A0A5K4EW05_SCHMA Loading...

Putative nuclear protein

AlphaFold DB , UniProt , Accession A0A5K4EW05, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 571 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.2	Very low	44.2	Very low	116 Å²	116	110.5 Å²	110.5	57%	0.571	54%	0.543	S	S	*	.				0	19.8	0	-84.8	-81.8	-97.9	0	0	112.6	F3 F4 L570	M1-F3 PolarHBondContact O-N 2.77Å; M1-F4 PolarHBondContact O-N 3.46Å; M1-L570 HydrophobicContact CE-CB 3.8Å; M1-L570 HydrophobicContact CE-CD1 3.78Å; M1-L570 HydrophobicContact CE-CG 4.33Å; M1-L570 HydrophobicContact SD-CD1 4.25Å
2	D	36.6	Very low	45.4	Very low	128 Å²	128	104.8 Å²	104.8	68%	0.684	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-94.7	-5.8	-134.7	-40.1	-67.8	0	0	0	113.3	F4	D2-F4 VanDerWaalsContact C-N 3.26Å
3	F	33.8	Very low	46.3	Very low	189 Å²	189	97.1 Å²	97.1	83%	0.829	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-71.6	-21.8	172.7	-149.5	-91.9	0	0	0	112.3	M1	M1-F3 PolarHBondContact O-N 2.77Å
4	F	40.3	Very low	47.2	Very low	122 Å²	122	95.9 Å²	95.9	54%	0.535	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-88.6	-9.9	-170.8	-76.1	-68	0	0	0	115.8	M1 D2 K10	M1-F4 PolarHBondContact O-N 3.46Å; D2-F4 VanDerWaalsContact C-N 3.26Å; F4-K10 WeakPolarHBondContact O-CD 3.29Å; F4-K10 WeakPolarHBondContact O-CE 3.18Å; F4-K10 PolarHBondContact O-NZ 3.05Å
5	N	43	Very low	48.2	Very low	126 Å²	126	92.5 Å²	92.5	67%	0.674	46%	0.463	S	S	*	.	S	Bend	trans	-109.2	20.4	-165.8	-68	-6.9	0	0	0	114.7
6	R	42.1	Very low	48.8	Very low	211 Å²	211	87.3 Å²	87.3	80%	0.796	44%	0.437	S	S	*	.			trans	-101	4.7	-165.2	-68.5	-168.8	174.5	-145.1	-2.9	117.8
7	T	42.8	Very low	49.3	Very low	65 Å²	65	87.4 Å²	87.4	40%	0.399	44%	0.438	S	S	.	.			trans	-137.1	131.5	178.4	53.7	0	0	0	0	113.4	V9 K10	T7-V9 PolarHBondContact O-N 3.43Å; T7-K10 WeakPolarHBondContact O-CB 3.4Å; T7-K10 PolarHBondContact O-N 3.27Å
8	P	49.6	Very low	49.6	Very low	93 Å²	93	84.3 Å²	84.3	60%	0.604	43%	0.432	S	S	*	.	H	α-helix	trans	-65.2	-38.7	-179.2	24.9	-32.9	0	0	0	112.3	K10 N11 D12	P8-K10 PolarHBondContact O-N 3.03Å; P8-N11 WeakPolarHBondContact O-CA 3.17Å; P8-N11 WeakPolarHBondContact O-CB 3.39Å; P8-N11 PolarHBondContact O-N 2.87Å; P8-D12 PolarHBondContact O-N 2.83Å; P8-D12 VanDerWaalsContact O-N 3.11Å
9	V	48.7	Very low	50	Low	32 Å²	32	85.9 Å²	85.9	19%	0.194	44%	0.438	C	S	.	.	H	α-helix	trans	-53.4	-30.1	177.1	-177.3	0	0	0	0	112.7	T7 D12 I13	T7-V9 PolarHBondContact O-N 3.43Å; V9-D12 PolarHBondContact O-N 2.73Å; V9-I13 HydrophobicContact CG1-CD1 3.89Å; V9-I13 HydrophobicContact CG1-CG1 4.37Å; V9-I13 WeakPolarHBondContact O-CG1 3.43Å; V9-I13 PolarHBondContact O-N 2.56Å
10	K	52.4	Low	49.9	Very low	30 Å²	30	85.2 Å²	85.2	13%	0.13	44%	0.435	C	S	.	.	H	α-helix	trans	-65.6	-44.1	175.2	-170.1	-161.6	175.6	-154.3	0	111.4	F4 T7 P8 D12 L14 I391	F4-K10 WeakPolarHBondContact O-CD 3.29Å; F4-K10 WeakPolarHBondContact O-CE 3.18Å; F4-K10 PolarHBondContact O-NZ 3.05Å; T7-K10 WeakPolarHBondContact O-CB 3.4Å; T7-K10 PolarHBondContact O-N 3.27Å; P8-K10 PolarHBondContact O-N 3.03Å; K10-D12 VanDerWaalsContact C-N 3.34Å; K10-L14 HydrophobicContact CG-CD1 4.18Å; K10-L14 WeakPolarHBondContact O-CB 3.48Å; K10-L14 VanDerWaalsContact O-CG 3.28Å; K10-L14 WeakPolarHBondContact O-CG 3.33Å; K10-L14 PolarHBondContact O-N 2.95Å; K10-L14 VanDerWaalsContact O-N 3.07Å; K10-I391 HydrophobicContact CB-CD1 4Å; K10-I391 HydrophobicContact CG-CD1 4.41Å
11	N	57.3	Low	49.9	Very low	103 Å²	103	85.5 Å²	85.5	55%	0.551	45%	0.445	S	S	*	.	H	α-helix	trans	-67.1	-38.3	177.4	-66.6	-10.8	0	0	0	110.6	P8 L14 S15	P8-N11 WeakPolarHBondContact O-CA 3.17Å; P8-N11 WeakPolarHBondContact O-CB 3.39Å; P8-N11 PolarHBondContact O-N 2.87Å; N11-L14 PolarHBondContact O-N 3.41Å; N11-S15 WeakPolarHBondContact O-CB 3.12Å; N11-S15 PolarHBondContact O-N 3.12Å
12	D	58.9	Low	50.3	Low	43 Å²	43	83.7 Å²	83.7	23%	0.23	44%	0.443	C	S	.	.	H	α-helix	trans	-65.2	-44.6	176.7	-65.3	-44.1	0	0	0	112.6	P8 V9 K10 S15 I16 Y341	P8-D12 PolarHBondContact O-N 2.83Å; P8-D12 VanDerWaalsContact O-N 3.11Å; V9-D12 PolarHBondContact O-N 2.73Å; K10-D12 VanDerWaalsContact C-N 3.34Å; D12-S15 PolarHBondContact O-N 3.13Å; D12-I16 VanDerWaalsContact O-CG1 3.27Å; D12-I16 WeakPolarHBondContact O-CG1 3.36Å; D12-I16 PolarHBondContact O-N 3.05Å; D12-Y341 PolarHBondContact OD2-OH 3.32Å
13	I	57.6	Low	50.7	Low	4 Å²	4	85 Å²	85	2%	0.021	44%	0.443	C	S	.	.	H	α-helix	trans	-64.3	-43.7	177	-69.2	170.2	0	0	0	110.9	V9 S15 I16 I17 V340 Y387	V9-I13 HydrophobicContact CG1-CD1 3.89Å; V9-I13 HydrophobicContact CG1-CG1 4.37Å; V9-I13 WeakPolarHBondContact O-CG1 3.43Å; V9-I13 PolarHBondContact O-N 2.56Å; I13-S15 VanDerWaalsContact C-N 3.35Å; I13-I16 PolarHBondContact O-N 3.48Å; I13-I17 HydrophobicContact CG2-CD1 4.02Å; I13-I17 WeakPolarHBondContact O-CG1 3.4Å; I13-I17 PolarHBondContact O-N 3.37Å; I13-V340 HydrophobicContact CG1-CG1 4.32Å; I13-Y387 HydrophobicContact CD1-CD2 4.22Å; I13-Y387 HydrophobicContact CG2-CD2 3.98Å
14	L	57.8	Low	50.9	Low	81 Å²	81	81.2 Å²	81.2	42%	0.424	43%	0.426	S	S	.	.	H	α-helix	trans	-65.9	-37.3	176.3	-69	172.3	0	0	0	112	K10 N11 I17 G18	K10-L14 HydrophobicContact CG-CD1 4.18Å; K10-L14 WeakPolarHBondContact O-CB 3.48Å; K10-L14 VanDerWaalsContact O-CG 3.28Å; K10-L14 WeakPolarHBondContact O-CG 3.33Å; K10-L14 PolarHBondContact O-N 2.95Å; K10-L14 VanDerWaalsContact O-N 3.07Å; N11-L14 PolarHBondContact O-N 3.41Å; L14-I17 PolarHBondContact O-N 2.7Å; L14-G18 PolarHBondContact O-N 2.84Å
15	S	62.2	Low	50.8	Low	44 Å²	44	84.4 Å²	84.4	31%	0.308	44%	0.439	S	S	.	.	H	α-helix	trans	-63.6	-42.6	173.5	-177.9	0	0	0	0	111.9	N11 D12 I13 G18 H19	N11-S15 WeakPolarHBondContact O-CB 3.12Å; N11-S15 PolarHBondContact O-N 3.12Å; D12-S15 PolarHBondContact O-N 3.13Å; I13-S15 VanDerWaalsContact C-N 3.35Å; S15-G18 PolarHBondContact O-N 3.47Å; S15-H19 WeakPolarHBondContact O-CB 3.44Å; S15-H19 PolarHBondContact O-N 3.48Å; S15-H19 PolarHBondContact OG-CD2 3.31Å
16	I	58.6	Low	50.3	Low	9 Å²	9	90 Å²	90	5%	0.046	45%	0.453	C	S	.	.	H	α-helix	trans	-61.2	-47.8	174.6	-71.9	164.6	0	0	0	110.8	D12 I13 G18 H19 L20 V340 Y344	D12-I16 VanDerWaalsContact O-CG1 3.27Å; D12-I16 WeakPolarHBondContact O-CG1 3.36Å; D12-I16 PolarHBondContact O-N 3.05Å; I13-I16 PolarHBondContact O-N 3.48Å; I16-G18 PolarHBondContact O-N 3.48Å; I16-H19 PolarHBondContact O-N 2.96Å; I16-L20 HydrophobicContact CG2-CD1 3.76Å; I16-L20 HydrophobicContact CG2-CG 4.34Å; I16-L20 WeakPolarHBondContact O-CB 3.26Å; I16-L20 VanDerWaalsContact O-CG 3.23Å; I16-L20 WeakPolarHBondContact O-CG 3.5Å; I16-L20 PolarHBondContact O-N 3.26Å; I16-V340 HydrophobicContact CD1-CG1 3.37Å; I16-Y344 HydrophobicContact CD1-CD2 4.31Å; I16-Y344 HydrophobicContact CD1-CE2 3.69Å; I16-Y344 HydrophobicContact CG1-CD2 4.35Å; I16-Y344 HydrophobicContact CG1-CE1 4.31Å; I16-Y344 HydrophobicContact CG1-CE2 3.64Å
17	I	57.1	Low	49.8	Very low	89 Å²	89	85 Å²	85	46%	0.456	45%	0.45	S	S	.	.	H	α-helix	trans	-60.2	-46.7	177.1	-67	165.2	0	0	0	110.3	I13 L14 L20 S21	I13-I17 HydrophobicContact CG2-CD1 4.02Å; I13-I17 WeakPolarHBondContact O-CG1 3.4Å; I13-I17 PolarHBondContact O-N 3.37Å; L14-I17 PolarHBondContact O-N 2.7Å; I17-L20 PolarHBondContact O-N 3.45Å; I17-S21 WeakPolarHBondContact O-CB 3.33Å; I17-S21 PolarHBondContact O-N 2.76Å; I17-S21 VanDerWaalsContact O-N 3.1Å
18	G	55.5	Low	49.3	Very low	32 Å²	32	93.7 Å²	93.7	33%	0.33	48%	0.476	S	S	.	.	H	α-helix	trans	-60.8	-45.7	177	0	0	0	0	0	113.5	L14 S15 I16 S21 S22	L14-G18 PolarHBondContact O-N 2.84Å; S15-G18 PolarHBondContact O-N 3.47Å; I16-G18 PolarHBondContact O-N 3.48Å; G18-S21 PolarHBondContact O-N 3.28Å; G18-S22 WeakPolarHBondContact O-CB 3.33Å; G18-S22 PolarHBondContact O-N 3.46Å; G18-S22 PolarHBondContact O-OG 3.04Å
19	H	55.9	Low	48.6	Very low	115 Å²	115	95 Å²	95	53%	0.532	49%	0.485	S	S	.	.	H	α-helix	trans	-72.4	-32.8	179.5	-87	-54.6	0	0	0	113.7	S15 I16 S21 S22	S15-H19 WeakPolarHBondContact O-CB 3.44Å; S15-H19 PolarHBondContact O-N 3.48Å; S15-H19 PolarHBondContact OG-CD2 3.31Å; I16-H19 PolarHBondContact O-N 2.96Å; H19-S21 VanDerWaalsContact C-N 3.32Å; H19-S22 PolarHBondContact O-N 2.98Å
20	L	49.2	Very low	47.8	Very low	72 Å²	72	101.5 Å²	101.5	38%	0.377	52%	0.517	S	S	.	.	H	α-helix	trans	-65.8	-37.8	171.9	-72.2	172.1	0	0	0	111.1	I16 I17 F372	I16-L20 HydrophobicContact CG2-CD1 3.76Å; I16-L20 HydrophobicContact CG2-CG 4.34Å; I16-L20 WeakPolarHBondContact O-CB 3.26Å; I16-L20 VanDerWaalsContact O-CG 3.23Å; I16-L20 WeakPolarHBondContact O-CG 3.5Å; I16-L20 PolarHBondContact O-N 3.26Å; I17-L20 PolarHBondContact O-N 3.45Å; L20-F372 HydrophobicContact CD2-CE2 4.2Å; L20-F372 HydrophobicContact CD2-CZ 4.46Å
21	S	48.6	Very low	46.6	Very low	92 Å²	92	110 Å²	110	64%	0.643	56%	0.555	S	S	*	*	H	α-helix	trans	-73.6	-34.8	174.1	-170.3	0	0	0	0	113.4	I17 G18 H19 K23	I17-S21 WeakPolarHBondContact O-CB 3.33Å; I17-S21 PolarHBondContact O-N 2.76Å; I17-S21 VanDerWaalsContact O-N 3.1Å; G18-S21 PolarHBondContact O-N 3.28Å; H19-S21 VanDerWaalsContact C-N 3.32Å; S21-K23 PolarHBondContact O-N 3.11Å
22	S	47.6	Very low	45.6	Very low	77 Å²	77	111.8 Å²	111.8	54%	0.538	57%	0.569	S	S	.	*			trans	-84.2	0.8	-169.5	-61.2	0	0	0	0	116.2	G18 H19 K24	G18-S22 WeakPolarHBondContact O-CB 3.33Å; G18-S22 PolarHBondContact O-N 3.46Å; G18-S22 PolarHBondContact O-OG 3.04Å; H19-S22 PolarHBondContact O-N 2.98Å; S22-K24 PolarHBondContact O-N 2.88Å
23	K	45.6	Very low	44.2	Very low	156 Å²	156	112.9 Å²	112.9	68%	0.678	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	25.5	-176.5	-88.5	179.3	178.1	179.1	0	115.8	S21	S21-K23 PolarHBondContact O-N 3.11Å
24	K	37.8	Very low	42.9	Very low	110 Å²	110	120.2 Å²	120.2	48%	0.478	63%	0.63	S	S	.	*	T	Hydrogen-bonded Turn	trans	-126.7	2.6	-178	-100.2	176.3	170.7	173.3	0	115.8	S22 D219	S22-K24 PolarHBondContact O-N 2.88Å; K24-D219 IonicContact NZ-OD1 3.21Å; K24-D219 PolarHBondContact NZ-OD1 2.9Å; K24-D219 IonicContact NZ-OD2 3.02Å; K24-D219 PolarHBondContact NZ-OD2 3.09Å
25	K	38.5	Very low	41.8	Very low	188 Å²	188	125 Å²	125	82%	0.817	65%	0.65	S	S	*	*			trans	-120.8	58.4	-175.6	-69.9	-172	177.4	178.6	0	115.3
26	Y	31.9	Very low	40.1	Very low	243 Å²	243	129.4 Å²	129.4	95%	0.953	67%	0.67	S	S	*	*			trans	-139.4	75.1	164.8	-89.5	-76.9	0	0	0	112
27	S	32.8	Very low	38.8	Very low	107 Å²	107	137.4 Å²	137.4	75%	0.748	71%	0.71	S	S	*	*			trans	-145.8	126	166.2	48	0	0	0	0	109.5
28	R	30.9	Very low	37.5	Very low	247 Å²	247	138.8 Å²	138.8	93%	0.932	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-89.9	122.7	175.6	-69.5	-179.7	176.4	-178.8	-2.4	109.6
29	P	35.3	Very low	36.3	Very low	122 Å²	122	143.3 Å²	143.3	79%	0.792	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-75.7	131.8	161.4	-11.5	28.9	0	0	0	109.7
30	L	31	Very low	35	Very low	167 Å²	167	143 Å²	143	87%	0.874	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-85.2	147	169.2	-79.2	163	0	0	0	110.3	T32	L30-T32 PolarHBondContact O-N 3.26Å
31	F	27.5	Very low	34.2	Very low	209 Å²	209	151.7 Å²	151.7	92%	0.917	79%	0.788	S	S	*	*			trans	-89.3	98.2	-172.9	-120.7	-87.1	0	0	0	112.4
32	T	36.2	Very low	33.3	Very low	140 Å²	140	154.9 Å²	154.9	86%	0.859	79%	0.793	S	S	*	*			trans	-161.1	134.3	159.1	48.9	0	0	0	0	108.3	L30	L30-T32 PolarHBondContact O-N 3.26Å
33	G	31.2	Very low	32.5	Very low	67 Å²	67	159.3 Å²	159.3	69%	0.691	81%	0.809	S	S	*	*			cis	173	144.8	-7.6	0	0	0	0	0	109.8
34	N	30.2	Very low	31.9	Very low	157 Å²	157	161.6 Å²	161.6	84%	0.84	81%	0.813	S	S	*	*			trans	41.2	109.1	166.1	-56.1	-5.9	0	0	0	119.3
35	H	33.1	Very low	31.5	Very low	183 Å²	183	162.5 Å²	162.5	85%	0.847	83%	0.83	S	S	*	*				-157.9	157.4	107.4	-122.1	-93.9	0	0	0	112.2
36	L	28.1	Very low	31.2	Very low	136 Å²	136	159.2 Å²	159.2	71%	0.712	83%	0.831	S	S	*	*			trans	-87.2	153.3	-173.6	-51.7	99.9	0	0	0	112.8
37	I	31.2	Very low	30.9	Very low	176 Å²	176	153.2 Å²	153.2	90%	0.903	82%	0.82	S	S	*	*				-159.2	148.6	119.5	-99.1	152.9	0	0	0	109
38	T	28.9	Very low	30.8	Very low	118 Å²	118	156.2 Å²	156.2	72%	0.724	83%	0.827	S	S	*	*			trans	-106.4	140.5	-162.5	50.6	0	0	0	0	114.2
39	S	30.9	Very low	30.6	Very low	127 Å²	127	151.9 Å²	151.9	89%	0.888	82%	0.817	S	S	*	*			trans	-157.7	112.1	141.6	-169.1	0	0	0	0	109.7
40	S	28.8	Very low	30.4	Very low	108 Å²	108	155.1 Å²	155.1	76%	0.755	82%	0.819	S	S	*	*			trans	-126.1	131.7	-175.4	-56.9	0	0	0	0	111.1
41	R	31.3	Very low	30.4	Very low	255 Å²	255	152.9 Å²	152.9	96%	0.962	81%	0.808	S	S	*	*			trans	-138.4	103.5	153.9	-89.7	-170.2	169.1	172.2	-3	109.2
42	E	29.6	Very low	30.4	Very low	160 Å²	160	150.8 Å²	150.8	75%	0.748	80%	0.801	S	S	*	*			trans	-74.5	147.9	169.4	-56.3	-178.2	143	0	0	110.3
43	I	32.5	Very low	30	Very low	169 Å²	169	154.1 Å²	154.1	87%	0.867	80%	0.804	S	S	*	*			trans	-130.9	127.5	150.9	-60.9	-177.7	0	0	0	106.5
44	R	31.4	Very low	29.8	Very low	205 Å²	205	156.2 Å²	156.2	77%	0.774	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-83.6	146.5	-177.8	-60.9	174.9	-179	171.5	-1.9	110.7
45	P	30.8	Very low	29.8	Very low	128 Å²	128	154.2 Å²	154.2	83%	0.831	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-72.2	131.2	157.5	31.5	-31.2	0	0	0	109.3
46	S	31.3	Very low	29.5	Very low	120 Å²	120	151.9 Å²	151.9	84%	0.839	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-89.2	132.9	175.8	-65	0	0	0	0	111.1
47	T	26.1	Very low	29.7	Very low	117 Å²	117	148.7 Å²	148.7	72%	0.718	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-63.1	138.2	172	-49.4	0	0	0	0	111.4	Q49	T47-Q49 HydrophobicContact CG2-CG 4.2Å
48	L	30.5	Very low	29.6	Very low	169 Å²	169	145.2 Å²	145.2	89%	0.885	76%	0.759	S	S	*	*			trans	-124.9	124.1	148	-83.1	174.6	0	0	0	108.1
49	Q	27.4	Very low	29.8	Very low	157 Å²	157	145.9 Å²	145.9	73%	0.734	75%	0.753	S	S	*	*			trans	-82.4	148.3	170.1	-64.7	162.3	-103.3	0	0	109	T47	T47-Q49 HydrophobicContact CG2-CG 4.2Å
50	F	30.6	Very low	29.7	Very low	189 Å²	189	147 Å²	147	83%	0.829	75%	0.75	S	S	*	*			trans	-150.7	108.9	136.9	-93.2	-66.7	0	0	0	108.3
51	D	30.6	Very low	29.8	Very low	121 Å²	121	150.6 Å²	150.6	65%	0.647	76%	0.759	S	S	*	*			trans	27.9	106.3	143.9	-39.9	-22.4	0	0	0	116.1
52	E	27.2	Very low	29.6	Very low	164 Å²	164	145.6 Å²	145.6	77%	0.766	75%	0.747	S	S	*	*				65.4	101.7	73.3	-171.4	170.2	-157.9	0	0	113.3
53	F	29.2	Very low	29.6	Very low	210 Å²	210	147 Å²	147	92%	0.921	75%	0.751	S	S	*	*			trans	-153.8	115.5	136.1	-120.8	-76.1	0	0	0	110
54	T	25.6	Very low	29.5	Very low	112 Å²	112	146.3 Å²	146.3	69%	0.687	74%	0.744	S	S	*	*			trans	-88.3	149.8	172.7	38.7	0	0	0	0	111.1
55	V	31.1	Very low	29.3	Very low	115 Å²	115	144.1 Å²	144.1	70%	0.697	74%	0.742	S	S	*	*			trans	-151.1	140.7	135.2	153.6	0	0	0	0	105.4
56	E	27.7	Very low	29.2	Very low	134 Å²	134	147.5 Å²	147.5	63%	0.626	75%	0.747	S	S	*	*			trans	-86.7	175.6	175.3	-63.1	174.5	124.3	0	0	109.8	K185	E56-K185 WeakPolarHBondContact OE2-CE 3.18Å; E56-K185 IonicContact OE2-NZ 2.83Å
57	E	31	Very low	29	Very low	68 Å²	68	150.5 Å²	150.5	32%	0.318	75%	0.745	S	S	.	*				166.7	166.2	116.2	-85.6	151.7	-150.3	0	0	114.4	V183 D184 K185	E57-V183 VanDerWaalsContact OE2-CA 3.29Å; E57-V183 WeakPolarHBondContact OE2-CA 3.37Å; E57-D184 HydrophobicContact CG-CB 4.1Å; E57-D184 WeakPolarHBondContact CG-OD1 3.35Å; E57-D184 VanDerWaalsContact OE1-OD1 3.08Å; E57-D184 WeakPolarHBondContact OE2-CA 3.33Å; E57-D184 WeakPolarHBondContact OE2-CB 3.23Å; E57-D184 PolarHBondContact OE2-N 3.05Å; E57-K185 IonicContact OE1-NZ 3.95Å; E57-K185 PolarHBondContact OE1-NZ 3.07Å
58	S	29.7	Very low	29.4	Very low	103 Å²	103	150.1 Å²	150.1	72%	0.72	75%	0.747	S	S	*	*			trans	-163.3	136.5	-168.5	-66.9	0	0	0	0	111.1
59	H	33.1	Very low	29.3	Very low	132 Å²	132	149.2 Å²	149.2	61%	0.611	74%	0.743	S	S	*	*			trans	-141.1	141.6	162	-104.7	-66.3	0	0	0	112.1	V183 D184 K185	H59-V183 PolarHBondContact CD2-O 2.8Å; H59-D184 PolarHBondContact CD2-O 3.32Å; H59-D184 VanDerWaalsContact CD2-O 3.27Å; H59-D184 VanDerWaalsContact NE2-C 3.31Å; H59-D184 PolarHBondContact NE2-O 3.48Å; H59-K185 PolarHBondContact CE1-O 2.88Å; H59-K185 PolarHBondContact NE2-O 3.07Å
60	N	27.9	Very low	29.6	Very low	152 Å²	152	149.7 Å²	149.7	81%	0.813	75%	0.749	S	S	*	*			trans	-100.2	149.9	172	-83.9	-87.4	0	0	0	109.1
61	L	31	Very low	29.8	Very low	182 Å²	182	147.1 Å²	147.1	95%	0.953	74%	0.739	S	S	*	*			trans	-134.7	142.2	152.1	-105.6	171.1	0	0	0	110.8
62	H	28.1	Very low	29.8	Very low	151 Å²	151	148.8 Å²	148.8	70%	0.699	74%	0.741	S	S	*	*			trans	-113.8	137.8	-164	163	-68	0	0	0	109.7
63	F	29	Very low	30.2	Very low	189 Å²	189	150.6 Å²	150.6	83%	0.829	75%	0.746	S	S	*	*			trans	-139.5	164.1	162.8	-129.3	-89.8	0	0	0	113
64	E	30.9	Very low	30.3	Very low	154 Å²	154	145 Å²	145	72%	0.72	73%	0.733	S	S	*	*			trans	-89.3	170.2	-141.5	-62.1	-170	103.2	0	0	118.2
65	Q	26.6	Very low	30.5	Very low	160 Å²	160	144.2 Å²	144.2	75%	0.748	73%	0.732	S	S	*	*			trans	-75.1	151.9	168.9	-52.9	171.6	16.7	0	0	111.6
66	Q	29.7	Very low	30.4	Very low	198 Å²	198	147.8 Å²	147.8	93%	0.925	74%	0.739	S	S	*	*			trans	-134.1	146.4	148.7	-71.6	-164.4	-4.5	0	0	111.2
67	K	25.3	Very low	30.6	Very low	184 Å²	184	147.7 Å²	147.7	80%	0.8	75%	0.747	S	S	*	*			trans	-138	123.8	179.6	-76.8	179.9	178	172.2	0	111.1
68	S	34.9	Very low	30.3	Very low	108 Å²	108	148.5 Å²	148.5	76%	0.755	77%	0.766	S	S	*	*			trans	-169.1	117.1	157.5	45.1	0	0	0	0	108.1
69	N	29.5	Very low	30.4	Very low	151 Å²	151	152.9 Å²	152.9	81%	0.807	78%	0.775	S	S	*	*				78.4	114.8	68.3	-74.8	-8.6	0	0	0	114
70	I	33.5	Very low	30.1	Very low	167 Å²	167	153.8 Å²	153.8	86%	0.856	78%	0.784	S	S	*	*			trans	175.1	106.2	148.4	-88.2	147.3	0	0	0	104.2
71	E	33.2	Very low	30.4	Very low	134 Å²	134	155 Å²	155	63%	0.626	79%	0.789	S	S	*	*				90.8	98.9	53	-74.7	-97.3	117.1	0	0	115.4
72	K	32.6	Very low	30.5	Very low	157 Å²	157	151.5 Å²	151.5	68%	0.683	78%	0.78	S	S	*	*			trans	62.9	123.2	134.8	-61.5	174.4	-177	139.8	0	122.7
73	K	34.4	Very low	31.1	Very low	202 Å²	202	150.1 Å²	150.1	88%	0.878	78%	0.784	S	S	*	*			trans	142.6	156.7	134.3	-81.1	160.6	-176.4	173.6	0	111.6
74	S	31.1	Very low	31.4	Very low	93 Å²	93	146.8 Å²	146.8	65%	0.65	78%	0.782	S	S	*	*			cis	-171.2	112.7	-20.2	48.2	0	0	0	0	107.4
75	S	29.3	Very low	31.4	Very low	95 Å²	95	145 Å²	145	66%	0.664	79%	0.786	S	S	*	*				67.8	142.3	85.4	69.6	0	0	0	0	116.9
76	F	30.3	Very low	31.6	Very low	190 Å²	190	140.4 Å²	140.4	83%	0.833	78%	0.782	S	S	*	*			trans	79.9	137.9	177.9	-67.3	-88.1	0	0	0	116.7
77	T	30.5	Very low	31.7	Very low	131 Å²	131	140.3 Å²	140.3	80%	0.804	78%	0.778	S	S	*	*			cis	-154.4	176.2	-20.9	-5.1	0	0	0	0	109.8
78	A	26	Very low	32.1	Very low	85 Å²	85	141 Å²	141	70%	0.702	78%	0.781	S	S	*	*			trans	-129.9	151.9	179.2	0	0	0	0	0	113.1
79	E	31.4	Very low	31.7	Very low	195 Å²	195	141.4 Å²	141.4	91%	0.911	78%	0.784	S	S	*	*			trans	-129	155.9	165.8	-68.4	-163.9	135.9	0	0	110.6
80	N	27.4	Very low	31.9	Very low	152 Å²	152	139.8 Å²	139.8	81%	0.813	78%	0.782	S	S	*	*			trans	-130	139.1	-175.1	-62.2	-97.5	0	0	0	110.6
81	I	32.6	Very low	31.5	Very low	176 Å²	176	137.8 Å²	137.8	90%	0.903	78%	0.777	S	S	*	*			trans	-135.5	140	160.9	-59.3	-176.5	0	0	0	108.9
82	S	34.2	Very low	31.2	Very low	110 Å²	110	140 Å²	140	77%	0.769	79%	0.787	S	S	*	*			trans	-102.9	158.5	-164.8	-59.7	0	0	0	0	114.8
83	P	41.5	Very low	30.8	Very low	122 Å²	122	137.1 Å²	137.1	79%	0.792	79%	0.793	S	S	*	*			trans	-107.5	164.8	-176.7	40.7	-35.6	0	0	0	115.4
84	P	33.8	Very low	30.4	Very low	119 Å²	119	135.6 Å²	135.6	77%	0.773	79%	0.793	S	S	*	*			trans	-133.1	171	154.2	39.3	-26.9	0	0	0	112.8
85	S	30.7	Very low	30	Very low	116 Å²	116	138.4 Å²	138.4	81%	0.811	80%	0.8	S	S	*	*			cis	-176.4	145.4	-33.9	66	0	0	0	0	108.8
86	G	32.3	Very low	29.8	Very low	64 Å²	64	142.9 Å²	142.9	66%	0.66	81%	0.808	S	S	*	*			trans	149.8	118.7	171.6	0	0	0	0	0	114.1
87	K	32.1	Very low	29.5	Very low	196 Å²	196	138.6 Å²	138.6	85%	0.852	80%	0.797	S	S	*	*				72.8	118.3	74.3	-72.5	169.5	-175.7	170.9	0	112.1
88	K	32.4	Very low	29.3	Very low	198 Å²	198	138.7 Å²	138.7	86%	0.861	79%	0.793	S	S	*	*			cis	-156.3	158.5	6.6	-86.7	171.8	-178.5	177.5	0	113.7
89	S	26.3	Very low	29.5	Very low	117 Å²	117	142.8 Å²	142.8	82%	0.818	80%	0.802	S	S	*	*			trans	-21.4	170.2	153.8	-75.4	0	0	0	0	123.5
90	P	35.2	Very low	29.1	Very low	116 Å²	116	141.5 Å²	141.5	75%	0.753	80%	0.796	S	S	*	*			trans	-136.3	-142.3	-141.3	45	-25.5	0	0	0	115.9
91	V	24.3	Very low	29.2	Very low	125 Å²	125	139.8 Å²	139.8	76%	0.758	79%	0.794	S	S	*	*			trans	99.8	153.4	163.5	-164.1	0	0	0	0	117.2
92	Q	27.2	Very low	28.7	Very low	181 Å²	181	138 Å²	138	85%	0.846	79%	0.787	S	S	*	*			trans	83.7	115.9	175.4	-49.7	-172.3	8.5	0	0	114.6
93	A	23.7	Very low	28.4	Very low	96 Å²	96	138.4 Å²	138.4	79%	0.793	79%	0.79	S	S	*	*			cis	86.9	114.6	28.3	0	0	0	0	0	115.1
94	L	25.9	Very low	27.5	Very low	171 Å²	171	137.9 Å²	137.9	90%	0.895	79%	0.789	S	S	*	*			trans	-157.7	157.9	168.3	-116	163.5	0	0	0	111.2
95	L	22.7	Very low	27.1	Very low	151 Å²	151	140.1 Å²	140.1	79%	0.791	79%	0.792	S	S	*	*			trans	-104.2	-175.6	-174.9	-69.3	88.1	0	0	0	111.8
96	K	25.6	Very low	26.8	Very low	189 Å²	189	142.4 Å²	142.4	82%	0.822	80%	0.795	S	S	*	*			trans	89.3	141.6	164.2	-62.4	-177.1	-179.7	-177.2	0	114.9
97	T	24.4	Very low	26.4	Very low	101 Å²	101	142.7 Å²	142.7	62%	0.62	80%	0.798	S	S	*	*			cis	171.8	176.6	-27.9	31.7	0	0	0	0	103.6
98	D	25.3	Very low	26.1	Very low	132 Å²	132	140.9 Å²	140.9	71%	0.706	80%	0.798	S	S	*	*			trans	69.6	122.9	159.3	-43.5	-54.9	0	0	0	117.9
99	L	30.4	Very low	25.8	Very low	172 Å²	172	136.1 Å²	136.1	90%	0.901	79%	0.789	S	S	*	*				-177.5	152.3	97.5	-93.1	169.9	0	0	0	112.3
100	H	24.2	Very low	25.8	Very low	168 Å²	168	140.9 Å²	140.9	78%	0.778	79%	0.791	S	S	*	*			trans	-76.5	153.5	168.6	-103.5	-111.1	0	0	0	111.3
101	C	28.1	Very low	25.4	Very low	116 Å²	116	140.5 Å²	140.5	78%	0.784	79%	0.79	S	S	*	*			trans	-155.5	115.2	148.1	-168	0	0	0	0	111.3
102	D	23.1	Very low	25.5	Very low	139 Å²	139	143.6 Å²	143.6	74%	0.743	79%	0.793	S	S	*	*			trans	-89.3	133.4	159.9	-70.2	-78.6	0	0	0	108.8
103	S	27.3	Very low	25.7	Very low	118 Å²	118	137.9 Å²	137.9	83%	0.825	77%	0.773	S	S	*	*			trans	-160.8	132.1	160.3	-85.5	0	0	0	0	113.3
104	S	22.2	Very low	26	Very low	111 Å²	111	136.2 Å²	136.2	78%	0.776	75%	0.751	S	S	*	*			trans	-78	162.4	169.1	-51.7	0	0	0	0	111.5
105	I	25.2	Very low	26.3	Very low	165 Å²	165	132.4 Å²	132.4	85%	0.846	73%	0.731	S	S	*	*				-179.4	156.5	124.9	-93.7	156.5	0	0	0	111.8
106	L	24.2	Very low	26.8	Very low	164 Å²	164	133 Å²	133	86%	0.859	73%	0.728	S	S	*	*			trans	-80.6	165.9	-171.4	-57.3	84.2	0	0	0	114
107	G	24.7	Very low	27.1	Very low	71 Å²	71	129.9 Å²	129.9	73%	0.732	72%	0.72	S	S	*	*			trans	167.1	87.8	155.2	0	0	0	0	0	118.3
108	N	25.3	Very low	27.5	Very low	158 Å²	158	131 Å²	131	85%	0.845	72%	0.722	S	S	*	*			trans	12.1	150.2	134.1	-61.9	-8	0	0	0	119.8
109	S	26.8	Very low	27.8	Very low	98 Å²	98	135.6 Å²	135.6	69%	0.685	73%	0.731	S	S	*	*			cis	-171.2	-165.9	-1.7	53.5	0	0	0	0	107.5
110	Y	25.7	Very low	27.8	Very low	217 Å²	217	130.4 Å²	130.4	85%	0.851	72%	0.719	S	S	*	*			cis	-156	-167.9	4.3	-132.7	-41.1	0	0	0	109
111	C	26.8	Very low	28.1	Very low	108 Å²	108	127.9 Å²	127.9	73%	0.73	72%	0.721	S	S	*	*			trans	-164.3	166.2	-177.5	59.6	0	0	0	0	114.7
112	K	27.4	Very low	28	Very low	190 Å²	190	130.3 Å²	130.3	83%	0.826	73%	0.725	S	S	*	*			trans	-165	144.6	153	-108.6	156.7	-174.7	176.5	0	112.9	K288	K112-K288 HydrophobicContact CG-CD 4.32Å
113	S	31.1	Very low	28.2	Very low	61 Å²	61	128.1 Å²	128.1	43%	0.427	72%	0.721	S	S	.	*			trans	-98.7	-166.3	-169.9	50.7	0	0	0	0	114.2	K288	S113-K288 WeakPolarHBondContact O-CD 3.42Å; S113-K288 WeakPolarHBondContact O-CG 3.48Å; S113-K288 PolarHBondContact O-NZ 3Å
114	N	30.4	Very low	28.1	Very low	60 Å²	60	131.6 Å²	131.6	32%	0.321	72%	0.721	S	S	.	*			trans	-163.4	142.3	166	-86.7	-28.9	0	0	0	113.2	E286 S287 K288	N114-E286 VanDerWaalsContact ND2-CB 3.27Å; N114-E286 WeakPolarHBondContact ND2-CB 3.32Å; N114-E286 VanDerWaalsContact ND2-CG 3.33Å; N114-E286 WeakPolarHBondContact ND2-CG 3.27Å; N114-E286 PolarHBondContact ND2-OE1 2.87Å; N114-S287 CarbonylContact C-O 3.56Å; N114-S287 WeakPolarHBondContact CA-O 3.42Å; N114-S287 WeakPolarHBondContact CB-O 3.21Å; N114-S287 VanDerWaalsContact CG-C 3.46Å; N114-S287 VanDerWaalsContact CG-N 3.32Å; N114-S287 WeakPolarHBondContact OD1-CA 3.47Å; N114-S287 PolarHBondContact OD1-N 3.43Å; N114-S287 PolarHBondContact OD1-O 2.68Å; N114-K288 WeakPolarHBondContact OD1-CA 3.14Å; N114-K288 VanDerWaalsContact OD1-CB 3.25Å; N114-K288 WeakPolarHBondContact OD1-CB 3.27Å; N114-K288 WeakPolarHBondContact OD1-CG 3.13Å; N114-K288 PolarHBondContact OD1-N 3.21Å; N114-K288 PolarHBondContact OD1-NZ 3.33Å
115	N	32.2	Very low	28.6	Very low	91 Å²	91	133.3 Å²	133.3	49%	0.487	72%	0.721	S	S	.	*			trans	-148.7	160.3	-172.9	-68.7	12.1	0	0	0	113.6	S287 F289	N115-S287 PolarHBondContact N-O 3.36Å; N115-S287 VanDerWaalsContact O-O 3.12Å; N115-F289 PolarHBondContact ND2-O 3.48Å
116	F	32.6	Very low	28.6	Very low	164 Å²	164	133.6 Å²	133.6	72%	0.719	72%	0.718	S	S	*	*			trans	-156.4	163.8	154.1	-116.4	-78.2	0	0	0	116	S287	F116-S287 WeakPolarHBondContact CD2-OG 3.49Å
117	N	32	Very low	29.3	Very low	124 Å²	124	130.4 Å²	130.4	66%	0.663	71%	0.707	S	S	*	*			trans	-77.8	-166.1	-161.7	-44.3	6.6	0	0	0	118.3
118	D	31.7	Very low	29.7	Very low	124 Å²	124	136 Å²	136	66%	0.663	71%	0.712	S	S	*	*			cis	-163.2	-170.4	3.1	-134.9	-45.5	0	0	0	114.8
119	Y	32.7	Very low	30	Very low	229 Å²	229	134.1 Å²	134.1	90%	0.898	71%	0.706	S	S	*	*			trans	85.9	140.1	167.3	-56.2	-80.5	0	0	0	118.8
120	G	30.1	Very low	30.3	Very low	63 Å²	63	134.2 Å²	134.2	65%	0.649	70%	0.703	S	S	*	*			cis	166.2	153.2	-10.8	0	0	0	0	0	114.5
121	S	31.3	Very low	30.7	Very low	115 Å²	115	132.2 Å²	132.2	80%	0.804	70%	0.701	S	S	*	*			trans	100.5	112.7	179.2	-48.9	0	0	0	0	115.9
122	L	25.7	Very low	30.9	Very low	167 Å²	167	131.3 Å²	131.3	87%	0.874	70%	0.696	S	S	*	*				78.9	136.7	77.1	-70.4	167.6	0	0	0	114.1
123	S	27	Very low	31.3	Very low	93 Å²	93	128.9 Å²	128.9	65%	0.65	70%	0.697	S	S	*	*			cis	-169.1	163	0.8	51.8	0	0	0	0	113.3
124	F	25.1	Very low	31.5	Very low	191 Å²	191	130.4 Å²	130.4	84%	0.838	71%	0.708	S	S	*	*			trans	69.3	143.6	162.3	-93.6	-145.8	0	0	0	117.1
125	L	31.7	Very low	31.6	Very low	146 Å²	146	132 Å²	132	76%	0.764	72%	0.724	S	S	*	*			cis	-139.9	166.8	5.2	-100.8	170.5	0	0	0	112.1
126	E	26.6	Very low	31.9	Very low	171 Å²	171	134.7 Å²	134.7	80%	0.799	74%	0.738	S	S	*	*			trans	-145.1	-175.5	-179.1	-115.1	-158.2	-171.8	0	0	109.6
127	P	37.6	Very low	32	Very low	97 Å²	97	132.4 Å²	132.4	63%	0.63	73%	0.733	S	S	*	*			cis	-132.2	-167.3	-43.9	38.5	-22.2	0	0	0	111.4
128	K	34.5	Very low	31.9	Very low	189 Å²	189	133.8 Å²	133.8	82%	0.822	74%	0.739	S	S	*	*			trans	-178.3	120.1	133.1	-101.1	161.3	-175.4	176.6	0	114.5
129	T	30.6	Very low	32	Very low	118 Å²	118	134.1 Å²	134.1	72%	0.724	75%	0.746	S	S	*	*			trans	36	152	130.1	42.6	0	0	0	0	122.4
130	T	33.6	Very low	32	Very low	101 Å²	101	128.6 Å²	128.6	62%	0.62	74%	0.741	S	S	*	*			cis	-161.7	152.7	24.5	-10.4	0	0	0	0	113.2
131	Q	33.5	Very low	31.9	Very low	175 Å²	175	133.9 Å²	133.9	82%	0.818	75%	0.749	S	S	*	*			trans	62.8	152.7	144.9	-75.6	161	-0.4	0	0	120.9
132	S	32.5	Very low	32.2	Very low	89 Å²	89	132.2 Å²	132.2	62%	0.622	74%	0.735	S	S	*	*			cis	-171.8	160.7	-16.7	49.8	0	0	0	0	113.3
133	V	35.1	Very low	32.4	Very low	138 Å²	138	133.7 Å²	133.7	84%	0.836	74%	0.735	S	S	*	*			trans	57.5	154.2	159.6	-67.9	0	0	0	0	119.3
134	S	34.2	Very low	32.5	Very low	94 Å²	94	132.9 Å²	132.9	66%	0.657	73%	0.734	S	S	*	*			cis	-160.4	134.5	-12.5	38.1	0	0	0	0	106.5
135	S	34.3	Very low	32.7	Very low	94 Å²	94	131.8 Å²	131.8	66%	0.657	74%	0.736	S	S	*	*				67.7	148.1	74.6	101.7	0	0	0	0	114.1
136	D	37.3	Very low	32.5	Very low	146 Å²	146	130.9 Å²	130.9	78%	0.781	74%	0.737	S	S	*	*			cis	-110.1	-147.4	0.2	-55.3	-55.8	0	0	0	110.3
137	D	35.1	Very low	32.8	Very low	117 Å²	117	127.7 Å²	127.7	63%	0.626	73%	0.731	S	S	*	*			cis	-152.8	156.7	-6.3	-161.2	58.8	0	0	0	105.6
138	L	30.8	Very low	32.3	Very low	152 Å²	152	128.2 Å²	128.2	80%	0.796	74%	0.737	S	S	*	*			cis	86	168	38.8	-40.7	179.4	0	0	0	116.7
139	V	32.9	Very low	32	Very low	132 Å²	132	125.7 Å²	125.7	80%	0.8	74%	0.736	S	S	*	*			trans	68.3	132.3	179.7	-176.3	0	0	0	0	115.8
140	S	32	Very low	31.8	Very low	113 Å²	113	127.2 Å²	127.2	79%	0.79	74%	0.74	S	S	*	*			cis	-153.5	-163.2	-7.4	-143	0	0	0	0	112.9
141	Q	29.1	Very low	31.4	Very low	174 Å²	174	130.5 Å²	130.5	81%	0.813	75%	0.745	S	S	*	*			trans	-155.9	-174.2	-175.4	-96.7	-159.9	13.6	0	0	111.3
142	P	38.1	Very low	31	Very low	79 Å²	79	131.2 Å²	131.2	51%	0.513	75%	0.746	S	S	.	*				-140.8	-141.3	-55.7	44.5	-24.4	0	0	0	112.4
143	F	29.7	Very low	30.5	Very low	198 Å²	198	133.3 Å²	133.3	87%	0.868	75%	0.75	S	S	*	*			trans	72.3	154.7	169.8	-61.2	-59	0	0	0	117.8
144	A	28.6	Very low	30.2	Very low	77 Å²	77	132.9 Å²	132.9	64%	0.636	75%	0.747	S	S	*	*			cis	-158.7	164.1	-23.4	0	0	0	0	0	107.4
145	L	29.8	Very low	30	Very low	167 Å²	167	135.3 Å²	135.3	87%	0.874	75%	0.753	S	S	*	*				-175.1	-173.8	67.9	-85.9	172	0	0	0	110.7
146	T	26.9	Very low	29.6	Very low	128 Å²	128	137.1 Å²	137.1	79%	0.785	76%	0.761	S	S	*	*			trans	-121.1	-158.4	-177.7	58.4	0	0	0	0	110.4
147	P	33.6	Very low	29.2	Very low	104 Å²	104	136 Å²	136	68%	0.675	76%	0.764	S	S	*	*			cis	-144.3	-178	-9.3	42.3	-22.8	0	0	0	118.1
148	S	27.3	Very low	28.8	Very low	108 Å²	108	136.3 Å²	136.3	76%	0.755	77%	0.77	S	S	*	*			trans	76	168.6	139.3	-75.5	0	0	0	0	123.7
149	V	27.6	Very low	28.9	Very low	135 Å²	135	138.6 Å²	138.6	82%	0.818	77%	0.774	S	S	*	*			trans	82.4	125.3	173.4	-173.7	0	0	0	0	114.6
150	L	27	Very low	28.9	Very low	151 Å²	151	141.3 Å²	141.3	79%	0.791	78%	0.775	S	S	*	*			cis	-154.4	-171.6	-15.6	-124.9	178.4	0	0	0	110.3
151	K	23.4	Very low	28.7	Very low	170 Å²	170	142.7 Å²	142.7	74%	0.739	77%	0.774	S	S	*	*			trans	-153.1	152.2	176.5	-163.9	178	-175	-178.8	0	111.2
152	F	25.5	Very low	28.8	Very low	190 Å²	190	141 Å²	141	83%	0.833	77%	0.774	S	S	*	*			trans	-137.2	137.3	169.6	-98.6	-84.4	0	0	0	112.2
153	N	23.2	Very low	28.4	Very low	132 Å²	132	142.6 Å²	142.6	71%	0.706	79%	0.788	S	S	*	*			trans	-124.3	165.7	164.5	-78.6	10.7	0	0	0	107.4
154	V	28.7	Very low	28.5	Very low	129 Å²	129	138.6 Å²	138.6	78%	0.782	78%	0.782	S	S	*	*			trans	155.6	137.5	161.1	148	0	0	0	0	107.4
155	D	29.1	Very low	28.5	Very low	146 Å²	146	139 Å²	139	78%	0.781	78%	0.78	S	S	*	*			cis	-153.9	174.6	-17.2	-104.3	-19.2	0	0	0	110.7
156	T	25.4	Very low	28.6	Very low	132 Å²	132	138 Å²	138	81%	0.81	78%	0.775	S	S	*	*			trans	-101.6	160.2	179.8	45.6	0	0	0	0	114.3
157	S	30.1	Very low	28.9	Very low	121 Å²	121	136.1 Å²	136.1	85%	0.846	77%	0.767	S	S	*	*			trans	-143.5	159.2	159	63.8	0	0	0	0	110.8
158	T	27.2	Very low	28.8	Very low	125 Å²	125	137.7 Å²	137.7	77%	0.767	77%	0.77	S	S	*	*			trans	-137.6	149.1	-152.1	37.2	0	0	0	0	116
159	K	32.5	Very low	29	Very low	200 Å²	200	139 Å²	139	87%	0.87	77%	0.769	S	S	*	*			trans	-169.6	122.6	147	-94.4	140.4	-174.1	179.9	0	106.5
160	K	32.3	Very low	29.2	Very low	188 Å²	188	139.4 Å²	139.4	82%	0.817	77%	0.766	S	S	*	*				58.1	134	67.1	-74.6	-167.3	175.4	-175.1	0	113.7
161	N	28.4	Very low	29.3	Very low	143 Å²	143	141.3 Å²	141.3	77%	0.765	77%	0.769	S	S	*	*			cis	-176.6	161.2	-21.2	-115.2	23	0	0	0	107.1
162	V	30.9	Very low	29.6	Very low	137 Å²	137	139.4 Å²	139.4	83%	0.83	76%	0.76	S	S	*	*			trans	157.5	138.9	142.4	155.2	0	0	0	0	110.9
163	S	28.8	Very low	29.6	Very low	114 Å²	114	137.3 Å²	137.3	80%	0.797	76%	0.764	S	S	*	*			trans	-140.1	150.3	171.5	-47.2	0	0	0	0	109.2
164	P	32.9	Very low	29.8	Very low	113 Å²	113	133.1 Å²	133.1	73%	0.734	75%	0.752	S	S	*	*				-127.6	150.2	122.1	4.7	17.5	0	0	0	109.7
165	S	28.1	Very low	29.8	Very low	86 Å²	86	135.9 Å²	135.9	60%	0.601	75%	0.754	S	S	*	*			cis	112.5	146.3	31.4	75.8	0	0	0	0	110.2
166	D	32.1	Very low	29.8	Very low	145 Å²	145	135.7 Å²	135.7	78%	0.775	75%	0.751	S	S	*	*			trans	69	147.3	164	-41	-47.2	0	0	0	117.1
167	S	32.8	Very low	30	Very low	89 Å²	89	138.1 Å²	138.1	62%	0.622	75%	0.754	S	S	*	*			cis	-162.5	178	-20.3	55.6	0	0	0	0	110.9
168	D	32.5	Very low	29.9	Very low	138 Å²	138	137 Å²	137	74%	0.738	75%	0.746	S	S	*	*			trans	65.2	108.2	150.9	-47.6	-37.1	0	0	0	123
169	D	31.3	Very low	30.3	Very low	136 Å²	136	137.2 Å²	137.2	73%	0.727	75%	0.75	S	S	*	*				50.1	129.4	113.6	-79.4	24.5	0	0	0	125.1
170	N	30.6	Very low	30.1	Very low	142 Å²	142	139 Å²	139	76%	0.759	75%	0.751	S	S	*	*			trans	52.8	81.1	133.1	-62.7	-51.2	0	0	0	120.7
171	F	30.5	Very low	30.2	Very low	192 Å²	192	133.8 Å²	133.8	84%	0.842	74%	0.743	S	S	*	*			trans	-138	141	153.9	-125.4	-123.2	0	0	0	108.2
172	F	28.1	Very low	30.5	Very low	129 Å²	129	132.6 Å²	132.6	57%	0.566	74%	0.736	S	S	*	*			cis	-151.9	136	9.5	-177.3	-112.4	0	0	0	110.9	G174 F175	F172-G174 WeakPolarHBondContact CE1-O 3.28Å; F172-G174 WeakPolarHBondContact CZ-O 3.44Å; F172-F175 HydrophobicContact CZ-CB 4.48Å
173	T	26.9	Very low	30.7	Very low	147 Å²	147	131.2 Å²	131.2	90%	0.902	73%	0.728	S	S	*	*			trans	-144.9	112.4	166.2	51.9	0	0	0	0	110.1
174	G	27.3	Very low	31	Very low	44 Å²	44	128.7 Å²	128.7	45%	0.454	71%	0.706	S	S	.	*			trans	151.1	167.7	-179.9	0	0	0	0	0	111.4	F172	F172-G174 WeakPolarHBondContact CE1-O 3.28Å; F172-G174 WeakPolarHBondContact CZ-O 3.44Å
175	F	27.6	Very low	31.1	Very low	187 Å²	187	128.1 Å²	128.1	82%	0.82	69%	0.692	S	S	*	*			trans	58	100.7	179.2	-64.3	-81.5	0	0	0	113.8	F172	F172-F175 HydrophobicContact CZ-CB 4.48Å
176	L	29.2	Very low	31.4	Very low	141 Å²	141	128.5 Å²	128.5	74%	0.738	69%	0.694	S	S	*	*			cis	61.7	120.1	31	-87.9	173.6	0	0	0	115
177	E	30.6	Very low	31.4	Very low	184 Å²	184	129.1 Å²	129.1	86%	0.86	70%	0.696	S	S	*	*			trans	76.5	159.9	152.5	-71.7	160.6	149.2	0	0	120.7
178	S	27.8	Very low	31.4	Very low	97 Å²	97	129.2 Å²	129.2	68%	0.678	70%	0.697	S	S	*	*			trans	-122.6	168.4	-163.3	179.9	0	0	0	0	109.9
179	P	34.3	Very low	31.3	Very low	130 Å²	130	127.6 Å²	127.6	84%	0.844	70%	0.696	S	S	*	*				-143.7	-161.8	102.4	36.1	-18	0	0	0	114.3
180	R	29.6	Very low	31.5	Very low	236 Å²	236	127.1 Å²	127.1	89%	0.891	70%	0.704	S	S	*	*			trans	-118.1	179.6	-160.9	-59.5	170.2	166.7	155.1	-9.3	113.9
181	A	34.4	Very low	31.4	Very low	80 Å²	80	123.5 Å²	123.5	66%	0.661	70%	0.7	S	S	*	*			trans	87.2	150.8	142.8	0	0	0	0	0	120.4
182	D	33.2	Very low	31.6	Very low	117 Å²	117	120.4 Å²	120.4	63%	0.626	70%	0.702	S	S	*	*			cis	-171.8	-168.2	-23.8	-89.3	-27.3	0	0	0	108.7
183	V	36.9	Very low	31.6	Very low	109 Å²	109	121.6 Å²	121.6	66%	0.661	71%	0.714	S	S	*	*			trans	115.8	91	148.2	-168.8	0	0	0	0	121.5	E57 H59	E57-V183 VanDerWaalsContact OE2-CA 3.29Å; E57-V183 WeakPolarHBondContact OE2-CA 3.37Å; H59-V183 PolarHBondContact CD2-O 2.8Å
184	D	34.5	Very low	32	Very low	61 Å²	61	124.9 Å²	124.9	33%	0.326	72%	0.716	S	S	.	*				57.7	121.4	127	-123.5	5.7	0	0	0	134.9	E57 H59	E57-D184 HydrophobicContact CG-CB 4.1Å; E57-D184 WeakPolarHBondContact CG-OD1 3.35Å; E57-D184 VanDerWaalsContact OE1-OD1 3.08Å; E57-D184 WeakPolarHBondContact OE2-CA 3.33Å; E57-D184 WeakPolarHBondContact OE2-CB 3.23Å; E57-D184 PolarHBondContact OE2-N 3.05Å; H59-D184 PolarHBondContact CD2-O 3.32Å; H59-D184 VanDerWaalsContact CD2-O 3.27Å; H59-D184 VanDerWaalsContact NE2-C 3.31Å; H59-D184 PolarHBondContact NE2-O 3.48Å
185	K	35.8	Very low	32.1	Very low	100 Å²	100	132.4 Å²	132.4	44%	0.435	74%	0.736	S	S	.	*			trans	48.1	172.5	140.4	-86.2	164.3	-145.2	87.1	0	121.2	E56 E57 H59	E56-K185 WeakPolarHBondContact OE2-CE 3.18Å; E56-K185 IonicContact OE2-NZ 2.83Å; E57-K185 IonicContact OE1-NZ 3.95Å; E57-K185 PolarHBondContact OE1-NZ 3.07Å; H59-K185 PolarHBondContact CE1-O 2.88Å; H59-K185 PolarHBondContact NE2-O 3.07Å
186	S	33.6	Very low	32.4	Very low	94 Å²	94	128.8 Å²	128.8	66%	0.657	73%	0.734	S	S	*	*			cis	-160.6	160.3	32	-42.9	0	0	0	0	117.1
187	I	32.3	Very low	32.4	Very low	159 Å²	159	130.1 Å²	130.1	82%	0.815	74%	0.741	S	S	*	*			trans	70.7	139.6	140.9	-74.4	162.1	0	0	0	119.2
188	S	33.4	Very low	32.5	Very low	90 Å²	90	125 Å²	125	63%	0.629	74%	0.738	S	S	*	*			cis	-172	148.7	-15.9	60.6	0	0	0	0	115.6
189	S	30.4	Very low	32.7	Very low	104 Å²	104	128.8 Å²	128.8	73%	0.727	75%	0.745	S	S	*	*			trans	74	145.6	137.7	77	0	0	0	0	124.9
190	S	34.3	Very low	32.6	Very low	127 Å²	127	129.7 Å²	129.7	89%	0.888	75%	0.748	S	S	*	*			trans	72.9	150.6	161.8	80	0	0	0	0	119.3
191	G	28.7	Very low	32.7	Very low	66 Å²	66	122.1 Å²	122.1	68%	0.68	74%	0.736	S	S	*	*			cis	164.5	153.1	-13.5	0	0	0	0	0	116.3
192	S	34.8	Very low	32.6	Very low	126 Å²	126	125 Å²	125	88%	0.881	74%	0.74	S	S	*	*			trans	84.7	159.2	164.6	84.8	0	0	0	0	120.9
193	N	27.6	Very low	32.6	Very low	154 Å²	154	129.8 Å²	129.8	82%	0.824	75%	0.75	S	S	*	*			trans	-113.4	161.5	-170.9	-64.4	-86.5	0	0	0	112.4
194	K	34.8	Very low	32.2	Very low	216 Å²	216	130 Å²	130	94%	0.939	75%	0.751	S	S	*	*			trans	-167.1	167	134.1	-108.2	153.1	-171.6	175.4	0	115.2
195	K	29.9	Very low	32.3	Very low	202 Å²	202	132.9 Å²	132.9	88%	0.878	78%	0.776	S	S	*	*			trans	-120.4	143.9	-174.8	-50.5	170.4	-178.9	175.6	0	111.4
196	S	33.4	Very low	32	Very low	111 Å²	111	135.1 Å²	135.1	78%	0.776	79%	0.793	S	S	*	*			trans	169.5	120.1	142.5	51.3	0	0	0	0	108.2
197	L	29.6	Very low	32.1	Very low	170 Å²	170	136.3 Å²	136.3	89%	0.89	80%	0.801	S	S	*	*				65.2	109.5	65	-163	78	0	0	0	113.1
198	G	32.5	Very low	31.9	Very low	77 Å²	77	136 Å²	136	79%	0.794	80%	0.8	S	S	*	*			trans	-175.3	118.7	173.2	0	0	0	0	0	110.6
199	Q	31.9	Very low	32	Very low	176 Å²	176	139.4 Å²	139.4	82%	0.822	81%	0.809	S	S	*	*			trans	-109.9	148.1	177.1	-61.1	173.5	-9.2	0	0	109.3
200	T	32.2	Very low	31.9	Very low	149 Å²	149	143.3 Å²	143.3	91%	0.914	81%	0.813	S	S	*	*				-175.2	153.8	124.2	30.8	0	0	0	0	112.8
201	A	31.7	Very low	31.8	Very low	77 Å²	77	143 Å²	143	64%	0.636	81%	0.811	S	S	*	*			trans	-63.4	166.2	179.9	0	0	0	0	0	114
202	N	32.6	Very low	32.1	Very low	140 Å²	140	148.3 Å²	148.3	75%	0.749	82%	0.818	S	S	*	*				-172	155.5	66.7	-105.7	-56.4	0	0	0	117.1
203	R	33	Very low	32	Very low	218 Å²	218	149 Å²	149	82%	0.823	82%	0.816	S	S	*	*			trans	59.9	92	145.9	-69.6	177.5	177.5	-170.7	-3.4	121.6
204	T	30.3	Very low	32.3	Very low	112 Å²	112	144.9 Å²	144.9	69%	0.687	81%	0.81	S	S	*	*				40.2	125.2	111	-40.2	0	0	0	0	121.1
205	S	36.3	Very low	32.7	Very low	123 Å²	123	138.2 Å²	138.2	86%	0.86	79%	0.79	S	S	*	*			trans	-151.6	133.3	139.2	-79.7	0	0	0	0	109.6
206	N	29.6	Very low	33.7	Very low	147 Å²	147	132.7 Å²	132.7	79%	0.786	78%	0.777	S	S	*	*			trans	-94.7	144.5	-170	-73.2	-22.6	0	0	0	113.3
207	S	34.7	Very low	34.7	Very low	118 Å²	118	132.5 Å²	132.5	83%	0.825	77%	0.768	S	S	*	*			trans	-143.3	128.2	157.1	-175.7	0	0	0	0	109.2
208	I	29	Very low	35.9	Very low	154 Å²	154	127.2 Å²	127.2	79%	0.79	74%	0.74	S	S	*	*			trans	-107.5	113.6	-166.8	-59.8	169.1	0	0	0	110.2
209	I	33.9	Very low	37.1	Very low	161 Å²	161	127.4 Å²	127.4	83%	0.826	72%	0.723	S	S	*	*			trans	-131.9	138.6	162.4	-60.4	-175.6	0	0	0	109.4
210	K	29.4	Very low	38.9	Very low	186 Å²	186	125 Å²	125	81%	0.809	71%	0.712	S	S	*	*			trans	-73.9	131.4	-166.1	-58.2	170.2	-178	176	0	112.7
211	S	31.4	Very low	40.4	Very low	119 Å²	119	119.9 Å²	119.9	83%	0.832	68%	0.684	S	S	*	*			trans	-90.1	106.6	162.5	53.7	0	0	0	0	110.5
212	H	35.8	Very low	41.3	Very low	179 Å²	179	119.6 Å²	119.6	83%	0.829	67%	0.669	S	S	*	*			trans	-81.1	126.3	170.3	-114.7	-85.8	0	0	0	110.3
213	V	32.4	Very low	42.8	Very low	141 Å²	141	117.5 Å²	117.5	86%	0.855	66%	0.655	S	S	*	*			trans	-69.7	132.2	168.6	178.3	0	0	0	0	108.7
214	G	34.8	Very low	44.5	Very low	67 Å²	67	110.3 Å²	110.3	69%	0.691	63%	0.633	S	S	*	*			trans	-112.7	142.6	-178.7	0	0	0	0	0	112.1
215	S	42.2	Very low	46.3	Very low	75 Å²	75	106.3 Å²	106.3	52%	0.524	61%	0.606	S	S	.	*			trans	-72.7	167.3	-165	-161.7	0	0	0	0	115.8	D217	S215-D217 VanDerWaalsContact C-N 3.35Å; S215-D217 WeakPolarHBondContact CB-OD2 3.36Å; S215-D217 VanDerWaalsContact OG-CG 3.25Å; S215-D217 PolarHBondContact OG-OD1 3.17Å; S215-D217 PolarHBondContact OG-OD2 3.35Å
216	S	50.7	Low	47.4	Very low	87 Å²	87	104.1 Å²	104.1	61%	0.608	58%	0.584	S	S	*	*	S	Bend	trans	-78.8	-14.1	-178.5	-163.9	0	0	0	0	114.2	D218 D219	S216-D218 VanDerWaalsContact C-N 3.29Å; S216-D218 PolarHBondContact O-N 3.32Å; S216-D219 PolarHBondContact O-N 3.1Å
217	D	54.5	Low	49.2	Very low	107 Å²	107	102.4 Å²	102.4	57%	0.572	57%	0.57	S	S	*	*	H	α-helix	trans	-71.3	-19.2	-160.6	-36.5	-51.7	0	0	0	114.3	S215 D219 A221	S215-D217 VanDerWaalsContact C-N 3.35Å; S215-D217 WeakPolarHBondContact CB-OD2 3.36Å; S215-D217 VanDerWaalsContact OG-CG 3.25Å; S215-D217 PolarHBondContact OG-OD1 3.17Å; S215-D217 PolarHBondContact OG-OD2 3.35Å; D217-D219 VanDerWaalsContact C-N 3.29Å; D217-D219 PolarHBondContact O-N 2.72Å; D217-A221 WeakPolarHBondContact O-CB 3.46Å; D217-A221 PolarHBondContact O-N 3.35Å
218	D	54.7	Low	50.7	Low	58 Å²	58	99.5 Å²	99.5	31%	0.31	55%	0.549	S	S	.	.	H	α-helix	trans	-61	-36.4	-179.4	-80	-46.6	0	0	0	112.8	S216 F222 K373 R376	S216-D218 VanDerWaalsContact C-N 3.29Å; S216-D218 PolarHBondContact O-N 3.32Å; D218-F222 PolarHBondContact O-N 2.78Å; D218-K373 WeakPolarHBondContact OD1-CE 3.25Å; D218-K373 IonicContact OD1-NZ 2.66Å; D218-K373 PolarHBondContact OD1-NZ 2.72Å; D218-K373 WeakPolarHBondContact OD2-CE 3.16Å; D218-K373 IonicContact OD2-NZ 2.68Å; D218-K373 PolarHBondContact OD2-NZ 3.34Å; D218-R376 PolarHBondContact O-NH1 2.95Å
219	D	58.6	Low	51.8	Low	81 Å²	81	95 Å²	95	43%	0.433	53%	0.525	S	S	.	.	H	α-helix	trans	-80.1	-46.1	-168.4	-53.7	-21.2	0	0	0	110.9	K24 S216 D217 A221 F222 E223	K24-D219 IonicContact NZ-OD1 3.21Å; K24-D219 PolarHBondContact NZ-OD1 2.9Å; K24-D219 IonicContact NZ-OD2 3.02Å; K24-D219 PolarHBondContact NZ-OD2 3.09Å; S216-D219 PolarHBondContact O-N 3.1Å; D217-D219 VanDerWaalsContact C-N 3.29Å; D217-D219 PolarHBondContact O-N 2.72Å; D219-A221 PolarHBondContact O-N 3.2Å; D219-F222 WeakPolarHBondContact O-CB 3.31Å; D219-F222 PolarHBondContact O-N 3.34Å; D219-E223 PolarHBondContact O-N 2.87Å; D219-E223 VanDerWaalsContact O-N 3.14Å
220	E	68.7	Low	52.8	Low	126 Å²	126	92.2 Å²	92.2	59%	0.589	51%	0.508	S	S	*	.	H	α-helix	trans	-55.9	-41.2	173.2	-179.5	-175.4	168.9	0	0	110.8	F222 E223 N224	E220-F222 PolarHBondContact O-N 3.42Å; E220-E223 PolarHBondContact O-N 2.9Å; E220-N224 WeakPolarHBondContact CG-ND2 3.3Å; E220-N224 WeakPolarHBondContact O-CB 3.28Å; E220-N224 VanDerWaalsContact O-CG 3.28Å; E220-N224 PolarHBondContact O-N 3.4Å; E220-N224 PolarHBondContact OE1-ND2 3.35Å
221	A	64.2	Low	54	Low	41 Å²	41	86.3 Å²	86.3	34%	0.339	49%	0.488	S	S	.	.	H	α-helix	trans	-73.8	-7.1	-179.3	0	0	0	0	0	114	D217 D219 R376	D217-A221 WeakPolarHBondContact O-CB 3.46Å; D217-A221 PolarHBondContact O-N 3.35Å; D219-A221 PolarHBondContact O-N 3.2Å; A221-R376 PolarHBondContact O-NH2 3.47Å
222	F	51.4	Low	55.2	Low	71 Å²	71	85.3 Å²	85.3	31%	0.311	47%	0.47	S	S	.	.	H	α-helix	trans	-88.4	-44.9	164.3	178.3	-105.9	0	0	0	111.3	D218 D219 E220 N224 F225 L226	D218-F222 PolarHBondContact O-N 2.78Å; D219-F222 WeakPolarHBondContact O-CB 3.31Å; D219-F222 PolarHBondContact O-N 3.34Å; E220-F222 PolarHBondContact O-N 3.42Å; F222-N224 VanDerWaalsContact C-N 3.26Å; F222-N224 PolarHBondContact O-N 3.48Å; F222-F225 WeakPolarHBondContact O-CA 3.15Å; F222-F225 WeakPolarHBondContact O-CB 3.4Å; F222-F225 PolarHBondContact O-N 3.22Å; F222-L226 HydrophobicContact CD1-CD1 4.27Å; F222-L226 HydrophobicContact CE1-CD1 3.73Å; F222-L226 HydrophobicContact CE1-CG 4.2Å; F222-L226 HydrophobicContact CZ-CD1 4.17Å; F222-L226 HydrophobicContact CZ-CD2 4.23Å; F222-L226 HydrophobicContact CZ-CG 4.28Å; F222-L226 PolarHBondContact O-N 2.7Å
223	E	63.2	Low	55.7	Low	96 Å²	96	79.2 Å²	79.2	45%	0.449	44%	0.443	S	S	.	.	H	α-helix	trans	-56.8	-40.2	172.6	-74.4	-58.9	135	0	0	112.2	D219 E220 F225 L226 K227	D219-E223 PolarHBondContact O-N 2.87Å; D219-E223 VanDerWaalsContact O-N 3.14Å; E220-E223 PolarHBondContact O-N 2.9Å; E223-F225 VanDerWaalsContact C-N 3.29Å; E223-F225 PolarHBondContact O-N 2.8Å; E223-L226 PolarHBondContact O-N 2.83Å; E223-K227 VanDerWaalsContact O-CG 3.26Å; E223-K227 WeakPolarHBondContact O-CG 3.33Å; E223-K227 PolarHBondContact O-N 3.35Å
224	N	69.7	Low	56.3	Low	67 Å²	67	75.3 Å²	75.3	36%	0.358	42%	0.417	S	S	.	.	H	α-helix	trans	-69.9	-23.2	176.3	-68.6	-13.8	0	0	0	112.7	E220 F222 K227 S228	E220-N224 WeakPolarHBondContact CG-ND2 3.3Å; E220-N224 WeakPolarHBondContact O-CB 3.28Å; E220-N224 VanDerWaalsContact O-CG 3.28Å; E220-N224 PolarHBondContact O-N 3.4Å; E220-N224 PolarHBondContact OE1-ND2 3.35Å; F222-N224 VanDerWaalsContact C-N 3.26Å; F222-N224 PolarHBondContact O-N 3.48Å; N224-K227 PolarHBondContact OD1-NZ 3.07Å; N224-S228 VanDerWaalsContact O-CB 3.32Å; N224-S228 WeakPolarHBondContact O-CB 3.32Å; N224-S228 PolarHBondContact O-N 2.65Å
225	F	66.6	Low	57.1	Low	29 Å²	29	78.4 Å²	78.4	13%	0.127	41%	0.412	C	S	.	.	H	α-helix	trans	-72.2	-44.8	167.9	167	-96.3	0	0	0	111.8	F222 E223 K227 S228 Q229 S377 A380	F222-F225 WeakPolarHBondContact O-CA 3.15Å; F222-F225 WeakPolarHBondContact O-CB 3.4Å; F222-F225 PolarHBondContact O-N 3.22Å; E223-F225 VanDerWaalsContact C-N 3.29Å; E223-F225 PolarHBondContact O-N 2.8Å; F225-K227 VanDerWaalsContact C-N 3.34Å; F225-K227 PolarHBondContact O-N 2.82Å; F225-S228 WeakPolarHBondContact O-CA 3.5Å; F225-S228 WeakPolarHBondContact O-CB 3.38Å; F225-S228 PolarHBondContact O-N 2.78Å; F225-Q229 HydrophobicContact CD1-CG 4.49Å; F225-Q229 HydrophobicContact CD2-CG 4.34Å; F225-Q229 HydrophobicContact CE1-CG 3.91Å; F225-Q229 HydrophobicContact CE2-CG 3.76Å; F225-Q229 HydrophobicContact CZ-CG 3.52Å; F225-Q229 PolarHBondContact O-N 3.1Å; F225-S377 WeakPolarHBondContact CZ-O 3.36Å; F225-A380 HydrophobicContact CD1-CB 4.35Å; F225-A380 HydrophobicContact CE1-CB 3.51Å; F225-A380 HydrophobicContact CZ-CB 4.03Å
226	L	60.1	Low	56.9	Low	77 Å²	77	80 Å²	80	40%	0.403	41%	0.414	S	S	.	.	H	α-helix	trans	-60.1	-44.4	176	-63.8	-179.5	0	0	0	111.3	F222 E223 S228 Q229 Q230	F222-L226 HydrophobicContact CD1-CD1 4.27Å; F222-L226 HydrophobicContact CE1-CD1 3.73Å; F222-L226 HydrophobicContact CE1-CG 4.2Å; F222-L226 HydrophobicContact CZ-CD1 4.17Å; F222-L226 HydrophobicContact CZ-CD2 4.23Å; F222-L226 HydrophobicContact CZ-CG 4.28Å; F222-L226 PolarHBondContact O-N 2.7Å; E223-L226 PolarHBondContact O-N 2.83Å; L226-S228 VanDerWaalsContact C-N 3.34Å; L226-S228 PolarHBondContact O-N 3.36Å; L226-Q229 PolarHBondContact O-N 3.49Å; L226-Q230 PolarHBondContact O-N 3.47Å
227	K	67.7	Low	56.3	Low	111 Å²	111	77 Å²	77	48%	0.483	40%	0.395	S	S	.	.	H	α-helix	trans	-59.1	-43	171	-65.7	167.1	-155.4	162.9	0	111.6	E223 N224 F225 Q229 Q230 T231	E223-K227 VanDerWaalsContact O-CG 3.26Å; E223-K227 WeakPolarHBondContact O-CG 3.33Å; E223-K227 PolarHBondContact O-N 3.35Å; N224-K227 PolarHBondContact OD1-NZ 3.07Å; F225-K227 VanDerWaalsContact C-N 3.34Å; F225-K227 PolarHBondContact O-N 2.82Å; K227-Q229 PolarHBondContact O-N 2.68Å; K227-Q230 PolarHBondContact O-N 3.17Å; K227-T231 WeakPolarHBondContact O-CG2 3.43Å; K227-T231 PolarHBondContact O-N 3.3Å
228	S	66.3	Low	55.6	Low	56 Å²	56	76.1 Å²	76.1	39%	0.392	39%	0.393	S	S	.	.	H	α-helix	trans	-58.6	-49.1	177.5	-170.3	0	0	0	0	111.5	N224 F225 L226 Q230 T231 E232	N224-S228 VanDerWaalsContact O-CB 3.32Å; N224-S228 WeakPolarHBondContact O-CB 3.32Å; N224-S228 PolarHBondContact O-N 2.65Å; F225-S228 WeakPolarHBondContact O-CA 3.5Å; F225-S228 WeakPolarHBondContact O-CB 3.38Å; F225-S228 PolarHBondContact O-N 2.78Å; L226-S228 VanDerWaalsContact C-N 3.34Å; L226-S228 PolarHBondContact O-N 3.36Å; S228-Q230 VanDerWaalsContact C-N 3.34Å; S228-Q230 PolarHBondContact O-N 2.9Å; S228-T231 CarbonylContact O-C 3.37Å; S228-T231 PolarHBondContact O-N 3.39Å; S228-T231 VanDerWaalsContact O-N 3.08Å; S228-T231 PolarHBondContact O-OG1 2.91Å; S228-E232 PolarHBondContact O-N 3.26Å
229	Q	52.6	Low	54.9	Low	59 Å²	59	79.4 Å²	79.4	28%	0.276	41%	0.411	S	S	.	.	H	α-helix	trans	-58.6	-44.5	176.7	-69.8	-60.4	-54.3	0	0	111.7	F225 L226 K227 T231 E232 I233	F225-Q229 HydrophobicContact CD1-CG 4.49Å; F225-Q229 HydrophobicContact CD2-CG 4.34Å; F225-Q229 HydrophobicContact CE1-CG 3.91Å; F225-Q229 HydrophobicContact CE2-CG 3.76Å; F225-Q229 HydrophobicContact CZ-CG 3.52Å; F225-Q229 PolarHBondContact O-N 3.1Å; L226-Q229 PolarHBondContact O-N 3.49Å; K227-Q229 PolarHBondContact O-N 2.68Å; Q229-T231 VanDerWaalsContact C-N 3.32Å; Q229-T231 PolarHBondContact O-N 2.97Å; Q229-E232 PolarHBondContact O-N 2.64Å; Q229-E232 VanDerWaalsContact O-N 3.13Å; Q229-I233 WeakPolarHBondContact O-CG1 3.46Å; Q229-I233 PolarHBondContact O-N 3.14Å
230	Q	54.4	Low	53.8	Low	104 Å²	104	81.8 Å²	81.8	49%	0.486	42%	0.419	S	S	.	.	H	α-helix	trans	-60.4	-39.5	174.4	-170	61.7	63.1	0	0	112.4	L226 K227 S228 N234	L226-Q230 PolarHBondContact O-N 3.47Å; K227-Q230 PolarHBondContact O-N 3.17Å; S228-Q230 VanDerWaalsContact C-N 3.34Å; S228-Q230 PolarHBondContact O-N 2.9Å; Q230-N234 PolarHBondContact NE2-OD1 2.89Å; Q230-N234 WeakPolarHBondContact O-CB 3.27Å; Q230-N234 PolarHBondContact O-N 3.33Å; Q230-N234 VanDerWaalsContact O-N 3.08Å; Q230-N234 PolarHBondContact O-ND2 3.09Å; Q230-N234 PolarHBondContact O-OD1 3.43Å
231	T	55.2	Low	52	Low	62 Å²	62	81.9 Å²	81.9	38%	0.38	42%	0.424	S	S	.	.	H	α-helix	trans	-71.4	-27.2	175.2	66.6	0	0	0	0	113.7	K227 S228 Q229 N234 K235	K227-T231 WeakPolarHBondContact O-CG2 3.43Å; K227-T231 PolarHBondContact O-N 3.3Å; S228-T231 CarbonylContact O-C 3.37Å; S228-T231 PolarHBondContact O-N 3.39Å; S228-T231 VanDerWaalsContact O-N 3.08Å; S228-T231 PolarHBondContact O-OG1 2.91Å; Q229-T231 VanDerWaalsContact C-N 3.32Å; Q229-T231 PolarHBondContact O-N 2.97Å; T231-N234 PolarHBondContact O-N 3.06Å; T231-K235 WeakPolarHBondContact O-CB 3.47Å; T231-K235 VanDerWaalsContact O-CG 3.24Å; T231-K235 WeakPolarHBondContact O-CG 3.34Å; T231-K235 PolarHBondContact O-N 3.19Å
232	E	55	Low	50.5	Low	97 Å²	97	84.9 Å²	84.9	45%	0.453	44%	0.442	S	S	.	.	H	α-helix	trans	-75.6	-40.6	177.1	-172.3	153.6	-154.6	0	0	111.6	S228 Q229 N234 K235 L236	S228-E232 PolarHBondContact O-N 3.26Å; Q229-E232 PolarHBondContact O-N 2.64Å; Q229-E232 VanDerWaalsContact O-N 3.13Å; E232-N234 VanDerWaalsContact C-N 3.31Å; E232-N234 PolarHBondContact O-N 3.31Å; E232-K235 PolarHBondContact O-N 3.1Å; E232-L236 HydrophobicContact CG-CD1 4.37Å; E232-L236 WeakPolarHBondContact O-CG 3.15Å; E232-L236 PolarHBondContact O-N 3.03Å
233	I	46.9	Very low	49.5	Very low	52 Å²	52	88.8 Å²	88.8	27%	0.267	46%	0.461	S	S	.	.	H	α-helix	trans	-54.6	-48.4	166.6	-67.8	166.5	0	0	0	110.2	Q229 K235 L236 A237 I398	Q229-I233 WeakPolarHBondContact O-CG1 3.46Å; Q229-I233 PolarHBondContact O-N 3.14Å; I233-K235 PolarHBondContact O-N 2.66Å; I233-L236 PolarHBondContact O-N 2.98Å; I233-A237 PolarHBondContact O-N 3.29Å; I233-A237 VanDerWaalsContact O-N 3.12Å; I233-I398 HydrophobicContact CG2-CD1 4.07Å
234	N	44.9	Very low	47.9	Very low	58 Å²	58	91.9 Å²	91.9	31%	0.31	47%	0.469	S	S	.	.	H	α-helix	trans	-63.3	-37.9	178.1	-65.7	-11.1	0	0	0	112.5	Q230 T231 E232 V238 Q400	Q230-N234 PolarHBondContact NE2-OD1 2.89Å; Q230-N234 WeakPolarHBondContact O-CB 3.27Å; Q230-N234 PolarHBondContact O-N 3.33Å; Q230-N234 VanDerWaalsContact O-N 3.08Å; Q230-N234 PolarHBondContact O-ND2 3.09Å; Q230-N234 PolarHBondContact O-OD1 3.43Å; T231-N234 PolarHBondContact O-N 3.06Å; E232-N234 VanDerWaalsContact C-N 3.31Å; E232-N234 PolarHBondContact O-N 3.31Å; N234-V238 WeakPolarHBondContact O-CG2 3.38Å; N234-V238 PolarHBondContact O-N 3.45Å; N234-Q400 PolarHBondContact OD1-NE2 3.02Å
235	K	51.4	Low	46	Very low	133 Å²	133	91.4 Å²	91.4	58%	0.578	47%	0.471	S	S	*	.	H	α-helix	trans	-68	-38.6	175.3	-77.1	165.2	-177.9	168.4	0	112.5	T231 E232 I233 A237 V238 N239	T231-K235 WeakPolarHBondContact O-CB 3.47Å; T231-K235 VanDerWaalsContact O-CG 3.24Å; T231-K235 WeakPolarHBondContact O-CG 3.34Å; T231-K235 PolarHBondContact O-N 3.19Å; E232-K235 PolarHBondContact O-N 3.1Å; I233-K235 PolarHBondContact O-N 2.66Å; K235-A237 VanDerWaalsContact C-N 3.34Å; K235-V238 PolarHBondContact O-N 3.32Å; K235-N239 PolarHBondContact O-N 3.12Å; K235-N239 PolarHBondContact O-ND2 2.7Å
236	L	38.9	Very low	44.2	Very low	107 Å²	107	94.4 Å²	94.4	56%	0.56	50%	0.495	S	S	*	.	H	α-helix	trans	-70.3	-30.9	179.6	-72.8	170	0	0	0	112.3	E232 I233	E232-L236 HydrophobicContact CG-CD1 4.37Å; E232-L236 WeakPolarHBondContact O-CG 3.15Å; E232-L236 PolarHBondContact O-N 3.03Å; I233-L236 PolarHBondContact O-N 2.98Å
237	A	36.9	Very low	42.9	Very low	26 Å²	26	98.8 Å²	98.8	22%	0.215	51%	0.507	C	S	.	.	H	α-helix	trans	-64	-50	171.3	0	0	0	0	0	112	I233 K235 N239 Q240	I233-A237 PolarHBondContact O-N 3.29Å; I233-A237 VanDerWaalsContact O-N 3.12Å; K235-A237 VanDerWaalsContact C-N 3.34Å; A237-N239 PolarHBondContact O-N 2.88Å; A237-N239 VanDerWaalsContact O-N 3.09Å; A237-Q240 PolarHBondContact O-N 3.31Å; A237-Q240 VanDerWaalsContact O-N 3.08Å
238	V	41.3	Very low	41.1	Very low	88 Å²	88	100.3 Å²	100.3	53%	0.533	52%	0.52	S	S	.	.	H	α-helix	trans	-61.8	-19.6	-179.6	172.8	0	0	0	0	113.4	N234 K235	N234-V238 WeakPolarHBondContact O-CG2 3.38Å; N234-V238 PolarHBondContact O-N 3.45Å; K235-V238 PolarHBondContact O-N 3.32Å
239	N	38.9	Very low	39.7	Very low	127 Å²	127	102.5 Å²	102.5	68%	0.679	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	8.9	177.8	-73.5	-69.4	0	0	0	114.4	K235 A237	K235-N239 PolarHBondContact O-N 3.12Å; K235-N239 PolarHBondContact O-ND2 2.7Å; A237-N239 PolarHBondContact O-N 2.88Å; A237-N239 VanDerWaalsContact O-N 3.09Å
240	Q	35.8	Very low	38.7	Very low	130 Å²	130	106.7 Å²	106.7	61%	0.607	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	12.6	173.8	-68.2	-171.9	32.2	0	0	114.3	A237 S242	A237-Q240 PolarHBondContact O-N 3.31Å; A237-Q240 VanDerWaalsContact O-N 3.08Å; Q240-S242 PolarHBondContact O-N 3.02Å
241	D	31.7	Very low	38.1	Very low	129 Å²	129	109 Å²	109	69%	0.69	58%	0.575	S	S	*	*			trans	-69.8	44.2	178.2	-82.3	-4.4	0	0	0	114
242	S	31.3	Very low	37.1	Very low	103 Å²	103	113.2 Å²	113.2	72%	0.72	60%	0.595	S	S	*	*			trans	-154	43.5	-173.2	74.4	0	0	0	0	117.8	Q240	Q240-S242 PolarHBondContact O-N 3.02Å
243	E	31.2	Very low	36.5	Very low	153 Å²	153	115.4 Å²	115.4	72%	0.715	61%	0.61	S	S	*	*			trans	-162.3	102.8	154.4	-119.1	178.7	170.7	0	0	111.8
244	W	29.5	Very low	35.7	Very low	162 Å²	162	124.3 Å²	124.3	61%	0.614	64%	0.64	S	S	*	*			trans	-124.8	101	177.2	-158.3	-62.2	0	0	0	111.5	V268	W244-V268 HydrophobicContact CH2-CB 4.2Å; W244-V268 HydrophobicContact CH2-CG1 3.58Å; W244-V268 HydrophobicContact CZ2-CG1 4.47Å; W244-V268 HydrophobicContact CZ3-CG1 4.2Å
245	S	29.1	Very low	35.5	Very low	57 Å²	57	126.3 Å²	126.3	40%	0.399	66%	0.659	S	S	.	*			trans	-95.4	136.4	170.1	77.1	0	0	0	0	110.6	K271	S245-K271 PolarHBondContact OG-O 2.98Å
246	S	29.3	Very low	34.4	Very low	92 Å²	92	125.6 Å²	125.6	64%	0.643	67%	0.671	S	S	*	*			trans	-94.3	138.3	-175.9	-161.7	0	0	0	0	111
247	W	32.7	Very low	34	Very low	169 Å²	169	123.5 Å²	123.5	64%	0.64	67%	0.665	S	S	*	*			trans	-129.5	173.1	149.4	-78.1	-13	0	0	0	108.1	K271 H273	W247-K271 HydrophobicContact CB-CD 4.26Å; W247-K271 HydrophobicContact CD2-CD 2.71Å; W247-K271 HydrophobicContact CD2-CG 4.05Å; W247-K271 HydrophobicContact CE3-CD 3.31Å; W247-K271 HydrophobicContact CE3-CG 4.2Å; W247-K271 HydrophobicContact CG-CD 3.31Å; W247-K271 HydrophobicContact CH2-CD 3.81Å; W247-K271 HydrophobicContact CZ2-CD 3.28Å; W247-K271 HydrophobicContact CZ2-CG 4.47Å; W247-K271 HydrophobicContact CZ3-CD 3.82Å; W247-K271 HydrophobicContact CZ3-CG 4.48Å; W247-K271 VanDerWaalsContact NE1-CD 3.3Å; W247-H273 AromaticContact CH2-CD2 3.91Å; W247-H273 AromaticContact CH2-NE2 3.4Å; W247-H273 WeakPolarHBondContact CH2-NE2 3.47Å; W247-H273 AromaticContact CZ2-NE2 3.52Å
248	D	29.5	Very low	33.6	Very low	142 Å²	142	130.2 Å²	130.2	76%	0.759	70%	0.697	S	S	*	*			trans	-116.2	152.9	163.3	-50.3	-84.4	0	0	0	107.2
249	S	37.6	Very low	33.4	Very low	102 Å²	102	128.1 Å²	128.1	71%	0.713	69%	0.686	S	S	*	*			trans	-144.7	112	167.3	-77.4	0	0	0	0	108.1
250	D	31.3	Very low	33.1	Very low	147 Å²	147	126.8 Å²	126.8	79%	0.786	69%	0.685	S	S	*	*			trans	-70.8	136.5	-174.9	-51.1	-76	0	0	0	112
251	N	42.8	Very low	33.1	Very low	153 Å²	153	124.7 Å²	124.7	82%	0.818	67%	0.671	S	S	*	*			trans	-144.8	113.8	165.3	-83.9	-74.4	0	0	0	108.4	D253	N251-D253 PolarHBondContact O-N 3.12Å; N251-D253 VanDerWaalsContact O-N 3.11Å
252	D	33.7	Very low	33.1	Very low	150 Å²	150	121.1 Å²	121.1	80%	0.802	65%	0.651	S	S	*	*			trans	-76	90.9	-177.8	-80	-74.5	0	0	0	112.5
253	D	41.5	Very low	33.2	Very low	143 Å²	143	121 Å²	121	77%	0.765	65%	0.646	S	S	*	*			trans	-111.5	92.6	167.1	-137.1	-8.6	0	0	0	109.2	N251 S255	N251-D253 PolarHBondContact O-N 3.12Å; N251-D253 VanDerWaalsContact O-N 3.11Å; D253-S255 PolarHBondContact O-N 2.87Å
254	R	31.3	Very low	33.1	Very low	239 Å²	239	118.1 Å²	118.1	90%	0.902	63%	0.631	S	S	*	*			trans	-73.4	80.9	-168.4	-76	-172.2	171.3	-161.4	-1.1	113.5
255	S	39.3	Very low	33.2	Very low	101 Å²	101	114.4 Å²	114.4	71%	0.706	62%	0.618	S	S	*	*			trans	-106.3	97	169.2	-172.5	0	0	0	0	111.5	D253 C257	D253-S255 PolarHBondContact O-N 2.87Å; S255-C257 PolarHBondContact O-N 3.25Å; S255-C257 VanDerWaalsContact O-N 3.17Å
256	S	29.7	Very low	33.3	Very low	117 Å²	117	118 Å²	118	82%	0.818	62%	0.623	S	S	*	*			trans	-70.7	107.6	-178	-174.2	0	0	0	0	111.9
257	C	29.1	Very low	33.4	Very low	64 Å²	64	123.1 Å²	123.1	43%	0.432	63%	0.629	S	S	.	*			trans	-152	85.5	172.8	53.1	0	0	0	0	111.6	S255 S259	S255-C257 PolarHBondContact O-N 3.25Å; S255-C257 VanDerWaalsContact O-N 3.17Å; C257-S259 VanDerWaalsContact C-N 3.25Å; C257-S259 PolarHBondContact O-N 2.94Å
258	D	29.5	Very low	33.1	Very low	166 Å²	166	118.3 Å²	118.3	89%	0.888	62%	0.618	S	S	*	*			trans	-69.5	72.6	-178.9	-79.7	-51.6	0	0	0	113.6
259	S	36.3	Very low	33.3	Very low	44 Å²	44	115.7 Å²	115.7	31%	0.308	60%	0.604	S	S	.	*			trans	-108.5	119.3	172.1	177.5	0	0	0	0	110.5	C257 Y261 Q262	C257-S259 VanDerWaalsContact C-N 3.25Å; C257-S259 PolarHBondContact O-N 2.94Å; S259-Y261 PolarHBondContact O-N 2.86Å; S259-Y261 PolarHBondContact OG-N 3.48Å; S259-Q262 PolarHBondContact O-N 2.88Å
260	P	33.3	Very low	32.9	Very low	100 Å²	100	114.6 Å²	114.6	65%	0.649	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-1.2	174.9	-26.1	35.7	0	0	0	115.7
261	Y	34.9	Very low	32.8	Very low	85 Å²	85	110 Å²	110	33%	0.333	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101	-22.1	178	-56.4	-73.7	0	0	0	113	S259 T263 F264 N482	S259-Y261 PolarHBondContact O-N 2.86Å; S259-Y261 PolarHBondContact OG-N 3.48Å; Y261-T263 PolarHBondContact O-N 3.44Å; Y261-F264 WeakPolarHBondContact O-CB 3.39Å; Y261-F264 PolarHBondContact O-N 2.93Å; Y261-N482 HydrophobicContact CE1-CB 3.9Å; Y261-N482 VanDerWaalsContact OH-CB 3.31Å; Y261-N482 WeakPolarHBondContact OH-CB 3.43Å; Y261-N482 VanDerWaalsContact OH-CG 3.29Å; Y261-N482 PolarHBondContact OH-ND2 3.46Å
262	Q	33.3	Very low	32.2	Very low	55 Å²	55	107.5 Å²	107.5	26%	0.257	55%	0.549	S	S	.	.	H	α-helix	trans	-58.9	-47.5	-179.9	-136.9	82.3	-0.5	0	0	111.1	S259 F264 Y265 C461	S259-Q262 PolarHBondContact O-N 2.88Å; Q262-F264 PolarHBondContact O-N 3.34Å; Q262-Y265 PolarHBondContact O-N 2.88Å; Q262-C461 PolarHBondContact NE2-SG 2.85Å
263	T	32.9	Very low	31.8	Very low	101 Å²	101	106.9 Å²	106.9	62%	0.62	54%	0.541	S	S	*	.	H	α-helix	trans	-69.3	-1.4	-177.8	57.5	0	0	0	0	114.8	Y261	Y261-T263 PolarHBondContact O-N 3.44Å
264	F	29.7	Very low	31.2	Very low	92 Å²	92	108.3 Å²	108.3	40%	0.404	55%	0.548	S	S	.	.	H	α-helix	trans	-84.9	-32.5	173.3	-173.6	-106.2	0	0	0	112.6	Y261 Q262 T303	Y261-F264 WeakPolarHBondContact O-CB 3.39Å; Y261-F264 PolarHBondContact O-N 2.93Å; Q262-F264 PolarHBondContact O-N 3.34Å; F264-T303 HydrophobicContact CE2-CG2 4.15Å; F264-T303 HydrophobicContact CZ-CG2 3.86Å
265	Y	30.4	Very low	30.9	Very low	84 Å²	84	102.3 Å²	102.3	33%	0.329	54%	0.542	S	S	.	.	H	α-helix	trans	-83.7	-27.7	-172.7	-78.6	-84.7	0	0	0	114.2	Q262 R267 I466	Q262-Y265 PolarHBondContact O-N 2.88Å; Y265-R267 VanDerWaalsContact C-N 3.3Å; Y265-R267 PolarHBondContact O-N 3.33Å; Y265-I466 HydrophobicContact CE2-CD1 4.45Å; Y265-I466 VanDerWaalsContact OH-CD1 3.25Å; Y265-I466 WeakPolarHBondContact OH-CD1 3.38Å
266	Y	32.5	Very low	30.3	Very low	132 Å²	132	100.8 Å²	100.8	52%	0.518	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	6.8	-173.4	-77.9	-78.3	0	0	0	116.1	V268 H437 C461	Y266-V268 PolarHBondContact O-N 2.88Å; Y266-H437 AromaticContact CE1-CE1 4Å; Y266-H437 AromaticContact CE1-ND1 3.97Å; Y266-C461 PolarHBondContact OH-SG 3.22Å
267	R	30.3	Very low	30.2	Very low	200 Å²	200	102.8 Å²	102.8	76%	0.755	54%	0.542	S	S	*	.			trans	-91.1	22	-164.8	-139.4	-177	-153.8	101.7	11.1	116	Y265	Y265-R267 VanDerWaalsContact C-N 3.3Å; Y265-R267 PolarHBondContact O-N 3.33Å
268	V	26.9	Very low	30.1	Very low	67 Å²	67	105.9 Å²	105.9	41%	0.406	56%	0.559	S	S	.	*			trans	-134.7	70.1	-163.9	-168.7	0	0	0	0	112.4	W244 Y266 T307	W244-V268 HydrophobicContact CH2-CB 4.2Å; W244-V268 HydrophobicContact CH2-CG1 3.58Å; W244-V268 HydrophobicContact CZ2-CG1 4.47Å; W244-V268 HydrophobicContact CZ3-CG1 4.2Å; Y266-V268 PolarHBondContact O-N 2.88Å; V268-T307 HydrophobicContact CG1-CG2 4.19Å
269	N	32.6	Very low	30	Very low	88 Å²	88	106.9 Å²	106.9	47%	0.471	56%	0.559	S	S	.	*			trans	-157.8	138	146.2	-117.5	-26.8	0	0	0	116.1	N434	N269-N434 PolarHBondContact ND2-OD1 2.9Å
270	N	30.4	Very low	29.6	Very low	78 Å²	78	112.7 Å²	112.7	42%	0.417	59%	0.585	S	S	.	*			trans	34.9	116.4	155.4	-66.2	-60.8	0	0	0	122.6	K312 N434	N270-K312 PolarHBondContact OD1-NZ 3.09Å; N270-N434 PolarHBondContact ND2-ND2 3.18Å; N270-N434 VanDerWaalsContact ND2-ND2 3.16Å
271	K	29.5	Very low	29.3	Very low	52 Å²	52	113.7 Å²	113.7	23%	0.226	59%	0.592	C	S	.	*				-146.7	132	123.3	-168.5	172.8	-135.1	166.4	0	113.2	S245 W247	S245-K271 PolarHBondContact OG-O 2.98Å; W247-K271 HydrophobicContact CB-CD 4.26Å; W247-K271 HydrophobicContact CD2-CD 2.71Å; W247-K271 HydrophobicContact CD2-CG 4.05Å; W247-K271 HydrophobicContact CE3-CD 3.31Å; W247-K271 HydrophobicContact CE3-CG 4.2Å; W247-K271 HydrophobicContact CG-CD 3.31Å; W247-K271 HydrophobicContact CH2-CD 3.81Å; W247-K271 HydrophobicContact CZ2-CD 3.28Å; W247-K271 HydrophobicContact CZ2-CG 4.47Å; W247-K271 HydrophobicContact CZ3-CD 3.82Å; W247-K271 HydrophobicContact CZ3-CG 4.48Å; W247-K271 VanDerWaalsContact NE1-CD 3.3Å
272	L	28.8	Very low	28.9	Very low	100 Å²	100	115.4 Å²	115.4	52%	0.524	62%	0.617	S	S	.	*			trans	-155.9	129.5	162.4	-117	174.7	0	0	0	108.7
273	H	25.4	Very low	28.8	Very low	136 Å²	136	124.2 Å²	124.2	63%	0.63	65%	0.647	S	S	*	*			trans	-72.3	149.7	-175.8	-106.9	-138.7	0	0	0	113	W247	W247-H273 AromaticContact CH2-CD2 3.91Å; W247-H273 AromaticContact CH2-NE2 3.4Å; W247-H273 WeakPolarHBondContact CH2-NE2 3.47Å; W247-H273 AromaticContact CZ2-NE2 3.52Å
274	L	29.1	Very low	28.6	Very low	174 Å²	174	124.1 Å²	124.1	91%	0.911	65%	0.651	S	S	*	*			trans	-130.1	131.8	149.2	-163.5	70.2	0	0	0	107.2
275	S	25	Very low	28.7	Very low	112 Å²	112	125.8 Å²	125.8	78%	0.783	67%	0.674	S	S	*	*			trans	-97.8	133.5	-166	51.8	0	0	0	0	113.4
276	G	26	Very low	28.5	Very low	69 Å²	69	129 Å²	129	71%	0.711	69%	0.692	S	S	*	*			trans	113.8	138.6	-175.8	0	0	0	0	0	110.6
277	I	28.6	Very low	28.4	Very low	160 Å²	160	125.5 Å²	125.5	82%	0.821	69%	0.687	S	S	*	*			cis	-143	137.8	14.4	-73.5	176.8	0	0	0	110.9
278	T	27.8	Very low	28.5	Very low	128 Å²	128	119.3 Å²	119.3	79%	0.785	67%	0.665	S	S	*	*			trans	64.9	126.4	160.5	-57.4	0	0	0	0	120.9
279	E	26.4	Very low	28.6	Very low	187 Å²	187	124.1 Å²	124.1	87%	0.874	68%	0.681	S	S	*	*			trans	-100.5	160.4	165	-54	174.3	148.4	0	0	111
280	L	28.3	Very low	28.5	Very low	166 Å²	166	123.4 Å²	123.4	87%	0.869	68%	0.683	S	S	*	*			trans	-154.2	160.1	152	-98.9	174.2	0	0	0	107.9
281	P	27.5	Very low	28.7	Very low	121 Å²	121	128.7 Å²	128.7	79%	0.786	71%	0.705	S	S	*	*				-117.8	175.5	-114.4	40.9	-31.7	0	0	0	115.6
282	S	26.7	Very low	28.8	Very low	122 Å²	122	131.3 Å²	131.3	85%	0.853	73%	0.73	S	S	*	*			trans	-106.8	163.3	-167.8	55.4	0	0	0	0	115.6
283	R	29.4	Very low	28.8	Very low	240 Å²	240	130 Å²	130	91%	0.906	74%	0.74	S	S	*	*			trans	-148.2	148	162.8	-98.1	-174.7	147.7	-177	-5.6	108.7
284	S	28.4	Very low	29.2	Very low	98 Å²	98	133.2 Å²	133.2	69%	0.685	75%	0.752	S	S	*	*			cis	173	111.2	-36.1	46	0	0	0	0	109.3
285	S	32.2	Very low	29.1	Very low	127 Å²	127	134.3 Å²	134.3	89%	0.888	75%	0.749	S	S	*	*			trans	-178.1	167	157	47.7	0	0	0	0	113
286	E	26.8	Very low	29.3	Very low	151 Å²	151	137.2 Å²	137.2	71%	0.706	74%	0.744	S	S	*	*			trans	-144.5	156.3	-161.4	-68.4	-162	88	0	0	115.1	N114	N114-E286 VanDerWaalsContact ND2-CB 3.27Å; N114-E286 WeakPolarHBondContact ND2-CB 3.32Å; N114-E286 VanDerWaalsContact ND2-CG 3.33Å; N114-E286 WeakPolarHBondContact ND2-CG 3.27Å; N114-E286 PolarHBondContact ND2-OE1 2.87Å
287	S	31.2	Very low	29.4	Very low	60 Å²	60	141.4 Å²	141.4	42%	0.42	75%	0.749	S	S	.	*			trans	175.1	158.2	141.6	38	0	0	0	0	111	N114 N115 F116	N114-S287 CarbonylContact C-O 3.56Å; N114-S287 WeakPolarHBondContact CA-O 3.42Å; N114-S287 WeakPolarHBondContact CB-O 3.21Å; N114-S287 VanDerWaalsContact CG-C 3.46Å; N114-S287 VanDerWaalsContact CG-N 3.32Å; N114-S287 WeakPolarHBondContact OD1-CA 3.47Å; N114-S287 PolarHBondContact OD1-N 3.43Å; N114-S287 PolarHBondContact OD1-O 2.68Å; N115-S287 PolarHBondContact N-O 3.36Å; N115-S287 VanDerWaalsContact O-O 3.12Å; F116-S287 WeakPolarHBondContact CD2-OG 3.49Å
288	K	30.6	Very low	29.6	Very low	69 Å²	69	136.2 Å²	136.2	30%	0.3	73%	0.73	S	S	.	*			trans	-128.2	154.5	-155.8	-139.4	173.2	-43.5	-58.6	0	113.2	K112 S113 N114	K112-K288 HydrophobicContact CG-CD 4.32Å; S113-K288 WeakPolarHBondContact O-CD 3.42Å; S113-K288 WeakPolarHBondContact O-CG 3.48Å; S113-K288 PolarHBondContact O-NZ 3Å; N114-K288 WeakPolarHBondContact OD1-CA 3.14Å; N114-K288 VanDerWaalsContact OD1-CB 3.25Å; N114-K288 WeakPolarHBondContact OD1-CB 3.27Å; N114-K288 WeakPolarHBondContact OD1-CG 3.13Å; N114-K288 PolarHBondContact OD1-N 3.21Å; N114-K288 PolarHBondContact OD1-NZ 3.33Å
289	F	29.1	Very low	29.6	Very low	169 Å²	169	135.5 Å²	135.5	74%	0.741	73%	0.728	S	S	*	*				180	150.3	120.5	-112	-82.9	0	0	0	115	N115	N115-F289 PolarHBondContact ND2-O 3.48Å
290	S	31.2	Very low	29.8	Very low	72 Å²	72	133.5 Å²	133.5	50%	0.503	72%	0.723	S	S	.	*			trans	-146.8	141.8	-167.1	60.8	0	0	0	0	115.5
291	H	34.1	Very low	30	Very low	190 Å²	190	134 Å²	134	88%	0.88	72%	0.718	S	S	*	*			trans	-162.7	155.5	162.4	-109	55.8	0	0	0	109.5
292	S	32.2	Very low	30.1	Very low	107 Å²	107	138.2 Å²	138.2	75%	0.748	72%	0.724	S	S	*	*			cis	-165.8	164.5	-26.7	64.2	0	0	0	0	108.9
293	G	29.7	Very low	30.4	Very low	71 Å²	71	137.3 Å²	137.3	73%	0.732	71%	0.713	S	S	*	*			trans	152	76.4	164.6	0	0	0	0	0	121.7
294	K	32	Very low	31.1	Very low	205 Å²	205	130 Å²	130	89%	0.891	69%	0.69	S	S	*	*			trans	51.5	106.6	142.7	-60.9	176.5	-179.5	177.3	0	120
295	K	27.7	Very low	32	Very low	197 Å²	197	127 Å²	127	86%	0.857	67%	0.669	S	S	*	*			trans	-70.2	151.2	170	-60.8	176.6	178.3	178.6	0	113.6
296	Y	28.7	Very low	32.6	Very low	173 Å²	173	121.5 Å²	121.5	68%	0.678	63%	0.63	S	S	*	*			trans	-150.8	90.6	158.4	-89.9	-67.8	0	0	0	113.7	K493	Y296-K493 PolarHBondContact O-NZ 3.22Å
297	I	28.6	Very low	33.8	Very low	156 Å²	156	116.1 Å²	116.1	80%	0.8	61%	0.607	S	S	*	*			trans	-82.6	141.8	169.6	-61.9	175.4	0	0	0	109.9
298	A	32.1	Very low	34.7	Very low	51 Å²	51	114.2 Å²	114.2	42%	0.421	59%	0.593	S	S	.	*			trans	-151.7	154.7	174.1	0	0	0	0	0	109.3
299	P	29.1	Very low	35.6	Very low	114 Å²	114	113.8 Å²	113.8	74%	0.74	59%	0.592	S	S	*	*			trans	-94.2	152.6	-148.9	34.7	-37.6	0	0	0	117
300	N	29.5	Very low	36.5	Very low	144 Å²	144	107.8 Å²	107.8	77%	0.77	57%	0.569	S	S	*	*			trans	30.7	113	142	-169.5	-9.6	0	0	0	118.8
301	K	33.3	Very low	37.2	Very low	177 Å²	177	106.1 Å²	106.1	77%	0.77	56%	0.557	S	S	*	*			trans	-161.6	141.3	142.1	-103.4	133.9	-168.1	169.2	0	111.9	T303	K301-T303 PolarHBondContact O-N 3.11Å
302	K	28.9	Very low	37.7	Very low	209 Å²	209	102.3 Å²	102.3	91%	0.909	54%	0.539	S	S	*	.			trans	-44.8	121.7	180	-59.3	-175.8	177.7	-169.8	0	112.8
303	T	34.3	Very low	38.1	Very low	104 Å²	104	102 Å²	102	64%	0.638	52%	0.522	S	S	*	.			trans	-112.2	128.9	173.6	32	0	0	0	0	110.4	F264 K301 S305	F264-T303 HydrophobicContact CE2-CG2 4.15Å; F264-T303 HydrophobicContact CZ-CG2 3.86Å; K301-T303 PolarHBondContact O-N 3.11Å; T303-S305 PolarHBondContact O-N 3.36Å
304	Q	44.3	Very low	38.7	Very low	87 Å²	87	102.2 Å²	102.2	41%	0.407	51%	0.51	S	S	.	.			trans	-89.1	84	-173.6	-58	179.1	-89.3	0	0	111.2	S404 K406	Q304-S404 VanDerWaalsContact CB-OG 3.26Å; Q304-S404 WeakPolarHBondContact CB-OG 3.5Å; Q304-S404 WeakPolarHBondContact O-CB 3.49Å; Q304-S404 PolarHBondContact O-OG 3.43Å; Q304-K406 VanDerWaalsContact OE1-CD 3.23Å
305	S	45.7	Very low	38.9	Very low	35 Å²	35	100.8 Å²	100.8	25%	0.245	50%	0.504	C	S	.	.			trans	-79.9	159.3	166	-158.7	0	0	0	0	110.9	T303 T307	T303-S305 PolarHBondContact O-N 3.36Å; S305-T307 WeakPolarHBondContact CB-OG1 3.47Å
306	C	44.8	Very low	39.4	Very low	10 Å²	10	95.2 Å²	95.2	7%	0.068	48%	0.482	C	S	.	.			trans	-83.2	137.5	151.1	-53.8	0	0	0	0	107	L402 L403 S404 T417	C306-L402 VanDerWaalsContact CA-O 3.31Å; C306-L402 WeakPolarHBondContact CA-O 3.25Å; C306-L403 HydrophobicContact CB-CD2 4.43Å; C306-S404 PolarHBondContact SG-N 3.15Å; C306-T417 HydrophobicContact CB-CG2 3.8Å
307	T	53.7	Low	39.9	Very low	39 Å²	39	90.6 Å²	90.6	24%	0.239	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	136.2	-174.6	-55.8	0	0	0	0	111.2	V268 S305 Q309 L402 E421	V268-T307 HydrophobicContact CG1-CG2 4.19Å; S305-T307 WeakPolarHBondContact CB-OG1 3.47Å; T307-Q309 PolarHBondContact O-N 3.49Å; T307-L402 PolarHBondContact N-O 3.2Å; T307-L402 VanDerWaalsContact N-O 3.14Å; T307-L402 PolarHBondContact O-N 2.95Å; T307-E421 VanDerWaalsContact C-OE2 3.26Å; T307-E421 WeakPolarHBondContact CA-OE2 3.33Å
308	V	49.3	Very low	40.4	Very low	20 Å²	20	91.7 Å²	91.7	12%	0.121	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	107.5	158	-171.5	0	0	0	0	109.9	V310 A399 Q400 I401 E421 H424 A425	V308-V310 HydrophobicContact CG1-CG2 4.04Å; V308-V310 PolarHBondContact O-N 2.9Å; V308-A399 HydrophobicContact CG1-CB 4Å; V308-Q400 CarbonylContact C-O 3.56Å; V308-Q400 WeakPolarHBondContact CA-O 3.46Å; V308-I401 HydrophobicContact CG2-CG1 4.29Å; V308-E421 HydrophobicContact CG2-CB 4Å; V308-E421 VanDerWaalsContact CG2-O 3.25Å; V308-E421 WeakPolarHBondContact CG2-O 3.41Å; V308-E421 WeakPolarHBondContact CG2-OE2 3.45Å; V308-E421 PolarHBondContact N-OE2 3.11Å; V308-H424 HydrophobicContact CB-CB 4.47Å; V308-H424 HydrophobicContact CG2-CB 3.61Å; V308-A425 HydrophobicContact CG1-CB 4.45Å
309	Q	48.8	Very low	40.5	Very low	60 Å²	60	97 Å²	97	28%	0.28	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	107.1	164.3	-73.9	-162.1	-39.6	0	0	109.2	T307 Q400 L402	T307-Q309 PolarHBondContact O-N 3.49Å; Q309-Q400 HydrophobicContact CB-CB 4.43Å; Q309-Q400 PolarHBondContact N-O 3.01Å; Q309-Q400 PolarHBondContact O-N 2.89Å; Q309-L402 HydrophobicContact CG-CD1 4.23Å
310	V	47.8	Very low	40.8	Very low	43 Å²	43	98.3 Å²	98.3	26%	0.261	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	110.7	170.8	165.8	0	0	0	0	108.9	V308 W428	V308-V310 HydrophobicContact CG1-CG2 4.04Å; V308-V310 PolarHBondContact O-N 2.9Å; V310-W428 HydrophobicContact CB-CD2 4.48Å; V310-W428 HydrophobicContact CG1-CD2 3.65Å; V310-W428 HydrophobicContact CG1-CE3 3.99Å; V310-W428 HydrophobicContact CG1-CG 4.29Å; V310-W428 HydrophobicContact CG1-CH2 3.8Å; V310-W428 HydrophobicContact CG1-CZ2 3.41Å; V310-W428 VanDerWaalsContact CG1-CZ2 3.41Å; V310-W428 HydrophobicContact CG1-CZ3 4.07Å; V310-W428 HydrophobicContact CG2-CB 4.27Å; V310-W428 HydrophobicContact CG2-CD2 4Å; V310-W428 HydrophobicContact CG2-CG 3.79Å
311	S	46.2	Very low	40.9	Very low	36 Å²	36	100.4 Å²	100.4	25%	0.252	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	128.7	166.6	52.4	0	0	0	0	109.9
312	K	45.4	Very low	41	Very low	111 Å²	111	96.9 Å²	96.9	48%	0.483	47%	0.472	S	S	.	.			trans	-64.8	157.4	161	-69.8	177.4	-178.7	170.2	0	108.5	N270	N270-K312 PolarHBondContact OD1-NZ 3.09Å
313	Y	40.7	Very low	41.2	Very low	101 Å²	101	91.1 Å²	91.1	40%	0.396	46%	0.458	S	S	.	.			trans	-40.6	135.8	-177.6	-49.8	-54.9	0	0	0	112.3	K315 Q395	Y313-K315 PolarHBondContact O-N 3.4Å; Y313-Q395 HydrophobicContact CD1-CB 4.15Å; Y313-Q395 HydrophobicContact CE1-CB 3.52Å; Y313-Q395 HydrophobicContact CE1-CG 3.99Å; Y313-Q395 PolarHBondContact OH-OE1 3.03Å
314	P	41.3	Very low	41	Very low	74 Å²	74	94.6 Å²	94.6	48%	0.481	47%	0.467	S	S	.	.			trans	-58	106.1	179.5	24	-33.2	0	0	0	109.1	I316	P314-I316 VanDerWaalsContact O-CG1 3.25Å; P314-I316 WeakPolarHBondContact O-CG1 3.27Å; P314-I316 PolarHBondContact O-N 3.19Å
315	K	37	Very low	40.5	Very low	175 Å²	175	99.1 Å²	99.1	76%	0.761	49%	0.485	S	S	*	.			trans	-66.3	99.5	-174.6	-74.3	-177.5	177	176.7	0	109.6	Y313 S317	Y313-K315 PolarHBondContact O-N 3.4Å; K315-S317 PolarHBondContact O-N 2.9Å
316	I	38.7	Very low	39.8	Very low	80 Å²	80	103.8 Å²	103.8	41%	0.41	50%	0.504	S	S	.	.			trans	-75	44.8	177.2	-37.7	-174.1	0	0	0	111.3	P314 K318 Y319 Q320	P314-I316 VanDerWaalsContact O-CG1 3.25Å; P314-I316 WeakPolarHBondContact O-CG1 3.27Å; P314-I316 PolarHBondContact O-N 3.19Å; I316-K318 PolarHBondContact O-N 3.44Å; I316-Y319 HydrophobicContact CG2-CD2 3.8Å; I316-Y319 HydrophobicContact CG2-CG 4.33Å; I316-Y319 PolarHBondContact O-N 2.84Å; I316-Y319 VanDerWaalsContact O-N 3.16Å; I316-Q320 PolarHBondContact O-N 3.41Å
317	S	38.7	Very low	39.3	Very low	76 Å²	76	111.7 Å²	111.7	53%	0.531	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-19.1	-173.4	59.9	0	0	0	0	113.8	K315	K315-S317 PolarHBondContact O-N 2.9Å
318	K	38.3	Very low	38.1	Very low	179 Å²	179	120.1 Å²	120.1	78%	0.778	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-24.5	174.9	-71.8	-174.9	176.9	178.3	0	113.7	I316	I316-K318 PolarHBondContact O-N 3.44Å
319	Y	33.7	Very low	37.2	Very low	162 Å²	162	124.4 Å²	124.4	64%	0.635	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	-26.7	-176.2	-66	-88.9	0	0	0	113.7	I316 K321 I322	I316-Y319 HydrophobicContact CG2-CD2 3.8Å; I316-Y319 HydrophobicContact CG2-CG 4.33Å; I316-Y319 PolarHBondContact O-N 2.84Å; I316-Y319 VanDerWaalsContact O-N 3.16Å; Y319-K321 PolarHBondContact O-N 2.97Å; Y319-K321 VanDerWaalsContact O-N 3.12Å; Y319-I322 HydrophobicContact CD1-CD1 4.09Å; Y319-I322 WeakPolarHBondContact O-CB 3.31Å; Y319-I322 PolarHBondContact O-N 3.05Å
320	Q	36	Very low	36.3	Very low	143 Å²	143	129.5 Å²	129.5	67%	0.668	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-23.6	175.4	-73.4	179.4	-40.6	0	0	113.8	I316 I322	I316-Q320 PolarHBondContact O-N 3.41Å; Q320-I322 VanDerWaalsContact C-N 3.31Å; Q320-I322 PolarHBondContact O-N 3.13Å
321	K	32.8	Very low	35.8	Very low	187 Å²	187	132.1 Å²	132.1	81%	0.813	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-7.9	172.7	-78.6	-170.4	172.9	-175.9	0	115.1	Y319	Y319-K321 PolarHBondContact O-N 2.97Å; Y319-K321 VanDerWaalsContact O-N 3.12Å
322	I	34.1	Very low	35.6	Very low	104 Å²	104	138.2 Å²	138.2	53%	0.533	68%	0.677	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.7	-30.4	178	-57.3	177.5	0	0	0	110.8	Y319 Q320 H324 K325	Y319-I322 HydrophobicContact CD1-CD1 4.09Å; Y319-I322 WeakPolarHBondContact O-CB 3.31Å; Y319-I322 PolarHBondContact O-N 3.05Å; Q320-I322 VanDerWaalsContact C-N 3.31Å; Q320-I322 PolarHBondContact O-N 3.13Å; I322-H324 PolarHBondContact O-N 2.91Å; I322-K325 PolarHBondContact O-N 3.34Å
323	S	33.2	Very low	35.8	Very low	88 Å²	88	142.6 Å²	142.6	62%	0.615	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-7	-175.4	-165.1	0	0	0	0	116.1
324	H	31.1	Very low	36.8	Very low	177 Å²	177	140.7 Å²	140.7	82%	0.819	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.5	19.8	-177.5	-80.2	-77.1	0	0	0	114	I322	I322-H324 PolarHBondContact O-N 2.91Å
325	K	32.5	Very low	38.1	Very low	182 Å²	182	139.3 Å²	139.3	79%	0.791	68%	0.68	S	S	*	*			trans	-138	27.9	174.3	-143.1	-177.1	-178.1	-173.1	0	114.9	I322 E327	I322-K325 PolarHBondContact O-N 3.34Å; K325-E327 PolarHBondContact O-N 2.92Å
326	M	31.8	Very low	40	Very low	132 Å²	132	132.9 Å²	132.9	65%	0.65	66%	0.656	S	S	*	*			trans	-81.9	99.5	170.2	-69.1	-177.3	69.3	0	0	109.8	Y333	M326-Y333 HydrophobicContact CE-CE2 4.18Å; M326-Y333 WeakPolarHBondContact CE-OH 3.36Å; M326-Y333 PolarHBondContact SD-OH 2.84Å
327	E	33.2	Very low	41.7	Very low	177 Å²	177	132.7 Å²	132.7	83%	0.827	65%	0.653	S	S	*	*			trans	-64.7	154.6	167.1	-67.3	175.7	123.8	0	0	110.6	K325 C329	K325-E327 PolarHBondContact O-N 2.92Å; E327-C329 PolarHBondContact O-N 3.3Å
328	K	29.2	Very low	43.6	Very low	216 Å²	216	133.4 Å²	133.4	94%	0.939	65%	0.648	S	S	*	*			trans	-61.8	110.8	-173.1	-66.2	176.5	179.6	176.5	0	111.5
329	C	31.1	Very low	45.9	Very low	109 Å²	109	125 Å²	125	74%	0.736	61%	0.612	S	S	*	*			trans	-133.8	125.3	164.4	-169.7	0	0	0	0	109.2	E327 S331	E327-C329 PolarHBondContact O-N 3.3Å; C329-S331 PolarHBondContact O-N 2.86Å
330	N	28.5	Very low	48.3	Very low	168 Å²	168	117.7 Å²	117.7	90%	0.898	58%	0.584	S	S	*	*			trans	-79.6	54	-172.7	-72.9	-7.5	0	0	0	112.8
331	S	37.7	Very low	50.4	Low	97 Å²	97	116.4 Å²	116.4	68%	0.678	57%	0.573	S	S	*	*			trans	-83.1	130.8	158.6	-174.5	0	0	0	0	108.4	C329 Y333	C329-S331 PolarHBondContact O-N 2.86Å; S331-Y333 PolarHBondContact O-N 3.15Å
332	Q	43.5	Very low	52.9	Low	165 Å²	165	108.3 Å²	108.3	77%	0.771	54%	0.54	S	S	*	.			trans	-59.4	128	177.2	-69.7	168.3	-63.4	0	0	110.1	L334	Q332-L334 PolarHBondContact O-N 2.89Å
333	Y	49.1	Very low	55.4	Low	202 Å²	202	104.6 Å²	104.6	79%	0.792	52%	0.521	S	S	*	.			trans	-72.3	80.5	167.4	-106.7	-97.3	0	0	0	108.2	M326 S331	M326-Y333 HydrophobicContact CE-CE2 4.18Å; M326-Y333 WeakPolarHBondContact CE-OH 3.36Å; M326-Y333 PolarHBondContact SD-OH 2.84Å; S331-Y333 PolarHBondContact O-N 3.15Å
334	L	60.4	Low	57.3	Low	62 Å²	62	103.5 Å²	103.5	33%	0.325	50%	0.504	S	S	.	.			trans	-62	142.2	170	-68.7	166.4	0	0	0	109.1	Q332 P363	Q332-L334 PolarHBondContact O-N 2.89Å; L334-P363 HydrophobicContact CD1-CG 4.32Å
335	S	69.7	Low	59.1	Low	44 Å²	44	99.3 Å²	99.3	31%	0.308	49%	0.493	S	S	.	.			trans	-77	154.6	-169.1	64.9	0	0	0	0	113	E337 E338 F339	S335-E337 PolarHBondContact O-N 3.32Å; S335-E338 VanDerWaalsContact CB-OE2 3.31Å; S335-E338 WeakPolarHBondContact CB-OE2 3.39Å; S335-E338 PolarHBondContact N-OE2 3.5Å; S335-E338 PolarHBondContact O-N 3.38Å; S335-E338 VanDerWaalsContact O-N 3.14Å; S335-E338 WeakPolarHBondContact OG-CB 3.15Å; S335-E338 VanDerWaalsContact OG-CG 3.26Å; S335-E338 WeakPolarHBondContact OG-CG 3.19Å; S335-E338 PolarHBondContact OG-N 3.1Å; S335-E338 VanDerWaalsContact OG-N 3.07Å; S335-E338 PolarHBondContact OG-OE2 3.16Å; S335-F339 PolarHBondContact O-N 3.21Å; S335-F339 VanDerWaalsContact O-N 3.1Å
336	T	77.2	Confident	60.6	Low	41 Å²	41	93.6 Å²	93.6	25%	0.252	47%	0.473	S	S	.	.	H	α-helix	trans	-54.2	-32.6	170.7	-35.5	0	0	0	0	112.1	V340 I386	T336-V340 WeakPolarHBondContact O-CG2 3.47Å; T336-V340 PolarHBondContact O-N 2.63Å; T336-I386 HydrophobicContact CG2-CB 4.12Å; T336-I386 HydrophobicContact CG2-CD1 3.75Å; T336-I386 HydrophobicContact CG2-CG1 3.52Å; T336-I386 HydrophobicContact CG2-CG2 3.6Å
337	E	74	Confident	61.7	Low	76 Å²	76	93.7 Å²	93.7	36%	0.355	48%	0.476	S	S	.	.	H	α-helix	trans	-73.3	-44.1	177.4	-75.8	134.8	-120.5	0	0	112	S335 F339 V340 Y341 K390	S335-E337 PolarHBondContact O-N 3.32Å; E337-F339 VanDerWaalsContact C-N 3.26Å; E337-F339 PolarHBondContact O-N 3.35Å; E337-V340 PolarHBondContact O-N 3.44Å; E337-V340 VanDerWaalsContact O-N 3.07Å; E337-Y341 HydrophobicContact CB-CD2 4.38Å; E337-Y341 HydrophobicContact CB-CE2 4.2Å; E337-Y341 WeakPolarHBondContact O-CD2 3.49Å; E337-Y341 PolarHBondContact O-N 2.76Å; E337-K390 IonicContact OE1-NZ 3.6Å; E337-K390 PolarHBondContact OE1-NZ 3.49Å
338	E	78.2	Confident	62.6	Low	90 Å²	90	90.7 Å²	90.7	42%	0.421	47%	0.466	S	S	.	.	H	α-helix	trans	-59.2	-35.8	173	-75.9	162.7	113.3	0	0	112.3	S335 S342	S335-E338 VanDerWaalsContact CB-OE2 3.31Å; S335-E338 WeakPolarHBondContact CB-OE2 3.39Å; S335-E338 PolarHBondContact N-OE2 3.5Å; S335-E338 PolarHBondContact O-N 3.38Å; S335-E338 VanDerWaalsContact O-N 3.14Å; S335-E338 WeakPolarHBondContact OG-CB 3.15Å; S335-E338 VanDerWaalsContact OG-CG 3.26Å; S335-E338 WeakPolarHBondContact OG-CG 3.19Å; S335-E338 PolarHBondContact OG-N 3.1Å; S335-E338 VanDerWaalsContact OG-N 3.07Å; S335-E338 PolarHBondContact OG-OE2 3.16Å; E338-S342 WeakPolarHBondContact O-CB 3.39Å; E338-S342 PolarHBondContact O-N 3.28Å; E338-S342 PolarHBondContact O-OG 3.35Å
339	F	86.7	Confident	63.7	Low	3 Å²	3	87.7 Å²	87.7	1%	0.013	46%	0.46	C	S	.	.	H	α-helix	trans	-60.5	-48.6	171.2	170.3	-98.4	0	0	0	112	S335 E337 S342 L343 D364 A365 F368 L379 K382 L383 I386	S335-F339 PolarHBondContact O-N 3.21Å; S335-F339 VanDerWaalsContact O-N 3.1Å; E337-F339 VanDerWaalsContact C-N 3.26Å; E337-F339 PolarHBondContact O-N 3.35Å; F339-S342 WeakPolarHBondContact O-CB 3.5Å; F339-S342 PolarHBondContact O-N 2.63Å; F339-L343 HydrophobicContact CE1-CD1 4.36Å; F339-L343 HydrophobicContact CZ-CD2 4.42Å; F339-D364 HydrophobicContact CD2-CB 3.76Å; F339-D364 HydrophobicContact CE2-CB 3.83Å; F339-A365 HydrophobicContact CD2-CB 4.1Å; F339-A365 HydrophobicContact CE2-CB 4.17Å; F339-F368 AromaticContact CE2-CD2 3.81Å; F339-F368 HydrophobicContact CE2-CD2 3.81Å; F339-F368 AromaticContact CE2-CE2 3.76Å; F339-F368 HydrophobicContact CE2-CE2 3.76Å; F339-F368 AromaticContact CZ-CD2 3.83Å; F339-F368 HydrophobicContact CZ-CD2 3.83Å; F339-F368 AromaticContact CZ-CE2 3.68Å; F339-F368 HydrophobicContact CZ-CE2 3.68Å; F339-L379 HydrophobicContact CZ-CD1 4.13Å; F339-K382 HydrophobicContact CE1-CD 3.93Å; F339-K382 HydrophobicContact CE1-CG 4.07Å; F339-K382 HydrophobicContact CE2-CD 4.16Å; F339-K382 HydrophobicContact CZ-CD 3.65Å; F339-K382 HydrophobicContact CZ-CG 4.2Å; F339-L383 HydrophobicContact CE1-CD2 4.44Å; F339-I386 HydrophobicContact CD1-CD1 3.49Å; F339-I386 VanDerWaalsContact CD1-CD1 3.49Å; F339-I386 HydrophobicContact CE1-CD1 3.7Å
340	V	84.6	Confident	64.5	Low	8 Å²	8	86 Å²	86	5%	0.048	44%	0.443	C	S	.	.	H	α-helix	trans	-65.2	-47.2	-178.6	172.4	0	0	0	0	111.2	I13 I16 T336 E337 S342 L343 L383 I386	I13-V340 HydrophobicContact CG1-CG1 4.32Å; I16-V340 HydrophobicContact CD1-CG1 3.37Å; T336-V340 WeakPolarHBondContact O-CG2 3.47Å; T336-V340 PolarHBondContact O-N 2.63Å; E337-V340 PolarHBondContact O-N 3.44Å; E337-V340 VanDerWaalsContact O-N 3.07Å; V340-S342 VanDerWaalsContact C-N 3.28Å; V340-S342 PolarHBondContact O-N 3.45Å; V340-L343 WeakPolarHBondContact O-CB 3.25Å; V340-L343 PolarHBondContact O-N 3.07Å; V340-L343 VanDerWaalsContact O-N 3.17Å; V340-L383 HydrophobicContact CG2-CD2 4.2Å; V340-I386 HydrophobicContact CG2-CD1 4.26Å; V340-I386 HydrophobicContact CG2-CG2 4.1Å
341	Y	80.7	Confident	65.6	Low	116 Å²	116	84.2 Å²	84.2	46%	0.455	43%	0.434	S	S	.	.	H	α-helix	trans	-63.5	-33.1	176.3	-69.7	-61	0	0	0	112.5	D12 E337 L343 Y344	D12-Y341 PolarHBondContact OD2-OH 3.32Å; E337-Y341 HydrophobicContact CB-CD2 4.38Å; E337-Y341 HydrophobicContact CB-CE2 4.2Å; E337-Y341 WeakPolarHBondContact O-CD2 3.49Å; E337-Y341 PolarHBondContact O-N 2.76Å; Y341-L343 PolarHBondContact O-N 2.94Å; Y341-Y344 HydrophobicContact CD1-CD2 4.47Å; Y341-Y344 HydrophobicContact CD1-CE2 4.36Å; Y341-Y344 PolarHBondContact O-N 2.68Å; Y341-Y344 VanDerWaalsContact O-N 3.1Å
342	S	84.6	Confident	66.4	Low	17 Å²	17	84.2 Å²	84.2	12%	0.119	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-4.9	176.2	-66.1	0	0	0	0	114.8	E338 F339 V340 R361 H362 A365	E338-S342 WeakPolarHBondContact O-CB 3.39Å; E338-S342 PolarHBondContact O-N 3.28Å; E338-S342 PolarHBondContact O-OG 3.35Å; F339-S342 WeakPolarHBondContact O-CB 3.5Å; F339-S342 PolarHBondContact O-N 2.63Å; V340-S342 VanDerWaalsContact C-N 3.28Å; V340-S342 PolarHBondContact O-N 3.45Å; S342-R361 PolarHBondContact O-NH1 3.07Å; S342-H362 WeakPolarHBondContact OG-CB 3.28Å; S342-H362 PolarHBondContact OG-N 3.08Å; S342-A365 VanDerWaalsContact CB-CB 3.48Å
343	L	85.7	Confident	66.6	Low	26 Å²	26	81.6 Å²	81.6	14%	0.136	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-18.6	172.9	-59.1	172.3	0	0	0	113.2	F339 V340 Y341 A365 F368 L379 L383	F339-L343 HydrophobicContact CE1-CD1 4.36Å; F339-L343 HydrophobicContact CZ-CD2 4.42Å; V340-L343 WeakPolarHBondContact O-CB 3.25Å; V340-L343 PolarHBondContact O-N 3.07Å; V340-L343 VanDerWaalsContact O-N 3.17Å; Y341-L343 PolarHBondContact O-N 2.94Å; L343-A365 HydrophobicContact CD2-CB 4.23Å; L343-F368 HydrophobicContact CD2-CB 4.17Å; L343-L379 HydrophobicContact CD1-CD1 3.87Å; L343-L379 HydrophobicContact CD2-CD1 3.84Å; L343-L383 HydrophobicContact CD1-CD1 4.25Å; L343-L383 HydrophobicContact CD1-CD2 3.87Å; L343-L383 HydrophobicContact CD1-CG 4.42Å
344	Y	74.7	Confident	66.5	Low	66 Å²	66	81.4 Å²	81.4	26%	0.259	42%	0.418	S	S	.	.	S	Bend	trans	-66.7	152.7	-180	-84.6	-81.3	0	0	0	112.4	I16 Y341 V346 R361	I16-Y344 HydrophobicContact CD1-CD2 4.31Å; I16-Y344 HydrophobicContact CD1-CE2 3.69Å; I16-Y344 HydrophobicContact CG1-CD2 4.35Å; I16-Y344 HydrophobicContact CG1-CE1 4.31Å; I16-Y344 HydrophobicContact CG1-CE2 3.64Å; Y341-Y344 HydrophobicContact CD1-CD2 4.47Å; Y341-Y344 HydrophobicContact CD1-CE2 4.36Å; Y341-Y344 PolarHBondContact O-N 2.68Å; Y341-Y344 VanDerWaalsContact O-N 3.1Å; Y344-V346 PolarHBondContact O-N 3.26Å; Y344-R361 PolarHBondContact O-NH1 2.91Å; Y344-R361 PolarHBondContact O-NH2 3.37Å
345	P	68.2	Low	65.7	Low	88 Å²	88	87.6 Å²	87.6	57%	0.571	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-57.7	136.3	163.5	-18.7	32.5	0	0	0	110
346	V	63.6	Low	64.7	Low	62 Å²	62	86.8 Å²	86.8	38%	0.376	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-91.8	134.5	167.6	167.8	0	0	0	0	106.5	Y344 N348 R361	Y344-V346 PolarHBondContact O-N 3.26Å; V346-N348 PolarHBondContact O-N 3.28Å; V346-N348 PolarHBondContact O-OD1 3.5Å; V346-R361 VanDerWaalsContact CG2-NH2 3.35Å
347	N	56.1	Low	63.2	Low	134 Å²	134	88.3 Å²	88.3	72%	0.717	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-68.5	120.6	177.5	-73.7	-19.6	0	0	0	109.7	N349	N347-N349 PolarHBondContact O-N 3.27Å; N347-N349 VanDerWaalsContact O-N 3.12Å
348	N	52.2	Low	62	Low	114 Å²	114	90.9 Å²	90.9	61%	0.61	46%	0.458	S	S	*	.			trans	-78.4	15.1	-179.2	-67	-20.4	0	0	0	113.5	V346 D350	V346-N348 PolarHBondContact O-N 3.28Å; V346-N348 PolarHBondContact O-OD1 3.5Å; N348-D350 PolarHBondContact O-N 3.29Å
349	N	51.9	Low	60.9	Low	153 Å²	153	95.6 Å²	95.6	82%	0.818	48%	0.477	S	S	*	.			trans	-78.8	18.3	-172.8	-60.6	11.2	0	0	0	113.4	N347	N347-N349 PolarHBondContact O-N 3.27Å; N347-N349 VanDerWaalsContact O-N 3.12Å
350	D	47.9	Very low	59.8	Low	73 Å²	73	100.6 Å²	100.6	39%	0.39	50%	0.503	S	S	.	.			trans	-140.6	70.6	-177.2	-171.1	8.8	0	0	0	109	N348 S352 K353	N348-D350 PolarHBondContact O-N 3.29Å; D350-S352 PolarHBondContact O-N 2.78Å; D350-S352 WeakPolarHBondContact OD1-CB 3.4Å; D350-S352 PolarHBondContact OD1-OG 3.37Å; D350-K353 PolarHBondContact O-N 3.42Å; D350-K353 IonicContact OD2-NZ 3.04Å; D350-K353 PolarHBondContact OD2-NZ 2.97Å
351	D	51.1	Low	58.9	Low	132 Å²	132	102 Å²	102	71%	0.706	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-53.9	-19.1	-179	-82.1	-64.3	0	0	0	113.6	K353	D351-K353 PolarHBondContact O-N 2.8Å; D351-K353 VanDerWaalsContact O-N 3.13Å
352	S	53.6	Low	58.8	Low	96 Å²	96	97.5 Å²	97.5	67%	0.671	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-57.9	-22.4	174.3	79.9	0	0	0	0	113.9	D350	D350-S352 PolarHBondContact O-N 2.78Å; D350-S352 WeakPolarHBondContact OD1-CB 3.4Å; D350-S352 PolarHBondContact OD1-OG 3.37Å
353	K	49.5	Very low	58.6	Low	110 Å²	110	100.3 Å²	100.3	48%	0.478	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-108.9	14.6	-169.9	-84.4	-172.7	-164.6	107.2	0	115.7	D350 D351 M355 S356	D350-K353 PolarHBondContact O-N 3.42Å; D350-K353 IonicContact OD2-NZ 3.04Å; D350-K353 PolarHBondContact OD2-NZ 2.97Å; D351-K353 PolarHBondContact O-N 2.8Å; D351-K353 VanDerWaalsContact O-N 3.13Å; K353-M355 PolarHBondContact O-N 3.23Å; K353-S356 WeakPolarHBondContact CB-OG 3.15Å; K353-S356 WeakPolarHBondContact O-CB 3.38Å; K353-S356 PolarHBondContact O-N 2.88Å; K353-S356 PolarHBondContact O-OG 3.1Å
354	R	46.7	Very low	58.5	Low	198 Å²	198	102.4 Å²	102.4	75%	0.747	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-23.7	-175.8	-158.1	168.6	-179.1	175.8	-0.6	115.2	H357	R354-H357 PolarHBondContact O-CD2 3.06Å
355	M	42.8	Very low	59	Low	193 Å²	193	99.3 Å²	99.3	95%	0.951	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	1.3	173.7	-74.9	172.5	59.5	0	0	115.5	K353	K353-M355 PolarHBondContact O-N 3.23Å
356	S	49	Very low	59.8	Low	26 Å²	26	96.7 Å²	96.7	18%	0.182	49%	0.489	C	S	.	.			trans	-111	-3.9	-173.1	69.9	0	0	0	0	115.6	K353 E358 K359 L360	K353-S356 WeakPolarHBondContact CB-OG 3.15Å; K353-S356 WeakPolarHBondContact O-CB 3.38Å; K353-S356 PolarHBondContact O-N 2.88Å; K353-S356 PolarHBondContact O-OG 3.1Å; S356-E358 PolarHBondContact O-N 3.31Å; S356-E358 VanDerWaalsContact O-N 3.09Å; S356-K359 PolarHBondContact O-N 3.15Å; S356-L360 PolarHBondContact O-N 3.03Å; S356-L360 WeakPolarHBondContact OG-CD1 3.4Å
357	H	46.4	Very low	61	Low	73 Å²	73	97.6 Å²	97.6	34%	0.338	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.9	-171.6	-76	-104.9	0	0	0	115.2	R354	R354-H357 PolarHBondContact O-CD2 3.06Å
358	E	49	Very low	62.5	Low	131 Å²	131	91.4 Å²	91.4	61%	0.612	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-17.4	174.4	-65.4	-173.4	131.5	0	0	113.4	S356 Q370	S356-E358 PolarHBondContact O-N 3.31Å; S356-E358 VanDerWaalsContact O-N 3.09Å; E358-Q370 PolarHBondContact OE1-NE2 3.5Å
359	K	54.4	Low	64.1	Low	189 Å²	189	88.9 Å²	88.9	82%	0.822	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-13.1	175.4	-68	-171.3	176.5	-175	0	113.5	S356	S356-K359 PolarHBondContact O-N 3.15Å
360	L	62.2	Low	65.7	Low	108 Å²	108	87.3 Å²	87.3	57%	0.565	43%	0.431	S	S	*	.	S	Bend	trans	-103.9	12.5	-176.7	-69	172.1	0	0	0	113.7	S356	S356-L360 PolarHBondContact O-N 3.03Å; S356-L360 WeakPolarHBondContact OG-CD1 3.4Å
361	R	67.7	Low	67.5	Low	36 Å²	36	90.3 Å²	90.3	14%	0.136	44%	0.44	C	S	.	.	S	Bend	trans	-133.3	142.9	176.8	-65.9	-176	-176.8	-86.6	-2.6	110.2	S342 Y344 V346 L366	S342-R361 PolarHBondContact O-NH1 3.07Å; Y344-R361 PolarHBondContact O-NH1 2.91Å; Y344-R361 PolarHBondContact O-NH2 3.37Å; V346-R361 VanDerWaalsContact CG2-NH2 3.35Å; R361-L366 HydrophobicContact CB-CD2 3.92Å; R361-L366 HydrophobicContact CB-CG 4.44Å
362	H	76.8	Confident	69.2	Low	23 Å²	23	88.3 Å²	88.3	11%	0.106	43%	0.426	C	S	.	.			trans	-53.2	134.1	169.3	-172.6	-60.2	0	0	0	110	S342 D364 A365	S342-H362 WeakPolarHBondContact OG-CB 3.28Å; S342-H362 PolarHBondContact OG-N 3.08Å; H362-D364 IonicContact CE1-OD1 2.7Å; H362-D364 PolarHBondContact CE1-OD1 3.47Å; H362-D364 WeakPolarHBondContact ND1-CB 3.48Å; H362-D364 PolarHBondContact ND1-N 2.99Å; H362-D364 IonicContact ND1-OD1 2.87Å; H362-D364 PolarHBondContact O-N 3.2Å; H362-A365 HydrophobicContact CB-CB 4.24Å; H362-A365 WeakPolarHBondContact O-CB 3.49Å; H362-A365 PolarHBondContact O-N 3.47Å
363	P	81.1	Confident	70.7	Confident	76 Å²	76	89.7 Å²	89.7	49%	0.494	42%	0.42	S	S	.	.	H	α-helix	trans	-54.8	-48.3	-174.5	18.3	-31.6	0	0	0	113	L334 A365 L366	L334-P363 HydrophobicContact CD1-CG 4.32Å; P363-A365 PolarHBondContact O-N 3.3Å; P363-A365 VanDerWaalsContact O-N 3.13Å; P363-L366 WeakPolarHBondContact O-CB 3.46Å; P363-L366 PolarHBondContact O-N 2.81Å; P363-L366 VanDerWaalsContact O-N 3.09Å
364	D	83.7	Confident	72.7	Confident	70 Å²	70	89 Å²	89	37%	0.374	43%	0.426	S	S	.	.	H	α-helix	trans	-55.2	-28.2	173.8	-64.6	37.8	0	0	0	115	F339 H362 K367 F368 K382	F339-D364 HydrophobicContact CD2-CB 3.76Å; F339-D364 HydrophobicContact CE2-CB 3.83Å; H362-D364 IonicContact CE1-OD1 2.7Å; H362-D364 PolarHBondContact CE1-OD1 3.47Å; H362-D364 WeakPolarHBondContact ND1-CB 3.48Å; H362-D364 PolarHBondContact ND1-N 2.99Å; H362-D364 IonicContact ND1-OD1 2.87Å; H362-D364 PolarHBondContact O-N 3.2Å; D364-K367 WeakPolarHBondContact O-CG 3.35Å; D364-F368 WeakPolarHBondContact O-CD2 3.06Å; D364-F368 WeakPolarHBondContact O-CE2 3.39Å; D364-K382 IonicContact OD2-NZ 2.73Å; D364-K382 PolarHBondContact OD2-NZ 2.97Å
365	A	86	Confident	74.7	Confident	0 Å²	0	81.4 Å²	81.4	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-76.1	-27.5	-179.4	0	0	0	0	0	112	F339 S342 L343 H362 P363 K367 F368 V369	F339-A365 HydrophobicContact CD2-CB 4.1Å; F339-A365 HydrophobicContact CE2-CB 4.17Å; S342-A365 VanDerWaalsContact CB-CB 3.48Å; L343-A365 HydrophobicContact CD2-CB 4.23Å; H362-A365 HydrophobicContact CB-CB 4.24Å; H362-A365 WeakPolarHBondContact O-CB 3.49Å; H362-A365 PolarHBondContact O-N 3.47Å; P363-A365 PolarHBondContact O-N 3.3Å; P363-A365 VanDerWaalsContact O-N 3.13Å; A365-K367 VanDerWaalsContact C-N 3.34Å; A365-K367 PolarHBondContact O-N 2.87Å; A365-F368 PolarHBondContact O-N 3.26Å; A365-V369 WeakPolarHBondContact O-CG2 3.33Å; A365-V369 PolarHBondContact O-N 3.02Å
366	L	84.2	Confident	76.8	Confident	34 Å²	34	74.5 Å²	74.5	18%	0.178	36%	0.364	C	S	.	.	H	α-helix	trans	-56.6	-44.3	-176.9	-68.5	172.1	0	0	0	112.2	R361 P363 F368 V369 Q370	R361-L366 HydrophobicContact CB-CD2 3.92Å; R361-L366 HydrophobicContact CB-CG 4.44Å; P363-L366 WeakPolarHBondContact O-CB 3.46Å; P363-L366 PolarHBondContact O-N 2.81Å; P363-L366 VanDerWaalsContact O-N 3.09Å; L366-F368 VanDerWaalsContact C-N 3.26Å; L366-F368 PolarHBondContact O-N 3.31Å; L366-V369 PolarHBondContact O-N 3.5Å; L366-Q370 VanDerWaalsContact O-CB 3.25Å; L366-Q370 WeakPolarHBondContact O-CB 3.48Å; L366-Q370 VanDerWaalsContact O-CG 3.27Å; L366-Q370 WeakPolarHBondContact O-CG 3.44Å; L366-Q370 PolarHBondContact O-N 2.9Å
367	K	88.2	Confident	78.6	Confident	81 Å²	81	75.4 Å²	75.4	35%	0.352	37%	0.37	S	S	.	.	H	α-helix	trans	-63.6	-31.5	179.2	67.9	172.8	-177.6	167	0	113.2	D364 A365 K371 N375 E378	D364-K367 WeakPolarHBondContact O-CG 3.35Å; A365-K367 VanDerWaalsContact C-N 3.34Å; A365-K367 PolarHBondContact O-N 2.87Å; K367-K371 PolarHBondContact O-N 2.97Å; K367-K371 VanDerWaalsContact O-N 3.15Å; K367-N375 PolarHBondContact O-ND2 3.18Å; K367-E378 WeakPolarHBondContact CE-OE2 3.42Å; K367-E378 IonicContact NZ-OE1 2.73Å; K367-E378 PolarHBondContact NZ-OE1 3.28Å; K367-E378 IonicContact NZ-OE2 2.7Å; K367-E378 PolarHBondContact NZ-OE2 3.17Å
368	F	88.9	Confident	80.7	Confident	4 Å²	4	76.1 Å²	76.1	2%	0.018	37%	0.373	C	S	.	.	H	α-helix	trans	-79.9	-37.9	179.3	-60.6	-59	0	0	0	111.8	F339 L343 D364 A365 L366 F372 N375 E378 L379 K382	F339-F368 AromaticContact CE2-CD2 3.81Å; F339-F368 HydrophobicContact CE2-CD2 3.81Å; F339-F368 AromaticContact CE2-CE2 3.76Å; F339-F368 HydrophobicContact CE2-CE2 3.76Å; F339-F368 AromaticContact CZ-CD2 3.83Å; F339-F368 HydrophobicContact CZ-CD2 3.83Å; F339-F368 AromaticContact CZ-CE2 3.68Å; F339-F368 HydrophobicContact CZ-CE2 3.68Å; L343-F368 HydrophobicContact CD2-CB 4.17Å; D364-F368 WeakPolarHBondContact O-CD2 3.06Å; D364-F368 WeakPolarHBondContact O-CE2 3.39Å; A365-F368 PolarHBondContact O-N 3.26Å; L366-F368 VanDerWaalsContact C-N 3.26Å; L366-F368 PolarHBondContact O-N 3.31Å; F368-F372 WeakPolarHBondContact O-CA 3.28Å; F368-F372 WeakPolarHBondContact O-CB 3.35Å; F368-F372 PolarHBondContact O-N 3.36Å; F368-F372 VanDerWaalsContact O-N 3.16Å; F368-N375 HydrophobicContact CD1-CB 3.71Å; F368-N375 HydrophobicContact CE1-CB 4.09Å; F368-E378 HydrophobicContact CE1-CB 4.05Å; F368-E378 HydrophobicContact CE1-CG 4.06Å; F368-E378 HydrophobicContact CZ-CG 4.08Å; F368-L379 HydrophobicContact CB-CD1 4.11Å; F368-L379 HydrophobicContact CB-CD2 4.28Å; F368-L379 HydrophobicContact CD1-CB 3.59Å; F368-L379 HydrophobicContact CD1-CD1 4.14Å; F368-L379 HydrophobicContact CD1-CG 4.33Å; F368-L379 HydrophobicContact CD2-CD1 3.86Å; F368-L379 HydrophobicContact CE1-CB 3.8Å; F368-L379 HydrophobicContact CE2-CD1 4.26Å; F368-L379 HydrophobicContact CG-CB 4.12Å; F368-L379 HydrophobicContact CG-CD1 3.79Å; F368-L379 HydrophobicContact CG-CG 4.36Å; F368-L379 HydrophobicContact CZ-CB 4.46Å; F368-K382 HydrophobicContact CE2-CD 4.3Å
369	V	85.8	Confident	82.7	Confident	61 Å²	61	70.1 Å²	70.1	37%	0.37	35%	0.346	S	S	.	.	H	α-helix	trans	-73.5	-44.3	177.2	176.8	0	0	0	0	111.6	A365 L366	A365-V369 WeakPolarHBondContact O-CG2 3.33Å; A365-V369 PolarHBondContact O-N 3.02Å; L366-V369 PolarHBondContact O-N 3.5Å
370	Q	84.8	Confident	84.4	Confident	119 Å²	119	62.3 Å²	62.3	56%	0.556	32%	0.317	S	S	*	.	H	α-helix	trans	-73.2	-34.5	-179.8	-67.5	177.7	-4.2	0	0	113.1	E358 L366	E358-Q370 PolarHBondContact OE1-NE2 3.5Å; L366-Q370 VanDerWaalsContact O-CB 3.25Å; L366-Q370 WeakPolarHBondContact O-CB 3.48Å; L366-Q370 VanDerWaalsContact O-CG 3.27Å; L366-Q370 WeakPolarHBondContact O-CG 3.44Å; L366-Q370 PolarHBondContact O-N 2.9Å
371	K	86.2	Confident	85.6	Confident	136 Å²	136	61.3 Å²	61.3	59%	0.591	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.6	54.8	-174	-65.3	-176.1	-179.1	177.3	0	111.8	K367 K373 P374 N375	K367-K371 PolarHBondContact O-N 2.97Å; K367-K371 VanDerWaalsContact O-N 3.15Å; K371-K373 PolarHBondContact O-N 3.26Å; K371-P374 HydrophobicContact CB-CG 4.08Å; K371-P374 VanDerWaalsContact O-CD 3.28Å; K371-P374 WeakPolarHBondContact O-CD 3.17Å; K371-P374 WeakPolarHBondContact O-CG 3.29Å; K371-N375 WeakPolarHBondContact O-CB 3.36Å; K371-N375 PolarHBondContact O-N 2.81Å; K371-N375 PolarHBondContact O-ND2 2.88Å
372	F	86.2	Confident	86.7	Confident	90 Å²	90	62 Å²	62	40%	0.395	31%	0.313	S	S	.	.	H	α-helix	trans	-53.6	-53.3	-177.3	177	-107	0	0	0	114	L20 F368 N375 R376 L379	L20-F372 HydrophobicContact CD2-CE2 4.2Å; L20-F372 HydrophobicContact CD2-CZ 4.46Å; F368-F372 WeakPolarHBondContact O-CA 3.28Å; F368-F372 WeakPolarHBondContact O-CB 3.35Å; F368-F372 PolarHBondContact O-N 3.36Å; F368-F372 VanDerWaalsContact O-N 3.16Å; F372-N375 CarbonylContact O-C 3.3Å; F372-N375 PolarHBondContact O-N 2.9Å; F372-N375 VanDerWaalsContact O-N 3.1Å; F372-R376 HydrophobicContact CE2-CB 4.14Å; F372-R376 HydrophobicContact CZ-CB 4.13Å; F372-R376 WeakPolarHBondContact O-CB 3.39Å; F372-R376 PolarHBondContact O-N 2.6Å; F372-L379 HydrophobicContact CD2-CD2 4.22Å; F372-L379 HydrophobicContact CE2-CD2 4.03Å
373	K	85.7	Confident	87.3	Confident	126 Å²	126	61.5 Å²	61.5	55%	0.548	31%	0.311	S	S	.	.	H	α-helix	trans	-52	-53.8	-173.6	-77.2	-158.1	173.2	-153.6	0	114.8	D218 K371 R376	D218-K373 WeakPolarHBondContact OD1-CE 3.25Å; D218-K373 IonicContact OD1-NZ 2.66Å; D218-K373 PolarHBondContact OD1-NZ 2.72Å; D218-K373 WeakPolarHBondContact OD2-CE 3.16Å; D218-K373 IonicContact OD2-NZ 2.68Å; D218-K373 PolarHBondContact OD2-NZ 3.34Å; K371-K373 PolarHBondContact O-N 3.26Å; K373-R376 WeakPolarHBondContact O-CG 3.37Å
374	P	90.2	Very high	87.5	Confident	95 Å²	95	62.8 Å²	62.8	62%	0.617	31%	0.307	S	S	*	.	H	α-helix	trans	-70.7	-31.9	177	27.4	-35.5	0	0	0	113.3	K371	K371-P374 HydrophobicContact CB-CG 4.08Å; K371-P374 VanDerWaalsContact O-CD 3.28Å; K371-P374 WeakPolarHBondContact O-CD 3.17Å; K371-P374 WeakPolarHBondContact O-CG 3.29Å
375	N	88.8	Confident	87.6	Confident	38 Å²	38	64 Å²	64	20%	0.203	31%	0.31	C	S	.	.	H	α-helix	trans	-93.9	0.8	-171	-58.9	-17.8	0	0	0	113.8	K367 F368 K371 F372 S377 E378 L379	K367-N375 PolarHBondContact O-ND2 3.18Å; F368-N375 HydrophobicContact CD1-CB 3.71Å; F368-N375 HydrophobicContact CE1-CB 4.09Å; K371-N375 WeakPolarHBondContact O-CB 3.36Å; K371-N375 PolarHBondContact O-N 2.81Å; K371-N375 PolarHBondContact O-ND2 2.88Å; F372-N375 CarbonylContact O-C 3.3Å; F372-N375 PolarHBondContact O-N 2.9Å; F372-N375 VanDerWaalsContact O-N 3.1Å; N375-S377 VanDerWaalsContact C-N 3.3Å; N375-S377 PolarHBondContact O-N 2.92Å; N375-E378 PolarHBondContact O-N 3.45Å; N375-L379 PolarHBondContact O-N 3.45Å
376	R	88	Confident	87.6	Confident	49 Å²	49	64.5 Å²	64.5	19%	0.185	31%	0.313	C	S	.	.	H	α-helix	trans	-58.8	-35	-174.7	68.1	-177.9	175.6	168.8	-5.4	114.2	D218 A221 F372 K373 L379 A380	D218-R376 PolarHBondContact O-NH1 2.95Å; A221-R376 PolarHBondContact O-NH2 3.47Å; F372-R376 HydrophobicContact CE2-CB 4.14Å; F372-R376 HydrophobicContact CZ-CB 4.13Å; F372-R376 WeakPolarHBondContact O-CB 3.39Å; F372-R376 PolarHBondContact O-N 2.6Å; K373-R376 WeakPolarHBondContact O-CG 3.37Å; R376-L379 PolarHBondContact O-N 2.93Å; R376-A380 WeakPolarHBondContact O-CB 3.2Å; R376-A380 PolarHBondContact O-N 3.04Å
377	S	86.1	Confident	87.5	Confident	45 Å²	45	65.6 Å²	65.6	32%	0.315	32%	0.315	S	S	.	.	H	α-helix	trans	-69.8	-45.2	-179.7	-53.1	0	0	0	0	111.1	F225 N375 L379 A380 E381	F225-S377 WeakPolarHBondContact CZ-O 3.36Å; N375-S377 VanDerWaalsContact C-N 3.3Å; N375-S377 PolarHBondContact O-N 2.92Å; S377-L379 VanDerWaalsContact C-N 3.34Å; S377-A380 PolarHBondContact O-N 3.36Å; S377-E381 PolarHBondContact O-N 3.46Å
378	E	90.6	Very high	87.3	Confident	87 Å²	87	62.1 Å²	62.1	41%	0.407	30%	0.3	S	S	.	.	H	α-helix	trans	-65.7	-37.2	174.1	-174	-166.7	-167.8	0	0	111.3	K367 F368 N375 E381 K382	K367-E378 WeakPolarHBondContact CE-OE2 3.42Å; K367-E378 IonicContact NZ-OE1 2.73Å; K367-E378 PolarHBondContact NZ-OE1 3.28Å; K367-E378 IonicContact NZ-OE2 2.7Å; K367-E378 PolarHBondContact NZ-OE2 3.17Å; F368-E378 HydrophobicContact CE1-CB 4.05Å; F368-E378 HydrophobicContact CE1-CG 4.06Å; F368-E378 HydrophobicContact CZ-CG 4.08Å; N375-E378 PolarHBondContact O-N 3.45Å; E378-E381 PolarHBondContact O-N 3.26Å; E378-K382 WeakPolarHBondContact O-CB 3.24Å; E378-K382 PolarHBondContact O-N 3.07Å
379	L	91.6	Very high	87	Confident	6 Å²	6	65.8 Å²	65.8	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-61.7	-47.2	173.6	179.5	60.8	0	0	0	111.4	F339 L343 F368 F372 N375 R376 S377 K382 L383	F339-L379 HydrophobicContact CZ-CD1 4.13Å; L343-L379 HydrophobicContact CD1-CD1 3.87Å; L343-L379 HydrophobicContact CD2-CD1 3.84Å; F368-L379 HydrophobicContact CB-CD1 4.11Å; F368-L379 HydrophobicContact CB-CD2 4.28Å; F368-L379 HydrophobicContact CD1-CB 3.59Å; F368-L379 HydrophobicContact CD1-CD1 4.14Å; F368-L379 HydrophobicContact CD1-CG 4.33Å; F368-L379 HydrophobicContact CD2-CD1 3.86Å; F368-L379 HydrophobicContact CE1-CB 3.8Å; F368-L379 HydrophobicContact CE2-CD1 4.26Å; F368-L379 HydrophobicContact CG-CB 4.12Å; F368-L379 HydrophobicContact CG-CD1 3.79Å; F368-L379 HydrophobicContact CG-CG 4.36Å; F368-L379 HydrophobicContact CZ-CB 4.46Å; F372-L379 HydrophobicContact CD2-CD2 4.22Å; F372-L379 HydrophobicContact CE2-CD2 4.03Å; N375-L379 PolarHBondContact O-N 3.45Å; R376-L379 PolarHBondContact O-N 2.93Å; S377-L379 VanDerWaalsContact C-N 3.34Å; L379-K382 PolarHBondContact O-N 3.27Å; L379-L383 HydrophobicContact CD1-CD1 3.99Å; L379-L383 HydrophobicContact CD1-CG 4.07Å; L379-L383 HydrophobicContact CG-CD1 3.9Å; L379-L383 HydrophobicContact CG-CG 4.38Å; L379-L383 WeakPolarHBondContact O-CB 3.21Å; L379-L383 VanDerWaalsContact O-CG 3.31Å; L379-L383 WeakPolarHBondContact O-CG 3.32Å; L379-L383 PolarHBondContact O-N 3.32Å
380	A	89	Confident	86.7	Confident	25 Å²	25	66.7 Å²	66.7	21%	0.207	32%	0.316	C	S	.	.	H	α-helix	trans	-65.1	-39.3	-180	0	0	0	0	0	111.7	F225 R376 S377 Y384	F225-A380 HydrophobicContact CD1-CB 4.35Å; F225-A380 HydrophobicContact CE1-CB 3.51Å; F225-A380 HydrophobicContact CZ-CB 4.03Å; R376-A380 WeakPolarHBondContact O-CB 3.2Å; R376-A380 PolarHBondContact O-N 3.04Å; S377-A380 PolarHBondContact O-N 3.36Å; A380-Y384 WeakPolarHBondContact O-CB 3.33Å; A380-Y384 PolarHBondContact O-N 3.22Å
381	E	88.6	Confident	86.4	Confident	87 Å²	87	63.3 Å²	63.3	41%	0.407	30%	0.301	S	S	.	.	H	α-helix	trans	-63.1	-48.2	172.7	-163.7	-166.8	153.8	0	0	111.5	S377 E378 L383 Y384 Q385	S377-E381 PolarHBondContact O-N 3.46Å; E378-E381 PolarHBondContact O-N 3.26Å; E381-L383 PolarHBondContact O-N 2.82Å; E381-Y384 PolarHBondContact O-N 3.14Å; E381-Q385 WeakPolarHBondContact O-CG 3.38Å; E381-Q385 PolarHBondContact O-N 3.23Å; E381-Q385 PolarHBondContact OE1-NE2 3.43Å
382	K	89.6	Confident	85.9	Confident	49 Å²	49	60.2 Å²	60.2	21%	0.213	29%	0.288	C	S	.	.	H	α-helix	trans	-62.7	-40.4	177.9	-174.6	166.9	-179.6	179.9	0	112.1	F339 D364 F368 E378 L379 Q385 I386	F339-K382 HydrophobicContact CE1-CD 3.93Å; F339-K382 HydrophobicContact CE1-CG 4.07Å; F339-K382 HydrophobicContact CE2-CD 4.16Å; F339-K382 HydrophobicContact CZ-CD 3.65Å; F339-K382 HydrophobicContact CZ-CG 4.2Å; D364-K382 IonicContact OD2-NZ 2.73Å; D364-K382 PolarHBondContact OD2-NZ 2.97Å; F368-K382 HydrophobicContact CE2-CD 4.3Å; E378-K382 WeakPolarHBondContact O-CB 3.24Å; E378-K382 PolarHBondContact O-N 3.07Å; L379-K382 PolarHBondContact O-N 3.27Å; K382-Q385 PolarHBondContact O-N 3.41Å; K382-I386 HydrophobicContact CG-CD1 4.04Å; K382-I386 WeakPolarHBondContact O-CB 3.42Å; K382-I386 WeakPolarHBondContact O-CG1 3.37Å; K382-I386 PolarHBondContact O-N 3.25Å
383	L	90	Very high	85.7	Confident	14 Å²	14	60.2 Å²	60.2	7%	0.073	30%	0.299	C	S	.	.	H	α-helix	trans	-65.8	-38.3	174.4	-74.6	174.3	0	0	0	112.2	F339 V340 L343 L379 E381 I386 Y387	F339-L383 HydrophobicContact CE1-CD2 4.44Å; V340-L383 HydrophobicContact CG2-CD2 4.2Å; L343-L383 HydrophobicContact CD1-CD1 4.25Å; L343-L383 HydrophobicContact CD1-CD2 3.87Å; L343-L383 HydrophobicContact CD1-CG 4.42Å; L379-L383 HydrophobicContact CD1-CD1 3.99Å; L379-L383 HydrophobicContact CD1-CG 4.07Å; L379-L383 HydrophobicContact CG-CD1 3.9Å; L379-L383 HydrophobicContact CG-CG 4.38Å; L379-L383 WeakPolarHBondContact O-CB 3.21Å; L379-L383 VanDerWaalsContact O-CG 3.31Å; L379-L383 WeakPolarHBondContact O-CG 3.32Å; L379-L383 PolarHBondContact O-N 3.32Å; E381-L383 PolarHBondContact O-N 2.82Å; L383-I386 PolarHBondContact O-N 3Å; L383-Y387 VanDerWaalsContact O-CB 3.27Å; L383-Y387 WeakPolarHBondContact O-CB 3.2Å; L383-Y387 PolarHBondContact O-N 2.85Å
384	Y	85.2	Confident	85.2	Confident	103 Å²	103	57.3 Å²	57.3	40%	0.404	29%	0.29	S	S	.	.	H	α-helix	trans	-65.3	-42	174.2	177.2	-97.5	0	0	0	112.2	A380 E381 Y387 N388	A380-Y384 WeakPolarHBondContact O-CB 3.33Å; A380-Y384 PolarHBondContact O-N 3.22Å; E381-Y384 PolarHBondContact O-N 3.14Å; Y384-Y387 PolarHBondContact O-N 3.17Å; Y384-N388 WeakPolarHBondContact O-CB 3.29Å; Y384-N388 PolarHBondContact O-N 3.49Å
385	Q	85.6	Confident	84.5	Confident	94 Å²	94	57.3 Å²	57.3	44%	0.439	28%	0.282	S	S	.	.	H	α-helix	trans	-59.5	-48.2	173.7	-69.9	171.9	14.1	0	0	111	E381 K382 Y387 N388 E389	E381-Q385 WeakPolarHBondContact O-CG 3.38Å; E381-Q385 PolarHBondContact O-N 3.23Å; E381-Q385 PolarHBondContact OE1-NE2 3.43Å; K382-Q385 PolarHBondContact O-N 3.41Å; Q385-Y387 VanDerWaalsContact C-N 3.35Å; Q385-Y387 PolarHBondContact O-N 3.42Å; Q385-N388 PolarHBondContact O-N 3.21Å; Q385-E389 WeakPolarHBondContact O-CB 3.36Å; Q385-E389 PolarHBondContact O-N 3.3Å
386	I	86.8	Confident	84.1	Confident	11 Å²	11	56.7 Å²	56.7	6%	0.056	28%	0.279	C	S	.	.	H	α-helix	trans	-60.7	-41.7	176.6	-69.7	170.1	0	0	0	111.7	T336 F339 V340 K382 L383 E389 K390	T336-I386 HydrophobicContact CG2-CB 4.12Å; T336-I386 HydrophobicContact CG2-CD1 3.75Å; T336-I386 HydrophobicContact CG2-CG1 3.52Å; T336-I386 HydrophobicContact CG2-CG2 3.6Å; F339-I386 HydrophobicContact CD1-CD1 3.49Å; F339-I386 VanDerWaalsContact CD1-CD1 3.49Å; F339-I386 HydrophobicContact CE1-CD1 3.7Å; V340-I386 HydrophobicContact CG2-CD1 4.26Å; V340-I386 HydrophobicContact CG2-CG2 4.1Å; K382-I386 HydrophobicContact CG-CD1 4.04Å; K382-I386 WeakPolarHBondContact O-CB 3.42Å; K382-I386 WeakPolarHBondContact O-CG1 3.37Å; K382-I386 PolarHBondContact O-N 3.25Å; L383-I386 PolarHBondContact O-N 3Å; I386-E389 PolarHBondContact O-N 2.91Å; I386-K390 HydrophobicContact CG2-CG 4.32Å; I386-K390 VanDerWaalsContact O-CB 3.3Å; I386-K390 WeakPolarHBondContact O-CB 3.42Å; I386-K390 WeakPolarHBondContact O-CG 3.46Å; I386-K390 PolarHBondContact O-N 3.29Å
387	Y	82	Confident	83.8	Confident	57 Å²	57	58 Å²	58	22%	0.224	28%	0.284	C	S	.	.	H	α-helix	trans	-66.7	-43.4	178.1	-178.6	-108	0	0	0	112	I13 L383 Y384 Q385 I391 F392	I13-Y387 HydrophobicContact CD1-CD2 4.22Å; I13-Y387 HydrophobicContact CG2-CD2 3.98Å; L383-Y387 VanDerWaalsContact O-CB 3.27Å; L383-Y387 WeakPolarHBondContact O-CB 3.2Å; L383-Y387 PolarHBondContact O-N 2.85Å; Y384-Y387 PolarHBondContact O-N 3.17Å; Q385-Y387 VanDerWaalsContact C-N 3.35Å; Q385-Y387 PolarHBondContact O-N 3.42Å; Y387-I391 HydrophobicContact CD2-CB 4.36Å; Y387-I391 HydrophobicContact CD2-CG1 3.62Å; Y387-I391 HydrophobicContact CE2-CB 4.25Å; Y387-I391 HydrophobicContact CE2-CG1 3.66Å; Y387-I391 HydrophobicContact CE2-CG2 4.44Å; Y387-I391 HydrophobicContact CG-CG1 4.41Å; Y387-I391 VanDerWaalsContact O-CB 3.28Å; Y387-I391 WeakPolarHBondContact O-CB 3.36Å; Y387-I391 PolarHBondContact O-N 3.37Å; Y387-F392 HydrophobicContact CD1-CE2 4.24Å; Y387-F392 HydrophobicContact CE1-CD2 4.49Å; Y387-F392 AromaticContact CE1-CE2 3.66Å; Y387-F392 HydrophobicContact CE1-CE2 3.66Å
388	N	83.2	Confident	83.8	Confident	8 Å²	8	57.8 Å²	57.8	4%	0.043	28%	0.279	C	S	.	.	H	α-helix	trans	-62	-44.4	173.4	-177.3	25.2	0	0	0	111.6	Y384 Q385 F392 S393 N394 V396	Y384-N388 WeakPolarHBondContact O-CB 3.29Å; Y384-N388 PolarHBondContact O-N 3.49Å; Q385-N388 PolarHBondContact O-N 3.21Å; N388-F392 CarbonylContact O-C 3.55Å; N388-F392 VanDerWaalsContact O-C 3.3Å; N388-F392 WeakPolarHBondContact O-CA 3.46Å; N388-F392 WeakPolarHBondContact O-CB 3.26Å; N388-F392 PolarHBondContact O-N 3.42Å; N388-F392 VanDerWaalsContact O-N 3.12Å; N388-S393 PolarHBondContact O-N 3.4Å; N388-S393 VanDerWaalsContact O-N 3.12Å; N388-N394 PolarHBondContact O-N 3.16Å; N388-N394 VanDerWaalsContact OD1-C 3.29Å; N388-N394 VanDerWaalsContact OD1-CA 3.28Å; N388-N394 WeakPolarHBondContact OD1-CA 3.49Å; N388-V396 HydrophobicContact CB-CG2 4.21Å; N388-V396 WeakPolarHBondContact OD1-CB 3.35Å; N388-V396 WeakPolarHBondContact OD1-CG2 3.26Å; N388-V396 PolarHBondContact OD1-N 3.25Å
389	E	82.1	Confident	83.6	Confident	81 Å²	81	55 Å²	55	38%	0.379	27%	0.271	S	S	.	.	H	α-helix	trans	-60	-55.3	175.2	-176.7	-163.8	115.8	0	0	111.8	Q385 I386 S393	Q385-E389 WeakPolarHBondContact O-CB 3.36Å; Q385-E389 PolarHBondContact O-N 3.3Å; I386-E389 PolarHBondContact O-N 2.91Å; E389-S393 WeakPolarHBondContact O-CA 3.45Å; E389-S393 PolarHBondContact O-N 2.89Å
390	K	81.3	Confident	83.5	Confident	81 Å²	81	56.6 Å²	56.6	35%	0.352	28%	0.278	S	S	.	.	H	α-helix	trans	-80.9	-32.4	-168.8	-68.1	-78.2	178.3	163.6	0	114.3	E337 I386	E337-K390 IonicContact OE1-NZ 3.6Å; E337-K390 PolarHBondContact OE1-NZ 3.49Å; I386-K390 HydrophobicContact CG2-CG 4.32Å; I386-K390 VanDerWaalsContact O-CB 3.3Å; I386-K390 WeakPolarHBondContact O-CB 3.42Å; I386-K390 WeakPolarHBondContact O-CG 3.46Å; I386-K390 PolarHBondContact O-N 3.29Å
391	I	77	Confident	83.6	Confident	47 Å²	47	57.8 Å²	57.8	24%	0.241	28%	0.28	C	S	.	.	H	α-helix	trans	-98.7	-28.4	-176.9	-54.3	-56.5	0	0	0	112.1	K10 Y387	K10-I391 HydrophobicContact CB-CD1 4Å; K10-I391 HydrophobicContact CG-CD1 4.41Å; Y387-I391 HydrophobicContact CD2-CB 4.36Å; Y387-I391 HydrophobicContact CD2-CG1 3.62Å; Y387-I391 HydrophobicContact CE2-CB 4.25Å; Y387-I391 HydrophobicContact CE2-CG1 3.66Å; Y387-I391 HydrophobicContact CE2-CG2 4.44Å; Y387-I391 HydrophobicContact CG-CG1 4.41Å; Y387-I391 VanDerWaalsContact O-CB 3.28Å; Y387-I391 WeakPolarHBondContact O-CB 3.36Å; Y387-I391 PolarHBondContact O-N 3.37Å
392	F	77.2	Confident	83.7	Confident	72 Å²	72	57.3 Å²	57.3	32%	0.316	28%	0.28	S	S	.	.	H	α-helix	trans	-122.5	4.3	-176.5	-59.1	-89.3	0	0	0	114	Y387 N388 N394 Q395 V396	Y387-F392 HydrophobicContact CD1-CE2 4.24Å; Y387-F392 HydrophobicContact CE1-CD2 4.49Å; Y387-F392 AromaticContact CE1-CE2 3.66Å; Y387-F392 HydrophobicContact CE1-CE2 3.66Å; N388-F392 CarbonylContact O-C 3.55Å; N388-F392 VanDerWaalsContact O-C 3.3Å; N388-F392 WeakPolarHBondContact O-CA 3.46Å; N388-F392 WeakPolarHBondContact O-CB 3.26Å; N388-F392 PolarHBondContact O-N 3.42Å; N388-F392 VanDerWaalsContact O-N 3.12Å; F392-N394 PolarHBondContact O-N 3.42Å; F392-Q395 WeakPolarHBondContact O-CA 3.19Å; F392-Q395 WeakPolarHBondContact O-CB 3.25Å; F392-Q395 PolarHBondContact O-N 3.3Å; F392-V396 HydrophobicContact CB-CG2 3.81Å; F392-V396 HydrophobicContact CD1-CG2 4.09Å; F392-V396 HydrophobicContact CD2-CG2 3.41Å; F392-V396 VanDerWaalsContact CD2-CG2 3.41Å; F392-V396 HydrophobicContact CE2-CG2 3.94Å; F392-V396 HydrophobicContact CG-CG2 3.5Å; F392-V396 VanDerWaalsContact CG-CG2 3.5Å; F392-V396 HydrophobicContact CZ-CG2 4.47Å
393	S	81	Confident	83.8	Confident	90 Å²	90	58 Å²	58	63%	0.629	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	33.9	-176.7	-52.9	0	0	0	0	113.8	N388 E389 Q395	N388-S393 PolarHBondContact O-N 3.4Å; N388-S393 VanDerWaalsContact O-N 3.12Å; E389-S393 WeakPolarHBondContact O-CA 3.45Å; E389-S393 PolarHBondContact O-N 2.89Å; S393-Q395 PolarHBondContact O-N 2.81Å
394	N	76.5	Confident	83.8	Confident	64 Å²	64	57.6 Å²	57.6	34%	0.342	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	15.5	-168.8	-67	-67.5	0	0	0	115.6	N388 F392	N388-N394 PolarHBondContact O-N 3.16Å; N388-N394 VanDerWaalsContact OD1-C 3.29Å; N388-N394 VanDerWaalsContact OD1-CA 3.28Å; N388-N394 WeakPolarHBondContact OD1-CA 3.49Å; F392-N394 PolarHBondContact O-N 3.42Å
395	Q	75.2	Confident	84	Confident	96 Å²	96	59.4 Å²	59.4	45%	0.449	30%	0.296	S	S	.	.			trans	-104.5	28.5	-176.9	-51.8	-173.6	11.2	0	0	113.9	Y313 F392 S393 R397	Y313-Q395 HydrophobicContact CD1-CB 4.15Å; Y313-Q395 HydrophobicContact CE1-CB 3.52Å; Y313-Q395 HydrophobicContact CE1-CG 3.99Å; Y313-Q395 PolarHBondContact OH-OE1 3.03Å; F392-Q395 WeakPolarHBondContact O-CA 3.19Å; F392-Q395 WeakPolarHBondContact O-CB 3.25Å; F392-Q395 PolarHBondContact O-N 3.3Å; S393-Q395 PolarHBondContact O-N 2.81Å; Q395-R397 PolarHBondContact O-N 3.34Å
396	V	79.6	Confident	84	Confident	24 Å²	24	58.5 Å²	58.5	15%	0.145	29%	0.291	C	S	.	.			trans	-52.3	114.2	168.1	163.7	0	0	0	0	109.4	N388 F392 I398	N388-V396 HydrophobicContact CB-CG2 4.21Å; N388-V396 WeakPolarHBondContact OD1-CB 3.35Å; N388-V396 WeakPolarHBondContact OD1-CG2 3.26Å; N388-V396 PolarHBondContact OD1-N 3.25Å; F392-V396 HydrophobicContact CB-CG2 3.81Å; F392-V396 HydrophobicContact CD1-CG2 4.09Å; F392-V396 HydrophobicContact CD2-CG2 3.41Å; F392-V396 VanDerWaalsContact CD2-CG2 3.41Å; F392-V396 HydrophobicContact CE2-CG2 3.94Å; F392-V396 HydrophobicContact CG-CG2 3.5Å; F392-V396 VanDerWaalsContact CG-CG2 3.5Å; F392-V396 HydrophobicContact CZ-CG2 4.47Å; V396-I398 HydrophobicContact CG1-CG1 4.06Å
397	R	82.4	Confident	83.9	Confident	76 Å²	76	58.2 Å²	58.2	29%	0.287	29%	0.29	S	S	.	.			trans	-84.8	136	173.8	-66.6	-172.8	-68.5	-112	8.3	108.8	Q395 W428 L429 I430	Q395-R397 PolarHBondContact O-N 3.34Å; R397-W428 HydrophobicContact CB-CZ2 4.05Å; R397-W428 VanDerWaalsContact CD-O 3.25Å; R397-W428 WeakPolarHBondContact CD-O 3.18Å; R397-W428 HydrophobicContact CG-CH2 4.3Å; R397-W428 HydrophobicContact CG-CZ2 3.81Å; R397-W428 PolarHBondContact NE-O 3.01Å; R397-L429 HydrophobicContact CB-CD2 4.03Å; R397-L429 PolarHBondContact NE-O 3.2Å; R397-L429 PolarHBondContact NH2-O 3.31Å; R397-L429 WeakPolarHBondContact O-CD2 3.31Å; R397-I430 PolarHBondContact NH2-O 2.82Å
398	I	85.2	Confident	84.4	Confident	42 Å²	42	56.1 Å²	56.1	22%	0.215	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	141	176.7	-57.8	174.7	0	0	0	108	I233 V396 W428	I233-I398 HydrophobicContact CG2-CD1 4.07Å; V396-I398 HydrophobicContact CG1-CG1 4.06Å; I398-W428 PolarHBondContact O-NE1 3.36Å
399	A	86.9	Confident	84.8	Confident	28 Å²	28	59.1 Å²	59.1	23%	0.231	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	140.3	171.1	0	0	0	0	0	108.9	V308 A425 L429	V308-A399 HydrophobicContact CG1-CB 4Å; A399-A425 HydrophobicContact CB-CB 3.94Å; A399-L429 HydrophobicContact CB-CD1 4.04Å; A399-L429 HydrophobicContact CB-CD2 4.21Å; A399-L429 HydrophobicContact CB-CG 4.08Å
400	Q	88.9	Confident	85.2	Confident	39 Å²	39	58.1 Å²	58.1	18%	0.182	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	120.9	167.5	-173	-178.2	96.9	0	0	109	N234 V308 Q309 L402	N234-Q400 PolarHBondContact OD1-NE2 3.02Å; V308-Q400 CarbonylContact C-O 3.56Å; V308-Q400 WeakPolarHBondContact CA-O 3.46Å; Q309-Q400 HydrophobicContact CB-CB 4.43Å; Q309-Q400 PolarHBondContact N-O 3.01Å; Q309-Q400 PolarHBondContact O-N 2.89Å; Q400-L402 HydrophobicContact CG-CD2 4.21Å; Q400-L402 HydrophobicContact CG-CG 4.37Å
401	I	91.7	Very high	85.9	Confident	51 Å²	51	57.9 Å²	57.9	26%	0.262	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	123.5	175.9	-62.9	175.9	0	0	0	108.4	V308 L403 L418 E421 I422 A425	V308-I401 HydrophobicContact CG2-CG1 4.29Å; I401-L403 HydrophobicContact CG2-CD2 4.06Å; I401-L403 HydrophobicContact CG2-CG 4.32Å; I401-L418 HydrophobicContact CD1-CD1 4.27Å; I401-L418 HydrophobicContact CG2-CD1 4.13Å; I401-E421 HydrophobicContact CB-CB 4.41Å; I401-E421 HydrophobicContact CD1-CB 4.04Å; I401-E421 HydrophobicContact CG1-CB 4.07Å; I401-E421 HydrophobicContact CG2-CB 3.56Å; I401-E421 HydrophobicContact CG2-CG 4Å; I401-I422 HydrophobicContact CD1-CB 4.42Å; I401-I422 HydrophobicContact CD1-CG1 3.6Å; I401-A425 HydrophobicContact CD1-CB 4.17Å; I401-A425 HydrophobicContact CG1-CB 4.44Å
402	L	91.1	Very high	86.6	Confident	76 Å²	76	60.3 Å²	60.3	40%	0.398	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	125	174.7	-63.3	177.4	0	0	0	109.8	C306 T307 Q309 Q400	C306-L402 VanDerWaalsContact CA-O 3.31Å; C306-L402 WeakPolarHBondContact CA-O 3.25Å; T307-L402 PolarHBondContact N-O 3.2Å; T307-L402 VanDerWaalsContact N-O 3.14Å; T307-L402 PolarHBondContact O-N 2.95Å; Q309-L402 HydrophobicContact CG-CD1 4.23Å; Q400-L402 HydrophobicContact CG-CD2 4.21Å; Q400-L402 HydrophobicContact CG-CG 4.37Å
403	L	91.3	Very high	87.4	Confident	65 Å²	65	58.8 Å²	58.8	34%	0.34	32%	0.317	S	S	.	.			trans	-106	137.8	179.7	-59.9	-178.3	0	0	0	111.2	C306 I401 E405 V414 T417 L418 E421	C306-L403 HydrophobicContact CB-CD2 4.43Å; I401-L403 HydrophobicContact CG2-CD2 4.06Å; I401-L403 HydrophobicContact CG2-CG 4.32Å; L403-E405 PolarHBondContact O-N 3.1Å; L403-V414 HydrophobicContact CD1-CG1 4.26Å; L403-T417 HydrophobicContact CD2-CG2 3.87Å; L403-L418 HydrophobicContact CD1-CB 4.24Å; L403-E421 HydrophobicContact CD2-CG 4.14Å
404	S	89.2	Confident	88	Confident	5 Å²	5	57.3 Å²	57.3	4%	0.035	30%	0.304	C	S	.	.			trans	-86.8	109.8	-178.9	-177.9	0	0	0	0	111.5	Q304 C306 K406 V407 C408	Q304-S404 VanDerWaalsContact CB-OG 3.26Å; Q304-S404 WeakPolarHBondContact CB-OG 3.5Å; Q304-S404 WeakPolarHBondContact O-CB 3.49Å; Q304-S404 PolarHBondContact O-OG 3.43Å; C306-S404 PolarHBondContact SG-N 3.15Å; S404-K406 PolarHBondContact O-N 3.5Å; S404-V407 PolarHBondContact O-N 3.05Å; S404-C408 PolarHBondContact O-N 3.43Å
405	E	89.3	Confident	88.9	Confident	140 Å²	140	58 Å²	58	65%	0.654	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.8	-36.7	172.1	179.6	-156.4	-151.8	0	0	113.7	L403 V407	L403-E405 PolarHBondContact O-N 3.1Å; E405-V407 VanDerWaalsContact C-N 3.35Å
406	K	86.1	Confident	89.7	Confident	75 Å²	75	55 Å²	55	33%	0.326	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-3.2	-177.8	-60.6	-168.5	-176	54.4	0	114.6	Q304 S404 H484	Q304-K406 VanDerWaalsContact OE1-CD 3.23Å; S404-K406 PolarHBondContact O-N 3.5Å; K406-H484 HydrophobicContact CD-CB 4.12Å
407	V	86	Confident	90.4	Very high	5 Å²	5	53.9 Å²	53.9	3%	0.03	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-48.3	176	179.2	0	0	0	0	109.5	S404 E405 T409 R413 Y464 I466	S404-V407 PolarHBondContact O-N 3.05Å; E405-V407 VanDerWaalsContact C-N 3.35Å; V407-T409 PolarHBondContact O-N 3.41Å; V407-R413 WeakPolarHBondContact O-CD 3.44Å; V407-R413 PolarHBondContact O-NH1 2.87Å; V407-R413 VanDerWaalsContact O-NH1 3.15Å; V407-Y464 HydrophobicContact CG1-CD2 3.98Å; V407-I466 HydrophobicContact CG1-CD1 4.27Å; V407-I466 HydrophobicContact CG1-CG1 4.38Å; V407-I466 HydrophobicContact CG2-CD1 4.2Å
408	C	91.3	Very high	91	Very high	14 Å²	14	52.8 Å²	52.8	10%	0.095	28%	0.282	C	S	.	.			trans	-83.5	56.7	-178.2	-54.3	0	0	0	0	111.4	S404 T410 V414	S404-C408 PolarHBondContact O-N 3.43Å; C408-T410 VanDerWaalsContact C-N 3.32Å; C408-T410 PolarHBondContact O-N 3.47Å; C408-V414 HydrophobicContact CB-CG2 3.79Å
409	T	90.7	Very high	91.5	Very high	71 Å²	71	51.8 Å²	51.8	44%	0.436	28%	0.277	S	S	.	.			trans	-81.7	-3.3	-172.8	51.2	0	0	0	0	114.9	V407 R413	V407-T409 PolarHBondContact O-N 3.41Å; T409-R413 PolarHBondContact OG1-NH1 3.24Å
410	T	92	Very high	91.9	Very high	59 Å²	59	51.1 Å²	51.1	36%	0.362	27%	0.269	S	S	.	.	S	Bend	trans	-138.7	161.1	176.6	80.2	0	0	0	0	110.5	C408 E412 R413 V414	C408-T410 VanDerWaalsContact C-N 3.32Å; C408-T410 PolarHBondContact O-N 3.47Å; T410-E412 VanDerWaalsContact C-N 3.29Å; T410-E412 WeakPolarHBondContact CB-OE2 3.36Å; T410-E412 PolarHBondContact O-N 2.83Å; T410-E412 PolarHBondContact OG1-OE2 2.94Å; T410-R413 PolarHBondContact O-N 3.37Å; T410-R413 VanDerWaalsContact O-N 3.17Å; T410-R413 PolarHBondContact OG1-N 2.94Å; T410-V414 WeakPolarHBondContact O-CG2 3.4Å; T410-V414 PolarHBondContact O-N 3.42Å
411	A	94.6	Very high	92.2	Very high	76 Å²	76	50 Å²	50	63%	0.628	26%	0.264	S	S	*	.	H	α-helix	trans	-61.8	-36	-177	0	0	0	0	0	112.8	V414 R415	A411-V414 PolarHBondContact O-N 2.98Å; A411-R415 WeakPolarHBondContact O-CB 3.25Å; A411-R415 PolarHBondContact O-N 3.13Å
412	E	93	Very high	92.3	Very high	98 Å²	98	51 Å²	51	46%	0.458	27%	0.269	S	S	.	.	H	α-helix	trans	-63.8	-45.2	176.1	-51.5	70.6	-150	0	0	110.3	T410 V414 R415 D416	T410-E412 VanDerWaalsContact C-N 3.29Å; T410-E412 WeakPolarHBondContact CB-OE2 3.36Å; T410-E412 PolarHBondContact O-N 2.83Å; T410-E412 PolarHBondContact OG1-OE2 2.94Å; E412-V414 PolarHBondContact O-N 3.44Å; E412-R415 PolarHBondContact O-N 3.38Å; E412-D416 WeakPolarHBondContact O-CB 3.32Å; E412-D416 VanDerWaalsContact O-CG 3.23Å; E412-D416 PolarHBondContact O-N 2.84Å
413	R	93.3	Very high	92.5	Very high	40 Å²	40	47.4 Å²	47.4	15%	0.151	25%	0.25	C	C	.	.	H	α-helix	trans	-64.9	-39.1	177	-63.4	-174.8	-176.4	-161.5	-2.3	112	V407 T409 T410 T417 Y464 T465	V407-R413 WeakPolarHBondContact O-CD 3.44Å; V407-R413 PolarHBondContact O-NH1 2.87Å; V407-R413 VanDerWaalsContact O-NH1 3.15Å; T409-R413 PolarHBondContact OG1-NH1 3.24Å; T410-R413 PolarHBondContact O-N 3.37Å; T410-R413 VanDerWaalsContact O-N 3.17Å; T410-R413 PolarHBondContact OG1-N 2.94Å; R413-T417 WeakPolarHBondContact O-CB 3.41Å; R413-T417 PolarHBondContact O-N 2.94Å; R413-T417 PolarHBondContact O-OG1 2.91Å; R413-Y464 HydrophobicContact CB-CE1 4.5Å; R413-Y464 HydrophobicContact CB-CE2 4.12Å; R413-Y464 HydrophobicContact CG-CD1 4.06Å; R413-Y464 HydrophobicContact CG-CD2 4.31Å; R413-Y464 HydrophobicContact CG-CE1 3.85Å; R413-Y464 HydrophobicContact CG-CE2 4.11Å; R413-Y464 HydrophobicContact CG-CG 4.31Å; R413-T465 PolarHBondContact NH1-O 3.33Å; R413-T465 PolarHBondContact NH2-O 3.21Å
414	V	94.6	Very high	92.7	Very high	59 Å²	59	46 Å²	46	36%	0.358	24%	0.241	S	C	.	.	H	α-helix	trans	-60.3	-51.1	173.9	173.6	0	0	0	0	109.9	L403 C408 T410 A411 E412 L418	L403-V414 HydrophobicContact CD1-CG1 4.26Å; C408-V414 HydrophobicContact CB-CG2 3.79Å; T410-V414 WeakPolarHBondContact O-CG2 3.4Å; T410-V414 PolarHBondContact O-N 3.42Å; A411-V414 PolarHBondContact O-N 2.98Å; E412-V414 PolarHBondContact O-N 3.44Å; V414-L418 WeakPolarHBondContact O-CB 3.41Å; V414-L418 PolarHBondContact O-N 3.08Å
415	R	94.7	Very high	92.9	Very high	80 Å²	80	46.2 Å²	46.2	30%	0.302	24%	0.244	S	C	.	.	H	α-helix	trans	-56.8	-57	178.1	178.2	-164.6	69.5	-137.4	-9.7	112.1	A411 E412 T417 L418 L419	A411-R415 WeakPolarHBondContact O-CB 3.25Å; A411-R415 PolarHBondContact O-N 3.13Å; E412-R415 PolarHBondContact O-N 3.38Å; R415-T417 VanDerWaalsContact C-N 3.33Å; R415-T417 PolarHBondContact O-N 3.48Å; R415-L418 PolarHBondContact O-N 3.35Å; R415-L419 HydrophobicContact CG-CD1 4.16Å; R415-L419 WeakPolarHBondContact O-CG 3.43Å; R415-L419 PolarHBondContact O-N 3.29Å
416	D	92.9	Very high	93.2	Very high	32 Å²	32	40.2 Å²	40.2	17%	0.171	22%	0.218	C	C	.	.	H	α-helix	trans	-68.9	-33.9	-170.9	-64.5	-19	0	0	0	111.6	E412 H420 H462 Y464	E412-D416 WeakPolarHBondContact O-CB 3.32Å; E412-D416 VanDerWaalsContact O-CG 3.23Å; E412-D416 PolarHBondContact O-N 2.84Å; D416-H420 PolarHBondContact O-N 3.49Å; D416-H462 PolarHBondContact O-CE1 3.3Å; D416-Y464 WeakPolarHBondContact CB-OH 3.39Å
417	T	93.8	Very high	93.5	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	20%	0.203	C	C	.	.	H	α-helix	trans	-73.1	-42.7	172.8	-44.7	0	0	0	0	111.4	C306 L403 R413 R415 L419 H420 E421 Y464	C306-T417 HydrophobicContact CB-CG2 3.8Å; L403-T417 HydrophobicContact CD2-CG2 3.87Å; R413-T417 WeakPolarHBondContact O-CB 3.41Å; R413-T417 PolarHBondContact O-N 2.94Å; R413-T417 PolarHBondContact O-OG1 2.91Å; R415-T417 VanDerWaalsContact C-N 3.33Å; R415-T417 PolarHBondContact O-N 3.48Å; T417-L419 VanDerWaalsContact C-N 3.3Å; T417-L419 PolarHBondContact O-N 3.43Å; T417-H420 WeakPolarHBondContact O-CB 3.1Å; T417-H420 PolarHBondContact O-N 2.93Å; T417-H420 VanDerWaalsContact O-N 3.1Å; T417-E421 HydrophobicContact CG2-CG 4.35Å; T417-E421 WeakPolarHBondContact O-CG 3.38Å; T417-E421 PolarHBondContact O-N 2.97Å; T417-Y464 PolarHBondContact OG1-OH 3.33Å
418	L	95.4	Very high	93.7	Very high	52 Å²	52	37.6 Å²	37.6	27%	0.272	21%	0.206	S	C	.	.	H	α-helix	trans	-59.7	-41.6	177.2	179.1	58.6	0	0	0	111.3	I401 L403 V414 R415 H420 E421 I422	I401-L418 HydrophobicContact CD1-CD1 4.27Å; I401-L418 HydrophobicContact CG2-CD1 4.13Å; L403-L418 HydrophobicContact CD1-CB 4.24Å; V414-L418 WeakPolarHBondContact O-CB 3.41Å; V414-L418 PolarHBondContact O-N 3.08Å; R415-L418 PolarHBondContact O-N 3.35Å; L418-H420 VanDerWaalsContact C-N 3.35Å; L418-H420 PolarHBondContact O-N 2.91Å; L418-E421 PolarHBondContact O-N 3.34Å; L418-I422 HydrophobicContact CD1-CD1 3.91Å; L418-I422 HydrophobicContact CD1-CG1 4.1Å; L418-I422 HydrophobicContact CG-CD1 3.78Å; L418-I422 HydrophobicContact CG-CG1 4.39Å; L418-I422 VanDerWaalsContact O-CB 3.29Å; L418-I422 WeakPolarHBondContact O-CB 3.32Å; L418-I422 WeakPolarHBondContact O-CG1 3.38Å; L418-I422 PolarHBondContact O-N 3.01Å
419	L	95	Very high	93.7	Very high	22 Å²	22	40.4 Å²	40.4	12%	0.115	22%	0.219	C	C	.	.	H	α-helix	trans	-64.4	-37.4	174.6	-68.4	173	0	0	0	112.5	R415 T417 I422 C423 V448 L455 V458	R415-L419 HydrophobicContact CG-CD1 4.16Å; R415-L419 WeakPolarHBondContact O-CG 3.43Å; R415-L419 PolarHBondContact O-N 3.29Å; T417-L419 VanDerWaalsContact C-N 3.3Å; T417-L419 PolarHBondContact O-N 3.43Å; L419-I422 PolarHBondContact O-N 3.48Å; L419-C423 PolarHBondContact O-N 2.8Å; L419-C423 PolarHBondContact O-SG 2.92Å; L419-V448 HydrophobicContact CD1-CG1 4.03Å; L419-V448 HydrophobicContact CD2-CG1 3.9Å; L419-V448 HydrophobicContact CG-CG1 4.4Å; L419-L455 HydrophobicContact CD1-CD1 3.97Å; L419-V458 HydrophobicContact CB-CG1 4.45Å; L419-V458 HydrophobicContact CB-CG2 3.88Å; L419-V458 HydrophobicContact CD1-CG2 4.37Å
420	H	94.6	Very high	93.7	Very high	14 Å²	14	42.1 Å²	42.1	7%	0.065	23%	0.225	C	C	.	.	H	α-helix	trans	-62.7	-48.6	174.8	-173.3	103.2	0	0	0	112.1	D416 T417 L418 C423 H424 H437 W441 V458 S459 V460 H462	D416-H420 PolarHBondContact O-N 3.49Å; T417-H420 WeakPolarHBondContact O-CB 3.1Å; T417-H420 PolarHBondContact O-N 2.93Å; T417-H420 VanDerWaalsContact O-N 3.1Å; L418-H420 VanDerWaalsContact C-N 3.35Å; L418-H420 PolarHBondContact O-N 2.91Å; H420-C423 PolarHBondContact O-N 2.9Å; H420-H424 AromaticContact CD2-CD2 3.6Å; H420-H424 AromaticContact CD2-NE2 3.36Å; H420-H424 PolarHBondContact CD2-NE2 2.78Å; H420-H424 AromaticContact NE2-CD2 3.77Å; H420-H424 AromaticContact NE2-NE2 3.01Å; H420-H424 PolarHBondContact NE2-NE2 3.06Å; H420-H424 PolarHBondContact O-CD2 3.36Å; H420-H424 VanDerWaalsContact O-CD2 3.25Å; H420-H424 PolarHBondContact O-N 3.12Å; H420-H437 AromaticContact CE1-CD2 3.48Å; H420-H437 PolarHBondContact CE1-CD2 3.43Å; H420-H437 VanDerWaalsContact CE1-CD2 3.48Å; H420-H437 AromaticContact CE1-NE2 3.11Å; H420-H437 PolarHBondContact CE1-NE2 3.49Å; H420-H437 AromaticContact NE2-CD2 3.65Å; H420-H437 AromaticContact NE2-NE2 2.98Å; H420-H437 PolarHBondContact NE2-NE2 3.08Å; H420-W441 AromaticContact CE1-CZ2 3.6Å; H420-W441 AromaticContact CG-CZ2 3.94Å; H420-W441 AromaticContact ND1-CH2 3.98Å; H420-W441 AromaticContact ND1-CZ2 3.4Å; H420-W441 WeakPolarHBondContact ND1-CZ2 3.36Å; H420-W441 PolarHBondContact O-NE1 2.58Å; H420-V458 HydrophobicContact CB-CG1 4.14Å; H420-S459 PolarHBondContact CE1-O 2.81Å; H420-S459 VanDerWaalsContact CE1-O 3.3Å; H420-S459 PolarHBondContact ND1-O 3.04Å; H420-V460 PolarHBondContact CE1-O 3.22Å; H420-H462 AromaticContact CG-NE2 3.76Å
421	E	95.1	Very high	93.5	Very high	16 Å²	16	42.3 Å²	42.3	8%	0.075	22%	0.223	C	C	.	.	H	α-helix	trans	-69.1	-33.3	177.1	-56.5	-62.5	153.7	0	0	112.1	T307 V308 I401 L403 T417 L418 C423 H424 A425	T307-E421 VanDerWaalsContact C-OE2 3.26Å; T307-E421 WeakPolarHBondContact CA-OE2 3.33Å; V308-E421 HydrophobicContact CG2-CB 4Å; V308-E421 VanDerWaalsContact CG2-O 3.25Å; V308-E421 WeakPolarHBondContact CG2-O 3.41Å; V308-E421 WeakPolarHBondContact CG2-OE2 3.45Å; V308-E421 PolarHBondContact N-OE2 3.11Å; I401-E421 HydrophobicContact CB-CB 4.41Å; I401-E421 HydrophobicContact CD1-CB 4.04Å; I401-E421 HydrophobicContact CG1-CB 4.07Å; I401-E421 HydrophobicContact CG2-CB 3.56Å; I401-E421 HydrophobicContact CG2-CG 4Å; L403-E421 HydrophobicContact CD2-CG 4.14Å; T417-E421 HydrophobicContact CG2-CG 4.35Å; T417-E421 WeakPolarHBondContact O-CG 3.38Å; T417-E421 PolarHBondContact O-N 2.97Å; L418-E421 PolarHBondContact O-N 3.34Å; E421-C423 VanDerWaalsContact C-N 3.33Å; E421-C423 PolarHBondContact O-N 3.3Å; E421-H424 PolarHBondContact O-N 3.48Å; E421-A425 WeakPolarHBondContact O-CB 3.45Å; E421-A425 PolarHBondContact O-N 2.98Å
422	I	95	Very high	93.2	Very high	71 Å²	71	40 Å²	40	36%	0.364	21%	0.207	S	C	.	.	H	α-helix	trans	-63.7	-38	172.4	-76.8	171.4	0	0	0	111.1	I401 L418 L419 H424 A425 A426	I401-I422 HydrophobicContact CD1-CB 4.42Å; I401-I422 HydrophobicContact CD1-CG1 3.6Å; L418-I422 HydrophobicContact CD1-CD1 3.91Å; L418-I422 HydrophobicContact CD1-CG1 4.1Å; L418-I422 HydrophobicContact CG-CD1 3.78Å; L418-I422 HydrophobicContact CG-CG1 4.39Å; L418-I422 VanDerWaalsContact O-CB 3.29Å; L418-I422 WeakPolarHBondContact O-CB 3.32Å; L418-I422 WeakPolarHBondContact O-CG1 3.38Å; L418-I422 PolarHBondContact O-N 3.01Å; L419-I422 PolarHBondContact O-N 3.48Å; I422-H424 PolarHBondContact O-N 3.35Å; I422-A425 PolarHBondContact O-N 2.83Å; I422-A426 WeakPolarHBondContact O-CB 3.47Å; I422-A426 PolarHBondContact O-N 3.16Å
423	C	95.5	Very high	93	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.007	20%	0.203	C	C	.	.	H	α-helix	trans	-62.7	-42.4	175.3	-68.1	0	0	0	0	111.5	L419 H420 E421 A426 V427 W441 W444	L419-C423 PolarHBondContact O-N 2.8Å; L419-C423 PolarHBondContact O-SG 2.92Å; H420-C423 PolarHBondContact O-N 2.9Å; E421-C423 VanDerWaalsContact C-N 3.33Å; E421-C423 PolarHBondContact O-N 3.3Å; C423-A426 PolarHBondContact O-N 3.16Å; C423-V427 WeakPolarHBondContact O-CG2 3.39Å; C423-V427 PolarHBondContact O-N 3.2Å; C423-V427 VanDerWaalsContact O-N 3.08Å; C423-W441 HydrophobicContact CB-CD2 4.35Å; C423-W441 HydrophobicContact CB-CG 4.28Å; C423-W441 HydrophobicContact CB-CZ2 4.25Å; C423-W441 VanDerWaalsContact CB-NE1 3.31Å; C423-W444 HydrophobicContact CB-CB 4.07Å
424	H	94.7	Very high	92.6	Very high	35 Å²	35	40 Å²	40	16%	0.162	21%	0.213	C	C	.	.	H	α-helix	trans	-62.8	-44.4	172.1	-68.3	-58.7	0	0	0	112.1	V308 H420 E421 I422 A426 V427 W428 H437 W441	V308-H424 HydrophobicContact CB-CB 4.47Å; V308-H424 HydrophobicContact CG2-CB 3.61Å; H420-H424 AromaticContact CD2-CD2 3.6Å; H420-H424 AromaticContact CD2-NE2 3.36Å; H420-H424 PolarHBondContact CD2-NE2 2.78Å; H420-H424 AromaticContact NE2-CD2 3.77Å; H420-H424 AromaticContact NE2-NE2 3.01Å; H420-H424 PolarHBondContact NE2-NE2 3.06Å; H420-H424 PolarHBondContact O-CD2 3.36Å; H420-H424 VanDerWaalsContact O-CD2 3.25Å; H420-H424 PolarHBondContact O-N 3.12Å; E421-H424 PolarHBondContact O-N 3.48Å; I422-H424 PolarHBondContact O-N 3.35Å; H424-A426 VanDerWaalsContact C-N 3.31Å; H424-A426 PolarHBondContact O-N 3.25Å; H424-V427 PolarHBondContact O-N 3.43Å; H424-W428 PolarHBondContact O-N 3.48Å; H424-H437 AromaticContact CE1-CD2 3.58Å; H424-H437 AromaticContact CE1-NE2 3.54Å; H424-H437 AromaticContact NE2-CD2 3.77Å; H424-H437 AromaticContact NE2-NE2 3.43Å; H424-H437 PolarHBondContact NE2-NE2 3.29Å; H424-W441 AromaticContact CD2-NE1 3.64Å; H424-W441 AromaticContact CE1-CD1 3.32Å; H424-W441 AromaticContact CE1-NE1 3.29Å; H424-W441 PolarHBondContact CE1-NE1 3.17Å; H424-W441 VanDerWaalsContact CE1-NE1 3.29Å; H424-W441 AromaticContact CG-CD1 3.71Å; H424-W441 AromaticContact CG-NE1 3.69Å; H424-W441 AromaticContact ND1-CD1 3.18Å; H424-W441 AromaticContact ND1-NE1 3.49Å; H424-W441 PolarHBondContact ND1-NE1 3.45Å; H424-W441 AromaticContact NE2-CD1 3.89Å; H424-W441 AromaticContact NE2-NE1 3.37Å; H424-W441 PolarHBondContact NE2-NE1 2.89Å
425	A	94.4	Very high	92	Very high	10 Å²	10	40.1 Å²	40.1	8%	0.083	21%	0.211	C	C	.	.	H	α-helix	trans	-62.8	-35.3	177	0	0	0	0	0	112.4	V308 A399 I401 E421 I422 W428 L429	V308-A425 HydrophobicContact CG1-CB 4.45Å; A399-A425 HydrophobicContact CB-CB 3.94Å; I401-A425 HydrophobicContact CD1-CB 4.17Å; I401-A425 HydrophobicContact CG1-CB 4.44Å; E421-A425 WeakPolarHBondContact O-CB 3.45Å; E421-A425 PolarHBondContact O-N 2.98Å; I422-A425 PolarHBondContact O-N 2.83Å; A425-W428 PolarHBondContact O-N 2.85Å; A425-L429 VanDerWaalsContact O-CB 3.24Å; A425-L429 WeakPolarHBondContact O-CB 3.41Å; A425-L429 WeakPolarHBondContact O-CG 3.41Å; A425-L429 PolarHBondContact O-N 2.93Å
426	A	93.8	Very high	91.8	Very high	13 Å²	13	38 Å²	38	11%	0.107	21%	0.214	C	C	.	.	H	α-helix	trans	-69.5	-41.4	175.7	0	0	0	0	0	112.1	I422 C423 H424 W428 I430 W444	I422-A426 WeakPolarHBondContact O-CB 3.47Å; I422-A426 PolarHBondContact O-N 3.16Å; C423-A426 PolarHBondContact O-N 3.16Å; H424-A426 VanDerWaalsContact C-N 3.31Å; H424-A426 PolarHBondContact O-N 3.25Å; A426-W428 VanDerWaalsContact C-N 3.33Å; A426-W428 PolarHBondContact O-N 3.37Å; A426-I430 HydrophobicContact CB-CD1 4.42Å; A426-I430 WeakPolarHBondContact O-CA 3.5Å; A426-I430 VanDerWaalsContact O-CB 3.27Å; A426-I430 WeakPolarHBondContact O-CB 3.24Å; A426-I430 PolarHBondContact O-N 3.11Å; A426-W444 HydrophobicContact CB-CD2 3.63Å; A426-W444 HydrophobicContact CB-CE3 4.12Å; A426-W444 HydrophobicContact CB-CG 3.83Å; A426-W444 HydrophobicContact CB-CZ2 4.25Å
427	V	92.8	Very high	91.8	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.012	21%	0.214	C	C	.	.	I	π-helix	trans	-59.7	-44.2	172.5	176.2	0	0	0	0	111.1	C423 H424 N431 G432 L433 D435 H440 W441	C423-V427 WeakPolarHBondContact O-CG2 3.39Å; C423-V427 PolarHBondContact O-N 3.2Å; C423-V427 VanDerWaalsContact O-N 3.08Å; H424-V427 PolarHBondContact O-N 3.43Å; V427-N431 CarbonylContact O-C 3.58Å; V427-N431 WeakPolarHBondContact O-CA 3.1Å; V427-N431 WeakPolarHBondContact O-CB 3.49Å; V427-N431 PolarHBondContact O-N 3.25Å; V427-G432 PolarHBondContact O-N 3.18Å; V427-L433 HydrophobicContact CG1-CB 3.88Å; V427-L433 PolarHBondContact O-N 3.3Å; V427-D435 HydrophobicContact CG1-CB 4.1Å; V427-H440 HydrophobicContact CG1-CB 4.16Å; V427-H440 HydrophobicContact CG2-CB 3.89Å; V427-W441 HydrophobicContact CG2-CB 4.1Å
428	W	91.6	Very high	91.7	Very high	24 Å²	24	39.2 Å²	39.2	9%	0.091	22%	0.224	C	C	.	.	I	π-helix	trans	-67.2	-54	176.7	174	-117.8	0	0	0	112.9	V310 R397 I398 H424 A425 A426 G432 L433 N434	V310-W428 HydrophobicContact CB-CD2 4.48Å; V310-W428 HydrophobicContact CG1-CD2 3.65Å; V310-W428 HydrophobicContact CG1-CE3 3.99Å; V310-W428 HydrophobicContact CG1-CG 4.29Å; V310-W428 HydrophobicContact CG1-CH2 3.8Å; V310-W428 HydrophobicContact CG1-CZ2 3.41Å; V310-W428 VanDerWaalsContact CG1-CZ2 3.41Å; V310-W428 HydrophobicContact CG1-CZ3 4.07Å; V310-W428 HydrophobicContact CG2-CB 4.27Å; V310-W428 HydrophobicContact CG2-CD2 4Å; V310-W428 HydrophobicContact CG2-CG 3.79Å; R397-W428 HydrophobicContact CB-CZ2 4.05Å; R397-W428 VanDerWaalsContact CD-O 3.25Å; R397-W428 WeakPolarHBondContact CD-O 3.18Å; R397-W428 HydrophobicContact CG-CH2 4.3Å; R397-W428 HydrophobicContact CG-CZ2 3.81Å; R397-W428 PolarHBondContact NE-O 3.01Å; I398-W428 PolarHBondContact O-NE1 3.36Å; H424-W428 PolarHBondContact O-N 3.48Å; A425-W428 PolarHBondContact O-N 2.85Å; A426-W428 VanDerWaalsContact C-N 3.33Å; A426-W428 PolarHBondContact O-N 3.37Å; W428-G432 VanDerWaalsContact O-CA 3.29Å; W428-G432 WeakPolarHBondContact O-CA 3.49Å; W428-G432 PolarHBondContact O-N 3.02Å; W428-L433 WeakPolarHBondContact CA-O 3.25Å; W428-N434 HydrophobicContact CE3-CB 4.34Å; W428-N434 HydrophobicContact CZ3-CB 4.44Å
429	L	89.8	Confident	91.8	Very high	73 Å²	73	47 Å²	47	38%	0.382	25%	0.25	S	C	.	.	I	π-helix	trans	-71.5	-42.7	-173	-67.2	175.3	0	0	0	112.3	R397 A399 A425	R397-L429 HydrophobicContact CB-CD2 4.03Å; R397-L429 PolarHBondContact NE-O 3.2Å; R397-L429 PolarHBondContact NH2-O 3.31Å; R397-L429 WeakPolarHBondContact O-CD2 3.31Å; A399-L429 HydrophobicContact CB-CD1 4.04Å; A399-L429 HydrophobicContact CB-CD2 4.21Å; A399-L429 HydrophobicContact CB-CG 4.08Å; A425-L429 VanDerWaalsContact O-CB 3.24Å; A425-L429 WeakPolarHBondContact O-CB 3.41Å; A425-L429 WeakPolarHBondContact O-CG 3.41Å; A425-L429 PolarHBondContact O-N 2.93Å
430	I	90.5	Very high	91.7	Very high	107 Å²	107	49.3 Å²	49.3	55%	0.549	26%	0.26	S	S	.	.	I	π-helix	trans	-95.2	-57.3	-172.3	-55.2	171.9	0	0	0	110.6	R397 A426 G432 W444	R397-I430 PolarHBondContact NH2-O 2.82Å; A426-I430 HydrophobicContact CB-CD1 4.42Å; A426-I430 WeakPolarHBondContact O-CA 3.5Å; A426-I430 VanDerWaalsContact O-CB 3.27Å; A426-I430 WeakPolarHBondContact O-CB 3.24Å; A426-I430 PolarHBondContact O-N 3.11Å; I430-G432 VanDerWaalsContact C-N 3.32Å; I430-G432 PolarHBondContact O-N 3.34Å; I430-W444 HydrophobicContact CB-CZ2 4.1Å; I430-W444 HydrophobicContact CD1-CH2 3.51Å; I430-W444 HydrophobicContact CD1-CZ2 3.58Å; I430-W444 HydrophobicContact CD1-CZ3 4.42Å; I430-W444 HydrophobicContact CG1-CZ2 4.41Å; I430-W444 HydrophobicContact CG2-CZ2 4.08Å
431	N	89.4	Confident	91.8	Very high	62 Å²	62	48.9 Å²	48.9	33%	0.332	26%	0.258	S	S	.	.	I	π-helix	trans	-74.4	-21.4	-179	-57.4	104.9	0	0	0	113.2	V427 L433 H440 W444	V427-N431 CarbonylContact O-C 3.58Å; V427-N431 WeakPolarHBondContact O-CA 3.1Å; V427-N431 WeakPolarHBondContact O-CB 3.49Å; V427-N431 PolarHBondContact O-N 3.25Å; N431-L433 VanDerWaalsContact C-N 3.29Å; N431-L433 HydrophobicContact CB-CD1 4.31Å; N431-L433 HydrophobicContact CB-CG 4.24Å; N431-L433 PolarHBondContact O-N 3.43Å; N431-H440 PolarHBondContact ND2-ND1 3.14Å; N431-W444 PolarHBondContact OD1-NE1 3.31Å
432	G	87.5	Confident	91.9	Very high	27 Å²	27	52.7 Å²	52.7	28%	0.278	27%	0.274	S	S	.	.			trans	76.2	15	-179.5	0	0	0	0	0	114.6	V427 W428 I430	V427-G432 PolarHBondContact O-N 3.18Å; W428-G432 VanDerWaalsContact O-CA 3.29Å; W428-G432 WeakPolarHBondContact O-CA 3.49Å; W428-G432 PolarHBondContact O-N 3.02Å; I430-G432 VanDerWaalsContact C-N 3.32Å; I430-G432 PolarHBondContact O-N 3.34Å
433	L	87.8	Confident	92	Very high	74 Å²	74	53 Å²	53	39%	0.387	28%	0.282	S	S	.	.			trans	-102.3	146.9	-177.8	-56.3	176.1	0	0	0	110	V427 W428 N431 D435 H440	V427-L433 HydrophobicContact CG1-CB 3.88Å; V427-L433 PolarHBondContact O-N 3.3Å; W428-L433 WeakPolarHBondContact CA-O 3.25Å; N431-L433 VanDerWaalsContact C-N 3.29Å; N431-L433 HydrophobicContact CB-CD1 4.31Å; N431-L433 HydrophobicContact CB-CG 4.24Å; N431-L433 PolarHBondContact O-N 3.43Å; L433-D435 HydrophobicContact CB-CB 4.35Å; L433-H440 WeakPolarHBondContact CD1-CD2 3.26Å
434	N	85.8	Confident	92.1	Very high	66 Å²	66	55.7 Å²	55.7	35%	0.353	29%	0.292	S	S	.	.			trans	-107.1	64	166.4	-165.1	-10.7	0	0	0	108	N269 N270 W428	N269-N434 PolarHBondContact ND2-OD1 2.9Å; N270-N434 PolarHBondContact ND2-ND2 3.18Å; N270-N434 VanDerWaalsContact ND2-ND2 3.16Å; W428-N434 HydrophobicContact CE3-CB 4.34Å; W428-N434 HydrophobicContact CZ3-CB 4.44Å
435	D	81.9	Confident	92.1	Very high	60 Å²	60	54.2 Å²	54.2	32%	0.321	29%	0.286	S	S	.	.			trans	-89.1	158.9	177	-176.9	15.9	0	0	0	109.6	V427 L433 G438	V427-D435 HydrophobicContact CG1-CB 4.1Å; L433-D435 HydrophobicContact CB-CB 4.35Å; D435-G438 VanDerWaalsContact OD2-CA 3.25Å; D435-G438 WeakPolarHBondContact OD2-CA 3.42Å
436	G	89.9	Confident	92.2	Very high	35 Å²	35	58 Å²	58	36%	0.361	31%	0.305	S	S	.	.	S	Bend	trans	-85.6	-135.7	166.6	0	0	0	0	0	110.5	G438 W441	G436-G438 PolarHBondContact O-N 3.39Å; G436-W441 VanDerWaalsContact O-CB 3.26Å; G436-W441 WeakPolarHBondContact O-CB 3.4Å
437	H	93.7	Very high	92.3	Very high	39 Å²	39	62 Å²	62	18%	0.181	32%	0.321	C	S	.	.	S	Bend	trans	-77.6	33.6	179.6	-46	98.6	0	0	0	113.9	Y266 H420 H424 W441 K442 V460	Y266-H437 AromaticContact CE1-CE1 4Å; Y266-H437 AromaticContact CE1-ND1 3.97Å; H420-H437 AromaticContact CE1-CD2 3.48Å; H420-H437 PolarHBondContact CE1-CD2 3.43Å; H420-H437 VanDerWaalsContact CE1-CD2 3.48Å; H420-H437 AromaticContact CE1-NE2 3.11Å; H420-H437 PolarHBondContact CE1-NE2 3.49Å; H420-H437 AromaticContact NE2-CD2 3.65Å; H420-H437 AromaticContact NE2-NE2 2.98Å; H420-H437 PolarHBondContact NE2-NE2 3.08Å; H424-H437 AromaticContact CE1-CD2 3.58Å; H424-H437 AromaticContact CE1-NE2 3.54Å; H424-H437 AromaticContact NE2-CD2 3.77Å; H424-H437 AromaticContact NE2-NE2 3.43Å; H424-H437 PolarHBondContact NE2-NE2 3.29Å; H437-W441 HydrophobicContact CB-CD2 4.24Å; H437-W441 HydrophobicContact CB-CE3 4.04Å; H437-W441 AromaticContact CD2-CD2 3.94Å; H437-W441 AromaticContact CD2-CE2 3.77Å; H437-K442 WeakPolarHBondContact O-CE 3.41Å; H437-V460 HydrophobicContact CB-CB 4.49Å; H437-V460 HydrophobicContact CB-CG1 3.81Å; H437-V460 HydrophobicContact CB-CG2 4.16Å; H437-V460 PolarHBondContact NE2-O 2.88Å
438	G	92.1	Very high	92.4	Very high	20 Å²	20	62.4 Å²	62.4	21%	0.206	32%	0.324	C	S	.	.	S	Bend	trans	-75.6	-162.4	-176.2	0	0	0	0	0	114.2	D435 G436 H440 W441 K442	D435-G438 VanDerWaalsContact OD2-CA 3.25Å; D435-G438 WeakPolarHBondContact OD2-CA 3.42Å; G436-G438 PolarHBondContact O-N 3.39Å; G438-H440 VanDerWaalsContact C-N 3.31Å; G438-H440 PolarHBondContact O-N 2.61Å; G438-W441 PolarHBondContact O-N 3.01Å; G438-K442 WeakPolarHBondContact O-CB 3.46Å; G438-K442 WeakPolarHBondContact O-CG 3.15Å; G438-K442 PolarHBondContact O-N 3.36Å
439	R	95.9	Very high	92.5	Very high	217 Å²	217	64.7 Å²	64.7	82%	0.819	34%	0.335	S	S	*	.	H	α-helix	trans	-58.6	-40.7	-170.9	-174	-178.6	-72.7	-159.1	-0.1	112.2	S443	R439-S443 PolarHBondContact O-N 3.17Å; R439-S443 VanDerWaalsContact O-N 3.07Å
440	H	94.7	Very high	92.7	Very high	70 Å²	70	71 Å²	71	32%	0.324	35%	0.354	S	S	.	.	H	α-helix	trans	-72.2	-42	-179.3	-66.9	-88.2	0	0	0	111.7	V427 N431 L433 G438 S443 W444	V427-H440 HydrophobicContact CG1-CB 4.16Å; V427-H440 HydrophobicContact CG2-CB 3.89Å; N431-H440 PolarHBondContact ND2-ND1 3.14Å; L433-H440 WeakPolarHBondContact CD1-CD2 3.26Å; G438-H440 VanDerWaalsContact C-N 3.31Å; G438-H440 PolarHBondContact O-N 2.61Å; H440-S443 WeakPolarHBondContact O-CB 3.34Å; H440-S443 PolarHBondContact O-N 3.27Å; H440-S443 VanDerWaalsContact O-N 3.15Å; H440-W444 PolarHBondContact O-N 3.37Å
441	W	96.8	Very high	92.9	Very high	4 Å²	4	69.4 Å²	69.4	2%	0.015	35%	0.349	C	S	.	.	H	α-helix	trans	-61.7	-45.5	175.5	-174.1	96.6	0	0	0	111.8	H420 C423 H424 V427 G436 H437 G438 S443 W444 A445 V458 V460	H420-W441 AromaticContact CE1-CZ2 3.6Å; H420-W441 AromaticContact CG-CZ2 3.94Å; H420-W441 AromaticContact ND1-CH2 3.98Å; H420-W441 AromaticContact ND1-CZ2 3.4Å; H420-W441 WeakPolarHBondContact ND1-CZ2 3.36Å; H420-W441 PolarHBondContact O-NE1 2.58Å; C423-W441 HydrophobicContact CB-CD2 4.35Å; C423-W441 HydrophobicContact CB-CG 4.28Å; C423-W441 HydrophobicContact CB-CZ2 4.25Å; C423-W441 VanDerWaalsContact CB-NE1 3.31Å; H424-W441 AromaticContact CD2-NE1 3.64Å; H424-W441 AromaticContact CE1-CD1 3.32Å; H424-W441 AromaticContact CE1-NE1 3.29Å; H424-W441 PolarHBondContact CE1-NE1 3.17Å; H424-W441 VanDerWaalsContact CE1-NE1 3.29Å; H424-W441 AromaticContact CG-CD1 3.71Å; H424-W441 AromaticContact CG-NE1 3.69Å; H424-W441 AromaticContact ND1-CD1 3.18Å; H424-W441 AromaticContact ND1-NE1 3.49Å; H424-W441 PolarHBondContact ND1-NE1 3.45Å; H424-W441 AromaticContact NE2-CD1 3.89Å; H424-W441 AromaticContact NE2-NE1 3.37Å; H424-W441 PolarHBondContact NE2-NE1 2.89Å; V427-W441 HydrophobicContact CG2-CB 4.1Å; G436-W441 VanDerWaalsContact O-CB 3.26Å; G436-W441 WeakPolarHBondContact O-CB 3.4Å; H437-W441 HydrophobicContact CB-CD2 4.24Å; H437-W441 HydrophobicContact CB-CE3 4.04Å; H437-W441 AromaticContact CD2-CD2 3.94Å; H437-W441 AromaticContact CD2-CE2 3.77Å; G438-W441 PolarHBondContact O-N 3.01Å; W441-S443 PolarHBondContact O-N 3.25Å; W441-W444 PolarHBondContact O-N 3.12Å; W441-W444 VanDerWaalsContact O-N 3.1Å; W441-A445 HydrophobicContact CE3-CB 4.24Å; W441-A445 HydrophobicContact CH2-CB 4.01Å; W441-A445 HydrophobicContact CZ3-CB 3.83Å; W441-A445 PolarHBondContact O-N 3.48Å; W441-V458 HydrophobicContact CH2-CG1 3.98Å; W441-V458 HydrophobicContact CZ2-CG1 3.92Å; W441-V460 HydrophobicContact CE3-CG2 4.46Å; W441-V460 HydrophobicContact CH2-CG2 4.35Å; W441-V460 HydrophobicContact CZ3-CG2 3.76Å
442	K	96.3	Very high	93.1	Very high	97 Å²	97	72.9 Å²	72.9	42%	0.422	36%	0.357	S	S	.	.	H	α-helix	trans	-59.6	-34.9	174.5	-72.2	170	177.1	168.1	0	111.8	H437 G438 N446	H437-K442 WeakPolarHBondContact O-CE 3.41Å; G438-K442 WeakPolarHBondContact O-CB 3.46Å; G438-K442 WeakPolarHBondContact O-CG 3.15Å; G438-K442 PolarHBondContact O-N 3.36Å; K442-N446 WeakPolarHBondContact O-CB 3.33Å; K442-N446 PolarHBondContact O-N 3.19Å; K442-N446 PolarHBondContact O-ND2 3.35Å
443	S	96.6	Very high	93.4	Very high	76 Å²	76	75.8 Å²	75.8	53%	0.531	37%	0.372	S	S	.	.	H	α-helix	trans	-65.5	-41.9	173.6	-164.8	0	0	0	0	112.7	R439 H440 W441 N446 H447	R439-S443 PolarHBondContact O-N 3.17Å; R439-S443 VanDerWaalsContact O-N 3.07Å; H440-S443 WeakPolarHBondContact O-CB 3.34Å; H440-S443 PolarHBondContact O-N 3.27Å; H440-S443 VanDerWaalsContact O-N 3.15Å; W441-S443 PolarHBondContact O-N 3.25Å; S443-N446 PolarHBondContact O-N 3.08Å; S443-H447 WeakPolarHBondContact O-CB 3.36Å; S443-H447 PolarHBondContact O-N 3.09Å
444	W	97.2	Very high	93.6	Very high	59 Å²	59	82 Å²	82	22%	0.223	40%	0.396	C	S	.	.	H	α-helix	trans	-69.4	-41.1	176.1	-73.4	110.6	0	0	0	112.7	C423 A426 I430 N431 H440 W441 N446 H447 V448	C423-W444 HydrophobicContact CB-CB 4.07Å; A426-W444 HydrophobicContact CB-CD2 3.63Å; A426-W444 HydrophobicContact CB-CE3 4.12Å; A426-W444 HydrophobicContact CB-CG 3.83Å; A426-W444 HydrophobicContact CB-CZ2 4.25Å; I430-W444 HydrophobicContact CB-CZ2 4.1Å; I430-W444 HydrophobicContact CD1-CH2 3.51Å; I430-W444 HydrophobicContact CD1-CZ2 3.58Å; I430-W444 HydrophobicContact CD1-CZ3 4.42Å; I430-W444 HydrophobicContact CG1-CZ2 4.41Å; I430-W444 HydrophobicContact CG2-CZ2 4.08Å; N431-W444 PolarHBondContact OD1-NE1 3.31Å; H440-W444 PolarHBondContact O-N 3.37Å; W441-W444 PolarHBondContact O-N 3.12Å; W441-W444 VanDerWaalsContact O-N 3.1Å; W444-N446 VanDerWaalsContact C-N 3.31Å; W444-N446 PolarHBondContact O-N 3.13Å; W444-H447 HydrophobicContact CE3-CB 4.41Å; W444-H447 AromaticContact CZ3-CD2 4Å; W444-H447 WeakPolarHBondContact O-CB 3.31Å; W444-H447 PolarHBondContact O-N 3.47Å; W444-H447 VanDerWaalsContact O-N 3.09Å; W444-V448 WeakPolarHBondContact O-CG2 3.27Å; W444-V448 PolarHBondContact O-N 2.8Å
445	A	96	Very high	93.9	Very high	3 Å²	3	81.3 Å²	81.3	3%	0.025	39%	0.391	C	S	.	.	H	α-helix	trans	-58.1	-42.8	173	0	0	0	0	0	111.9	W441 V448 H449 V458	W441-A445 HydrophobicContact CE3-CB 4.24Å; W441-A445 HydrophobicContact CH2-CB 4.01Å; W441-A445 HydrophobicContact CZ3-CB 3.83Å; W441-A445 PolarHBondContact O-N 3.48Å; A445-V448 PolarHBondContact O-N 2.98Å; A445-H449 PolarHBondContact O-N 3.43Å; A445-H449 VanDerWaalsContact O-N 3.15Å; A445-V458 HydrophobicContact CB-CB 4.05Å
446	N	96	Very high	94.3	Very high	91 Å²	91	81.6 Å²	81.6	49%	0.487	40%	0.397	S	S	.	.	H	α-helix	trans	-66.5	-36.2	173.7	-73.5	-21.4	0	0	0	112.7	K442 S443 W444 H449 R450	K442-N446 WeakPolarHBondContact O-CB 3.33Å; K442-N446 PolarHBondContact O-N 3.19Å; K442-N446 PolarHBondContact O-ND2 3.35Å; S443-N446 PolarHBondContact O-N 3.08Å; W444-N446 VanDerWaalsContact C-N 3.31Å; W444-N446 PolarHBondContact O-N 3.13Å; N446-H449 PolarHBondContact O-N 3.26Å; N446-R450 WeakPolarHBondContact O-CG 3.42Å; N446-R450 PolarHBondContact O-N 2.86Å
447	H	95.8	Very high	94.4	Very high	95 Å²	95	84.3 Å²	84.3	44%	0.44	41%	0.406	S	S	.	.	H	α-helix	trans	-65.5	-45.2	175.5	-178.8	75.6	0	0	0	111.6	S443 W444 H449 R450 V451	S443-H447 WeakPolarHBondContact O-CB 3.36Å; S443-H447 PolarHBondContact O-N 3.09Å; W444-H447 HydrophobicContact CE3-CB 4.41Å; W444-H447 AromaticContact CZ3-CD2 4Å; W444-H447 WeakPolarHBondContact O-CB 3.31Å; W444-H447 PolarHBondContact O-N 3.47Å; W444-H447 VanDerWaalsContact O-N 3.09Å; H447-H449 VanDerWaalsContact C-N 3.3Å; H447-H449 PolarHBondContact O-N 3.15Å; H447-R450 PolarHBondContact O-N 3Å; H447-R450 VanDerWaalsContact O-N 3.11Å; H447-V451 WeakPolarHBondContact O-CG2 3.2Å; H447-V451 PolarHBondContact O-N 2.78Å
448	V	94.8	Very high	94.4	Very high	12 Å²	12	83 Å²	83	7%	0.073	40%	0.401	C	S	.	.	H	α-helix	trans	-54.6	-46.1	173.2	169.1	0	0	0	0	111	L419 W444 A445 R450 V451 W452 V458	L419-V448 HydrophobicContact CD1-CG1 4.03Å; L419-V448 HydrophobicContact CD2-CG1 3.9Å; L419-V448 HydrophobicContact CG-CG1 4.4Å; W444-V448 WeakPolarHBondContact O-CG2 3.27Å; W444-V448 PolarHBondContact O-N 2.8Å; A445-V448 PolarHBondContact O-N 2.98Å; V448-R450 PolarHBondContact O-N 2.91Å; V448-V451 PolarHBondContact O-N 3.47Å; V448-W452 HydrophobicContact CG1-CE3 4.06Å; V448-W452 HydrophobicContact CG1-CZ3 4.46Å; V448-W452 PolarHBondContact O-N 3.07Å; V448-V458 HydrophobicContact CB-CG2 4.24Å; V448-V458 HydrophobicContact CG1-CG2 3.75Å
449	H	93.2	Very high	94.4	Very high	71 Å²	71	84.5 Å²	84.5	33%	0.329	41%	0.408	S	S	.	.	H	α-helix	trans	-68.8	-30.9	178.4	-173.8	58.2	0	0	0	113.4	A445 N446 H447 W452 P453	A445-H449 PolarHBondContact O-N 3.43Å; A445-H449 VanDerWaalsContact O-N 3.15Å; N446-H449 PolarHBondContact O-N 3.26Å; H447-H449 VanDerWaalsContact C-N 3.3Å; H447-H449 PolarHBondContact O-N 3.15Å; H449-W452 CarbonylContact O-C 3.16Å; H449-P453 WeakPolarHBondContact O-CA 2.94Å; H449-P453 VanDerWaalsContact O-N 3.11Å
450	R	94.7	Very high	94.2	Very high	207 Å²	207	77 Å²	77	78%	0.781	39%	0.386	S	S	*	.	H	α-helix	trans	-68.2	-39.1	173.3	-74.6	174	-177.2	-163.8	0.8	112.9	N446 H447 V448	N446-R450 WeakPolarHBondContact O-CG 3.42Å; N446-R450 PolarHBondContact O-N 2.86Å; H447-R450 PolarHBondContact O-N 3Å; H447-R450 VanDerWaalsContact O-N 3.11Å; V448-R450 PolarHBondContact O-N 2.91Å
451	V	95.4	Very high	93.9	Very high	73 Å²	73	75.8 Å²	75.8	44%	0.442	39%	0.385	S	S	.	.	H	α-helix	trans	-75.6	-39.6	178.3	179.1	0	0	0	0	111	H447 V448 P453	H447-V451 WeakPolarHBondContact O-CG2 3.2Å; H447-V451 PolarHBondContact O-N 2.78Å; V448-V451 PolarHBondContact O-N 3.47Å; V451-P453 VanDerWaalsContact C-CD 3.48Å; V451-P453 WeakPolarHBondContact O-CD 3.04Å
452	W	93	Very high	93.1	Very high	134 Å²	134	78 Å²	78	51%	0.508	40%	0.395	S	S	.	.			trans	-123.4	70.9	-179.7	-59.8	-72.5	0	0	0	112.3	V448 H449 K454 L455	V448-W452 HydrophobicContact CG1-CE3 4.06Å; V448-W452 HydrophobicContact CG1-CZ3 4.46Å; V448-W452 PolarHBondContact O-N 3.07Å; H449-W452 CarbonylContact O-C 3.16Å; W452-K454 PolarHBondContact O-N 2.81Å; W452-L455 HydrophobicContact CB-CB 4.38Å; W452-L455 HydrophobicContact CB-CD1 3.73Å; W452-L455 HydrophobicContact CB-CG 3.87Å; W452-L455 HydrophobicContact CG-CD1 4.19Å; W452-L455 WeakPolarHBondContact O-CB 3.36Å; W452-L455 PolarHBondContact O-N 2.77Å
453	P	93.5	Very high	92.2	Very high	89 Å²	89	78.4 Å²	78.4	58%	0.578	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-12.3	-177.1	26.7	-35.9	0	0	0	114.2	H449 V451 L455	H449-P453 WeakPolarHBondContact O-CA 2.94Å; H449-P453 VanDerWaalsContact O-N 3.11Å; V451-P453 VanDerWaalsContact C-CD 3.48Å; V451-P453 WeakPolarHBondContact O-CD 3.04Å; P453-L455 VanDerWaalsContact C-N 3.32Å
454	K	92.8	Very high	91.6	Very high	205 Å²	205	77.2 Å²	77.2	89%	0.891	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-8.4	172.8	-64.5	-178	-180	176.9	0	113.6	W452	W452-K454 PolarHBondContact O-N 2.81Å
455	L	91.1	Very high	90.9	Very high	50 Å²	50	79.8 Å²	79.8	26%	0.262	42%	0.424	S	S	.	.	S	Bend	trans	-93.9	151	177.6	-63.7	-174.6	0	0	0	111.6	L419 W452 P453	L419-L455 HydrophobicContact CD1-CD1 3.97Å; W452-L455 HydrophobicContact CB-CB 4.38Å; W452-L455 HydrophobicContact CB-CD1 3.73Å; W452-L455 HydrophobicContact CB-CG 3.87Å; W452-L455 HydrophobicContact CG-CD1 4.19Å; W452-L455 WeakPolarHBondContact O-CB 3.36Å; W452-L455 PolarHBondContact O-N 2.77Å; P453-L455 VanDerWaalsContact C-N 3.32Å
456	P	91.1	Very high	90.3	Very high	67 Å²	67	81.3 Å²	81.3	44%	0.435	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-54.8	147.3	170.3	-24	34.9	0	0	0	111.9	V458	P456-V458 PolarHBondContact O-N 3.42Å
457	V	92.5	Very high	89.7	Confident	92 Å²	92	82.7 Å²	82.7	56%	0.558	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-61.7	128.1	175.2	-179.8	0	0	0	0	109.5	S459	V457-S459 PolarHBondContact O-N 3.2Å
458	V	93.4	Very high	89.4	Confident	12 Å²	12	78.9 Å²	78.9	7%	0.073	42%	0.422	C	S	.	.			trans	-64	108.5	178.8	-174.4	0	0	0	0	109	L419 H420 W441 A445 V448 P456	L419-V458 HydrophobicContact CB-CG1 4.45Å; L419-V458 HydrophobicContact CB-CG2 3.88Å; L419-V458 HydrophobicContact CD1-CG2 4.37Å; H420-V458 HydrophobicContact CB-CG1 4.14Å; W441-V458 HydrophobicContact CH2-CG1 3.98Å; W441-V458 HydrophobicContact CZ2-CG1 3.92Å; A445-V458 HydrophobicContact CB-CB 4.05Å; V448-V458 HydrophobicContact CB-CG2 4.24Å; V448-V458 HydrophobicContact CG1-CG2 3.75Å; P456-V458 PolarHBondContact O-N 3.42Å
459	S	91.4	Very high	89	Confident	51 Å²	51	83.3 Å²	83.3	36%	0.357	44%	0.438	S	S	.	.			trans	-85	149.6	-172.4	49.2	0	0	0	0	112.7	H420 V457 C461	H420-S459 PolarHBondContact CE1-O 2.81Å; H420-S459 VanDerWaalsContact CE1-O 3.3Å; H420-S459 PolarHBondContact ND1-O 3.04Å; V457-S459 PolarHBondContact O-N 3.2Å; S459-C461 WeakPolarHBondContact CB-O 3.34Å; S459-C461 PolarHBondContact O-N 3.48Å; S459-C461 PolarHBondContact OG-O 3.05Å
460	V	92.3	Very high	88.9	Confident	58 Å²	58	80.3 Å²	80.3	35%	0.352	42%	0.423	S	S	.	.	S	Bend	trans	-65.1	-28.1	175.7	170.7	0	0	0	0	112.1	H420 H437 W441	H420-V460 PolarHBondContact CE1-O 3.22Å; H437-V460 HydrophobicContact CB-CB 4.49Å; H437-V460 HydrophobicContact CB-CG1 3.81Å; H437-V460 HydrophobicContact CB-CG2 4.16Å; H437-V460 PolarHBondContact NE2-O 2.88Å; W441-V460 HydrophobicContact CE3-CG2 4.46Å; W441-V460 HydrophobicContact CH2-CG2 4.35Å; W441-V460 HydrophobicContact CZ3-CG2 3.76Å
461	C	87.7	Confident	88.8	Confident	46 Å²	46	70.5 Å²	70.5	31%	0.311	39%	0.386	S	S	.	.	S	Bend	trans	-137.6	141.8	174	-57.5	0	0	0	0	110	Q262 Y266 S459	Q262-C461 PolarHBondContact NE2-SG 2.85Å; Y266-C461 PolarHBondContact OH-SG 3.22Å; S459-C461 WeakPolarHBondContact CB-O 3.34Å; S459-C461 PolarHBondContact O-N 3.48Å; S459-C461 PolarHBondContact OG-O 3.05Å
462	H	79.5	Confident	88.8	Confident	49 Å²	49	67.2 Å²	67.2	23%	0.227	37%	0.366	C	S	.	.			trans	-87.3	123.1	171.7	-59	-55.1	0	0	0	111.4	D416 H420 Y464	D416-H462 PolarHBondContact O-CE1 3.3Å; H420-H462 AromaticContact CG-NE2 3.76Å; H462-Y464 HydrophobicContact CB-CD1 4.22Å; H462-Y464 HydrophobicContact CB-CD2 3.65Å; H462-Y464 HydrophobicContact CB-CE1 4.06Å; H462-Y464 HydrophobicContact CB-CE2 3.47Å; H462-Y464 VanDerWaalsContact CB-CE2 3.47Å; H462-Y464 HydrophobicContact CB-CG 4Å; H462-Y464 AromaticContact CD2-CE2 3.95Å; H462-Y464 AromaticContact CG-CE2 3.55Å; H462-Y464 AromaticContact CG-CZ 3.63Å; H462-Y464 AromaticContact ND1-CZ 3.68Å; H462-Y464 PolarHBondContact ND1-OH 2.92Å; H462-Y464 PolarHBondContact O-N 3.01Å; H462-Y464 VanDerWaalsContact O-N 3.13Å
463	A	79.1	Confident	88.9	Confident	107 Å²	107	65.2 Å²	65.2	88%	0.884	36%	0.359	S	S	*	.			trans	-84.7	37.8	177.6	0	0	0	0	0	113.2
464	Y	82.9	Confident	89	Confident	51 Å²	51	61.1 Å²	61.1	20%	0.2	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-77.8	128.7	-174.5	-56.5	-31.1	0	0	0	112.6	V407 R413 D416 T417 H462 I466	V407-Y464 HydrophobicContact CG1-CD2 3.98Å; R413-Y464 HydrophobicContact CB-CE1 4.5Å; R413-Y464 HydrophobicContact CB-CE2 4.12Å; R413-Y464 HydrophobicContact CG-CD1 4.06Å; R413-Y464 HydrophobicContact CG-CD2 4.31Å; R413-Y464 HydrophobicContact CG-CE1 3.85Å; R413-Y464 HydrophobicContact CG-CE2 4.11Å; R413-Y464 HydrophobicContact CG-CG 4.31Å; D416-Y464 WeakPolarHBondContact CB-OH 3.39Å; T417-Y464 PolarHBondContact OG1-OH 3.33Å; H462-Y464 HydrophobicContact CB-CD1 4.22Å; H462-Y464 HydrophobicContact CB-CD2 3.65Å; H462-Y464 HydrophobicContact CB-CE1 4.06Å; H462-Y464 HydrophobicContact CB-CE2 3.47Å; H462-Y464 VanDerWaalsContact CB-CE2 3.47Å; H462-Y464 HydrophobicContact CB-CG 4Å; H462-Y464 AromaticContact CD2-CE2 3.95Å; H462-Y464 AromaticContact CG-CE2 3.55Å; H462-Y464 AromaticContact CG-CZ 3.63Å; H462-Y464 AromaticContact ND1-CZ 3.68Å; H462-Y464 PolarHBondContact ND1-OH 2.92Å; H462-Y464 PolarHBondContact O-N 3.01Å; H462-Y464 VanDerWaalsContact O-N 3.13Å; Y464-I466 PolarHBondContact O-N 3.28Å
465	T	82.6	Confident	89.2	Confident	112 Å²	112	55.5 Å²	55.5	69%	0.687	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-67	119.1	158.7	-53.3	0	0	0	0	109	R413	R413-T465 PolarHBondContact NH1-O 3.33Å; R413-T465 PolarHBondContact NH2-O 3.21Å
466	I	84.2	Confident	89.3	Confident	35 Å²	35	55.5 Å²	55.5	18%	0.179	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-103.6	119.9	-177	-65.9	164.2	0	0	0	109.9	Y265 V407 Y464 T468 H484	Y265-I466 HydrophobicContact CE2-CD1 4.45Å; Y265-I466 VanDerWaalsContact OH-CD1 3.25Å; Y265-I466 WeakPolarHBondContact OH-CD1 3.38Å; V407-I466 HydrophobicContact CG1-CD1 4.27Å; V407-I466 HydrophobicContact CG1-CG1 4.38Å; V407-I466 HydrophobicContact CG2-CD1 4.2Å; Y464-I466 PolarHBondContact O-N 3.28Å; I466-T468 HydrophobicContact CG2-CG2 4.38Å; I466-T468 PolarHBondContact O-N 2.84Å; I466-H484 WeakPolarHBondContact CG2-CE1 3.31Å; I466-H484 VanDerWaalsContact CG2-NE2 3.34Å; I466-H484 WeakPolarHBondContact CG2-NE2 3.21Å
467	D	83.5	Confident	89.6	Confident	120 Å²	120	55 Å²	55	64%	0.642	33%	0.325	S	S	*	.			trans	-73.8	96.4	-177.2	-69.9	-53.9	0	0	0	111.9	H484	D467-H484 PolarHBondContact O-CE1 2.79Å; D467-H484 VanDerWaalsContact O-CE1 3.28Å; D467-H484 PolarHBondContact O-ND1 2.91Å
468	T	87.8	Confident	89.7	Confident	16 Å²	16	52.4 Å²	52.4	10%	0.098	32%	0.316	C	S	.	.			trans	-92.9	136.2	176	61.9	0	0	0	0	111.6	I466 F470 N482 N507	I466-T468 HydrophobicContact CG2-CG2 4.38Å; I466-T468 PolarHBondContact O-N 2.84Å; T468-F470 VanDerWaalsContact C-N 3.31Å; T468-F470 PolarHBondContact O-N 3.46Å; T468-N482 HydrophobicContact CG2-CB 3.83Å; T468-N482 WeakPolarHBondContact OG1-CB 3.42Å; T468-N507 WeakPolarHBondContact O-CB 3.46Å; T468-N507 PolarHBondContact O-ND2 3Å
469	R	87.1	Confident	89.7	Confident	105 Å²	105	54.3 Å²	54.3	40%	0.396	33%	0.328	S	S	.	.	S	Bend	trans	-70.1	-26.5	178.9	-172	173.8	-173.7	174.6	5.4	113.2	I506 N507 R525 L526 H529	R469-I506 HydrophobicContact CG-CG2 4.34Å; R469-I506 WeakPolarHBondContact O-CA 3.25Å; R469-I506 WeakPolarHBondContact O-CG2 3.32Å; R469-N507 PolarHBondContact O-N 2.83Å; R469-R525 PolarHBondContact NH2-O 2.87Å; R469-L526 VanDerWaalsContact NH2-CD2 3.27Å; R469-H529 VanDerWaalsContact CZ-NE2 3.3Å; R469-H529 PolarHBondContact NH2-NE2 2.94Å; R469-H529 VanDerWaalsContact NH2-NE2 3.19Å
470	F	91.2	Very high	89.7	Confident	7 Å²	7	54 Å²	54	3%	0.031	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	137.7	-174.3	-54	-74.3	0	0	0	111.2	T468 R483 S485 K486 L504 L505 I506 H529	T468-F470 VanDerWaalsContact C-N 3.31Å; T468-F470 PolarHBondContact O-N 3.46Å; F470-R483 WeakPolarHBondContact CB-O 3.47Å; F470-R483 PolarHBondContact N-O 3.45Å; F470-R483 PolarHBondContact O-N 2.82Å; F470-S485 VanDerWaalsContact CD2-C 3.48Å; F470-K486 HydrophobicContact CD1-CG 3.96Å; F470-K486 HydrophobicContact CD2-CG 4.24Å; F470-K486 HydrophobicContact CE1-CD 4.39Å; F470-K486 HydrophobicContact CE1-CG 3.78Å; F470-K486 HydrophobicContact CE2-CG 4.07Å; F470-K486 HydrophobicContact CG-CG 4.18Å; F470-K486 HydrophobicContact CZ-CG 3.83Å; F470-L504 HydrophobicContact CB-CD1 3.92Å; F470-L504 HydrophobicContact CD1-CD1 4.08Å; F470-L504 HydrophobicContact CG-CD1 4.36Å; F470-L505 WeakPolarHBondContact CA-O 3.49Å; F470-I506 HydrophobicContact CD1-CG1 4.11Å; F470-I506 HydrophobicContact CE1-CD1 4.29Å; F470-I506 HydrophobicContact CE1-CG1 4.16Å; F470-I506 HydrophobicContact CE1-CG2 4.48Å; F470-H529 AromaticContact CZ-CE1 3.78Å; F470-H529 AromaticContact CZ-ND1 3.91Å; F470-H529 AromaticContact CZ-NE2 3.92Å
471	T	93.6	Very high	89.7	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.006	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	132.2	170	-60.4	0	0	0	0	109.6	C480 N482 L505 N507 M513	T471-C480 HydrophobicContact CG2-CB 3.62Å; T471-N482 WeakPolarHBondContact CB-OD1 3.39Å; T471-N482 WeakPolarHBondContact CG2-OD1 3.4Å; T471-N482 PolarHBondContact OG1-OD1 3.32Å; T471-L505 PolarHBondContact N-O 2.71Å; T471-L505 WeakPolarHBondContact O-CB 3.3Å; T471-L505 PolarHBondContact O-N 2.7Å; T471-N507 PolarHBondContact OG1-ND2 3.15Å; T471-N507 PolarHBondContact OG1-OD1 3.2Å; T471-M513 VanDerWaalsContact CB-CE 3.48Å; T471-M513 HydrophobicContact CG2-CE 3.36Å
472	Y	94	Very high	89.9	Confident	5 Å²	5	53.2 Å²	53.2	2%	0.02	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	109	173.4	-67.3	-89.2	0	0	0	108.8	C480 I481 R483 K486 S487 L488 I490 E503 L504	Y472-C480 CarbonylContact O-C 3.55Å; Y472-C480 WeakPolarHBondContact O-CA 3.16Å; Y472-I481 PolarHBondContact N-O 3.05Å; Y472-I481 PolarHBondContact O-N 2.97Å; Y472-R483 HydrophobicContact CD2-CG 4.18Å; Y472-R483 HydrophobicContact CE2-CB 4.26Å; Y472-R483 HydrophobicContact CE2-CG 4.11Å; Y472-K486 WeakPolarHBondContact OH-CA 3.36Å; Y472-S487 PolarHBondContact OH-N 3.32Å; Y472-L488 HydrophobicContact CD1-CB 3.98Å; Y472-L488 HydrophobicContact CD1-CD2 3.88Å; Y472-L488 HydrophobicContact CD1-CG 4.44Å; Y472-L488 HydrophobicContact CD2-CB 3.86Å; Y472-L488 HydrophobicContact CD2-CD2 4.24Å; Y472-L488 HydrophobicContact CE1-CB 3.72Å; Y472-L488 HydrophobicContact CE1-CD2 4.44Å; Y472-L488 VanDerWaalsContact CE1-O 3.23Å; Y472-L488 WeakPolarHBondContact CE1-O 3.46Å; Y472-L488 HydrophobicContact CE2-CB 3.62Å; Y472-L488 HydrophobicContact CG-CB 4.01Å; Y472-L488 HydrophobicContact CG-CD2 3.72Å; Y472-L488 HydrophobicContact CG-CG 4.5Å; Y472-L488 VanDerWaalsContact CZ-CB 3.5Å; Y472-L488 PolarHBondContact OH-N 3.02Å; Y472-L488 VanDerWaalsContact OH-N 3.08Å; Y472-L488 PolarHBondContact OH-O 2.87Å; Y472-I490 HydrophobicContact CD1-CG2 3.57Å; Y472-I490 HydrophobicContact CE1-CG2 3.6Å; Y472-E503 CarbonylContact C-O 3.59Å; Y472-E503 WeakPolarHBondContact CA-O 3.38Å; Y472-L504 HydrophobicContact CD1-CB 4.35Å; Y472-L504 HydrophobicContact CD1-CD1 4.12Å; Y472-L504 HydrophobicContact CE1-CB 4.22Å; Y472-L504 HydrophobicContact CE1-CD1 3.79Å; Y472-L504 HydrophobicContact CE1-CG 4.46Å; Y472-L504 HydrophobicContact CE2-CD1 4.21Å
473	R	95.4	Very high	90.4	Very high	91 Å²	91	55.2 Å²	55.2	34%	0.343	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	129.6	-179.9	178.6	164.8	66.7	-167.4	2	110.1	T475 F502 E503 L505	R473-T475 PolarHBondContact O-N 2.98Å; R473-F502 CarbonylContact O-C 3.48Å; R473-F502 WeakPolarHBondContact O-CA 3.41Å; R473-E503 HydrophobicContact CB-CG 4.09Å; R473-E503 IonicContact CZ-OE1 2.72Å; R473-E503 PolarHBondContact N-O 3.26Å; R473-E503 IonicContact NE-OE1 3.92Å; R473-E503 PolarHBondContact NE-OE1 3.42Å; R473-E503 IonicContact NH2-OE1 3.29Å; R473-E503 PolarHBondContact NH2-OE1 2.7Å; R473-E503 PolarHBondContact O-N 2.69Å; R473-L505 HydrophobicContact CB-CD1 3.87Å
474	C	96.6	Very high	90.7	Very high	3 Å²	3	53.1 Å²	53.1	2%	0.02	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	131.6	174	-177.6	0	0	0	0	110.4	G476 C477 G478 V479 C495 C498 F502	C474-G476 PolarHBondContact O-N 3.32Å; C474-C477 VanDerWaalsContact SG-SG 3.67Å; C474-G478 WeakPolarHBondContact O-CA 3.39Å; C474-G478 PolarHBondContact O-N 3.28Å; C474-V479 HydrophobicContact CB-CB 4.47Å; C474-V479 WeakPolarHBondContact CB-O 3.29Å; C474-V479 PolarHBondContact N-O 2.65Å; C474-C495 HydrophobicContact CB-CB 4.09Å; C474-C495 WeakPolarHBondContact SG-CB 3.19Å; C474-C498 PolarHBondContact SG-SG 3.34Å; C474-F502 HydrophobicContact CB-CD1 4.14Å; C474-F502 HydrophobicContact CB-CE1 3.92Å
475	T	95.5	Very high	91	Very high	88 Å²	88	53.5 Å²	53.5	54%	0.54	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-3.2	-178.3	68.2	0	0	0	0	114.1	R473 K501 E503	R473-T475 PolarHBondContact O-N 2.98Å; T475-K501 PolarHBondContact N-O 2.93Å; T475-K501 PolarHBondContact OG1-O 2.66Å; T475-E503 HydrophobicContact CG2-CB 4.14Å; T475-E503 HydrophobicContact CG2-CG 4.37Å
476	G	95	Very high	91.2	Very high	50 Å²	50	52 Å²	52	52%	0.515	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-80.2	173.7	0	0	0	0	0	111	C474 G478	C474-G476 PolarHBondContact O-N 3.32Å; G476-G478 VanDerWaalsContact C-N 3.29Å; G476-G478 PolarHBondContact O-N 3.34Å
477	C	96.1	Very high	91.3	Very high	57 Å²	57	53.3 Å²	53.3	39%	0.385	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	4.4	-175.9	65.1	0	0	0	0	116	C474 V479 C498	C474-C477 VanDerWaalsContact SG-SG 3.67Å; C477-V479 HydrophobicContact CB-CG2 4.41Å; C477-V479 PolarHBondContact O-N 2.84Å; C477-V479 VanDerWaalsContact SG-CG2 3.52Å; C477-C498 HydrophobicContact CB-CB 4.03Å; C477-C498 PolarHBondContact N-SG 2.88Å; C477-C498 VanDerWaalsContact N-SG 3.42Å; C477-C498 PolarHBondContact SG-SG 3.05Å
478	G	94.4	Very high	91.5	Very high	36 Å²	36	49.2 Å²	49.2	37%	0.371	28%	0.277	S	S	.	.			trans	69.9	-11	178.7	0	0	0	0	0	116.7	C474 G476 C480	C474-G478 WeakPolarHBondContact O-CA 3.39Å; C474-G478 PolarHBondContact O-N 3.28Å; G476-G478 VanDerWaalsContact C-N 3.29Å; G476-G478 PolarHBondContact O-N 3.34Å; G478-C480 PolarHBondContact O-N 3.35Å; G478-C480 PolarHBondContact O-SG 2.87Å
479	V	93.1	Very high	91.5	Very high	53 Å²	53	51.6 Å²	51.6	32%	0.321	29%	0.289	S	S	.	.			trans	-50.3	128.9	-179.5	172.1	0	0	0	0	111.6	C474 C477	C474-V479 HydrophobicContact CB-CB 4.47Å; C474-V479 WeakPolarHBondContact CB-O 3.29Å; C474-V479 PolarHBondContact N-O 2.65Å; C477-V479 HydrophobicContact CB-CG2 4.41Å; C477-V479 PolarHBondContact O-N 2.84Å; C477-V479 VanDerWaalsContact SG-CG2 3.52Å
480	C	93.2	Very high	91.7	Very high	45 Å²	45	49.8 Å²	49.8	30%	0.304	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135.4	-173.1	-77.5	0	0	0	0	112.4	T471 Y472 G478	T471-C480 HydrophobicContact CG2-CB 3.62Å; Y472-C480 CarbonylContact O-C 3.55Å; Y472-C480 WeakPolarHBondContact O-CA 3.16Å; G478-C480 PolarHBondContact O-N 3.35Å; G478-C480 PolarHBondContact O-SG 2.87Å
481	I	91	Very high	91.5	Very high	44 Å²	44	55.3 Å²	55.3	23%	0.226	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	108.5	177.7	-57.1	179.3	0	0	0	109.4	Y472 R483 F502	Y472-I481 PolarHBondContact N-O 3.05Å; Y472-I481 PolarHBondContact O-N 2.97Å; I481-R483 VanDerWaalsContact CG2-CZ 3.41Å; I481-F502 HydrophobicContact CD1-CE1 3.73Å; I481-F502 HydrophobicContact CD1-CE2 4.3Å; I481-F502 HydrophobicContact CD1-CZ 3.47Å; I481-F502 VanDerWaalsContact CD1-CZ 3.47Å; I481-F502 HydrophobicContact CG1-CE1 4.12Å; I481-F502 HydrophobicContact CG1-CZ 4.35Å
482	N	91.2	Very high	91.4	Very high	42 Å²	42	61.7 Å²	61.7	23%	0.225	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	137.8	-178.5	-75.9	-0.5	0	0	0	112.4	Y261 T468 T471	Y261-N482 HydrophobicContact CE1-CB 3.9Å; Y261-N482 VanDerWaalsContact OH-CB 3.31Å; Y261-N482 WeakPolarHBondContact OH-CB 3.43Å; Y261-N482 VanDerWaalsContact OH-CG 3.29Å; Y261-N482 PolarHBondContact OH-ND2 3.46Å; T468-N482 HydrophobicContact CG2-CB 3.83Å; T468-N482 WeakPolarHBondContact OG1-CB 3.42Å; T471-N482 WeakPolarHBondContact CB-OD1 3.39Å; T471-N482 WeakPolarHBondContact CG2-OD1 3.4Å; T471-N482 PolarHBondContact OG1-OD1 3.32Å
483	R	90.3	Very high	91.2	Very high	91 Å²	91	64.7 Å²	64.7	34%	0.343	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	137.1	-179.8	-63.4	-65.6	178.8	-106.5	10.8	112.2	F470 Y472 I481 S485	F470-R483 WeakPolarHBondContact CB-O 3.47Å; F470-R483 PolarHBondContact N-O 3.45Å; F470-R483 PolarHBondContact O-N 2.82Å; Y472-R483 HydrophobicContact CD2-CG 4.18Å; Y472-R483 HydrophobicContact CE2-CB 4.26Å; Y472-R483 HydrophobicContact CE2-CG 4.11Å; I481-R483 VanDerWaalsContact CG2-CZ 3.41Å; R483-S485 VanDerWaalsContact CB-O 3.29Å; R483-S485 WeakPolarHBondContact CB-O 3.44Å; R483-S485 PolarHBondContact O-N 2.96Å
484	H	85.6	Confident	91.2	Very high	64 Å²	64	65.1 Å²	65.1	30%	0.296	37%	0.366	S	S	.	.	S	Bend	trans	-71.6	-13.3	172.7	-57.6	-80.4	0	0	0	113.7	K406 I466 D467	K406-H484 HydrophobicContact CD-CB 4.12Å; I466-H484 WeakPolarHBondContact CG2-CE1 3.31Å; I466-H484 VanDerWaalsContact CG2-NE2 3.34Å; I466-H484 WeakPolarHBondContact CG2-NE2 3.21Å; D467-H484 PolarHBondContact O-CE1 2.79Å; D467-H484 VanDerWaalsContact O-CE1 3.28Å; D467-H484 PolarHBondContact O-ND1 2.91Å
485	S	88.7	Confident	91.1	Very high	59 Å²	59	65.1 Å²	65.1	41%	0.413	37%	0.366	S	S	.	.	S	Bend	trans	-131.6	157.5	-179	63.9	0	0	0	0	111.5	F470 R483 S487	F470-S485 VanDerWaalsContact CD2-C 3.48Å; R483-S485 VanDerWaalsContact CB-O 3.29Å; R483-S485 WeakPolarHBondContact CB-O 3.44Å; R483-S485 PolarHBondContact O-N 2.96Å; S485-S487 PolarHBondContact O-N 3.19Å; S485-S487 PolarHBondContact O-OG 3.39Å; S485-S487 WeakPolarHBondContact OG-CB 3.36Å; S485-S487 PolarHBondContact OG-OG 3.04Å; S485-S487 VanDerWaalsContact OG-OG 3.05Å
486	K	87.2	Confident	91	Very high	79 Å²	79	64.6 Å²	64.6	34%	0.343	38%	0.378	S	S	.	.	S	Bend	trans	-73.6	59.3	170.5	-65	-170.9	179.2	-171.4	0	111.7	F470 Y472 L504 H529	F470-K486 HydrophobicContact CD1-CG 3.96Å; F470-K486 HydrophobicContact CD2-CG 4.24Å; F470-K486 HydrophobicContact CE1-CD 4.39Å; F470-K486 HydrophobicContact CE1-CG 3.78Å; F470-K486 HydrophobicContact CE2-CG 4.07Å; F470-K486 HydrophobicContact CG-CG 4.18Å; F470-K486 HydrophobicContact CZ-CG 3.83Å; Y472-K486 WeakPolarHBondContact OH-CA 3.36Å; K486-L504 HydrophobicContact CD-CD2 3.88Å; K486-L504 HydrophobicContact CG-CD2 4.1Å; K486-H529 WeakPolarHBondContact CE-ND1 3.39Å; K486-H529 PolarHBondContact NZ-O 2.93Å
487	S	87	Confident	90.8	Very high	63 Å²	63	69.5 Å²	69.5	44%	0.441	39%	0.387	S	S	.	.			trans	-92.1	-17.9	-172.1	40.1	0	0	0	0	114.7	Y472 S485	Y472-S487 PolarHBondContact OH-N 3.32Å; S485-S487 PolarHBondContact O-N 3.19Å; S485-S487 PolarHBondContact O-OG 3.39Å; S485-S487 WeakPolarHBondContact OG-CB 3.36Å; S485-S487 PolarHBondContact OG-OG 3.04Å; S485-S487 VanDerWaalsContact OG-OG 3.05Å
488	L	87.6	Confident	90.8	Very high	34 Å²	34	69 Å²	69	18%	0.178	38%	0.384	C	S	.	.			trans	-86.9	117.5	174.4	-166.7	75.8	0	0	0	109.9	Y472 I490 K493 F502	Y472-L488 HydrophobicContact CD1-CB 3.98Å; Y472-L488 HydrophobicContact CD1-CD2 3.88Å; Y472-L488 HydrophobicContact CD1-CG 4.44Å; Y472-L488 HydrophobicContact CD2-CB 3.86Å; Y472-L488 HydrophobicContact CD2-CD2 4.24Å; Y472-L488 HydrophobicContact CE1-CB 3.72Å; Y472-L488 HydrophobicContact CE1-CD2 4.44Å; Y472-L488 VanDerWaalsContact CE1-O 3.23Å; Y472-L488 WeakPolarHBondContact CE1-O 3.46Å; Y472-L488 HydrophobicContact CE2-CB 3.62Å; Y472-L488 HydrophobicContact CG-CB 4.01Å; Y472-L488 HydrophobicContact CG-CD2 3.72Å; Y472-L488 HydrophobicContact CG-CG 4.5Å; Y472-L488 VanDerWaalsContact CZ-CB 3.5Å; Y472-L488 PolarHBondContact OH-N 3.02Å; Y472-L488 VanDerWaalsContact OH-N 3.08Å; Y472-L488 PolarHBondContact OH-O 2.87Å; L488-I490 PolarHBondContact O-N 3.07Å; L488-K493 HydrophobicContact CD1-CB 3.83Å; L488-K493 HydrophobicContact CD1-CG 3.86Å; L488-K493 HydrophobicContact CG-CB 4.2Å; L488-F502 HydrophobicContact CD2-CB 4.43Å; L488-F502 HydrophobicContact CD2-CD2 3.78Å; L488-F502 HydrophobicContact CD2-CE2 4.13Å; L488-F502 HydrophobicContact CD2-CG 4.02Å
489	D	88.8	Confident	90.8	Very high	66 Å²	66	76.9 Å²	76.9	35%	0.353	40%	0.403	S	S	.	.			trans	-78.8	103.2	170.1	178.3	-6.4	0	0	0	109.8	T491 R492 K493	D489-T491 PolarHBondContact O-N 3.26Å; D489-T491 WeakPolarHBondContact OD1-CA 3.35Å; D489-T491 WeakPolarHBondContact OD1-CB 3.35Å; D489-T491 PolarHBondContact OD1-N 3.47Å; D489-T491 PolarHBondContact OD1-OG1 2.87Å; D489-T491 PolarHBondContact OD2-OG1 3.47Å; D489-R492 HydrophobicContact CB-CB 4.4Å; D489-R492 PolarHBondContact O-N 2.93Å; D489-R492 PolarHBondContact OD1-N 2.94Å; D489-R492 WeakPolarHBondContact OD2-CD 3.23Å; D489-R492 WeakPolarHBondContact OD2-CG 3.34Å; D489-K493 WeakPolarHBondContact O-CB 3.5Å; D489-K493 PolarHBondContact O-N 3.42Å
490	I	89.8	Confident	90.9	Very high	67 Å²	67	76.2 Å²	76.2	34%	0.344	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-8.6	-179	65.7	176.3	0	0	0	114.1	Y472 L488 F502	Y472-I490 HydrophobicContact CD1-CG2 3.57Å; Y472-I490 HydrophobicContact CE1-CG2 3.6Å; L488-I490 PolarHBondContact O-N 3.07Å; I490-F502 HydrophobicContact CG2-CB 3.9Å
491	T	88.1	Confident	91	Very high	123 Å²	123	81 Å²	81	76%	0.755	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-33.7	172.8	74.1	0	0	0	0	111.3	D489	D489-T491 PolarHBondContact O-N 3.26Å; D489-T491 WeakPolarHBondContact OD1-CA 3.35Å; D489-T491 WeakPolarHBondContact OD1-CB 3.35Å; D489-T491 PolarHBondContact OD1-N 3.47Å; D489-T491 PolarHBondContact OD1-OG1 2.87Å; D489-T491 PolarHBondContact OD2-OG1 3.47Å
492	R	89.9	Confident	91.2	Very high	135 Å²	135	79.5 Å²	79.5	51%	0.509	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-15.5	-177.4	-66.4	-178.3	67.8	-168	0.8	114.9	D489	D489-R492 HydrophobicContact CB-CB 4.4Å; D489-R492 PolarHBondContact O-N 2.93Å; D489-R492 PolarHBondContact OD1-N 2.94Å; D489-R492 WeakPolarHBondContact OD2-CD 3.23Å; D489-R492 WeakPolarHBondContact OD2-CG 3.34Å
493	K	91.5	Very high	91.4	Very high	68 Å²	68	78.9 Å²	78.9	30%	0.296	40%	0.404	S	S	.	.			trans	-119.2	125	-176.8	-63.2	-65.7	-175.1	177.4	0	111.5	Y296 L488 D489	Y296-K493 PolarHBondContact O-NZ 3.22Å; L488-K493 HydrophobicContact CD1-CB 3.83Å; L488-K493 HydrophobicContact CD1-CG 3.86Å; L488-K493 HydrophobicContact CG-CB 4.2Å; D489-K493 WeakPolarHBondContact O-CB 3.5Å; D489-K493 PolarHBondContact O-N 3.42Å
494	I	94	Very high	91.6	Very high	101 Å²	101	76 Å²	76	52%	0.518	40%	0.395	S	S	.	.			trans	-108.1	162.8	173.8	59.6	174.5	0	0	0	110.4	R499 F502	I494-R499 WeakPolarHBondContact CB-O 3.36Å; I494-R499 HydrophobicContact CD1-CB 4.13Å; I494-R499 HydrophobicContact CD1-CG 4.48Å; I494-F502 VanDerWaalsContact C-CE2 3.48Å
495	C	95.3	Very high	91.9	Very high	3 Å²	3	73 Å²	73	2%	0.02	38%	0.381	C	S	.	.			trans	-67.7	134.9	177.7	180	0	0	0	0	112	C474 H497 R499 S500 F502	C474-C495 HydrophobicContact CB-CB 4.09Å; C474-C495 WeakPolarHBondContact SG-CB 3.19Å; C495-H497 PolarHBondContact O-N 2.85Å; C495-H497 PolarHBondContact SG-N 3.49Å; C495-R499 WeakPolarHBondContact O-CA 3.46Å; C495-R499 PolarHBondContact O-N 2.95Å; C495-S500 PolarHBondContact N-O 3.08Å; C495-F502 HydrophobicContact CB-CE1 4.45Å; C495-F502 HydrophobicContact CB-CE2 4.15Å; C495-F502 HydrophobicContact CB-CZ 3.85Å
496	G	92.5	Very high	92.1	Very high	76 Å²	76	70.2 Å²	70.2	78%	0.784	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-37.4	177	0	0	0	0	0	113.7
497	H	92.5	Very high	92.2	Very high	153 Å²	153	68.2 Å²	68.2	71%	0.708	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-54.9	-176.1	-54.9	-83.3	0	0	0	112.7	C495	C495-H497 PolarHBondContact O-N 2.85Å; C495-H497 PolarHBondContact SG-N 3.49Å
498	C	95.8	Very high	92.1	Very high	48 Å²	48	66.3 Å²	66.3	32%	0.324	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117	7	-171.5	76.6	0	0	0	0	115	C474 C477 S500	C474-C498 PolarHBondContact SG-SG 3.34Å; C477-C498 HydrophobicContact CB-CB 4.03Å; C477-C498 PolarHBondContact N-SG 2.88Å; C477-C498 VanDerWaalsContact N-SG 3.42Å; C477-C498 PolarHBondContact SG-SG 3.05Å; C498-S500 PolarHBondContact O-N 2.84Å; C498-S500 PolarHBondContact O-OG 2.93Å; C498-S500 PolarHBondContact SG-OG 2.84Å
499	R	94	Very high	91.6	Very high	201 Å²	201	70.9 Å²	70.9	76%	0.758	37%	0.372	S	S	*	.			trans	59.8	1.8	178	-56.5	178.7	-175.3	169.1	2.9	116.4	I494 C495	I494-R499 WeakPolarHBondContact CB-O 3.36Å; I494-R499 HydrophobicContact CD1-CB 4.13Å; I494-R499 HydrophobicContact CD1-CG 4.48Å; C495-R499 WeakPolarHBondContact O-CA 3.46Å; C495-R499 PolarHBondContact O-N 2.95Å
500	S	95.2	Very high	91.1	Very high	38 Å²	38	76.3 Å²	76.3	27%	0.266	39%	0.392	S	S	.	.			trans	-71	164.2	174.3	-41.1	0	0	0	0	112.3	C495 C498	C495-S500 PolarHBondContact N-O 3.08Å; C498-S500 PolarHBondContact O-N 2.84Å; C498-S500 PolarHBondContact O-OG 2.93Å; C498-S500 PolarHBondContact SG-OG 2.84Å
501	K	95.3	Very high	90.6	Very high	147 Å²	147	76.2 Å²	76.2	64%	0.639	41%	0.408	S	S	*	.			trans	-70.8	170	177.5	-64	-179.4	-178.7	176.6	0	111.8	T475	T475-K501 PolarHBondContact N-O 2.93Å; T475-K501 PolarHBondContact OG1-O 2.66Å
502	F	95.4	Very high	90.5	Very high	11 Å²	11	76.5 Å²	76.5	5%	0.048	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	139	169.8	-71.7	-80.7	0	0	0	110.9	R473 C474 I481 L488 I490 I494 C495	R473-F502 CarbonylContact O-C 3.48Å; R473-F502 WeakPolarHBondContact O-CA 3.41Å; C474-F502 HydrophobicContact CB-CD1 4.14Å; C474-F502 HydrophobicContact CB-CE1 3.92Å; I481-F502 HydrophobicContact CD1-CE1 3.73Å; I481-F502 HydrophobicContact CD1-CE2 4.3Å; I481-F502 HydrophobicContact CD1-CZ 3.47Å; I481-F502 VanDerWaalsContact CD1-CZ 3.47Å; I481-F502 HydrophobicContact CG1-CE1 4.12Å; I481-F502 HydrophobicContact CG1-CZ 4.35Å; L488-F502 HydrophobicContact CD2-CB 4.43Å; L488-F502 HydrophobicContact CD2-CD2 3.78Å; L488-F502 HydrophobicContact CD2-CE2 4.13Å; L488-F502 HydrophobicContact CD2-CG 4.02Å; I490-F502 HydrophobicContact CG2-CB 3.9Å; I494-F502 VanDerWaalsContact C-CE2 3.48Å; C495-F502 HydrophobicContact CB-CE1 4.45Å; C495-F502 HydrophobicContact CB-CE2 4.15Å; C495-F502 HydrophobicContact CB-CZ 3.85Å
503	E	94.3	Very high	90.5	Very high	30 Å²	30	73.7 Å²	73.7	14%	0.14	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	149.9	160.1	68.1	173.8	162.8	0	0	110.5	Y472 R473 T475 R515	Y472-E503 CarbonylContact C-O 3.59Å; Y472-E503 WeakPolarHBondContact CA-O 3.38Å; R473-E503 HydrophobicContact CB-CG 4.09Å; R473-E503 IonicContact CZ-OE1 2.72Å; R473-E503 PolarHBondContact N-O 3.26Å; R473-E503 IonicContact NE-OE1 3.92Å; R473-E503 PolarHBondContact NE-OE1 3.42Å; R473-E503 IonicContact NH2-OE1 3.29Å; R473-E503 PolarHBondContact NH2-OE1 2.7Å; R473-E503 PolarHBondContact O-N 2.69Å; T475-E503 HydrophobicContact CG2-CB 4.14Å; T475-E503 HydrophobicContact CG2-CG 4.37Å; E503-R515 IonicContact OE2-CZ 3.2Å; E503-R515 IonicContact OE2-NE 2.8Å; E503-R515 PolarHBondContact OE2-NE 3.28Å; E503-R515 IonicContact OE2-NH2 2.71Å; E503-R515 PolarHBondContact OE2-NH2 3.01Å
504	L	94.3	Very high	90.5	Very high	29 Å²	29	71.4 Å²	71.4	15%	0.152	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	129.3	175.5	173.9	62.6	0	0	0	110.6	F470 Y472 K486 P516	F470-L504 HydrophobicContact CB-CD1 3.92Å; F470-L504 HydrophobicContact CD1-CD1 4.08Å; F470-L504 HydrophobicContact CG-CD1 4.36Å; Y472-L504 HydrophobicContact CD1-CB 4.35Å; Y472-L504 HydrophobicContact CD1-CD1 4.12Å; Y472-L504 HydrophobicContact CE1-CB 4.22Å; Y472-L504 HydrophobicContact CE1-CD1 3.79Å; Y472-L504 HydrophobicContact CE1-CG 4.46Å; Y472-L504 HydrophobicContact CE2-CD1 4.21Å; K486-L504 HydrophobicContact CD-CD2 3.88Å; K486-L504 HydrophobicContact CG-CD2 4.1Å; L504-P516 HydrophobicContact CD2-CG 4.33Å; L504-P516 HydrophobicContact CG-CG 4.33Å; L504-P516 VanDerWaalsContact O-CD 3.26Å; L504-P516 WeakPolarHBondContact O-CD 3.36Å
505	L	93.3	Very high	90.3	Very high	3 Å²	3	73.7 Å²	73.7	2%	0.016	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	149.4	171.9	-55.7	171.8	0	0	0	109.6	F470 T471 R473 M513 L514 R515	F470-L505 WeakPolarHBondContact CA-O 3.49Å; T471-L505 PolarHBondContact N-O 2.71Å; T471-L505 WeakPolarHBondContact O-CB 3.3Å; T471-L505 PolarHBondContact O-N 2.7Å; R473-L505 HydrophobicContact CB-CD1 3.87Å; L505-M513 HydrophobicContact CB-CB 4.33Å; L505-M513 HydrophobicContact CD1-CB 4.11Å; L505-M513 HydrophobicContact CD1-CE 3.91Å; L505-L514 CarbonylContact C-O 3.59Å; L505-L514 WeakPolarHBondContact CA-O 3.49Å; L505-R515 HydrophobicContact CD2-CG 3.81Å
506	I	91.7	Very high	89.9	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.7	171.4	-48.8	-173.3	0	0	0	107.6	R469 F470 L514 P516 A519 L526 H529	R469-I506 HydrophobicContact CG-CG2 4.34Å; R469-I506 WeakPolarHBondContact O-CA 3.25Å; R469-I506 WeakPolarHBondContact O-CG2 3.32Å; F470-I506 HydrophobicContact CD1-CG1 4.11Å; F470-I506 HydrophobicContact CE1-CD1 4.29Å; F470-I506 HydrophobicContact CE1-CG1 4.16Å; F470-I506 HydrophobicContact CE1-CG2 4.48Å; I506-L514 PolarHBondContact N-O 2.94Å; I506-L514 PolarHBondContact O-N 2.87Å; I506-P516 HydrophobicContact CD1-CB 3.91Å; I506-P516 HydrophobicContact CD1-CG 4.11Å; I506-P516 HydrophobicContact CG1-CB 4.37Å; I506-P516 HydrophobicContact CG1-CG 4.06Å; I506-A519 HydrophobicContact CB-CB 4.05Å; I506-A519 HydrophobicContact CD1-CB 4.11Å; I506-A519 HydrophobicContact CG1-CB 4.38Å; I506-L526 HydrophobicContact CG2-CD1 4.07Å; I506-L526 HydrophobicContact CG2-CD2 4.32Å; I506-H529 HydrophobicContact CD1-CB 3.56Å
507	N	89.4	Confident	89.6	Confident	37 Å²	37	74.4 Å²	74.4	20%	0.198	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	126	178.3	-59.7	-21.6	0	0	0	108.8	T468 R469 T471	T468-N507 WeakPolarHBondContact O-CB 3.46Å; T468-N507 PolarHBondContact O-ND2 3Å; R469-N507 PolarHBondContact O-N 2.83Å; T471-N507 PolarHBondContact OG1-ND2 3.15Å; T471-N507 PolarHBondContact OG1-OD1 3.2Å
508	T	84.7	Confident	89.3	Confident	23 Å²	23	70.2 Å²	70.2	14%	0.141	36%	0.357	C	S	.	.			trans	-88.8	155.3	176.6	62.9	0	0	0	0	110.8	K510 G511 R512 L514	T508-K510 PolarHBondContact O-N 2.78Å; T508-G511 PolarHBondContact O-N 2.96Å; T508-R512 WeakPolarHBondContact CB-O 3.48Å; T508-R512 PolarHBondContact N-O 3.36Å; T508-R512 PolarHBondContact OG1-N 3.41Å; T508-R512 PolarHBondContact OG1-O 2.91Å; T508-L514 HydrophobicContact CG2-CD1 3.65Å; T508-L514 HydrophobicContact CG2-CG 4.06Å
509	P	77.5	Confident	88.9	Confident	130 Å²	130	68 Å²	68	84%	0.844	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-10.2	175.7	-25.7	35.5	0	0	0	115.4
510	K	78.1	Confident	88.4	Confident	179 Å²	179	58.6 Å²	58.6	78%	0.778	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	28.8	173.4	-61.5	-167.4	175.7	-168.9	0	112.3	T508 R512	T508-K510 PolarHBondContact O-N 2.78Å; K510-R512 PolarHBondContact O-N 2.77Å
511	G	80.4	Confident	87.9	Confident	65 Å²	65	62.6 Å²	62.6	67%	0.67	32%	0.321	S	S	*	.	S	Bend	trans	68.2	-16.5	179.4	0	0	0	0	0	116.5	T508 M513	T508-G511 PolarHBondContact O-N 2.96Å; G511-M513 PolarHBondContact O-N 2.91Å
512	R	85.4	Confident	87.2	Confident	130 Å²	130	62.7 Å²	62.7	49%	0.491	32%	0.319	S	S	.	.			trans	-70.9	129.1	-177.4	-59.5	-170.5	-62.6	179.5	3.1	111.4	T508 K510 L514	T508-R512 WeakPolarHBondContact CB-O 3.48Å; T508-R512 PolarHBondContact N-O 3.36Å; T508-R512 PolarHBondContact OG1-N 3.41Å; T508-R512 PolarHBondContact OG1-O 2.91Å; K510-R512 PolarHBondContact O-N 2.77Å; R512-L514 HydrophobicContact CB-CD2 4.35Å; R512-L514 HydrophobicContact CB-CG 4.49Å
513	M	89.9	Confident	86.3	Confident	76 Å²	76	63.9 Å²	63.9	37%	0.374	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	115.3	174.4	-49.3	170.4	78.1	0	0	109.2	T471 L505 G511	T471-M513 VanDerWaalsContact CB-CE 3.48Å; T471-M513 HydrophobicContact CG2-CE 3.36Å; L505-M513 HydrophobicContact CB-CB 4.33Å; L505-M513 HydrophobicContact CD1-CB 4.11Å; L505-M513 HydrophobicContact CD1-CE 3.91Å; G511-M513 PolarHBondContact O-N 2.91Å
514	L	90.4	Very high	85.5	Confident	19 Å²	19	70.7 Å²	70.7	10%	0.099	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	143.6	-174.1	-58.8	-178.6	0	0	0	111.4	L505 I506 T508 R512 L518 A519 Y522	L505-L514 CarbonylContact C-O 3.59Å; L505-L514 WeakPolarHBondContact CA-O 3.49Å; I506-L514 PolarHBondContact N-O 2.94Å; I506-L514 PolarHBondContact O-N 2.87Å; T508-L514 HydrophobicContact CG2-CD1 3.65Å; T508-L514 HydrophobicContact CG2-CG 4.06Å; R512-L514 HydrophobicContact CB-CD2 4.35Å; R512-L514 HydrophobicContact CB-CG 4.49Å; L514-L518 HydrophobicContact CD1-CG 4.46Å; L514-L518 HydrophobicContact CD2-CD2 4.01Å; L514-L518 HydrophobicContact CD2-CG 4.43Å; L514-A519 HydrophobicContact CB-CB 3.91Å; L514-Y522 HydrophobicContact CD1-CD2 3.65Å; L514-Y522 HydrophobicContact CD1-CE2 4.07Å
515	R	90.6	Very high	84.8	Confident	149 Å²	149	77.9 Å²	77.9	56%	0.562	38%	0.38	S	S	*	.			trans	-59.8	144.2	167.8	-75.3	-178.4	173.5	162.8	-0.1	109.6	E503 L505 S517 L518 A519	E503-R515 IonicContact OE2-CZ 3.2Å; E503-R515 IonicContact OE2-NE 2.8Å; E503-R515 PolarHBondContact OE2-NE 3.28Å; E503-R515 IonicContact OE2-NH2 2.71Å; E503-R515 PolarHBondContact OE2-NH2 3.01Å; L505-R515 HydrophobicContact CD2-CG 3.81Å; R515-S517 VanDerWaalsContact C-N 3.28Å; R515-S517 PolarHBondContact O-N 3.5Å; R515-S517 VanDerWaalsContact O-N 3.1Å; R515-L518 PolarHBondContact O-N 3.22Å; R515-A519 PolarHBondContact O-N 2.89Å
516	P	86.6	Confident	83.8	Confident	23 Å²	23	78.4 Å²	78.4	15%	0.149	38%	0.383	C	S	.	.	H	α-helix	trans	-49.5	-40.9	-173.2	-31.6	33.8	0	0	0	115.9	L504 I506 A519 A520 H529 C530	L504-P516 HydrophobicContact CD2-CG 4.33Å; L504-P516 HydrophobicContact CG-CG 4.33Å; L504-P516 VanDerWaalsContact O-CD 3.26Å; L504-P516 WeakPolarHBondContact O-CD 3.36Å; I506-P516 HydrophobicContact CD1-CB 3.91Å; I506-P516 HydrophobicContact CD1-CG 4.11Å; I506-P516 HydrophobicContact CG1-CB 4.37Å; I506-P516 HydrophobicContact CG1-CG 4.06Å; P516-A519 PolarHBondContact O-N 3.13Å; P516-A520 WeakPolarHBondContact O-CB 3.32Å; P516-A520 PolarHBondContact O-N 3.26Å; P516-H529 WeakPolarHBondContact CB-O 3.5Å; P516-C530 PolarHBondContact O-SG 3.25Å; P516-C530 VanDerWaalsContact O-SG 3.35Å
517	S	85.9	Confident	82.8	Confident	71 Å²	71	82 Å²	82	50%	0.497	40%	0.401	S	S	.	.	H	α-helix	trans	-58.6	-48.5	176.5	46.3	0	0	0	0	113	R515 Q521	R515-S517 VanDerWaalsContact C-N 3.28Å; R515-S517 PolarHBondContact O-N 3.5Å; R515-S517 VanDerWaalsContact O-N 3.1Å; S517-Q521 WeakPolarHBondContact O-CG 3.43Å; S517-Q521 PolarHBondContact O-N 3.43Å
518	L	86.8	Confident	82.2	Confident	66 Å²	66	85.3 Å²	85.3	35%	0.346	43%	0.425	S	S	.	.	H	α-helix	trans	-71.4	-37.4	177.5	-177.6	58.4	0	0	0	111.5	L514 R515 A520 Q521 Y522	L514-L518 HydrophobicContact CD1-CG 4.46Å; L514-L518 HydrophobicContact CD2-CD2 4.01Å; L514-L518 HydrophobicContact CD2-CG 4.43Å; R515-L518 PolarHBondContact O-N 3.22Å; L518-A520 VanDerWaalsContact C-N 3.31Å; L518-A520 PolarHBondContact O-N 2.97Å; L518-Q521 VanDerWaalsContact CD1-OE1 3.29Å; L518-Q521 WeakPolarHBondContact O-CB 3.18Å; L518-Q521 PolarHBondContact O-N 3.07Å; L518-Y522 HydrophobicContact CD1-CD2 4.37Å; L518-Y522 HydrophobicContact CD1-CE2 3.72Å; L518-Y522 HydrophobicContact CG-CD2 4.47Å; L518-Y522 HydrophobicContact CG-CE2 4.04Å; L518-Y522 VanDerWaalsContact O-CD2 3.32Å; L518-Y522 WeakPolarHBondContact O-CD2 3.45Å; L518-Y522 PolarHBondContact O-N 3.4Å
519	A	86.6	Confident	81.5	Confident	0 Å²	0	85.8 Å²	85.8	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-60.1	-41.5	175.9	0	0	0	0	0	111.9	I506 L514 R515 P516 Q521 Y522 D523 L526	I506-A519 HydrophobicContact CB-CB 4.05Å; I506-A519 HydrophobicContact CD1-CB 4.11Å; I506-A519 HydrophobicContact CG1-CB 4.38Å; L514-A519 HydrophobicContact CB-CB 3.91Å; R515-A519 PolarHBondContact O-N 2.89Å; P516-A519 PolarHBondContact O-N 3.13Å; A519-Q521 VanDerWaalsContact C-N 3.31Å; A519-Q521 PolarHBondContact O-N 3.11Å; A519-Y522 PolarHBondContact O-N 2.89Å; A519-D523 PolarHBondContact O-N 3.42Å; A519-L526 HydrophobicContact CB-CD1 3.78Å
520	A	84.6	Confident	81	Confident	5 Å²	5	80.9 Å²	80.9	4%	0.041	39%	0.394	C	S	.	.	H	α-helix	trans	-73	-16.7	178.8	0	0	0	0	0	114.8	P516 L518 L526 L527 C530	P516-A520 WeakPolarHBondContact O-CB 3.32Å; P516-A520 PolarHBondContact O-N 3.26Å; L518-A520 VanDerWaalsContact C-N 3.31Å; L518-A520 PolarHBondContact O-N 2.97Å; A520-L526 HydrophobicContact CB-CB 4.41Å; A520-L527 HydrophobicContact CB-CD2 3.89Å; A520-L527 HydrophobicContact CB-CG 4.12Å; A520-C530 WeakPolarHBondContact CB-SG 3.49Å
521	Q	85.4	Confident	80.2	Confident	121 Å²	121	77.9 Å²	77.9	57%	0.565	40%	0.396	S	S	*	.	H	α-helix	trans	-72	-37.3	169.1	-68.8	169.4	-4.6	0	0	111.2	S517 L518 A519	S517-Q521 WeakPolarHBondContact O-CG 3.43Å; S517-Q521 PolarHBondContact O-N 3.43Å; L518-Q521 VanDerWaalsContact CD1-OE1 3.29Å; L518-Q521 WeakPolarHBondContact O-CB 3.18Å; L518-Q521 PolarHBondContact O-N 3.07Å; A519-Q521 VanDerWaalsContact C-N 3.31Å; A519-Q521 PolarHBondContact O-N 3.11Å
522	Y	80.1	Confident	78.9	Confident	149 Å²	149	78.7 Å²	78.7	58%	0.584	39%	0.391	S	S	*	.	H	α-helix	trans	-84	-32.3	178.9	-69.2	-68.2	0	0	0	114.3	L514 L518 A519	L514-Y522 HydrophobicContact CD1-CD2 3.65Å; L514-Y522 HydrophobicContact CD1-CE2 4.07Å; L518-Y522 HydrophobicContact CD1-CD2 4.37Å; L518-Y522 HydrophobicContact CD1-CE2 3.72Å; L518-Y522 HydrophobicContact CG-CD2 4.47Å; L518-Y522 HydrophobicContact CG-CE2 4.04Å; L518-Y522 VanDerWaalsContact O-CD2 3.32Å; L518-Y522 WeakPolarHBondContact O-CD2 3.45Å; L518-Y522 PolarHBondContact O-N 3.4Å; A519-Y522 PolarHBondContact O-N 2.89Å
523	D	76.7	Confident	76.8	Confident	36 Å²	36	80.8 Å²	80.8	19%	0.193	41%	0.412	C	S	.	.			trans	-137	111.9	176.7	-176.2	-9.7	0	0	0	111	A519 R525 L526	A519-D523 PolarHBondContact O-N 3.42Å; D523-R525 PolarHBondContact O-N 3.16Å; D523-R525 VanDerWaalsContact O-N 3.11Å; D523-R525 WeakPolarHBondContact OD1-CB 3.37Å; D523-R525 VanDerWaalsContact OD1-CG 3.31Å; D523-R525 WeakPolarHBondContact OD1-CG 3.11Å; D523-R525 IonicContact OD1-CZ 3.36Å; D523-R525 PolarHBondContact OD1-N 3.29Å; D523-R525 IonicContact OD1-NE 2.6Å; D523-R525 PolarHBondContact OD1-NE 3.41Å; D523-R525 IonicContact OD1-NH2 2.63Å; D523-R525 IonicContact OD2-CZ 2.68Å; D523-R525 VanDerWaalsContact OD2-CZ 3.29Å; D523-R525 IonicContact OD2-NE 2.68Å; D523-R525 PolarHBondContact OD2-NE 3.3Å; D523-R525 IonicContact OD2-NH2 3.68Å; D523-R525 PolarHBondContact OD2-NH2 2.87Å; D523-L526 HydrophobicContact CB-CD1 4.02Å; D523-L526 HydrophobicContact CB-CG 3.98Å; D523-L526 VanDerWaalsContact O-CB 3.3Å; D523-L526 WeakPolarHBondContact O-CB 3.26Å; D523-L526 PolarHBondContact O-N 2.92Å
524	K	76.7	Confident	74.5	Confident	174 Å²	174	86.2 Å²	86.2	76%	0.757	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-59	-24.1	179.8	-66.1	-179.4	-178.4	175.6	0	113	L526 L527	K524-L526 PolarHBondContact O-N 3.25Å; K524-L526 VanDerWaalsContact O-N 3.13Å; K524-L527 HydrophobicContact CB-CD1 3.95Å; K524-L527 HydrophobicContact CG-CD1 4.22Å; K524-L527 VanDerWaalsContact O-CB 3.32Å; K524-L527 WeakPolarHBondContact O-CB 3.22Å; K524-L527 WeakPolarHBondContact O-CD1 3.47Å; K524-L527 WeakPolarHBondContact O-CG 3.36Å; K524-L527 PolarHBondContact O-N 3.27Å; K524-L527 VanDerWaalsContact O-N 3.07Å
525	R	79.2	Confident	72.1	Confident	180 Å²	180	89.1 Å²	89.1	68%	0.679	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-68.6	-6.3	174.1	-54.5	172.6	-63.3	179.5	4.5	112.8	R469 D523	R469-R525 PolarHBondContact NH2-O 2.87Å; D523-R525 PolarHBondContact O-N 3.16Å; D523-R525 VanDerWaalsContact O-N 3.11Å; D523-R525 WeakPolarHBondContact OD1-CB 3.37Å; D523-R525 VanDerWaalsContact OD1-CG 3.31Å; D523-R525 WeakPolarHBondContact OD1-CG 3.11Å; D523-R525 IonicContact OD1-CZ 3.36Å; D523-R525 PolarHBondContact OD1-N 3.29Å; D523-R525 IonicContact OD1-NE 2.6Å; D523-R525 PolarHBondContact OD1-NE 3.41Å; D523-R525 IonicContact OD1-NH2 2.63Å; D523-R525 IonicContact OD2-CZ 2.68Å; D523-R525 VanDerWaalsContact OD2-CZ 3.29Å; D523-R525 IonicContact OD2-NE 2.68Å; D523-R525 PolarHBondContact OD2-NE 3.3Å; D523-R525 IonicContact OD2-NH2 3.68Å; D523-R525 PolarHBondContact OD2-NH2 2.87Å
526	L	73.8	Confident	69.5	Low	13 Å²	13	87.4 Å²	87.4	7%	0.068	46%	0.458	C	S	.	.	G	3₁₀ helix	trans	-100.8	-5.7	173.9	-49.8	-177.2	0	0	0	113.1	R469 I506 A519 A520 D523 K524 P528 H529	R469-L526 VanDerWaalsContact NH2-CD2 3.27Å; I506-L526 HydrophobicContact CG2-CD1 4.07Å; I506-L526 HydrophobicContact CG2-CD2 4.32Å; A519-L526 HydrophobicContact CB-CD1 3.78Å; A520-L526 HydrophobicContact CB-CB 4.41Å; D523-L526 HydrophobicContact CB-CD1 4.02Å; D523-L526 HydrophobicContact CB-CG 3.98Å; D523-L526 VanDerWaalsContact O-CB 3.3Å; D523-L526 WeakPolarHBondContact O-CB 3.26Å; D523-L526 PolarHBondContact O-N 2.92Å; K524-L526 PolarHBondContact O-N 3.25Å; K524-L526 VanDerWaalsContact O-N 3.13Å; L526-P528 VanDerWaalsContact C-CD 3.46Å; L526-P528 VanDerWaalsContact C-N 3.34Å; L526-H529 WeakPolarHBondContact O-CB 3.45Å; L526-H529 PolarHBondContact O-N 3.34Å
527	L	70.7	Confident	67.1	Low	75 Å²	75	95.2 Å²	95.2	39%	0.393	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-52.6	-41.2	174	-75.1	163.2	0	0	0	113.6	A520 K524 H529 C530 V535	A520-L527 HydrophobicContact CB-CD2 3.89Å; A520-L527 HydrophobicContact CB-CG 4.12Å; K524-L527 HydrophobicContact CB-CD1 3.95Å; K524-L527 HydrophobicContact CG-CD1 4.22Å; K524-L527 VanDerWaalsContact O-CB 3.32Å; K524-L527 WeakPolarHBondContact O-CB 3.22Å; K524-L527 WeakPolarHBondContact O-CD1 3.47Å; K524-L527 WeakPolarHBondContact O-CG 3.36Å; K524-L527 PolarHBondContact O-N 3.27Å; K524-L527 VanDerWaalsContact O-N 3.07Å; L527-H529 PolarHBondContact O-N 3.49Å; L527-C530 WeakPolarHBondContact O-CB 3.41Å; L527-C530 PolarHBondContact O-N 3.35Å; L527-V535 HydrophobicContact CD2-CG2 4.18Å
528	P	76.2	Confident	64.9	Low	108 Å²	108	100 Å²	100	70%	0.701	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-62.8	-4.5	174.8	-23.5	35.5	0	0	0	115	L526	L526-P528 VanDerWaalsContact C-CD 3.46Å; L526-P528 VanDerWaalsContact C-N 3.34Å
529	H	69.7	Low	62.3	Low	33 Å²	33	105.7 Å²	105.7	15%	0.153	53%	0.531	C	S	.	.	G	3₁₀ helix	trans	-100.9	-3.7	175.8	-61.8	-49.4	0	0	0	114	R469 F470 K486 I506 P516 L526 L527	R469-H529 VanDerWaalsContact CZ-NE2 3.3Å; R469-H529 PolarHBondContact NH2-NE2 2.94Å; R469-H529 VanDerWaalsContact NH2-NE2 3.19Å; F470-H529 AromaticContact CZ-CE1 3.78Å; F470-H529 AromaticContact CZ-ND1 3.91Å; F470-H529 AromaticContact CZ-NE2 3.92Å; K486-H529 WeakPolarHBondContact CE-ND1 3.39Å; K486-H529 PolarHBondContact NZ-O 2.93Å; I506-H529 HydrophobicContact CD1-CB 3.56Å; P516-H529 WeakPolarHBondContact CB-O 3.5Å; L526-H529 WeakPolarHBondContact O-CB 3.45Å; L526-H529 PolarHBondContact O-N 3.34Å; L527-H529 PolarHBondContact O-N 3.49Å
530	C	66.7	Low	59.8	Low	26 Å²	26	111.1 Å²	111.1	18%	0.176	57%	0.569	C	S	.	*			trans	-79.5	119.1	171.4	-70.1	0	0	0	0	111.2	P516 A520 L527 S532	P516-C530 PolarHBondContact O-SG 3.25Å; P516-C530 VanDerWaalsContact O-SG 3.35Å; A520-C530 WeakPolarHBondContact CB-SG 3.49Å; L527-C530 WeakPolarHBondContact O-CB 3.41Å; L527-C530 PolarHBondContact O-N 3.35Å; C530-S532 PolarHBondContact O-N 2.94Å
531	S	62.7	Low	57.1	Low	116 Å²	116	119.6 Å²	119.6	81%	0.811	61%	0.608	S	S	*	*	S	Bend	trans	-78.8	27	174	-57.4	0	0	0	0	113.3
532	S	53.1	Low	54.8	Low	83 Å²	83	119.7 Å²	119.7	58%	0.58	62%	0.619	S	S	*	*	S	Bend	trans	-161.2	122.1	-174.2	-65	0	0	0	0	112.1	C530 K534	C530-S532 PolarHBondContact O-N 2.94Å; S532-K534 PolarHBondContact O-N 2.87Å
533	N	40.7	Very low	52.6	Low	173 Å²	173	119.7 Å²	119.7	93%	0.925	62%	0.624	S	S	*	*	S	Bend	trans	-77.6	39.3	177.1	-69	-10.7	0	0	0	113.2
534	K	40.7	Very low	50.4	Low	191 Å²	191	127.7 Å²	127.7	83%	0.83	66%	0.657	S	S	*	*			trans	-122.2	74.7	178.3	-71.6	-170.6	175.8	-175.6	0	110.3	S532	S532-K534 PolarHBondContact O-N 2.87Å
535	V	40.2	Very low	48.4	Very low	79 Å²	79	128.6 Å²	128.6	48%	0.479	66%	0.657	S	S	.	*			trans	-99	89.2	167.2	-178.1	0	0	0	0	107.9	L527 K537	L527-V535 HydrophobicContact CD2-CG2 4.18Å; V535-K537 PolarHBondContact O-N 2.63Å
536	T	37.5	Very low	46	Very low	114 Å²	114	131.7 Å²	131.7	70%	0.699	67%	0.669	S	S	*	*			trans	-63.4	120.8	171	-34.3	0	0	0	0	108.5	M538	T536-M538 PolarHBondContact O-N 2.73Å
537	K	35.8	Very low	44	Very low	187 Å²	187	138.9 Å²	138.9	81%	0.813	71%	0.707	S	S	*	*			trans	-66.2	120.5	168.4	-74.1	-178.8	178.8	177.2	0	108.1	V535	V535-K537 PolarHBondContact O-N 2.63Å
538	M	38.2	Very low	42	Very low	171 Å²	171	140.8 Å²	140.8	84%	0.842	73%	0.726	S	S	*	*			trans	-105.5	133.9	157.3	-58.5	-153.9	83.4	0	0	107.9	T536	T536-M538 PolarHBondContact O-N 2.73Å
539	H	32.4	Very low	39.8	Very low	185 Å²	185	147 Å²	147	86%	0.856	74%	0.736	S	S	*	*			trans	-74.3	140.1	172.4	-78.1	-124.5	0	0	0	108.9
540	S	35.1	Very low	38.2	Very low	115 Å²	115	151.7 Å²	151.7	80%	0.804	77%	0.766	S	S	*	*			trans	-148	138	169.5	45.6	0	0	0	0	108.4
541	E	28.3	Very low	36.4	Very low	183 Å²	183	155 Å²	155	86%	0.855	79%	0.788	S	S	*	*			trans	-74.5	154.5	-178.2	-70.3	178.8	94	0	0	112.1	E543	E541-E543 PolarHBondContact O-N 2.8Å
542	P	35.8	Very low	35.1	Very low	122 Å²	122	156.6 Å²	156.6	79%	0.792	79%	0.787	S	S	*	*			trans	-83.3	96.2	177.7	32.9	-33.3	0	0	0	111.7	K544	P542-K544 PolarHBondContact O-N 3.01Å
543	E	35.1	Very low	34.1	Very low	150 Å²	150	160 Å²	160	70%	0.701	79%	0.794	S	S	*	*			trans	-58.3	123.9	166.1	-76.5	-166.8	128.5	0	0	111.2	E541 Y545	E541-E543 PolarHBondContact O-N 2.8Å; E543-Y545 HydrophobicContact CB-CD2 4.14Å; E543-Y545 HydrophobicContact CB-CE2 3.8Å; E543-Y545 PolarHBondContact O-N 3.42Å
544	K	30.5	Very low	33.6	Very low	204 Å²	204	159.6 Å²	159.6	89%	0.887	79%	0.792	S	S	*	*			trans	-80.8	83	-176	-73.7	178.3	176.8	170.1	0	112.4	P542 R546	P542-K544 PolarHBondContact O-N 3.01Å; K544-R546 PolarHBondContact O-N 3.1Å
545	Y	34.5	Very low	33.4	Very low	192 Å²	192	159.4 Å²	159.4	75%	0.753	79%	0.787	S	S	*	*			trans	-81.2	96.2	165.8	-71.9	-78.7	0	0	0	111.5	E543 L547	E543-Y545 HydrophobicContact CB-CD2 4.14Å; E543-Y545 HydrophobicContact CB-CE2 3.8Å; E543-Y545 PolarHBondContact O-N 3.42Å; Y545-L547 PolarHBondContact O-N 3.35Å; Y545-L547 VanDerWaalsContact O-N 3.15Å
546	R	27.6	Very low	33.1	Very low	246 Å²	246	162.7 Å²	162.7	93%	0.928	80%	0.802	S	S	*	*			trans	-79.2	86.3	-178.7	-172.2	-174.6	-166	170.3	3.7	111.2	K544	K544-R546 PolarHBondContact O-N 3.1Å
547	L	32	Very low	33.1	Very low	164 Å²	164	164.2 Å²	164.2	86%	0.859	81%	0.811	S	S	*	*			trans	-86.2	116.5	170.3	-139.6	76.6	0	0	0	110.4	Y545	Y545-L547 PolarHBondContact O-N 3.35Å; Y545-L547 VanDerWaalsContact O-N 3.15Å
548	S	28.9	Very low	33.1	Very low	115 Å²	115	163.2 Å²	163.2	80%	0.804	81%	0.809	S	S	*	*			trans	-65.9	139.6	173.2	38.8	0	0	0	0	111
549	R	31.2	Very low	33	Very low	239 Å²	239	162.4 Å²	162.4	90%	0.902	81%	0.808	S	S	*	*			trans	-111.8	132.7	163.4	-60.9	-175.2	-168.8	173.6	3.9	108.3
550	T	34.9	Very low	33.1	Very low	130 Å²	130	156.2 Å²	156.2	80%	0.798	80%	0.795	S	S	*	*			trans	-78.3	153	150.2	49	0	0	0	0	108.8
551	P	30.4	Very low	33.2	Very low	97 Å²	97	157.8 Å²	157.8	63%	0.63	79%	0.793	S	S	*	*			trans	-76.3	-169.3	162.3	35.7	-34.1	0	0	0	110.6
552	D	33.6	Very low	33.6	Very low	149 Å²	149	153.8 Å²	153.8	80%	0.797	79%	0.785	S	S	*	*			trans	73.1	139.9	169.9	-44.6	-36.3	0	0	0	115.2
553	E	33.4	Very low	33.8	Very low	155 Å²	155	154.5 Å²	154.5	72%	0.724	78%	0.783	S	S	*	*			cis	-126.1	155.8	4.4	-66.5	180	132.3	0	0	112.3	Y555	E553-Y555 HydrophobicContact CB-CD2 4.31Å; E553-Y555 HydrophobicContact CB-CE2 4.29Å
554	N	30.3	Very low	34.1	Very low	163 Å²	163	153.2 Å²	153.2	87%	0.872	78%	0.779	S	S	*	*			trans	-87.6	123.2	168.4	-86.1	-33.3	0	0	0	110.5
555	Y	35.9	Very low	34.5	Very low	188 Å²	188	151.5 Å²	151.5	74%	0.737	77%	0.772	S	S	*	*			trans	-121.4	122.4	166.4	-91.1	-88.5	0	0	0	111.5	E553	E553-Y555 HydrophobicContact CB-CD2 4.31Å; E553-Y555 HydrophobicContact CB-CE2 4.29Å
556	N	34.3	Very low	34.7	Very low	147 Å²	147	144.8 Å²	144.8	79%	0.786	76%	0.761	S	S	*	*			trans	-75	123.2	-174.9	-72.1	-25.3	0	0	0	112.1	E558	N556-E558 VanDerWaalsContact C-N 3.33Å; N556-E558 PolarHBondContact O-N 3.04Å
557	V	36.8	Very low	35.2	Very low	146 Å²	146	140.7 Å²	140.7	89%	0.885	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	50.9	-174.8	-163.6	0	0	0	0	111.7
558	E	35.2	Very low	35.4	Very low	166 Å²	166	139.8 Å²	139.8	78%	0.776	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.4	-20.6	-177.4	-67.2	-166.8	131	0	0	115.1	N556 G560	N556-E558 VanDerWaalsContact C-N 3.33Å; N556-E558 PolarHBondContact O-N 3.04Å; E558-G560 PolarHBondContact O-N 3.06Å
559	N	37.4	Very low	35.7	Very low	154 Å²	154	145.9 Å²	145.9	82%	0.824	76%	0.759	S	S	*	*	S	Bend	trans	-92.9	10.6	-175.3	-71.4	-16.4	0	0	0	115.2
560	G	35	Very low	35.7	Very low	56 Å²	56	140.5 Å²	140.5	58%	0.577	75%	0.747	S	S	*	*	S	Bend	trans	-96.4	-17.2	-170	0	0	0	0	0	117.2	E558	E558-G560 PolarHBondContact O-N 3.06Å
561	L	36.3	Very low	35.4	Very low	147 Å²	147	146.1 Å²	146.1	77%	0.77	76%	0.764	S	S	*	*	S	Bend	trans	-97.8	-16.9	-166	-67.5	173.3	0	0	0	114.9	N563	L561-N563 VanDerWaalsContact C-N 3.33Å; L561-N563 PolarHBondContact O-N 2.92Å
562	S	37.5	Very low	35.6	Very low	99 Å²	99	148.6 Å²	148.6	69%	0.692	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-18	-173	-50.4	0	0	0	0	114.7
563	N	39.5	Very low	35.7	Very low	138 Å²	138	148.5 Å²	148.5	74%	0.738	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	15.7	-167.5	-65.7	2.8	0	0	0	114.2	L561	L561-N563 VanDerWaalsContact C-N 3.33Å; L561-N563 PolarHBondContact O-N 2.92Å
564	I	41.9	Very low	35.8	Very low	122 Å²	122	148.2 Å²	148.2	63%	0.626	77%	0.772	S	S	*	*	S	Bend	trans	-108.3	-13.9	-176.8	-65.5	175.6	0	0	0	112.6
565	F	37.3	Very low	36.2	Very low	169 Å²	169	147.3 Å²	147.3	74%	0.741	77%	0.766	S	S	*	*	S	Bend	trans	-122.7	17.5	-176.1	-67.9	-79.7	0	0	0	114.3
566	G	39.1	Very low	36.2	Very low	51 Å²	51	144.8 Å²	144.8	53%	0.526	77%	0.768	S	S	.	*	S	Bend	trans	-81	-40.5	180	0	0	0	0	0	114.7	L568	G566-L568 VanDerWaalsContact C-N 3.33Å; G566-L568 PolarHBondContact O-N 3.28Å
567	D	39	Very low	36.3	Very low	160 Å²	160	144.6 Å²	144.6	86%	0.856	77%	0.767	S	S	*	*			trans	-95	30.2	-158	-54.4	-33	0	0	0	114.4
568	L	34.8	Very low	36.3	Very low	145 Å²	145	144.5 Å²	144.5	76%	0.759	76%	0.758	S	S	*	*			trans	-106.3	25.6	174.5	-94.4	165.4	0	0	0	113.2	G566 L570	G566-L568 VanDerWaalsContact C-N 3.33Å; G566-L568 PolarHBondContact O-N 3.28Å; L568-L570 PolarHBondContact O-N 3.29Å
569	R	35.1	Very low	36.4	Very low	243 Å²	243	142.8 Å²	142.8	92%	0.917	76%	0.757	S	S	*	*			trans	-81	98.3	159.8	-92.4	-175.1	170.1	162.4	-1	109.5
570	L	32.5	Very low	36.3	Very low	126 Å²	126	141.9 Å²	141.9	66%	0.66	75%	0.751	S	S	*	*			trans	-79.9	146.8	164.5	-67.3	160.9	0	0	0	110.1	M1 L568	M1-L570 HydrophobicContact CE-CB 3.8Å; M1-L570 HydrophobicContact CE-CD1 3.78Å; M1-L570 HydrophobicContact CE-CG 4.33Å; M1-L570 HydrophobicContact SD-CD1 4.25Å; L568-L570 PolarHBondContact O-N 3.29Å
571	E	27.3	Very low	36.4	Very low	247 Å²	247	149.7 Å²	149.7	100%	1.154	77%	0.767	S	S	*	*			trans	-76.3	0	158.5	-60.3	-179	132.2	0	0	110.9

Retrieved 571 of 571 residues in 559.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).