O-N 2.97Å; T512-M542 HydrophobicContact CG2-SD 3.7Å
513	A	95.7	Very high	93.2	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-52.6	-35.5	171.2	0	0	0	0	0	112.5	L478 H479 A482 I516 V517 L533	L478-A513 HydrophobicContact CD2-CB 4.07Å; L478-A513 HydrophobicContact CG-CB 4.13Å; H479-A513 PolarHBondContact CD2-N 3.22Å; H479-A513 PolarHBondContact NE2-N 2.92Å; A482-A513 HydrophobicContact CB-CB 4.22Å; A513-I516 PolarHBondContact O-N 3.26Å; A513-V517 WeakPolarHBondContact O-CG2 3.48Å; A513-V517 PolarHBondContact O-N 3.32Å; A513-L533 HydrophobicContact CB-CD1 4.39Å; A513-L533 HydrophobicContact CB-CD2 4.24Å
514	L	95.5	Very high	92.8	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-66.9	-36.2	176.5	-168.6	63.1	0	0	0	113	T512 S518 V530 L533 M534 A538 P550 L567	T512-L514 PolarHBondContact O-N 3.48Å; T512-L514 VanDerWaalsContact O-N 3.16Å; T512-L514 PolarHBondContact OG1-N 2.83Å; L514-S518 VanDerWaalsContact O-CB 3.26Å; L514-S518 WeakPolarHBondContact O-CB 3.33Å; L514-S518 PolarHBondContact O-N 3.46Å; L514-S518 VanDerWaalsContact O-N 3.07Å; L514-S518 PolarHBondContact O-OG 3.08Å; L514-V530 HydrophobicContact CD1-CG1 4.18Å; L514-L533 HydrophobicContact CD1-CB 4.1Å; L514-L533 HydrophobicContact CD1-CD1 4.25Å; L514-M534 HydrophobicContact CD1-SD 4.27Å; L514-M534 HydrophobicContact CD2-SD 3.72Å; L514-A538 HydrophobicContact CB-CB 4.29Å; L514-A538 HydrophobicContact CD1-CB 4.42Å; L514-A538 HydrophobicContact CD2-CB 3.97Å; L514-A538 HydrophobicContact CG-CB 4.47Å; L514-P550 HydrophobicContact CD2-CB 4.37Å; L514-P550 HydrophobicContact CD2-CG 4.19Å; L514-P550 HydrophobicContact CG-CB 4.14Å; L514-P550 HydrophobicContact CG-CG 4.26Å; L514-L567 HydrophobicContact CD1-CD2 3.93Å; L514-L567 HydrophobicContact CD2-CD2 3.88Å; L514-L567 HydrophobicContact CG-CD2 4.04Å
515	H	95.4	Very high	92.6	Very high	1 Å²	1	49 Å²	49	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-62.5	-46	172.9	-68.6	72.8	0	0	0	110.4	N511 T512 S518 S519 M542 N544 E548 L553	N511-H515 HydrophobicContact CB-CB 3.9Å; T512-H515 PolarHBondContact N-ND1 3.36Å; T512-H515 WeakPolarHBondContact O-CB 3.36Å; T512-H515 PolarHBondContact O-N 2.86Å; T512-H515 PolarHBondContact OG1-ND1 3.14Å; H515-S518 PolarHBondContact O-N 3.02Å; H515-S519 PolarHBondContact O-N 3.38Å; H515-S519 VanDerWaalsContact O-N 3.09Å; H515-M542 PolarHBondContact CE1-O 3.2Å; H515-M542 PolarHBondContact NE2-O 3.25Å; H515-N544 PolarHBondContact NE2-N 3.46Å; H515-E548 PolarHBondContact NE2-O 3.27Å; H515-L553 HydrophobicContact CB-CD1 3.84Å
516	I	95.6	Very high	92.5	Very high	24 Å²	24	47.4 Å²	47.4	12%	0.123	23%	0.23	C	C	.	.	H	α-helix	trans	-61.2	-50.1	-179.6	-63.6	-178.7	0	0	0	111.3	H479 A482 E483 T507 T512 A513 S518 S519 L520	H479-I516 HydrophobicContact CB-CD1 3.88Å; A482-I516 HydrophobicContact CB-CB 4.21Å; A482-I516 HydrophobicContact CB-CG2 4.02Å; E483-I516 HydrophobicContact CB-CG2 4.28Å; T507-I516 HydrophobicContact CG2-CD1 4.46Å; T512-I516 PolarHBondContact O-N 2.97Å; A513-I516 PolarHBondContact O-N 3.26Å; I516-S518 PolarHBondContact O-N 3.34Å; I516-S519 PolarHBondContact O-N 3.12Å; I516-S519 PolarHBondContact O-OG 3.09Å; I516-S519 VanDerWaalsContact O-OG 3.1Å; I516-L520 WeakPolarHBondContact O-CG 3.3Å
517	V	95.3	Very high	92.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.4	-34.4	177.7	-173.8	0	0	0	0	111.3	A482 A513 L520 Q526 A529 V530 L533	A482-V517 HydrophobicContact CB-CG2 3.57Å; A513-V517 WeakPolarHBondContact O-CG2 3.48Å; A513-V517 PolarHBondContact O-N 3.32Å; V517-L520 HydrophobicContact CG1-CD1 4.45Å; V517-L520 WeakPolarHBondContact O-CB 3.4Å; V517-L520 WeakPolarHBondContact O-CG 3.47Å; V517-L520 PolarHBondContact O-N 3.13Å; V517-Q526 HydrophobicContact CG1-CG 4.05Å; V517-Q526 WeakPolarHBondContact O-CG 3.18Å; V517-Q526 PolarHBondContact O-NE2 3.49Å; V517-A529 HydrophobicContact CG1-CB 3.59Å; V517-A529 HydrophobicContact CG2-CB 4.31Å; V517-V530 HydrophobicContact CB-CG2 4.19Å; V517-V530 HydrophobicContact CG1-CG2 3.61Å; V517-L533 HydrophobicContact CB-CD1 4.37Å; V517-L533 HydrophobicContact CG2-CD1 3.65Å
518	S	93.8	Very high	92.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-66.9	-37.6	-178.6	-61.1	0	0	0	0	113	L514 H515 I516 L520 Q526 P550 V554 P555 L567	L514-S518 VanDerWaalsContact O-CB 3.26Å; L514-S518 WeakPolarHBondContact O-CB 3.33Å; L514-S518 PolarHBondContact O-N 3.46Å; L514-S518 VanDerWaalsContact O-N 3.07Å; L514-S518 PolarHBondContact O-OG 3.08Å; H515-S518 PolarHBondContact O-N 3.02Å; I516-S518 PolarHBondContact O-N 3.34Å; S518-L520 VanDerWaalsContact C-N 3.27Å; S518-L520 PolarHBondContact O-N 2.99Å; S518-Q526 PolarHBondContact O-NE2 3.47Å; S518-Q526 VanDerWaalsContact O-NE2 3.14Å; S518-P550 WeakPolarHBondContact CB-O 3.34Å; S518-V554 WeakPolarHBondContact O-CA 3.3Å; S518-P555 VanDerWaalsContact O-CD 3.29Å; S518-P555 WeakPolarHBondContact O-CD 3.5Å; S518-L567 WeakPolarHBondContact OG-CD1 3.41Å
519	S	94	Very high	92.3	Very high	52 Å²	52	43.2 Å²	43.2	36%	0.364	21%	0.214	S	C	.	.	H	α-helix	trans	-75.8	-8.3	-179.9	63	0	0	0	0	115	H515 I516 L553	H515-S519 PolarHBondContact O-N 3.38Å; H515-S519 VanDerWaalsContact O-N 3.09Å; I516-S519 PolarHBondContact O-N 3.12Å; I516-S519 PolarHBondContact O-OG 3.09Å; I516-S519 VanDerWaalsContact O-OG 3.1Å; S519-L553 WeakPolarHBondContact CA-O 3.4Å
520	L	92.3	Very high	92.4	Very high	17 Å²	17	40.3 Å²	40.3	9%	0.089	19%	0.194	C	C	.	.			trans	-65.8	139.7	-175.5	-63.6	-172.7	0	0	0	113.9	E483 A485 I516 V517 S518 Y523 Q526 P555	E483-L520 VanDerWaalsContact O-CD2 3.28Å; E483-L520 WeakPolarHBondContact O-CD2 3.48Å; A485-L520 HydrophobicContact CB-CD1 3.8Å; I516-L520 WeakPolarHBondContact O-CG 3.3Å; V517-L520 HydrophobicContact CG1-CD1 4.45Å; V517-L520 WeakPolarHBondContact O-CB 3.4Å; V517-L520 WeakPolarHBondContact O-CG 3.47Å; V517-L520 PolarHBondContact O-N 3.13Å; S518-L520 VanDerWaalsContact C-N 3.27Å; S518-L520 PolarHBondContact O-N 2.99Å; L520-Y523 HydrophobicContact CB-CD2 3.59Å; L520-Y523 HydrophobicContact CB-CE2 3.92Å; L520-Y523 HydrophobicContact CB-CG 4.31Å; L520-Y523 HydrophobicContact CD1-CD1 4.38Å; L520-Y523 HydrophobicContact CD1-CD2 3.96Å; L520-Y523 HydrophobicContact CD1-CE2 4.08Å; L520-Y523 HydrophobicContact CD1-CG 4.07Å; L520-Y523 HydrophobicContact CD2-CD2 4.39Å; L520-Y523 HydrophobicContact CD2-CE2 3.86Å; L520-Y523 HydrophobicContact CG-CD2 4.18Å; L520-Y523 HydrophobicContact CG-CE2 4.15Å; L520-Q526 HydrophobicContact CB-CG 4.4Å; L520-Q526 PolarHBondContact O-NE2 2.92Å; L520-Q526 PolarHBondContact O-OE1 2.72Å; L520-P555 WeakPolarHBondContact O-CG 3.49Å
521	Q	87.4	Confident	92.3	Very high	128 Å²	128	43.6 Å²	43.6	60%	0.598	21%	0.208	S	C	*	.			trans	-108.9	134.6	177.5	-66.6	179.9	15.8	0	0	112.1	R432 Y523 P555	R432-Q521 PolarHBondContact NH2-O 2.94Å; Q521-Y523 VanDerWaalsContact C-N 3.26Å; Q521-Y523 WeakPolarHBondContact O-CD2 3.39Å; Q521-Y523 PolarHBondContact O-N 3.1Å; Q521-P555 HydrophobicContact CG-CB 3.81Å; Q521-P555 HydrophobicContact CG-CG 3.76Å
522	N	80.7	Confident	92.2	Very high	140 Å²	140	42.3 Å²	42.3	75%	0.749	20%	0.201	S	C	*	.	S	Bend	trans	59.2	24.2	173.6	-57.1	-41.5	0	0	0	116	R432	R432-N522 PolarHBondContact NH2-O 3.41Å
523	Y	86.3	Confident	92.1	Very high	29 Å²	29	42.3 Å²	42.3	11%	0.114	20%	0.201	C	C	.	.			trans	-89.4	115	174.1	-75.7	-101.1	0	0	0	110.6	R432 E483 E484 A485 L520 Q521 N525 Q526	R432-Y523 VanDerWaalsContact NH1-CE2 3.34Å; R432-Y523 PolarHBondContact NH1-OH 2.77Å; E483-Y523 PolarHBondContact O-OH 3.04Å; E484-Y523 HydrophobicContact CB-CE1 4.42Å; E484-Y523 WeakPolarHBondContact O-CE1 3.46Å; E484-Y523 WeakPolarHBondContact OE2-CE1 3.29Å; E484-Y523 PolarHBondContact OE2-OH 2.83Å; A485-Y523 HydrophobicContact CB-CD1 3.95Å; A485-Y523 HydrophobicContact CB-CG 4.33Å; L520-Y523 HydrophobicContact CB-CD2 3.59Å; L520-Y523 HydrophobicContact CB-CE2 3.92Å; L520-Y523 HydrophobicContact CB-CG 4.31Å; L520-Y523 HydrophobicContact CD1-CD1 4.38Å; L520-Y523 HydrophobicContact CD1-CD2 3.96Å; L520-Y523 HydrophobicContact CD1-CE2 4.08Å; L520-Y523 HydrophobicContact CD1-CG 4.07Å; L520-Y523 HydrophobicContact CD2-CD2 4.39Å; L520-Y523 HydrophobicContact CD2-CE2 3.86Å; L520-Y523 HydrophobicContact CG-CD2 4.18Å; L520-Y523 HydrophobicContact CG-CE2 4.15Å; Q521-Y523 VanDerWaalsContact C-N 3.26Å; Q521-Y523 WeakPolarHBondContact O-CD2 3.39Å; Q521-Y523 PolarHBondContact O-N 3.1Å; Y523-N525 PolarHBondContact O-N 3.14Å; Y523-N525 VanDerWaalsContact O-N 3.13Å; Y523-Q526 VanDerWaalsContact O-CB 3.3Å; Y523-Q526 WeakPolarHBondContact O-CB 3.48Å; Y523-Q526 PolarHBondContact O-N 3.26Å; Y523-Q526 VanDerWaalsContact O-N 3.12Å
524	R	84.1	Confident	92	Very high	240 Å²	240	45.1 Å²	45.1	91%	0.906	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54	-34.1	176.8	-72	-178.1	176.7	160.3	0.3	113
525	N	89.7	Confident	91.8	Very high	79 Å²	79	53.1 Å²	53.1	42%	0.422	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-8.2	-175.6	-65.7	-0.1	0	0	0	114.3	A485 I487 Y523 V527 E528 A529	A485-N525 HydrophobicContact CB-CB 4.05Å; I487-N525 HydrophobicContact CD1-CB 4.14Å; I487-N525 HydrophobicContact CG1-CB 3.84Å; Y523-N525 PolarHBondContact O-N 3.14Å; Y523-N525 VanDerWaalsContact O-N 3.13Å; N525-V527 VanDerWaalsContact C-N 3.31Å; N525-V527 PolarHBondContact O-N 3.27Å; N525-E528 PolarHBondContact O-N 3.08Å; N525-E528 VanDerWaalsContact O-N 3.09Å; N525-A529 PolarHBondContact O-N 3.22Å
526	Q	92.6	Very high	91.6	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.009	26%	0.258	C	S	.	.	H	α-helix	trans	-53.2	-45.8	-171.7	-171.2	-175.9	20.9	0	0	112.9	V517 S518 L520 Y523 E528 A529 V530 V559 V563	V517-Q526 HydrophobicContact CG1-CG 4.05Å; V517-Q526 WeakPolarHBondContact O-CG 3.18Å; V517-Q526 PolarHBondContact O-NE2 3.49Å; S518-Q526 PolarHBondContact O-NE2 3.47Å; S518-Q526 VanDerWaalsContact O-NE2 3.14Å; L520-Q526 HydrophobicContact CB-CG 4.4Å; L520-Q526 PolarHBondContact O-NE2 2.92Å; L520-Q526 PolarHBondContact O-OE1 2.72Å; Y523-Q526 VanDerWaalsContact O-CB 3.3Å; Y523-Q526 WeakPolarHBondContact O-CB 3.48Å; Y523-Q526 PolarHBondContact O-N 3.26Å; Y523-Q526 VanDerWaalsContact O-N 3.12Å; Q526-E528 VanDerWaalsContact C-N 3.32Å; Q526-E528 PolarHBondContact O-N 3.13Å; Q526-A529 PolarHBondContact O-N 2.88Å; Q526-V530 WeakPolarHBondContact O-CG2 3.23Å; Q526-V530 PolarHBondContact O-N 3.25Å; Q526-V559 HydrophobicContact CB-CG1 4.42Å; Q526-V563 HydrophobicContact CG-CG2 4.04Å
527	V	92.4	Very high	91.3	Very high	27 Å²	27	56.9 Å²	56.9	16%	0.164	27%	0.272	C	S	.	.	H	α-helix	trans	-61.3	-40.1	-178.4	-179.9	0	0	0	0	111.7	N525 K531 V559 K562 V563 I566	N525-V527 VanDerWaalsContact C-N 3.31Å; N525-V527 PolarHBondContact O-N 3.27Å; V527-K531 HydrophobicContact CG1-CD 4.46Å; V527-K531 WeakPolarHBondContact O-CG 3.39Å; V527-K531 PolarHBondContact O-N 3.35Å; V527-K531 VanDerWaalsContact O-N 3.08Å; V527-V559 HydrophobicContact CG2-CG1 3.8Å; V527-K562 HydrophobicContact CG2-CB 4.39Å; V527-V563 HydrophobicContact CG2-CG2 4.06Å; V527-I566 HydrophobicContact CG1-CD1 3.75Å
528	E	93.4	Very high	91.2	Very high	71 Å²	71	57.2 Å²	57.2	33%	0.332	28%	0.275	S	S	.	.	H	α-helix	trans	-80.7	-31.8	-179.3	-153.6	60.6	-142.8	0	0	111.9	I487 N525 Q526 K531 L532 R535	I487-E528 HydrophobicContact CD1-CB 4.24Å; N525-E528 PolarHBondContact O-N 3.08Å; N525-E528 VanDerWaalsContact O-N 3.09Å; Q526-E528 VanDerWaalsContact C-N 3.32Å; Q526-E528 PolarHBondContact O-N 3.13Å; E528-K531 PolarHBondContact O-N 3.13Å; E528-K531 WeakPolarHBondContact OE2-CD 3.45Å; E528-K531 IonicContact OE2-NZ 3.8Å; E528-K531 PolarHBondContact OE2-NZ 2.98Å; E528-L532 VanDerWaalsContact O-CB 3.22Å; E528-L532 WeakPolarHBondContact O-CB 3.29Å; E528-L532 PolarHBondContact O-N 3.23Å; E528-R535 IonicContact OE1-CZ 3.88Å; E528-R535 IonicContact OE1-NH1 3.04Å; E528-R535 PolarHBondContact OE1-NH1 2.98Å; E528-R535 IonicContact OE1-NH2 2.73Å; E528-R535 PolarHBondContact OE1-NH2 3.43Å
529	A	94.9	Very high	91	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.9	-42.7	170.3	0	0	0	0	0	111.8	A485 I487 L490 V517 N525 Q526 L532 L533	A485-A529 HydrophobicContact CB-CB 4.34Å; I487-A529 HydrophobicContact CD1-CB 3.72Å; L490-A529 HydrophobicContact CD1-CB 3.73Å; V517-A529 HydrophobicContact CG1-CB 3.59Å; V517-A529 HydrophobicContact CG2-CB 4.31Å; N525-A529 PolarHBondContact O-N 3.22Å; Q526-A529 PolarHBondContact O-N 2.88Å; A529-L532 PolarHBondContact O-N 3.48Å; A529-L533 WeakPolarHBondContact O-CG 3.42Å; A529-L533 PolarHBondContact O-N 2.97Å
530	V	94.4	Very high	90.9	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.2	-49	173.2	171.8	0	0	0	0	111	L514 V517 Q526 L532 L533 M534 V563 I566 L567	L514-V530 HydrophobicContact CD1-CG1 4.18Å; V517-V530 HydrophobicContact CB-CG2 4.19Å; V517-V530 HydrophobicContact CG1-CG2 3.61Å; Q526-V530 WeakPolarHBondContact O-CG2 3.23Å; Q526-V530 PolarHBondContact O-N 3.25Å; V530-L532 VanDerWaalsContact C-N 3.31Å; V530-L532 PolarHBondContact O-N 2.96Å; V530-L533 PolarHBondContact O-N 3Å; V530-M534 HydrophobicContact CG1-CG 4.21Å; V530-M534 VanDerWaalsContact O-CG 3.27Å; V530-M534 WeakPolarHBondContact O-CG 3.45Å; V530-M534 PolarHBondContact O-N 3.39Å; V530-V563 HydrophobicContact CG1-CG1 4.42Å; V530-V563 HydrophobicContact CG2-CG1 3.93Å; V530-V563 HydrophobicContact CG2-CG2 4.33Å; V530-I566 HydrophobicContact CG1-CG2 4.03Å; V530-L567 HydrophobicContact CG1-CD2 3.92Å; V530-L567 HydrophobicContact CG1-CG 4.19Å
531	K	93.2	Very high	90.8	Very high	69 Å²	69	61 Å²	61	30%	0.3	31%	0.305	S	S	.	.	H	α-helix	trans	-58.7	-41.9	176.8	-73.4	166.1	-179.8	175	0	112.5	V527 E528 M534 R535 I566	V527-K531 HydrophobicContact CG1-CD 4.46Å; V527-K531 WeakPolarHBondContact O-CG 3.39Å; V527-K531 PolarHBondContact O-N 3.35Å; V527-K531 VanDerWaalsContact O-N 3.08Å; E528-K531 PolarHBondContact O-N 3.13Å; E528-K531 WeakPolarHBondContact OE2-CD 3.45Å; E528-K531 IonicContact OE2-NZ 3.8Å; E528-K531 PolarHBondContact OE2-NZ 2.98Å; K531-M534 PolarHBondContact O-N 2.76Å; K531-R535 VanDerWaalsContact O-CB 3.3Å; K531-R535 WeakPolarHBondContact O-CB 3.38Å; K531-R535 WeakPolarHBondContact O-CG 3.45Å; K531-R535 PolarHBondContact O-N 3.31Å; K531-I566 HydrophobicContact CG-CD1 4.1Å
532	L	94.3	Very high	91	Very high	9 Å²	9	57 Å²	57	5%	0.047	29%	0.287	C	S	.	.	H	α-helix	trans	-63.1	-45.2	179.3	179	61.5	0	0	0	111.2	L490 H491 L494 E528 A529 V530 K536	L490-L532 HydrophobicContact CB-CD2 3.68Å; H491-L532 VanDerWaalsContact CD2-CD2 3.4Å; H491-L532 WeakPolarHBondContact CD2-CD2 3.48Å; L494-L532 HydrophobicContact CD1-CD2 4.21Å; L494-L532 HydrophobicContact CD1-CG 3.89Å; E528-L532 VanDerWaalsContact O-CB 3.22Å; E528-L532 WeakPolarHBondContact O-CB 3.29Å; E528-L532 PolarHBondContact O-N 3.23Å; A529-L532 PolarHBondContact O-N 3.48Å; V530-L532 VanDerWaalsContact C-N 3.31Å; V530-L532 PolarHBondContact O-N 2.96Å; L532-K536 HydrophobicContact CD1-CG 4.41Å; L532-K536 WeakPolarHBondContact O-CB 3.41Å; L532-K536 WeakPolarHBondContact O-CG 3.42Å; L532-K536 PolarHBondContact O-N 3.1Å
533	L	93.8	Very high	91.6	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.2	-48.2	174.1	-75.3	168.2	0	0	0	111.8	L478 L494 A513 L514 V517 A529 V530 R535 K536 G537 A538	L478-L533 HydrophobicContact CD2-CD2 4.44Å; L494-L533 HydrophobicContact CD1-CD2 3.96Å; A513-L533 HydrophobicContact CB-CD1 4.39Å; A513-L533 HydrophobicContact CB-CD2 4.24Å; L514-L533 HydrophobicContact CD1-CB 4.1Å; L514-L533 HydrophobicContact CD1-CD1 4.25Å; V517-L533 HydrophobicContact CB-CD1 4.37Å; V517-L533 HydrophobicContact CG2-CD1 3.65Å; A529-L533 WeakPolarHBondContact O-CG 3.42Å; A529-L533 PolarHBondContact O-N 2.97Å; V530-L533 PolarHBondContact O-N 3Å; L533-R535 PolarHBondContact O-N 3.21Å; L533-K536 CarbonylContact O-C 3.57Å; L533-K536 WeakPolarHBondContact O-CA 3.49Å; L533-K536 PolarHBondContact O-N 3.04Å; L533-G537 PolarHBondContact O-N 3.3Å; L533-A538 VanDerWaalsContact C-CB 3.47Å; L533-A538 HydrophobicContact CB-CB 3.83Å; L533-A538 WeakPolarHBondContact O-CB 3.35Å; L533-A538 PolarHBondContact O-N 2.95Å
534	M	92.1	Very high	91.9	Very high	59 Å²	59	54.4 Å²	54.4	29%	0.291	27%	0.267	S	S	.	.	H	α-helix	trans	-60.1	-45.4	177.9	-67.1	-62.5	-61.7	0	0	112	L514 V530 K531 K536 G537 L567	L514-M534 HydrophobicContact CD1-SD 4.27Å; L514-M534 HydrophobicContact CD2-SD 3.72Å; V530-M534 HydrophobicContact CG1-CG 4.21Å; V530-M534 VanDerWaalsContact O-CG 3.27Å; V530-M534 WeakPolarHBondContact O-CG 3.45Å; V530-M534 PolarHBondContact O-N 3.39Å; K531-M534 PolarHBondContact O-N 2.76Å; M534-K536 PolarHBondContact O-N 3.24Å; M534-K536 VanDerWaalsContact O-N 3.14Å; M534-G537 PolarHBondContact O-N 3.42Å; M534-G537 VanDerWaalsContact O-N 3.16Å; M534-L567 HydrophobicContact SD-CD2 4.04Å
535	R	91.5	Very high	92.3	Very high	168 Å²	168	49.5 Å²	49.5	63%	0.634	25%	0.252	S	S	*	.	H	α-helix	trans	-60	-20.9	173.8	-75	170.4	-177.8	143.2	-2.4	113.4	E528 K531 L533	E528-R535 IonicContact OE1-CZ 3.88Å; E528-R535 IonicContact OE1-NH1 3.04Å; E528-R535 PolarHBondContact OE1-NH1 2.98Å; E528-R535 IonicContact OE1-NH2 2.73Å; E528-R535 PolarHBondContact OE1-NH2 3.43Å; K531-R535 VanDerWaalsContact O-CB 3.3Å; K531-R535 WeakPolarHBondContact O-CB 3.38Å; K531-R535 WeakPolarHBondContact O-CG 3.45Å; K531-R535 PolarHBondContact O-N 3.31Å; L533-R535 PolarHBondContact O-N 3.21Å
536	K	91.9	Very high	92.5	Very high	64 Å²	64	53 Å²	53	28%	0.278	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	20.7	-178.5	-66.4	-78.3	-173.2	167.9	0	112.5	L494 L500 V503 L532 L533 M534	L494-K536 HydrophobicContact CB-CD 4.12Å; L494-K536 HydrophobicContact CB-CG 3.98Å; L494-K536 HydrophobicContact CD1-CB 4.43Å; L494-K536 HydrophobicContact CD1-CG 4.33Å; L494-K536 HydrophobicContact CD2-CB 4.34Å; L494-K536 WeakPolarHBondContact O-CD 3.36Å; L494-K536 VanDerWaalsContact O-CE 3.23Å; L494-K536 WeakPolarHBondContact O-CE 3.45Å; L494-K536 PolarHBondContact O-NZ 3.34Å; L500-K536 WeakPolarHBondContact CD2-O 3.46Å; V503-K536 HydrophobicContact CG2-CB 4.49Å; L532-K536 HydrophobicContact CD1-CG 4.41Å; L532-K536 WeakPolarHBondContact O-CB 3.41Å; L532-K536 WeakPolarHBondContact O-CG 3.42Å; L532-K536 PolarHBondContact O-N 3.1Å; L533-K536 CarbonylContact O-C 3.57Å; L533-K536 WeakPolarHBondContact O-CA 3.49Å; L533-K536 PolarHBondContact O-N 3.04Å; M534-K536 PolarHBondContact O-N 3.24Å; M534-K536 VanDerWaalsContact O-N 3.14Å
537	G	89.8	Confident	92.5	Very high	41 Å²	41	58 Å²	58	42%	0.423	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	86	20.3	170.9	0	0	0	0	0	115.3	N504 L533 M534	N504-G537 PolarHBondContact ND2-O 3.5Å; L533-G537 PolarHBondContact O-N 3.3Å; M534-G537 PolarHBondContact O-N 3.42Å; M534-G537 VanDerWaalsContact O-N 3.16Å
538	A	92.9	Very high	92.5	Very high	7 Å²	7	59.9 Å²	59.9	6%	0.058	30%	0.3	C	S	.	.			trans	-69.5	129.3	172.8	0	0	0	0	0	111.5	V503 N504 L514 L533	V503-A538 VanDerWaalsContact CG1-CA 3.45Å; V503-A538 HydrophobicContact CG1-CB 3.58Å; N504-A538 WeakPolarHBondContact OD1-CA 3.18Å; L514-A538 HydrophobicContact CB-CB 4.29Å; L514-A538 HydrophobicContact CD1-CB 4.42Å; L514-A538 HydrophobicContact CD2-CB 3.97Å; L514-A538 HydrophobicContact CG-CB 4.47Å; L533-A538 VanDerWaalsContact C-CB 3.47Å; L533-A538 HydrophobicContact CB-CB 3.83Å; L533-A538 WeakPolarHBondContact O-CB 3.35Å; L533-A538 PolarHBondContact O-N 2.95Å
539	D	90	Very high	92.6	Very high	71 Å²	71	58 Å²	58	38%	0.38	29%	0.292	S	S	.	.			trans	-86	117.3	-179.6	179.1	10.7	0	0	0	111.3	N504 G541 M542	N504-D539 PolarHBondContact OD1-N 3.04Å; D539-G541 WeakPolarHBondContact OD1-CA 3.37Å; D539-G541 PolarHBondContact OD1-N 3.5Å; D539-M542 HydrophobicContact CB-CB 4.15Å; D539-M542 HydrophobicContact CB-CE 4.1Å; D539-M542 PolarHBondContact OD1-N 3.26Å; D539-M542 WeakPolarHBondContact OD2-CB 3.48Å; D539-M542 PolarHBondContact OD2-N 3.42Å
540	S	90.8	Very high	92.4	Very high	31 Å²	31	58 Å²	58	22%	0.217	29%	0.292	C	S	.	.	S	Bend	trans	-83.5	-9.1	175.9	65.2	0	0	0	0	114.3	L567	S540-L567 PolarHBondContact OG-O 2.97Å; S540-L567 VanDerWaalsContact OG-O 3.1Å
541	G	90.2	Very high	92.3	Very high	47 Å²	47	58.9 Å²	58.9	49%	0.485	30%	0.298	S	S	.	.	S	Bend	trans	-90.5	-13.2	173.2	0	0	0	0	0	114.1	D539 L549	D539-G541 WeakPolarHBondContact OD1-CA 3.37Å; D539-G541 PolarHBondContact OD1-N 3.5Å; G541-L549 WeakPolarHBondContact O-CD2 3.42Å
542	M	91.3	Very high	92.2	Very high	43 Å²	43	60.7 Å²	60.7	21%	0.212	31%	0.308	C	S	.	.			trans	-69.2	136.4	177.6	-162.8	173.9	-58.9	0	0	111.3	N504 K506 T512 H515 D539 P550	N504-M542 HydrophobicContact CB-CE 3.88Å; K506-M542 HydrophobicContact CD-SD 4.48Å; K506-M542 WeakPolarHBondContact CE-SD 3.39Å; K506-M542 HydrophobicContact CG-SD 4.4Å; T512-M542 HydrophobicContact CG2-SD 3.7Å; H515-M542 PolarHBondContact CE1-O 3.2Å; H515-M542 PolarHBondContact NE2-O 3.25Å; D539-M542 HydrophobicContact CB-CB 4.15Å; D539-M542 HydrophobicContact CB-CE 4.1Å; D539-M542 PolarHBondContact OD1-N 3.26Å; D539-M542 WeakPolarHBondContact OD2-CB 3.48Å; D539-M542 PolarHBondContact OD2-N 3.42Å; M542-P550 VanDerWaalsContact O-CD 3.25Å; M542-P550 WeakPolarHBondContact O-CD 3.41Å
543	R	93	Very high	92.1	Very high	104 Å²	104	62.2 Å²	62.2	39%	0.392	32%	0.316	S	S	.	.			trans	-103.7	153.6	178.9	-63.2	-179.9	-177.6	-106.3	0.9	113.9	K506 N547 E548 L549	K506-R543 WeakPolarHBondContact CE-O 3.39Å; K506-R543 PolarHBondContact NZ-O 3.44Å; R543-N547 WeakPolarHBondContact CD-O 3.26Å; R543-N547 WeakPolarHBondContact CD-OD1 3.4Å; R543-N547 PolarHBondContact NH1-O 3.48Å; R543-E548 CarbonylContact C-O 3.6Å; R543-E548 WeakPolarHBondContact CA-O 3.32Å; R543-E548 WeakPolarHBondContact CB-O 3.37Å; R543-L549 HydrophobicContact CG-CD2 3.56Å; R543-L549 HydrophobicContact CG-CG 4Å
544	N	93.7	Very high	92	Very high	10 Å²	10	62.5 Å²	62.5	5%	0.053	32%	0.317	C	S	.	.			trans	-79.1	-172.3	168.7	71.4	6.4	0	0	0	112.3	G510 N511 H515 E546 N547 E548	G510-N544 WeakPolarHBondContact O-CA 3.41Å; N511-N544 WeakPolarHBondContact OD1-CB 3.29Å; N511-N544 PolarHBondContact OD1-ND2 2.79Å; H515-N544 PolarHBondContact NE2-N 3.46Å; N544-E546 WeakPolarHBondContact OD1-CA 3.49Å; N544-E546 WeakPolarHBondContact OD1-CB 3.38Å; N544-E546 PolarHBondContact OD1-N 3.28Å; N544-E546 VanDerWaalsContact OD1-N 3.11Å; N544-N547 PolarHBondContact O-N 3.26Å; N544-N547 PolarHBondContact OD1-N 3.35Å; N544-N547 VanDerWaalsContact OD1-N 3.13Å; N544-E548 PolarHBondContact N-O 3.05Å; N544-E548 PolarHBondContact ND2-OE2 3.05Å; N544-E548 WeakPolarHBondContact OD1-CB 3.13Å; N544-E548 PolarHBondContact OD1-N 3.14Å
545	F	93	Very high	91.9	Very high	138 Å²	138	60.9 Å²	60.9	61%	0.605	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-22	179.1	-63.2	-28.1	0	0	0	113.4	K506 F508 S509 N547	K506-F545 HydrophobicContact CD-CE1 4.49Å; F508-F545 WeakPolarHBondContact O-CD2 3.46Å; F508-F545 WeakPolarHBondContact O-CE2 3.43Å; S509-F545 VanDerWaalsContact C-CD2 3.46Å; S509-F545 PolarHBondContact O-N 3.13Å; F545-N547 PolarHBondContact O-N 3.25Å
546	E	92.8	Very high	91.7	Very high	152 Å²	152	62 Å²	62	71%	0.71	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	6.3	166.5	-56.5	-58	133.5	0	0	112.7	N544 E548	N544-E546 WeakPolarHBondContact OD1-CA 3.49Å; N544-E546 WeakPolarHBondContact OD1-CB 3.38Å; N544-E546 PolarHBondContact OD1-N 3.28Å; N544-E546 VanDerWaalsContact OD1-N 3.11Å; E546-E548 HydrophobicContact CB-CG 3.98Å; E546-E548 PolarHBondContact O-N 3.38Å
547	N	93.1	Very high	91.4	Very high	107 Å²	107	61.2 Å²	61.2	57%	0.572	33%	0.334	S	S	*	.	S	Bend	trans	63	20	-178.5	-169	41	0	0	0	114.2	R543 N544 F545	R543-N547 WeakPolarHBondContact CD-O 3.26Å; R543-N547 WeakPolarHBondContact CD-OD1 3.4Å; R543-N547 PolarHBondContact NH1-O 3.48Å; N544-N547 PolarHBondContact O-N 3.26Å; N544-N547 PolarHBondContact OD1-N 3.35Å; N544-N547 VanDerWaalsContact OD1-N 3.13Å; F545-N547 PolarHBondContact O-N 3.25Å
548	E	93.5	Very high	91.2	Very high	66 Å²	66	63.9 Å²	63.9	31%	0.308	35%	0.346	S	S	.	.			trans	-87	149.5	177.7	-53.3	173.1	106.4	0	0	112	H515 R543 N544 E546 L553	H515-E548 PolarHBondContact NE2-O 3.27Å; R543-E548 CarbonylContact C-O 3.6Å; R543-E548 WeakPolarHBondContact CA-O 3.32Å; R543-E548 WeakPolarHBondContact CB-O 3.37Å; N544-E548 PolarHBondContact N-O 3.05Å; N544-E548 PolarHBondContact ND2-OE2 3.05Å; N544-E548 WeakPolarHBondContact OD1-CB 3.13Å; N544-E548 PolarHBondContact OD1-N 3.14Å; E546-E548 HydrophobicContact CB-CG 3.98Å; E546-E548 PolarHBondContact O-N 3.38Å; E548-L553 WeakPolarHBondContact OE1-CD2 3.49Å; E548-L553 WeakPolarHBondContact OE2-CD2 3.4Å
549	L	93.8	Very high	90.9	Very high	31 Å²	31	66 Å²	66	16%	0.162	36%	0.358	C	S	.	.			trans	-92.9	154	168.7	-67.8	164.4	0	0	0	111.5	G541 R543 C551 Q552 L553	G541-L549 WeakPolarHBondContact O-CD2 3.42Å; R543-L549 HydrophobicContact CG-CD2 3.56Å; R543-L549 HydrophobicContact CG-CG 4Å; L549-C551 PolarHBondContact O-N 3.38Å; L549-C551 VanDerWaalsContact O-N 3.1Å; L549-Q552 HydrophobicContact CB-CG 4.18Å; L549-Q552 WeakPolarHBondContact O-CB 3.47Å; L549-Q552 PolarHBondContact O-N 3.23Å; L549-L553 PolarHBondContact O-N 3.47Å
550	P	92.4	Very high	90.8	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-37.9	172.1	-25.4	31.5	0	0	0	112.8	L514 S518 M542 Q552 L553 V554 L567	L514-P550 HydrophobicContact CD2-CB 4.37Å; L514-P550 HydrophobicContact CD2-CG 4.19Å; L514-P550 HydrophobicContact CG-CB 4.14Å; L514-P550 HydrophobicContact CG-CG 4.26Å; S518-P550 WeakPolarHBondContact CB-O 3.34Å; M542-P550 VanDerWaalsContact O-CD 3.25Å; M542-P550 WeakPolarHBondContact O-CD 3.41Å; P550-Q552 VanDerWaalsContact C-N 3.27Å; P550-Q552 PolarHBondContact O-N 2.92Å; P550-L553 PolarHBondContact O-N 2.63Å; P550-V554 VanDerWaalsContact O-CG2 3.32Å; P550-V554 WeakPolarHBondContact O-CG2 3.46Å; P550-L567 HydrophobicContact CB-CD1 4.27Å; P550-L567 HydrophobicContact CB-CD2 4.45Å
551	C	91.8	Very high	90.6	Very high	20 Å²	20	65.3 Å²	65.3	14%	0.135	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-10.2	-178.7	72.3	0	0	0	0	114.9	L549 R564 L567	L549-C551 PolarHBondContact O-N 3.38Å; L549-C551 VanDerWaalsContact O-N 3.1Å; C551-R564 PolarHBondContact O-NH1 3.34Å; C551-L567 HydrophobicContact CB-CB 3.81Å; C551-L567 HydrophobicContact CB-CD1 4.04Å
552	Q	91.6	Very high	90.5	Very high	106 Å²	106	68.4 Å²	68.4	50%	0.495	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-43.7	172.3	-66.4	175.6	-90.2	0	0	110.6	L549 P550 V554	L549-Q552 HydrophobicContact CB-CG 4.18Å; L549-Q552 WeakPolarHBondContact O-CB 3.47Å; L549-Q552 PolarHBondContact O-N 3.23Å; P550-Q552 VanDerWaalsContact C-N 3.27Å; P550-Q552 PolarHBondContact O-N 2.92Å; Q552-V554 PolarHBondContact O-N 2.98Å
553	L	91.4	Very high	90.4	Very high	42 Å²	42	66.4 Å²	66.4	22%	0.22	34%	0.34	C	S	.	.	S	Bend	trans	-59.6	-15.3	176.6	-72.5	175.5	0	0	0	114.9	H515 S519 E548 L549 P550 P555	H515-L553 HydrophobicContact CB-CD1 3.84Å; S519-L553 WeakPolarHBondContact CA-O 3.4Å; E548-L553 WeakPolarHBondContact OE1-CD2 3.49Å; E548-L553 WeakPolarHBondContact OE2-CD2 3.4Å; L549-L553 PolarHBondContact O-N 3.47Å; P550-L553 PolarHBondContact O-N 2.63Å; L553-P555 WeakPolarHBondContact O-CD 3.43Å
554	V	92.4	Very high	90.2	Very high	5 Å²	5	63.6 Å²	63.6	3%	0.03	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-64.8	121.9	-177.6	-172	0	0	0	0	110.9	S518 P550 Q552 G560 V563 R564 L567	S518-V554 WeakPolarHBondContact O-CA 3.3Å; P550-V554 VanDerWaalsContact O-CG2 3.32Å; P550-V554 WeakPolarHBondContact O-CG2 3.46Å; Q552-V554 PolarHBondContact O-N 2.98Å; V554-G560 VanDerWaalsContact CG1-CA 3.46Å; V554-G560 WeakPolarHBondContact CG1-O 3.49Å; V554-V563 HydrophobicContact CG1-CB 4.04Å; V554-V563 HydrophobicContact CG1-CG1 4.03Å; V554-V563 HydrophobicContact CG2-CG1 3.77Å; V554-R564 PolarHBondContact O-NH1 3.29Å; V554-R564 PolarHBondContact O-NH2 3.07Å; V554-L567 HydrophobicContact CG2-CD1 3.79Å
555	P	90	Very high	90	Very high	25 Å²	25	66.2 Å²	66.2	16%	0.162	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-68	164.1	179.3	29	-35.6	0	0	0	112.1	S518 L520 Q521 L553	S518-P555 VanDerWaalsContact O-CD 3.29Å; S518-P555 WeakPolarHBondContact O-CD 3.5Å; L520-P555 WeakPolarHBondContact O-CG 3.49Å; Q521-P555 HydrophobicContact CG-CB 3.81Å; Q521-P555 HydrophobicContact CG-CG 3.76Å; L553-P555 WeakPolarHBondContact O-CD 3.43Å
556	E	86.3	Confident	89.8	Confident	191 Å²	191	60.6 Å²	60.6	89%	0.893	32%	0.318	S	S	*	.	S	Bend	trans	-73	153.1	176.1	-59.7	-166.5	160.3	0	0	112.2
557	G	86.3	Confident	89.5	Confident	49 Å²	49	53.7 Å²	53.7	51%	0.505	29%	0.286	S	S	.	.	S	Bend	trans	124.1	170.1	-179.6	0	0	0	0	0	114.1	V559 G560 E561	G557-V559 VanDerWaalsContact C-N 3.28Å; G557-V559 PolarHBondContact O-N 2.99Å; G557-G560 PolarHBondContact O-N 3.41Å; G557-E561 PolarHBondContact O-N 3.04Å
558	S	86.1	Confident	89.1	Confident	97 Å²	97	54.8 Å²	54.8	68%	0.678	29%	0.285	S	S	*	.	H	α-helix	trans	-68.7	-20.4	-171.4	61.1	0	0	0	0	115.1	K562	S558-K562 WeakPolarHBondContact O-CD 3.46Å; S558-K562 WeakPolarHBondContact O-CG 3.36Å
559	V	86.6	Confident	87.9	Confident	50 Å²	50	54.6 Å²	54.6	30%	0.303	30%	0.301	S	S	.	.	H	α-helix	trans	-83.5	-45.3	171.6	-175.5	0	0	0	0	110.1	Q526 V527 G557 E561 K562 V563	Q526-V559 HydrophobicContact CB-CG1 4.42Å; V527-V559 HydrophobicContact CG2-CG1 3.8Å; G557-V559 VanDerWaalsContact C-N 3.28Å; G557-V559 PolarHBondContact O-N 2.99Å; V559-E561 PolarHBondContact O-N 3.4Å; V559-K562 WeakPolarHBondContact O-CB 3.47Å; V559-K562 PolarHBondContact O-N 3.49Å; V559-V563 PolarHBondContact O-N 3.16Å; V559-V563 VanDerWaalsContact O-N 3.14Å
560	G	86.4	Confident	86.1	Confident	3 Å²	3	61 Å²	61	3%	0.031	33%	0.327	C	S	.	.	H	α-helix	trans	-59.2	-46.3	177.8	0	0	0	0	0	112.4	V554 G557 K562 V563 R564	V554-G560 VanDerWaalsContact CG1-CA 3.46Å; V554-G560 WeakPolarHBondContact CG1-O 3.49Å; G557-G560 PolarHBondContact O-N 3.41Å; G560-K562 VanDerWaalsContact C-N 3.29Å; G560-K562 PolarHBondContact O-N 2.61Å; G560-V563 CarbonylContact O-C 3.57Å; G560-V563 WeakPolarHBondContact O-CA 3.36Å; G560-V563 WeakPolarHBondContact O-CB 3.23Å; G560-V563 PolarHBondContact O-N 3.06Å; G560-R564 PolarHBondContact O-N 2.98Å
561	E	86.8	Confident	83.9	Confident	85 Å²	85	69.2 Å²	69.2	40%	0.397	36%	0.36	S	S	.	.	H	α-helix	trans	-63.8	-33	179.8	-178.5	49.8	-154.1	0	0	112.9	G557 V559 R564 Q565	G557-E561 PolarHBondContact O-N 3.04Å; V559-E561 PolarHBondContact O-N 3.4Å; E561-R564 PolarHBondContact O-N 3.19Å; E561-R564 IonicContact OE2-NE 2.83Å; E561-R564 PolarHBondContact OE2-NE 3.41Å; E561-Q565 VanDerWaalsContact O-CG 3.26Å; E561-Q565 WeakPolarHBondContact O-CG 3.31Å; E561-Q565 PolarHBondContact O-N 3.26Å; E561-Q565 WeakPolarHBondContact OE1-CG 3.43Å; E561-Q565 PolarHBondContact OE1-NE2 3.2Å
562	K	87.8	Confident	81.5	Confident	113 Å²	113	71 Å²	71	49%	0.491	38%	0.382	S	S	.	.	H	α-helix	trans	-64	-43.3	171	-68.4	174.3	-177.4	-179.7	0	111.9	V527 S558 V559 G560 R564 Q565 I566	V527-K562 HydrophobicContact CG2-CB 4.39Å; S558-K562 WeakPolarHBondContact O-CD 3.46Å; S558-K562 WeakPolarHBondContact O-CG 3.36Å; V559-K562 WeakPolarHBondContact O-CB 3.47Å; V559-K562 PolarHBondContact O-N 3.49Å; G560-K562 VanDerWaalsContact C-N 3.29Å; G560-K562 PolarHBondContact O-N 2.61Å; K562-R564 VanDerWaalsContact C-N 3.34Å; K562-Q565 PolarHBondContact O-N 3.19Å; K562-I566 WeakPolarHBondContact O-CD1 3.41Å; K562-I566 VanDerWaalsContact O-CG1 3.29Å; K562-I566 WeakPolarHBondContact O-CG1 3.38Å; K562-I566 PolarHBondContact O-N 3.19Å; K562-I566 VanDerWaalsContact O-N 3.1Å
563	V	89.7	Confident	78.8	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-60.9	-44.3	173.5	170.7	0	0	0	0	110.7	Q526 V527 V530 V554 V559 G560 Q565 I566 L567	Q526-V563 HydrophobicContact CG-CG2 4.04Å; V527-V563 HydrophobicContact CG2-CG2 4.06Å; V530-V563 HydrophobicContact CG1-CG1 4.42Å; V530-V563 HydrophobicContact CG2-CG1 3.93Å; V530-V563 HydrophobicContact CG2-CG2 4.33Å; V554-V563 HydrophobicContact CG1-CB 4.04Å; V554-V563 HydrophobicContact CG1-CG1 4.03Å; V554-V563 HydrophobicContact CG2-CG1 3.77Å; V559-V563 PolarHBondContact O-N 3.16Å; V559-V563 VanDerWaalsContact O-N 3.14Å; G560-V563 CarbonylContact O-C 3.57Å; G560-V563 WeakPolarHBondContact O-CA 3.36Å; G560-V563 WeakPolarHBondContact O-CB 3.23Å; G560-V563 PolarHBondContact O-N 3.06Å; V563-Q565 VanDerWaalsContact C-N 3.33Å; V563-Q565 PolarHBondContact O-N 2.89Å; V563-I566 PolarHBondContact O-N 3.05Å; V563-L567 HydrophobicContact CG1-CD1 3.66Å; V563-L567 HydrophobicContact CG1-CG 4.26Å; V563-L567 WeakPolarHBondContact O-CG 3.45Å; V563-L567 PolarHBondContact O-N 3.33Å
564	R	89.8	Confident	75.9	Confident	45 Å²	45	83.9 Å²	83.9	17%	0.17	46%	0.455	C	S	.	.	H	α-helix	trans	-62.8	-37.3	179.6	-154.3	-173.7	-54.6	-79.9	3.9	112.2	C551 V554 G560 E561 K562 K568	C551-R564 PolarHBondContact O-NH1 3.34Å; V554-R564 PolarHBondContact O-NH1 3.29Å; V554-R564 PolarHBondContact O-NH2 3.07Å; G560-R564 PolarHBondContact O-N 2.98Å; E561-R564 PolarHBondContact O-N 3.19Å; E561-R564 IonicContact OE2-NE 2.83Å; E561-R564 PolarHBondContact OE2-NE 3.41Å; K562-R564 VanDerWaalsContact C-N 3.34Å; R564-K568 HydrophobicContact CG-CD 4.37Å; R564-K568 WeakPolarHBondContact O-CB 3.45Å; R564-K568 VanDerWaalsContact O-CG 3.25Å; R564-K568 WeakPolarHBondContact O-CG 3.41Å; R564-K568 PolarHBondContact O-N 3.27Å; R564-K568 VanDerWaalsContact O-N 3.15Å
565	Q	87.8	Confident	75	Confident	65 Å²	65	87.9 Å²	87.9	30%	0.304	48%	0.477	S	S	.	.	H	α-helix	trans	-68.5	-42.2	174.9	-72.4	168.4	11.4	0	0	112.6	E561 K562 V563 K568 G569 K570	E561-Q565 VanDerWaalsContact O-CG 3.26Å; E561-Q565 WeakPolarHBondContact O-CG 3.31Å; E561-Q565 PolarHBondContact O-N 3.26Å; E561-Q565 WeakPolarHBondContact OE1-CG 3.43Å; E561-Q565 PolarHBondContact OE1-NE2 3.2Å; K562-Q565 PolarHBondContact O-N 3.19Å; V563-Q565 VanDerWaalsContact C-N 3.33Å; V563-Q565 PolarHBondContact O-N 2.89Å; Q565-K568 PolarHBondContact O-N 3.06Å; Q565-G569 PolarHBondContact O-N 2.97Å; Q565-K570 HydrophobicContact CB-CB 4.48Å; Q565-K570 PolarHBondContact O-N 2.95Å
566	I	88.9	Confident	74.2	Confident	21 Å²	21	91.2 Å²	91.2	11%	0.108	49%	0.493	C	S	.	.	H	α-helix	trans	-61.9	-49.9	175.6	-68.1	161.6	0	0	0	110.6	V527 V530 K531 K562 V563 K568 G569 Y571	V527-I566 HydrophobicContact CG1-CD1 3.75Å; V530-I566 HydrophobicContact CG1-CG2 4.03Å; K531-I566 HydrophobicContact CG-CD1 4.1Å; K562-I566 WeakPolarHBondContact O-CD1 3.41Å; K562-I566 VanDerWaalsContact O-CG1 3.29Å; K562-I566 WeakPolarHBondContact O-CG1 3.38Å; K562-I566 PolarHBondContact O-N 3.19Å; K562-I566 VanDerWaalsContact O-N 3.1Å; V563-I566 PolarHBondContact O-N 3.05Å; I566-K568 VanDerWaalsContact C-N 3.27Å; I566-K568 PolarHBondContact O-N 2.95Å; I566-G569 PolarHBondContact O-N 3.37Å; I566-Y571 HydrophobicContact CG1-CD2 3.68Å; I566-Y571 HydrophobicContact CG1-CE2 4.22Å; I566-Y571 HydrophobicContact CG1-CG 4.4Å
567	L	88.1	Confident	73.6	Confident	7 Å²	7	85.6 Å²	85.6	4%	0.037	47%	0.471	C	S	.	.	H	α-helix	trans	-64.9	-29.1	-178.9	-67.7	169.2	0	0	0	113.4	L514 S518 V530 M534 S540 P550 C551 V554 V563 G569	L514-L567 HydrophobicContact CD1-CD2 3.93Å; L514-L567 HydrophobicContact CD2-CD2 3.88Å; L514-L567 HydrophobicContact CG-CD2 4.04Å; S518-L567 WeakPolarHBondContact OG-CD1 3.41Å; V530-L567 HydrophobicContact CG1-CD2 3.92Å; V530-L567 HydrophobicContact CG1-CG 4.19Å; M534-L567 HydrophobicContact SD-CD2 4.04Å; S540-L567 PolarHBondContact OG-O 2.97Å; S540-L567 VanDerWaalsContact OG-O 3.1Å; P550-L567 HydrophobicContact CB-CD1 4.27Å; P550-L567 HydrophobicContact CB-CD2 4.45Å; C551-L567 HydrophobicContact CB-CB 3.81Å; C551-L567 HydrophobicContact CB-CD1 4.04Å; V554-L567 HydrophobicContact CG2-CD1 3.79Å; V563-L567 HydrophobicContact CG1-CD1 3.66Å; V563-L567 HydrophobicContact CG1-CG 4.26Å; V563-L567 WeakPolarHBondContact O-CG 3.45Å; V563-L567 PolarHBondContact O-N 3.33Å; L567-G569 VanDerWaalsContact C-N 3.28Å
568	K	83.3	Confident	72.8	Confident	130 Å²	130	87.8 Å²	87.8	57%	0.565	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	10.6	174.1	-69.8	178.3	178.3	-178.2	0	113.6	R564 Q565 I566 K570	R564-K568 HydrophobicContact CG-CD 4.37Å; R564-K568 WeakPolarHBondContact O-CB 3.45Å; R564-K568 VanDerWaalsContact O-CG 3.25Å; R564-K568 WeakPolarHBondContact O-CG 3.41Å; R564-K568 PolarHBondContact O-N 3.27Å; R564-K568 VanDerWaalsContact O-N 3.15Å; Q565-K568 PolarHBondContact O-N 3.06Å; I566-K568 VanDerWaalsContact C-N 3.27Å; I566-K568 PolarHBondContact O-N 2.95Å; K568-K570 VanDerWaalsContact C-N 3.28Å; K568-K570 PolarHBondContact O-N 3.36Å
569	G	69.7	Low	72	Confident	61 Å²	61	87.2 Å²	87.2	63%	0.629	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.1	11.8	174.7	0	0	0	0	0	115.6	Q565 I566 L567 Y571	Q565-G569 PolarHBondContact O-N 2.97Å; I566-G569 PolarHBondContact O-N 3.37Å; L567-G569 VanDerWaalsContact C-N 3.28Å; G569-Y571 PolarHBondContact O-N 3.12Å; G569-Y571 VanDerWaalsContact O-N 3.13Å
570	K	54.9	Low	71	Confident	165 Å²	165	89.7 Å²	89.7	72%	0.717	47%	0.466	S	S	*	.			trans	-79.2	14.6	-177.8	-70.6	-163.9	171	-168.1	0	114.7	Q565 K568	Q565-K570 HydrophobicContact CB-CB 4.48Å; Q565-K570 PolarHBondContact O-N 2.95Å; K568-K570 VanDerWaalsContact C-N 3.28Å; K568-K570 PolarHBondContact O-N 3.36Å
571	Y	46.2	Very low	69.9	Low	174 Å²	174	95.9 Å²	95.9	68%	0.682	50%	0.497	S	S	*	.			trans	-112.5	62	173.1	-99.4	-77.7	0	0	0	111	I566 G569	I566-Y571 HydrophobicContact CG1-CD2 3.68Å; I566-Y571 HydrophobicContact CG1-CE2 4.22Å; I566-Y571 HydrophobicContact CG1-CG 4.4Å; G569-Y571 PolarHBondContact O-N 3.12Å; G569-Y571 VanDerWaalsContact O-N 3.13Å
572	G	42.3	Very low	68.6	Low	58 Å²	58	96.7 Å²	96.7	60%	0.598	51%	0.505	S	S	*	.			trans	-141.6	137.2	163.1	0	0	0	0	0	108
573	Q	33.6	Very low	67	Low	196 Å²	196	95.3 Å²	95.3	92%	0.916	51%	0.506	S	S	*	.			trans	67.3	76.2	-165.8	-51.6	179.6	3.3	0	0	114.7
574	V	30.2	Very low	65	Low	222 Å²	222	104 Å²	104	100%	1.345	55%	0.552	S	S	*	*				-139.8	0	103.4	-174.1	0	0	0	0	107.3

Retrieved 574 of 574 residues in 210.3 ms (Link to these results)

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