A0A087X1X7_HUMAN Loading...

Elongation factor 1-delta

AlphaFold DB , UniProt , Accession A0A087X1X7, Species HUMAN (Homo sapiens, Human), Gene EEF1D, Length 631 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	39.3	Very low	38.1	Very low	219 Å²	219	144.5 Å²	144.5	100%	1.079	82%	0.82	S	S	*	*				0	141.5	0	-83.2	173.5	72.2	0	0	109.1
2	R	35.5	Very low	38.5	Very low	231 Å²	231	139.8 Å²	139.8	87%	0.872	80%	0.797	S	S	*	*			trans	68.6	148.1	167.3	-61.3	179.3	-175.7	-134.2	1.1	116
3	S	41.1	Very low	38.8	Very low	122 Å²	122	137.3 Å²	137.3	85%	0.853	79%	0.786	S	S	*	*			cis	172.2	153.2	-16.1	174.3	0	0	0	0	104.3
4	G	33.1	Very low	39	Very low	73 Å²	73	141.2 Å²	141.2	75%	0.753	78%	0.782	S	S	*	*			trans	152.8	90.3	156.9	0	0	0	0	0	114.8
5	K	41.8	Very low	39.2	Very low	208 Å²	208	141.3 Å²	141.3	90%	0.904	77%	0.774	S	S	*	*			trans	-74.9	136.4	169.1	-68.8	168	175.3	177	0	109.3
6	A	33.3	Very low	39.7	Very low	112 Å²	112	137.8 Å²	137.8	93%	0.926	75%	0.754	S	S	*	*			trans	-92.2	117	171.1	0	0	0	0	0	110.1
7	S	39.3	Very low	40.7	Very low	111 Å²	111	136.4 Å²	136.4	78%	0.776	74%	0.739	S	S	*	*			trans	-131.8	111.6	166.8	50.4	0	0	0	0	107.1
8	C	36.9	Very low	41.3	Very low	98 Å²	98	135.7 Å²	135.7	66%	0.662	73%	0.73	S	S	*	*			trans	162.2	94.8	149.7	-173	0	0	0	0	109.9
9	T	40.1	Very low	42	Very low	123 Å²	123	135.2 Å²	135.2	76%	0.755	72%	0.72	S	S	*	*	S	Bend	trans	-144.8	3.5	159.4	51.4	0	0	0	0	112.9
10	L	39	Very low	42.4	Very low	141 Å²	141	136.9 Å²	136.9	74%	0.738	72%	0.717	S	S	*	*	S	Bend	trans	-101.3	-7	-173.1	-129.9	119.9	0	0	0	114
11	E	39.8	Very low	43.4	Very low	151 Å²	151	134.1 Å²	134.1	71%	0.706	70%	0.701	S	S	*	*	S	Bend	trans	-91.7	-21.9	-173.7	-144.4	166.8	-163.4	0	0	112.9
12	T	42.8	Very low	44.3	Very low	89 Å²	89	127.1 Å²	127.1	55%	0.546	67%	0.666	S	S	.	*	H	α-helix	trans	-80.9	-18.8	-178.3	43.3	0	0	0	0	114.7	W14	T12-W14 VanDerWaalsContact C-N 3.33Å; T12-W14 PolarHBondContact O-N 3.12Å
13	V	43	Very low	45.7	Very low	107 Å²	107	118.9 Å²	118.9	65%	0.648	65%	0.647	S	S	*	*	H	α-helix	trans	-75	-24.5	-178.1	-179	0	0	0	0	112.1
14	W	41.6	Very low	46.7	Very low	192 Å²	192	117.5 Å²	117.5	73%	0.727	63%	0.627	S	S	*	*	H	α-helix	trans	-85.7	-24.9	-176.7	-75.1	94.1	0	0	0	114	T12 D16	T12-W14 VanDerWaalsContact C-N 3.33Å; T12-W14 PolarHBondContact O-N 3.12Å; W14-D16 VanDerWaalsContact C-N 3.28Å; W14-D16 PolarHBondContact O-N 2.99Å
15	E	41	Very low	48.6	Very low	143 Å²	143	122 Å²	122	67%	0.668	62%	0.621	S	S	*	*	H	α-helix	trans	-72	-21.3	177.1	-66.7	-171	151.2	0	0	113.1
16	D	48.1	Very low	49.6	Very low	85 Å²	85	119.4 Å²	119.4	46%	0.455	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.6	-7.5	-177.7	-82.5	-13.7	0	0	0	114.2	W14 H18 K19 Y20	W14-D16 VanDerWaalsContact C-N 3.28Å; W14-D16 PolarHBondContact O-N 2.99Å; D16-H18 PolarHBondContact O-N 3.02Å; D16-K19 PolarHBondContact O-N 3.43Å; D16-K19 WeakPolarHBondContact OD1-CD 3.14Å; D16-K19 IonicContact OD1-NZ 3.72Å; D16-K19 PolarHBondContact OD1-NZ 3.48Å; D16-Y20 PolarHBondContact O-N 2.81Å
17	K	55.7	Low	51.2	Low	113 Å²	113	120 Å²	120	49%	0.491	59%	0.588	S	S	.	*	H	α-helix	trans	-62.6	-41.4	176.1	-169.8	176.7	-176.5	-88.3	0	112.2	K19 Y20 E21	K17-K19 VanDerWaalsContact C-N 3.33Å; K17-K19 PolarHBondContact O-N 2.67Å; K17-Y20 WeakPolarHBondContact O-CB 3.26Å; K17-Y20 PolarHBondContact O-N 3.41Å; K17-E21 IonicContact NZ-OE1 2.74Å; K17-E21 PolarHBondContact NZ-OE1 3.29Å; K17-E21 WeakPolarHBondContact O-CG 3.35Å; K17-E21 PolarHBondContact O-N 3.11Å
18	H	51.6	Low	52.6	Low	125 Å²	125	121.2 Å²	121.2	58%	0.579	58%	0.576	S	S	*	*	H	α-helix	trans	-65.3	-37.8	177.3	-178.7	-83.5	0	0	0	111.7	D16 Y20 E22	D16-H18 PolarHBondContact O-N 3.02Å; H18-Y20 VanDerWaalsContact C-N 3.31Å; H18-E22 IonicContact CE1-OE2 3.34Å; H18-E22 IonicContact ND1-OE2 3.87Å; H18-E22 VanDerWaalsContact O-CB 3.28Å; H18-E22 WeakPolarHBondContact O-CB 3.41Å; H18-E22 PolarHBondContact O-N 2.89Å
19	K	55.2	Low	54.3	Low	126 Å²	126	122.2 Å²	122.2	55%	0.548	57%	0.571	S	S	.	*	H	α-helix	trans	-69	-33.6	176.6	-60.9	-178.4	-162.3	146.6	0	111.4	D16 K17 A23	D16-K19 PolarHBondContact O-N 3.43Å; D16-K19 WeakPolarHBondContact OD1-CD 3.14Å; D16-K19 IonicContact OD1-NZ 3.72Å; D16-K19 PolarHBondContact OD1-NZ 3.48Å; K17-K19 VanDerWaalsContact C-N 3.33Å; K17-K19 PolarHBondContact O-N 2.67Å; K19-A23 VanDerWaalsContact O-CB 3.29Å; K19-A23 WeakPolarHBondContact O-CB 3.47Å; K19-A23 PolarHBondContact O-N 3.2Å
20	Y	50.2	Low	55.7	Low	168 Å²	168	121.6 Å²	121.6	66%	0.659	56%	0.559	S	S	*	*	H	α-helix	trans	-67	-48.6	174.6	-163.1	-89.9	0	0	0	111.8	D16 K17 H18 E22 A23 E24	D16-Y20 PolarHBondContact O-N 2.81Å; K17-Y20 WeakPolarHBondContact O-CB 3.26Å; K17-Y20 PolarHBondContact O-N 3.41Å; H18-Y20 VanDerWaalsContact C-N 3.31Å; Y20-E22 VanDerWaalsContact C-N 3.3Å; Y20-E22 PolarHBondContact O-N 3.39Å; Y20-A23 PolarHBondContact O-N 3.28Å; Y20-E24 WeakPolarHBondContact O-CB 3.5Å; Y20-E24 PolarHBondContact O-N 3.17Å
21	E	62.5	Low	57.2	Low	80 Å²	80	119.7 Å²	119.7	37%	0.374	55%	0.547	S	S	.	.	H	α-helix	trans	-63.2	-35.4	176.4	-70.6	173.9	-174.4	0	0	112.2	K17 R25	K17-E21 IonicContact NZ-OE1 2.74Å; K17-E21 PolarHBondContact NZ-OE1 3.29Å; K17-E21 WeakPolarHBondContact O-CG 3.35Å; K17-E21 PolarHBondContact O-N 3.11Å; E21-R25 WeakPolarHBondContact O-CB 3.25Å; E21-R25 PolarHBondContact O-N 3.29Å
22	E	59.7	Low	58.6	Low	72 Å²	72	115.3 Å²	115.3	34%	0.336	54%	0.536	S	S	.	.	H	α-helix	trans	-72.5	-36.2	175.7	-168.3	174.6	-177.8	0	0	112.2	H18 Y20 R26	H18-E22 IonicContact CE1-OE2 3.34Å; H18-E22 IonicContact ND1-OE2 3.87Å; H18-E22 VanDerWaalsContact O-CB 3.28Å; H18-E22 WeakPolarHBondContact O-CB 3.41Å; H18-E22 PolarHBondContact O-N 2.89Å; Y20-E22 VanDerWaalsContact C-N 3.3Å; Y20-E22 PolarHBondContact O-N 3.39Å; E22-R26 WeakPolarHBondContact O-CG 3.41Å; E22-R26 PolarHBondContact O-N 2.79Å; E22-R26 VanDerWaalsContact O-N 3.13Å; E22-R26 IonicContact OE1-CZ 2.72Å; E22-R26 IonicContact OE1-NE 3.81Å; E22-R26 IonicContact OE1-NH2 3.13Å; E22-R26 PolarHBondContact OE1-NH2 2.86Å
23	A	63.4	Low	59.9	Low	58 Å²	58	115.2 Å²	115.2	48%	0.479	54%	0.536	S	S	.	.	H	α-helix	trans	-67.9	-41.5	174.1	0	0	0	0	0	111.9	K19 Y20 R26 F27	K19-A23 VanDerWaalsContact O-CB 3.29Å; K19-A23 WeakPolarHBondContact O-CB 3.47Å; K19-A23 PolarHBondContact O-N 3.2Å; Y20-A23 PolarHBondContact O-N 3.28Å; A23-R26 PolarHBondContact O-N 3.3Å; A23-F27 PolarHBondContact O-N 3.35Å
24	E	61.8	Low	61.1	Low	92 Å²	92	115.4 Å²	115.4	43%	0.43	53%	0.53	S	S	.	.	H	α-helix	trans	-64.1	-42.6	176.5	-173.8	174.9	-150.8	0	0	111.4	Y20 R26 F27 Y28	Y20-E24 WeakPolarHBondContact O-CB 3.5Å; Y20-E24 PolarHBondContact O-N 3.17Å; E24-R26 VanDerWaalsContact C-N 3.35Å; E24-R26 PolarHBondContact O-N 2.91Å; E24-F27 WeakPolarHBondContact O-CB 3.32Å; E24-F27 PolarHBondContact O-N 2.84Å; E24-Y28 HydrophobicContact CG-CD2 3.87Å; E24-Y28 HydrophobicContact CG-CE2 3.53Å; E24-Y28 WeakPolarHBondContact O-CD2 3.38Å; E24-Y28 PolarHBondContact O-N 3.46Å
25	R	73.6	Confident	62.3	Low	168 Å²	168	109.2 Å²	109.2	63%	0.634	52%	0.519	S	S	*	.	H	α-helix	trans	-59.9	-43.7	174	-171.6	-174.1	-54.7	-137.6	-1.3	112.4	E21 F27 Y28 E29	E21-R25 WeakPolarHBondContact O-CB 3.25Å; E21-R25 PolarHBondContact O-N 3.29Å; R25-F27 VanDerWaalsContact C-N 3.31Å; R25-Y28 PolarHBondContact O-N 3Å; R25-E29 PolarHBondContact O-N 2.9Å
26	R	62.3	Low	63.4	Low	154 Å²	154	104.8 Å²	104.8	58%	0.581	51%	0.507	S	S	*	.	H	α-helix	trans	-68.4	-31.8	178.3	-72.8	-179.7	-175	161.8	4.2	112.3	E22 A23 E24 H30	E22-R26 WeakPolarHBondContact O-CG 3.41Å; E22-R26 PolarHBondContact O-N 2.79Å; E22-R26 VanDerWaalsContact O-N 3.13Å; E22-R26 IonicContact OE1-CZ 2.72Å; E22-R26 IonicContact OE1-NE 3.81Å; E22-R26 IonicContact OE1-NH2 3.13Å; E22-R26 PolarHBondContact OE1-NH2 2.86Å; A23-R26 PolarHBondContact O-N 3.3Å; E24-R26 VanDerWaalsContact C-N 3.35Å; E24-R26 PolarHBondContact O-N 2.91Å; R26-H30 VanDerWaalsContact O-CB 3.31Å; R26-H30 WeakPolarHBondContact O-CB 3.48Å; R26-H30 PolarHBondContact O-N 3.5Å
27	F	68.3	Low	64.2	Low	125 Å²	125	103.2 Å²	103.2	55%	0.548	51%	0.506	S	S	.	.	H	α-helix	trans	-63.9	-49.6	172.9	178.9	-94.7	0	0	0	111.1	A23 E24 R25 E29 H30 E31	A23-F27 PolarHBondContact O-N 3.35Å; E24-F27 WeakPolarHBondContact O-CB 3.32Å; E24-F27 PolarHBondContact O-N 2.84Å; R25-F27 VanDerWaalsContact C-N 3.31Å; F27-E29 PolarHBondContact O-N 3.01Å; F27-H30 PolarHBondContact O-N 2.79Å; F27-E31 HydrophobicContact CE1-CG 4.46Å; F27-E31 PolarHBondContact O-N 3.48Å
28	Y	67.6	Low	64.3	Low	135 Å²	135	101.5 Å²	101.5	53%	0.529	51%	0.508	S	S	.	.	H	α-helix	trans	-67.6	-34.2	177.7	-72.7	-60.4	0	0	0	113.3	E24 R25 E31 A32	E24-Y28 HydrophobicContact CG-CD2 3.87Å; E24-Y28 HydrophobicContact CG-CE2 3.53Å; E24-Y28 WeakPolarHBondContact O-CD2 3.38Å; E24-Y28 PolarHBondContact O-N 3.46Å; R25-Y28 PolarHBondContact O-N 3Å; Y28-E31 PolarHBondContact O-N 3.29Å; Y28-A32 VanDerWaalsContact O-CB 3.27Å; Y28-A32 WeakPolarHBondContact O-CB 3.15Å; Y28-A32 PolarHBondContact O-N 3.16Å
29	E	72.8	Confident	64.6	Low	120 Å²	120	98.9 Å²	98.9	56%	0.561	51%	0.508	S	S	*	.	H	α-helix	trans	-65.3	-38.4	171	-84.8	-179.7	169.9	0	0	112.3	R25 F27 A32 T33	R25-E29 PolarHBondContact O-N 2.9Å; F27-E29 PolarHBondContact O-N 3.01Å; E29-A32 PolarHBondContact O-N 3.03Å; E29-T33 WeakPolarHBondContact O-CB 3.32Å; E29-T33 WeakPolarHBondContact O-CG2 3.33Å; E29-T33 PolarHBondContact O-N 3.23Å; E29-T33 PolarHBondContact O-OG1 2.91Å
30	H	70	Confident	64.5	Low	110 Å²	110	101 Å²	101	51%	0.509	52%	0.52	S	S	.	.	H	α-helix	trans	-68.9	-39.5	176.5	-174.2	-88.8	0	0	0	112.1	R26 F27 T33 Q34	R26-H30 VanDerWaalsContact O-CB 3.31Å; R26-H30 WeakPolarHBondContact O-CB 3.48Å; R26-H30 PolarHBondContact O-N 3.5Å; F27-H30 PolarHBondContact O-N 2.79Å; H30-T33 WeakPolarHBondContact CA-OG1 3.46Å; H30-T33 PolarHBondContact O-N 3.48Å; H30-T33 PolarHBondContact O-OG1 2.87Å; H30-Q34 PolarHBondContact CE1-NE2 2.92Å; H30-Q34 PolarHBondContact O-N 3.19Å
31	E	70.4	Confident	64.4	Low	101 Å²	101	100.4 Å²	100.4	47%	0.472	52%	0.523	S	S	.	.	H	α-helix	trans	-63.9	-43.7	171.2	-97	-161	135	0	0	112.1	F27 Y28 T33 Q34 A35	F27-E31 HydrophobicContact CE1-CG 4.46Å; F27-E31 PolarHBondContact O-N 3.48Å; Y28-E31 PolarHBondContact O-N 3.29Å; E31-T33 VanDerWaalsContact C-N 3.32Å; E31-T33 PolarHBondContact O-N 3.27Å; E31-Q34 PolarHBondContact O-N 2.94Å; E31-A35 WeakPolarHBondContact O-CB 3.42Å; E31-A35 PolarHBondContact O-N 2.91Å
32	A	68.6	Low	63.1	Low	59 Å²	59	103.8 Å²	103.8	49%	0.488	54%	0.543	S	S	.	.	H	α-helix	trans	-64	-37.6	178.5	0	0	0	0	0	112.1	Y28 E29 A36	Y28-A32 VanDerWaalsContact O-CB 3.27Å; Y28-A32 WeakPolarHBondContact O-CB 3.15Å; Y28-A32 PolarHBondContact O-N 3.16Å; E29-A32 PolarHBondContact O-N 3.03Å; A32-A36 VanDerWaalsContact O-CB 3.29Å; A32-A36 WeakPolarHBondContact O-CB 3.37Å; A32-A36 PolarHBondContact O-N 2.85Å
33	T	71.6	Confident	62.1	Low	87 Å²	87	106 Å²	106	53%	0.534	56%	0.564	S	S	.	*	H	α-helix	trans	-72.7	-34.7	175.4	50.1	0	0	0	0	112.7	E29 H30 E31 A37	E29-T33 WeakPolarHBondContact O-CB 3.32Å; E29-T33 WeakPolarHBondContact O-CG2 3.33Å; E29-T33 PolarHBondContact O-N 3.23Å; E29-T33 PolarHBondContact O-OG1 2.91Å; H30-T33 WeakPolarHBondContact CA-OG1 3.46Å; H30-T33 PolarHBondContact O-N 3.48Å; H30-T33 PolarHBondContact O-OG1 2.87Å; E31-T33 VanDerWaalsContact C-N 3.32Å; E31-T33 PolarHBondContact O-N 3.27Å; T33-A37 WeakPolarHBondContact O-CB 3.36Å; T33-A37 PolarHBondContact O-N 3.29Å
34	Q	66.3	Low	60.8	Low	111 Å²	111	108.1 Å²	108.1	52%	0.519	58%	0.581	S	S	.	*	H	α-helix	trans	-66	-43.4	170	-87.1	-172.7	-9.9	0	0	112.2	H30 E31 A36 A37 S38	H30-Q34 PolarHBondContact CE1-NE2 2.92Å; H30-Q34 PolarHBondContact O-N 3.19Å; E31-Q34 PolarHBondContact O-N 2.94Å; Q34-A36 VanDerWaalsContact C-N 3.34Å; Q34-A36 PolarHBondContact O-N 3.31Å; Q34-A37 PolarHBondContact O-N 2.92Å; Q34-S38 PolarHBondContact O-N 3.45Å; Q34-S38 PolarHBondContact O-OG 3.41Å
35	A	67.3	Low	59.3	Low	62 Å²	62	113.3 Å²	113.3	51%	0.512	61%	0.605	S	S	.	*	H	α-helix	trans	-62.9	-40.2	176	0	0	0	0	0	111.8	E31 S38 A39	E31-A35 WeakPolarHBondContact O-CB 3.42Å; E31-A35 PolarHBondContact O-N 2.91Å; A35-S38 PolarHBondContact O-N 3.49Å; A35-A39 WeakPolarHBondContact O-CB 3.37Å; A35-A39 PolarHBondContact O-N 3.28Å
36	A	64.4	Low	57.4	Low	50 Å²	50	108.3 Å²	108.3	41%	0.413	61%	0.607	S	S	.	*	H	α-helix	trans	-67	-36.2	174.7	0	0	0	0	0	112.8	A32 Q34 A39 Q40	A32-A36 VanDerWaalsContact O-CB 3.29Å; A32-A36 WeakPolarHBondContact O-CB 3.37Å; A32-A36 PolarHBondContact O-N 2.85Å; Q34-A36 VanDerWaalsContact C-N 3.34Å; Q34-A36 PolarHBondContact O-N 3.31Å; A36-A39 PolarHBondContact O-N 3.32Å; A36-Q40 PolarHBondContact O-N 3.44Å
37	A	66.1	Low	56.1	Low	51 Å²	51	107.3 Å²	107.3	42%	0.421	62%	0.62	S	S	.	*	H	α-helix	trans	-69.2	-38.6	174.7	0	0	0	0	0	112.1	T33 Q34 Q40	T33-A37 WeakPolarHBondContact O-CB 3.36Å; T33-A37 PolarHBondContact O-N 3.29Å; Q34-A37 PolarHBondContact O-N 2.92Å; A37-Q40 PolarHBondContact O-N 2.93Å
38	S	57.1	Low	54.3	Low	77 Å²	77	106.5 Å²	106.5	54%	0.538	64%	0.636	S	S	.	*	H	α-helix	trans	-68.9	-32.6	174.3	-63.5	0	0	0	0	112.9	Q34 A35 Q40 Q41	Q34-S38 PolarHBondContact O-N 3.45Å; Q34-S38 PolarHBondContact O-OG 3.41Å; A35-S38 PolarHBondContact O-N 3.49Å; S38-Q40 VanDerWaalsContact C-N 3.32Å; S38-Q40 PolarHBondContact O-N 3.45Å; S38-Q41 PolarHBondContact O-N 2.87Å
39	A	56.6	Low	52.5	Low	70 Å²	70	109 Å²	109	58%	0.579	66%	0.655	S	S	*	*	H	α-helix	trans	-68.9	-27.3	175.5	0	0	0	0	0	113.4	A35 A36 Q41	A35-A39 WeakPolarHBondContact O-CB 3.37Å; A35-A39 PolarHBondContact O-N 3.28Å; A36-A39 PolarHBondContact O-N 3.32Å; A39-Q41 PolarHBondContact O-N 2.91Å
40	Q	53.9	Low	50.5	Low	171 Å²	171	111.2 Å²	111.2	80%	0.799	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-4.5	175.8	-72.5	178.1	21.6	0	0	114	A36 A37 S38	A36-Q40 PolarHBondContact O-N 3.44Å; A37-Q40 PolarHBondContact O-N 2.93Å; S38-Q40 VanDerWaalsContact C-N 3.32Å; S38-Q40 PolarHBondContact O-N 3.45Å
41	Q	47.9	Very low	48.3	Very low	156 Å²	156	109.4 Å²	109.4	73%	0.729	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	3.9	-175.4	-99.7	164.6	-26.2	0	0	115.4	S38 A39	S38-Q41 PolarHBondContact O-N 2.87Å; A39-Q41 PolarHBondContact O-N 2.91Å
42	L	34.9	Very low	46.6	Very low	150 Å²	150	111.1 Å²	111.1	79%	0.785	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-95.5	118.2	174.9	-70.2	171.5	0	0	0	110.9
43	P	39.8	Very low	44.5	Very low	119 Å²	119	111.7 Å²	111.7	77%	0.773	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-78.3	140.6	175	31.2	-30.8	0	0	0	111	E45	P43-E45 PolarHBondContact O-N 3.01Å
44	A	34.8	Very low	42.5	Very low	103 Å²	103	116.1 Å²	116.1	85%	0.851	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-66.4	123.8	-179	0	0	0	0	0	112.5
45	E	31.4	Very low	40.7	Very low	200 Å²	200	118 Å²	118	94%	0.935	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-76.2	121	158.1	-82.8	-156.8	139.5	0	0	109.3	P43	P43-E45 PolarHBondContact O-N 3.01Å
46	G	32.4	Very low	38.8	Very low	64 Å²	64	122.6 Å²	122.6	66%	0.66	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-85.9	157.3	177	0	0	0	0	0	112.9
47	P	36.5	Very low	38.2	Very low	133 Å²	133	125 Å²	125	86%	0.864	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-84.2	142.7	-173.7	33.5	-32.1	0	0	0	112.5
48	A	30	Very low	36.6	Very low	107 Å²	107	130.6 Å²	130.6	88%	0.884	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-70.4	129.7	173.8	0	0	0	0	0	112.1
49	M	28.9	Very low	35.4	Very low	187 Å²	187	133.5 Å²	133.5	92%	0.921	80%	0.795	S	S	*	*			trans	-136.4	131.1	166.4	-114.1	-87.3	-170.4	0	0	108.5
50	N	30.6	Very low	34.3	Very low	168 Å²	168	133.9 Å²	133.9	90%	0.898	80%	0.798	S	S	*	*			trans	-70.4	148.9	-178.5	-78.7	-75.1	0	0	0	112.7
51	G	24	Very low	33.3	Very low	71 Å²	71	133 Å²	133	73%	0.732	80%	0.799	S	S	*	*			trans	145.7	115.5	156.5	0	0	0	0	0	114.5
52	P	34.9	Very low	32.7	Very low	138 Å²	138	133.7 Å²	133.7	90%	0.896	80%	0.802	S	S	*	*			trans	-95.1	158.4	-164.9	37.4	-33.3	0	0	0	113.8
53	G	24.9	Very low	32.6	Very low	70 Å²	70	130.6 Å²	130.6	72%	0.722	80%	0.798	S	S	*	*			trans	-151.1	116.1	170	0	0	0	0	0	113.1
54	Q	29.3	Very low	32.1	Very low	180 Å²	180	133.5 Å²	133.5	84%	0.841	80%	0.802	S	S	*	*			trans	70.9	106.5	150.3	-73.4	177.2	-75	0	0	121.7
55	D	28.1	Very low	31.9	Very low	150 Å²	150	132.4 Å²	132.4	80%	0.802	79%	0.793	S	S	*	*				45.1	105.2	110.1	-51.2	-38.3	0	0	0	119.8
56	D	26.9	Very low	32.8	Very low	159 Å²	159	128.6 Å²	128.6	85%	0.85	79%	0.785	S	S	*	*			trans	-24.2	178	148.4	-78.5	-49.4	0	0	0	120.3
57	P	52	Low	32.6	Very low	100 Å²	100	133.5 Å²	133.5	65%	0.649	80%	0.797	S	S	*	*			cis	-142.3	-162.7	-34.4	34.4	-11.6	0	0	0	114.5
58	E	33.1	Very low	32.2	Very low	169 Å²	169	130.5 Å²	130.5	79%	0.79	79%	0.79	S	S	*	*			trans	92.1	139.5	159.1	-57.1	-178.4	165.5	0	0	117.9
59	D	31.9	Very low	32	Very low	139 Å²	139	129.1 Å²	129.1	74%	0.743	79%	0.786	S	S	*	*			cis	-170.9	155	-5.5	-111.3	-35.8	0	0	0	111.1
60	A	34.4	Very low	31.9	Very low	77 Å²	77	125.6 Å²	125.6	64%	0.636	78%	0.779	S	S	*	*			trans	65.2	118.1	140.3	0	0	0	0	0	125.1
61	D	33.2	Very low	31.9	Very low	154 Å²	154	128.6 Å²	128.6	82%	0.824	78%	0.778	S	S	*	*				54.1	153.8	120.1	-71.6	-47.5	0	0	0	121.7
62	E	33.6	Very low	32.3	Very low	170 Å²	170	137.1 Å²	137.1	79%	0.794	79%	0.788	S	S	*	*			cis	-167.4	136	8.7	-121.9	-177.2	159.1	0	0	105
63	A	33	Very low	32	Very low	85 Å²	85	138 Å²	138	70%	0.702	79%	0.785	S	S	*	*				74.2	145.4	95.6	0	0	0	0	0	119.5
64	E	30.5	Very low	32.9	Very low	179 Å²	179	139.6 Å²	139.6	84%	0.836	78%	0.783	S	S	*	*			trans	87.3	86.5	159.8	-67.8	-75.8	136.6	0	0	121.6
65	A	30.7	Very low	32.8	Very low	81 Å²	81	141.2 Å²	141.2	67%	0.669	78%	0.781	S	S	*	*				42.7	171	106.6	0	0	0	0	0	122.6
66	P	50.6	Low	32.9	Very low	120 Å²	120	142 Å²	142	78%	0.779	78%	0.778	S	S	*	*				-135.6	-175.2	-78.5	39.8	-21.7	0	0	0	114.7
67	D	28	Very low	32.9	Very low	167 Å²	167	139.5 Å²	139.5	89%	0.893	77%	0.773	S	S	*	*			trans	108.9	142.2	140.9	-142.5	7	0	0	0	119.2
68	G	28.1	Very low	32	Very low	70 Å²	70	142.7 Å²	142.7	72%	0.722	78%	0.779	S	S	*	*			trans	128.8	93.9	170.4	0	0	0	0	0	115.5
69	G	25.8	Very low	31.8	Very low	78 Å²	78	141 Å²	141	80%	0.804	78%	0.775	S	S	*	*			trans	-86.2	-173.4	-178.9	0	0	0	0	0	117.4
70	S	26.7	Very low	31.8	Very low	112 Å²	112	139.8 Å²	139.8	78%	0.783	78%	0.778	S	S	*	*			trans	98	106.6	153.7	-147.3	0	0	0	0	119.1
71	R	30.7	Very low	31.8	Very low	231 Å²	231	147.8 Å²	147.8	87%	0.872	79%	0.792	S	S	*	*			trans	46.1	124.8	131.7	-74.7	-178.8	163.1	-164.8	-3.6	119.7
72	R	31.6	Very low	31.9	Very low	250 Å²	250	149.8 Å²	149.8	94%	0.943	79%	0.793	S	S	*	*				-174.4	122.6	121.8	-100.1	165.9	-155.7	-109.3	7.6	112.3
73	D	28.6	Very low	31.8	Very low	156 Å²	156	147.7 Å²	147.7	83%	0.834	79%	0.794	S	S	*	*			trans	-59.7	173.6	150.4	-78.8	-54	0	0	0	110.7
74	P	43.7	Very low	31.8	Very low	104 Å²	104	151.6 Å²	151.6	68%	0.675	80%	0.802	S	S	*	*			cis	-156.4	-176.5	28.4	45.3	-23.4	0	0	0	119.5
75	R	28.7	Very low	32	Very low	214 Å²	214	152.3 Å²	152.3	81%	0.808	81%	0.806	S	S	*	*			trans	74.3	144.1	151.9	-75.1	171.1	176.8	-165.9	-0.5	117.4
76	K	29.6	Very low	32.1	Very low	167 Å²	167	158.3 Å²	158.3	73%	0.726	82%	0.816	S	S	*	*			cis	-170.5	151.9	14.3	-129.6	172	-179.3	-172.7	0	110.2
77	S	27.1	Very low	31.1	Very low	107 Å²	107	161.1 Å²	161.1	75%	0.748	82%	0.816	S	S	*	*			trans	60.2	142.1	153.8	65.2	0	0	0	0	118.6
78	Q	32.2	Very low	31.4	Very low	167 Å²	167	165.5 Å²	165.5	78%	0.78	82%	0.82	S	S	*	*			cis	-167.8	147.6	37.8	-152.1	173.2	4.9	0	0	111.3
79	D	29.5	Very low	31.6	Very low	133 Å²	133	170.3 Å²	170.3	71%	0.711	82%	0.821	S	S	*	*			trans	26.7	118.8	151.6	-64.7	-38.3	0	0	0	121.7
80	S	30.7	Very low	31.9	Very low	113 Å²	113	178 Å²	178	79%	0.79	83%	0.826	S	S	*	*				157.9	130.8	99.5	53.1	0	0	0	0	113.8
81	R	34.9	Very low	32.2	Very low	246 Å²	246	178.4 Å²	178.4	93%	0.928	83%	0.829	S	S	*	*			trans	50.8	108.4	150.9	-64.5	-179.7	178.1	-179	-0.5	120.1
82	K	35.4	Very low	32.4	Very low	196 Å²	196	173.3 Å²	173.3	85%	0.852	83%	0.826	S	S	*	*			trans	-71.8	159.2	161.1	-62.2	176.9	-180	176.5	0	111.5
83	P	32.7	Very low	32.9	Very low	125 Å²	125	171.5 Å²	171.5	81%	0.812	83%	0.825	S	S	*	*				-121.2	149.8	116.6	16.7	-0.7	0	0	0	112.6
84	L	32.2	Very low	33.1	Very low	168 Å²	168	169.4 Å²	169.4	88%	0.88	82%	0.822	S	S	*	*			trans	-63.4	127.7	-172.1	-67.7	108.5	0	0	0	113.1
85	Q	34.5	Very low	32.7	Very low	194 Å²	194	168.1 Å²	168.1	91%	0.907	83%	0.828	S	S	*	*			trans	-111.2	130.9	150.1	-74	-131.5	1.2	0	0	109.9
86	K	33	Very low	33.2	Very low	206 Å²	206	164.7 Å²	164.7	90%	0.896	83%	0.825	S	S	*	*			trans	-63.9	145.2	-170.5	-80.3	168.6	172.7	171.6	0	112.3	R88	K86-R88 PolarHBondContact O-N 3.08Å
87	K	29.8	Very low	33.9	Very low	179 Å²	179	158.2 Å²	158.2	78%	0.778	81%	0.806	S	S	*	*			trans	-47.1	118	171	-66.9	174.3	175	173.2	0	111.7	K89	K87-K89 HydrophobicContact CB-CG 4.42Å; K87-K89 PolarHBondContact O-N 2.98Å
88	R	34.1	Very low	34.7	Very low	259 Å²	259	158.8 Å²	158.8	98%	0.977	81%	0.807	S	S	*	*			trans	-72	108.7	151.2	-81.8	-177	168.1	-173.5	-3.6	107.6	K86	K86-R88 PolarHBondContact O-N 3.08Å
89	K	33	Very low	35.3	Very low	171 Å²	171	154.1 Å²	154.1	74%	0.743	80%	0.796	S	S	*	*			trans	-107.5	123.5	165.3	-79.9	-161.5	173.6	-170.6	0	108.3	K87	K87-K89 HydrophobicContact CB-CG 4.42Å; K87-K89 PolarHBondContact O-N 2.98Å
90	R	30.1	Very low	36	Very low	241 Å²	241	151.7 Å²	151.7	91%	0.909	78%	0.783	S	S	*	*			trans	31.2	118.3	150.3	-67.9	-177.9	176	-170.6	-3	118.1
91	S	34.6	Very low	37	Very low	119 Å²	119	152.3 Å²	152.3	83%	0.832	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-52.8	136.9	159.8	-61.2	0	0	0	0	112
92	P	35.4	Very low	37.5	Very low	124 Å²	124	143.3 Å²	143.3	81%	0.805	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-84.1	121	161.9	-5.7	24.4	0	0	0	110
93	K	40.6	Very low	37.9	Very low	213 Å²	213	140 Å²	140	93%	0.926	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-69.6	127.8	152	-106.2	171.5	171.3	173.8	0	107.3
94	S	32.6	Very low	38.7	Very low	111 Å²	111	139.8 Å²	139.8	78%	0.776	74%	0.738	S	S	*	*			trans	-141.7	101	154.8	58.6	0	0	0	0	108.4
95	G	35.3	Very low	39.3	Very low	77 Å²	77	133.7 Å²	133.7	79%	0.794	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-76.2	133.6	166.6	0	0	0	0	0	108.9
96	L	40.3	Very low	39.6	Very low	142 Å²	142	129.3 Å²	129.3	74%	0.743	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-87.9	125.6	159.7	-68	171.1	0	0	0	106.5	D100	L96-D100 WeakPolarHBondContact CD2-OD2 3.37Å
97	G	43.6	Very low	40	Very low	32 Å²	32	122.8 Å²	122.8	33%	0.33	68%	0.678	S	S	.	*	P	Polyproline II helix	trans	-77.9	165.1	-177.5	0	0	0	0	0	111.8	A99 D100	G97-A99 PolarHBondContact O-N 3.19Å; G97-D100 PolarHBondContact O-N 2.98Å
98	P	44.8	Very low	40.6	Very low	119 Å²	119	117.3 Å²	117.3	77%	0.773	67%	0.666	S	S	*	*	H	α-helix	trans	-55.4	-20.3	178	-26.1	34.7	0	0	0	115	A102	P98-A102 PolarHBondContact O-N 2.85Å
99	A	43.8	Very low	40.9	Very low	68 Å²	68	111 Å²	111	56%	0.562	65%	0.648	S	S	*	*	H	α-helix	trans	-73.4	-29.3	177.4	0	0	0	0	0	113.9	G97 A102 L103	G97-A99 PolarHBondContact O-N 3.19Å; A99-A102 PolarHBondContact O-N 3.23Å; A99-L103 PolarHBondContact O-N 2.9Å
100	D	44.8	Very low	41.3	Very low	82 Å²	82	112.4 Å²	112.4	44%	0.439	65%	0.648	S	S	.	*	H	α-helix	trans	-77.7	-30.2	179.6	-72.6	-31.3	0	0	0	111.9	L96 G97 A102 L103 L104	L96-D100 WeakPolarHBondContact CD2-OD2 3.37Å; G97-D100 PolarHBondContact O-N 2.98Å; D100-A102 VanDerWaalsContact C-N 3.34Å; D100-L103 PolarHBondContact O-N 3.39Å; D100-L104 PolarHBondContact O-N 3.45Å
101	L	51.5	Low	42	Very low	127 Å²	127	106.6 Å²	106.6	67%	0.665	64%	0.64	S	S	*	*	H	α-helix	trans	-68.4	-32.9	170	-92.2	133.4	0	0	0	112.2	L104 G105	L101-L104 PolarHBondContact O-N 3.23Å; L101-G105 PolarHBondContact O-N 3.38Å
102	A	45.4	Very low	42.4	Very low	56 Å²	56	110.8 Å²	110.8	46%	0.463	64%	0.637	S	S	.	*	H	α-helix	trans	-69.2	-37.2	174.8	0	0	0	0	0	112.1	P98 A99 D100 G105 L106	P98-A102 PolarHBondContact O-N 2.85Å; A99-A102 PolarHBondContact O-N 3.23Å; D100-A102 VanDerWaalsContact C-N 3.34Å; A102-G105 PolarHBondContact O-N 2.97Å; A102-L106 VanDerWaalsContact O-CG 3.31Å; A102-L106 WeakPolarHBondContact O-CG 3.44Å; A102-L106 PolarHBondContact O-N 3.18Å; A102-L106 VanDerWaalsContact O-N 3.09Å
103	L	43.9	Very low	42.8	Very low	126 Å²	126	110.9 Å²	110.9	66%	0.66	63%	0.63	S	S	*	*	H	α-helix	trans	-69.1	-32.7	175.5	-110.2	106.2	0	0	0	113.2	A99 D100 S107	A99-L103 PolarHBondContact O-N 2.9Å; D100-L103 PolarHBondContact O-N 3.39Å; L103-S107 PolarHBondContact O-N 2.9Å
104	L	49.5	Very low	43.3	Very low	122 Å²	122	105.5 Å²	105.5	64%	0.639	61%	0.612	S	S	*	*	H	α-helix	trans	-71.8	-30.1	171.8	-89.8	156	0	0	0	112.9	D100 L101 S107	D100-L104 PolarHBondContact O-N 3.45Å; L101-L104 PolarHBondContact O-N 3.23Å; L104-S107 PolarHBondContact O-OG 3.04Å
105	G	44.2	Very low	44.5	Very low	40 Å²	40	106 Å²	106	41%	0.412	60%	0.6	S	S	.	*	H	α-helix	trans	-68.7	-38	171.1	0	0	0	0	0	112.8	L101 A102 S107 A108 E109	L101-G105 PolarHBondContact O-N 3.38Å; A102-G105 PolarHBondContact O-N 2.97Å; G105-S107 VanDerWaalsContact C-N 3.34Å; G105-S107 PolarHBondContact O-N 3.43Å; G105-A108 PolarHBondContact O-N 2.99Å; G105-E109 PolarHBondContact O-N 3.4Å
106	L	42.1	Very low	45.4	Very low	101 Å²	101	106.1 Å²	106.1	53%	0.529	59%	0.589	S	S	.	*	H	α-helix	trans	-74.3	-19.1	179.9	-69.3	167.6	0	0	0	113.9	A102	A102-L106 VanDerWaalsContact O-CG 3.31Å; A102-L106 WeakPolarHBondContact O-CG 3.44Å; A102-L106 PolarHBondContact O-N 3.18Å; A102-L106 VanDerWaalsContact O-N 3.09Å
107	S	41.6	Very low	46.3	Very low	70 Å²	70	103.7 Å²	103.7	49%	0.49	58%	0.576	S	S	.	*	H	α-helix	trans	-80.7	-21.9	171.2	54.5	0	0	0	0	112.9	L103 L104 G105	L103-S107 PolarHBondContact O-N 2.9Å; L104-S107 PolarHBondContact O-OG 3.04Å; G105-S107 VanDerWaalsContact C-N 3.34Å; G105-S107 PolarHBondContact O-N 3.43Å
108	A	41.3	Very low	46.9	Very low	63 Å²	63	108.9 Å²	108.9	52%	0.521	59%	0.59	S	S	.	*	H	α-helix	trans	-79.2	-25.6	172.8	0	0	0	0	0	113	G105 R110 V111	G105-A108 PolarHBondContact O-N 2.99Å; A108-R110 PolarHBondContact O-N 3.3Å; A108-V111 PolarHBondContact O-N 3.03Å
109	E	39.7	Very low	47.8	Very low	128 Å²	128	105.9 Å²	105.9	60%	0.598	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-71.9	-11.2	175.6	-79.4	-174.6	160.4	0	0	114.2	G105 V111 W112	G105-E109 PolarHBondContact O-N 3.4Å; E109-V111 VanDerWaalsContact C-N 3.32Å; E109-V111 PolarHBondContact O-N 3.33Å; E109-W112 PolarHBondContact O-N 2.88Å
110	R	42.9	Very low	48.6	Very low	199 Å²	199	109 Å²	109	75%	0.751	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-79.4	-11.7	175.9	-65.6	-173.7	-174.9	-146.4	1.1	114.2	A108 L113	A108-R110 PolarHBondContact O-N 3.3Å; R110-L113 HydrophobicContact CG-CD1 4.44Å
111	V	43.5	Very low	49.4	Very low	120 Å²	120	107.9 Å²	107.9	73%	0.727	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-75.1	-18.6	172.4	-175.9	0	0	0	0	111.3	A108 E109	A108-V111 PolarHBondContact O-N 3.03Å; E109-V111 VanDerWaalsContact C-N 3.32Å; E109-V111 PolarHBondContact O-N 3.33Å
112	W	43.5	Very low	49.7	Very low	206 Å²	206	105.3 Å²	105.3	78%	0.78	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-96.5	4.7	-179.9	-85.3	65.9	0	0	0	114.4	E109	E109-W112 PolarHBondContact O-N 2.88Å
113	L	44.3	Very low	50.1	Low	126 Å²	126	106.1 Å²	106.1	66%	0.66	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-2.9	-176.3	-93.7	160.6	0	0	0	115.3	R110	R110-L113 HydrophobicContact CG-CD1 4.44Å
114	D	50.8	Low	50.9	Low	100 Å²	100	102.7 Å²	102.7	54%	0.535	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.8	25.5	179.5	-81.2	-30	0	0	0	114.5	S116 L117 F118	D114-S116 PolarHBondContact O-N 2.95Å; D114-L117 HydrophobicContact CB-CB 4.24Å; D114-L117 HydrophobicContact CB-CD1 4.13Å; D114-L117 HydrophobicContact CB-CG 4.33Å; D114-L117 VanDerWaalsContact CG-CD1 3.49Å; D114-L117 PolarHBondContact O-N 3.37Å; D114-L117 WeakPolarHBondContact OD1-CD1 3.28Å; D114-F118 PolarHBondContact O-N 2.91Å
115	K	56.8	Low	51.5	Low	121 Å²	121	104.1 Å²	104.1	53%	0.526	54%	0.544	S	S	.	.	H	α-helix	trans	-55.3	-36.4	171.3	-177.1	178	-178.9	-63.1	0	111.9	L117 F118 D119	K115-L117 PolarHBondContact O-N 3.38Å; K115-F118 PolarHBondContact O-N 3.38Å; K115-D119 IonicContact NZ-OD1 2.69Å; K115-D119 IonicContact NZ-OD2 2.69Å; K115-D119 PolarHBondContact NZ-OD2 3.37Å; K115-D119 VanDerWaalsContact O-CB 3.32Å; K115-D119 WeakPolarHBondContact O-CB 3.41Å; K115-D119 PolarHBondContact O-N 2.99Å
116	S	56	Low	52.4	Low	81 Å²	81	109.7 Å²	109.7	57%	0.566	55%	0.552	S	S	*	*	H	α-helix	trans	-65.5	-35.9	176.9	55.4	0	0	0	0	113	D114 Q120	D114-S116 PolarHBondContact O-N 2.95Å; S116-Q120 WeakPolarHBondContact O-CB 3.33Å; S116-Q120 PolarHBondContact O-N 2.95Å
117	L	58.2	Low	53.6	Low	90 Å²	90	110.7 Å²	110.7	47%	0.471	55%	0.554	S	S	.	*	H	α-helix	trans	-73	-37.7	176.1	-63.4	-174.8	0	0	0	111.4	D114 K115 Q120 A121	D114-L117 HydrophobicContact CB-CB 4.24Å; D114-L117 HydrophobicContact CB-CD1 4.13Å; D114-L117 HydrophobicContact CB-CG 4.33Å; D114-L117 VanDerWaalsContact CG-CD1 3.49Å; D114-L117 PolarHBondContact O-N 3.37Å; D114-L117 WeakPolarHBondContact OD1-CD1 3.28Å; K115-L117 PolarHBondContact O-N 3.38Å; L117-Q120 PolarHBondContact O-N 2.84Å; L117-A121 WeakPolarHBondContact O-CB 3.5Å; L117-A121 PolarHBondContact O-N 3.19Å
118	F	55.7	Low	55	Low	142 Å²	142	113.6 Å²	113.6	62%	0.623	56%	0.558	S	S	*	*	H	α-helix	trans	-65.3	-48	174.6	-172	-92.2	0	0	0	111.7	D114 K115 Q120 A121 E122	D114-F118 PolarHBondContact O-N 2.91Å; K115-F118 PolarHBondContact O-N 3.38Å; F118-Q120 VanDerWaalsContact C-N 3.27Å; F118-Q120 PolarHBondContact O-N 3.45Å; F118-A121 PolarHBondContact O-N 3.06Å; F118-A121 VanDerWaalsContact O-N 3.14Å; F118-E122 PolarHBondContact O-N 3.49Å
119	D	65	Low	55.9	Low	56 Å²	56	115 Å²	115	30%	0.299	56%	0.557	S	S	.	*	H	α-helix	trans	-61.6	-36.9	176.8	-68.2	-16	0	0	0	111	K115 S123	K115-D119 IonicContact NZ-OD1 2.69Å; K115-D119 IonicContact NZ-OD2 2.69Å; K115-D119 PolarHBondContact NZ-OD2 3.37Å; K115-D119 VanDerWaalsContact O-CB 3.32Å; K115-D119 WeakPolarHBondContact O-CB 3.41Å; K115-D119 PolarHBondContact O-N 2.99Å; D119-S123 VanDerWaalsContact O-CB 3.32Å; D119-S123 WeakPolarHBondContact O-CB 3.28Å; D119-S123 PolarHBondContact O-N 2.97Å; D119-S123 PolarHBondContact O-OG 3.5Å
120	Q	59.1	Low	57	Low	133 Å²	133	111.6 Å²	111.6	62%	0.621	55%	0.55	S	S	*	*	H	α-helix	trans	-67.4	-40.7	174.5	-176.2	174.3	54.6	0	0	112.3	S116 L117 F118 S123 S124	S116-Q120 WeakPolarHBondContact O-CB 3.33Å; S116-Q120 PolarHBondContact O-N 2.95Å; L117-Q120 PolarHBondContact O-N 2.84Å; F118-Q120 VanDerWaalsContact C-N 3.27Å; F118-Q120 PolarHBondContact O-N 3.45Å; Q120-S123 PolarHBondContact O-N 3.06Å; Q120-S124 WeakPolarHBondContact O-CB 3.34Å; Q120-S124 PolarHBondContact O-N 3.28Å
121	A	61.8	Low	57.9	Low	59 Å²	59	105.7 Å²	105.7	49%	0.488	53%	0.533	S	S	.	.	H	α-helix	trans	-65.6	-43	176.1	0	0	0	0	0	111.7	L117 F118 S124 Y125	L117-A121 WeakPolarHBondContact O-CB 3.5Å; L117-A121 PolarHBondContact O-N 3.19Å; F118-A121 PolarHBondContact O-N 3.06Å; F118-A121 VanDerWaalsContact O-N 3.14Å; A121-S124 PolarHBondContact O-N 3.37Å; A121-Y125 WeakPolarHBondContact O-CB 3.49Å; A121-Y125 PolarHBondContact O-N 2.88Å
122	E	58.6	Low	59.1	Low	72 Å²	72	104.6 Å²	104.6	34%	0.336	53%	0.527	S	S	.	.	H	α-helix	trans	-63.7	-42.6	176.6	-168.8	-174.3	-175.3	0	0	111.5	F118 Y125 R126	F118-E122 PolarHBondContact O-N 3.49Å; E122-Y125 PolarHBondContact O-N 3.35Å; E122-R126 WeakPolarHBondContact O-CG 3.48Å; E122-R126 PolarHBondContact O-N 3.36Å; E122-R126 IonicContact OE1-CZ 3.96Å; E122-R126 IonicContact OE1-NE 2.66Å; E122-R126 IonicContact OE1-NH1 2.71Å; E122-R126 IonicContact OE1-NH2 3.35Å; E122-R126 PolarHBondContact OE1-NH2 2.75Å
123	S	53.3	Low	59.9	Low	73 Å²	73	97.8 Å²	97.8	51%	0.51	52%	0.515	S	S	.	.	H	α-helix	trans	-62.9	-42.7	176.2	-58.3	0	0	0	0	111.7	D119 Q120 Y125 R126 Q127	D119-S123 VanDerWaalsContact O-CB 3.32Å; D119-S123 WeakPolarHBondContact O-CB 3.28Å; D119-S123 PolarHBondContact O-N 2.97Å; D119-S123 PolarHBondContact O-OG 3.5Å; Q120-S123 PolarHBondContact O-N 3.06Å; S123-Y125 VanDerWaalsContact C-N 3.33Å; S123-Y125 PolarHBondContact O-N 2.97Å; S123-R126 PolarHBondContact O-N 3.17Å; S123-Q127 WeakPolarHBondContact O-CB 3.49Å; S123-Q127 PolarHBondContact O-N 3.29Å
124	S	60.4	Low	60.6	Low	55 Å²	55	94.5 Å²	94.5	39%	0.385	51%	0.506	S	S	.	.	H	α-helix	trans	-64.4	-37.6	176	-173.3	0	0	0	0	112.3	Q120 A121 K128	Q120-S124 WeakPolarHBondContact O-CB 3.34Å; Q120-S124 PolarHBondContact O-N 3.28Å; A121-S124 PolarHBondContact O-N 3.37Å; S124-K128 VanDerWaalsContact O-CG 3.32Å; S124-K128 WeakPolarHBondContact O-CG 3.37Å; S124-K128 PolarHBondContact O-N 2.77Å
125	Y	63.3	Low	60.6	Low	152 Å²	152	97 Å²	97	60%	0.596	51%	0.514	S	S	*	.	H	α-helix	trans	-65.6	-45.1	176.3	178.9	-107.5	0	0	0	112	A121 E122 S123 Q127 K128 L129	A121-Y125 WeakPolarHBondContact O-CB 3.49Å; A121-Y125 PolarHBondContact O-N 2.88Å; E122-Y125 PolarHBondContact O-N 3.35Å; S123-Y125 VanDerWaalsContact C-N 3.33Å; S123-Y125 PolarHBondContact O-N 2.97Å; Y125-Q127 PolarHBondContact O-N 3.44Å; Y125-K128 PolarHBondContact O-N 3.12Å; Y125-L129 HydrophobicContact CD1-CD1 4.09Å; Y125-L129 HydrophobicContact CE1-CD1 3.57Å; Y125-L129 HydrophobicContact CE1-CG 4.46Å; Y125-L129 PolarHBondContact O-N 2.99Å; Y125-L129 VanDerWaalsContact O-N 3.09Å
126	R	62.5	Low	60.4	Low	156 Å²	156	95.4 Å²	95.4	59%	0.589	52%	0.524	S	S	*	.	H	α-helix	trans	-63.8	-39.4	176	-72.4	-179.8	173.1	160.3	6.7	112.6	E122 S123 L129 A130	E122-R126 WeakPolarHBondContact O-CG 3.48Å; E122-R126 PolarHBondContact O-N 3.36Å; E122-R126 IonicContact OE1-CZ 3.96Å; E122-R126 IonicContact OE1-NE 2.66Å; E122-R126 IonicContact OE1-NH1 2.71Å; E122-R126 IonicContact OE1-NH2 3.35Å; E122-R126 PolarHBondContact OE1-NH2 2.75Å; S123-R126 PolarHBondContact O-N 3.17Å; R126-L129 PolarHBondContact O-N 3.31Å; R126-A130 PolarHBondContact O-N 3.04Å
127	Q	68.2	Low	59.8	Low	122 Å²	122	94.9 Å²	94.9	57%	0.57	52%	0.524	S	S	*	.	H	α-helix	trans	-60.6	-45.7	174.5	-168	79.2	36.4	0	0	111.2	S123 Y125 L129 A130 D131	S123-Q127 WeakPolarHBondContact O-CB 3.49Å; S123-Q127 PolarHBondContact O-N 3.29Å; Y125-Q127 PolarHBondContact O-N 3.44Å; Q127-L129 VanDerWaalsContact C-N 3.33Å; Q127-L129 PolarHBondContact O-N 2.89Å; Q127-A130 WeakPolarHBondContact O-CB 3.49Å; Q127-A130 PolarHBondContact O-N 2.67Å; Q127-A130 VanDerWaalsContact O-N 3.13Å; Q127-D131 VanDerWaalsContact O-CG 3.23Å; Q127-D131 PolarHBondContact O-N 3.49Å
128	K	69.4	Low	58.7	Low	132 Å²	132	101.9 Å²	101.9	57%	0.574	54%	0.544	S	S	*	.	H	α-helix	trans	-62.6	-38	177.9	-73.4	171.1	-175.9	174.8	0	112.7	S124 Y125 D131 V132	S124-K128 VanDerWaalsContact O-CG 3.32Å; S124-K128 WeakPolarHBondContact O-CG 3.37Å; S124-K128 PolarHBondContact O-N 2.77Å; Y125-K128 PolarHBondContact O-N 3.12Å; K128-D131 PolarHBondContact O-N 3.37Å; K128-V132 WeakPolarHBondContact O-CB 3.49Å; K128-V132 VanDerWaalsContact O-CG2 3.23Å; K128-V132 WeakPolarHBondContact O-CG2 3.4Å; K128-V132 PolarHBondContact O-N 2.74Å
129	L	60	Low	57.8	Low	93 Å²	93	100.7 Å²	100.7	49%	0.487	55%	0.551	S	S	.	*	H	α-helix	trans	-63.8	-41.3	173.7	-77.3	170.6	0	0	0	111.9	Y125 R126 Q127 V132 A133	Y125-L129 HydrophobicContact CD1-CD1 4.09Å; Y125-L129 HydrophobicContact CE1-CD1 3.57Å; Y125-L129 HydrophobicContact CE1-CG 4.46Å; Y125-L129 PolarHBondContact O-N 2.99Å; Y125-L129 VanDerWaalsContact O-N 3.09Å; R126-L129 PolarHBondContact O-N 3.31Å; Q127-L129 VanDerWaalsContact C-N 3.33Å; Q127-L129 PolarHBondContact O-N 2.89Å; L129-V132 PolarHBondContact O-N 2.81Å; L129-A133 WeakPolarHBondContact O-CB 3.34Å; L129-A133 PolarHBondContact O-N 3.26Å
130	A	63.5	Low	56.6	Low	56 Å²	56	104.3 Å²	104.3	46%	0.463	58%	0.577	S	S	.	*	H	α-helix	trans	-66.2	-39.7	175.8	0	0	0	0	0	112.2	R126 Q127 A133 A134	R126-A130 PolarHBondContact O-N 3.04Å; Q127-A130 WeakPolarHBondContact O-CB 3.49Å; Q127-A130 PolarHBondContact O-N 2.67Å; Q127-A130 VanDerWaalsContact O-N 3.13Å; A130-A133 PolarHBondContact O-N 2.86Å; A130-A134 WeakPolarHBondContact O-CB 3.4Å; A130-A134 PolarHBondContact O-N 3.4Å
131	D	63.1	Low	55.3	Low	74 Å²	74	102.3 Å²	102.3	40%	0.396	58%	0.583	S	S	.	*	H	α-helix	trans	-68.9	-35.6	178.3	-65.7	-23.7	0	0	0	111.9	Q127 K128 A134 Q135	Q127-D131 VanDerWaalsContact O-CG 3.23Å; Q127-D131 PolarHBondContact O-N 3.49Å; K128-D131 PolarHBondContact O-N 3.37Å; D131-A134 PolarHBondContact O-N 2.8Å; D131-Q135 WeakPolarHBondContact O-CB 3.46Å; D131-Q135 VanDerWaalsContact O-CG 3.25Å; D131-Q135 WeakPolarHBondContact O-CG 3.29Å; D131-Q135 PolarHBondContact O-N 3.48Å; D131-Q135 PolarHBondContact O-NE2 2.7Å
132	V	67.9	Low	54	Low	98 Å²	98	107.6 Å²	107.6	59%	0.594	60%	0.603	S	S	*	*	H	α-helix	trans	-67.8	-40.6	173.1	169.9	0	0	0	0	110.7	K128 L129 Q135 A136	K128-V132 WeakPolarHBondContact O-CB 3.49Å; K128-V132 VanDerWaalsContact O-CG2 3.23Å; K128-V132 WeakPolarHBondContact O-CG2 3.4Å; K128-V132 PolarHBondContact O-N 2.74Å; L129-V132 PolarHBondContact O-N 2.81Å; V132-Q135 PolarHBondContact O-N 3.22Å; V132-A136 PolarHBondContact O-N 2.63Å; V132-A136 VanDerWaalsContact O-N 3.14Å
133	A	61.1	Low	52.6	Low	63 Å²	63	108.3 Å²	108.3	52%	0.521	62%	0.621	S	S	.	*	H	α-helix	trans	-66.2	-36.6	174.9	0	0	0	0	0	112.4	L129 A130 A136	L129-A133 WeakPolarHBondContact O-CB 3.34Å; L129-A133 PolarHBondContact O-N 3.26Å; A130-A133 PolarHBondContact O-N 2.86Å; A133-A136 PolarHBondContact O-N 2.95Å
134	A	58	Low	52.6	Low	57 Å²	57	109.8 Å²	109.8	47%	0.471	63%	0.628	S	S	.	*	H	α-helix	trans	-69.9	-35.9	175.9	0	0	0	0	0	112.5	A130 D131 A136 A137	A130-A134 WeakPolarHBondContact O-CB 3.4Å; A130-A134 PolarHBondContact O-N 3.4Å; D131-A134 PolarHBondContact O-N 2.8Å; A134-A136 VanDerWaalsContact C-N 3.3Å; A134-A136 PolarHBondContact O-N 3.39Å; A134-A137 PolarHBondContact O-N 3.44Å
135	Q	49.8	Very low	51.2	Low	152 Å²	152	119.2 Å²	119.2	71%	0.71	66%	0.656	S	S	*	*	H	α-helix	trans	-68.7	-27.6	174.3	-76.1	169.3	80.2	0	0	112.8	D131 V132 A137	D131-Q135 WeakPolarHBondContact O-CB 3.46Å; D131-Q135 VanDerWaalsContact O-CG 3.25Å; D131-Q135 WeakPolarHBondContact O-CG 3.29Å; D131-Q135 PolarHBondContact O-N 3.48Å; D131-Q135 PolarHBondContact O-NE2 2.7Å; V132-Q135 PolarHBondContact O-N 3.22Å; Q135-A137 VanDerWaalsContact C-N 3.26Å; Q135-A137 PolarHBondContact O-N 2.63Å
136	A	53.7	Low	49.8	Very low	88 Å²	88	115.2 Å²	115.2	73%	0.727	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-9.4	173.8	0	0	0	0	0	113.9	V132 A133 A134	V132-A136 PolarHBondContact O-N 2.63Å; V132-A136 VanDerWaalsContact O-N 3.14Å; A133-A136 PolarHBondContact O-N 2.95Å; A134-A136 VanDerWaalsContact C-N 3.3Å; A134-A136 PolarHBondContact O-N 3.39Å
137	A	42.7	Very low	48.5	Very low	69 Å²	69	116.2 Å²	116.2	57%	0.57	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	11.2	-171	0	0	0	0	0	115.3	A134 Q135 P139	A134-A137 PolarHBondContact O-N 3.44Å; Q135-A137 VanDerWaalsContact C-N 3.26Å; Q135-A137 PolarHBondContact O-N 2.63Å; A137-P139 WeakPolarHBondContact O-CD 3.4Å
138	W	35.3	Very low	47.4	Very low	238 Å²	238	114.2 Å²	114.2	90%	0.902	68%	0.676	S	S	*	*			trans	-98.4	109.7	173.4	-79.1	12.9	0	0	0	111.4
139	P	37.8	Very low	46.4	Very low	116 Å²	116	114.2 Å²	114.2	75%	0.753	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-95.6	141.1	177.2	33.9	-29.2	0	0	0	112.3	A137	A137-P139 WeakPolarHBondContact O-CD 3.4Å
140	P	38.5	Very low	46	Very low	132 Å²	132	116.2 Å²	116.2	86%	0.857	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-78.7	153.2	156.1	20	-7.5	0	0	0	111.2
141	A	32	Very low	45	Very low	91 Å²	91	117 Å²	117	75%	0.752	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-69.8	143.4	-161.5	0	0	0	0	0	117.7
142	L	34.8	Very low	44.4	Very low	171 Å²	171	121.7 Å²	121.7	90%	0.895	73%	0.732	S	S	*	*			trans	60.5	119.8	142.6	-67	171.2	0	0	0	122.9
143	A	29.2	Very low	43.2	Very low	86 Å²	86	124.8 Å²	124.8	71%	0.711	74%	0.74	S	S	*	*			trans	96	160	136.1	0	0	0	0	0	119.2
144	P	52.6	Low	42.5	Very low	104 Å²	104	128.3 Å²	128.3	68%	0.675	75%	0.754	S	S	*	*				-137.4	105.8	-62.4	35.5	-18.3	0	0	0	112.2
145	W	31.8	Very low	42.1	Very low	254 Å²	254	129.5 Å²	129.5	96%	0.962	76%	0.764	S	S	*	*			trans	-153.6	143.5	176.9	-59.3	75.2	0	0	0	108.1
146	G	33.4	Very low	41.9	Very low	68 Å²	68	124.6 Å²	124.6	70%	0.701	75%	0.746	S	S	*	*			cis	-179.6	166.2	9.1	0	0	0	0	0	107.2	C148	G146-C148 PolarHBondContact O-N 2.68Å
147	L	36.1	Very low	41.4	Very low	177 Å²	177	127 Å²	127	93%	0.927	74%	0.742	S	S	*	*			trans	-57.4	125.1	-177.6	-75	137.1	0	0	0	111.7
148	C	44.9	Very low	41.7	Very low	80 Å²	80	129.3 Å²	129.3	54%	0.541	74%	0.741	S	S	.	*			trans	-90.9	112.9	175.4	-161.5	0	0	0	0	109.1	G146 H150	G146-C148 PolarHBondContact O-N 2.68Å; C148-H150 PolarHBondContact O-N 3.18Å; C148-H150 PolarHBondContact SG-CD2 3.2Å; C148-H150 PolarHBondContact SG-NE2 3.38Å; C148-H150 VanDerWaalsContact SG-NE2 3.38Å
149	T	49.1	Very low	42.2	Very low	132 Å²	132	120.2 Å²	120.2	81%	0.81	71%	0.711	S	S	*	*			trans	-85.2	81.4	176.7	50.6	0	0	0	0	110.2
150	H	50.4	Low	42.4	Very low	135 Å²	135	119 Å²	119	63%	0.625	70%	0.702	S	S	*	*			trans	-119.5	106.6	162.2	-63	-66.9	0	0	0	108.9	C148 N152	C148-H150 PolarHBondContact O-N 3.18Å; C148-H150 PolarHBondContact SG-CD2 3.2Å; C148-H150 PolarHBondContact SG-NE2 3.38Å; C148-H150 VanDerWaalsContact SG-NE2 3.38Å; H150-N152 PolarHBondContact O-N 2.86Å
151	G	42.6	Very low	42.4	Very low	71 Å²	71	122.6 Å²	122.6	73%	0.732	70%	0.699	S	S	*	*			trans	-69	121.7	164.8	0	0	0	0	0	109.4	Q153	G151-Q153 PolarHBondContact O-N 2.92Å
152	N	51.3	Low	42.7	Very low	174 Å²	174	120 Å²	120	93%	0.93	68%	0.681	S	S	*	*	S	Bend	trans	50	44.9	163.1	-67.6	-12.3	0	0	0	118.6	H150	H150-N152 PolarHBondContact O-N 2.86Å
153	Q	41.1	Very low	43	Very low	163 Å²	163	117.1 Å²	117.1	76%	0.762	67%	0.666	S	S	*	*			trans	-118.4	120.2	160.2	-70.6	-175.4	24.8	0	0	111.4	G151 A155	G151-Q153 PolarHBondContact O-N 2.92Å; Q153-A155 PolarHBondContact O-N 3.39Å; Q153-A155 VanDerWaalsContact O-N 3.12Å
154	V	47.3	Very low	43.5	Very low	136 Å²	136	123.5 Å²	123.5	82%	0.824	67%	0.671	S	S	*	*	S	Bend	trans	-78.9	86.8	177.3	179.7	0	0	0	0	108.4
155	A	48.9	Very low	43.1	Very low	82 Å²	82	123.5 Å²	123.5	68%	0.678	67%	0.669	S	S	*	*			trans	164.3	60.5	147.1	0	0	0	0	0	110.1	Q153	Q153-A155 PolarHBondContact O-N 3.39Å; Q153-A155 VanDerWaalsContact O-N 3.12Å
156	C	45.7	Very low	43.7	Very low	49 Å²	49	116.4 Å²	116.4	33%	0.331	65%	0.65	S	S	.	*			trans	-77.9	155.7	157.4	73.1	0	0	0	0	108.6	H158 V159	C156-H158 PolarHBondContact O-N 3.42Å; C156-V159 WeakPolarHBondContact O-CB 3.33Å; C156-V159 PolarHBondContact O-N 2.86Å
157	H	44.3	Very low	44.4	Very low	139 Å²	139	119 Å²	119	64%	0.644	64%	0.642	S	S	*	*	H	α-helix	trans	-58.9	-10.5	-176.5	105.2	-71.6	0	0	0	114.4	T160	H157-T160 PolarHBondContact O-OG1 2.8Å; H157-T160 VanDerWaalsContact O-OG1 3.12Å
158	H	48.7	Very low	44.9	Very low	118 Å²	118	114 Å²	114	55%	0.546	62%	0.622	S	S	.	*	H	α-helix	trans	-76.9	-25.3	171.2	-53.4	136.8	0	0	0	113.6	C156 W161 G162	C156-H158 PolarHBondContact O-N 3.42Å; H158-W161 PolarHBondContact O-N 3.35Å; H158-G162 PolarHBondContact O-N 2.83Å
159	V	44.8	Very low	45	Very low	47 Å²	47	112.5 Å²	112.5	29%	0.285	61%	0.612	S	S	.	*	H	α-helix	trans	-73.4	-35.2	-177.5	178.2	0	0	0	0	111.5	C156 W161 G162 I163	C156-V159 WeakPolarHBondContact O-CB 3.33Å; C156-V159 PolarHBondContact O-N 2.86Å; V159-W161 VanDerWaalsContact C-N 3.33Å; V159-W161 PolarHBondContact O-N 3.35Å; V159-G162 PolarHBondContact O-N 3.42Å; V159-G162 VanDerWaalsContact O-N 3.16Å; V159-I163 HydrophobicContact CG1-CD1 3.84Å; V159-I163 HydrophobicContact CG1-CG1 4.26Å; V159-I163 VanDerWaalsContact O-CG1 3.27Å; V159-I163 WeakPolarHBondContact O-CG1 3.5Å; V159-I163 PolarHBondContact O-N 2.9Å
160	T	42.6	Very low	44.7	Very low	91 Å²	91	112.8 Å²	112.8	56%	0.558	60%	0.603	S	S	*	*	H	α-helix	trans	-66.7	-34.4	175.9	41	0	0	0	0	112.2	H157 W164	H157-T160 PolarHBondContact O-OG1 2.8Å; H157-T160 VanDerWaalsContact O-OG1 3.12Å; T160-W164 PolarHBondContact O-N 2.93Å
161	W	38.1	Very low	44.9	Very low	206 Å²	206	108.3 Å²	108.3	78%	0.78	58%	0.583	S	S	*	*	H	α-helix	trans	-72.7	-36.6	168.3	-88.8	21.4	0	0	0	112.8	H158 V159 I163 W164 V165	H158-W161 PolarHBondContact O-N 3.35Å; V159-W161 VanDerWaalsContact C-N 3.33Å; V159-W161 PolarHBondContact O-N 3.35Å; W161-I163 PolarHBondContact O-N 3.27Å; W161-W164 PolarHBondContact O-N 2.89Å; W161-V165 WeakPolarHBondContact O-CG2 3.18Å; W161-V165 PolarHBondContact O-N 3.44Å
162	G	38.9	Very low	45.1	Very low	38 Å²	38	111 Å²	111	39%	0.392	58%	0.577	S	S	.	*	H	α-helix	trans	-63.1	-38.1	175.3	0	0	0	0	0	114	H158 V159 V165 N166	H158-G162 PolarHBondContact O-N 2.83Å; V159-G162 PolarHBondContact O-N 3.42Å; V159-G162 VanDerWaalsContact O-N 3.16Å; G162-V165 PolarHBondContact O-N 2.9Å; G162-N166 VanDerWaalsContact O-CB 3.23Å; G162-N166 WeakPolarHBondContact O-CB 3.31Å; G162-N166 PolarHBondContact O-N 3.35Å
163	I	41.7	Very low	44.8	Very low	110 Å²	110	105.6 Å²	105.6	56%	0.564	56%	0.556	S	S	*	*	H	α-helix	trans	-67.9	-37.3	176.6	-66.6	161.9	0	0	0	110.9	V159 W161 N166 K167	V159-I163 HydrophobicContact CG1-CD1 3.84Å; V159-I163 HydrophobicContact CG1-CG1 4.26Å; V159-I163 VanDerWaalsContact O-CG1 3.27Å; V159-I163 WeakPolarHBondContact O-CG1 3.5Å; V159-I163 PolarHBondContact O-N 2.9Å; W161-I163 PolarHBondContact O-N 3.27Å; I163-N166 PolarHBondContact O-N 3.5Å; I163-K167 PolarHBondContact O-N 3.39Å
164	W	40.2	Very low	45.2	Very low	219 Å²	219	103 Å²	103	83%	0.83	54%	0.544	S	S	*	.	H	α-helix	trans	-70	-38.5	177.1	-116.4	62	0	0	0	112.7	T160 W161	T160-W164 PolarHBondContact O-N 2.93Å; W161-W164 PolarHBondContact O-N 2.89Å
165	V	44.1	Very low	45.4	Very low	105 Å²	105	103.2 Å²	103.2	64%	0.636	53%	0.53	S	S	*	.	H	α-helix	trans	-68.3	-38.4	173.1	176.4	0	0	0	0	110.7	W161 G162 S168	W161-V165 WeakPolarHBondContact O-CG2 3.18Å; W161-V165 PolarHBondContact O-N 3.44Å; G162-V165 PolarHBondContact O-N 2.9Å; V165-S168 PolarHBondContact O-OG 2.92Å
166	N	44.3	Very low	45.4	Very low	105 Å²	105	101.9 Å²	101.9	56%	0.561	52%	0.519	S	S	*	.	H	α-helix	trans	-81.7	-14.7	-174.9	-151.6	12.2	0	0	0	114.9	G162 I163 S168 S169 F170	G162-N166 VanDerWaalsContact O-CB 3.23Å; G162-N166 WeakPolarHBondContact O-CB 3.31Å; G162-N166 PolarHBondContact O-N 3.35Å; I163-N166 PolarHBondContact O-N 3.5Å; N166-S168 VanDerWaalsContact C-N 3.34Å; N166-S169 VanDerWaalsContact CA-OG 3.25Å; N166-S169 WeakPolarHBondContact CA-OG 3.22Å; N166-S169 PolarHBondContact O-OG 2.83Å; N166-S169 PolarHBondContact OD1-OG 3.01Å; N166-F170 WeakPolarHBondContact O-CB 3.32Å; N166-F170 PolarHBondContact O-N 3.4Å
167	K	46.8	Very low	45.6	Very low	123 Å²	123	105.7 Å²	105.7	54%	0.535	53%	0.53	S	S	.	.	H	α-helix	trans	-65.4	-39.6	171.4	-180	162.3	175.4	43.9	0	111.4	I163 S169 F170 D171	I163-K167 PolarHBondContact O-N 3.39Å; K167-S169 PolarHBondContact O-N 3.25Å; K167-F170 PolarHBondContact O-N 3.3Å; K167-D171 WeakPolarHBondContact CG-OD2 3.5Å; K167-D171 IonicContact NZ-OD1 2.85Å; K167-D171 PolarHBondContact NZ-OD1 2.83Å; K167-D171 IonicContact NZ-OD2 2.67Å; K167-D171 PolarHBondContact NZ-OD2 3.42Å; K167-D171 WeakPolarHBondContact O-CB 3.34Å; K167-D171 PolarHBondContact O-N 2.8Å
168	S	47.9	Very low	46.3	Very low	72 Å²	72	102.1 Å²	102.1	50%	0.503	52%	0.518	S	S	.	.	H	α-helix	trans	-65.5	-38.3	179.1	70.7	0	0	0	0	113.2	V165 N166 Q172	V165-S168 PolarHBondContact O-OG 2.92Å; N166-S168 VanDerWaalsContact C-N 3.34Å; S168-Q172 VanDerWaalsContact O-CB 3.23Å; S168-Q172 WeakPolarHBondContact O-CB 3.23Å; S168-Q172 PolarHBondContact O-N 3.28Å
169	S	45.4	Very low	46.8	Very low	48 Å²	48	102.8 Å²	102.8	34%	0.336	52%	0.521	S	S	.	.	H	α-helix	trans	-74.5	-35.7	176.9	35.5	0	0	0	0	112.6	N166 K167 Q172 A173	N166-S169 VanDerWaalsContact CA-OG 3.25Å; N166-S169 WeakPolarHBondContact CA-OG 3.22Å; N166-S169 PolarHBondContact O-OG 2.83Å; N166-S169 PolarHBondContact OD1-OG 3.01Å; K167-S169 PolarHBondContact O-N 3.25Å; S169-Q172 PolarHBondContact O-N 3.11Å; S169-A173 WeakPolarHBondContact O-CB 3.17Å; S169-A173 PolarHBondContact O-N 2.89Å
170	F	43	Very low	47.1	Very low	137 Å²	137	108.1 Å²	108.1	60%	0.601	54%	0.536	S	S	*	.	H	α-helix	trans	-66.9	-47.5	173.7	-172.8	-93.4	0	0	0	111.5	N166 K167 Q172 A173 E174	N166-F170 WeakPolarHBondContact O-CB 3.32Å; N166-F170 PolarHBondContact O-N 3.4Å; K167-F170 PolarHBondContact O-N 3.3Å; F170-Q172 PolarHBondContact O-N 3.42Å; F170-A173 PolarHBondContact O-N 3.24Å; F170-A173 VanDerWaalsContact O-N 3.12Å; F170-E174 PolarHBondContact O-N 3.34Å
171	D	54.5	Low	47.5	Very low	42 Å²	42	105.8 Å²	105.8	23%	0.225	52%	0.524	C	S	.	.	H	α-helix	trans	-65.5	-26.7	178.3	-63	-13.6	0	0	0	111.4	K167 R175	K167-D171 WeakPolarHBondContact CG-OD2 3.5Å; K167-D171 IonicContact NZ-OD1 2.85Å; K167-D171 PolarHBondContact NZ-OD1 2.83Å; K167-D171 IonicContact NZ-OD2 2.67Å; K167-D171 PolarHBondContact NZ-OD2 3.42Å; K167-D171 WeakPolarHBondContact O-CB 3.34Å; K167-D171 PolarHBondContact O-N 2.8Å; D171-R175 WeakPolarHBondContact O-CB 3.35Å; D171-R175 PolarHBondContact O-N 3.28Å; D171-R175 PolarHBondContact O-NE 3.37Å; D171-R175 VanDerWaalsContact O-NE 3.11Å
172	Q	47.8	Very low	48	Very low	128 Å²	128	101.6 Å²	101.6	60%	0.598	51%	0.513	S	S	*	.	H	α-helix	trans	-78.3	-35.9	173.5	-168.6	169.1	49.9	0	0	112.4	S168 S169 F170 A176	S168-Q172 VanDerWaalsContact O-CB 3.23Å; S168-Q172 WeakPolarHBondContact O-CB 3.23Å; S168-Q172 PolarHBondContact O-N 3.28Å; S169-Q172 PolarHBondContact O-N 3.11Å; F170-Q172 PolarHBondContact O-N 3.42Å; Q172-A176 WeakPolarHBondContact O-CB 3.38Å; Q172-A176 PolarHBondContact O-N 3.26Å
173	A	45.5	Very low	48.5	Very low	59 Å²	59	102.7 Å²	102.7	49%	0.488	52%	0.519	S	S	.	.	H	α-helix	trans	-68.7	-38.2	173.3	0	0	0	0	0	111.9	S169 F170 A176 F177	S169-A173 WeakPolarHBondContact O-CB 3.17Å; S169-A173 PolarHBondContact O-N 2.89Å; F170-A173 PolarHBondContact O-N 3.24Å; F170-A173 VanDerWaalsContact O-N 3.12Å; A173-A176 PolarHBondContact O-N 2.77Å; A173-F177 WeakPolarHBondContact O-CB 3.42Å; A173-F177 PolarHBondContact O-N 3.39Å
174	E	48.9	Very low	49	Very low	110 Å²	110	102.6 Å²	102.6	51%	0.514	52%	0.519	S	S	.	.	H	α-helix	trans	-64.6	-45.1	174	-173.9	177.5	-155.1	0	0	111.3	F170 A176 F177 V178	F170-E174 PolarHBondContact O-N 3.34Å; E174-A176 PolarHBondContact O-N 2.86Å; E174-F177 WeakPolarHBondContact O-CB 3.35Å; E174-F177 PolarHBondContact O-N 3.5Å; E174-V178 WeakPolarHBondContact O-CG2 3.46Å; E174-V178 PolarHBondContact O-N 3.03Å
175	R	50.8	Low	49.4	Very low	140 Å²	140	97.6 Å²	97.6	53%	0.528	51%	0.507	S	S	.	.	H	α-helix	trans	-59.9	-45.5	172.9	-86.1	179.3	-87.1	131.7	-5.9	112.3	D171 F177 V178 E179	D171-R175 WeakPolarHBondContact O-CB 3.35Å; D171-R175 PolarHBondContact O-N 3.28Å; D171-R175 PolarHBondContact O-NE 3.37Å; D171-R175 VanDerWaalsContact O-NE 3.11Å; R175-F177 VanDerWaalsContact C-N 3.27Å; R175-F177 PolarHBondContact O-N 3.45Å; R175-V178 PolarHBondContact O-N 3.16Å; R175-E179 WeakPolarHBondContact O-CB 3.32Å; R175-E179 WeakPolarHBondContact O-CG 3.44Å; R175-E179 PolarHBondContact O-N 3.26Å
176	A	48.6	Very low	49.4	Very low	54 Å²	54	99.8 Å²	99.8	45%	0.446	52%	0.515	S	S	.	.	H	α-helix	trans	-62.4	-34.7	176.4	0	0	0	0	0	112.3	Q172 A173 E174 W180	Q172-A176 WeakPolarHBondContact O-CB 3.38Å; Q172-A176 PolarHBondContact O-N 3.26Å; A173-A176 PolarHBondContact O-N 2.77Å; E174-A176 PolarHBondContact O-N 2.86Å; A176-W180 WeakPolarHBondContact O-CB 3.42Å; A176-W180 PolarHBondContact O-N 3.19Å
177	F	51	Low	49.3	Very low	128 Å²	128	98.2 Å²	98.2	56%	0.561	52%	0.516	S	S	*	.	H	α-helix	trans	-69.5	-41	175.6	178.1	-98.5	0	0	0	112.4	A173 E174 R175 W180 S181	A173-F177 WeakPolarHBondContact O-CB 3.42Å; A173-F177 PolarHBondContact O-N 3.39Å; E174-F177 WeakPolarHBondContact O-CB 3.35Å; E174-F177 PolarHBondContact O-N 3.5Å; R175-F177 VanDerWaalsContact C-N 3.27Å; R175-F177 PolarHBondContact O-N 3.45Å; F177-W180 HydrophobicContact CD2-CE3 4.45Å; F177-S181 WeakPolarHBondContact O-CB 3.4Å; F177-S181 PolarHBondContact O-N 3.44Å; F177-S181 PolarHBondContact O-OG 3.35Å
178	V	59.3	Low	49.1	Very low	64 Å²	64	98.3 Å²	98.3	39%	0.388	53%	0.53	S	S	.	.	H	α-helix	trans	-66.7	-41.3	175.5	172.9	0	0	0	0	111	E174 R175 S181 Q182	E174-V178 WeakPolarHBondContact O-CG2 3.46Å; E174-V178 PolarHBondContact O-N 3.03Å; R175-V178 PolarHBondContact O-N 3.16Å; V178-S181 WeakPolarHBondContact CA-OG 3.29Å; V178-S181 PolarHBondContact O-OG 2.96Å; V178-Q182 WeakPolarHBondContact O-CB 3.39Å; V178-Q182 VanDerWaalsContact O-CG 3.31Å; V178-Q182 WeakPolarHBondContact O-CG 3.44Å; V178-Q182 PolarHBondContact O-N 2.92Å
179	E	58.6	Low	48.9	Very low	133 Å²	133	103 Å²	103	62%	0.621	55%	0.549	S	S	*	.	H	α-helix	trans	-68	-42	176.1	-72.6	176.1	178.4	0	0	112.1	R175 Q182 A183	R175-E179 WeakPolarHBondContact O-CB 3.32Å; R175-E179 WeakPolarHBondContact O-CG 3.44Å; R175-E179 PolarHBondContact O-N 3.26Å; E179-Q182 PolarHBondContact O-N 3.4Å; E179-A183 WeakPolarHBondContact O-CB 3.33Å; E179-A183 PolarHBondContact O-N 3.27Å
180	W	50.3	Low	48.4	Very low	158 Å²	158	104 Å²	104	60%	0.598	57%	0.567	S	S	*	*	H	α-helix	trans	-65.2	-40.4	176.9	-179.8	70.5	0	0	0	112.4	A176 F177 A183 L184	A176-W180 WeakPolarHBondContact O-CB 3.42Å; A176-W180 PolarHBondContact O-N 3.19Å; F177-W180 HydrophobicContact CD2-CE3 4.45Å; W180-A183 PolarHBondContact O-N 3.06Å; W180-L184 HydrophobicContact CD2-CD1 4.28Å; W180-L184 HydrophobicContact CH2-CD1 4.45Å; W180-L184 HydrophobicContact CZ2-CD1 3.75Å; W180-L184 PolarHBondContact O-N 2.98Å
181	S	51.2	Low	48	Very low	43 Å²	43	103.2 Å²	103.2	30%	0.301	58%	0.579	S	S	.	*	H	α-helix	trans	-68.7	-34.6	175.7	57.7	0	0	0	0	112.6	F177 V178 L185	F177-S181 WeakPolarHBondContact O-CB 3.4Å; F177-S181 PolarHBondContact O-N 3.44Å; F177-S181 PolarHBondContact O-OG 3.35Å; V178-S181 WeakPolarHBondContact CA-OG 3.29Å; V178-S181 PolarHBondContact O-OG 2.96Å; S181-L185 WeakPolarHBondContact O-CG 3.35Å; S181-L185 PolarHBondContact O-N 3.5Å
182	Q	49.5	Very low	47	Very low	118 Å²	118	111.5 Å²	111.5	55%	0.551	61%	0.607	S	S	*	*	H	α-helix	trans	-68.4	-37.7	170.4	-74.5	179.6	37.7	0	0	112.4	V178 E179 L185 L186	V178-Q182 WeakPolarHBondContact O-CB 3.39Å; V178-Q182 VanDerWaalsContact O-CG 3.31Å; V178-Q182 WeakPolarHBondContact O-CG 3.44Å; V178-Q182 PolarHBondContact O-N 2.92Å; E179-Q182 PolarHBondContact O-N 3.4Å; Q182-L185 PolarHBondContact O-N 3.27Å; Q182-L186 PolarHBondContact O-N 2.74Å
183	A	50.2	Low	46.2	Very low	61 Å²	61	117.2 Å²	117.2	50%	0.504	62%	0.623	S	S	.	*	H	α-helix	trans	-67.3	-36.2	175.5	0	0	0	0	0	112.5	E179 W180 L185 L186	E179-A183 WeakPolarHBondContact O-CB 3.33Å; E179-A183 PolarHBondContact O-N 3.27Å; W180-A183 PolarHBondContact O-N 3.06Å; A183-L185 PolarHBondContact O-N 3.45Å; A183-L186 PolarHBondContact O-N 2.81Å
184	L	51.4	Low	45.7	Very low	108 Å²	108	122.9 Å²	122.9	57%	0.565	64%	0.639	S	S	*	*	H	α-helix	trans	-64.4	-28.5	174.3	-124.3	87.2	0	0	0	112.7	W180 L186	W180-L184 HydrophobicContact CD2-CD1 4.28Å; W180-L184 HydrophobicContact CH2-CD1 4.45Å; W180-L184 HydrophobicContact CZ2-CD1 3.75Å; W180-L184 PolarHBondContact O-N 2.98Å; L184-L186 VanDerWaalsContact C-N 3.34Å
185	L	47.5	Very low	44.6	Very low	113 Å²	113	121.3 Å²	121.3	59%	0.592	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-13.6	178.2	-72.3	167.1	0	0	0	113.6	S181 Q182 A183	S181-L185 WeakPolarHBondContact O-CG 3.35Å; S181-L185 PolarHBondContact O-N 3.5Å; Q182-L185 PolarHBondContact O-N 3.27Å; A183-L185 PolarHBondContact O-N 3.45Å
186	L	45.4	Very low	43.6	Very low	152 Å²	152	121.2 Å²	121.2	80%	0.796	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	-0.5	180	-70.1	169.9	0	0	0	113.8	Q182 A183 L184	Q182-L186 PolarHBondContact O-N 2.74Å; A183-L186 PolarHBondContact O-N 2.81Å; L184-L186 VanDerWaalsContact C-N 3.34Å
187	A	41.4	Very low	43.8	Very low	71 Å²	71	123.6 Å²	123.6	59%	0.587	68%	0.678	S	S	*	*	S	Bend	trans	-75.9	126.6	176.3	0	0	0	0	0	110.8
188	P	42	Very low	42.8	Very low	126 Å²	126	124.6 Å²	124.6	82%	0.818	69%	0.69	S	S	*	*			trans	-71.8	133.9	-179.1	28.5	-31.4	0	0	0	111	G190	P188-G190 PolarHBondContact O-N 2.86Å
189	D	44.4	Very low	41.4	Very low	170 Å²	170	128 Å²	128	91%	0.909	71%	0.711	S	S	*	*			trans	-64.1	109.6	-173.1	-153.2	-4.6	0	0	0	111.7
190	G	34.5	Very low	39.9	Very low	69 Å²	69	124.7 Å²	124.7	71%	0.711	71%	0.712	S	S	*	*			trans	-97.3	100.5	-178.6	0	0	0	0	0	111.9	P188	P188-G190 PolarHBondContact O-N 2.86Å
191	S	34.4	Very low	38.9	Very low	121 Å²	121	126.8 Å²	126.8	85%	0.846	73%	0.728	S	S	*	*			trans	-50.7	139.9	-174.8	-170.8	0	0	0	0	117
192	R	33.6	Very low	37.8	Very low	216 Å²	216	133.3 Å²	133.3	82%	0.815	75%	0.754	S	S	*	*			trans	-55.1	127.3	172.2	-173.1	-174.8	-159.8	-152.3	5.2	114.3
193	R	31.5	Very low	36.9	Very low	247 Å²	247	134.7 Å²	134.7	93%	0.932	77%	0.77	S	S	*	*			trans	-151.2	125	141.1	-113.9	-175	-153.6	-103.4	2.1	112
194	Q	34.7	Very low	35.9	Very low	179 Å²	179	135.7 Å²	135.7	84%	0.836	78%	0.778	S	S	*	*			trans	-73.8	145.8	170.2	-81.5	174.2	-13.1	0	0	111.6
195	G	27.6	Very low	34.8	Very low	77 Å²	77	137.3 Å²	137.3	79%	0.794	79%	0.793	S	S	*	*			trans	-166.1	114.4	159.4	0	0	0	0	0	109.1
196	T	29.2	Very low	34.4	Very low	137 Å²	137	137.3 Å²	137.3	84%	0.84	80%	0.799	S	S	*	*			trans	-85.3	-174.1	179.8	56.1	0	0	0	0	111.2
197	P	51.9	Low	33.4	Very low	104 Å²	104	137.4 Å²	137.4	68%	0.675	80%	0.801	S	S	*	*				-117.5	170.1	-97.6	32.6	-12.9	0	0	0	112.5
198	N	29.6	Very low	32.8	Very low	150 Å²	150	142.2 Å²	142.2	80%	0.802	82%	0.815	S	S	*	*				173.2	141	129	-97.1	-29.6	0	0	0	116.2
199	T	30	Very low	32.1	Very low	136 Å²	136	140 Å²	140	83%	0.834	81%	0.808	S	S	*	*			trans	75.9	116.9	145.5	-42.9	0	0	0	0	120.7
200	G	26.9	Very low	31.3	Very low	62 Å²	62	140.8 Å²	140.8	64%	0.639	81%	0.806	S	S	*	*				127.9	110.3	121.5	0	0	0	0	0	118.8
201	Q	31	Very low	30.9	Very low	203 Å²	203	145.9 Å²	145.9	95%	0.949	81%	0.811	S	S	*	*			trans	87	113.7	140.4	-72.3	173.3	-43.8	0	0	121.8
202	Q	27.8	Very low	30.5	Very low	179 Å²	179	145.5 Å²	145.5	84%	0.836	81%	0.806	S	S	*	*			trans	-43	145.7	162.1	-57.6	-161.8	39.8	0	0	116.7
203	V	29	Very low	30.3	Very low	147 Å²	147	140.2 Å²	140.2	89%	0.891	80%	0.802	S	S	*	*				-149.4	135.6	125.1	176.5	0	0	0	0	108.6
204	A	29.5	Very low	30.5	Very low	82 Å²	82	133.9 Å²	133.9	68%	0.678	79%	0.793	S	S	*	*			trans	-109.5	141.3	-178.8	0	0	0	0	0	112
205	V	28.7	Very low	30.4	Very low	143 Å²	143	131.6 Å²	131.6	87%	0.867	79%	0.793	S	S	*	*			trans	-153.5	143.9	151.3	-178.6	0	0	0	0	108.1
206	P	39.1	Very low	30.7	Very low	112 Å²	112	133.6 Å²	133.6	73%	0.727	79%	0.79	S	S	*	*			trans	-115	167.4	-143.8	42.3	-33.3	0	0	0	117.8
207	D	25.5	Very low	30.9	Very low	154 Å²	154	134.4 Å²	134.4	82%	0.824	79%	0.789	S	S	*	*			trans	76.6	103.3	141	-109.3	-11.5	0	0	0	122.7
208	L	27.8	Very low	30.5	Very low	172 Å²	172	133.1 Å²	133.1	90%	0.901	80%	0.795	S	S	*	*			trans	-153.3	127.1	141.7	-107.2	158	0	0	0	109.6
209	A	27.2	Very low	30.7	Very low	80 Å²	80	134.2 Å²	134.2	66%	0.661	80%	0.795	S	S	*	*			trans	83	106.6	157	0	0	0	0	0	120.7
210	H	28.1	Very low	30.9	Very low	187 Å²	187	132.7 Å²	132.7	87%	0.866	79%	0.788	S	S	*	*				48.6	102.8	126.2	-77.7	71.6	0	0	0	119.2
211	Q	25.3	Very low	31.7	Very low	176 Å²	176	135.3 Å²	135.3	82%	0.822	79%	0.793	S	S	*	*			trans	-67.9	142.4	158.2	-80.1	-79.1	-19.8	0	0	112
212	P	26.8	Very low	32.3	Very low	112 Å²	112	132.3 Å²	132.3	73%	0.727	78%	0.783	S	S	*	*				-131.7	149.7	124.5	34.1	-22.1	0	0	0	113.5
213	S	28.4	Very low	33	Very low	106 Å²	106	126.4 Å²	126.4	74%	0.741	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-58.5	165.2	177	41.5	0	0	0	0	115.5
214	P	36.4	Very low	34	Very low	114 Å²	114	124 Å²	124	74%	0.74	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-87.9	157.6	-151.5	35.8	-34.7	0	0	0	114.6
215	P	32.9	Very low	34.7	Very low	130 Å²	130	126.1 Å²	126.1	84%	0.844	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-88.6	137.9	166.5	33.5	-28.7	0	0	0	112.1
216	V	32.8	Very low	35.6	Very low	120 Å²	120	124.6 Å²	124.6	73%	0.727	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-93.2	146.9	171.1	144.8	0	0	0	0	109.1
217	N	33.8	Very low	36	Very low	153 Å²	153	122.1 Å²	122.1	82%	0.818	73%	0.732	S	S	*	*			trans	95.8	109.9	164.5	-64	-28.5	0	0	0	120.2
218	G	43	Very low	36.8	Very low	78 Å²	78	120.4 Å²	120.4	80%	0.804	72%	0.722	S	S	*	*				65.3	91.4	124.1	0	0	0	0	0	119.2
219	Q	34.2	Very low	37.6	Very low	173 Å²	173	115.9 Å²	115.9	81%	0.808	70%	0.701	S	S	*	*			trans	-112.6	133.2	164.9	-77.8	-82.6	-38.1	0	0	110
220	P	34.4	Very low	38.4	Very low	103 Å²	103	119 Å²	119	67%	0.669	70%	0.696	S	S	*	*			trans	-80.8	165.8	167.2	33.9	-29.7	0	0	0	110.8	L222	P220-L222 PolarHBondContact O-N 2.86Å
221	P	43.7	Very low	39.1	Very low	117 Å²	117	117.8 Å²	117.8	76%	0.76	69%	0.691	S	S	*	*			trans	-72.3	127.1	-168.4	1.4	11.3	0	0	0	112.3	G223	P221-G223 PolarHBondContact O-N 2.85Å
222	L	43.9	Very low	40	Very low	140 Å²	140	113.9 Å²	113.9	73%	0.733	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.9	-11.9	179.4	-92.9	117	0	0	0	116.4	P220 S224	P220-L222 PolarHBondContact O-N 2.86Å; L222-S224 PolarHBondContact O-N 2.8Å
223	G	43.3	Very low	40.8	Very low	56 Å²	56	116.8 Å²	116.8	58%	0.577	68%	0.675	S	S	*	*	H	α-helix	trans	-70.5	-29	-175.3	0	0	0	0	0	115.1	P221	P221-G223 PolarHBondContact O-N 2.85Å
224	S	49.3	Very low	41.5	Very low	97 Å²	97	117.7 Å²	117.7	68%	0.678	67%	0.671	S	S	*	*	H	α-helix	trans	-82.3	-33.5	-175.7	168.8	0	0	0	0	113.2	L222 L228	L222-S224 PolarHBondContact O-N 2.8Å; S224-L228 PolarHBondContact O-N 2.81Å
225	L	44.4	Very low	41.8	Very low	126 Å²	126	117.8 Å²	117.8	66%	0.66	66%	0.662	S	S	*	*	H	α-helix	trans	-76.6	-37.5	-179	-157	80.4	0	0	0	111.5	A227 L228 V229	L225-A227 VanDerWaalsContact C-N 3.32Å; L225-A227 PolarHBondContact O-N 2.91Å; L225-L228 PolarHBondContact O-N 2.94Å; L225-V229 WeakPolarHBondContact O-CB 3.36Å; L225-V229 VanDerWaalsContact O-CG2 3.26Å; L225-V229 WeakPolarHBondContact O-CG2 3.04Å; L225-V229 PolarHBondContact O-N 3.47Å
226	Q	47.2	Very low	42.4	Very low	111 Å²	111	116.4 Å²	116.4	52%	0.519	64%	0.643	S	S	.	*	H	α-helix	trans	-69.1	-29.9	179.7	-164.3	175.1	24.4	0	0	112.7	R230	Q226-R230 WeakPolarHBondContact O-CB 3.45Å; Q226-R230 VanDerWaalsContact O-CG 3.27Å; Q226-R230 WeakPolarHBondContact O-CG 3.34Å; Q226-R230 PolarHBondContact O-N 2.99Å
227	A	46.5	Very low	43.1	Very low	60 Å²	60	114.4 Å²	114.4	50%	0.496	63%	0.632	S	S	.	*	H	α-helix	trans	-72.9	-39.8	174.4	0	0	0	0	0	112.2	L225 R230	L225-A227 VanDerWaalsContact C-N 3.32Å; L225-A227 PolarHBondContact O-N 2.91Å; A227-R230 PolarHBondContact O-N 2.94Å
228	L	43.1	Very low	43.6	Very low	118 Å²	118	116.2 Å²	116.2	62%	0.618	63%	0.628	S	S	*	*	H	α-helix	trans	-72.3	-37.4	-179.4	-156.5	73.8	0	0	0	112.4	S224 L225 V232	S224-L228 PolarHBondContact O-N 2.81Å; L225-L228 PolarHBondContact O-N 2.94Å; L228-V232 WeakPolarHBondContact O-CG2 3.29Å; L228-V232 PolarHBondContact O-N 3.19Å
229	V	44.2	Very low	43.7	Very low	76 Å²	76	119.4 Å²	119.4	46%	0.461	62%	0.616	S	S	.	*	H	α-helix	trans	-70.7	-31.9	175.2	175.2	0	0	0	0	111.4	L225 W233	L225-V229 WeakPolarHBondContact O-CB 3.36Å; L225-V229 VanDerWaalsContact O-CG2 3.26Å; L225-V229 WeakPolarHBondContact O-CG2 3.04Å; L225-V229 PolarHBondContact O-N 3.47Å; V229-W233 HydrophobicContact CG1-CB 4.43Å; V229-W233 WeakPolarHBondContact O-CB 3.27Å; V229-W233 PolarHBondContact O-N 3.4Å
230	R	45.1	Very low	44.6	Very low	147 Å²	147	113.8 Å²	113.8	56%	0.555	59%	0.592	S	S	*	*	H	α-helix	trans	-69.9	-30.3	-179.6	-89.9	178.1	154.9	174.8	-5.1	114.6	Q226 A227 L234	Q226-R230 WeakPolarHBondContact O-CB 3.45Å; Q226-R230 VanDerWaalsContact O-CG 3.27Å; Q226-R230 WeakPolarHBondContact O-CG 3.34Å; Q226-R230 PolarHBondContact O-N 2.99Å; A227-R230 PolarHBondContact O-N 2.94Å; R230-L234 WeakPolarHBondContact O-CB 3.39Å; R230-L234 VanDerWaalsContact O-CD1 3.25Å; R230-L234 WeakPolarHBondContact O-CD1 3.27Å
231	E	42.1	Very low	45.4	Very low	160 Å²	160	111 Å²	111	75%	0.748	58%	0.578	S	S	*	*	H	α-helix	trans	-92.2	-39.4	179.5	-67.2	-161.5	164.6	0	0	112.8
232	V	43.9	Very low	45.6	Very low	95 Å²	95	108.6 Å²	108.6	58%	0.576	57%	0.567	S	S	*	*	H	α-helix	trans	-81.5	-32.6	-173.7	-179	0	0	0	0	112.8	L228	L228-V232 WeakPolarHBondContact O-CG2 3.29Å; L228-V232 PolarHBondContact O-N 3.19Å
233	W	44.1	Very low	45.7	Very low	172 Å²	172	106.6 Å²	106.6	65%	0.652	55%	0.554	S	S	*	*	H	α-helix	trans	-93.7	-17.4	-175.8	-86.5	66.9	0	0	0	114.9	V229 E235 P237	V229-W233 HydrophobicContact CG1-CB 4.43Å; V229-W233 WeakPolarHBondContact O-CB 3.27Å; V229-W233 PolarHBondContact O-N 3.4Å; W233-E235 VanDerWaalsContact C-N 3.35Å; W233-P237 WeakPolarHBondContact O-CD 3.44Å
234	L	42.8	Very low	46.2	Very low	125 Å²	125	111 Å²	111	65%	0.654	55%	0.554	S	S	*	*	H	α-helix	trans	-74.8	-26.4	175.4	-114.3	121.3	0	0	0	112.7	R230	R230-L234 WeakPolarHBondContact O-CB 3.39Å; R230-L234 VanDerWaalsContact O-CD1 3.25Å; R230-L234 WeakPolarHBondContact O-CD1 3.27Å
235	E	42.6	Very low	46.3	Very low	116 Å²	116	108 Å²	108	54%	0.542	54%	0.538	S	S	.	.	H	α-helix	trans	-91.2	-18.5	-179.7	-67	-165.6	155.2	0	0	113.2	W233 R238 Y239	W233-E235 VanDerWaalsContact C-N 3.35Å; E235-R238 CarbonylContact O-C 3.57Å; E235-R238 WeakPolarHBondContact O-CA 3.46Å; E235-R238 WeakPolarHBondContact O-CB 3.31Å; E235-R238 PolarHBondContact O-N 3.09Å; E235-Y239 PolarHBondContact O-N 2.83Å
236	K	45.9	Very low	46.5	Very low	101 Å²	101	107.7 Å²	107.7	44%	0.439	53%	0.531	S	S	.	.	H	α-helix	trans	-55.8	-45.5	179.5	-175.6	170.2	-180	175.3	0	113.1	R238 Y239 D240	K236-R238 PolarHBondContact O-N 3.04Å; K236-Y239 CarbonylContact O-C 3.58Å; K236-Y239 WeakPolarHBondContact O-CB 3.33Å; K236-Y239 PolarHBondContact O-N 3.14Å; K236-Y239 VanDerWaalsContact O-N 3.12Å; K236-D240 WeakPolarHBondContact O-CB 3.47Å; K236-D240 PolarHBondContact O-N 2.94Å
237	P	47.8	Very low	46.6	Very low	79 Å²	79	108.1 Å²	108.1	51%	0.513	53%	0.529	S	S	.	.	H	α-helix	trans	-63.3	-26.5	174.3	-23.6	34.8	0	0	0	114.3	W233 A241	W233-P237 WeakPolarHBondContact O-CD 3.44Å; P237-A241 VanDerWaalsContact O-CB 3.25Å; P237-A241 WeakPolarHBondContact O-CB 3.23Å; P237-A241 PolarHBondContact O-N 3.05Å; P237-A241 VanDerWaalsContact O-N 3.08Å
238	R	44.8	Very low	46.9	Very low	190 Å²	190	111.1 Å²	111.1	72%	0.717	53%	0.533	S	S	*	.	H	α-helix	trans	-79.6	-35.9	175.9	-52.5	179.9	97.1	-177.9	6.8	110.8	E235 K236 A241 A242	E235-R238 CarbonylContact O-C 3.57Å; E235-R238 WeakPolarHBondContact O-CA 3.46Å; E235-R238 WeakPolarHBondContact O-CB 3.31Å; E235-R238 PolarHBondContact O-N 3.09Å; K236-R238 PolarHBondContact O-N 3.04Å; R238-A241 PolarHBondContact O-N 2.94Å; R238-A242 WeakPolarHBondContact O-CB 3.05Å; R238-A242 PolarHBondContact O-N 3.34Å
239	Y	43.8	Very low	47.4	Very low	146 Å²	146	109.3 Å²	109.3	57%	0.573	54%	0.535	S	S	*	.	H	α-helix	trans	-63.4	-49.8	171.2	-125.9	-88.2	0	0	0	110.8	E235 K236 A241 A242 E243	E235-Y239 PolarHBondContact O-N 2.83Å; K236-Y239 CarbonylContact O-C 3.58Å; K236-Y239 WeakPolarHBondContact O-CB 3.33Å; K236-Y239 PolarHBondContact O-N 3.14Å; K236-Y239 VanDerWaalsContact O-N 3.12Å; Y239-A241 VanDerWaalsContact C-N 3.27Å; Y239-A241 PolarHBondContact O-N 2.93Å; Y239-A242 PolarHBondContact O-N 3.21Å; Y239-A242 VanDerWaalsContact O-N 3.17Å; Y239-E243 VanDerWaalsContact O-CB 3.28Å; Y239-E243 WeakPolarHBondContact O-CB 3.25Å; Y239-E243 PolarHBondContact O-N 3.43Å
240	D	53.4	Low	47.5	Very low	55 Å²	55	110.5 Å²	110.5	29%	0.294	54%	0.538	S	S	.	.	H	α-helix	trans	-64.2	-33.6	177.6	-57.8	-19.7	0	0	0	110.9	K236 R244	K236-D240 WeakPolarHBondContact O-CB 3.47Å; K236-D240 PolarHBondContact O-N 2.94Å; D240-R244 VanDerWaalsContact O-CB 3.31Å; D240-R244 WeakPolarHBondContact O-CB 3.26Å; D240-R244 WeakPolarHBondContact O-CG 3.12Å; D240-R244 PolarHBondContact O-N 2.82Å; D240-R244 PolarHBondContact O-NH1 2.87Å
241	A	51.8	Low	47.7	Very low	45 Å²	45	111.1 Å²	111.1	37%	0.372	55%	0.545	S	S	.	.	H	α-helix	trans	-72.3	-37.7	174.2	0	0	0	0	0	113.1	P237 R238 Y239 G245	P237-A241 VanDerWaalsContact O-CB 3.25Å; P237-A241 WeakPolarHBondContact O-CB 3.23Å; P237-A241 PolarHBondContact O-N 3.05Å; P237-A241 VanDerWaalsContact O-N 3.08Å; R238-A241 PolarHBondContact O-N 2.94Å; Y239-A241 VanDerWaalsContact C-N 3.27Å; Y239-A241 PolarHBondContact O-N 2.93Å; A241-G245 PolarHBondContact O-N 3.08Å
242	A	48.7	Very low	48	Very low	65 Å²	65	108.9 Å²	108.9	54%	0.537	54%	0.538	S	S	.	.	H	α-helix	trans	-69.3	-39.1	174.8	0	0	0	0	0	111.5	R238 Y239 G245 F246	R238-A242 WeakPolarHBondContact O-CB 3.05Å; R238-A242 PolarHBondContact O-N 3.34Å; Y239-A242 PolarHBondContact O-N 3.21Å; Y239-A242 VanDerWaalsContact O-N 3.17Å; A242-G245 PolarHBondContact O-N 3.41Å; A242-F246 WeakPolarHBondContact O-CB 2.99Å; A242-F246 PolarHBondContact O-N 3.37Å
243	E	45.1	Very low	48.2	Very low	98 Å²	98	108 Å²	108	46%	0.458	55%	0.549	S	S	.	.	H	α-helix	trans	-66.5	-45.3	175.4	-173.6	173.1	-151	0	0	111.1	Y239 G245 F246 Y247	Y239-E243 VanDerWaalsContact O-CB 3.28Å; Y239-E243 WeakPolarHBondContact O-CB 3.25Å; Y239-E243 PolarHBondContact O-N 3.43Å; E243-G245 PolarHBondContact O-N 2.81Å; E243-F246 WeakPolarHBondContact O-CB 3.49Å; E243-F246 PolarHBondContact O-N 2.87Å; E243-Y247 HydrophobicContact CG-CD2 3.7Å; E243-Y247 HydrophobicContact CG-CE2 3.55Å; E243-Y247 WeakPolarHBondContact O-CD2 3.49Å; E243-Y247 PolarHBondContact O-N 3.27Å
244	R	53.3	Low	47.9	Very low	150 Å²	150	108.1 Å²	108.1	57%	0.566	56%	0.556	S	S	*	*	H	α-helix	trans	-57.4	-47.5	171	-77.5	-170.3	-51.5	-88.1	2.1	111.9	D240 F246 Y247 E248	D240-R244 VanDerWaalsContact O-CB 3.31Å; D240-R244 WeakPolarHBondContact O-CB 3.26Å; D240-R244 WeakPolarHBondContact O-CG 3.12Å; D240-R244 PolarHBondContact O-N 2.82Å; D240-R244 PolarHBondContact O-NH1 2.87Å; R244-F246 VanDerWaalsContact C-N 3.3Å; R244-F246 PolarHBondContact O-N 3.34Å; R244-Y247 PolarHBondContact O-N 3.48Å; R244-E248 WeakPolarHBondContact O-CB 3.39Å; R244-E248 PolarHBondContact O-N 3.32Å
245	G	52.7	Low	47.7	Very low	34 Å²	34	107.2 Å²	107.2	35%	0.351	56%	0.558	S	S	.	*	H	α-helix	trans	-64	-32.7	177.9	0	0	0	0	0	113.7	A241 A242 E243 A249	A241-G245 PolarHBondContact O-N 3.08Å; A242-G245 PolarHBondContact O-N 3.41Å; E243-G245 PolarHBondContact O-N 2.81Å; G245-A249 WeakPolarHBondContact O-CB 3.32Å; G245-A249 PolarHBondContact O-N 2.79Å
246	F	48.2	Very low	47.4	Very low	119 Å²	119	108.3 Å²	108.3	52%	0.522	58%	0.575	S	S	.	*	H	α-helix	trans	-67.7	-46.2	174.6	175.7	-98.6	0	0	0	111.9	A242 E243 R244 L250	A242-F246 WeakPolarHBondContact O-CB 2.99Å; A242-F246 PolarHBondContact O-N 3.37Å; E243-F246 WeakPolarHBondContact O-CB 3.49Å; E243-F246 PolarHBondContact O-N 2.87Å; R244-F246 VanDerWaalsContact C-N 3.3Å; R244-F246 PolarHBondContact O-N 3.34Å; F246-L250 HydrophobicContact CD1-CD1 4.46Å; F246-L250 HydrophobicContact CD2-CD1 4.35Å; F246-L250 HydrophobicContact CE1-CD1 4Å; F246-L250 HydrophobicContact CE2-CD1 3.88Å; F246-L250 HydrophobicContact CZ-CD1 3.69Å; F246-L250 WeakPolarHBondContact O-CB 3.32Å; F246-L250 PolarHBondContact O-N 2.84Å; F246-L250 VanDerWaalsContact O-N 3.08Å
247	Y	48.5	Very low	46.7	Very low	119 Å²	119	106.4 Å²	106.4	47%	0.467	59%	0.585	S	S	.	*	H	α-helix	trans	-73.1	-35	178	-75.2	-66	0	0	0	112.6	E243 R244 L250 F251	E243-Y247 HydrophobicContact CG-CD2 3.7Å; E243-Y247 HydrophobicContact CG-CE2 3.55Å; E243-Y247 WeakPolarHBondContact O-CD2 3.49Å; E243-Y247 PolarHBondContact O-N 3.27Å; R244-Y247 PolarHBondContact O-N 3.48Å; Y247-L250 PolarHBondContact O-N 2.99Å; Y247-F251 HydrophobicContact CD1-CD2 4.46Å; Y247-F251 HydrophobicContact CD1-CE2 4.03Å; Y247-F251 VanDerWaalsContact O-CD2 3.28Å; Y247-F251 WeakPolarHBondContact O-CD2 3.44Å; Y247-F251 PolarHBondContact O-N 3.34Å; Y247-F251 VanDerWaalsContact O-N 3.1Å
248	E	54.1	Low	46.1	Very low	123 Å²	123	113 Å²	113	58%	0.575	61%	0.605	S	S	*	*	H	α-helix	trans	-64.4	-42.1	173.9	-161.5	169.4	-152.1	0	0	110.5	R244 L250 F251 D252	R244-E248 WeakPolarHBondContact O-CB 3.39Å; R244-E248 PolarHBondContact O-N 3.32Å; E248-L250 VanDerWaalsContact C-N 3.32Å; E248-L250 PolarHBondContact O-N 3.33Å; E248-F251 PolarHBondContact O-N 3Å; E248-D252 WeakPolarHBondContact O-CB 3.34Å; E248-D252 PolarHBondContact O-N 3.22Å
249	A	52.3	Low	45.3	Very low	81 Å²	81	110.4 Å²	110.4	67%	0.669	61%	0.61	S	S	*	*	H	α-helix	trans	-70.7	-22.4	173.9	0	0	0	0	0	114.5	G245	G245-A249 WeakPolarHBondContact O-CB 3.32Å; G245-A249 PolarHBondContact O-N 2.79Å
250	L	47.6	Very low	44.7	Very low	101 Å²	101	114.5 Å²	114.5	53%	0.529	63%	0.625	S	S	.	*	H	α-helix	trans	-80.4	-29.2	176.4	-120.1	89.3	0	0	0	112.7	F246 Y247 E248	F246-L250 HydrophobicContact CD1-CD1 4.46Å; F246-L250 HydrophobicContact CD2-CD1 4.35Å; F246-L250 HydrophobicContact CE1-CD1 4Å; F246-L250 HydrophobicContact CE2-CD1 3.88Å; F246-L250 HydrophobicContact CZ-CD1 3.69Å; F246-L250 WeakPolarHBondContact O-CB 3.32Å; F246-L250 PolarHBondContact O-N 2.84Å; F246-L250 VanDerWaalsContact O-N 3.08Å; Y247-L250 PolarHBondContact O-N 2.99Å; E248-L250 VanDerWaalsContact C-N 3.32Å; E248-L250 PolarHBondContact O-N 3.33Å
251	F	47.9	Very low	43.5	Very low	159 Å²	159	120.4 Å²	120.4	70%	0.697	66%	0.655	S	S	*	*	H	α-helix	trans	-116.6	-15.9	-170.1	-69.4	-70.7	0	0	0	114.9	Y247 E248 G253	Y247-F251 HydrophobicContact CD1-CD2 4.46Å; Y247-F251 HydrophobicContact CD1-CE2 4.03Å; Y247-F251 VanDerWaalsContact O-CD2 3.28Å; Y247-F251 WeakPolarHBondContact O-CD2 3.44Å; Y247-F251 PolarHBondContact O-N 3.34Å; Y247-F251 VanDerWaalsContact O-N 3.1Å; E248-F251 PolarHBondContact O-N 3Å; F251-G253 PolarHBondContact O-N 3.17Å
252	D	49.1	Very low	42.5	Very low	113 Å²	113	126.6 Å²	126.6	60%	0.604	68%	0.676	S	S	*	*			trans	-86.3	91.6	163.3	-82.9	-15.9	0	0	0	110.3	E248 H254	E248-D252 WeakPolarHBondContact O-CB 3.34Å; E248-D252 PolarHBondContact O-N 3.22Å; D252-H254 VanDerWaalsContact C-N 3.28Å; D252-H254 PolarHBondContact O-N 2.82Å
253	G	48.9	Very low	41.5	Very low	78 Å²	78	132.9 Å²	132.9	80%	0.804	70%	0.695	S	S	*	*			trans	-65	86.7	162.8	0	0	0	0	0	111.2	F251	F251-G253 PolarHBondContact O-N 3.17Å
254	H	35.9	Very low	40.6	Very low	173 Å²	173	139 Å²	139	80%	0.801	71%	0.714	S	S	*	*			trans	-130.8	134.6	155.9	-104.4	-64	0	0	0	111.5	D252	D252-H254 VanDerWaalsContact C-N 3.28Å; D252-H254 PolarHBondContact O-N 2.82Å
255	P	39.8	Very low	39.4	Very low	107 Å²	107	136.8 Å²	136.8	70%	0.695	73%	0.727	S	S	*	*			trans	-79.2	147.7	-170.9	32.7	-32.8	0	0	0	111.3	G257	P255-G257 PolarHBondContact O-N 2.78Å
256	P	35.3	Very low	38.2	Very low	139 Å²	139	138.9 Å²	138.9	90%	0.903	75%	0.749	S	S	*	*	S	Bend	trans	-77.3	117.1	165.7	31.3	-28.3	0	0	0	109
257	G	32.7	Very low	37.3	Very low	61 Å²	61	141.5 Å²	141.5	63%	0.629	77%	0.767	S	S	*	*			trans	125.4	98	154.4	0	0	0	0	0	115.9	P255 V259	P255-G257 PolarHBondContact O-N 2.78Å; G257-V259 PolarHBondContact O-N 2.64Å
258	K	33.6	Very low	36.3	Very low	216 Å²	216	140 Å²	140	94%	0.939	78%	0.779	S	S	*	*			trans	-65.8	106.4	135	-72.4	-179	-179.2	178.9	0	106.3	R260	K258-R260 PolarHBondContact O-N 3.48Å
259	V	29.5	Very low	35.1	Very low	136 Å²	136	143.7 Å²	143.7	82%	0.824	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-62	126	170.5	168.5	0	0	0	0	108.3	G257 L261	G257-V259 PolarHBondContact O-N 2.64Å; V259-L261 PolarHBondContact O-N 2.99Å
260	R	30.1	Very low	34	Very low	233 Å²	233	143 Å²	143	88%	0.879	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-49.9	122.9	160.8	-71.7	175.1	112.9	120.9	-1.7	108.7	K258 Q262	K258-R260 PolarHBondContact O-N 3.48Å; R260-Q262 PolarHBondContact O-N 2.89Å
261	L	29.6	Very low	33.1	Very low	178 Å²	178	142.3 Å²	142.3	93%	0.932	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-66.7	122.8	157.2	-113.2	159.8	0	0	0	107.9	V259	V259-L261 PolarHBondContact O-N 2.99Å
262	Q	29.7	Very low	32.4	Very low	175 Å²	175	144.4 Å²	144.4	82%	0.818	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-80.4	128.5	179.5	176.7	167.1	25.3	0	0	109.8	R260	R260-Q262 PolarHBondContact O-N 2.89Å
263	E	27.3	Very low	31.5	Very low	198 Å²	198	149.4 Å²	149.4	93%	0.925	82%	0.82	S	S	*	*			trans	-157.4	163.6	140.3	-128.7	-179.9	162.8	0	0	111.8
264	R	27.7	Very low	30.5	Very low	227 Å²	227	149 Å²	149	86%	0.857	82%	0.816	S	S	*	*			trans	-123.3	150.9	-134.2	168.4	-177.2	178.7	179.7	0.1	110.3
265	A	26.6	Very low	30.2	Very low	102 Å²	102	152.3 Å²	152.3	84%	0.843	82%	0.821	S	S	*	*			trans	76.8	136.5	160.6	0	0	0	0	0	118.5
266	G	27.7	Very low	29.8	Very low	79 Å²	79	157.6 Å²	157.6	81%	0.814	83%	0.827	S	S	*	*			trans	143.9	89.7	156.8	0	0	0	0	0	114.7
267	L	30.1	Very low	29.6	Very low	174 Å²	174	157.4 Å²	157.4	91%	0.911	82%	0.818	S	S	*	*			trans	-56.7	142.5	160.1	-95	140.3	0	0	0	111.9
268	A	28	Very low	29.7	Very low	86 Å²	86	164.7 Å²	164.7	71%	0.711	83%	0.827	S	S	*	*			trans	64.4	146.7	142.9	0	0	0	0	0	121.3
269	E	28.5	Very low	29.6	Very low	201 Å²	201	166 Å²	166	94%	0.939	83%	0.826	S	S	*	*			trans	70.4	140.2	172.2	-56.5	-154.4	153.5	0	0	116.1
270	G	28	Very low	29.6	Very low	66 Å²	66	163 Å²	163	68%	0.68	82%	0.823	S	S	*	*			cis	150.2	139.7	12.6	0	0	0	0	0	107
271	A	29.1	Very low	29.8	Very low	88 Å²	88	163.6 Å²	163.6	73%	0.727	83%	0.825	S	S	*	*			trans	73.2	113.5	153.7	0	0	0	0	0	121.6
272	R	34.1	Very low	29.9	Very low	202 Å²	202	162.3 Å²	162.3	76%	0.762	82%	0.819	S	S	*	*				94.4	117.2	116.2	-74.2	177.4	-171.7	-146.5	1.6	121.1
273	R	30.1	Very low	30.1	Very low	219 Å²	219	161.8 Å²	161.8	83%	0.826	82%	0.821	S	S	*	*			trans	71.7	143.1	134.3	-60	-176.9	-165.8	-72	3.6	116.9
274	G	26.5	Very low	30.5	Very low	69 Å²	69	160.7 Å²	160.7	71%	0.711	82%	0.82	S	S	*	*			cis	159.3	168.3	3.4	0	0	0	0	0	111.1
275	R	30.3	Very low	30.4	Very low	242 Å²	242	153.2 Å²	153.2	91%	0.913	81%	0.814	S	S	*	*			trans	74	116.5	170.4	-57.7	-162.4	-156.7	-115.9	7.4	116.9
276	R	32.1	Very low	30.7	Very low	218 Å²	218	155 Å²	155	82%	0.823	81%	0.809	S	S	*	*				69.2	109.5	61	-154.1	-156.4	-70.3	-126.4	7.1	111.3
277	D	31.3	Very low	30.8	Very low	135 Å²	135	160.5 Å²	160.5	72%	0.722	81%	0.811	S	S	*	*				168.1	170	93.8	-127.9	-38.9	0	0	0	114.3
278	R	33.3	Very low	30.7	Very low	214 Å²	214	164 Å²	164	81%	0.808	81%	0.812	S	S	*	*			trans	-68.4	172.5	-171	-69.9	164.7	156.8	176.1	-5.2	118.8
279	R	32	Very low	30.7	Very low	243 Å²	243	164.8 Å²	164.8	92%	0.917	82%	0.818	S	S	*	*			trans	103.4	134.1	153.9	-59.3	-170.4	-77.5	-111.3	4.3	113.4
280	G	28.9	Very low	30.6	Very low	74 Å²	74	158.9 Å²	158.9	76%	0.763	81%	0.811	S	S	*	*			cis	118.6	127.7	18.2	0	0	0	0	0	109.9
281	R	34.8	Very low	30.5	Very low	245 Å²	245	163 Å²	163	93%	0.925	82%	0.817	S	S	*	*			trans	109.4	129.9	155.1	-136.3	-178.8	-63.4	-153.6	1.3	119.2
282	N	32.3	Very low	30.4	Very low	152 Å²	152	167.6 Å²	167.6	81%	0.813	82%	0.815	S	S	*	*			trans	-63.1	162.6	177.6	-50.3	-29.6	0	0	0	115.7
283	I	32.9	Very low	30.1	Very low	164 Å²	164	166.7 Å²	166.7	84%	0.841	81%	0.812	S	S	*	*			trans	-173.3	119.4	134.8	-63.7	-153.4	0	0	0	106.5
284	L	35.4	Very low	30.1	Very low	175 Å²	175	159.8 Å²	159.8	92%	0.916	80%	0.801	S	S	*	*				87.1	131.4	66.7	-151.1	85.4	0	0	0	116.6
285	G	27.3	Very low	30.1	Very low	70 Å²	70	164.3 Å²	164.3	72%	0.722	81%	0.81	S	S	*	*			trans	137.8	95.4	155.1	0	0	0	0	0	113.3
286	N	32.2	Very low	29.9	Very low	139 Å²	139	156 Å²	156	74%	0.743	80%	0.8	S	S	*	*				76	108	59.5	-155.9	29.6	0	0	0	115.2
287	K	30.4	Very low	29.5	Very low	195 Å²	195	154.8 Å²	154.8	85%	0.848	80%	0.803	S	S	*	*				170.1	152.3	113.6	-90.1	-175.8	-177.8	-178.2	0	113.8
288	R	28	Very low	29.3	Very low	248 Å²	248	152.5 Å²	152.5	94%	0.936	80%	0.803	S	S	*	*			trans	-89.3	159.3	-166.7	-64.7	166.7	171.6	167.5	-4	114.9
289	A	27.1	Very low	29.4	Very low	101 Å²	101	148.2 Å²	148.2	84%	0.835	80%	0.803	S	S	*	*				-177.6	115.3	125.5	0	0	0	0	0	107.5
290	G	26.8	Very low	29.3	Very low	78 Å²	78	142 Å²	142	80%	0.804	80%	0.797	S	S	*	*				97	139.2	77.9	0	0	0	0	0	109.1
291	L	24.7	Very low	29.3	Very low	152 Å²	152	143.2 Å²	143.2	80%	0.796	80%	0.8	S	S	*	*			cis	175.6	123	15.9	179.6	68.5	0	0	0	108.9
292	R	27.6	Very low	29	Very low	185 Å²	185	139.7 Å²	139.7	70%	0.698	80%	0.798	S	S	*	*			trans	74.9	150.8	141.4	-55.3	-77	-89.9	-138.4	-1.6	120.2
293	R	27.9	Very low	29.1	Very low	182 Å²	182	138.1 Å²	138.1	69%	0.687	80%	0.796	S	S	*	*			cis	-170	140.7	-10.8	-95.6	-126.4	-170.8	-168.9	1.1	106.5
294	A	30.3	Very low	28.8	Very low	74 Å²	74	140.6 Å²	140.6	61%	0.612	80%	0.797	S	S	*	*				71.2	138.9	106.6	0	0	0	0	0	113.9
295	D	26.2	Very low	28.5	Very low	165 Å²	165	136.9 Å²	136.9	88%	0.882	78%	0.784	S	S	*	*			cis	-148.7	166.8	36.8	-66.1	-56.2	0	0	0	110.1
296	G	26.5	Very low	28.6	Very low	68 Å²	68	143.8 Å²	143.8	70%	0.701	79%	0.79	S	S	*	*			cis	-167.8	176.3	18.2	0	0	0	0	0	116
297	E	24.5	Very low	28.6	Very low	191 Å²	191	147.1 Å²	147.1	89%	0.893	80%	0.798	S	S	*	*			trans	-5.8	124.5	169.2	-81.9	154.4	132	0	0	120.4
298	A	25.4	Very low	28.8	Very low	88 Å²	88	145.7 Å²	145.7	73%	0.727	80%	0.799	S	S	*	*				105.1	158.5	67.9	0	0	0	0	0	110.8
299	P	36.3	Very low	29	Very low	123 Å²	123	142.1 Å²	142.1	80%	0.799	79%	0.793	S	S	*	*			cis	-131.7	-177.8	-4	38.2	-18.2	0	0	0	115.6
300	S	30.6	Very low	29.5	Very low	114 Å²	114	146.9 Å²	146.9	80%	0.797	80%	0.795	S	S	*	*			trans	-51.5	143.1	177.9	55.7	0	0	0	0	118.6
301	A	27.5	Very low	30	Very low	99 Å²	99	150 Å²	150	82%	0.818	79%	0.793	S	S	*	*			trans	-151.1	112.3	142.5	0	0	0	0	0	110.4
302	L	29.4	Very low	30.5	Very low	170 Å²	170	146.7 Å²	146.7	89%	0.89	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-72.2	138	162.1	-75.8	164.6	0	0	0	108.5
303	P	34.7	Very low	31.1	Very low	120 Å²	120	146.8 Å²	146.8	78%	0.779	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-82.1	120.1	178.4	30.4	-29	0	0	0	110.2
304	Y	26.9	Very low	31.6	Very low	216 Å²	216	142.4 Å²	142.4	85%	0.847	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-86.6	130.3	167.4	-169.5	-99.1	0	0	0	109.4
305	C	29	Very low	32.1	Very low	96 Å²	96	144.2 Å²	144.2	65%	0.649	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-71.7	140.3	-173.2	-52.1	0	0	0	0	112.7
306	Y	29.7	Very low	32.9	Very low	215 Å²	215	147.8 Å²	147.8	84%	0.843	81%	0.805	S	S	*	*			trans	-106	128.3	150.1	-79.6	-80.3	0	0	0	108.7	L308	Y306-L308 PolarHBondContact O-N 3.39Å
307	F	31.6	Very low	33.8	Very low	210 Å²	210	151.6 Å²	151.6	92%	0.921	81%	0.809	S	S	*	*			trans	-62.2	115.3	176.6	-84.4	-100.1	0	0	0	110.4
308	L	33.5	Very low	35.3	Very low	165 Å²	165	145.9 Å²	145.9	86%	0.864	79%	0.79	S	S	*	*			trans	-101.4	123.5	158.4	-80.7	162.3	0	0	0	107.8	Y306	Y306-L308 PolarHBondContact O-N 3.39Å
309	Q	33.7	Very low	36.9	Very low	173 Å²	173	149 Å²	149	81%	0.808	79%	0.787	S	S	*	*			trans	-69.3	145.3	-176.8	-152.4	166	-10.8	0	0	110.3	D311	Q309-D311 PolarHBondContact O-N 3.43Å; Q309-D311 VanDerWaalsContact O-N 3.09Å
310	K	37	Very low	37.8	Very low	201 Å²	201	147.7 Å²	147.7	87%	0.874	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-1.6	-162.9	-146.6	177.3	-179.9	-176.2	0	115.7
311	D	36.8	Very low	38.7	Very low	144 Å²	144	144.7 Å²	144.7	77%	0.77	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.3	26.4	-174.5	-53.4	-48.3	0	0	0	113.1	Q309 E313	Q309-D311 PolarHBondContact O-N 3.43Å; Q309-D311 VanDerWaalsContact O-N 3.09Å; D311-E313 PolarHBondContact O-N 2.83Å
312	A	36.1	Very low	40.1	Very low	82 Å²	82	146.2 Å²	146.2	68%	0.678	75%	0.747	S	S	*	*			trans	-72.4	97	167.8	0	0	0	0	0	109.1	A314	A312-A314 PolarHBondContact O-N 3.32Å
313	E	39.8	Very low	41.3	Very low	186 Å²	186	141 Å²	141	87%	0.869	72%	0.72	S	S	*	*			trans	-55.1	121.3	169.6	-68	-174	165.9	0	0	109.5	D311 P315	D311-E313 PolarHBondContact O-N 2.83Å; E313-P315 WeakPolarHBondContact O-CD 3.39Å
314	A	38.1	Very low	42.2	Very low	91 Å²	91	138.3 Å²	138.3	75%	0.752	70%	0.703	S	S	*	*			trans	-65.6	124.4	178.3	0	0	0	0	0	109.4	A312 W316	A312-A314 PolarHBondContact O-N 3.32Å; A314-W316 PolarHBondContact O-N 3.05Å; A314-W316 VanDerWaalsContact O-N 3.15Å
315	P	41.8	Very low	43.5	Very low	112 Å²	112	130.1 Å²	130.1	73%	0.727	68%	0.68	S	S	*	*	S	Bend	trans	-70	115	174.8	-11.6	26.8	0	0	0	109	E313	E313-P315 WeakPolarHBondContact O-CD 3.39Å
316	W	41.5	Very low	44.8	Very low	239 Å²	239	129.6 Å²	129.6	91%	0.905	67%	0.668	S	S	*	*	S	Bend	trans	72.9	136	162.1	-55.9	75.4	0	0	0	116.8	A314 S318	A314-W316 PolarHBondContact O-N 3.05Å; A314-W316 VanDerWaalsContact O-N 3.15Å; W316-S318 PolarHBondContact O-N 3.07Å
317	L	46.2	Very low	46	Very low	149 Å²	149	123.6 Å²	123.6	78%	0.78	66%	0.657	S	S	*	*			trans	-37.9	120.8	179.6	-76.5	119.3	0	0	0	112.4	K319	L317-K319 PolarHBondContact O-N 2.78Å
318	S	55.5	Low	47.2	Very low	71 Å²	71	121.7 Å²	121.7	50%	0.497	64%	0.644	S	S	.	*			trans	-57.9	118.3	175.2	70.3	0	0	0	0	108.8	W316 P320 A321 Y322	W316-S318 PolarHBondContact O-N 3.07Å; S318-P320 VanDerWaalsContact O-N 3.09Å; S318-A321 WeakPolarHBondContact O-CA 3.38Å; S318-A321 WeakPolarHBondContact O-CB 3.4Å; S318-A321 PolarHBondContact O-N 3.32Å; S318-A321 WeakPolarHBondContact OG-CB 3.5Å; S318-Y322 PolarHBondContact O-N 2.85Å
319	K	58.6	Low	48.8	Very low	152 Å²	152	118.6 Å²	118.6	66%	0.661	63%	0.625	S	S	*	*	H	α-helix	trans	-45	-38.9	176.2	-171.2	173.8	174.6	71.7	0	113.2	L317 A321 Y322 D323	L317-K319 PolarHBondContact O-N 2.78Å; K319-A321 VanDerWaalsContact C-N 3.34Å; K319-A321 PolarHBondContact O-N 2.84Å; K319-Y322 PolarHBondContact O-N 2.98Å; K319-D323 PolarHBondContact O-N 3.21Å
320	P	54.9	Low	50.4	Low	96 Å²	96	115.4 Å²	115.4	62%	0.623	61%	0.609	S	S	*	*	H	α-helix	trans	-62.3	-32.5	174.2	-24.9	35.8	0	0	0	115.4	S318 S324	S318-P320 VanDerWaalsContact O-N 3.09Å; P320-S324 WeakPolarHBondContact O-CB 3.41Å; P320-S324 PolarHBondContact O-N 2.95Å
321	A	50.7	Low	51.8	Low	51 Å²	51	108.4 Å²	108.4	42%	0.421	59%	0.589	S	S	.	*	H	α-helix	trans	-75	-34	176.6	0	0	0	0	0	111.8	S318 K319 A325	S318-A321 WeakPolarHBondContact O-CA 3.38Å; S318-A321 WeakPolarHBondContact O-CB 3.4Å; S318-A321 PolarHBondContact O-N 3.32Å; S318-A321 WeakPolarHBondContact OG-CB 3.5Å; K319-A321 VanDerWaalsContact C-N 3.34Å; K319-A321 PolarHBondContact O-N 2.84Å; A321-A325 WeakPolarHBondContact O-CB 3.42Å; A321-A325 PolarHBondContact O-N 3.49Å
322	Y	56.2	Low	53	Low	132 Å²	132	103.9 Å²	103.9	52%	0.518	57%	0.572	S	S	.	*	H	α-helix	trans	-66.9	-50.8	172.9	-176.2	-88.7	0	0	0	110.7	S318 K319 S324 A325 E326	S318-Y322 PolarHBondContact O-N 2.85Å; K319-Y322 PolarHBondContact O-N 2.98Å; Y322-S324 VanDerWaalsContact C-N 3.25Å; Y322-S324 PolarHBondContact O-N 3.32Å; Y322-A325 WeakPolarHBondContact O-CA 3.42Å; Y322-A325 WeakPolarHBondContact O-CB 3.44Å; Y322-A325 PolarHBondContact O-N 2.85Å; Y322-E326 WeakPolarHBondContact O-CB 3.29Å; Y322-E326 PolarHBondContact O-N 2.68Å
323	D	56	Low	54.1	Low	61 Å²	61	103 Å²	103	33%	0.326	55%	0.554	S	S	.	*	H	α-helix	trans	-59.6	-38.9	178.4	-60.5	-12.8	0	0	0	110.7	K319 E326 C327	K319-D323 PolarHBondContact O-N 3.21Å; D323-E326 PolarHBondContact O-N 3.05Å; D323-C327 WeakPolarHBondContact O-CB 3.08Å; D323-C327 PolarHBondContact O-N 2.95Å; D323-C327 PolarHBondContact O-SG 3.24Å
324	S	53.2	Low	55.3	Low	62 Å²	62	97.1 Å²	97.1	43%	0.434	54%	0.537	S	S	.	.	H	α-helix	trans	-67.5	-33.7	174.2	-175.8	0	0	0	0	113.6	P320 Y322 R328	P320-S324 WeakPolarHBondContact O-CB 3.41Å; P320-S324 PolarHBondContact O-N 2.95Å; Y322-S324 VanDerWaalsContact C-N 3.25Å; Y322-S324 PolarHBondContact O-N 3.32Å; S324-R328 VanDerWaalsContact O-CG 3.31Å; S324-R328 WeakPolarHBondContact O-CG 3.45Å; S324-R328 PolarHBondContact O-N 3.45Å; S324-R328 PolarHBondContact O-NE 3.02Å
325	A	52.7	Low	56.6	Low	44 Å²	44	98.8 Å²	98.8	36%	0.364	53%	0.532	S	S	.	.	H	α-helix	trans	-71.2	-41.3	174.3	0	0	0	0	0	111.4	A321 Y322 R328 H329	A321-A325 WeakPolarHBondContact O-CB 3.42Å; A321-A325 PolarHBondContact O-N 3.49Å; Y322-A325 WeakPolarHBondContact O-CA 3.42Å; Y322-A325 WeakPolarHBondContact O-CB 3.44Å; Y322-A325 PolarHBondContact O-N 2.85Å; A325-R328 PolarHBondContact O-N 2.74Å; A325-H329 PolarHBondContact O-N 2.75Å
326	E	56.5	Low	58	Low	85 Å²	85	100.2 Å²	100.2	40%	0.397	52%	0.523	S	S	.	.	H	α-helix	trans	-65	-43.7	177.5	-170.2	168.9	-135.9	0	0	111.5	Y322 D323 R328 H329 H330	Y322-E326 WeakPolarHBondContact O-CB 3.29Å; Y322-E326 PolarHBondContact O-N 2.68Å; D323-E326 PolarHBondContact O-N 3.05Å; E326-R328 VanDerWaalsContact C-N 3.32Å; E326-R328 PolarHBondContact O-N 2.87Å; E326-H329 WeakPolarHBondContact O-CB 3.18Å; E326-H329 PolarHBondContact O-N 3.44Å; E326-H330 PolarHBondContact O-CD2 3.46Å; E326-H330 VanDerWaalsContact O-CD2 3.28Å; E326-H330 PolarHBondContact O-N 2.9Å
327	C	54.8	Low	59.3	Low	90 Å²	90	93 Å²	93	61%	0.608	51%	0.505	S	S	*	.	H	α-helix	trans	-59.4	-40.6	172.4	-70.9	0	0	0	0	112.6	D323 A331	D323-C327 WeakPolarHBondContact O-CB 3.08Å; D323-C327 PolarHBondContact O-N 2.95Å; D323-C327 PolarHBondContact O-SG 3.24Å; C327-A331 VanDerWaalsContact O-CB 3.29Å; C327-A331 WeakPolarHBondContact O-CB 3.36Å; C327-A331 PolarHBondContact O-N 2.81Å
328	R	58.5	Low	60.3	Low	170 Å²	170	88.3 Å²	88.3	64%	0.642	49%	0.488	S	S	*	.	H	α-helix	trans	-68.6	-35.5	177.2	-75.6	-176.1	-66.5	164.4	1.1	112.1	S324 A325 E326 A332	S324-R328 VanDerWaalsContact O-CG 3.31Å; S324-R328 WeakPolarHBondContact O-CG 3.45Å; S324-R328 PolarHBondContact O-N 3.45Å; S324-R328 PolarHBondContact O-NE 3.02Å; A325-R328 PolarHBondContact O-N 2.74Å; E326-R328 VanDerWaalsContact C-N 3.32Å; E326-R328 PolarHBondContact O-N 2.87Å; R328-A332 WeakPolarHBondContact O-CB 3.46Å; R328-A332 PolarHBondContact O-N 3.01Å
329	H	67.1	Low	60.8	Low	100 Å²	100	94 Å²	94	46%	0.463	50%	0.498	S	S	.	.	H	α-helix	trans	-62.3	-54.6	175.4	-176	73.2	0	0	0	110.8	A325 E326 A331 A332 E333	A325-H329 PolarHBondContact O-N 2.75Å; E326-H329 WeakPolarHBondContact O-CB 3.18Å; E326-H329 PolarHBondContact O-N 3.44Å; H329-A331 VanDerWaalsContact C-N 3.33Å; H329-A331 PolarHBondContact O-N 3.25Å; H329-A332 WeakPolarHBondContact O-CB 3.43Å; H329-A332 PolarHBondContact O-N 3.15Å; H329-A332 VanDerWaalsContact O-N 3.11Å; H329-E333 IonicContact CE1-OE1 3.97Å; H329-E333 IonicContact NE2-OE1 2.66Å; H329-E333 VanDerWaalsContact O-CG 3.32Å; H329-E333 WeakPolarHBondContact O-CG 3.42Å; H329-E333 PolarHBondContact O-N 2.81Å
330	H	66.8	Low	61	Low	105 Å²	105	90.7 Å²	90.7	49%	0.486	49%	0.494	S	S	.	.	H	α-helix	trans	-65.3	-33.8	180	-70.5	-60.7	0	0	0	113.3	E326 E333 A334	E326-H330 PolarHBondContact O-CD2 3.46Å; E326-H330 VanDerWaalsContact O-CD2 3.28Å; E326-H330 PolarHBondContact O-N 2.9Å; H330-E333 PolarHBondContact O-N 2.96Å; H330-A334 WeakPolarHBondContact O-CB 3.3Å; H330-A334 PolarHBondContact O-N 2.84Å
331	A	66	Low	61.3	Low	55 Å²	55	91.4 Å²	91.4	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-64.6	-40	172.4	0	0	0	0	0	112.4	C327 H329 L335	C327-A331 VanDerWaalsContact O-CB 3.29Å; C327-A331 WeakPolarHBondContact O-CB 3.36Å; C327-A331 PolarHBondContact O-N 2.81Å; H329-A331 VanDerWaalsContact C-N 3.33Å; H329-A331 PolarHBondContact O-N 3.25Å; A331-L335 WeakPolarHBondContact O-CG 3.22Å; A331-L335 PolarHBondContact O-N 3.14Å; A331-L335 VanDerWaalsContact O-N 3.11Å
332	A	63.1	Low	61.5	Low	48 Å²	48	94.9 Å²	94.9	40%	0.397	50%	0.499	S	S	.	.	H	α-helix	trans	-68.3	-38.2	175.3	0	0	0	0	0	111.9	R328 H329 L335 R336	R328-A332 WeakPolarHBondContact O-CB 3.46Å; R328-A332 PolarHBondContact O-N 3.01Å; H329-A332 WeakPolarHBondContact O-CB 3.43Å; H329-A332 PolarHBondContact O-N 3.15Å; H329-A332 VanDerWaalsContact O-N 3.11Å; A332-L335 PolarHBondContact O-N 3.15Å; A332-R336 WeakPolarHBondContact O-CG 3.48Å; A332-R336 PolarHBondContact O-N 3.46Å
333	E	58.9	Low	61.4	Low	65 Å²	65	91 Å²	91	30%	0.304	49%	0.494	S	S	.	.	H	α-helix	trans	-64.5	-43.8	174.8	-62.3	-145.1	125.6	0	0	112.1	H329 H330 L335 R336 V337	H329-E333 IonicContact CE1-OE1 3.97Å; H329-E333 IonicContact NE2-OE1 2.66Å; H329-E333 VanDerWaalsContact O-CG 3.32Å; H329-E333 WeakPolarHBondContact O-CG 3.42Å; H329-E333 PolarHBondContact O-N 2.81Å; H330-E333 PolarHBondContact O-N 2.96Å; E333-L335 VanDerWaalsContact C-N 3.3Å; E333-L335 PolarHBondContact O-N 2.95Å; E333-R336 VanDerWaalsContact CD-NH2 3.35Å; E333-R336 PolarHBondContact O-N 3.28Å; E333-R336 VanDerWaalsContact O-N 3.17Å; E333-R336 IonicContact OE1-CZ 3.73Å; E333-R336 IonicContact OE1-NH1 4Å; E333-R336 IonicContact OE1-NH2 2.76Å; E333-R336 PolarHBondContact OE1-NH2 2.95Å; E333-V337 WeakPolarHBondContact O-CG2 3.23Å; E333-V337 PolarHBondContact O-N 3.32Å
334	A	65.3	Low	61.3	Low	62 Å²	62	91.2 Å²	91.2	51%	0.512	50%	0.504	S	S	.	.	H	α-helix	trans	-59.9	-40.1	175.8	0	0	0	0	0	111.9	H330 V337 A338	H330-A334 WeakPolarHBondContact O-CB 3.3Å; H330-A334 PolarHBondContact O-N 2.84Å; A334-V337 PolarHBondContact O-N 2.8Å; A334-A338 WeakPolarHBondContact O-CB 3.24Å; A334-A338 PolarHBondContact O-N 3.21Å
335	L	65	Low	61.2	Low	125 Å²	125	92.8 Å²	92.8	65%	0.654	52%	0.515	S	S	*	.	H	α-helix	trans	-67.8	-37.5	175.3	-74.4	170.3	0	0	0	112.8	A331 A332 E333 A338 W339	A331-L335 WeakPolarHBondContact O-CG 3.22Å; A331-L335 PolarHBondContact O-N 3.14Å; A331-L335 VanDerWaalsContact O-N 3.11Å; A332-L335 PolarHBondContact O-N 3.15Å; E333-L335 VanDerWaalsContact C-N 3.3Å; E333-L335 PolarHBondContact O-N 2.95Å; L335-A338 PolarHBondContact O-N 3.38Å; L335-W339 WeakPolarHBondContact O-CB 3.39Å; L335-W339 PolarHBondContact O-N 3.13Å
336	R	70.4	Confident	61	Low	143 Å²	143	97.4 Å²	97.4	54%	0.54	53%	0.534	S	S	.	.	H	α-helix	trans	-64.9	-42.3	173.2	-70.7	-174.1	-35.8	-141	0.7	111.5	A332 E333 W339 C340	A332-R336 WeakPolarHBondContact O-CG 3.48Å; A332-R336 PolarHBondContact O-N 3.46Å; E333-R336 VanDerWaalsContact CD-NH2 3.35Å; E333-R336 PolarHBondContact O-N 3.28Å; E333-R336 VanDerWaalsContact O-N 3.17Å; E333-R336 IonicContact OE1-CZ 3.73Å; E333-R336 IonicContact OE1-NH1 4Å; E333-R336 IonicContact OE1-NH2 2.76Å; E333-R336 PolarHBondContact OE1-NH2 2.95Å; R336-W339 PolarHBondContact O-N 2.66Å; R336-C340 WeakPolarHBondContact O-CB 3.45Å; R336-C340 PolarHBondContact O-N 3.36Å; R336-C340 PolarHBondContact O-SG 3.49Å
337	V	69.1	Low	60.4	Low	86 Å²	86	98 Å²	98	52%	0.521	55%	0.547	S	S	.	.	H	α-helix	trans	-65.6	-42.2	178	172.8	0	0	0	0	110.6	E333 A334 W339 C340 L341	E333-V337 WeakPolarHBondContact O-CG2 3.23Å; E333-V337 PolarHBondContact O-N 3.32Å; A334-V337 PolarHBondContact O-N 2.8Å; V337-W339 PolarHBondContact O-N 3.45Å; V337-C340 PolarHBondContact O-N 2.89Å; V337-L341 HydrophobicContact CG1-CD1 3.88Å; V337-L341 WeakPolarHBondContact O-CD1 3.09Å; V337-L341 WeakPolarHBondContact O-CG 3.25Å; V337-L341 PolarHBondContact O-N 2.88Å
338	A	67.8	Low	59.7	Low	51 Å²	51	102.3 Å²	102.3	42%	0.421	56%	0.558	S	S	.	*	H	α-helix	trans	-60.7	-43.9	173.6	0	0	0	0	0	112.1	A334 L335 C340 L341 E342	A334-A338 WeakPolarHBondContact O-CB 3.24Å; A334-A338 PolarHBondContact O-N 3.21Å; L335-A338 PolarHBondContact O-N 3.38Å; A338-C340 PolarHBondContact O-N 3.43Å; A338-L341 PolarHBondContact O-N 3.12Å; A338-E342 WeakPolarHBondContact O-CB 3.25Å; A338-E342 PolarHBondContact O-N 3.39Å
339	W	65.4	Low	58.7	Low	190 Å²	190	105.5 Å²	105.5	72%	0.72	57%	0.57	S	S	*	*	H	α-helix	trans	-63.2	-39.5	175.6	-176.8	-86.8	0	0	0	112.6	L335 R336 V337 E342 A343	L335-W339 WeakPolarHBondContact O-CB 3.39Å; L335-W339 PolarHBondContact O-N 3.13Å; R336-W339 PolarHBondContact O-N 2.66Å; V337-W339 PolarHBondContact O-N 3.45Å; W339-E342 PolarHBondContact O-N 3.24Å; W339-A343 VanDerWaalsContact O-CB 3.29Å; W339-A343 WeakPolarHBondContact O-CB 3.34Å; W339-A343 PolarHBondContact O-N 2.79Å
340	C	62.4	Low	57.4	Low	83 Å²	83	106.7 Å²	106.7	56%	0.561	59%	0.586	S	S	*	*	H	α-helix	trans	-66.6	-36.2	175.6	-73	0	0	0	0	112.6	R336 V337 A338 A344	R336-C340 WeakPolarHBondContact O-CB 3.45Å; R336-C340 PolarHBondContact O-N 3.36Å; R336-C340 PolarHBondContact O-SG 3.49Å; V337-C340 PolarHBondContact O-N 2.89Å; A338-C340 PolarHBondContact O-N 3.43Å; C340-A344 PolarHBondContact O-N 2.83Å; C340-A344 VanDerWaalsContact O-N 3.08Å
341	L	60.6	Low	56	Low	111 Å²	111	105.2 Å²	105.2	58%	0.581	60%	0.599	S	S	*	*	H	α-helix	trans	-71.8	-36.6	175.5	-76.1	159.7	0	0	0	112.5	V337 A338 A344 S345	V337-L341 HydrophobicContact CG1-CD1 3.88Å; V337-L341 WeakPolarHBondContact O-CD1 3.09Å; V337-L341 WeakPolarHBondContact O-CG 3.25Å; V337-L341 PolarHBondContact O-N 2.88Å; A338-L341 PolarHBondContact O-N 3.12Å; L341-A344 PolarHBondContact O-N 2.86Å; L341-S345 PolarHBondContact O-N 2.83Å; L341-S345 VanDerWaalsContact O-N 3.13Å; L341-S345 PolarHBondContact O-OG 3.07Å
342	E	55	Low	55	Low	125 Å²	125	108.4 Å²	108.4	58%	0.584	62%	0.615	S	S	*	*	H	α-helix	trans	-70.2	-37.9	175.1	-160.3	175.1	-169.3	0	0	111.4	A338 W339 A344 S345 L346	A338-E342 WeakPolarHBondContact O-CB 3.25Å; A338-E342 PolarHBondContact O-N 3.39Å; W339-E342 PolarHBondContact O-N 3.24Å; E342-A344 PolarHBondContact O-N 3.12Å; E342-S345 PolarHBondContact O-N 3.35Å; E342-L346 PolarHBondContact O-N 2.96Å
343	A	54.8	Low	53.6	Low	50 Å²	50	117.5 Å²	117.5	41%	0.413	64%	0.639	S	S	.	*	H	α-helix	trans	-64.6	-35.9	172.4	0	0	0	0	0	113	W339 S345 L346	W339-A343 VanDerWaalsContact O-CB 3.29Å; W339-A343 WeakPolarHBondContact O-CB 3.34Å; W339-A343 PolarHBondContact O-N 2.79Å; A343-S345 VanDerWaalsContact C-N 3.32Å; A343-L346 PolarHBondContact O-N 3.05Å
344	A	53.2	Low	52.3	Low	65 Å²	65	120.4 Å²	120.4	54%	0.537	67%	0.667	S	S	.	*	H	α-helix	trans	-69.6	-29.4	173.9	0	0	0	0	0	112.7	C340 L341 E342 L346	C340-A344 PolarHBondContact O-N 2.83Å; C340-A344 VanDerWaalsContact O-N 3.08Å; L341-A344 PolarHBondContact O-N 2.86Å; E342-A344 PolarHBondContact O-N 3.12Å; A344-L346 VanDerWaalsContact C-N 3.33Å
345	S	51.4	Low	50.7	Low	95 Å²	95	121.1 Å²	121.1	66%	0.664	68%	0.68	S	S	*	*	H	α-helix	trans	-75.6	-19.8	178.6	-59.3	0	0	0	0	113.4	L341 E342 A343	L341-S345 PolarHBondContact O-N 2.83Å; L341-S345 VanDerWaalsContact O-N 3.13Å; L341-S345 PolarHBondContact O-OG 3.07Å; E342-S345 PolarHBondContact O-N 3.35Å; A343-S345 VanDerWaalsContact C-N 3.32Å
346	L	49.8	Very low	49	Very low	142 Å²	142	123.5 Å²	123.5	74%	0.743	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-4.8	177.7	-77.3	158.3	0	0	0	114	E342 A343 A344	E342-L346 PolarHBondContact O-N 2.96Å; A343-L346 PolarHBondContact O-N 3.05Å; A344-L346 VanDerWaalsContact C-N 3.33Å
347	S	43.8	Very low	47	Very low	96 Å²	96	122 Å²	122	67%	0.671	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-4.2	179	-63.8	0	0	0	0	115.2
348	H	38.9	Very low	45.3	Very low	181 Å²	181	124.3 Å²	124.3	84%	0.838	72%	0.718	S	S	*	*	S	Bend	trans	-125.1	75.4	177.6	-85.1	-71.2	0	0	0	113.3
349	R	37.1	Very low	43.7	Very low	237 Å²	237	127.2 Å²	127.2	89%	0.894	74%	0.735	S	S	*	*			trans	-156.6	131.3	148.6	-108.6	-161.3	-174.6	-128.1	3.9	112.2
350	P	39.8	Very low	42.4	Very low	126 Å²	126	123.3 Å²	123.3	82%	0.818	74%	0.737	S	S	*	*			trans	-85.6	142.5	170.5	9	8.7	0	0	0	111.8
351	G	37.9	Very low	41	Very low	73 Å²	73	126.8 Å²	126.8	75%	0.753	75%	0.749	S	S	*	*			trans	-72.3	-167.3	-176.6	0	0	0	0	0	115.9
352	P	46.4	Very low	39.9	Very low	122 Å²	122	133.4 Å²	133.4	79%	0.792	77%	0.766	S	S	*	*			cis	-146.4	165.3	42.7	37.4	-15.3	0	0	0	119.6
353	R	32.1	Very low	38.9	Very low	239 Å²	239	133.2 Å²	133.2	90%	0.902	78%	0.776	S	S	*	*			trans	51.3	114.7	148.1	-69.7	179.9	176.8	-125.3	-0.8	122
354	S	31.6	Very low	37.9	Very low	127 Å²	127	136 Å²	136	89%	0.888	78%	0.784	S	S	*	*				-168.4	141.7	106.3	-77.9	0	0	0	0	110.4
355	G	31.4	Very low	37.5	Very low	76 Å²	76	144.1 Å²	144.1	78%	0.784	80%	0.801	S	S	*	*			trans	-79.7	159.8	-156.5	0	0	0	0	0	116.4
356	L	30	Very low	37	Very low	176 Å²	176	147.5 Å²	147.5	92%	0.921	80%	0.803	S	S	*	*			trans	-154.4	142	143.7	-95.9	166.1	0	0	0	108.3
357	S	29.4	Very low	36.7	Very low	111 Å²	111	147.5 Å²	147.5	78%	0.776	80%	0.801	S	S	*	*			trans	-62.6	125.8	-164.6	-170.5	0	0	0	0	114.5
358	V	32.9	Very low	36.6	Very low	135 Å²	135	146.5 Å²	146.5	82%	0.818	80%	0.798	S	S	*	*			trans	-95.4	107.5	167.8	177.9	0	0	0	0	108.4
359	S	34.9	Very low	36.7	Very low	112 Å²	112	142.4 Å²	142.4	78%	0.783	79%	0.787	S	S	*	*			trans	-157.1	84.4	162.7	-75.6	0	0	0	0	110
360	S	37.4	Very low	37	Very low	107 Å²	107	136.4 Å²	136.4	75%	0.748	77%	0.772	S	S	*	*			trans	-167.1	152	144.6	-162.5	0	0	0	0	110.1
361	L	32.9	Very low	36.9	Very low	157 Å²	157	138.3 Å²	138.3	82%	0.822	77%	0.768	S	S	*	*			trans	86.9	68.7	174.9	-47.8	176.2	0	0	0	116.7
362	R	36.7	Very low	37.3	Very low	249 Å²	249	140.7 Å²	140.7	94%	0.94	76%	0.763	S	S	*	*			trans	-97.3	119.5	141.4	-76.1	-164.8	-178.1	-167.9	2.6	109.4	N364	R362-N364 PolarHBondContact O-N 2.98Å
363	P	33.9	Very low	37.3	Very low	121 Å²	121	138.6 Å²	138.6	79%	0.786	76%	0.755	S	S	*	*			trans	-80.1	105	160.8	-13.5	30.2	0	0	0	110.7	R365	P363-R365 PolarHBondContact O-N 2.94Å
364	N	34.8	Very low	37.9	Very low	108 Å²	108	135.3 Å²	135.3	58%	0.578	75%	0.75	S	S	*	*			trans	12.2	86.8	150	-150.9	-15.7	0	0	0	119.9	R362 K366	R362-N364 PolarHBondContact O-N 2.98Å; N364-K366 PolarHBondContact O-N 3.16Å; N364-K366 WeakPolarHBondContact OD1-CB 3.27Å; N364-K366 PolarHBondContact OD1-N 3.5Å; N364-K366 VanDerWaalsContact OD1-N 3.14Å
365	R	43.8	Very low	38.6	Very low	237 Å²	237	134 Å²	134	89%	0.894	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	7.8	164.4	-80.2	177.5	87.5	175.5	6.2	114.5	P363	P363-R365 PolarHBondContact O-N 2.94Å
366	K	42	Very low	39.5	Very low	166 Å²	166	138.3 Å²	138.3	72%	0.722	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-5	-170.2	-61.3	-176.5	178.7	-178.4	0	115.3	N364 N370	N364-K366 PolarHBondContact O-N 3.16Å; N364-K366 WeakPolarHBondContact OD1-CB 3.27Å; N364-K366 PolarHBondContact OD1-N 3.5Å; N364-K366 VanDerWaalsContact OD1-N 3.14Å; K366-N370 PolarHBondContact O-ND2 2.92Å
367	M	42.8	Very low	40.5	Very low	142 Å²	142	134.8 Å²	134.8	70%	0.7	71%	0.708	S	S	*	*	S	Bend	trans	-104.7	-11.1	179.9	-66.5	-135.7	-68.1	0	0	114.9
368	A	41.3	Very low	41.4	Very low	74 Å²	74	139.4 Å²	139.4	61%	0.612	71%	0.709	S	S	*	*	S	Bend	trans	-79.4	-21.8	176.9	0	0	0	0	0	113.2
369	T	41.9	Very low	42.1	Very low	96 Å²	96	140.2 Å²	140.2	59%	0.589	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-12.1	-175.8	55.4	0	0	0	0	114.2
370	N	43.5	Very low	42.9	Very low	111 Å²	111	136.8 Å²	136.8	59%	0.594	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-14.3	-176.9	-71.2	-44.6	0	0	0	114.1	K366	K366-N370 PolarHBondContact O-ND2 2.92Å
371	F	38.2	Very low	44.2	Very low	165 Å²	165	136.8 Å²	136.8	72%	0.724	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-29.2	174.5	-101.5	-90	0	0	0	113.1	A373	F371-A373 PolarHBondContact O-N 2.88Å
372	L	45.4	Very low	45.9	Very low	124 Å²	124	135.6 Å²	135.6	65%	0.649	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-10	178.8	-67.2	169.1	0	0	0	114
373	A	46.1	Very low	47.4	Very low	77 Å²	77	129 Å²	129	64%	0.636	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-17.2	-178.2	0	0	0	0	0	113.7	F371	F371-A373 PolarHBondContact O-N 2.88Å
374	H	45.1	Very low	48.6	Very low	171 Å²	171	130.4 Å²	130.4	79%	0.792	62%	0.618	S	S	*	*	S	Bend	trans	-106.4	-1.7	-178	-70.9	84	0	0	0	113.9	K376	H374-K376 PolarHBondContact O-N 3.48Å
375	E	45.4	Very low	50.4	Low	99 Å²	99	128.2 Å²	128.2	46%	0.463	61%	0.607	S	S	.	*			trans	-100	87.6	179.3	-67	-176.3	178.7	0	0	110.5	I377	E375-I377 PolarHBondContact O-N 3.47Å; E375-I377 VanDerWaalsContact O-N 3.17Å
376	K	51.3	Low	51.7	Low	166 Å²	166	119.9 Å²	119.9	72%	0.722	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-12.3	167	-79.9	-177.2	175.6	-179.6	0	113.1	H374 W378 F379 D380	H374-K376 PolarHBondContact O-N 3.48Å; K376-W378 PolarHBondContact O-N 3.43Å; K376-F379 PolarHBondContact O-N 2.95Å; K376-D380 PolarHBondContact O-N 2.96Å
377	I	50.6	Low	53	Low	102 Å²	102	114.6 Å²	114.6	52%	0.523	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.1	-38.9	-169.9	-56.9	166.9	0	0	0	111.2	E375 D380 K381	E375-I377 PolarHBondContact O-N 3.47Å; E375-I377 VanDerWaalsContact O-N 3.17Å; I377-D380 PolarHBondContact O-N 2.68Å; I377-K381 PolarHBondContact O-N 3.46Å
378	W	47.7	Very low	54	Low	209 Å²	209	112.9 Å²	112.9	79%	0.792	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-29.4	-179.9	-157.2	59.1	0	0	0	112.9	K376 D380	K376-W378 PolarHBondContact O-N 3.43Å; W378-D380 VanDerWaalsContact C-N 3.35Å
379	F	49.3	Very low	55.5	Low	151 Å²	151	116.7 Å²	116.7	66%	0.662	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-21.9	175.5	-73.8	-78.9	0	0	0	113.4	K376 F382	K376-F379 PolarHBondContact O-N 2.95Å; F379-F382 VanDerWaalsContact O-CD1 3.25Å; F379-F382 WeakPolarHBondContact O-CD1 3.27Å; F379-F382 VanDerWaalsContact O-CE1 3.31Å; F379-F382 WeakPolarHBondContact O-CE1 3.36Å
380	D	51.8	Low	56.8	Low	41 Å²	41	119.3 Å²	119.3	22%	0.219	56%	0.555	C	S	.	*	T	Hydrogen-bonded Turn	trans	-98.2	0.7	-179.4	-73.4	-31.5	0	0	0	113.3	K376 I377 W378 F382 K383 Y384	K376-D380 PolarHBondContact O-N 2.96Å; I377-D380 PolarHBondContact O-N 2.68Å; W378-D380 VanDerWaalsContact C-N 3.35Å; D380-F382 PolarHBondContact O-N 3.45Å; D380-F382 VanDerWaalsContact O-N 3.13Å; D380-K383 HydrophobicContact CB-CD 4.27Å; D380-K383 WeakPolarHBondContact O-CA 3.44Å; D380-K383 VanDerWaalsContact O-CB 3.3Å; D380-K383 WeakPolarHBondContact O-CB 3.46Å; D380-K383 PolarHBondContact O-N 3.24Å; D380-K383 WeakPolarHBondContact OD1-CD 3.39Å; D380-K383 VanDerWaalsContact OD1-CE 3.25Å; D380-K383 WeakPolarHBondContact OD1-CE 3.36Å; D380-K383 IonicContact OD1-NZ 3.46Å; D380-K383 PolarHBondContact OD1-NZ 2.83Å; D380-Y384 HydrophobicContact CB-CD2 4.39Å; D380-Y384 HydrophobicContact CB-CE2 3.92Å; D380-Y384 WeakPolarHBondContact O-CD2 3.48Å; D380-Y384 PolarHBondContact O-N 3.03Å
381	K	64.7	Low	57.9	Low	107 Å²	107	119.6 Å²	119.6	47%	0.465	55%	0.551	S	S	.	*	H	α-helix	trans	-49.8	-41.1	177.5	-171.9	-171.6	-179.3	-52.9	0	112.5	I377 K383 Y384 D385	I377-K381 PolarHBondContact O-N 3.46Å; K381-K383 PolarHBondContact O-N 3.24Å; K381-Y384 PolarHBondContact O-N 2.96Å; K381-Y384 VanDerWaalsContact O-N 3.13Å; K381-D385 IonicContact NZ-OD1 3.98Å; K381-D385 PolarHBondContact NZ-OD1 3.13Å; K381-D385 IonicContact NZ-OD2 3.66Å; K381-D385 PolarHBondContact NZ-OD2 3.39Å; K381-D385 VanDerWaalsContact O-CG 3.24Å; K381-D385 PolarHBondContact O-N 2.98Å
382	F	66.8	Low	59.2	Low	131 Å²	131	117.7 Å²	117.7	58%	0.575	54%	0.54	S	S	*	.	H	α-helix	trans	-63.1	-29.2	178.5	81.7	-89.2	0	0	0	113	F379 D380 D386	F379-F382 VanDerWaalsContact O-CD1 3.25Å; F379-F382 WeakPolarHBondContact O-CD1 3.27Å; F379-F382 VanDerWaalsContact O-CE1 3.31Å; F379-F382 WeakPolarHBondContact O-CE1 3.36Å; D380-F382 PolarHBondContact O-N 3.45Å; D380-F382 VanDerWaalsContact O-N 3.13Å; F382-D386 VanDerWaalsContact O-CB 3.23Å; F382-D386 WeakPolarHBondContact O-CB 3.29Å; F382-D386 PolarHBondContact O-N 3.04Å
383	K	69.5	Low	60.3	Low	111 Å²	111	117.5 Å²	117.5	48%	0.483	54%	0.536	S	S	.	.	H	α-helix	trans	-74.5	-34.9	176.6	-59.1	177.9	-177.8	160.5	0	111.2	D380 K381 A387	D380-K383 HydrophobicContact CB-CD 4.27Å; D380-K383 WeakPolarHBondContact O-CA 3.44Å; D380-K383 VanDerWaalsContact O-CB 3.3Å; D380-K383 WeakPolarHBondContact O-CB 3.46Å; D380-K383 PolarHBondContact O-N 3.24Å; D380-K383 WeakPolarHBondContact OD1-CD 3.39Å; D380-K383 VanDerWaalsContact OD1-CE 3.25Å; D380-K383 WeakPolarHBondContact OD1-CE 3.36Å; D380-K383 IonicContact OD1-NZ 3.46Å; D380-K383 PolarHBondContact OD1-NZ 2.83Å; K381-K383 PolarHBondContact O-N 3.24Å; K383-A387 VanDerWaalsContact O-CB 3.24Å; K383-A387 WeakPolarHBondContact O-CB 3.34Å; K383-A387 PolarHBondContact O-N 3.4Å
384	Y	58.4	Low	61.2	Low	151 Å²	151	121.7 Å²	121.7	59%	0.592	54%	0.542	S	S	*	.	H	α-helix	trans	-70.7	-44.2	173.7	-66	-75.6	0	0	0	111.3	D380 K381 D386 A387 E388	D380-Y384 HydrophobicContact CB-CD2 4.39Å; D380-Y384 HydrophobicContact CB-CE2 3.92Å; D380-Y384 WeakPolarHBondContact O-CD2 3.48Å; D380-Y384 PolarHBondContact O-N 3.03Å; K381-Y384 PolarHBondContact O-N 2.96Å; K381-Y384 VanDerWaalsContact O-N 3.13Å; Y384-D386 VanDerWaalsContact C-N 3.33Å; Y384-D386 PolarHBondContact O-N 2.66Å; Y384-A387 PolarHBondContact O-N 2.93Å; Y384-E388 VanDerWaalsContact O-CB 3.3Å; Y384-E388 WeakPolarHBondContact O-CB 3.32Å; Y384-E388 PolarHBondContact O-N 3.42Å
385	D	72	Confident	61.6	Low	62 Å²	62	119.9 Å²	119.9	33%	0.332	54%	0.536	S	S	.	.	H	α-helix	trans	-62.7	-38.5	175.4	-61.9	-16.6	0	0	0	111.3	K381 R389	K381-D385 IonicContact NZ-OD1 3.98Å; K381-D385 PolarHBondContact NZ-OD1 3.13Å; K381-D385 IonicContact NZ-OD2 3.66Å; K381-D385 PolarHBondContact NZ-OD2 3.39Å; K381-D385 VanDerWaalsContact O-CG 3.24Å; K381-D385 PolarHBondContact O-N 2.98Å; D385-R389 WeakPolarHBondContact O-CB 3.31Å; D385-R389 PolarHBondContact O-N 2.94Å
386	D	71.7	Confident	62.3	Low	61 Å²	61	121.7 Å²	121.7	33%	0.326	55%	0.548	S	S	.	.	H	α-helix	trans	-71.1	-37.5	175.8	-168	52	0	0	0	112.1	F382 Y384 R390	F382-D386 VanDerWaalsContact O-CB 3.23Å; F382-D386 WeakPolarHBondContact O-CB 3.29Å; F382-D386 PolarHBondContact O-N 3.04Å; Y384-D386 VanDerWaalsContact C-N 3.33Å; Y384-D386 PolarHBondContact O-N 2.66Å; D386-R390 WeakPolarHBondContact O-CB 3.42Å; D386-R390 VanDerWaalsContact O-CG 3.24Å; D386-R390 WeakPolarHBondContact O-CG 3.41Å; D386-R390 PolarHBondContact O-N 2.91Å; D386-R390 IonicContact OD1-NE 2.68Å; D386-R390 IonicContact OD2-CZ 3.36Å; D386-R390 IonicContact OD2-NE 3.88Å; D386-R390 PolarHBondContact OD2-NE 3.48Å; D386-R390 VanDerWaalsContact OD2-NE 3.13Å; D386-R390 IonicContact OD2-NH2 3.66Å; D386-R390 PolarHBondContact OD2-NH2 3.42Å
387	A	68.8	Low	62.4	Low	56 Å²	56	115 Å²	115	46%	0.463	53%	0.527	S	S	.	.	H	α-helix	trans	-67.3	-39.6	174.1	0	0	0	0	0	112.2	K383 Y384 R390 F391	K383-A387 VanDerWaalsContact O-CB 3.24Å; K383-A387 WeakPolarHBondContact O-CB 3.34Å; K383-A387 PolarHBondContact O-N 3.4Å; Y384-A387 PolarHBondContact O-N 2.93Å; A387-R390 PolarHBondContact O-N 3.32Å; A387-F391 WeakPolarHBondContact O-CB 3.15Å; A387-F391 PolarHBondContact O-N 3.49Å
388	E	64.8	Low	62.2	Low	105 Å²	105	116.6 Å²	116.6	49%	0.491	54%	0.544	S	S	.	.	H	α-helix	trans	-65.4	-44.8	175.1	-177.1	175.9	-145.2	0	0	111	Y384 R390 F391 Y392	Y384-E388 VanDerWaalsContact O-CB 3.3Å; Y384-E388 WeakPolarHBondContact O-CB 3.32Å; Y384-E388 PolarHBondContact O-N 3.42Å; E388-R390 PolarHBondContact O-N 3.44Å; E388-F391 WeakPolarHBondContact O-CB 3.1Å; E388-F391 PolarHBondContact O-N 2.93Å; E388-F391 VanDerWaalsContact O-N 3.17Å; E388-Y392 HydrophobicContact CG-CD2 3.75Å; E388-Y392 HydrophobicContact CG-CE2 3.49Å; E388-Y392 VanDerWaalsContact CG-CE2 3.49Å; E388-Y392 WeakPolarHBondContact O-CD2 3.24Å; E388-Y392 PolarHBondContact O-N 3.33Å
389	R	73.4	Confident	61.9	Low	155 Å²	155	112.7 Å²	112.7	59%	0.585	54%	0.543	S	S	*	.	H	α-helix	trans	-58.3	-47.6	174	-174.7	-178	-61	176.3	1.9	111.4	D385 F391 Y392 E393	D385-R389 WeakPolarHBondContact O-CB 3.31Å; D385-R389 PolarHBondContact O-N 2.94Å; R389-F391 VanDerWaalsContact C-N 3.3Å; R389-F391 PolarHBondContact O-N 3.49Å; R389-Y392 PolarHBondContact O-N 3.3Å; R389-E393 WeakPolarHBondContact CD-OE1 3.46Å; R389-E393 HydrophobicContact CG-CG 4.29Å; R389-E393 VanDerWaalsContact CG-OE1 3.27Å; R389-E393 WeakPolarHBondContact CG-OE1 3.4Å; R389-E393 VanDerWaalsContact O-CB 3.32Å; R389-E393 WeakPolarHBondContact O-CB 3.5Å; R389-E393 VanDerWaalsContact O-CG 3.27Å; R389-E393 WeakPolarHBondContact O-CG 3.47Å; R389-E393 PolarHBondContact O-N 3.46Å
390	R	67.7	Low	61.9	Low	151 Å²	151	110.8 Å²	110.8	57%	0.57	56%	0.555	S	S	*	*	H	α-helix	trans	-63.6	-34.7	176.7	-71.3	176.2	-166.1	-165.4	6.5	112.5	D386 A387 E388 Q394	D386-R390 WeakPolarHBondContact O-CB 3.42Å; D386-R390 VanDerWaalsContact O-CG 3.24Å; D386-R390 WeakPolarHBondContact O-CG 3.41Å; D386-R390 PolarHBondContact O-N 2.91Å; D386-R390 IonicContact OD1-NE 2.68Å; D386-R390 IonicContact OD2-CZ 3.36Å; D386-R390 IonicContact OD2-NE 3.88Å; D386-R390 PolarHBondContact OD2-NE 3.48Å; D386-R390 VanDerWaalsContact OD2-NE 3.13Å; D386-R390 IonicContact OD2-NH2 3.66Å; D386-R390 PolarHBondContact OD2-NH2 3.42Å; A387-R390 PolarHBondContact O-N 3.32Å; E388-R390 PolarHBondContact O-N 3.44Å; R390-Q394 WeakPolarHBondContact O-CB 3.44Å; R390-Q394 PolarHBondContact O-N 3.23Å
391	F	67.8	Low	61.8	Low	117 Å²	117	112 Å²	112	51%	0.513	58%	0.577	S	S	.	*	H	α-helix	trans	-63.7	-46.9	175.4	176.6	-98.3	0	0	0	111.7	A387 E388 R389 Q394 M395	A387-F391 WeakPolarHBondContact O-CB 3.15Å; A387-F391 PolarHBondContact O-N 3.49Å; E388-F391 WeakPolarHBondContact O-CB 3.1Å; E388-F391 PolarHBondContact O-N 2.93Å; E388-F391 VanDerWaalsContact O-N 3.17Å; R389-F391 VanDerWaalsContact C-N 3.3Å; R389-F391 PolarHBondContact O-N 3.49Å; F391-Q394 PolarHBondContact O-N 3.49Å; F391-M395 HydrophobicContact CE1-CG 4.37Å; F391-M395 HydrophobicContact CE2-CG 4.42Å; F391-M395 HydrophobicContact CZ-CG 4.22Å; F391-M395 WeakPolarHBondContact O-CB 3.36Å; F391-M395 WeakPolarHBondContact O-CG 3.35Å; F391-M395 PolarHBondContact O-N 3.39Å
392	Y	64.3	Low	60.5	Low	124 Å²	124	109.9 Å²	109.9	49%	0.486	58%	0.58	S	S	.	*	H	α-helix	trans	-72.7	-32.6	177.4	-72.1	-65.8	0	0	0	113.1	E388 R389 N396	E388-Y392 HydrophobicContact CG-CD2 3.75Å; E388-Y392 HydrophobicContact CG-CE2 3.49Å; E388-Y392 VanDerWaalsContact CG-CE2 3.49Å; E388-Y392 WeakPolarHBondContact O-CD2 3.24Å; E388-Y392 PolarHBondContact O-N 3.33Å; R389-Y392 PolarHBondContact O-N 3.3Å; Y392-N396 VanDerWaalsContact O-CB 3.24Å; Y392-N396 WeakPolarHBondContact O-CB 3.46Å; Y392-N396 VanDerWaalsContact O-CG 3.32Å; Y392-N396 PolarHBondContact O-N 3.14Å; Y392-N396 PolarHBondContact O-ND2 2.8Å
393	E	69.3	Low	59.7	Low	120 Å²	120	109.2 Å²	109.2	56%	0.561	59%	0.591	S	S	*	*	H	α-helix	trans	-70.3	-32.5	172.8	-74.4	173.1	178.3	0	0	112.3	R389 G397	R389-E393 WeakPolarHBondContact CD-OE1 3.46Å; R389-E393 HydrophobicContact CG-CG 4.29Å; R389-E393 VanDerWaalsContact CG-OE1 3.27Å; R389-E393 WeakPolarHBondContact CG-OE1 3.4Å; R389-E393 VanDerWaalsContact O-CB 3.32Å; R389-E393 WeakPolarHBondContact O-CB 3.5Å; R389-E393 VanDerWaalsContact O-CG 3.27Å; R389-E393 WeakPolarHBondContact O-CG 3.47Å; R389-E393 PolarHBondContact O-N 3.46Å; E393-G397 VanDerWaalsContact O-CA 3.29Å; E393-G397 WeakPolarHBondContact O-CA 3.13Å; E393-G397 PolarHBondContact O-N 3.03Å
394	Q	64.8	Low	58.8	Low	166 Å²	166	114.8 Å²	114.8	78%	0.776	61%	0.609	S	S	*	*	H	α-helix	trans	-78.2	-35	176.8	-165.5	88.6	51.9	0	0	112	R390 F391	R390-Q394 WeakPolarHBondContact O-CB 3.44Å; R390-Q394 PolarHBondContact O-N 3.23Å; F391-Q394 PolarHBondContact O-N 3.49Å
395	M	53.9	Low	58.4	Low	133 Å²	133	114.9 Å²	114.9	66%	0.655	62%	0.615	S	S	*	*	H	α-helix	trans	-70.9	-30.3	173	-79.5	-77.8	-77	0	0	112.6	F391	F391-M395 HydrophobicContact CE1-CG 4.37Å; F391-M395 HydrophobicContact CE2-CG 4.42Å; F391-M395 HydrophobicContact CZ-CG 4.22Å; F391-M395 WeakPolarHBondContact O-CB 3.36Å; F391-M395 WeakPolarHBondContact O-CG 3.35Å; F391-M395 PolarHBondContact O-N 3.39Å
396	N	59.3	Low	57.4	Low	136 Å²	136	119.1 Å²	119.1	73%	0.727	63%	0.633	S	S	*	*	S	Bend	trans	-102.8	2.7	178.3	-63	-42.4	0	0	0	113.6	Y392	Y392-N396 VanDerWaalsContact O-CB 3.24Å; Y392-N396 WeakPolarHBondContact O-CB 3.46Å; Y392-N396 VanDerWaalsContact O-CG 3.32Å; Y392-N396 PolarHBondContact O-N 3.14Å; Y392-N396 PolarHBondContact O-ND2 2.8Å
397	G	53.5	Low	56.7	Low	27 Å²	27	121.4 Å²	121.4	28%	0.278	65%	0.645	S	S	.	*	S	Bend	trans	-77.1	153.5	175.5	0	0	0	0	0	111.3	E393 V399	E393-G397 VanDerWaalsContact O-CA 3.29Å; E393-G397 WeakPolarHBondContact O-CA 3.13Å; E393-G397 PolarHBondContact O-N 3.03Å; G397-V399 PolarHBondContact O-N 3.48Å
398	P	46.6	Very low	56.3	Low	134 Å²	134	120.5 Å²	120.5	87%	0.87	64%	0.641	S	S	*	*			trans	-63.9	111.7	-176.7	25.3	-31	0	0	0	109.9	A400	P398-A400 PolarHBondContact O-N 3.32Å; P398-A400 VanDerWaalsContact O-N 3.07Å
399	V	41.4	Very low	56.1	Low	128 Å²	128	118 Å²	118	78%	0.776	64%	0.639	S	S	*	*			trans	-57.9	113.1	166.8	169	0	0	0	0	107.4	G397 G401	G397-V399 PolarHBondContact O-N 3.48Å; V399-G401 VanDerWaalsContact C-N 3.29Å; V399-G401 PolarHBondContact O-N 3.49Å
400	A	50	Low	56.2	Low	110 Å²	110	112.1 Å²	112.1	91%	0.909	62%	0.621	S	S	*	*	S	Bend	trans	-63.3	90.5	171.7	0	0	0	0	0	109	P398	P398-A400 PolarHBondContact O-N 3.32Å; P398-A400 VanDerWaalsContact O-N 3.07Å
401	G	49.9	Very low	57	Low	67 Å²	67	108.3 Å²	108.3	69%	0.691	62%	0.615	S	S	*	*			trans	169.8	52.6	-178.4	0	0	0	0	0	114.9	V399	V399-G401 VanDerWaalsContact C-N 3.29Å; V399-G401 PolarHBondContact O-N 3.49Å
402	A	37.1	Very low	57.9	Low	63 Å²	63	107.6 Å²	107.6	52%	0.521	62%	0.615	S	S	.	*			trans	-157.7	74.2	165.4	0	0	0	0	0	112.9	R404 Q405	A402-R404 PolarHBondContact O-N 3.4Å; A402-Q405 PolarHBondContact O-N 2.99Å
403	S	49.6	Very low	59.1	Low	116 Å²	116	107.4 Å²	107.4	81%	0.811	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	21	169	58	0	0	0	0	114.3
404	R	51.4	Low	60.1	Low	228 Å²	228	108.9 Å²	108.9	86%	0.86	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.9	-13.9	178.6	-150.4	174.4	177.9	-158.3	-2.3	114.2	A402	A402-R404 PolarHBondContact O-N 3.4Å
405	Q	49.7	Very low	61.3	Low	154 Å²	154	105.1 Å²	105.1	72%	0.72	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	-16.8	-178.5	-163.7	164.2	-36.1	0	0	114	A402 N407 G408 A409	A402-Q405 PolarHBondContact O-N 2.99Å; Q405-N407 PolarHBondContact O-N 2.85Å; Q405-G408 PolarHBondContact O-N 3.47Å; Q405-G408 VanDerWaalsContact O-N 3.15Å; Q405-A409 PolarHBondContact O-N 3.31Å; Q405-A409 VanDerWaalsContact O-N 3.14Å
406	E	49.4	Very low	63	Low	150 Å²	150	102.2 Å²	102.2	70%	0.701	59%	0.594	S	S	*	*	H	α-helix	trans	-61.1	-26.9	169.1	-79.4	-174.4	150.8	0	0	112.3	S410	E406-S410 WeakPolarHBondContact O-CB 3.35Å; E406-S410 PolarHBondContact O-N 2.94Å; E406-S410 PolarHBondContact O-OG 2.76Å
407	N	58	Low	64.5	Low	109 Å²	109	98.5 Å²	98.5	58%	0.583	58%	0.582	S	S	*	*	H	α-helix	trans	-67.7	-39.9	175.4	-71.7	-21.2	0	0	0	111.7	Q405 S410 V411	Q405-N407 PolarHBondContact O-N 2.85Å; N407-S410 PolarHBondContact O-OG 3.04Å; N407-V411 WeakPolarHBondContact O-CB 3.47Å; N407-V411 WeakPolarHBondContact O-CG2 3.27Å; N407-V411 PolarHBondContact O-N 3.03Å
408	G	60.4	Low	66.4	Low	37 Å²	37	105 Å²	105	38%	0.381	60%	0.598	S	S	.	*	H	α-helix	trans	-69.8	-45.3	176.2	0	0	0	0	0	112.4	Q405 S410 V411 I412	Q405-G408 PolarHBondContact O-N 3.47Å; Q405-G408 VanDerWaalsContact O-N 3.15Å; G408-S410 VanDerWaalsContact C-N 3.34Å; G408-S410 PolarHBondContact O-N 3.48Å; G408-V411 PolarHBondContact O-N 3.4Å; G408-I412 WeakPolarHBondContact O-CG1 3.44Å; G408-I412 PolarHBondContact O-N 3.48Å
409	A	61	Low	68.5	Low	53 Å²	53	101 Å²	101	44%	0.438	58%	0.576	S	S	.	*	H	α-helix	trans	-63.5	-39.4	176.5	0	0	0	0	0	112	Q405 I412 L413	Q405-A409 PolarHBondContact O-N 3.31Å; Q405-A409 VanDerWaalsContact O-N 3.14Å; A409-I412 PolarHBondContact O-N 3.39Å; A409-L413 WeakPolarHBondContact O-CB 3.22Å; A409-L413 WeakPolarHBondContact O-CG 3.43Å; A409-L413 PolarHBondContact O-N 3.01Å
410	S	75.9	Confident	70.9	Confident	31 Å²	31	103 Å²	103	22%	0.217	57%	0.57	C	S	.	*	H	α-helix	trans	-73.7	-23.7	175.1	69.9	0	0	0	0	113.4	E406 N407 G408 R414	E406-S410 WeakPolarHBondContact O-CB 3.35Å; E406-S410 PolarHBondContact O-N 2.94Å; E406-S410 PolarHBondContact O-OG 2.76Å; N407-S410 PolarHBondContact O-OG 3.04Å; G408-S410 VanDerWaalsContact C-N 3.34Å; G408-S410 PolarHBondContact O-N 3.48Å; S410-R414 VanDerWaalsContact C-NH1 3.31Å; S410-R414 VanDerWaalsContact CB-NH1 3.27Å; S410-R414 WeakPolarHBondContact O-CB 3.49Å; S410-R414 WeakPolarHBondContact O-CG 3.24Å; S410-R414 PolarHBondContact O-N 2.97Å; S410-R414 VanDerWaalsContact O-N 3.14Å; S410-R414 PolarHBondContact O-NH1 3.17Å; S410-R414 PolarHBondContact OG-NH1 3.03Å
411	V	83.6	Confident	72.8	Confident	72 Å²	72	102 Å²	102	44%	0.436	55%	0.547	S	S	.	.	H	α-helix	trans	-72	-46.7	170.1	167.1	0	0	0	0	110.3	N407 G408 L413 R414 D415	N407-V411 WeakPolarHBondContact O-CB 3.47Å; N407-V411 WeakPolarHBondContact O-CG2 3.27Å; N407-V411 PolarHBondContact O-N 3.03Å; G408-V411 PolarHBondContact O-N 3.4Å; V411-L413 VanDerWaalsContact C-N 3.33Å; V411-L413 PolarHBondContact O-N 3.4Å; V411-R414 CarbonylContact O-C 3.59Å; V411-R414 WeakPolarHBondContact O-CB 3.23Å; V411-R414 PolarHBondContact O-N 3.35Å; V411-R414 VanDerWaalsContact O-N 3.09Å; V411-D415 PolarHBondContact O-N 3.09Å
412	I	86.3	Confident	74.6	Confident	102 Å²	102	103.8 Å²	103.8	52%	0.523	54%	0.54	S	S	.	.	H	α-helix	trans	-61.6	-42.1	176.6	-64.9	164.7	0	0	0	110.8	G408 A409 R414 D415 I416	G408-I412 WeakPolarHBondContact O-CG1 3.44Å; G408-I412 PolarHBondContact O-N 3.48Å; A409-I412 PolarHBondContact O-N 3.39Å; I412-R414 VanDerWaalsContact C-N 3.32Å; I412-R414 PolarHBondContact O-N 3.42Å; I412-D415 PolarHBondContact O-N 3.4Å; I412-I416 HydrophobicContact CG2-CD1 3.69Å; I412-I416 HydrophobicContact CG2-CG1 4.26Å; I412-I416 WeakPolarHBondContact O-CB 3.38Å; I412-I416 WeakPolarHBondContact O-CG1 3.28Å; I412-I416 PolarHBondContact O-N 2.76Å
413	L	89.9	Confident	77	Confident	119 Å²	119	105.7 Å²	105.7	62%	0.623	54%	0.54	S	S	*	.	H	α-helix	trans	-63.2	-37.1	175.3	-72.1	170.4	0	0	0	112.4	A409 V411 A417	A409-L413 WeakPolarHBondContact O-CB 3.22Å; A409-L413 WeakPolarHBondContact O-CG 3.43Å; A409-L413 PolarHBondContact O-N 3.01Å; V411-L413 VanDerWaalsContact C-N 3.33Å; V411-L413 PolarHBondContact O-N 3.4Å; L413-A417 VanDerWaalsContact O-CB 3.3Å; L413-A417 WeakPolarHBondContact O-CB 3.29Å; L413-A417 PolarHBondContact O-N 2.95Å
414	R	89.7	Confident	78.8	Confident	151 Å²	151	106.4 Å²	106.4	57%	0.57	53%	0.531	S	S	*	.	H	α-helix	trans	-68.6	-37	173.4	-75.9	177	-168.4	102.5	-4.4	112.1	S410 V411 I412 A417 R418	S410-R414 VanDerWaalsContact C-NH1 3.31Å; S410-R414 VanDerWaalsContact CB-NH1 3.27Å; S410-R414 WeakPolarHBondContact O-CB 3.49Å; S410-R414 WeakPolarHBondContact O-CG 3.24Å; S410-R414 PolarHBondContact O-N 2.97Å; S410-R414 VanDerWaalsContact O-N 3.14Å; S410-R414 PolarHBondContact O-NH1 3.17Å; S410-R414 PolarHBondContact OG-NH1 3.03Å; V411-R414 CarbonylContact O-C 3.59Å; V411-R414 WeakPolarHBondContact O-CB 3.23Å; V411-R414 PolarHBondContact O-N 3.35Å; V411-R414 VanDerWaalsContact O-N 3.09Å; I412-R414 VanDerWaalsContact C-N 3.32Å; I412-R414 PolarHBondContact O-N 3.42Å; R414-A417 PolarHBondContact O-N 2.85Å; R414-R418 WeakPolarHBondContact O-CB 3.36Å; R414-R418 PolarHBondContact O-N 2.88Å
415	D	90.2	Very high	80.3	Confident	87 Å²	87	101.8 Å²	101.8	47%	0.465	52%	0.517	S	S	.	.	H	α-helix	trans	-72.2	-38.1	177.8	-72.2	-17.5	0	0	0	111.8	V411 I412 R418 A419	V411-D415 PolarHBondContact O-N 3.09Å; I412-D415 PolarHBondContact O-N 3.4Å; D415-R418 PolarHBondContact O-N 2.84Å; D415-A419 VanDerWaalsContact O-CB 3.27Å; D415-A419 WeakPolarHBondContact O-CB 3.49Å; D415-A419 PolarHBondContact O-N 2.9Å
416	I	90.3	Very high	81.7	Confident	73 Å²	73	98.2 Å²	98.2	37%	0.374	51%	0.509	S	S	.	.	H	α-helix	trans	-63.4	-43.2	170.5	-67.9	167	0	0	0	110.1	I412 A419 R420	I412-I416 HydrophobicContact CG2-CD1 3.69Å; I412-I416 HydrophobicContact CG2-CG1 4.26Å; I412-I416 WeakPolarHBondContact O-CB 3.38Å; I412-I416 WeakPolarHBondContact O-CG1 3.28Å; I412-I416 PolarHBondContact O-N 2.76Å; I416-A419 PolarHBondContact O-N 3.21Å; I416-R420 WeakPolarHBondContact O-CB 3.34Å; I416-R420 VanDerWaalsContact O-CG 3.24Å; I416-R420 WeakPolarHBondContact O-CG 3.39Å; I416-R420 PolarHBondContact O-N 3.03Å
417	A	91.3	Very high	82.8	Confident	57 Å²	57	95.8 Å²	95.8	47%	0.471	50%	0.5	S	S	.	.	H	α-helix	trans	-62.8	-42.5	176.1	0	0	0	0	0	111.7	L413 R414 R420 E421	L413-A417 VanDerWaalsContact O-CB 3.3Å; L413-A417 WeakPolarHBondContact O-CB 3.29Å; L413-A417 PolarHBondContact O-N 2.95Å; R414-A417 PolarHBondContact O-N 2.85Å; A417-R420 PolarHBondContact O-N 3.22Å; A417-E421 WeakPolarHBondContact O-CB 3.25Å; A417-E421 PolarHBondContact O-N 2.95Å
418	R	91.7	Very high	83.2	Confident	164 Å²	164	93.4 Å²	93.4	62%	0.619	50%	0.496	S	S	*	.	H	α-helix	trans	-66.8	-40.1	176.8	-169.3	-172.5	-59	-86.6	0.4	112.3	R414 D415 E421 N422	R414-R418 WeakPolarHBondContact O-CB 3.36Å; R414-R418 PolarHBondContact O-N 2.88Å; D415-R418 PolarHBondContact O-N 2.84Å; R418-E421 PolarHBondContact O-N 3Å; R418-N422 WeakPolarHBondContact O-CB 3.23Å; R418-N422 PolarHBondContact O-N 3.3Å
419	A	91	Very high	82.8	Confident	50 Å²	50	94.9 Å²	94.9	41%	0.413	51%	0.511	S	S	.	.	H	α-helix	trans	-64.8	-42.2	175.4	0	0	0	0	0	111.1	D415 I416 N422 I423	D415-A419 VanDerWaalsContact O-CB 3.27Å; D415-A419 WeakPolarHBondContact O-CB 3.49Å; D415-A419 PolarHBondContact O-N 2.9Å; I416-A419 PolarHBondContact O-N 3.21Å; A419-N422 PolarHBondContact O-N 2.95Å; A419-I423 VanDerWaalsContact O-CG1 3.27Å; A419-I423 WeakPolarHBondContact O-CG1 3.43Å; A419-I423 PolarHBondContact O-N 2.98Å
420	R	92.2	Very high	82.5	Confident	170 Å²	170	95.6 Å²	95.6	64%	0.642	51%	0.513	S	S	*	.	H	α-helix	trans	-62.1	-43.1	173.2	-74.1	174.2	177.8	-169.3	0	111.7	I416 A417 N422 I423 Q424	I416-R420 WeakPolarHBondContact O-CB 3.34Å; I416-R420 VanDerWaalsContact O-CG 3.24Å; I416-R420 WeakPolarHBondContact O-CG 3.39Å; I416-R420 PolarHBondContact O-N 3.03Å; A417-R420 PolarHBondContact O-N 3.22Å; R420-N422 VanDerWaalsContact C-N 3.34Å; R420-N422 PolarHBondContact O-N 3.2Å; R420-I423 PolarHBondContact O-N 2.98Å; R420-Q424 WeakPolarHBondContact O-CB 3.29Å; R420-Q424 VanDerWaalsContact O-CG 3.31Å; R420-Q424 WeakPolarHBondContact O-CG 3.36Å; R420-Q424 PolarHBondContact O-N 3.27Å
421	E	90.5	Very high	81.2	Confident	90 Å²	90	98.4 Å²	98.4	42%	0.421	53%	0.532	S	S	.	.	H	α-helix	trans	-64	-38.1	175.3	-166.2	-166.7	158.6	0	0	111.8	A417 R418 Q424 K425	A417-E421 WeakPolarHBondContact O-CB 3.25Å; A417-E421 PolarHBondContact O-N 2.95Å; R418-E421 PolarHBondContact O-N 3Å; E421-Q424 CarbonylContact O-C 3.35Å; E421-Q424 PolarHBondContact O-N 3.5Å; E421-K425 HydrophobicContact CG-CD 4.38Å; E421-K425 VanDerWaalsContact O-CB 3.32Å; E421-K425 WeakPolarHBondContact O-CB 3.44Å; E421-K425 WeakPolarHBondContact O-CG 3.39Å; E421-K425 PolarHBondContact O-N 2.94Å; E421-K425 VanDerWaalsContact OE1-CE 3.29Å; E421-K425 WeakPolarHBondContact OE1-CE 3.38Å; E421-K425 IonicContact OE1-NZ 2.88Å; E421-K425 PolarHBondContact OE1-NZ 2.89Å
422	N	88.5	Confident	79.3	Confident	104 Å²	104	96.8 Å²	96.8	56%	0.556	53%	0.53	S	S	*	.	H	α-helix	trans	-68.9	-40.1	177.7	-167.2	26.7	0	0	0	112.3	R418 A419 R420 K425 S426	R418-N422 WeakPolarHBondContact O-CB 3.23Å; R418-N422 PolarHBondContact O-N 3.3Å; A419-N422 PolarHBondContact O-N 2.95Å; R420-N422 VanDerWaalsContact C-N 3.34Å; R420-N422 PolarHBondContact O-N 3.2Å; N422-K425 PolarHBondContact O-N 2.97Å; N422-S426 WeakPolarHBondContact O-CB 3.47Å; N422-S426 PolarHBondContact O-N 2.95Å; N422-S426 PolarHBondContact O-OG 3.23Å
423	I	87.1	Confident	77.7	Confident	102 Å²	102	99 Å²	99	52%	0.523	55%	0.552	S	S	.	*	H	α-helix	trans	-64.3	-44.2	172.3	-68.5	164.6	0	0	0	109.8	A419 R420 S426 L427	A419-I423 VanDerWaalsContact O-CG1 3.27Å; A419-I423 WeakPolarHBondContact O-CG1 3.43Å; A419-I423 PolarHBondContact O-N 2.98Å; R420-I423 PolarHBondContact O-N 2.98Å; I423-S426 PolarHBondContact O-N 3.41Å; I423-L427 HydrophobicContact CG2-CD1 3.59Å; I423-L427 WeakPolarHBondContact O-CB 3.25Å; I423-L427 WeakPolarHBondContact O-CD1 3.42Å; I423-L427 WeakPolarHBondContact O-CG 3.37Å; I423-L427 PolarHBondContact O-N 2.82Å
424	Q	86.6	Confident	75.9	Confident	132 Å²	132	96.6 Å²	96.6	62%	0.617	56%	0.555	S	S	*	*	H	α-helix	trans	-65.2	-36.8	175.5	-77.9	-179.9	-20.3	0	0	112.8	R420 E421 L427 A428	R420-Q424 WeakPolarHBondContact O-CB 3.29Å; R420-Q424 VanDerWaalsContact O-CG 3.31Å; R420-Q424 WeakPolarHBondContact O-CG 3.36Å; R420-Q424 PolarHBondContact O-N 3.27Å; E421-Q424 CarbonylContact O-C 3.35Å; E421-Q424 PolarHBondContact O-N 3.5Å; Q424-L427 PolarHBondContact O-N 2.96Å; Q424-A428 WeakPolarHBondContact O-CA 3.11Å; Q424-A428 WeakPolarHBondContact O-CB 3.18Å; Q424-A428 PolarHBondContact O-N 3.18Å
425	K	82.9	Confident	73.7	Confident	130 Å²	130	92.4 Å²	92.4	57%	0.565	55%	0.553	S	S	*	*	H	α-helix	trans	-69.1	-35.5	173	-85.3	173.2	169.6	162.9	0	112	E421 N422 G429	E421-K425 HydrophobicContact CG-CD 4.38Å; E421-K425 VanDerWaalsContact O-CB 3.32Å; E421-K425 WeakPolarHBondContact O-CB 3.44Å; E421-K425 WeakPolarHBondContact O-CG 3.39Å; E421-K425 PolarHBondContact O-N 2.94Å; E421-K425 VanDerWaalsContact OE1-CE 3.29Å; E421-K425 WeakPolarHBondContact OE1-CE 3.38Å; E421-K425 IonicContact OE1-NZ 2.88Å; E421-K425 PolarHBondContact OE1-NZ 2.89Å; N422-K425 PolarHBondContact O-N 2.97Å; K425-G429 PolarHBondContact O-N 2.98Å
426	S	78.6	Confident	71.7	Confident	79 Å²	79	94 Å²	94	55%	0.552	57%	0.571	S	S	*	*	H	α-helix	trans	-69.1	-41.1	173.8	-59.2	0	0	0	0	111.3	N422 I423 S430	N422-S426 WeakPolarHBondContact O-CB 3.47Å; N422-S426 PolarHBondContact O-N 2.95Å; N422-S426 PolarHBondContact O-OG 3.23Å; I423-S426 PolarHBondContact O-N 3.41Å; S426-S430 PolarHBondContact O-N 2.89Å
427	L	73.5	Confident	69.9	Low	99 Å²	99	95.7 Å²	95.7	52%	0.518	59%	0.589	S	S	.	*	H	α-helix	trans	-70.2	-38.7	174.2	-78.7	157	0	0	0	112	I423 Q424 S430 S431	I423-L427 HydrophobicContact CG2-CD1 3.59Å; I423-L427 WeakPolarHBondContact O-CB 3.25Å; I423-L427 WeakPolarHBondContact O-CD1 3.42Å; I423-L427 WeakPolarHBondContact O-CG 3.37Å; I423-L427 PolarHBondContact O-N 2.82Å; Q424-L427 PolarHBondContact O-N 2.96Å; L427-S430 CarbonylContact O-C 3.59Å; L427-S430 VanDerWaalsContact O-C 3.31Å; L427-S430 WeakPolarHBondContact O-CA 3.41Å; L427-S430 WeakPolarHBondContact O-CB 3.29Å; L427-S430 PolarHBondContact O-N 3.31Å; L427-S430 PolarHBondContact O-OG 3.49Å; L427-S431 VanDerWaalsContact O-CB 3.29Å; L427-S431 WeakPolarHBondContact O-CB 3.39Å; L427-S431 PolarHBondContact O-N 3.31Å; L427-S431 PolarHBondContact O-OG 3.46Å
428	A	65.8	Low	68	Low	60 Å²	60	95.6 Å²	95.6	50%	0.496	59%	0.594	S	S	.	*	H	α-helix	trans	-72.7	-31.2	175.6	0	0	0	0	0	112	Q424 S430 S431 G432	Q424-A428 WeakPolarHBondContact O-CA 3.11Å; Q424-A428 WeakPolarHBondContact O-CB 3.18Å; Q424-A428 PolarHBondContact O-N 3.18Å; A428-S430 PolarHBondContact O-N 3.48Å; A428-S431 CarbonylContact O-C 3.57Å; A428-S431 PolarHBondContact O-N 3.41Å; A428-G432 PolarHBondContact O-N 3.39Å; A428-G432 VanDerWaalsContact O-N 3.12Å
429	G	53.3	Low	66.1	Low	67 Å²	67	93 Å²	93	69%	0.691	60%	0.597	S	S	*	*	H	α-helix	trans	-62.1	-22.9	165.2	0	0	0	0	0	112.8	K425	K425-G429 PolarHBondContact O-N 2.98Å
430	S	54.2	Low	64.2	Low	68 Å²	68	95.2 Å²	95.2	48%	0.476	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.5	-7.5	169.1	82.1	0	0	0	0	114.3	S426 L427 A428	S426-S430 PolarHBondContact O-N 2.89Å; L427-S430 CarbonylContact O-C 3.59Å; L427-S430 VanDerWaalsContact O-C 3.31Å; L427-S430 WeakPolarHBondContact O-CA 3.41Å; L427-S430 WeakPolarHBondContact O-CB 3.29Å; L427-S430 PolarHBondContact O-N 3.31Å; L427-S430 PolarHBondContact O-OG 3.49Å; A428-S430 PolarHBondContact O-N 3.48Å
431	S	49	Very low	62.4	Low	90 Å²	90	89.5 Å²	89.5	63%	0.629	60%	0.603	S	S	*	*			trans	-126.1	31	-173.4	-57.7	0	0	0	0	112.9	L427 A428	L427-S431 VanDerWaalsContact O-CB 3.29Å; L427-S431 WeakPolarHBondContact O-CB 3.39Å; L427-S431 PolarHBondContact O-N 3.31Å; L427-S431 PolarHBondContact O-OG 3.46Å; A428-S431 CarbonylContact O-C 3.57Å; A428-S431 PolarHBondContact O-N 3.41Å
432	G	43.3	Very low	60.8	Low	38 Å²	38	89.5 Å²	89.5	39%	0.392	61%	0.606	S	S	.	*	S	Bend	trans	-68.3	145.7	157.8	0	0	0	0	0	109.6	A428 G434 A435	A428-G432 PolarHBondContact O-N 3.39Å; A428-G432 VanDerWaalsContact O-N 3.12Å; G432-G434 PolarHBondContact O-N 2.86Å; G432-A435 PolarHBondContact O-N 3.41Å
433	P	53.1	Low	60	Low	150 Å²	150	90.9 Å²	90.9	97%	0.974	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	88.1	174.6	29	-30.9	0	0	0	108.2
434	G	52.1	Low	59.8	Low	68 Å²	68	87.8 Å²	87.8	70%	0.701	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	155.8	-7.7	-173.7	0	0	0	0	0	116.1	G432	G432-G434 PolarHBondContact O-N 2.86Å
435	A	42.8	Very low	59.7	Low	63 Å²	63	87.7 Å²	87.7	52%	0.521	60%	0.602	S	S	.	*			trans	-98.3	25.4	-179.6	0	0	0	0	0	114.5	G432 S437	G432-A435 PolarHBondContact O-N 3.41Å; A435-S437 VanDerWaalsContact C-N 3.28Å; A435-S437 PolarHBondContact O-N 3.12Å
436	S	48.1	Very low	59.7	Low	121 Å²	121	86 Å²	86	85%	0.846	60%	0.598	S	S	*	*			trans	-92	37	168.8	68.3	0	0	0	0	112.6
437	S	53.4	Low	60.3	Low	107 Å²	107	86.4 Å²	86.4	75%	0.748	60%	0.597	S	S	*	*			trans	-148.5	93.3	172	-163	0	0	0	0	109.8	A435	A435-S437 VanDerWaalsContact C-N 3.28Å; A435-S437 PolarHBondContact O-N 3.12Å
438	G	50.7	Low	61.2	Low	55 Å²	55	86.6 Å²	86.6	57%	0.567	60%	0.603	S	S	*	*	S	Bend	trans	-167.8	-6.5	177.1	0	0	0	0	0	115.6
439	T	51.8	Low	62.6	Low	111 Å²	111	91.7 Å²	91.7	68%	0.681	61%	0.609	S	S	*	*	S	Bend	trans	-138.2	-1.1	170.6	58.3	0	0	0	0	113.9	H443	T439-H443 PolarHBondContact O-N 2.92Å
440	S	51.5	Low	64.5	Low	95 Å²	95	92.9 Å²	92.9	66%	0.664	60%	0.598	S	S	*	*	H	α-helix	trans	-84.4	-27.7	175	-179.9	0	0	0	0	113.2
441	G	53.4	Low	66.5	Low	51 Å²	51	91.8 Å²	91.8	53%	0.526	59%	0.593	S	S	.	*	H	α-helix	trans	-71.3	-43.5	174.3	0	0	0	0	0	111.4	H443 G444 E445	G441-H443 VanDerWaalsContact C-N 3.31Å; G441-H443 PolarHBondContact O-N 3.46Å; G441-G444 PolarHBondContact O-N 3.26Å; G441-E445 PolarHBondContact O-N 2.92Å
442	D	57.9	Low	68.7	Low	90 Å²	90	90.3 Å²	90.3	48%	0.481	58%	0.583	S	S	.	*	H	α-helix	trans	-66.6	-32.4	-178.9	-58	-4.5	0	0	0	112.3	E445 L446	D442-E445 PolarHBondContact O-N 3.41Å; D442-L446 VanDerWaalsContact O-CB 3.23Å; D442-L446 WeakPolarHBondContact O-CB 3.27Å; D442-L446 WeakPolarHBondContact O-CD1 3.42Å; D442-L446 WeakPolarHBondContact O-CG 3.2Å; D442-L446 PolarHBondContact O-N 3.47Å
443	H	70	Confident	71.2	Confident	132 Å²	132	92.6 Å²	92.6	61%	0.611	59%	0.586	S	S	*	*	H	α-helix	trans	-67.4	-37.7	176.3	-126.7	-61.5	0	0	0	112	T439 G441 V447	T439-H443 PolarHBondContact O-N 2.92Å; G441-H443 VanDerWaalsContact C-N 3.31Å; G441-H443 PolarHBondContact O-N 3.46Å; H443-V447 WeakPolarHBondContact O-CG2 3.27Å; H443-V447 PolarHBondContact O-N 3.06Å
444	G	83.9	Confident	73.3	Confident	38 Å²	38	90.8 Å²	90.8	39%	0.392	56%	0.564	S	S	.	*	H	α-helix	trans	-68.2	-43.3	174.4	0	0	0	0	0	112.1	G441 V447 V448	G441-G444 PolarHBondContact O-N 3.26Å; G444-V447 PolarHBondContact O-N 3.06Å; G444-V448 WeakPolarHBondContact O-CG2 3.45Å; G444-V448 PolarHBondContact O-N 3.06Å
445	E	85.1	Confident	75.5	Confident	129 Å²	129	92 Å²	92	60%	0.603	56%	0.558	S	S	*	*	H	α-helix	trans	-64.7	-40.6	176.4	-168.8	180	160.8	0	0	112.1	G441 D442 V447 V448 R449	G441-E445 PolarHBondContact O-N 2.92Å; D442-E445 PolarHBondContact O-N 3.41Å; E445-V447 PolarHBondContact O-N 3.29Å; E445-V448 PolarHBondContact O-N 2.87Å; E445-R449 WeakPolarHBondContact O-CB 3.27Å; E445-R449 PolarHBondContact O-N 2.88Å
446	L	82	Confident	78	Confident	95 Å²	95	94.1 Å²	94.1	50%	0.497	56%	0.557	S	S	.	*	H	α-helix	trans	-60.4	-43.8	172.8	-86.1	158.8	0	0	0	111.7	D442 R449 I450	D442-L446 VanDerWaalsContact O-CB 3.23Å; D442-L446 WeakPolarHBondContact O-CB 3.27Å; D442-L446 WeakPolarHBondContact O-CD1 3.42Å; D442-L446 WeakPolarHBondContact O-CG 3.2Å; D442-L446 PolarHBondContact O-N 3.47Å; L446-R449 PolarHBondContact O-N 3.19Å; L446-I450 WeakPolarHBondContact O-CB 3.32Å; L446-I450 WeakPolarHBondContact O-CD1 3.35Å; L446-I450 WeakPolarHBondContact O-CG1 3.37Å; L446-I450 PolarHBondContact O-N 3.13Å
447	V	91.1	Very high	80.3	Confident	87 Å²	87	92.3 Å²	92.3	53%	0.527	54%	0.538	S	S	.	.	H	α-helix	trans	-64.8	-42	177.8	169.5	0	0	0	0	111.3	H443 G444 E445 I450 A451	H443-V447 WeakPolarHBondContact O-CG2 3.27Å; H443-V447 PolarHBondContact O-N 3.06Å; G444-V447 PolarHBondContact O-N 3.06Å; E445-V447 PolarHBondContact O-N 3.29Å; V447-I450 PolarHBondContact O-N 2.96Å; V447-A451 PolarHBondContact O-N 2.98Å
448	V	93.3	Very high	82.4	Confident	104 Å²	104	93.6 Å²	93.6	63%	0.63	53%	0.532	S	S	*	.	H	α-helix	trans	-63.9	-41.5	175.5	172.2	0	0	0	0	111.2	G444 E445 A451 S452	G444-V448 WeakPolarHBondContact O-CG2 3.45Å; G444-V448 PolarHBondContact O-N 3.06Å; E445-V448 PolarHBondContact O-N 2.87Å; V448-A451 PolarHBondContact O-N 2.89Å; V448-S452 PolarHBondContact O-N 3.39Å
449	R	94.2	Very high	84.6	Confident	166 Å²	166	94.5 Å²	94.5	63%	0.626	53%	0.53	S	S	*	.	H	α-helix	trans	-64.7	-41.1	176.8	-165.6	177.7	-140.1	154.8	6.9	112	E445 L446 S452 L453	E445-R449 WeakPolarHBondContact O-CB 3.27Å; E445-R449 PolarHBondContact O-N 2.88Å; L446-R449 PolarHBondContact O-N 3.19Å; R449-S452 PolarHBondContact O-N 3.49Å; R449-L453 HydrophobicContact CG-CD1 4.41Å; R449-L453 WeakPolarHBondContact O-CB 3.41Å; R449-L453 VanDerWaalsContact O-CG 3.31Å; R449-L453 WeakPolarHBondContact O-CG 3.38Å; R449-L453 PolarHBondContact O-N 3.34Å
450	I	94.2	Very high	86.8	Confident	92 Å²	92	94.3 Å²	94.3	47%	0.472	52%	0.524	S	S	.	.	H	α-helix	trans	-62.2	-47.8	175.7	-70.2	163	0	0	0	110	L446 V447 S452 L453 E454	L446-I450 WeakPolarHBondContact O-CB 3.32Å; L446-I450 WeakPolarHBondContact O-CD1 3.35Å; L446-I450 WeakPolarHBondContact O-CG1 3.37Å; L446-I450 PolarHBondContact O-N 3.13Å; V447-I450 PolarHBondContact O-N 2.96Å; I450-S452 VanDerWaalsContact C-N 3.32Å; I450-S452 PolarHBondContact O-N 3.28Å; I450-L453 PolarHBondContact O-N 2.66Å; I450-E454 WeakPolarHBondContact O-CG 3.31Å; I450-E454 PolarHBondContact O-N 3.48Å
451	A	95.8	Very high	89	Confident	45 Å²	45	97.9 Å²	97.9	37%	0.372	52%	0.523	S	S	.	.	H	α-helix	trans	-60.6	-39.9	177.4	0	0	0	0	0	112.6	V447 V448 E454 V455	V447-A451 PolarHBondContact O-N 2.98Å; V448-A451 PolarHBondContact O-N 2.89Å; A451-E454 PolarHBondContact O-N 2.9Å; A451-V455 WeakPolarHBondContact O-CG2 3.32Å; A451-V455 PolarHBondContact O-N 3.45Å
452	S	95.8	Very high	91.1	Very high	59 Å²	59	96.7 Å²	96.7	41%	0.413	51%	0.511	S	S	.	.	H	α-helix	trans	-62.5	-45.6	174.7	-167	0	0	0	0	112	V448 R449 I450 E454 V455 E456	V448-S452 PolarHBondContact O-N 3.39Å; R449-S452 PolarHBondContact O-N 3.49Å; I450-S452 VanDerWaalsContact C-N 3.32Å; I450-S452 PolarHBondContact O-N 3.28Å; S452-E454 VanDerWaalsContact C-N 3.28Å; S452-E454 PolarHBondContact O-N 2.97Å; S452-V455 PolarHBondContact O-N 3.47Å; S452-E456 PolarHBondContact O-N 2.84Å
453	L	96	Very high	93	Very high	87 Å²	87	95.5 Å²	95.5	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-65.2	-31.3	178.4	-72.9	172.4	0	0	0	112.7	R449 I450 N457	R449-L453 HydrophobicContact CG-CD1 4.41Å; R449-L453 WeakPolarHBondContact O-CB 3.41Å; R449-L453 VanDerWaalsContact O-CG 3.31Å; R449-L453 WeakPolarHBondContact O-CG 3.38Å; R449-L453 PolarHBondContact O-N 3.34Å; I450-L453 PolarHBondContact O-N 2.66Å; L453-N457 WeakPolarHBondContact O-CB 3.35Å; L453-N457 PolarHBondContact O-N 2.94Å; L453-N457 PolarHBondContact O-ND2 2.72Å
454	E	96.6	Very high	94.3	Very high	111 Å²	111	92.9 Å²	92.9	52%	0.519	50%	0.5	S	S	.	.	H	α-helix	trans	-67	-42.7	174	-74.1	175.4	174.4	0	0	111.7	I450 A451 S452 N457 Q458	I450-E454 WeakPolarHBondContact O-CG 3.31Å; I450-E454 PolarHBondContact O-N 3.48Å; A451-E454 PolarHBondContact O-N 2.9Å; S452-E454 VanDerWaalsContact C-N 3.28Å; S452-E454 PolarHBondContact O-N 2.97Å; E454-N457 PolarHBondContact O-N 3.44Å; E454-Q458 WeakPolarHBondContact O-CG 3.37Å; E454-Q458 PolarHBondContact O-N 3.43Å
455	V	97.2	Very high	95	Very high	95 Å²	95	96.4 Å²	96.4	58%	0.576	51%	0.506	S	S	*	.	H	α-helix	trans	-65.5	-44.6	176.3	173.5	0	0	0	0	111.1	A451 S452 N457 Q458 S459	A451-V455 WeakPolarHBondContact O-CG2 3.32Å; A451-V455 PolarHBondContact O-N 3.45Å; S452-V455 PolarHBondContact O-N 3.47Å; V455-N457 VanDerWaalsContact C-N 3.33Å; V455-N457 PolarHBondContact O-N 2.96Å; V455-Q458 WeakPolarHBondContact O-CB 3.23Å; V455-Q458 PolarHBondContact O-N 2.95Å; V455-S459 PolarHBondContact O-N 3.13Å
456	E	96.6	Very high	95.6	Very high	107 Å²	107	96.6 Å²	96.6	50%	0.5	51%	0.507	S	S	.	.	H	α-helix	trans	-61.5	-41.2	175.5	-74	174.8	-156.9	0	0	111.6	S452 Q458 S459 L460	S452-E456 PolarHBondContact O-N 2.84Å; E456-Q458 VanDerWaalsContact C-N 3.33Å; E456-Q458 PolarHBondContact O-N 3.28Å; E456-S459 WeakPolarHBondContact O-CB 3.47Å; E456-S459 PolarHBondContact O-N 3.37Å; E456-L460 WeakPolarHBondContact O-CB 3.34Å; E456-L460 WeakPolarHBondContact O-CG 3.37Å; E456-L460 PolarHBondContact O-N 2.87Å
457	N	96.8	Very high	96.3	Very high	83 Å²	83	97 Å²	97	44%	0.444	51%	0.509	S	S	.	.	H	α-helix	trans	-62.4	-38.5	174.2	-94.1	-75.3	0	0	0	112.8	L453 E454 V455 R461	L453-N457 WeakPolarHBondContact O-CB 3.35Å; L453-N457 PolarHBondContact O-N 2.94Å; L453-N457 PolarHBondContact O-ND2 2.72Å; E454-N457 PolarHBondContact O-N 3.44Å; V455-N457 VanDerWaalsContact C-N 3.33Å; V455-N457 PolarHBondContact O-N 2.96Å; N457-R461 WeakPolarHBondContact O-CB 3.47Å; N457-R461 WeakPolarHBondContact O-CG 3.32Å; N457-R461 PolarHBondContact O-N 3.4Å
458	Q	97.3	Very high	96.6	Very high	133 Å²	133	98.2 Å²	98.2	62%	0.621	51%	0.509	S	S	*	.	H	α-helix	trans	-65.6	-42.7	174.4	-70.9	172	33.9	0	0	111.2	E454 V455 E456 R461 G462	E454-Q458 WeakPolarHBondContact O-CG 3.37Å; E454-Q458 PolarHBondContact O-N 3.43Å; V455-Q458 WeakPolarHBondContact O-CB 3.23Å; V455-Q458 PolarHBondContact O-N 2.95Å; E456-Q458 VanDerWaalsContact C-N 3.33Å; E456-Q458 PolarHBondContact O-N 3.28Å; Q458-R461 PolarHBondContact O-N 3.11Å; Q458-G462 PolarHBondContact O-N 2.92Å
459	S	97	Very high	96.8	Very high	74 Å²	74	99.7 Å²	99.7	52%	0.517	51%	0.509	S	S	.	.	H	α-helix	trans	-60.9	-46.5	175.4	-179.9	0	0	0	0	111.9	V455 E456 R461 G462 V463	V455-S459 PolarHBondContact O-N 3.13Å; E456-S459 WeakPolarHBondContact O-CB 3.47Å; E456-S459 PolarHBondContact O-N 3.37Å; S459-R461 VanDerWaalsContact C-N 3.32Å; S459-R461 PolarHBondContact O-N 3.19Å; S459-G462 WeakPolarHBondContact O-CA 3.49Å; S459-G462 PolarHBondContact O-N 3.3Å; S459-V463 PolarHBondContact O-N 2.92Å
460	L	97.9	Very high	96.9	Very high	107 Å²	107	94 Å²	94	56%	0.56	50%	0.498	S	S	*	.	H	α-helix	trans	-61	-40.4	176.5	-71.9	174	0	0	0	112	E456 G462 V463 V464	E456-L460 WeakPolarHBondContact O-CB 3.34Å; E456-L460 WeakPolarHBondContact O-CG 3.37Å; E456-L460 PolarHBondContact O-N 2.87Å; L460-G462 VanDerWaalsContact C-N 3.28Å; L460-G462 PolarHBondContact O-N 2.94Å; L460-V463 PolarHBondContact O-N 3.48Å; L460-V464 VanDerWaalsContact O-CG2 3.28Å; L460-V464 WeakPolarHBondContact O-CG2 3.41Å; L460-V464 PolarHBondContact O-N 2.89Å
461	R	97.3	Very high	97.1	Very high	170 Å²	170	93.9 Å²	93.9	64%	0.642	50%	0.497	S	S	*	.	H	α-helix	trans	-62.2	-37.6	173.6	-72.6	170.4	-172.7	-79.4	-0.4	111.7	N457 Q458 S459 V464 Q465	N457-R461 WeakPolarHBondContact O-CB 3.47Å; N457-R461 WeakPolarHBondContact O-CG 3.32Å; N457-R461 PolarHBondContact O-N 3.4Å; Q458-R461 PolarHBondContact O-N 3.11Å; S459-R461 VanDerWaalsContact C-N 3.32Å; S459-R461 PolarHBondContact O-N 3.19Å; R461-V464 PolarHBondContact O-N 2.88Å; R461-Q465 WeakPolarHBondContact O-CG 3.45Å; R461-Q465 PolarHBondContact O-N 2.92Å; R461-Q465 VanDerWaalsContact O-N 3.08Å
462	G	97.8	Very high	97.1	Very high	26 Å²	26	95 Å²	95	27%	0.268	50%	0.502	S	S	.	.	H	α-helix	trans	-62.1	-50.7	172.3	0	0	0	0	0	112.5	Q458 S459 L460 V464 Q465 E466	Q458-G462 PolarHBondContact O-N 2.92Å; S459-G462 WeakPolarHBondContact O-CA 3.49Å; S459-G462 PolarHBondContact O-N 3.3Å; L460-G462 VanDerWaalsContact C-N 3.28Å; L460-G462 PolarHBondContact O-N 2.94Å; G462-V464 VanDerWaalsContact C-N 3.28Å; G462-V464 PolarHBondContact O-N 3.25Å; G462-Q465 WeakPolarHBondContact O-CA 3.3Å; G462-Q465 WeakPolarHBondContact O-CB 3.24Å; G462-Q465 PolarHBondContact O-N 3.36Å; G462-E466 PolarHBondContact O-N 3.5Å
463	V	97.6	Very high	97.2	Very high	66 Å²	66	99.1 Å²	99.1	40%	0.4	51%	0.513	S	S	.	.	H	α-helix	trans	-58.9	-40.2	177	174.8	0	0	0	0	111.4	S459 L460 Q465 E466 L467	S459-V463 PolarHBondContact O-N 2.92Å; L460-V463 PolarHBondContact O-N 3.48Å; V463-Q465 VanDerWaalsContact C-N 3.32Å; V463-Q465 PolarHBondContact O-N 3.19Å; V463-E466 PolarHBondContact O-N 3.15Å; V463-L467 HydrophobicContact CG1-CD1 4.11Å; V463-L467 HydrophobicContact CG1-CG 4.38Å; V463-L467 WeakPolarHBondContact O-CB 3.23Å; V463-L467 WeakPolarHBondContact O-CG 3.13Å; V463-L467 PolarHBondContact O-N 2.98Å
464	V	97.9	Very high	97.2	Very high	76 Å²	76	99.6 Å²	99.6	46%	0.461	52%	0.515	S	S	.	.	H	α-helix	trans	-62.3	-40	175.2	169.7	0	0	0	0	111.4	L460 R461 G462 L467 Q468	L460-V464 VanDerWaalsContact O-CG2 3.28Å; L460-V464 WeakPolarHBondContact O-CG2 3.41Å; L460-V464 PolarHBondContact O-N 2.89Å; R461-V464 PolarHBondContact O-N 2.88Å; G462-V464 VanDerWaalsContact C-N 3.28Å; G462-V464 PolarHBondContact O-N 3.25Å; V464-L467 PolarHBondContact O-N 2.89Å; V464-Q468 WeakPolarHBondContact O-CB 3.38Å; V464-Q468 VanDerWaalsContact O-CG 3.29Å; V464-Q468 WeakPolarHBondContact O-CG 3.36Å; V464-Q468 PolarHBondContact O-N 3.35Å
465	Q	97.4	Very high	97.1	Very high	113 Å²	113	99.1 Å²	99.1	53%	0.528	51%	0.513	S	S	.	.	H	α-helix	trans	-66.6	-41	175.2	-71.2	172.7	11.8	0	0	112	R461 G462 V463 Q468 Q469	R461-Q465 WeakPolarHBondContact O-CG 3.45Å; R461-Q465 PolarHBondContact O-N 2.92Å; R461-Q465 VanDerWaalsContact O-N 3.08Å; G462-Q465 WeakPolarHBondContact O-CA 3.3Å; G462-Q465 WeakPolarHBondContact O-CB 3.24Å; G462-Q465 PolarHBondContact O-N 3.36Å; V463-Q465 VanDerWaalsContact C-N 3.32Å; V463-Q465 PolarHBondContact O-N 3.19Å; Q465-Q468 WeakPolarHBondContact O-CB 3.45Å; Q465-Q468 PolarHBondContact O-N 3Å; Q465-Q469 WeakPolarHBondContact O-CG 3.35Å; Q465-Q469 PolarHBondContact O-N 2.98Å
466	E	97.3	Very high	97	Very high	133 Å²	133	97.3 Å²	97.3	62%	0.621	51%	0.507	S	S	*	.	H	α-helix	trans	-62.5	-42.7	175.1	-70.7	-179.6	-178.4	0	0	111.6	G462 V463 Q469 A470	G462-E466 PolarHBondContact O-N 3.5Å; V463-E466 PolarHBondContact O-N 3.15Å; E466-Q469 PolarHBondContact O-N 2.7Å; E466-A470 WeakPolarHBondContact O-CB 3.48Å; E466-A470 PolarHBondContact O-N 3.44Å
467	L	97.5	Very high	96.9	Very high	102 Å²	102	99.4 Å²	99.4	53%	0.534	51%	0.511	S	S	.	.	H	α-helix	trans	-62.4	-42.8	174.2	-73.8	173.1	0	0	0	111.6	V463 V464 Q469 A470 I471	V463-L467 HydrophobicContact CG1-CD1 4.11Å; V463-L467 HydrophobicContact CG1-CG 4.38Å; V463-L467 WeakPolarHBondContact O-CB 3.23Å; V463-L467 WeakPolarHBondContact O-CG 3.13Å; V463-L467 PolarHBondContact O-N 2.98Å; V464-L467 PolarHBondContact O-N 2.89Å; L467-Q469 VanDerWaalsContact C-N 3.35Å; L467-Q469 PolarHBondContact O-N 3.14Å; L467-A470 PolarHBondContact O-N 2.9Å; L467-I471 VanDerWaalsContact O-CG1 3.28Å; L467-I471 WeakPolarHBondContact O-CG1 3.34Å; L467-I471 PolarHBondContact O-N 3.23Å
468	Q	97.2	Very high	96.8	Very high	114 Å²	114	100.4 Å²	100.4	53%	0.533	52%	0.516	S	S	.	.	H	α-helix	trans	-59.7	-45	174.5	-76.9	174.9	-10.9	0	0	111.6	V464 Q465 A470 I471 S472	V464-Q468 WeakPolarHBondContact O-CB 3.38Å; V464-Q468 VanDerWaalsContact O-CG 3.29Å; V464-Q468 WeakPolarHBondContact O-CG 3.36Å; V464-Q468 PolarHBondContact O-N 3.35Å; Q465-Q468 WeakPolarHBondContact O-CB 3.45Å; Q465-Q468 PolarHBondContact O-N 3Å; Q468-A470 PolarHBondContact O-N 2.86Å; Q468-I471 PolarHBondContact O-N 3.44Å; Q468-S472 PolarHBondContact O-N 3.42Å; Q468-S472 PolarHBondContact O-OG 3.36Å
469	Q	97.4	Very high	96.5	Very high	135 Å²	135	97.7 Å²	97.7	63%	0.631	51%	0.506	S	S	*	.	H	α-helix	trans	-64.2	-39.7	176.5	-70.2	175.3	19.3	0	0	112.3	Q465 E466 L467 I471 S472 K473	Q465-Q469 WeakPolarHBondContact O-CG 3.35Å; Q465-Q469 PolarHBondContact O-N 2.98Å; E466-Q469 PolarHBondContact O-N 2.7Å; L467-Q469 VanDerWaalsContact C-N 3.35Å; L467-Q469 PolarHBondContact O-N 3.14Å; Q469-I471 VanDerWaalsContact C-N 3.35Å; Q469-S472 PolarHBondContact O-N 3.04Å; Q469-K473 WeakPolarHBondContact O-CB 3.36Å; Q469-K473 PolarHBondContact O-N 3.25Å
470	A	96.5	Very high	96.3	Very high	47 Å²	47	98.7 Å²	98.7	39%	0.388	51%	0.508	S	S	.	.	H	α-helix	trans	-63.3	-41.6	175.8	0	0	0	0	0	111.5	E466 L467 Q468 K473 L474	E466-A470 WeakPolarHBondContact O-CB 3.48Å; E466-A470 PolarHBondContact O-N 3.44Å; L467-A470 PolarHBondContact O-N 2.9Å; Q468-A470 PolarHBondContact O-N 2.86Å; A470-K473 PolarHBondContact O-N 3.02Å; A470-L474 WeakPolarHBondContact O-CG 3.43Å; A470-L474 PolarHBondContact O-N 3.37Å
471	I	97.3	Very high	95.7	Very high	89 Å²	89	98.7 Å²	98.7	46%	0.456	51%	0.508	S	S	.	.	H	α-helix	trans	-62.4	-50.7	174.4	-69.3	165.5	0	0	0	110.2	L467 Q468 Q469 K473 L474 E475	L467-I471 VanDerWaalsContact O-CG1 3.28Å; L467-I471 WeakPolarHBondContact O-CG1 3.34Å; L467-I471 PolarHBondContact O-N 3.23Å; Q468-I471 PolarHBondContact O-N 3.44Å; Q469-I471 VanDerWaalsContact C-N 3.35Å; I471-K473 PolarHBondContact O-N 3.5Å; I471-L474 CarbonylContact O-C 3.58Å; I471-L474 WeakPolarHBondContact O-CA 3.43Å; I471-L474 WeakPolarHBondContact O-CB 3.46Å; I471-L474 PolarHBondContact O-N 2.96Å; I471-E475 HydrophobicContact CG2-CG 4.23Å; I471-E475 WeakPolarHBondContact O-CG 3.32Å; I471-E475 PolarHBondContact O-N 3.28Å
472	S	96.7	Very high	95.2	Very high	67 Å²	67	97.3 Å²	97.3	47%	0.469	51%	0.509	S	S	.	.	H	α-helix	trans	-59.6	-35.2	177.7	-59.9	0	0	0	0	112.7	Q468 Q469 A476	Q468-S472 PolarHBondContact O-N 3.42Å; Q468-S472 PolarHBondContact O-OG 3.36Å; Q469-S472 PolarHBondContact O-N 3.04Å; S472-A476 WeakPolarHBondContact O-CB 3.42Å; S472-A476 PolarHBondContact O-N 3.37Å
473	K	96.9	Very high	94.5	Very high	147 Å²	147	104.2 Å²	104.2	64%	0.639	53%	0.532	S	S	*	.	H	α-helix	trans	-68.7	-38.9	174.2	-174.1	176.6	-178.4	177.3	0	112.2	Q469 A470 I471 R477	Q469-K473 WeakPolarHBondContact O-CB 3.36Å; Q469-K473 PolarHBondContact O-N 3.25Å; A470-K473 PolarHBondContact O-N 3.02Å; I471-K473 PolarHBondContact O-N 3.5Å; K473-R477 WeakPolarHBondContact O-CG 3.49Å; K473-R477 PolarHBondContact O-N 3.44Å
474	L	96.1	Very high	93.2	Very high	96 Å²	96	104.6 Å²	104.6	50%	0.503	54%	0.537	S	S	.	.	H	α-helix	trans	-67.5	-42.4	174.3	-74.1	170.3	0	0	0	111.4	A470 I471 A476 R477 L478	A470-L474 WeakPolarHBondContact O-CG 3.43Å; A470-L474 PolarHBondContact O-N 3.37Å; I471-L474 CarbonylContact O-C 3.58Å; I471-L474 WeakPolarHBondContact O-CA 3.43Å; I471-L474 WeakPolarHBondContact O-CB 3.46Å; I471-L474 PolarHBondContact O-N 2.96Å; L474-A476 VanDerWaalsContact C-N 3.33Å; L474-A476 PolarHBondContact O-N 2.87Å; L474-R477 CarbonylContact O-C 3.59Å; L474-R477 PolarHBondContact O-N 3.13Å; L474-R477 VanDerWaalsContact O-N 3.16Å; L474-L478 WeakPolarHBondContact O-CB 3.5Å; L474-L478 PolarHBondContact O-N 3.23Å
475	E	95.9	Very high	91.1	Very high	102 Å²	102	105 Å²	105	48%	0.477	54%	0.543	S	S	.	.	H	α-helix	trans	-59.4	-43	173.6	-72.2	172.8	169.3	0	0	111.2	I471 R477 L478 N479	I471-E475 HydrophobicContact CG2-CG 4.23Å; I471-E475 WeakPolarHBondContact O-CG 3.32Å; I471-E475 PolarHBondContact O-N 3.28Å; E475-R477 PolarHBondContact O-N 3.26Å; E475-L478 PolarHBondContact O-N 3.24Å; E475-N479 WeakPolarHBondContact O-CB 3.32Å; E475-N479 PolarHBondContact O-N 3.27Å; E475-N479 PolarHBondContact O-ND2 3.02Å
476	A	94.6	Very high	88.9	Confident	56 Å²	56	104.7 Å²	104.7	46%	0.463	55%	0.551	S	S	.	*	H	α-helix	trans	-62.5	-42.4	174.4	0	0	0	0	0	111.8	S472 L474 N479 V480	S472-A476 WeakPolarHBondContact O-CB 3.42Å; S472-A476 PolarHBondContact O-N 3.37Å; L474-A476 VanDerWaalsContact C-N 3.33Å; L474-A476 PolarHBondContact O-N 2.87Å; A476-N479 PolarHBondContact O-N 3.34Å; A476-V480 WeakPolarHBondContact O-CG2 3.38Å; A476-V480 PolarHBondContact O-N 2.94Å
477	R	94.7	Very high	86.6	Confident	151 Å²	151	101.9 Å²	101.9	57%	0.57	56%	0.558	S	S	*	*	H	α-helix	trans	-65.4	-42.4	175.9	-73.5	175.7	67.2	-168.7	1	112.1	K473 L474 E475 V480 L481	K473-R477 WeakPolarHBondContact O-CG 3.49Å; K473-R477 PolarHBondContact O-N 3.44Å; L474-R477 CarbonylContact O-C 3.59Å; L474-R477 PolarHBondContact O-N 3.13Å; L474-R477 VanDerWaalsContact O-N 3.16Å; E475-R477 PolarHBondContact O-N 3.26Å; R477-V480 PolarHBondContact O-N 2.67Å; R477-L481 VanDerWaalsContact O-CD1 3.26Å; R477-L481 WeakPolarHBondContact O-CD1 3.35Å; R477-L481 PolarHBondContact O-N 2.85Å
478	L	94.3	Very high	83.8	Confident	105 Å²	105	106.5 Å²	106.5	55%	0.55	58%	0.576	S	S	.	*	H	α-helix	trans	-60.5	-46.5	174.9	-82.7	172.2	0	0	0	110.9	L474 E475 V480 L481 E482	L474-L478 WeakPolarHBondContact O-CB 3.5Å; L474-L478 PolarHBondContact O-N 3.23Å; E475-L478 PolarHBondContact O-N 3.24Å; L478-V480 VanDerWaalsContact C-N 3.27Å; L478-V480 PolarHBondContact O-N 3.49Å; L478-L481 PolarHBondContact O-N 3.37Å; L478-L481 VanDerWaalsContact O-N 3.11Å; L478-E482 WeakPolarHBondContact O-CB 3.39Å; L478-E482 WeakPolarHBondContact O-CG 3.46Å; L478-E482 PolarHBondContact O-N 2.86Å
479	N	92.1	Very high	81	Confident	76 Å²	76	112.9 Å²	112.9	41%	0.406	60%	0.595	S	S	.	*	H	α-helix	trans	-58.2	-37.2	174.4	-85.3	-69.1	0	0	0	112.8	E475 A476 K483	E475-N479 WeakPolarHBondContact O-CB 3.32Å; E475-N479 PolarHBondContact O-N 3.27Å; E475-N479 PolarHBondContact O-ND2 3.02Å; A476-N479 PolarHBondContact O-N 3.34Å; N479-K483 WeakPolarHBondContact O-CB 3.26Å; N479-K483 VanDerWaalsContact O-CD 3.32Å; N479-K483 WeakPolarHBondContact O-CD 3.45Å; N479-K483 WeakPolarHBondContact O-CG 3.24Å; N479-K483 PolarHBondContact O-N 3.06Å
480	V	91.2	Very high	78.2	Confident	94 Å²	94	110.6 Å²	110.6	57%	0.57	60%	0.6	S	S	*	*	H	α-helix	trans	-71.2	-41.3	174.8	171.4	0	0	0	0	111.4	A476 R477 L478 K483 S484	A476-V480 WeakPolarHBondContact O-CG2 3.38Å; A476-V480 PolarHBondContact O-N 2.94Å; R477-V480 PolarHBondContact O-N 2.67Å; L478-V480 VanDerWaalsContact C-N 3.27Å; L478-V480 PolarHBondContact O-N 3.49Å; V480-K483 PolarHBondContact O-N 3.49Å; V480-S484 VanDerWaalsContact O-CB 3.25Å; V480-S484 WeakPolarHBondContact O-CB 3.31Å; V480-S484 PolarHBondContact O-N 3.03Å; V480-S484 PolarHBondContact O-OG 3.05Å
481	L	85.3	Confident	75.2	Confident	107 Å²	107	115.3 Å²	115.3	56%	0.56	62%	0.624	S	S	*	*	H	α-helix	trans	-64	-41.8	176	-94.9	111.5	0	0	0	112.1	R477 L478 K483 S484 S485	R477-L481 VanDerWaalsContact O-CD1 3.26Å; R477-L481 WeakPolarHBondContact O-CD1 3.35Å; R477-L481 PolarHBondContact O-N 2.85Å; L478-L481 PolarHBondContact O-N 3.37Å; L478-L481 VanDerWaalsContact O-N 3.11Å; L481-K483 VanDerWaalsContact C-N 3.28Å; L481-K483 PolarHBondContact O-N 3.22Å; L481-S484 WeakPolarHBondContact CA-OG 3.36Å; L481-S484 PolarHBondContact O-N 3.34Å; L481-S484 PolarHBondContact O-OG 3.26Å; L481-S485 PolarHBondContact O-N 3.25Å
482	E	87.8	Confident	72.3	Confident	142 Å²	142	115.2 Å²	115.2	66%	0.664	64%	0.637	S	S	*	*	H	α-helix	trans	-62.9	-35.4	174.6	-74.8	178.6	171.7	0	0	112	L478	L478-E482 WeakPolarHBondContact O-CB 3.39Å; L478-E482 WeakPolarHBondContact O-CG 3.46Å; L478-E482 PolarHBondContact O-N 2.86Å
483	K	82.4	Confident	69.6	Low	171 Å²	171	117.6 Å²	117.6	74%	0.743	65%	0.651	S	S	*	*	H	α-helix	trans	-81.3	-23.5	177	-70.3	170.1	-172.2	177.5	0	114.1	N479 V480 L481	N479-K483 WeakPolarHBondContact O-CB 3.26Å; N479-K483 VanDerWaalsContact O-CD 3.32Å; N479-K483 WeakPolarHBondContact O-CD 3.45Å; N479-K483 WeakPolarHBondContact O-CG 3.24Å; N479-K483 PolarHBondContact O-N 3.06Å; V480-K483 PolarHBondContact O-N 3.49Å; L481-K483 VanDerWaalsContact C-N 3.28Å; L481-K483 PolarHBondContact O-N 3.22Å
484	S	71.2	Confident	66.5	Low	74 Å²	74	118.9 Å²	118.9	52%	0.517	66%	0.659	S	S	.	*	H	α-helix	trans	-100.3	-5.1	-177.1	56.6	0	0	0	0	114.2	V480 L481 P486	V480-S484 VanDerWaalsContact O-CB 3.25Å; V480-S484 WeakPolarHBondContact O-CB 3.31Å; V480-S484 PolarHBondContact O-N 3.03Å; V480-S484 PolarHBondContact O-OG 3.05Å; L481-S484 WeakPolarHBondContact CA-OG 3.36Å; L481-S484 PolarHBondContact O-N 3.34Å; L481-S484 PolarHBondContact O-OG 3.26Å; S484-P486 WeakPolarHBondContact O-CD 3.32Å
485	S	53.3	Low	63.4	Low	84 Å²	84	119.8 Å²	119.8	59%	0.587	67%	0.669	S	S	*	*			trans	-77	106.9	168.3	175	0	0	0	0	110.1	L481	L481-S485 PolarHBondContact O-N 3.25Å
486	P	51.2	Low	60.4	Low	107 Å²	107	123.6 Å²	123.6	70%	0.695	69%	0.686	S	S	*	*			trans	-74.9	131.5	166.2	3.7	17.6	0	0	0	106.7	S484 H488	S484-P486 WeakPolarHBondContact O-CD 3.32Å; P486-H488 PolarHBondContact O-N 2.82Å
487	G	48.8	Very low	57.3	Low	74 Å²	74	129.5 Å²	129.5	76%	0.763	70%	0.704	S	S	*	*			trans	-49.5	114.5	-179.3	0	0	0	0	0	112.4	R489	G487-R489 PolarHBondContact O-N 2.89Å; G487-R489 VanDerWaalsContact O-N 3.12Å
488	H	38.7	Very low	54.2	Low	199 Å²	199	127.3 Å²	127.3	92%	0.921	71%	0.707	S	S	*	*			trans	-77.2	87.7	150.5	-91.3	-70.3	0	0	0	107.8	P486	P486-H488 PolarHBondContact O-N 2.82Å
489	R	39.9	Very low	51.4	Low	247 Å²	247	127.4 Å²	127.4	93%	0.932	72%	0.716	S	S	*	*			trans	-121.4	103	149.4	-170.7	170.8	-171.5	158.2	2.7	109.2	G487	G487-R489 PolarHBondContact O-N 2.89Å; G487-R489 VanDerWaalsContact O-N 3.12Å
490	A	38.3	Very low	49.4	Very low	88 Å²	88	128.8 Å²	128.8	73%	0.727	73%	0.729	S	S	*	*			trans	-167.1	127.1	149.2	0	0	0	0	0	105.3
491	T	32.9	Very low	46.3	Very low	146 Å²	146	132.5 Å²	132.5	90%	0.896	74%	0.743	S	S	*	*			cis	-154	146.8	43.1	-36.2	0	0	0	0	110.7
492	A	35.7	Very low	43.8	Very low	87 Å²	87	138.6 Å²	138.6	72%	0.719	76%	0.758	S	S	*	*			trans	-84.2	-178.4	-173	0	0	0	0	0	114.4
493	P	40.5	Very low	41	Very low	117 Å²	117	140.4 Å²	140.4	76%	0.76	77%	0.767	S	S	*	*				-132.9	145.3	77.5	22.5	-2	0	0	0	116.7
494	Q	31.8	Very low	38.5	Very low	173 Å²	173	138.9 Å²	138.9	81%	0.808	77%	0.772	S	S	*	*			trans	61.9	128.6	143.9	-58.3	-173.9	21.1	0	0	118.1
495	T	30.8	Very low	36.7	Very low	116 Å²	116	143.7 Å²	143.7	71%	0.712	79%	0.786	S	S	*	*			cis	-154	136.9	45.3	44.2	0	0	0	0	113.5
496	Q	33.2	Very low	36.8	Very low	181 Å²	181	144.6 Å²	144.6	85%	0.846	79%	0.79	S	S	*	*			trans	53.9	103.8	142.6	-57.8	178.8	0.6	0	0	119
497	H	29.8	Very low	36.2	Very low	180 Å²	180	146 Å²	146	83%	0.833	80%	0.799	S	S	*	*				67.7	117.5	85.1	-157.1	-125	0	0	0	110.1
498	V	30.2	Very low	35.6	Very low	106 Å²	106	146.9 Å²	146.9	64%	0.642	80%	0.799	S	S	*	*			cis	-165.3	128.8	48.2	175.1	0	0	0	0	109.4
499	S	35.5	Very low	35.2	Very low	106 Å²	106	147.6 Å²	147.6	74%	0.741	80%	0.8	S	S	*	*			trans	-87.1	169.9	148.1	-32.8	0	0	0	0	107.9
500	P	49	Very low	34.8	Very low	105 Å²	105	145.4 Å²	145.4	68%	0.682	80%	0.797	S	S	*	*				-167.3	-179.6	55.9	41	-16.2	0	0	0	119.7
501	M	26.7	Very low	35	Very low	173 Å²	173	147 Å²	147	85%	0.852	80%	0.8	S	S	*	*			trans	74.1	138.9	148.5	-92.3	166.9	139.6	0	0	117.6
502	R	32.4	Very low	34.9	Very low	235 Å²	235	144.8 Å²	144.8	89%	0.887	80%	0.796	S	S	*	*			cis	-167.4	150.5	43.4	-154.8	173.7	176.4	-160.5	-1.2	110.5
503	Q	29.6	Very low	34.8	Very low	179 Å²	179	147 Å²	147	84%	0.836	80%	0.801	S	S	*	*			trans	-71.4	166.1	-179.3	-59.1	-175.6	-10.8	0	0	114.5
504	V	30.1	Very low	34.8	Very low	140 Å²	140	147.1 Å²	147.1	85%	0.848	80%	0.802	S	S	*	*				169.7	141	120.7	158.1	0	0	0	0	111.6
505	E	32.1	Very low	34.7	Very low	174 Å²	174	143.2 Å²	143.2	81%	0.813	80%	0.799	S	S	*	*			trans	-117.4	-179.5	172.3	-149.7	-170.1	138.8	0	0	109.8
506	P	55.8	Low	35	Very low	103 Å²	103	146.8 Å²	146.8	67%	0.669	81%	0.808	S	S	*	*				-100.6	-172.1	-104.5	40	-23.1	0	0	0	115.7
507	P	37.5	Very low	35.2	Very low	136 Å²	136	145.1 Å²	145.1	88%	0.883	80%	0.804	S	S	*	*				-153.7	173.3	111.1	37	-16.6	0	0	0	117.8
508	A	36.3	Very low	36.1	Very low	94 Å²	94	144.2 Å²	144.2	78%	0.777	81%	0.806	S	S	*	*			trans	-97.8	156.2	-168.1	0	0	0	0	0	117.5
509	K	30	Very low	37.1	Very low	214 Å²	214	147.4 Å²	147.4	93%	0.93	81%	0.814	S	S	*	*			trans	174.9	141.3	131.1	-99.8	172.8	-177.7	177.5	0	114.5
510	K	32.3	Very low	37.5	Very low	200 Å²	200	150.2 Å²	150.2	87%	0.87	82%	0.821	S	S	*	*			trans	-80.2	-178	172.6	-56.9	176.8	173.3	179.5	0	111.7
511	P	43.3	Very low	37.5	Very low	121 Å²	121	151.9 Å²	151.9	79%	0.786	82%	0.824	S	S	*	*			cis	-145.5	178	5.8	41.2	-19.8	0	0	0	119.3
512	A	29.8	Very low	38.8	Very low	100 Å²	100	151.8 Å²	151.8	83%	0.826	83%	0.827	S	S	*	*			trans	96.2	133.1	146.7	0	0	0	0	0	122.7
513	T	34.4	Very low	39.6	Very low	135 Å²	135	146.8 Å²	146.8	83%	0.828	82%	0.816	S	S	*	*			trans	-76.5	-178.8	-170.1	48.6	0	0	0	0	116.7
514	P	40.5	Very low	41.3	Very low	119 Å²	119	143.8 Å²	143.8	77%	0.773	81%	0.806	S	S	*	*			cis	-141.1	177.4	10.2	41.1	-20.6	0	0	0	118.6
515	A	30.4	Very low	42.8	Very low	90 Å²	90	143.9 Å²	143.9	74%	0.744	80%	0.801	S	S	*	*			trans	87.7	122.3	150.3	0	0	0	0	0	121.5
516	E	37	Very low	43.6	Very low	192 Å²	192	145 Å²	145	90%	0.897	80%	0.803	S	S	*	*			trans	50.2	109.2	144.1	-54.9	-168.5	-177.8	0	0	120
517	D	36.5	Very low	43.5	Very low	145 Å²	145	143 Å²	143	78%	0.775	80%	0.802	S	S	*	*				-166.8	124.8	116.9	-138.1	-10.6	0	0	0	109.4
518	D	48.4	Very low	43.7	Very low	161 Å²	161	141.6 Å²	141.6	86%	0.861	80%	0.795	S	S	*	*			trans	-88.3	91.1	168.1	-97.9	-32	0	0	0	106.2
519	E	50.9	Low	44.1	Very low	173 Å²	173	144.9 Å²	144.9	81%	0.808	80%	0.8	S	S	*	*			trans	-174.8	95.4	166.2	-104.8	163	-138.9	0	0	108.2
520	D	45.3	Very low	44.8	Very low	166 Å²	166	140 Å²	140	89%	0.888	78%	0.783	S	S	*	*			trans	-134.2	115.4	162.5	-121.1	-13.9	0	0	0	109
521	D	47.1	Very low	45.6	Very low	140 Å²	140	139.4 Å²	139.4	75%	0.749	78%	0.784	S	S	*	*			trans	-52.7	125.3	-174.9	-69.7	-63.4	0	0	0	112.9	I523	D521-I523 HydrophobicContact CB-CG1 4.04Å; D521-I523 PolarHBondContact O-N 3.32Å
522	D	54.6	Low	45.8	Very low	171 Å²	171	142.3 Å²	142.3	91%	0.914	79%	0.787	S	S	*	*			trans	-63.4	82	156.5	-84.1	-33.6	0	0	0	108.2	D524	D522-D524 PolarHBondContact O-N 3.2Å
523	I	50	Low	46.6	Very low	129 Å²	129	144.5 Å²	144.5	66%	0.662	78%	0.78	S	S	*	*			trans	-68.9	97.2	169.5	-52.2	-168.3	0	0	0	107.8	D521 L525	D521-I523 HydrophobicContact CB-CG1 4.04Å; D521-I523 PolarHBondContact O-N 3.32Å; I523-L525 HydrophobicContact CB-CD1 4.05Å; I523-L525 HydrophobicContact CG2-CD1 3.37Å; I523-L525 HydrophobicContact CG2-CG 4.27Å; I523-L525 PolarHBondContact O-N 2.71Å
524	D	64.9	Low	47.4	Very low	117 Å²	117	142.4 Å²	142.4	63%	0.626	76%	0.764	S	S	*	*			trans	-71.3	90.1	168.7	-177.1	13.3	0	0	0	110.4	D522 F526 G527	D522-D524 PolarHBondContact O-N 3.2Å; D524-F526 PolarHBondContact O-N 3.43Å; D524-F526 PolarHBondContact OD1-N 3.26Å; D524-G527 PolarHBondContact OD1-N 3.42Å
525	L	62.5	Low	48.1	Very low	142 Å²	142	144.4 Å²	144.4	74%	0.743	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	5	173.8	-98	104.6	0	0	0	114.2	I523	I523-L525 HydrophobicContact CB-CD1 4.05Å; I523-L525 HydrophobicContact CG2-CD1 3.37Å; I523-L525 HydrophobicContact CG2-CG 4.27Å; I523-L525 PolarHBondContact O-N 2.71Å
526	F	48.4	Very low	49.2	Very low	197 Å²	197	147.2 Å²	147.2	86%	0.864	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.5	15.2	178	-73.5	-82.9	0	0	0	113.8	D524 S528	D524-F526 PolarHBondContact O-N 3.43Å; D524-F526 PolarHBondContact OD1-N 3.26Å; F526-S528 VanDerWaalsContact C-N 3.33Å; F526-S528 PolarHBondContact O-N 3.32Å; F526-S528 VanDerWaalsContact O-N 3.08Å
527	G	52.4	Low	50.2	Low	61 Å²	61	139.5 Å²	139.5	63%	0.629	73%	0.727	S	S	*	*			trans	-83.1	67.3	174.9	0	0	0	0	0	112.8	D524	D524-G527 PolarHBondContact OD1-N 3.42Å
528	S	42.8	Very low	51.6	Low	106 Å²	106	134.8 Å²	134.8	74%	0.741	71%	0.708	S	S	*	*			trans	-122.9	109.9	164.5	72	0	0	0	0	110.9	F526	F526-S528 VanDerWaalsContact C-N 3.33Å; F526-S528 PolarHBondContact O-N 3.32Å; F526-S528 VanDerWaalsContact O-N 3.08Å
529	D	44.5	Very low	52.5	Low	164 Å²	164	132.9 Å²	132.9	88%	0.877	69%	0.694	S	S	*	*	S	Bend	trans	79.6	99.1	157.5	-149.3	18	0	0	0	118.2
530	N	43.8	Very low	53.3	Low	110 Å²	110	130 Å²	130	59%	0.588	68%	0.684	S	S	*	*				158.4	93.3	127.8	-164.6	35.2	0	0	0	110.9	E532	N530-E532 PolarHBondContact O-N 3.39Å
531	E	49.8	Very low	54.4	Low	189 Å²	189	129 Å²	129	88%	0.883	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	3.7	-168.2	-69.7	-171.5	145.4	0	0	116.5
532	E	47.3	Very low	55.4	Low	181 Å²	181	126.8 Å²	126.8	85%	0.846	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	-13.3	-171.7	-152.5	134	-150.8	0	0	114.4	N530	N530-E532 PolarHBondContact O-N 3.39Å
533	E	46	Very low	56.1	Low	147 Å²	147	124.1 Å²	124.1	69%	0.687	64%	0.635	S	S	*	*	S	Bend	trans	-99	-8.1	179.9	-155	165.7	-175	0	0	113.3	K535 A537	E533-K535 PolarHBondContact O-N 3.09Å; E533-A537 PolarHBondContact O-N 3.13Å
534	D	51.4	Low	57.2	Low	90 Å²	90	124 Å²	124	48%	0.481	63%	0.626	S	S	.	*	H	α-helix	trans	-81.2	-19.7	-167.5	-135.9	4.5	0	0	0	113.9	A538 R541	D534-A538 WeakPolarHBondContact O-CB 3.21Å; D534-A538 PolarHBondContact O-N 3.26Å; D534-R541 IonicContact OD1-NH1 3.44Å; D534-R541 IonicContact OD1-NH2 2.67Å; D534-R541 PolarHBondContact OD1-NH2 3.04Å
535	K	54.9	Low	57.5	Low	162 Å²	162	124.1 Å²	124.1	70%	0.704	63%	0.626	S	S	*	*	H	α-helix	trans	-73.6	-34.2	177.1	-68.3	176	-173.5	161.6	0	112.5	E533 Q539	E533-K535 PolarHBondContact O-N 3.09Å; K535-Q539 VanDerWaalsContact O-CG 3.25Å; K535-Q539 WeakPolarHBondContact O-CG 3.19Å; K535-Q539 PolarHBondContact O-N 3.45Å; K535-Q539 PolarHBondContact O-NE2 3.49Å
536	E	54.7	Low	57.8	Low	148 Å²	148	124.3 Å²	124.3	69%	0.692	62%	0.617	S	S	*	*	H	α-helix	trans	-81.3	-36.8	176.8	-63	-160	170.4	0	0	110.9	Q539 L540	E536-Q539 PolarHBondContact O-N 3.34Å; E536-L540 WeakPolarHBondContact O-CB 3.27Å; E536-L540 PolarHBondContact O-N 3.4Å
537	A	58.8	Low	58.6	Low	31 Å²	31	118.4 Å²	118.4	26%	0.256	59%	0.592	S	S	.	*	H	α-helix	trans	-65.9	-38.2	173	0	0	0	0	0	112.4	E533 L540 R541	E533-A537 PolarHBondContact O-N 3.13Å; A537-L540 PolarHBondContact O-N 3.21Å; A537-R541 WeakPolarHBondContact O-CB 3.42Å; A537-R541 VanDerWaalsContact O-CG 3.25Å; A537-R541 WeakPolarHBondContact O-CG 3.49Å; A537-R541 PolarHBondContact O-N 3.46Å
538	A	65.7	Low	58.7	Low	45 Å²	45	121.3 Å²	121.3	37%	0.372	59%	0.585	S	S	.	*	H	α-helix	trans	-64.9	-41	173.7	0	0	0	0	0	112.1	D534 R541 E542	D534-A538 WeakPolarHBondContact O-CB 3.21Å; D534-A538 PolarHBondContact O-N 3.26Å; A538-R541 PolarHBondContact O-N 2.69Å; A538-E542 WeakPolarHBondContact O-CB 3.47Å; A538-E542 PolarHBondContact O-N 2.83Å
539	Q	66.9	Low	59.9	Low	121 Å²	121	119 Å²	119	57%	0.565	57%	0.572	S	S	*	*	H	α-helix	trans	-64.6	-41.3	174.7	-75.6	171.4	63.4	0	0	112	K535 E536 E542 E543	K535-Q539 VanDerWaalsContact O-CG 3.25Å; K535-Q539 WeakPolarHBondContact O-CG 3.19Å; K535-Q539 PolarHBondContact O-N 3.45Å; K535-Q539 PolarHBondContact O-NE2 3.49Å; E536-Q539 PolarHBondContact O-N 3.34Å; Q539-E542 PolarHBondContact O-N 3.05Å; Q539-E543 VanDerWaalsContact O-CB 3.23Å; Q539-E543 WeakPolarHBondContact O-CB 3.37Å; Q539-E543 PolarHBondContact O-N 3.31Å
540	L	66.5	Low	60.8	Low	113 Å²	113	116.9 Å²	116.9	59%	0.592	56%	0.557	S	S	*	*	H	α-helix	trans	-65.8	-38.2	174.8	-96.3	154.7	0	0	0	112.7	E536 A537 R544	E536-L540 WeakPolarHBondContact O-CB 3.27Å; E536-L540 PolarHBondContact O-N 3.4Å; A537-L540 PolarHBondContact O-N 3.21Å; L540-R544 VanDerWaalsContact O-CB 3.25Å; L540-R544 WeakPolarHBondContact O-CB 3.45Å; L540-R544 WeakPolarHBondContact O-CG 3.31Å; L540-R544 PolarHBondContact O-N 3.01Å
541	R	68.4	Low	61.8	Low	145 Å²	145	117.7 Å²	117.7	55%	0.547	56%	0.555	S	S	.	*	H	α-helix	trans	-66.8	-43	174.2	-72.3	177	-144.1	142.5	8.3	111	D534 A537 A538 R544 L545	D534-R541 IonicContact OD1-NH1 3.44Å; D534-R541 IonicContact OD1-NH2 2.67Å; D534-R541 PolarHBondContact OD1-NH2 3.04Å; A537-R541 WeakPolarHBondContact O-CB 3.42Å; A537-R541 VanDerWaalsContact O-CG 3.25Å; A537-R541 WeakPolarHBondContact O-CG 3.49Å; A537-R541 PolarHBondContact O-N 3.46Å; A538-R541 PolarHBondContact O-N 2.69Å; R541-R544 PolarHBondContact O-N 2.92Å; R541-L545 WeakPolarHBondContact O-CB 3.15Å; R541-L545 WeakPolarHBondContact O-CD1 3.3Å; R541-L545 VanDerWaalsContact O-CG 3.27Å; R541-L545 WeakPolarHBondContact O-CG 3.45Å; R541-L545 PolarHBondContact O-N 3.2Å
542	E	69.9	Low	62.3	Low	93 Å²	93	115.8 Å²	115.8	44%	0.435	54%	0.544	S	S	.	.	H	α-helix	trans	-66.2	-42.4	177.4	-170.6	179.4	-178.3	0	0	111.6	A538 Q539 R544 L545 R546	A538-E542 WeakPolarHBondContact O-CB 3.47Å; A538-E542 PolarHBondContact O-N 2.83Å; Q539-E542 PolarHBondContact O-N 3.05Å; E542-R544 PolarHBondContact O-N 3.2Å; E542-L545 PolarHBondContact O-N 2.97Å; E542-R546 WeakPolarHBondContact O-CB 3.48Å; E542-R546 VanDerWaalsContact O-CG 3.27Å; E542-R546 WeakPolarHBondContact O-CG 3.25Å; E542-R546 PolarHBondContact O-N 3.3Å; E542-R546 IonicContact OE1-CZ 2.68Å; E542-R546 IonicContact OE1-NE 3.18Å; E542-R546 PolarHBondContact OE1-NE 2.77Å; E542-R546 IonicContact OE1-NH2 2.85Å; E542-R546 PolarHBondContact OE1-NH2 3.17Å; E542-R546 IonicContact OE2-NH2 3.17Å
543	E	69.4	Low	62.8	Low	115 Å²	115	111.1 Å²	111.1	54%	0.537	54%	0.537	S	S	.	.	H	α-helix	trans	-67.2	-37.2	176.7	-172.9	151.3	-155.2	0	0	111.6	Q539 R546 Q547	Q539-E543 VanDerWaalsContact O-CB 3.23Å; Q539-E543 WeakPolarHBondContact O-CB 3.37Å; Q539-E543 PolarHBondContact O-N 3.31Å; E543-R546 PolarHBondContact O-N 3.09Å; E543-Q547 WeakPolarHBondContact O-CB 3.25Å; E543-Q547 VanDerWaalsContact O-CG 3.23Å; E543-Q547 WeakPolarHBondContact O-CG 3.22Å; E543-Q547 PolarHBondContact O-N 3.27Å
544	R	72.1	Confident	63.3	Low	128 Å²	128	112 Å²	112	48%	0.483	54%	0.538	S	S	.	.	H	α-helix	trans	-64.4	-43.2	170.6	-72.9	-82.2	-75.2	-171.6	-4.2	111.3	L540 R541 E542 Q547 Y548	L540-R544 VanDerWaalsContact O-CB 3.25Å; L540-R544 WeakPolarHBondContact O-CB 3.45Å; L540-R544 WeakPolarHBondContact O-CG 3.31Å; L540-R544 PolarHBondContact O-N 3.01Å; R541-R544 PolarHBondContact O-N 2.92Å; E542-R544 PolarHBondContact O-N 3.2Å; R544-Q547 PolarHBondContact O-N 2.81Å; R544-Y548 PolarHBondContact NH2-OH 2.81Å; R544-Y548 WeakPolarHBondContact O-CB 3.36Å; R544-Y548 WeakPolarHBondContact O-CD2 3.43Å; R544-Y548 PolarHBondContact O-N 2.92Å
545	L	71.7	Confident	63.2	Low	119 Å²	119	114.7 Å²	114.7	62%	0.623	55%	0.546	S	S	*	.	H	α-helix	trans	-64.1	-39.6	176.8	-78.7	162.3	0	0	0	112	R541 E542 Y548 A549	R541-L545 WeakPolarHBondContact O-CB 3.15Å; R541-L545 WeakPolarHBondContact O-CD1 3.3Å; R541-L545 VanDerWaalsContact O-CG 3.27Å; R541-L545 WeakPolarHBondContact O-CG 3.45Å; R541-L545 PolarHBondContact O-N 3.2Å; E542-L545 PolarHBondContact O-N 2.97Å; L545-Y548 CarbonylContact O-C 3.58Å; L545-Y548 PolarHBondContact O-N 2.98Å; L545-A549 WeakPolarHBondContact O-CB 3.25Å; L545-A549 PolarHBondContact O-N 3.34Å
546	R	67.9	Low	62.9	Low	146 Å²	146	113 Å²	113	55%	0.551	55%	0.551	S	S	*	*	H	α-helix	trans	-63.9	-44.1	172.8	-72.4	174	-175.2	-169.5	3.1	111.3	E542 E543 Y548 A549 E550	E542-R546 WeakPolarHBondContact O-CB 3.48Å; E542-R546 VanDerWaalsContact O-CG 3.27Å; E542-R546 WeakPolarHBondContact O-CG 3.25Å; E542-R546 PolarHBondContact O-N 3.3Å; E542-R546 IonicContact OE1-CZ 2.68Å; E542-R546 IonicContact OE1-NE 3.18Å; E542-R546 PolarHBondContact OE1-NE 2.77Å; E542-R546 IonicContact OE1-NH2 2.85Å; E542-R546 PolarHBondContact OE1-NH2 3.17Å; E542-R546 IonicContact OE2-NH2 3.17Å; E543-R546 PolarHBondContact O-N 3.09Å; R546-Y548 VanDerWaalsContact C-N 3.3Å; R546-Y548 PolarHBondContact O-N 3Å; R546-A549 PolarHBondContact O-N 3.08Å; R546-A549 VanDerWaalsContact O-N 3.17Å; R546-E550 WeakPolarHBondContact O-CB 3.28Å; R546-E550 WeakPolarHBondContact O-CG 3.25Å; R546-E550 PolarHBondContact O-N 3.46Å
547	Q	65.9	Low	62.9	Low	72 Å²	72	109.6 Å²	109.6	34%	0.336	55%	0.548	S	S	.	.	H	α-helix	trans	-63.7	-34.9	173.5	-71.5	175.5	21.9	0	0	112.5	E543 R544 K551	E543-Q547 WeakPolarHBondContact O-CB 3.25Å; E543-Q547 VanDerWaalsContact O-CG 3.23Å; E543-Q547 WeakPolarHBondContact O-CG 3.22Å; E543-Q547 PolarHBondContact O-N 3.27Å; R544-Q547 PolarHBondContact O-N 2.81Å; Q547-K551 VanDerWaalsContact O-CB 3.26Å; Q547-K551 WeakPolarHBondContact O-CB 3.39Å; Q547-K551 WeakPolarHBondContact O-CD 3.35Å; Q547-K551 WeakPolarHBondContact O-CG 3.17Å; Q547-K551 PolarHBondContact O-N 3.12Å
548	Y	54.9	Low	62.4	Low	122 Å²	122	117.1 Å²	117.1	48%	0.478	58%	0.583	S	S	.	*	H	α-helix	trans	-72.6	-34	173.7	-79.8	-65.9	0	0	0	112.2	R544 L545 R546 K551 K552	R544-Y548 PolarHBondContact NH2-OH 2.81Å; R544-Y548 WeakPolarHBondContact O-CB 3.36Å; R544-Y548 WeakPolarHBondContact O-CD2 3.43Å; R544-Y548 PolarHBondContact O-N 2.92Å; L545-Y548 CarbonylContact O-C 3.58Å; L545-Y548 PolarHBondContact O-N 2.98Å; R546-Y548 VanDerWaalsContact C-N 3.3Å; R546-Y548 PolarHBondContact O-N 3Å; Y548-K551 PolarHBondContact O-N 3.28Å; Y548-K552 VanDerWaalsContact O-CB 3.32Å; Y548-K552 WeakPolarHBondContact O-CB 3.21Å; Y548-K552 WeakPolarHBondContact O-CG 3.39Å; Y548-K552 PolarHBondContact O-N 3.27Å
549	A	66.4	Low	61.7	Low	59 Å²	59	119 Å²	119	49%	0.488	59%	0.59	S	S	.	*	H	α-helix	trans	-68.5	-45.1	174.2	0	0	0	0	0	111.3	L545 R546 K551 K552 A553	L545-A549 WeakPolarHBondContact O-CB 3.25Å; L545-A549 PolarHBondContact O-N 3.34Å; R546-A549 PolarHBondContact O-N 3.08Å; R546-A549 VanDerWaalsContact O-N 3.17Å; A549-K551 VanDerWaalsContact C-N 3.34Å; A549-K551 PolarHBondContact O-N 3.24Å; A549-K552 CarbonylContact O-C 3.48Å; A549-K552 PolarHBondContact O-N 2.92Å; A549-A553 VanDerWaalsContact O-CB 3.29Å; A549-A553 WeakPolarHBondContact O-CB 3.31Å; A549-A553 PolarHBondContact O-N 3.42Å
550	E	65.4	Low	61.2	Low	119 Å²	119	116.3 Å²	116.3	56%	0.556	59%	0.589	S	S	*	*	H	α-helix	trans	-62.2	-39.4	173.3	-73.8	176.4	-169.8	0	0	112.1	R546 K554	R546-E550 WeakPolarHBondContact O-CB 3.28Å; R546-E550 WeakPolarHBondContact O-CG 3.25Å; R546-E550 PolarHBondContact O-N 3.46Å; E550-K554 WeakPolarHBondContact O-CG 3.4Å; E550-K554 PolarHBondContact O-N 2.86Å
551	K	63.7	Low	61.4	Low	126 Å²	126	119 Å²	119	55%	0.548	60%	0.596	S	S	.	*	H	α-helix	trans	-72.4	-28.1	175.5	-72.8	170	-174.1	172.7	0	112.7	Q547 Y548 A549	Q547-K551 VanDerWaalsContact O-CB 3.26Å; Q547-K551 WeakPolarHBondContact O-CB 3.39Å; Q547-K551 WeakPolarHBondContact O-CD 3.35Å; Q547-K551 WeakPolarHBondContact O-CG 3.17Å; Q547-K551 PolarHBondContact O-N 3.12Å; Y548-K551 PolarHBondContact O-N 3.28Å; A549-K551 VanDerWaalsContact C-N 3.34Å; A549-K551 PolarHBondContact O-N 3.24Å
552	K	60.6	Low	61.7	Low	149 Å²	149	114.3 Å²	114.3	65%	0.648	59%	0.585	S	S	*	*	H	α-helix	trans	-82.3	-30.2	173.6	-79.6	-158.8	175.8	-177.8	0	113.2	Y548 A549 K554 K555	Y548-K552 VanDerWaalsContact O-CB 3.32Å; Y548-K552 WeakPolarHBondContact O-CB 3.21Å; Y548-K552 WeakPolarHBondContact O-CG 3.39Å; Y548-K552 PolarHBondContact O-N 3.27Å; A549-K552 CarbonylContact O-C 3.48Å; A549-K552 PolarHBondContact O-N 2.92Å; K552-K554 VanDerWaalsContact C-N 3.26Å; K552-K554 PolarHBondContact O-N 3.24Å; K552-K555 WeakPolarHBondContact O-CB 3.47Å; K552-K555 PolarHBondContact O-N 3.25Å
553	A	58	Low	62.3	Low	84 Å²	84	113.3 Å²	113.3	69%	0.694	59%	0.588	S	S	*	*	H	α-helix	trans	-69.8	-22.5	173.1	0	0	0	0	0	112.7	A549 K555	A549-A553 VanDerWaalsContact O-CB 3.29Å; A549-A553 WeakPolarHBondContact O-CB 3.31Å; A549-A553 PolarHBondContact O-N 3.42Å; A553-K555 PolarHBondContact O-N 2.92Å
554	K	56.4	Low	63.2	Low	164 Å²	164	110.8 Å²	110.8	71%	0.713	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	3.4	171.9	-74.4	172	-175.1	177.4	0	114.6	E550 K552 P556	E550-K554 WeakPolarHBondContact O-CG 3.4Å; E550-K554 PolarHBondContact O-N 2.86Å; K552-K554 VanDerWaalsContact C-N 3.26Å; K552-K554 PolarHBondContact O-N 3.24Å; K554-P556 WeakPolarHBondContact O-CD 3.43Å
555	K	49.2	Very low	64	Low	147 Å²	147	109.9 Å²	109.9	64%	0.639	58%	0.582	S	S	*	*	S	Bend	trans	-78.6	116.8	167	-66.9	-176.1	179.7	-171.7	0	107.9	K552 A553 A557	K552-K555 WeakPolarHBondContact O-CB 3.47Å; K552-K555 PolarHBondContact O-N 3.25Å; A553-K555 PolarHBondContact O-N 2.92Å; K555-A557 PolarHBondContact O-N 3.28Å
556	P	49.3	Very low	64.8	Low	127 Å²	127	107 Å²	107	83%	0.825	57%	0.567	S	S	*	*			trans	-68.6	100.2	-179.2	27.8	-31.9	0	0	0	108.6	K554	K554-P556 WeakPolarHBondContact O-CD 3.43Å
557	A	54.6	Low	65.8	Low	76 Å²	76	103.8 Å²	103.8	63%	0.628	56%	0.56	S	S	*	*			trans	-55.5	147.2	155.6	0	0	0	0	0	107.7	K555 V559	K555-A557 PolarHBondContact O-N 3.28Å; A557-V559 PolarHBondContact O-N 3.18Å
558	L	48.3	Very low	66.8	Low	189 Å²	189	102.4 Å²	102.4	99%	0.99	56%	0.557	S	S	*	*			trans	-64.8	76.9	175.8	-81.2	150.6	0	0	0	109.7	A560	L558-A560 PolarHBondContact O-N 3.37Å
559	V	51	Low	68.4	Low	85 Å²	85	103.3 Å²	103.3	52%	0.515	56%	0.563	S	S	.	*			trans	-75.6	119.4	172.2	178.7	0	0	0	0	106.4	A557 K561	A557-V559 PolarHBondContact O-N 3.18Å; V559-K561 PolarHBondContact O-N 3.02Å
560	A	56.1	Low	69.4	Low	65 Å²	65	100.8 Å²	100.8	54%	0.537	54%	0.542	S	S	.	.			trans	-57	111.5	170.9	0	0	0	0	0	108.7	L558 R617	L558-A560 PolarHBondContact O-N 3.37Å; A560-R617 PolarHBondContact O-N 3.37Å
561	K	70.1	Confident	69.9	Low	169 Å²	169	106.7 Å²	106.7	74%	0.735	56%	0.559	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.1	122.6	176.2	-65.4	176.4	-177.6	177.5	0	108	V559 V614	V559-K561 PolarHBondContact O-N 3.02Å; K561-V614 HydrophobicContact CB-CG1 4.12Å; K561-V614 HydrophobicContact CD-CG1 4.41Å
562	S	74.6	Confident	70.7	Confident	47 Å²	47	104.6 Å²	104.6	33%	0.329	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.6	133.5	167.7	47.9	0	0	0	0	109.1	V614 G615	S562-V614 WeakPolarHBondContact O-CA 3.43Å; S562-G615 PolarHBondContact N-O 2.9Å; S562-G615 PolarHBondContact O-N 3.2Å; S562-G615 PolarHBondContact OG-O 3.13Å
563	S	83.7	Confident	71.7	Confident	71 Å²	71	101.2 Å²	101.2	50%	0.497	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	122.6	168.2	172.7	0	0	0	0	107.9	Q612 C613	S563-Q612 PolarHBondContact OG-NE2 3.42Å; S563-C613 CarbonylContact C-O 3.57Å; S563-C613 WeakPolarHBondContact CA-O 3.35Å
564	I	86.4	Confident	72.7	Confident	63 Å²	63	105.5 Å²	105.5	32%	0.323	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	138.4	-177.1	-55	167.4	0	0	0	107.8	L566 Q612 C613	I564-L566 HydrophobicContact CG2-CG 4.26Å; I564-Q612 CarbonylContact O-C 3.59Å; I564-Q612 WeakPolarHBondContact O-CA 3.35Å; I564-C613 PolarHBondContact N-O 3.31Å; I564-C613 PolarHBondContact O-N 3.48Å
565	L	88.9	Confident	73.9	Confident	109 Å²	109	100 Å²	100	57%	0.571	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	119.7	171.3	-69.5	172.6	0	0	0	108.3	Q612	L565-Q612 HydrophobicContact CD2-CB 3.86Å; L565-Q612 HydrophobicContact CD2-CG 4.07Å
566	L	88.6	Confident	75.5	Confident	57 Å²	57	96.7 Å²	96.7	30%	0.298	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	126.1	-179	-69.9	149.9	0	0	0	109.3	I564 W594 Q610 I611 C613	I564-L566 HydrophobicContact CG2-CG 4.26Å; L566-W594 HydrophobicContact CD1-CH2 4.05Å; L566-W594 HydrophobicContact CD1-CZ3 3.67Å; L566-Q610 CarbonylContact O-C 3.53Å; L566-Q610 WeakPolarHBondContact O-CA 3.48Å; L566-I611 HydrophobicContact CB-CG2 3.94Å; L566-I611 PolarHBondContact N-O 2.92Å; L566-I611 PolarHBondContact O-N 3.48Å; L566-C613 HydrophobicContact CD1-CB 4.22Å
567	D	89.8	Confident	77.1	Confident	79 Å²	79	91.3 Å²	91.3	42%	0.422	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	106.2	173.5	-81.6	13	0	0	0	109	K608 L609 Q610	D567-K608 IonicContact OD2-NZ 3.64Å; D567-K608 PolarHBondContact OD2-NZ 3.11Å; D567-L609 CarbonylContact C-O 3.58Å; D567-L609 WeakPolarHBondContact CA-O 3.49Å; D567-Q610 WeakPolarHBondContact OD1-CG 3.41Å; D567-Q610 PolarHBondContact OD1-NE2 2.91Å
568	V	86.9	Confident	78.5	Confident	44 Å²	44	90.7 Å²	90.7	27%	0.267	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	114.5	177.4	-166.3	0	0	0	0	109	L580 V584 L609	V568-L580 HydrophobicContact CB-CD2 4.03Å; V568-L580 HydrophobicContact CG1-CD1 4.44Å; V568-L580 HydrophobicContact CG1-CD2 3.68Å; V568-L580 HydrophobicContact CG1-CG 4.34Å; V568-V584 HydrophobicContact CG2-CG2 4.25Å; V568-L609 HydrophobicContact CB-CB 4.31Å; V568-L609 PolarHBondContact N-O 3.46Å; V568-L609 PolarHBondContact O-N 3.49Å
569	K	87.7	Confident	80.2	Confident	140 Å²	140	87.6 Å²	87.6	61%	0.609	46%	0.458	S	S	*	.			trans	-101.3	120.4	-178.8	-173.1	177.5	174.2	179.6	0	109.5
570	P	87.6	Confident	81.9	Confident	6 Å²	6	85.1 Å²	85.1	4%	0.039	44%	0.441	C	S	.	.			trans	-70	158.6	174.8	32.7	-36.6	0	0	0	110.5	D572 T575 M577 I606 R607	P570-D572 VanDerWaalsContact C-N 3.34Å; P570-T575 HydrophobicContact CB-CG2 3.97Å; P570-M577 HydrophobicContact CB-SD 4.28Å; P570-M577 HydrophobicContact CG-CE 4.18Å; P570-M577 HydrophobicContact CG-SD 3.81Å; P570-I606 HydrophobicContact CG-CG2 4.04Å; P570-R607 WeakPolarHBondContact CD-O 3.4Å; P570-R607 VanDerWaalsContact CG-O 3.24Å; P570-R607 WeakPolarHBondContact CG-O 3.29Å
571	W	77.2	Confident	83.4	Confident	243 Å²	243	83.9 Å²	83.9	92%	0.92	43%	0.425	S	S	*	.	S	Bend	trans	-70.4	-32.1	177.1	-71.7	91.8	0	0	0	112.5
572	D	80.6	Confident	84.2	Confident	83 Å²	83	78.7 Å²	78.7	44%	0.444	41%	0.413	S	S	.	.	S	Bend	trans	-147.2	162	-174.3	-159.2	14.9	0	0	0	113.3	P570 T575	P570-D572 VanDerWaalsContact C-N 3.34Å; D572-T575 WeakPolarHBondContact O-CB 3.5Å; D572-T575 PolarHBondContact O-N 2.92Å; D572-T575 PolarHBondContact O-OG1 3.42Å
573	D	80.9	Confident	84.8	Confident	78 Å²	78	78.8 Å²	78.8	42%	0.417	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-21.1	-177.4	72.7	-19.4	0	0	0	114.3	T575 I606	D573-T575 PolarHBondContact O-N 3.37Å; D573-I606 HydrophobicContact CB-CG1 3.94Å
574	E	79.6	Confident	84.9	Confident	173 Å²	173	76.5 Å²	76.5	81%	0.808	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-9.4	171.8	-62.5	-167.1	165.3	0	0	113.5	D576	E574-D576 PolarHBondContact O-N 3.17Å
575	T	80.5	Confident	85	Confident	50 Å²	50	79 Å²	79	31%	0.307	40%	0.401	S	S	.	.	S	Bend	trans	-65.5	126.3	-178.2	-49.1	0	0	0	0	111.1	P570 D572 D573 M577 L580	P570-T575 HydrophobicContact CB-CG2 3.97Å; D572-T575 WeakPolarHBondContact O-CB 3.5Å; D572-T575 PolarHBondContact O-N 2.92Å; D572-T575 PolarHBondContact O-OG1 3.42Å; D573-T575 PolarHBondContact O-N 3.37Å; T575-M577 PolarHBondContact O-N 3.38Å; T575-L580 HydrophobicContact CG2-CD1 4.41Å
576	D	84	Confident	84.9	Confident	77 Å²	77	77.7 Å²	77.7	41%	0.412	40%	0.401	S	S	.	.			trans	-68.4	105	176.2	-174.3	-1.6	0	0	0	111.1	E574 A578 Q579 L580	E574-D576 PolarHBondContact O-N 3.17Å; D576-A578 PolarHBondContact O-N 2.69Å; D576-A578 WeakPolarHBondContact OD1-CB 3.45Å; D576-A578 PolarHBondContact OD1-N 3.24Å; D576-Q579 HydrophobicContact CB-CB 4.24Å; D576-Q579 HydrophobicContact CB-CG 4.19Å; D576-Q579 PolarHBondContact O-N 3.4Å; D576-Q579 WeakPolarHBondContact OD2-CG 3.31Å; D576-Q579 PolarHBondContact OD2-NE2 2.99Å; D576-L580 PolarHBondContact O-N 3.46Å; D576-L580 VanDerWaalsContact O-N 3.16Å
577	M	81.3	Confident	84.8	Confident	14 Å²	14	77.8 Å²	77.8	7%	0.069	40%	0.401	C	S	.	.	H	α-helix	trans	-63.3	-26.2	-179.3	-58.7	-54.3	-64.1	0	0	113	P570 T575 L580 E581 L599 R607 L609	P570-M577 HydrophobicContact CB-SD 4.28Å; P570-M577 HydrophobicContact CG-CE 4.18Å; P570-M577 HydrophobicContact CG-SD 3.81Å; T575-M577 PolarHBondContact O-N 3.38Å; M577-L580 HydrophobicContact CE-CD2 4.41Å; M577-E581 PolarHBondContact O-N 3.46Å; M577-L599 HydrophobicContact CB-CD1 4.1Å; M577-L599 HydrophobicContact CB-CD2 3.91Å; M577-L599 HydrophobicContact CE-CD2 3.61Å; M577-L599 HydrophobicContact CG-CD1 4.45Å; M577-L599 HydrophobicContact CG-CD2 4.21Å; M577-R607 WeakPolarHBondContact CE-O 3.41Å; M577-L609 HydrophobicContact CE-CB 4.03Å
578	A	84.3	Confident	84.4	Confident	62 Å²	62	82.6 Å²	82.6	51%	0.512	42%	0.421	S	S	.	.	H	α-helix	trans	-74.8	-37.8	179.5	0	0	0	0	0	111.6	D576 E581 A582	D576-A578 PolarHBondContact O-N 2.69Å; D576-A578 WeakPolarHBondContact OD1-CB 3.45Å; D576-A578 PolarHBondContact OD1-N 3.24Å; A578-E581 PolarHBondContact O-N 2.8Å; A578-A582 WeakPolarHBondContact O-CB 3.43Å; A578-A582 PolarHBondContact O-N 3.22Å
579	Q	84.8	Confident	84	Confident	124 Å²	124	83.6 Å²	83.6	58%	0.579	43%	0.425	S	S	*	.	H	α-helix	trans	-66.8	-41.4	173.2	-72.1	174.3	40	0	0	111	D576 E581 A582 C583	D576-Q579 HydrophobicContact CB-CB 4.24Å; D576-Q579 HydrophobicContact CB-CG 4.19Å; D576-Q579 PolarHBondContact O-N 3.4Å; D576-Q579 WeakPolarHBondContact OD2-CG 3.31Å; D576-Q579 PolarHBondContact OD2-NE2 2.99Å; Q579-E581 VanDerWaalsContact C-N 3.32Å; Q579-E581 PolarHBondContact O-N 3.42Å; Q579-A582 WeakPolarHBondContact O-CB 3.32Å; Q579-A582 PolarHBondContact O-N 3.32Å; Q579-A582 VanDerWaalsContact O-N 3.11Å; Q579-C583 PolarHBondContact O-N 3.1Å; Q579-C583 PolarHBondContact O-SG 2.93Å
580	L	85.9	Confident	83.2	Confident	33 Å²	33	85.2 Å²	85.2	17%	0.173	44%	0.44	C	S	.	.	H	α-helix	trans	-61.2	-41.1	176.1	-167.6	122.3	0	0	0	111.7	V568 T575 D576 M577 C583 V584 L609	V568-L580 HydrophobicContact CB-CD2 4.03Å; V568-L580 HydrophobicContact CG1-CD1 4.44Å; V568-L580 HydrophobicContact CG1-CD2 3.68Å; V568-L580 HydrophobicContact CG1-CG 4.34Å; T575-L580 HydrophobicContact CG2-CD1 4.41Å; D576-L580 PolarHBondContact O-N 3.46Å; D576-L580 VanDerWaalsContact O-N 3.16Å; M577-L580 HydrophobicContact CE-CD2 4.41Å; L580-C583 PolarHBondContact O-N 3.02Å; L580-V584 WeakPolarHBondContact O-CG2 3.19Å; L580-V584 PolarHBondContact O-N 3.39Å; L580-L609 HydrophobicContact CD2-CB 3.97Å; L580-L609 HydrophobicContact CD2-CD2 3.78Å
581	E	87.6	Confident	82.6	Confident	40 Å²	40	87.1 Å²	87.1	19%	0.187	46%	0.461	C	S	.	.	H	α-helix	trans	-63.9	-40.7	172.3	-178.5	178.2	177.5	0	0	112.5	M577 A578 Q579 V584 R585 S597 L609	M577-E581 PolarHBondContact O-N 3.46Å; A578-E581 PolarHBondContact O-N 2.8Å; Q579-E581 VanDerWaalsContact C-N 3.32Å; Q579-E581 PolarHBondContact O-N 3.42Å; E581-V584 PolarHBondContact O-N 3.31Å; E581-R585 WeakPolarHBondContact O-CB 3.31Å; E581-R585 WeakPolarHBondContact O-CG 3.35Å; E581-R585 PolarHBondContact O-N 3.11Å; E581-R585 IonicContact OE1-CZ 2.66Å; E581-R585 IonicContact OE1-NE 3.19Å; E581-R585 PolarHBondContact OE1-NE 3.37Å; E581-R585 IonicContact OE1-NH1 3.8Å; E581-R585 PolarHBondContact OE1-NH1 3.22Å; E581-R585 IonicContact OE1-NH2 3.16Å; E581-R585 PolarHBondContact OE1-NH2 2.9Å; E581-S597 VanDerWaalsContact CD-OG 3.3Å; E581-S597 PolarHBondContact OE1-OG 2.96Å; E581-L609 HydrophobicContact CB-CD1 4.45Å; E581-L609 HydrophobicContact CB-CD2 3.94Å; E581-L609 HydrophobicContact CG-CD2 4.43Å
582	A	87.9	Confident	82.8	Confident	59 Å²	59	76.9 Å²	76.9	49%	0.488	42%	0.424	S	S	.	.	H	α-helix	trans	-63.9	-42.2	176.3	0	0	0	0	0	111.8	A578 Q579 R585 S586	A578-A582 WeakPolarHBondContact O-CB 3.43Å; A578-A582 PolarHBondContact O-N 3.22Å; Q579-A582 WeakPolarHBondContact O-CB 3.32Å; Q579-A582 PolarHBondContact O-N 3.32Å; Q579-A582 VanDerWaalsContact O-N 3.11Å; A582-R585 PolarHBondContact O-N 3.08Å; A582-S586 WeakPolarHBondContact O-CB 3.49Å; A582-S586 PolarHBondContact O-N 3.17Å
583	C	86.3	Confident	83	Confident	50 Å²	50	77.3 Å²	77.3	34%	0.338	43%	0.43	S	S	.	.	H	α-helix	trans	-60.1	-46.7	175	-69.9	0	0	0	0	111.3	Q579 L580 R585 S586 V631	Q579-C583 PolarHBondContact O-N 3.1Å; Q579-C583 PolarHBondContact O-SG 2.93Å; L580-C583 PolarHBondContact O-N 3.02Å; C583-R585 PolarHBondContact O-N 3.01Å; C583-S586 WeakPolarHBondContact O-CB 3.38Å; C583-S586 PolarHBondContact O-N 3Å; C583-S586 PolarHBondContact O-OG 3.39Å; C583-V631 HydrophobicContact CB-CG1 3.84Å
584	V	86.8	Confident	83.4	Confident	22 Å²	22	75.9 Å²	75.9	13%	0.133	42%	0.419	C	S	.	.	H	α-helix	trans	-64.3	-42.4	177.6	177	0	0	0	0	111.5	V568 L580 E581 S586 I587 W594 I611	V568-V584 HydrophobicContact CG2-CG2 4.25Å; L580-V584 WeakPolarHBondContact O-CG2 3.19Å; L580-V584 PolarHBondContact O-N 3.39Å; E581-V584 PolarHBondContact O-N 3.31Å; V584-S586 VanDerWaalsContact C-N 3.27Å; V584-S586 PolarHBondContact O-N 2.91Å; V584-I587 PolarHBondContact O-N 3.39Å; V584-W594 HydrophobicContact CG1-CE3 4.15Å; V584-W594 HydrophobicContact CG1-CH2 3.63Å; V584-W594 HydrophobicContact CG1-CZ2 4.14Å; V584-W594 HydrophobicContact CG1-CZ3 3.63Å; V584-W594 VanDerWaalsContact O-CZ2 3.31Å; V584-W594 WeakPolarHBondContact O-CZ2 3.4Å; V584-I611 HydrophobicContact CG1-CD1 4.12Å; V584-I611 HydrophobicContact CG1-CG2 4.13Å
585	R	87.9	Confident	83.7	Confident	116 Å²	116	68.9 Å²	68.9	44%	0.438	39%	0.392	S	S	.	.	H	α-helix	trans	-70.3	-20.8	177.5	-74.6	-176.8	172.8	169.7	7	114	E581 A582 C583 I587 W594 S597 I611	E581-R585 WeakPolarHBondContact O-CB 3.31Å; E581-R585 WeakPolarHBondContact O-CG 3.35Å; E581-R585 PolarHBondContact O-N 3.11Å; E581-R585 IonicContact OE1-CZ 2.66Å; E581-R585 IonicContact OE1-NE 3.19Å; E581-R585 PolarHBondContact OE1-NE 3.37Å; E581-R585 IonicContact OE1-NH1 3.8Å; E581-R585 PolarHBondContact OE1-NH1 3.22Å; E581-R585 IonicContact OE1-NH2 3.16Å; E581-R585 PolarHBondContact OE1-NH2 2.9Å; A582-R585 PolarHBondContact O-N 3.08Å; C583-R585 PolarHBondContact O-N 3.01Å; R585-I587 PolarHBondContact O-N 3.46Å; R585-W594 HydrophobicContact CG-CB 4.46Å; R585-W594 HydrophobicContact CG-CG 4.49Å; R585-S597 PolarHBondContact NH2-OG 3.27Å; R585-I611 HydrophobicContact CG-CD1 4.25Å
586	S	87.4	Confident	84	Confident	81 Å²	81	70.1 Å²	70.1	57%	0.566	41%	0.408	S	S	*	.	H	α-helix	trans	-69.8	-18.6	177.8	77.5	0	0	0	0	113	A582 C583 V584 Q588	A582-S586 WeakPolarHBondContact O-CB 3.49Å; A582-S586 PolarHBondContact O-N 3.17Å; C583-S586 WeakPolarHBondContact O-CB 3.38Å; C583-S586 PolarHBondContact O-N 3Å; C583-S586 PolarHBondContact O-OG 3.39Å; V584-S586 VanDerWaalsContact C-N 3.27Å; V584-S586 PolarHBondContact O-N 2.91Å; S586-Q588 PolarHBondContact O-N 2.89Å
587	I	86.3	Confident	84.3	Confident	59 Å²	59	68.1 Å²	68.1	30%	0.303	40%	0.4	S	S	.	.			trans	-70.6	99.3	176.5	-57.3	169.5	0	0	0	108.6	V584 R585 L589 W594 L623	V584-I587 PolarHBondContact O-N 3.39Å; R585-I587 PolarHBondContact O-N 3.46Å; I587-L589 HydrophobicContact CG2-CD1 4.35Å; I587-L589 HydrophobicContact CG2-CG 4.3Å; I587-W594 HydrophobicContact CB-CZ2 4.05Å; I587-W594 HydrophobicContact CG2-CZ2 4.42Å; I587-W594 PolarHBondContact O-NE1 3.4Å; I587-L623 HydrophobicContact CG2-CD2 4.31Å
588	Q	80.5	Confident	84.7	Confident	180 Å²	180	73.1 Å²	73.1	84%	0.841	42%	0.421	S	S	*	.			trans	-97.6	115.3	174.5	-68.1	-176.1	3.7	0	0	109.8	S586	S586-Q588 PolarHBondContact O-N 2.89Å
589	L	78.3	Confident	84.9	Confident	65 Å²	65	74 Å²	74	34%	0.34	42%	0.417	S	S	.	.			trans	-127	145	171.7	-68.2	174.5	0	0	0	109	I587 G591 L592 L623	I587-L589 HydrophobicContact CG2-CD1 4.35Å; I587-L589 HydrophobicContact CG2-CG 4.3Å; L589-G591 PolarHBondContact O-N 3.31Å; L589-L592 HydrophobicContact CB-CB 3.95Å; L589-L592 HydrophobicContact CB-CD2 4.15Å; L589-L592 HydrophobicContact CD1-CD2 4.32Å; L589-L592 HydrophobicContact CG-CD2 4.49Å; L589-L592 WeakPolarHBondContact O-CB 3.13Å; L589-L592 PolarHBondContact O-N 2.93Å; L589-L592 VanDerWaalsContact O-N 3.07Å; L589-L623 HydrophobicContact CD1-CD1 4.47Å; L589-L623 HydrophobicContact CD1-CD2 4.27Å; L589-L623 HydrophobicContact CD1-CG 4.21Å
590	D	72	Confident	85	Confident	174 Å²	174	70 Å²	70	93%	0.93	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	126.8	-179.7	-165.1	13.2	0	0	0	110.4	L592	D590-L592 VanDerWaalsContact C-N 3.35Å
591	G	75.1	Confident	85	Confident	46 Å²	46	73.5 Å²	73.5	47%	0.474	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	8.7	-174.2	0	0	0	0	0	116.3	L589 G615 G616	L589-G591 PolarHBondContact O-N 3.31Å; G591-G615 WeakPolarHBondContact O-CA 3.29Å; G591-G616 PolarHBondContact O-N 3.44Å
592	L	80.9	Confident	84.8	Confident	28 Å²	28	75.5 Å²	75.5	15%	0.147	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	122.3	172.1	-176.1	72.3	0	0	0	110.8	L589 D590 W594 C613 L623	L589-L592 HydrophobicContact CB-CB 3.95Å; L589-L592 HydrophobicContact CB-CD2 4.15Å; L589-L592 HydrophobicContact CD1-CD2 4.32Å; L589-L592 HydrophobicContact CG-CD2 4.49Å; L589-L592 WeakPolarHBondContact O-CB 3.13Å; L589-L592 PolarHBondContact O-N 2.93Å; L589-L592 VanDerWaalsContact O-N 3.07Å; D590-L592 VanDerWaalsContact C-N 3.35Å; L592-W594 HydrophobicContact CD2-CH2 4.42Å; L592-W594 HydrophobicContact CD2-CZ2 3.62Å; L592-C613 HydrophobicContact CD1-CB 4.02Å; L592-L623 HydrophobicContact CD1-CD1 3.78Å; L592-L623 HydrophobicContact CD2-CD1 3.76Å; L592-L623 HydrophobicContact CG-CD1 4.44Å
593	V	84.4	Confident	84.5	Confident	93 Å²	93	74.2 Å²	74.2	56%	0.564	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.3	121.1	175.9	-178.7	0	0	0	0	109.5	C613 V614	V593-C613 CarbonylContact O-C 3.31Å; V593-C613 WeakPolarHBondContact O-CA 3.49Å; V593-V614 PolarHBondContact N-O 3.35Å; V593-V614 PolarHBondContact O-N 2.98Å
594	W	88.9	Confident	84.1	Confident	48 Å²	48	82.8 Å²	82.8	18%	0.182	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	130.4	172.1	-63	108.2	0	0	0	110.5	L566 V584 R585 I587 L592 I611 C613	L566-W594 HydrophobicContact CD1-CH2 4.05Å; L566-W594 HydrophobicContact CD1-CZ3 3.67Å; V584-W594 HydrophobicContact CG1-CE3 4.15Å; V584-W594 HydrophobicContact CG1-CH2 3.63Å; V584-W594 HydrophobicContact CG1-CZ2 4.14Å; V584-W594 HydrophobicContact CG1-CZ3 3.63Å; V584-W594 VanDerWaalsContact O-CZ2 3.31Å; V584-W594 WeakPolarHBondContact O-CZ2 3.4Å; R585-W594 HydrophobicContact CG-CB 4.46Å; R585-W594 HydrophobicContact CG-CG 4.49Å; I587-W594 HydrophobicContact CB-CZ2 4.05Å; I587-W594 HydrophobicContact CG2-CZ2 4.42Å; I587-W594 PolarHBondContact O-NE1 3.4Å; L592-W594 HydrophobicContact CD2-CH2 4.42Å; L592-W594 HydrophobicContact CD2-CZ2 3.62Å; W594-I611 HydrophobicContact CE3-CD1 3.87Å; W594-I611 HydrophobicContact CE3-CG1 4.18Å; W594-I611 HydrophobicContact CZ3-CD1 4.46Å; W594-I611 HydrophobicContact CZ3-CG2 4.32Å; W594-C613 HydrophobicContact CD2-CB 4.41Å; W594-C613 HydrophobicContact CE3-CB 3.61Å; W594-C613 HydrophobicContact CH2-CB 4.36Å; W594-C613 HydrophobicContact CZ3-CB 3.6Å
595	G	86.4	Confident	83.8	Confident	25 Å²	25	84 Å²	84	26%	0.258	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	-155	179.5	0	0	0	0	0	112.8	Q612	G595-Q612 WeakPolarHBondContact CA-O 3.21Å; G595-Q612 PolarHBondContact N-O 3.08Å
596	A	88.1	Confident	83.7	Confident	76 Å²	76	80.3 Å²	80.3	63%	0.628	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.5	141.7	-178.6	0	0	0	0	0	112	Q612	A596-Q612 PolarHBondContact O-N 3.49Å
597	S	88.8	Confident	83.6	Confident	36 Å²	36	82.3 Å²	82.3	25%	0.252	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	145	172.7	48.5	0	0	0	0	110	E581 R585 Q610	E581-S597 VanDerWaalsContact CD-OG 3.3Å; E581-S597 PolarHBondContact OE1-OG 2.96Å; R585-S597 PolarHBondContact NH2-OG 3.27Å; S597-Q610 CarbonylContact C-O 3.57Å; S597-Q610 VanDerWaalsContact CA-O 3.29Å; S597-Q610 WeakPolarHBondContact CA-O 3.37Å
598	K	90.3	Very high	83.7	Confident	118 Å²	118	82.2 Å²	82.2	51%	0.513	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	146.3	170	68.2	176.1	-178.6	-175.8	0	110.9	V600 Q610	K598-V600 HydrophobicContact CD-CG2 4.21Å; K598-V600 HydrophobicContact CG-CG2 4.14Å; K598-Q610 HydrophobicContact CG-CB 3.97Å; K598-Q610 HydrophobicContact CG-CG 4.48Å; K598-Q610 PolarHBondContact N-O 2.91Å; K598-Q610 PolarHBondContact O-N 3.28Å
599	L	87.9	Confident	84.2	Confident	80 Å²	80	73.6 Å²	73.6	42%	0.419	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	120.9	174.5	-61.3	175.4	0	0	0	109.1	M577 K608 L609	M577-L599 HydrophobicContact CB-CD1 4.1Å; M577-L599 HydrophobicContact CB-CD2 3.91Å; M577-L599 HydrophobicContact CE-CD2 3.61Å; M577-L599 HydrophobicContact CG-CD1 4.45Å; M577-L599 HydrophobicContact CG-CD2 4.21Å; L599-K608 WeakPolarHBondContact CA-O 3.28Å; L599-L609 HydrophobicContact CD2-CB 4.16Å; L599-L609 HydrophobicContact CD2-CD1 3.67Å
600	V	86.4	Confident	84.8	Confident	42 Å²	42	72.3 Å²	72.3	26%	0.255	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	120.8	178.3	-177.7	0	0	0	0	108.6	K598 V602 R607 K608 Q610	K598-V600 HydrophobicContact CD-CG2 4.21Å; K598-V600 HydrophobicContact CG-CG2 4.14Å; V600-V602 PolarHBondContact O-N 2.99Å; V600-R607 WeakPolarHBondContact O-CA 3.37Å; V600-K608 HydrophobicContact CB-CG 3.91Å; V600-K608 PolarHBondContact N-O 3.5Å; V600-K608 WeakPolarHBondContact O-CG 3.34Å; V600-K608 PolarHBondContact O-N 2.92Å; V600-Q610 HydrophobicContact CG2-CB 4.44Å
601	P	87.4	Confident	85.7	Confident	105 Å²	105	64 Å²	64	68%	0.682	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	132.3	175.5	27.8	-32.2	0	0	0	110.3	R607	P601-R607 HydrophobicContact CB-CG 4.47Å
602	V	82.2	Confident	86.4	Confident	82 Å²	82	65.1 Å²	65.1	50%	0.497	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	-33.3	179.7	-174.2	0	0	0	0	111	V600 I606 K608	V600-V602 PolarHBondContact O-N 2.99Å; V602-I606 PolarHBondContact N-O 2.87Å; V602-K608 HydrophobicContact CG2-CB 3.89Å; V602-K608 HydrophobicContact CG2-CD 3.68Å; V602-K608 HydrophobicContact CG2-CG 3.55Å
603	G	81.4	Confident	86.8	Confident	33 Å²	33	63.9 Å²	63.9	34%	0.34	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	146.3	164.4	177.1	0	0	0	0	0	111.9	G605 I606	G603-G605 VanDerWaalsContact C-N 3.32Å; G603-G605 PolarHBondContact O-N 3.41Å; G603-I606 PolarHBondContact N-O 3.3Å; G603-I606 WeakPolarHBondContact O-CB 3.49Å; G603-I606 PolarHBondContact O-N 2.88Å
604	Y	79.8	Confident	86.7	Confident	229 Å²	229	61.6 Å²	61.6	90%	0.898	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	42.7	176	-57.8	-83.8	0	0	0	114.5	I606	Y604-I606 PolarHBondContact O-N 3.3Å
605	G	79	Confident	86.3	Confident	49 Å²	49	59.5 Å²	59.5	51%	0.505	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	-19.8	-177	0	0	0	0	0	114.9	G603 R607	G603-G605 VanDerWaalsContact C-N 3.32Å; G603-G605 PolarHBondContact O-N 3.41Å; G605-R607 PolarHBondContact O-N 3.42Å
606	I	85.9	Confident	85	Confident	37 Å²	37	59 Å²	59	19%	0.19	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	125.2	-176.8	-54.9	174.5	0	0	0	111.1	P570 D573 V602 G603 Y604	P570-I606 HydrophobicContact CG-CG2 4.04Å; D573-I606 HydrophobicContact CB-CG1 3.94Å; V602-I606 PolarHBondContact N-O 2.87Å; G603-I606 PolarHBondContact N-O 3.3Å; G603-I606 WeakPolarHBondContact O-CB 3.49Å; G603-I606 PolarHBondContact O-N 2.88Å; Y604-I606 PolarHBondContact O-N 3.3Å
607	R	85	Confident	83.2	Confident	124 Å²	124	65.2 Å²	65.2	47%	0.468	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	136.9	172.9	-64.7	178.3	-70.6	-123.1	-3.6	109.3	P570 M577 V600 P601 G605	P570-R607 WeakPolarHBondContact CD-O 3.4Å; P570-R607 VanDerWaalsContact CG-O 3.24Å; P570-R607 WeakPolarHBondContact CG-O 3.29Å; M577-R607 WeakPolarHBondContact CE-O 3.41Å; V600-R607 WeakPolarHBondContact O-CA 3.37Å; P601-R607 HydrophobicContact CB-CG 4.47Å; G605-R607 PolarHBondContact O-N 3.42Å
608	K	90.1	Very high	81.4	Confident	56 Å²	56	72.7 Å²	72.7	24%	0.243	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	144.5	170.3	65.3	177.8	178.6	166.2	0	110.6	D567 L599 V600 V602	D567-K608 IonicContact OD2-NZ 3.64Å; D567-K608 PolarHBondContact OD2-NZ 3.11Å; L599-K608 WeakPolarHBondContact CA-O 3.28Å; V600-K608 HydrophobicContact CB-CG 3.91Å; V600-K608 PolarHBondContact N-O 3.5Å; V600-K608 WeakPolarHBondContact O-CG 3.34Å; V600-K608 PolarHBondContact O-N 2.92Å; V602-K608 HydrophobicContact CG2-CB 3.89Å; V602-K608 HydrophobicContact CG2-CD 3.68Å; V602-K608 HydrophobicContact CG2-CG 3.55Å
609	L	90.6	Very high	79.3	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	115.8	172.5	179	70.5	0	0	0	108.9	D567 V568 M577 L580 E581 L599	D567-L609 CarbonylContact C-O 3.58Å; D567-L609 WeakPolarHBondContact CA-O 3.49Å; V568-L609 HydrophobicContact CB-CB 4.31Å; V568-L609 PolarHBondContact N-O 3.46Å; V568-L609 PolarHBondContact O-N 3.49Å; M577-L609 HydrophobicContact CE-CB 4.03Å; L580-L609 HydrophobicContact CD2-CB 3.97Å; L580-L609 HydrophobicContact CD2-CD2 3.78Å; E581-L609 HydrophobicContact CB-CD1 4.45Å; E581-L609 HydrophobicContact CB-CD2 3.94Å; E581-L609 HydrophobicContact CG-CD2 4.43Å; L599-L609 HydrophobicContact CD2-CB 4.16Å; L599-L609 HydrophobicContact CD2-CD1 3.67Å
610	Q	90	Very high	77.4	Confident	38 Å²	38	65 Å²	65	18%	0.178	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	114.2	170.3	178.6	158.5	72	0	0	108.6	L566 D567 S597 K598 V600	L566-Q610 CarbonylContact O-C 3.53Å; L566-Q610 WeakPolarHBondContact O-CA 3.48Å; D567-Q610 WeakPolarHBondContact OD1-CG 3.41Å; D567-Q610 PolarHBondContact OD1-NE2 2.91Å; S597-Q610 CarbonylContact C-O 3.57Å; S597-Q610 VanDerWaalsContact CA-O 3.29Å; S597-Q610 WeakPolarHBondContact CA-O 3.37Å; K598-Q610 HydrophobicContact CG-CB 3.97Å; K598-Q610 HydrophobicContact CG-CG 4.48Å; K598-Q610 PolarHBondContact N-O 2.91Å; K598-Q610 PolarHBondContact O-N 3.28Å; V600-Q610 HydrophobicContact CG2-CB 4.44Å
611	I	91.8	Very high	75.6	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	135.9	-178.2	-170.7	168.6	0	0	0	111.2	L566 V584 R585 W594	L566-I611 HydrophobicContact CB-CG2 3.94Å; L566-I611 PolarHBondContact N-O 2.92Å; L566-I611 PolarHBondContact O-N 3.48Å; V584-I611 HydrophobicContact CG1-CD1 4.12Å; V584-I611 HydrophobicContact CG1-CG2 4.13Å; R585-I611 HydrophobicContact CG-CD1 4.25Å; W594-I611 HydrophobicContact CE3-CD1 3.87Å; W594-I611 HydrophobicContact CE3-CG1 4.18Å; W594-I611 HydrophobicContact CZ3-CD1 4.46Å; W594-I611 HydrophobicContact CZ3-CG2 4.32Å
612	Q	90.3	Very high	73.9	Confident	68 Å²	68	74.1 Å²	74.1	32%	0.318	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	138.2	174.4	-171	176.8	21.2	0	0	110.4	S563 I564 L565 G595 A596	S563-Q612 PolarHBondContact OG-NE2 3.42Å; I564-Q612 CarbonylContact O-C 3.59Å; I564-Q612 WeakPolarHBondContact O-CA 3.35Å; L565-Q612 HydrophobicContact CD2-CB 3.86Å; L565-Q612 HydrophobicContact CD2-CG 4.07Å; G595-Q612 WeakPolarHBondContact CA-O 3.21Å; G595-Q612 PolarHBondContact N-O 3.08Å; A596-Q612 PolarHBondContact O-N 3.49Å
613	C	88.2	Confident	72.5	Confident	2 Å²	2	73 Å²	73	1%	0.014	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	144.4	164.7	78.3	0	0	0	0	110.8	S563 I564 L566 L592 V593 W594	S563-C613 CarbonylContact C-O 3.57Å; S563-C613 WeakPolarHBondContact CA-O 3.35Å; I564-C613 PolarHBondContact N-O 3.31Å; I564-C613 PolarHBondContact O-N 3.48Å; L566-C613 HydrophobicContact CD1-CB 4.22Å; L592-C613 HydrophobicContact CD1-CB 4.02Å; V593-C613 CarbonylContact O-C 3.31Å; V593-C613 WeakPolarHBondContact O-CA 3.49Å; W594-C613 HydrophobicContact CD2-CB 4.41Å; W594-C613 HydrophobicContact CE3-CB 3.61Å; W594-C613 HydrophobicContact CH2-CB 4.36Å; W594-C613 HydrophobicContact CZ3-CB 3.6Å
614	V	83.4	Confident	71	Confident	45 Å²	45	75.5 Å²	75.5	27%	0.273	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	110.3	177.2	-178.1	0	0	0	0	107.1	K561 S562 V593	K561-V614 HydrophobicContact CB-CG1 4.12Å; K561-V614 HydrophobicContact CD-CG1 4.41Å; S562-V614 WeakPolarHBondContact O-CA 3.43Å; V593-V614 PolarHBondContact N-O 3.35Å; V593-V614 PolarHBondContact O-N 2.98Å
615	G	79.1	Confident	68.9	Low	4 Å²	4	67.8 Å²	67.8	4%	0.041	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	142	-178.1	0	0	0	0	0	112.1	S562 G591	S562-G615 PolarHBondContact N-O 2.9Å; S562-G615 PolarHBondContact O-N 3.2Å; S562-G615 PolarHBondContact OG-O 3.13Å; G591-G615 WeakPolarHBondContact O-CA 3.29Å
616	G	59.2	Low	66.9	Low	14 Å²	14	67.7 Å²	67.7	14%	0.144	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	145.4	162.7	0	0	0	0	0	110.8	G591 Q618 G619	G591-G616 PolarHBondContact O-N 3.44Å; G616-Q618 PolarHBondContact O-N 3.14Å; G616-G619 PolarHBondContact O-N 3.34Å
617	R	51.5	Low	64.7	Low	207 Å²	207	69.1 Å²	69.1	78%	0.781	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-6.8	-172.7	-138.6	-176.1	-165	-156.6	4	117	A560	A560-R617 PolarHBondContact O-N 3.37Å
618	Q	50.6	Low	62.4	Low	194 Å²	194	70.7 Å²	70.7	91%	0.907	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-14.8	172.3	-71.8	-173.6	25.5	0	0	114.2	G616	G616-Q618 PolarHBondContact O-N 3.14Å
619	G	45.8	Very low	59.6	Low	21 Å²	21	76.3 Å²	76.3	22%	0.216	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-15.7	-175.9	0	0	0	0	0	115.9	G616	G616-G619 PolarHBondContact O-N 3.34Å
620	G	47.5	Very low	56.9	Low	14 Å²	14	85.3 Å²	85.3	14%	0.144	47%	0.472	C	S	.	.	H	α-helix	trans	-66.8	-36.6	-174.9	0	0	0	0	0	114.3	R622 L623 A624	G620-R622 VanDerWaalsContact C-N 3.29Å; G620-R622 PolarHBondContact O-N 3.35Å; G620-L623 PolarHBondContact O-N 3.34Å; G620-A624 WeakPolarHBondContact O-CB 3.43Å; G620-A624 PolarHBondContact O-N 3.37Å
621	D	49	Very low	54.3	Low	136 Å²	136	90.9 Å²	90.9	73%	0.727	51%	0.509	S	S	*	.	H	α-helix	trans	-71.4	-22.7	-176.4	-73.2	-9.8	0	0	0	113.1	G625	D621-G625 PolarHBondContact O-N 3.22Å
622	R	51.3	Low	52.4	Low	204 Å²	204	95.5 Å²	95.5	77%	0.77	53%	0.534	S	S	*	.	H	α-helix	trans	-75.2	-23.6	174.9	-69.7	-169.6	-168.5	-171.4	4.1	113.5	G620	G620-R622 VanDerWaalsContact C-N 3.29Å; G620-R622 PolarHBondContact O-N 3.35Å
623	L	53.3	Low	50.5	Low	58 Å²	58	96.9 Å²	96.9	30%	0.304	55%	0.545	S	S	.	.	H	α-helix	trans	-92.9	-30.6	175.4	-68.9	172.1	0	0	0	112	I587 L589 L592 G620	I587-L623 HydrophobicContact CG2-CD2 4.31Å; L589-L623 HydrophobicContact CD1-CD1 4.47Å; L589-L623 HydrophobicContact CD1-CD2 4.27Å; L589-L623 HydrophobicContact CD1-CG 4.21Å; L592-L623 HydrophobicContact CD1-CD1 3.78Å; L592-L623 HydrophobicContact CD2-CD1 3.76Å; L592-L623 HydrophobicContact CG-CD1 4.44Å; G620-L623 PolarHBondContact O-N 3.34Å
624	A	49.9	Very low	48.4	Very low	85 Å²	85	102.2 Å²	102.2	70%	0.702	58%	0.575	S	S	*	*	H	α-helix	trans	-85.1	-22.4	178.9	0	0	0	0	0	113.7	G620	G620-A624 WeakPolarHBondContact O-CB 3.43Å; G620-A624 PolarHBondContact O-N 3.37Å
625	G	36.4	Very low	46.3	Very low	68 Å²	68	105.5 Å²	105.5	70%	0.701	59%	0.593	S	S	*	*	S	Bend	trans	-88.7	0.2	-179.8	0	0	0	0	0	115.8	D621	D621-G625 PolarHBondContact O-N 3.22Å
626	G	36.5	Very low	44.2	Very low	47 Å²	47	111.9 Å²	111.9	49%	0.485	63%	0.627	S	S	.	*			trans	-100.8	66.1	179	0	0	0	0	0	112.3	D628	G626-D628 PolarHBondContact O-N 3.3Å
627	G	39.1	Very low	43.3	Very low	66 Å²	66	118.4 Å²	118.4	68%	0.68	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	123.5	155	0	0	0	0	0	107.6
628	D	36.4	Very low	42.7	Very low	158 Å²	158	112.1 Å²	112.1	85%	0.845	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	78.6	48.8	175.1	-50.8	-27.7	0	0	0	117.7	G626	G626-D628 PolarHBondContact O-N 3.3Å
629	H	31.8	Very low	42.1	Very low	174 Å²	174	105.8 Å²	105.8	81%	0.806	63%	0.631	S	S	*	*			trans	-114.5	106.9	152.4	-83.3	5.5	0	0	0	110.5	V631	H629-V631 PolarHBondContact O-N 3.37Å
630	Q	34.7	Very low	41.7	Very low	188 Å²	188	112.8 Å²	112.8	88%	0.879	67%	0.666	S	S	*	*			trans	-58.3	124.9	169	-82.1	169	3.3	0	0	109.7
631	V	34.9	Very low	41.2	Very low	156 Å²	156	121.8 Å²	121.8	95%	0.945	71%	0.713	S	S	*	*			trans	-120.7	0	158.1	-179.2	0	0	0	0	107.6	C583 H629	C583-V631 HydrophobicContact CB-CG1 3.84Å; H629-V631 PolarHBondContact O-N 3.37Å

Retrieved 631 of 631 residues in 335.2 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).