A0A096NHL6_PAPAN Loading...

Protein kinase C and casein kinase substrate in neurons protein 1

AlphaFold DB (A0A2K5LFT0), UniProt , Accession A0A096NHL6, Species PAPAN (Papio anubis, Olive baboon), Gene PACSIN1, Length 444 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	34.9	Very low	37.3	Very low	248 Å²	248	137.7 Å²	137.7	100%	1.222	81%	0.814	S	S	*	*				0	123.8	0	-64.6	-176.4	-173.8	0	0	107.6	G3	M1-G3 PolarHBondContact O-N 3.23Å
2	S	38.5	Very low	37.8	Very low	123 Å²	123	136.2 Å²	136.2	86%	0.86	81%	0.811	S	S	*	*			trans	-89	99	179.3	47.4	0	0	0	0	109.8	S4	S2-S4 PolarHBondContact O-N 3.06Å
3	G	31.7	Very low	39	Very low	69 Å²	69	135.5 Å²	135.5	71%	0.711	79%	0.794	S	S	*	*			trans	-75.5	114.9	166.7	0	0	0	0	0	109.3	M1 Y5	M1-G3 PolarHBondContact O-N 3.23Å; G3-Y5 PolarHBondContact O-N 3.03Å
4	S	33.9	Very low	39.7	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	80%	0.797	S	S	*	*			trans	-61.6	132.5	166.7	45	0	0	0	0	109	S2 D6	S2-S4 PolarHBondContact O-N 3.06Å; S4-D6 PolarHBondContact O-N 3.11Å
5	Y	34.4	Very low	40.9	Very low	196 Å²	196	138 Å²	138	77%	0.769	80%	0.797	S	S	*	*			trans	-65.7	117.2	163.7	-87.2	-100.6	0	0	0	107.5	G3 E7	G3-Y5 PolarHBondContact O-N 3.03Å; Y5-E7 PolarHBondContact O-N 2.9Å
6	D	36.6	Very low	43.3	Very low	152 Å²	152	133.6 Å²	133.6	81%	0.813	77%	0.773	S	S	*	*			trans	-60.3	110	163.8	-87	-40.3	0	0	0	108.1	S4 A8	S4-D6 PolarHBondContact O-N 3.11Å; D6-A8 PolarHBondContact O-N 3.03Å
7	E	38.4	Very low	46.1	Very low	184 Å²	184	135.3 Å²	135.3	86%	0.86	78%	0.779	S	S	*	*			trans	-66.3	84.9	163.5	-177	159.7	-149.6	0	0	106.9	Y5 S9	Y5-E7 PolarHBondContact O-N 2.9Å; E7-S9 PolarHBondContact O-N 3.11Å
8	A	40.4	Very low	48.9	Very low	88 Å²	88	130.1 Å²	130.1	73%	0.727	75%	0.751	S	S	*	*			trans	-50.8	110	-179.7	0	0	0	0	0	108.7	D6 L10	D6-A8 PolarHBondContact O-N 3.03Å; A8-L10 PolarHBondContact O-N 3.05Å
9	S	40.1	Very low	51.4	Low	109 Å²	109	125.8 Å²	125.8	76%	0.762	72%	0.723	S	S	*	*			trans	-51.1	109	-176.4	52.3	0	0	0	0	109.4	E7 A11	E7-S9 PolarHBondContact O-N 3.11Å; S9-A11 VanDerWaalsContact C-N 3.33Å; S9-A11 PolarHBondContact O-N 3.25Å
10	L	42.2	Very low	53.7	Low	163 Å²	163	123.8 Å²	123.8	85%	0.853	70%	0.703	S	S	*	*			trans	-55.9	109	153.3	-75	163.4	0	0	0	104.8	A8	A8-L10 PolarHBondContact O-N 3.05Å
11	A	39.5	Very low	55.7	Low	78 Å²	78	121.7 Å²	121.7	65%	0.645	69%	0.687	S	S	*	*			trans	-51.1	138.8	171.1	0	0	0	0	0	107.5	S9 E13	S9-A11 VanDerWaalsContact C-N 3.33Å; S9-A11 PolarHBondContact O-N 3.25Å; A11-E13 PolarHBondContact O-N 3.08Å; A11-E13 VanDerWaalsContact O-N 3.16Å
12	P	42.8	Very low	58.6	Low	119 Å²	119	113.8 Å²	113.8	77%	0.773	65%	0.653	S	S	*	*			trans	-51.3	128.8	173.1	-21.6	32	0	0	0	107.9	E14	P12-E14 PolarHBondContact O-N 2.91Å
13	E	53.5	Low	61.3	Low	127 Å²	127	108.5 Å²	108.5	59%	0.593	62%	0.618	S	S	*	*			trans	-59.9	110.4	168.8	-71.4	-176.2	141.1	0	0	105.8	A11 T15 K157	A11-E13 PolarHBondContact O-N 3.08Å; A11-E13 VanDerWaalsContact O-N 3.16Å; E13-T15 PolarHBondContact O-N 3.44Å; E13-K157 IonicContact OE1-NZ 3.26Å; E13-K157 PolarHBondContact OE1-NZ 3.44Å
14	E	49.1	Very low	64.5	Low	180 Å²	180	108 Å²	108	84%	0.841	60%	0.599	S	S	*	*			trans	-63.4	91.6	174.1	-76.3	-172.8	151.1	0	0	107.4	P12 T16	P12-E14 PolarHBondContact O-N 2.91Å; E14-T16 VanDerWaalsContact C-N 3.29Å; E14-T16 WeakPolarHBondContact O-CG2 3.34Å; E14-T16 PolarHBondContact O-N 3.02Å
15	T	57.7	Low	67.5	Low	129 Å²	129	103.6 Å²	103.6	79%	0.791	57%	0.566	S	S	*	*			trans	-67	93	173.1	50.6	0	0	0	0	107.5	E13	E13-T15 PolarHBondContact O-N 3.44Å
16	T	79.8	Confident	70.5	Confident	67 Å²	67	100.3 Å²	100.3	41%	0.411	56%	0.556	S	S	.	*			trans	-68.6	138.1	-178.8	78.2	0	0	0	0	109.8	E14 S18 E21 N24	E14-T16 VanDerWaalsContact C-N 3.29Å; E14-T16 WeakPolarHBondContact O-CG2 3.34Å; E14-T16 PolarHBondContact O-N 3.02Å; T16-S18 PolarHBondContact O-N 2.86Å; T16-S18 WeakPolarHBondContact OG1-CB 3.49Å; T16-E21 WeakPolarHBondContact O-CG 3.46Å; T16-N24 PolarHBondContact O-ND2 2.98Å
17	D	90.4	Very high	73.4	Confident	163 Å²	163	103.5 Å²	103.5	87%	0.872	56%	0.557	S	S	*	*			trans	-74.4	25.3	171.1	-75.6	-28.7	0	0	0	112.4
18	S	95.8	Very high	76.3	Confident	41 Å²	41	95.4 Å²	95.4	29%	0.287	52%	0.52	S	S	.	.			trans	-65.6	138.4	179.6	178.5	0	0	0	0	110.8	T16 W20 E21 N24	T16-S18 PolarHBondContact O-N 2.86Å; T16-S18 WeakPolarHBondContact OG1-CB 3.49Å; S18-W20 PolarHBondContact O-N 3.21Å; S18-W20 VanDerWaalsContact O-N 3.15Å; S18-W20 PolarHBondContact OG-N 2.97Å; S18-E21 PolarHBondContact O-N 3.25Å; S18-E21 VanDerWaalsContact O-N 3.16Å; S18-N24 WeakPolarHBondContact O-CB 3.33Å; S18-N24 PolarHBondContact O-ND2 3.32Å
19	F	97.5	Very high	79.1	Confident	50 Å²	50	91.7 Å²	91.7	22%	0.219	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-31	172.9	168	-100.7	0	0	0	112.8	E21 F139 M227 F231	F19-E21 VanDerWaalsContact C-N 3.27Å; F19-E21 PolarHBondContact O-N 3.49Å; F19-F139 HydrophobicContact CE2-CE1 4.1Å; F19-F139 HydrophobicContact CE2-CZ 4.37Å; F19-F139 AromaticContact CZ-CE1 3.86Å; F19-F139 HydrophobicContact CZ-CE1 3.86Å; F19-F139 HydrophobicContact CZ-CZ 4.49Å; F19-M227 HydrophobicContact CE1-CB 4.24Å; F19-M227 HydrophobicContact CE1-CE 4.1Å; F19-M227 HydrophobicContact CE2-CE 4.35Å; F19-M227 HydrophobicContact CZ-CB 4.41Å; F19-M227 HydrophobicContact CZ-CE 3.76Å; F19-F231 AromaticContact CE2-CD2 3.9Å; F19-F231 HydrophobicContact CE2-CD2 3.9Å; F19-F231 HydrophobicContact CZ-CB 4.23Å; F19-F231 HydrophobicContact CZ-CD2 4.06Å; F19-F231 HydrophobicContact CZ-CG 4.42Å
20	W	97.3	Very high	81.9	Confident	85 Å²	85	92 Å²	92	32%	0.322	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-14	-176.4	-60	116	0	0	0	114.3	S18 Y223 M224 M227 E228	S18-W20 PolarHBondContact O-N 3.21Å; S18-W20 VanDerWaalsContact O-N 3.15Å; S18-W20 PolarHBondContact OG-N 2.97Å; W20-Y223 HydrophobicContact CE3-CE1 4.03Å; W20-Y223 PolarHBondContact O-OH 3.43Å; W20-M224 HydrophobicContact CE3-CG 4.35Å; W20-M224 HydrophobicContact CH2-CB 4.03Å; W20-M224 HydrophobicContact CH2-CE 4.11Å; W20-M224 HydrophobicContact CH2-CG 3.95Å; W20-M224 HydrophobicContact CZ2-CE 3.97Å; W20-M224 HydrophobicContact CZ3-CB 4.1Å; W20-M224 HydrophobicContact CZ3-CG 3.85Å; W20-M227 HydrophobicContact CZ3-CB 3.89Å; W20-M227 HydrophobicContact CZ3-CG 4.42Å; W20-E228 HydrophobicContact CH2-CG 3.94Å; W20-E228 WeakPolarHBondContact CH2-OE1 3.39Å
21	E	95.8	Very high	84.5	Confident	79 Å²	79	87.6 Å²	87.6	37%	0.369	45%	0.448	S	S	.	.	S	Bend	trans	-70	157.9	176.4	-69.7	-58.4	158.1	0	0	112.7	T16 S18 F19 G23 N24 Q143	T16-E21 WeakPolarHBondContact O-CG 3.46Å; S18-E21 PolarHBondContact O-N 3.25Å; S18-E21 VanDerWaalsContact O-N 3.16Å; F19-E21 VanDerWaalsContact C-N 3.27Å; F19-E21 PolarHBondContact O-N 3.49Å; E21-G23 PolarHBondContact O-N 3.32Å; E21-N24 HydrophobicContact CB-CB 4.24Å; E21-N24 PolarHBondContact O-N 2.97Å; E21-Q143 PolarHBondContact O-NE2 2.92Å
22	V	95.6	Very high	87.4	Confident	83 Å²	83	84.3 Å²	84.3	50%	0.503	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	109.2	-174	-178.1	0	0	0	0	110.9	Q143 W146 A147	V22-Q143 VanDerWaalsContact CA-OE1 3.31Å; V22-W146 HydrophobicContact CG2-CE3 4.4Å; V22-W146 HydrophobicContact CG2-CZ3 3.89Å; V22-A147 HydrophobicContact CG1-CB 4Å; V22-A147 HydrophobicContact CG2-CB 3.98Å
23	G	95.5	Very high	90	Very high	12 Å²	12	81.4 Å²	81.4	12%	0.124	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.5	-2.3	-178.7	0	0	0	0	0	116.5	E21 Y25 K26	E21-G23 PolarHBondContact O-N 3.32Å; G23-Y25 PolarHBondContact O-N 2.71Å; G23-K26 WeakPolarHBondContact O-CB 3.37Å; G23-K26 WeakPolarHBondContact O-CD 3.44Å; G23-K26 WeakPolarHBondContact O-CG 2.97Å; G23-K26 PolarHBondContact O-N 3.31Å
24	N	97.4	Very high	92.1	Very high	57 Å²	57	77.8 Å²	77.8	31%	0.305	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-13.1	-177.9	-81.8	7.4	0	0	0	114	T16 S18 E21 K26 R27	T16-N24 PolarHBondContact O-ND2 2.98Å; S18-N24 WeakPolarHBondContact O-CB 3.33Å; S18-N24 PolarHBondContact O-ND2 3.32Å; E21-N24 HydrophobicContact CB-CB 4.24Å; E21-N24 PolarHBondContact O-N 2.97Å; N24-K26 PolarHBondContact O-N 3.31Å; N24-R27 PolarHBondContact O-N 3.49Å
25	Y	98.2	Very high	94.5	Very high	14 Å²	14	69.3 Å²	69.3	6%	0.055	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-16.5	168	61.9	-103.5	0	0	0	114.2	G23 R27 T28 V29 E136 F139 Q143 M227	G23-Y25 PolarHBondContact O-N 2.71Å; Y25-R27 PolarHBondContact O-N 3.5Å; Y25-R27 VanDerWaalsContact O-N 3.09Å; Y25-T28 WeakPolarHBondContact O-CA 3.44Å; Y25-T28 VanDerWaalsContact O-CB 3.31Å; Y25-T28 WeakPolarHBondContact O-CB 3.47Å; Y25-T28 PolarHBondContact O-N 3.31Å; Y25-V29 HydrophobicContact CD2-CG2 4.03Å; Y25-V29 PolarHBondContact O-N 3.19Å; Y25-E136 WeakPolarHBondContact CE2-OE2 3.47Å; Y25-F139 HydrophobicContact CD1-CB 3.84Å; Y25-F139 HydrophobicContact CD1-CG 4.34Å; Y25-F139 HydrophobicContact CD2-CB 3.37Å; Y25-F139 AromaticContact CD2-CD2 3.65Å; Y25-F139 HydrophobicContact CD2-CD2 3.65Å; Y25-F139 AromaticContact CD2-CG 3.65Å; Y25-F139 HydrophobicContact CD2-CG 3.65Å; Y25-F139 HydrophobicContact CE1-CB 3.96Å; Y25-F139 HydrophobicContact CE2-CB 3.54Å; Y25-F139 HydrophobicContact CE2-CD2 4.44Å; Y25-F139 HydrophobicContact CE2-CG 4.31Å; Y25-F139 HydrophobicContact CG-CB 3.54Å; Y25-F139 HydrophobicContact CG-CD1 4.17Å; Y25-F139 HydrophobicContact CG-CD2 4.01Å; Y25-F139 AromaticContact CG-CG 3.67Å; Y25-F139 HydrophobicContact CG-CG 3.67Å; Y25-Q143 VanDerWaalsContact CE1-OE1 3.31Å; Y25-M227 HydrophobicContact CD1-CE 3.9Å; Y25-M227 HydrophobicContact CG-CE 4.35Å
26	K	97.9	Very high	96.5	Very high	126 Å²	126	64.3 Å²	64.3	55%	0.548	31%	0.31	S	S	.	.	H	α-helix	trans	-52.9	-29.7	176.3	-76.3	171	-175.8	176.3	0	113.7	G23 N24 T28 V29 K30	G23-K26 WeakPolarHBondContact O-CB 3.37Å; G23-K26 WeakPolarHBondContact O-CD 3.44Å; G23-K26 WeakPolarHBondContact O-CG 2.97Å; G23-K26 PolarHBondContact O-N 3.31Å; N24-K26 PolarHBondContact O-N 3.31Å; K26-T28 VanDerWaalsContact C-N 3.29Å; K26-T28 PolarHBondContact O-N 3.23Å; K26-V29 PolarHBondContact O-N 3.27Å; K26-K30 VanDerWaalsContact O-CB 3.31Å; K26-K30 WeakPolarHBondContact O-CB 3.49Å; K26-K30 PolarHBondContact O-N 3.43Å
27	R	97.6	Very high	97.4	Very high	220 Å²	220	68.5 Å²	68.5	83%	0.83	32%	0.318	S	S	*	.	H	α-helix	trans	-62.1	-38.3	174.5	-173.9	177.1	178.7	-178	0	111.8	N24 Y25 R31	N24-R27 PolarHBondContact O-N 3.49Å; Y25-R27 PolarHBondContact O-N 3.5Å; Y25-R27 VanDerWaalsContact O-N 3.09Å; R27-R31 PolarHBondContact O-N 2.95Å
28	T	98.5	Very high	97.7	Very high	14 Å²	14	64.4 Å²	64.4	9%	0.086	30%	0.296	C	S	.	.	H	α-helix	trans	-70.4	-44.2	175.8	-51.9	0	0	0	0	111.3	Y25 K26 R31 F139 F231 C234	Y25-T28 WeakPolarHBondContact O-CA 3.44Å; Y25-T28 VanDerWaalsContact O-CB 3.31Å; Y25-T28 WeakPolarHBondContact O-CB 3.47Å; Y25-T28 PolarHBondContact O-N 3.31Å; K26-T28 VanDerWaalsContact C-N 3.29Å; K26-T28 PolarHBondContact O-N 3.23Å; T28-R31 WeakPolarHBondContact O-CB 3.46Å; T28-R31 PolarHBondContact O-N 3.22Å; T28-F139 HydrophobicContact CG2-CE2 4.16Å; T28-F139 HydrophobicContact CG2-CZ 4.07Å; T28-F231 HydrophobicContact CG2-CD2 3.79Å; T28-F231 HydrophobicContact CG2-CE2 3.93Å; T28-C234 HydrophobicContact CG2-CB 3.62Å
29	V	98.6	Very high	97.9	Very high	9 Å²	9	62.4 Å²	62.4	6%	0.055	28%	0.282	C	S	.	.	H	α-helix	trans	-61.5	-47.4	177.4	176.5	0	0	0	0	111	Y25 K26 R31 I32 T132 A135 E136 F139	Y25-V29 HydrophobicContact CD2-CG2 4.03Å; Y25-V29 PolarHBondContact O-N 3.19Å; K26-V29 PolarHBondContact O-N 3.27Å; V29-R31 PolarHBondContact O-N 3.2Å; V29-I32 VanDerWaalsContact O-CB 3.31Å; V29-I32 WeakPolarHBondContact O-CB 3.3Å; V29-I32 PolarHBondContact O-N 3.4Å; V29-T132 HydrophobicContact CG1-CG2 3.55Å; V29-A135 HydrophobicContact CG2-CB 4.24Å; V29-E136 HydrophobicContact CG1-CB 4.16Å; V29-F139 HydrophobicContact CG2-CD2 3.63Å; V29-F139 HydrophobicContact CG2-CE2 3.9Å
30	K	98.4	Very high	98	Very high	116 Å²	116	62.7 Å²	62.7	50%	0.504	29%	0.286	S	S	.	.	H	α-helix	trans	-57.3	-33.9	177.6	-166.8	-156.8	170.4	-133.3	0	112.7	K26 I32 D33 D34	K26-K30 VanDerWaalsContact O-CB 3.31Å; K26-K30 WeakPolarHBondContact O-CB 3.49Å; K26-K30 PolarHBondContact O-N 3.43Å; K30-I32 PolarHBondContact O-N 3.13Å; K30-I32 VanDerWaalsContact O-N 3.12Å; K30-D33 PolarHBondContact O-N 2.99Å; K30-D33 VanDerWaalsContact O-N 3.1Å; K30-D34 WeakPolarHBondContact CD-OD2 3.49Å; K30-D34 WeakPolarHBondContact CE-OD1 3.46Å; K30-D34 WeakPolarHBondContact CE-OD2 3.36Å; K30-D34 IonicContact NZ-OD1 2.84Å; K30-D34 PolarHBondContact NZ-OD1 3.02Å; K30-D34 IonicContact NZ-OD2 3.82Å; K30-D34 PolarHBondContact NZ-OD2 2.82Å; K30-D34 PolarHBondContact O-N 3.01Å
31	R	98.6	Very high	98	Very high	71 Å²	71	61.7 Å²	61.7	27%	0.268	29%	0.287	S	S	.	.	H	α-helix	trans	-58.1	-26.2	177.8	-165.4	-179.9	67.5	-169.1	-0.6	112.6	R27 T28 V29 G35 C234 Q235	R27-R31 PolarHBondContact O-N 2.95Å; T28-R31 WeakPolarHBondContact O-CB 3.46Å; T28-R31 PolarHBondContact O-N 3.22Å; V29-R31 PolarHBondContact O-N 3.2Å; R31-G35 PolarHBondContact O-N 2.88Å; R31-C234 PolarHBondContact NH2-O 2.67Å; R31-Q235 VanDerWaalsContact CZ-OE1 3.29Å
32	I	98.6	Very high	98.2	Very high	9 Å²	9	59.3 Å²	59.3	5%	0.046	28%	0.277	C	S	.	.	H	α-helix	trans	-67	-50.8	175.6	-58	171.9	0	0	0	110	V29 K30 G35 H36 Y121 E131 T132 A135 F237	V29-I32 VanDerWaalsContact O-CB 3.31Å; V29-I32 WeakPolarHBondContact O-CB 3.3Å; V29-I32 PolarHBondContact O-N 3.4Å; K30-I32 PolarHBondContact O-N 3.13Å; K30-I32 VanDerWaalsContact O-N 3.12Å; I32-G35 PolarHBondContact O-N 2.77Å; I32-H36 PolarHBondContact O-N 3.47Å; I32-Y121 HydrophobicContact CG2-CD1 4.48Å; I32-Y121 HydrophobicContact CG2-CE1 3.94Å; I32-Y121 WeakPolarHBondContact O-CE1 3.48Å; I32-Y121 PolarHBondContact O-OH 3.34Å; I32-E131 HydrophobicContact CG2-CB 4.02Å; I32-T132 WeakPolarHBondContact CG2-OG1 3.06Å; I32-A135 HydrophobicContact CD1-CB 3.5Å; I32-F237 HydrophobicContact CG2-CD1 4.44Å; I32-F237 HydrophobicContact CG2-CE1 3.92Å
33	D	98.1	Very high	98.3	Very high	58 Å²	58	56.2 Å²	56.2	31%	0.31	26%	0.257	S	S	.	.	H	α-helix	trans	-63.7	-44.4	176.4	-62	-30.8	0	0	0	111.7	K30 G35 H36 R37 F129 T132	K30-D33 PolarHBondContact O-N 2.99Å; K30-D33 VanDerWaalsContact O-N 3.1Å; D33-G35 PolarHBondContact O-N 3.47Å; D33-H36 PolarHBondContact O-N 3.15Å; D33-R37 PolarHBondContact O-N 3.24Å; D33-R37 VanDerWaalsContact O-N 3.08Å; D33-F129 WeakPolarHBondContact OD1-CD2 3.36Å; D33-T132 WeakPolarHBondContact OD1-CB 3.07Å; D33-T132 WeakPolarHBondContact OD1-CG2 3.27Å; D33-T132 PolarHBondContact OD1-OG1 3.03Å; D33-T132 WeakPolarHBondContact OD2-CG2 3.41Å
34	D	98.6	Very high	98.5	Very high	51 Å²	51	59.3 Å²	59.3	27%	0.273	27%	0.27	S	S	.	.	H	α-helix	trans	-60.2	-34.6	175.7	-72.9	-25.8	0	0	0	110.4	K30 R37 L38	K30-D34 WeakPolarHBondContact CD-OD2 3.49Å; K30-D34 WeakPolarHBondContact CE-OD1 3.46Å; K30-D34 WeakPolarHBondContact CE-OD2 3.36Å; K30-D34 IonicContact NZ-OD1 2.84Å; K30-D34 PolarHBondContact NZ-OD1 3.02Å; K30-D34 IonicContact NZ-OD2 3.82Å; K30-D34 PolarHBondContact NZ-OD2 2.82Å; K30-D34 PolarHBondContact O-N 3.01Å; D34-R37 WeakPolarHBondContact O-CB 3.25Å; D34-R37 PolarHBondContact O-N 3.06Å; D34-L38 VanDerWaalsContact O-CG 3.29Å; D34-L38 WeakPolarHBondContact O-CG 3.47Å; D34-L38 PolarHBondContact O-N 3.01Å
35	G	98.7	Very high	98.6	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-62.8	-43.4	174.5	0	0	0	0	0	113.8	R31 I32 D33 R37 L38 C39 Y121	R31-G35 PolarHBondContact O-N 2.88Å; I32-G35 PolarHBondContact O-N 2.77Å; D33-G35 PolarHBondContact O-N 3.47Å; G35-R37 VanDerWaalsContact C-N 3.34Å; G35-L38 PolarHBondContact O-N 2.78Å; G35-C39 PolarHBondContact O-N 3.27Å; G35-Y121 WeakPolarHBondContact CA-OH 3.17Å
36	H	98.8	Very high	98.6	Very high	24 Å²	24	59.9 Å²	59.9	11%	0.111	28%	0.28	C	S	.	.	H	α-helix	trans	-63.2	-42.5	173.4	171.8	-73.4	0	0	0	110.9	I32 D33 C39 N40 Q117 Y121 F129	I32-H36 PolarHBondContact O-N 3.47Å; D33-H36 PolarHBondContact O-N 3.15Å; H36-C39 WeakPolarHBondContact O-CB 3.42Å; H36-C39 PolarHBondContact O-N 3.04Å; H36-N40 PolarHBondContact O-N 2.85Å; H36-Q117 PolarHBondContact CE1-NE2 3.35Å; H36-Q117 PolarHBondContact O-NE2 3.32Å; H36-Y121 HydrophobicContact CB-CD1 3.87Å; H36-Y121 HydrophobicContact CB-CD2 3.9Å; H36-Y121 HydrophobicContact CB-CE1 3.86Å; H36-Y121 HydrophobicContact CB-CE2 3.9Å; H36-Y121 HydrophobicContact CB-CG 3.88Å; H36-Y121 AromaticContact CD2-CD2 3.91Å; H36-Y121 AromaticContact CD2-CG 3.8Å; H36-Y121 PolarHBondContact N-OH 2.84Å; H36-F129 HydrophobicContact CB-CE2 3.92Å; H36-F129 HydrophobicContact CB-CZ 3.97Å; H36-F129 AromaticContact CD2-CE1 3.44Å; H36-F129 VanDerWaalsContact CD2-CE1 3.44Å; H36-F129 WeakPolarHBondContact CD2-CE1 3.37Å; H36-F129 AromaticContact CD2-CZ 3.24Å; H36-F129 WeakPolarHBondContact CD2-CZ 3.47Å; H36-F129 AromaticContact CE1-CZ 3.69Å; H36-F129 AromaticContact CG-CE2 3.8Å; H36-F129 AromaticContact CG-CZ 3.34Å; H36-F129 AromaticContact ND1-CZ 3.61Å; H36-F129 AromaticContact NE2-CE1 3.67Å; H36-F129 AromaticContact NE2-CZ 3.46Å; H36-F129 WeakPolarHBondContact NE2-CZ 2.88Å
37	R	98.6	Very high	98.6	Very high	155 Å²	155	58 Å²	58	59%	0.585	27%	0.273	S	S	*	.	H	α-helix	trans	-59.1	-47	176.4	178	-171.5	165.4	166.1	3.1	111.2	D33 D34 G35 C39 N40 D41	D33-R37 PolarHBondContact O-N 3.24Å; D33-R37 VanDerWaalsContact O-N 3.08Å; D34-R37 WeakPolarHBondContact O-CB 3.25Å; D34-R37 PolarHBondContact O-N 3.06Å; G35-R37 VanDerWaalsContact C-N 3.34Å; R37-C39 PolarHBondContact O-N 2.97Å; R37-N40 WeakPolarHBondContact O-CA 3.47Å; R37-N40 VanDerWaalsContact O-CB 3.29Å; R37-N40 WeakPolarHBondContact O-CB 3.4Å; R37-N40 PolarHBondContact O-N 2.97Å; R37-D41 IonicContact NE-OD2 3.76Å; R37-D41 PolarHBondContact NE-OD2 3Å; R37-D41 PolarHBondContact O-N 3.34Å
38	L	98.8	Very high	98.7	Very high	77 Å²	77	52.9 Å²	52.9	40%	0.403	26%	0.259	S	S	.	.	H	α-helix	trans	-60.5	-29.2	179.5	-72.8	168.8	0	0	0	113.1	D34 G35 D41 L42	D34-L38 VanDerWaalsContact O-CG 3.29Å; D34-L38 WeakPolarHBondContact O-CG 3.47Å; D34-L38 PolarHBondContact O-N 3.01Å; G35-L38 PolarHBondContact O-N 2.78Å; L38-D41 PolarHBondContact O-N 3.04Å; L38-L42 PolarHBondContact O-N 2.95Å
39	C	98.8	Very high	98.7	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.1	-38.6	170	-67.7	0	0	0	0	112.3	G35 H36 R37 M43 V113 Q117	G35-C39 PolarHBondContact O-N 3.27Å; H36-C39 WeakPolarHBondContact O-CB 3.42Å; H36-C39 PolarHBondContact O-N 3.04Å; R37-C39 PolarHBondContact O-N 2.97Å; C39-M43 VanDerWaalsContact O-CG 3.31Å; C39-M43 WeakPolarHBondContact O-CG 3.48Å; C39-M43 PolarHBondContact O-N 2.82Å; C39-V113 HydrophobicContact CB-CG1 3.93Å; C39-Q117 HydrophobicContact CB-CB 4.15Å; C39-Q117 HydrophobicContact CB-CG 4Å
40	N	98.8	Very high	98.7	Very high	56 Å²	56	56.7 Å²	56.7	30%	0.299	27%	0.271	S	S	.	.	H	α-helix	trans	-65	-44.8	171.8	-66.2	-27.6	0	0	0	111.5	H36 R37 L42 M43 N44 Q117	H36-N40 PolarHBondContact O-N 2.85Å; R37-N40 WeakPolarHBondContact O-CA 3.47Å; R37-N40 VanDerWaalsContact O-CB 3.29Å; R37-N40 WeakPolarHBondContact O-CB 3.4Å; R37-N40 PolarHBondContact O-N 2.97Å; N40-L42 VanDerWaalsContact C-N 3.27Å; N40-L42 PolarHBondContact O-N 3.09Å; N40-M43 PolarHBondContact O-N 2.96Å; N40-M43 VanDerWaalsContact O-N 3.14Å; N40-M43 VanDerWaalsContact OD1-CE 3.31Å; N40-M43 WeakPolarHBondContact OD1-CE 3.43Å; N40-N44 WeakPolarHBondContact O-CB 3.47Å; N40-N44 VanDerWaalsContact O-CG 3.25Å; N40-N44 PolarHBondContact O-N 3.17Å; N40-N44 PolarHBondContact O-ND2 2.89Å; N40-Q117 PolarHBondContact OD1-NE2 3.16Å
41	D	98.9	Very high	98.7	Very high	64 Å²	64	56.8 Å²	56.8	34%	0.342	27%	0.271	S	S	.	.	H	α-helix	trans	-60.9	-39.2	-178.7	-60.9	-20.4	0	0	0	110.5	R37 L38 C45	R37-D41 IonicContact NE-OD2 3.76Å; R37-D41 PolarHBondContact NE-OD2 3Å; R37-D41 PolarHBondContact O-N 3.34Å; L38-D41 PolarHBondContact O-N 3.04Å; D41-C45 WeakPolarHBondContact O-CB 3.47Å; D41-C45 PolarHBondContact O-N 2.85Å
42	L	98.8	Very high	98.8	Very high	29 Å²	29	58.7 Å²	58.7	15%	0.152	29%	0.286	C	S	.	.	H	α-helix	trans	-66.9	-45.3	171.6	-178.7	62.1	0	0	0	112.9	L38 N40 N44 C45 V46 V113 L245 V248 L249	L38-L42 PolarHBondContact O-N 2.95Å; N40-L42 VanDerWaalsContact C-N 3.27Å; N40-L42 PolarHBondContact O-N 3.09Å; L42-N44 VanDerWaalsContact C-N 3.29Å; L42-N44 PolarHBondContact O-N 3.45Å; L42-C45 WeakPolarHBondContact O-CB 3.43Å; L42-C45 PolarHBondContact O-N 3.01Å; L42-V46 HydrophobicContact CD1-CG2 4.16Å; L42-V46 HydrophobicContact CG-CG2 4.41Å; L42-V46 WeakPolarHBondContact O-CG2 3.46Å; L42-V46 PolarHBondContact O-N 3.1Å; L42-V113 HydrophobicContact CD2-CG2 4Å; L42-L245 HydrophobicContact CD2-CD2 3.68Å; L42-V248 HydrophobicContact CD2-CG1 4.28Å; L42-L249 HydrophobicContact CD1-CD2 4.34Å
43	M	98.9	Very high	98.8	Very high	18 Å²	18	59 Å²	59	9%	0.089	29%	0.287	C	S	.	.	H	α-helix	trans	-59.4	-41	177.7	-73.8	-174.1	-68.7	0	0	111.8	C39 N40 V46 Q47 L110 V113 K114	C39-M43 VanDerWaalsContact O-CG 3.31Å; C39-M43 WeakPolarHBondContact O-CG 3.48Å; C39-M43 PolarHBondContact O-N 2.82Å; N40-M43 PolarHBondContact O-N 2.96Å; N40-M43 VanDerWaalsContact O-N 3.14Å; N40-M43 VanDerWaalsContact OD1-CE 3.31Å; N40-M43 WeakPolarHBondContact OD1-CE 3.43Å; M43-V46 PolarHBondContact O-N 3.19Å; M43-Q47 VanDerWaalsContact O-CB 3.31Å; M43-Q47 WeakPolarHBondContact O-CB 3.22Å; M43-Q47 PolarHBondContact O-N 2.98Å; M43-L110 HydrophobicContact CB-CD1 4.4Å; M43-L110 HydrophobicContact CB-CG 4.08Å; M43-L110 HydrophobicContact CG-CG 4.04Å; M43-L110 WeakPolarHBondContact O-CD1 3.5Å; M43-L110 HydrophobicContact SD-CD2 4.38Å; M43-V113 HydrophobicContact CG-CB 3.86Å; M43-V113 HydrophobicContact CG-CG1 3.61Å; M43-V113 HydrophobicContact SD-CB 4.33Å; M43-V113 HydrophobicContact SD-CG1 4.1Å; M43-K114 HydrophobicContact SD-CB 3.56Å; M43-K114 VanDerWaalsContact SD-CB 3.56Å; M43-K114 HydrophobicContact SD-CG 4.17Å
44	N	98.9	Very high	98.8	Very high	76 Å²	76	61.6 Å²	61.6	41%	0.406	30%	0.295	S	S	.	.	H	α-helix	trans	-63.9	-46.8	175.6	-68.1	-21.9	0	0	0	111.4	N40 L42 V46 Q47 E48	N40-N44 WeakPolarHBondContact O-CB 3.47Å; N40-N44 VanDerWaalsContact O-CG 3.25Å; N40-N44 PolarHBondContact O-N 3.17Å; N40-N44 PolarHBondContact O-ND2 2.89Å; L42-N44 VanDerWaalsContact C-N 3.29Å; L42-N44 PolarHBondContact O-N 3.45Å; N44-V46 PolarHBondContact O-N 3.25Å; N44-Q47 WeakPolarHBondContact O-CB 3.07Å; N44-Q47 PolarHBondContact O-N 2.85Å; N44-Q47 VanDerWaalsContact O-N 3.13Å; N44-E48 WeakPolarHBondContact O-CG 3.37Å; N44-E48 PolarHBondContact O-N 3.15Å
45	C	98.9	Very high	98.8	Very high	76 Å²	76	61.3 Å²	61.3	51%	0.514	30%	0.3	S	S	.	.	H	α-helix	trans	-57	-46	175.8	177.6	0	0	0	0	112.3	D41 L42 E48 R49	D41-C45 WeakPolarHBondContact O-CB 3.47Å; D41-C45 PolarHBondContact O-N 2.85Å; L42-C45 WeakPolarHBondContact O-CB 3.43Å; L42-C45 PolarHBondContact O-N 3.01Å; C45-E48 PolarHBondContact O-N 3.09Å; C45-R49 PolarHBondContact O-N 2.98Å
46	V	98.8	Very high	98.8	Very high	7 Å²	7	66.5 Å²	66.5	4%	0.042	32%	0.32	C	S	.	.	H	α-helix	trans	-63.5	-41.7	175	172.9	0	0	0	0	111.2	L42 M43 N44 R49 A50 L105 L110 I252	L42-V46 HydrophobicContact CD1-CG2 4.16Å; L42-V46 HydrophobicContact CG-CG2 4.41Å; L42-V46 WeakPolarHBondContact O-CG2 3.46Å; L42-V46 PolarHBondContact O-N 3.1Å; M43-V46 PolarHBondContact O-N 3.19Å; N44-V46 PolarHBondContact O-N 3.25Å; V46-R49 PolarHBondContact O-N 3.33Å; V46-A50 WeakPolarHBondContact O-CB 3.47Å; V46-A50 PolarHBondContact O-N 2.87Å; V46-L105 HydrophobicContact CG1-CB 3.96Å; V46-L105 HydrophobicContact CG1-CD2 4.26Å; V46-L105 VanDerWaalsContact CG1-O 3.23Å; V46-L105 WeakPolarHBondContact CG1-O 3.46Å; V46-L110 HydrophobicContact CG1-CB 4.16Å; V46-I252 HydrophobicContact CG2-CD1 3.58Å; V46-I252 HydrophobicContact CG2-CG1 4.43Å
47	Q	98.8	Very high	98.8	Very high	86 Å²	86	65.3 Å²	65.3	40%	0.402	32%	0.315	S	S	.	.	H	α-helix	trans	-65.4	-38.8	178.3	-168	-176.2	6.6	0	0	112.4	M43 N44 A50 K51 L106 L110	M43-Q47 VanDerWaalsContact O-CB 3.31Å; M43-Q47 WeakPolarHBondContact O-CB 3.22Å; M43-Q47 PolarHBondContact O-N 2.98Å; N44-Q47 WeakPolarHBondContact O-CB 3.07Å; N44-Q47 PolarHBondContact O-N 2.85Å; N44-Q47 VanDerWaalsContact O-N 3.13Å; Q47-A50 PolarHBondContact O-N 3.44Å; Q47-K51 WeakPolarHBondContact O-CG 3.37Å; Q47-K51 PolarHBondContact O-N 2.9Å; Q47-K51 VanDerWaalsContact O-N 3.13Å; Q47-L106 HydrophobicContact CB-CD2 4.34Å; Q47-L106 HydrophobicContact CG-CD2 4.17Å; Q47-L110 HydrophobicContact CB-CD1 3.95Å; Q47-L110 HydrophobicContact CG-CD1 4.5Å
48	E	98.8	Very high	98.8	Very high	114 Å²	114	62 Å²	62	53%	0.533	31%	0.306	S	S	.	.	H	α-helix	trans	-66.6	-45.8	174.8	-75.5	171.5	-164.5	0	0	111.5	N44 C45 A50 K51 I52	N44-E48 WeakPolarHBondContact O-CG 3.37Å; N44-E48 PolarHBondContact O-N 3.15Å; C45-E48 PolarHBondContact O-N 3.09Å; E48-A50 VanDerWaalsContact C-N 3.31Å; E48-A50 PolarHBondContact O-N 3.39Å; E48-K51 WeakPolarHBondContact O-CB 3.4Å; E48-K51 PolarHBondContact O-N 3.28Å; E48-K51 VanDerWaalsContact O-N 3.08Å; E48-I52 PolarHBondContact O-N 3.28Å
49	R	98.9	Very high	98.8	Very high	100 Å²	100	64.7 Å²	64.7	38%	0.377	32%	0.316	S	S	.	.	H	α-helix	trans	-56.5	-46	173	178.9	57.6	-173.1	-93.5	3.2	111.6	C45 V46 K51 I52 E53 L105 L256	C45-R49 PolarHBondContact O-N 2.98Å; V46-R49 PolarHBondContact O-N 3.33Å; R49-K51 VanDerWaalsContact C-N 3.27Å; R49-K51 PolarHBondContact O-N 2.96Å; R49-I52 WeakPolarHBondContact O-CB 3.43Å; R49-I52 PolarHBondContact O-N 2.95Å; R49-E53 IonicContact CZ-OE1 3.69Å; R49-E53 IonicContact NE-OE1 3.22Å; R49-E53 PolarHBondContact NE-OE1 3.13Å; R49-E53 IonicContact NH2-OE1 3.82Å; R49-E53 PolarHBondContact NH2-OE1 3.46Å; R49-E53 WeakPolarHBondContact O-CG 3.35Å; R49-E53 PolarHBondContact O-N 2.97Å; R49-E53 VanDerWaalsContact O-N 3.14Å; R49-L105 HydrophobicContact CG-CD1 4.01Å; R49-L256 HydrophobicContact CG-CD2 4.29Å
50	A	98.9	Very high	98.8	Very high	2 Å²	2	66 Å²	66	2%	0.017	32%	0.323	C	S	.	.	H	α-helix	trans	-62.3	-29	177.6	0	0	0	0	0	113.7	V46 Q47 E48 K54 K102 L105 L106	V46-A50 WeakPolarHBondContact O-CB 3.47Å; V46-A50 PolarHBondContact O-N 2.87Å; Q47-A50 PolarHBondContact O-N 3.44Å; E48-A50 VanDerWaalsContact C-N 3.31Å; E48-A50 PolarHBondContact O-N 3.39Å; A50-K54 PolarHBondContact O-N 3.2Å; A50-K54 VanDerWaalsContact O-N 3.12Å; A50-K102 HydrophobicContact CB-CG 4.17Å; A50-K102 VanDerWaalsContact O-CG 3.31Å; A50-K102 WeakPolarHBondContact O-CG 3.43Å; A50-L105 HydrophobicContact CB-CB 4.2Å; A50-L105 HydrophobicContact CB-CD1 4.15Å; A50-L106 HydrophobicContact CB-CD1 4.27Å; A50-L106 HydrophobicContact CB-CD2 3.64Å; A50-L106 HydrophobicContact CB-CG 3.74Å
51	K	98.8	Very high	98.8	Very high	119 Å²	119	65.5 Å²	65.5	52%	0.517	32%	0.322	S	S	.	.	H	α-helix	trans	-66.8	-39.3	171.8	-68.2	166	-167	164.8	0	111.6	Q47 E48 R49 K54 A55	Q47-K51 WeakPolarHBondContact O-CG 3.37Å; Q47-K51 PolarHBondContact O-N 2.9Å; Q47-K51 VanDerWaalsContact O-N 3.13Å; E48-K51 WeakPolarHBondContact O-CB 3.4Å; E48-K51 PolarHBondContact O-N 3.28Å; E48-K51 VanDerWaalsContact O-N 3.08Å; R49-K51 VanDerWaalsContact C-N 3.27Å; R49-K51 PolarHBondContact O-N 2.96Å; K51-K54 PolarHBondContact O-N 2.98Å; K51-A55 WeakPolarHBondContact O-CB 3.42Å; K51-A55 PolarHBondContact O-N 3.49Å
52	I	98.9	Very high	98.8	Very high	111 Å²	111	66.3 Å²	66.3	57%	0.569	33%	0.327	S	S	*	.	H	α-helix	trans	-63.4	-49.5	177.7	-60.9	169.1	0	0	0	110	E48 R49 K54 A55 Y56	E48-I52 PolarHBondContact O-N 3.28Å; R49-I52 WeakPolarHBondContact O-CB 3.43Å; R49-I52 PolarHBondContact O-N 2.95Å; I52-K54 VanDerWaalsContact C-N 3.33Å; I52-K54 PolarHBondContact O-N 3.06Å; I52-A55 PolarHBondContact O-N 2.86Å; I52-A55 VanDerWaalsContact O-N 3.08Å; I52-Y56 PolarHBondContact O-N 2.92Å
53	E	98.9	Very high	98.8	Very high	14 Å²	14	69.7 Å²	69.7	7%	0.065	34%	0.338	C	S	.	.	H	α-helix	trans	-56.3	-46	177.1	-61.3	-57.7	157.5	0	0	111.8	R49 A55 Y56 G57 H98 V101 K102 L105	R49-E53 IonicContact CZ-OE1 3.69Å; R49-E53 IonicContact NE-OE1 3.22Å; R49-E53 PolarHBondContact NE-OE1 3.13Å; R49-E53 IonicContact NH2-OE1 3.82Å; R49-E53 PolarHBondContact NH2-OE1 3.46Å; R49-E53 WeakPolarHBondContact O-CG 3.35Å; R49-E53 PolarHBondContact O-N 2.97Å; R49-E53 VanDerWaalsContact O-N 3.14Å; E53-A55 VanDerWaalsContact C-N 3.35Å; E53-A55 PolarHBondContact O-N 2.93Å; E53-Y56 PolarHBondContact O-N 3.33Å; E53-G57 PolarHBondContact O-N 3.38Å; E53-H98 IonicContact OE2-CE1 3.53Å; E53-H98 PolarHBondContact OE2-CE1 3.19Å; E53-H98 IonicContact OE2-CG 3.53Å; E53-H98 IonicContact OE2-ND1 3.59Å; E53-H98 PolarHBondContact OE2-ND1 2.84Å; E53-V101 HydrophobicContact CG-CG1 3.99Å; E53-K102 HydrophobicContact CB-CB 3.94Å; E53-L105 HydrophobicContact CG-CD1 4.29Å
54	K	98.8	Very high	98.8	Very high	113 Å²	113	68.9 Å²	68.9	49%	0.491	33%	0.333	S	S	.	.	H	α-helix	trans	-58.2	-45.4	174.3	-176	-177.2	175.2	-171.4	0	112.3	A50 K51 I52 Q58 Q99 K102	A50-K54 PolarHBondContact O-N 3.2Å; A50-K54 VanDerWaalsContact O-N 3.12Å; K51-K54 PolarHBondContact O-N 2.98Å; I52-K54 VanDerWaalsContact C-N 3.33Å; I52-K54 PolarHBondContact O-N 3.06Å; K54-Q58 WeakPolarHBondContact O-CB 3.41Å; K54-Q58 PolarHBondContact O-N 3.43Å; K54-Q99 PolarHBondContact O-NE2 2.93Å; K54-K102 HydrophobicContact CB-CG 4.16Å
55	A	98.8	Very high	98.8	Very high	46 Å²	46	71 Å²	71	38%	0.38	34%	0.339	S	S	.	.	H	α-helix	trans	-69.4	-34	-174.6	0	0	0	0	0	112.5	K51 I52 E53 Q59	K51-A55 WeakPolarHBondContact O-CB 3.42Å; K51-A55 PolarHBondContact O-N 3.49Å; I52-A55 PolarHBondContact O-N 2.86Å; I52-A55 VanDerWaalsContact O-N 3.08Å; E53-A55 VanDerWaalsContact C-N 3.35Å; E53-A55 PolarHBondContact O-N 2.93Å; A55-Q59 WeakPolarHBondContact O-CG 3.02Å; A55-Q59 PolarHBondContact O-N 3.45Å; A55-Q59 PolarHBondContact O-NE2 3.16Å; A55-Q59 VanDerWaalsContact O-NE2 3.08Å
56	Y	98.9	Very high	98.8	Very high	109 Å²	109	75.3 Å²	75.3	43%	0.427	35%	0.345	S	S	.	.	H	α-helix	trans	-67.1	-51.4	173.5	178.8	-115.7	0	0	0	111.4	I52 E53 Q58 Q59 L60 V94 H98	I52-Y56 PolarHBondContact O-N 2.92Å; E53-Y56 PolarHBondContact O-N 3.33Å; Y56-Q58 VanDerWaalsContact C-N 3.33Å; Y56-Q58 PolarHBondContact O-N 2.85Å; Y56-Q59 PolarHBondContact O-N 2.75Å; Y56-Q59 VanDerWaalsContact O-N 3.15Å; Y56-L60 HydrophobicContact CD1-CD1 4.13Å; Y56-L60 HydrophobicContact CE1-CD1 3.59Å; Y56-L60 HydrophobicContact CE1-CG 4.34Å; Y56-L60 HydrophobicContact CE2-CD1 4.36Å; Y56-L60 HydrophobicContact CE2-CD2 4.37Å; Y56-L60 HydrophobicContact CE2-CG 4.27Å; Y56-L60 PolarHBondContact O-N 3Å; Y56-L60 VanDerWaalsContact O-N 3.08Å; Y56-V94 HydrophobicContact CE1-CG1 4.25Å; Y56-H98 HydrophobicContact CD1-CB 4.49Å; Y56-H98 AromaticContact CD1-CD2 3.73Å; Y56-H98 AromaticContact CD1-CE1 3.69Å; Y56-H98 AromaticContact CD1-CG 3.75Å; Y56-H98 AromaticContact CD1-ND1 3.72Å; Y56-H98 AromaticContact CD1-NE2 3.7Å; Y56-H98 AromaticContact CE1-CD2 3.7Å; Y56-H98 AromaticContact CE1-CE1 3.85Å; Y56-H98 AromaticContact CE1-NE2 3.46Å; Y56-H98 WeakPolarHBondContact CE1-NE2 3.44Å
57	G	98.6	Very high	98.8	Very high	0 Å²	0	79.4 Å²	79.4	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-58	-43.7	176.8	0	0	0	0	0	112.8	E53 Q59 L60 T61 S95	E53-G57 PolarHBondContact O-N 3.38Å; G57-Q59 VanDerWaalsContact C-N 3.33Å; G57-Q59 PolarHBondContact O-N 3.39Å; G57-L60 WeakPolarHBondContact O-CB 3.39Å; G57-L60 PolarHBondContact O-N 3.34Å; G57-L60 VanDerWaalsContact O-N 3.16Å; G57-T61 PolarHBondContact O-N 2.91Å; G57-T61 PolarHBondContact O-OG1 3.43Å; G57-S95 WeakPolarHBondContact CA-OG 3.33Å; G57-S95 WeakPolarHBondContact O-CB 3.22Å; G57-S95 PolarHBondContact O-OG 3.25Å
58	Q	98.8	Very high	98.8	Very high	84 Å²	84	78.6 Å²	78.6	39%	0.393	35%	0.352	S	S	.	.	H	α-helix	trans	-57.9	-43.5	176.7	-174.8	60.2	59.3	0	0	112.5	K54 Y56 T61 D62	K54-Q58 WeakPolarHBondContact O-CB 3.41Å; K54-Q58 PolarHBondContact O-N 3.43Å; Y56-Q58 VanDerWaalsContact C-N 3.33Å; Y56-Q58 PolarHBondContact O-N 2.85Å; Q58-T61 PolarHBondContact O-N 2.99Å; Q58-D62 VanDerWaalsContact NE2-CG 3.3Å; Q58-D62 PolarHBondContact NE2-OD1 3.46Å; Q58-D62 PolarHBondContact NE2-OD2 3.34Å; Q58-D62 PolarHBondContact O-N 2.91Å
59	Q	98.9	Very high	98.7	Very high	134 Å²	134	77.4 Å²	77.4	63%	0.626	35%	0.347	S	S	*	.	H	α-helix	trans	-64.4	-38.8	177.3	-76.7	174.2	82.2	0	0	112.5	A55 Y56 G57 W63	A55-Q59 WeakPolarHBondContact O-CG 3.02Å; A55-Q59 PolarHBondContact O-N 3.45Å; A55-Q59 PolarHBondContact O-NE2 3.16Å; A55-Q59 VanDerWaalsContact O-NE2 3.08Å; Y56-Q59 PolarHBondContact O-N 2.75Å; Y56-Q59 VanDerWaalsContact O-N 3.15Å; G57-Q59 VanDerWaalsContact C-N 3.33Å; G57-Q59 PolarHBondContact O-N 3.39Å; Q59-W63 VanDerWaalsContact O-CB 3.23Å; Q59-W63 WeakPolarHBondContact O-CB 3.4Å; Q59-W63 PolarHBondContact O-N 3.23Å
60	L	98.9	Very high	98.7	Very high	28 Å²	28	76.9 Å²	76.9	15%	0.147	35%	0.351	C	S	.	.	H	α-helix	trans	-61.8	-47	173.7	-70.3	175.9	0	0	0	111.7	Y56 G57 D62 W63 A64 A91 V94	Y56-L60 HydrophobicContact CD1-CD1 4.13Å; Y56-L60 HydrophobicContact CE1-CD1 3.59Å; Y56-L60 HydrophobicContact CE1-CG 4.34Å; Y56-L60 HydrophobicContact CE2-CD1 4.36Å; Y56-L60 HydrophobicContact CE2-CD2 4.37Å; Y56-L60 HydrophobicContact CE2-CG 4.27Å; Y56-L60 PolarHBondContact O-N 3Å; Y56-L60 VanDerWaalsContact O-N 3.08Å; G57-L60 WeakPolarHBondContact O-CB 3.39Å; G57-L60 PolarHBondContact O-N 3.34Å; G57-L60 VanDerWaalsContact O-N 3.16Å; L60-D62 PolarHBondContact O-N 3.21Å; L60-W63 PolarHBondContact O-N 3.47Å; L60-A64 VanDerWaalsContact O-CB 3.23Å; L60-A64 WeakPolarHBondContact O-CB 3.47Å; L60-A64 PolarHBondContact O-N 3.33Å; L60-A91 HydrophobicContact CB-CB 4.3Å; L60-A91 HydrophobicContact CD2-CB 4.23Å; L60-V94 HydrophobicContact CD1-CB 3.96Å; L60-V94 HydrophobicContact CD1-CG1 3.58Å
61	T	98.8	Very high	98.6	Very high	45 Å²	45	77.3 Å²	77.3	28%	0.276	35%	0.353	S	S	.	.	H	α-helix	trans	-63	-41.5	178.2	-64.1	0	0	0	0	112.4	G57 Q58 A64 K65 S95	G57-T61 PolarHBondContact O-N 2.91Å; G57-T61 PolarHBondContact O-OG1 3.43Å; Q58-T61 PolarHBondContact O-N 2.99Å; T61-A64 PolarHBondContact O-N 2.83Å; T61-K65 VanDerWaalsContact O-CB 3.23Å; T61-K65 WeakPolarHBondContact O-CB 3.41Å; T61-K65 PolarHBondContact O-N 2.78Å; T61-S95 VanDerWaalsContact OG1-CB 3.3Å; T61-S95 WeakPolarHBondContact OG1-CB 3.5Å; T61-S95 PolarHBondContact OG1-OG 2.83Å
62	D	98.8	Very high	98.5	Very high	81 Å²	81	77.4 Å²	77.4	43%	0.433	36%	0.355	S	S	.	.	H	α-helix	trans	-69.2	-38.3	178.1	-71.5	-36.9	0	0	0	112	Q58 L60 R66	Q58-D62 VanDerWaalsContact NE2-CG 3.3Å; Q58-D62 PolarHBondContact NE2-OD1 3.46Å; Q58-D62 PolarHBondContact NE2-OD2 3.34Å; Q58-D62 PolarHBondContact O-N 2.91Å; L60-D62 PolarHBondContact O-N 3.21Å; D62-R66 WeakPolarHBondContact O-CB 3.34Å; D62-R66 PolarHBondContact O-N 3.04Å
63	W	98.8	Very high	98.4	Very high	101 Å²	101	79.9 Å²	79.9	38%	0.383	36%	0.362	S	S	.	.	H	α-helix	trans	-62.4	-48	171.6	175.1	94.9	0	0	0	111.6	Q59 L60 R66 W67 I87 M88 A91	Q59-W63 VanDerWaalsContact O-CB 3.23Å; Q59-W63 WeakPolarHBondContact O-CB 3.4Å; Q59-W63 PolarHBondContact O-N 3.23Å; L60-W63 PolarHBondContact O-N 3.47Å; W63-R66 PolarHBondContact O-N 3.06Å; W63-W67 AromaticContact CD1-CD1 3.62Å; W63-W67 AromaticContact CD1-NE1 3.74Å; W63-W67 AromaticContact CD2-CD1 3.9Å; W63-W67 AromaticContact CE2-CD1 3.43Å; W63-W67 VanDerWaalsContact CE2-CD1 3.43Å; W63-W67 AromaticContact CE2-NE1 3.84Å; W63-W67 AromaticContact CG-CD1 3.97Å; W63-W67 AromaticContact CZ2-CD1 3.93Å; W63-W67 HydrophobicContact CZ2-CG 4.44Å; W63-W67 AromaticContact NE1-CD1 3.29Å; W63-W67 VanDerWaalsContact NE1-CD1 3.29Å; W63-W67 AromaticContact NE1-NE1 3.28Å; W63-W67 PolarHBondContact O-N 2.91Å; W63-I87 HydrophobicContact CH2-CG2 3.84Å; W63-I87 HydrophobicContact CZ3-CG2 4.45Å; W63-M88 HydrophobicContact CE3-CG 4.32Å; W63-M88 HydrophobicContact CH2-CG 4.1Å; W63-M88 HydrophobicContact CH2-SD 3.87Å; W63-M88 HydrophobicContact CZ3-CB 4.45Å; W63-M88 HydrophobicContact CZ3-CG 3.74Å; W63-M88 HydrophobicContact CZ3-SD 4.13Å; W63-A91 HydrophobicContact CE3-CB 3.73Å; W63-A91 HydrophobicContact CZ3-CB 3.63Å
64	A	98.8	Very high	98.3	Very high	0 Å²	0	80.9 Å²	80.9	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-60.7	-49.2	-178.7	0	0	0	0	0	111.5	L60 T61 R66 W67 R68 M88 A91 D92	L60-A64 VanDerWaalsContact O-CB 3.23Å; L60-A64 WeakPolarHBondContact O-CB 3.47Å; L60-A64 PolarHBondContact O-N 3.33Å; T61-A64 PolarHBondContact O-N 2.83Å; A64-R66 VanDerWaalsContact C-N 3.34Å; A64-R66 PolarHBondContact O-N 3.04Å; A64-W67 PolarHBondContact O-N 2.78Å; A64-R68 WeakPolarHBondContact O-CB 3.39Å; A64-R68 PolarHBondContact O-N 2.97Å; A64-M88 HydrophobicContact CB-CB 3.89Å; A64-M88 HydrophobicContact CB-CG 4.21Å; A64-M88 WeakPolarHBondContact CB-O 3.44Å; A64-M88 WeakPolarHBondContact O-CG 3.25Å; A64-A91 HydrophobicContact CB-CB 4.17Å; A64-D92 WeakPolarHBondContact CB-OD1 3.4Å
65	K	98.8	Very high	98.3	Very high	120 Å²	120	81.5 Å²	81.5	52%	0.522	39%	0.391	S	S	.	.	H	α-helix	trans	-58.1	-42.5	174.9	-178.7	179.7	178.5	-178.3	0	112.6	T61 Q69	T61-K65 VanDerWaalsContact O-CB 3.23Å; T61-K65 WeakPolarHBondContact O-CB 3.41Å; T61-K65 PolarHBondContact O-N 2.78Å; K65-Q69 WeakPolarHBondContact O-CG 3.5Å; K65-Q69 PolarHBondContact O-N 2.78Å
66	R	98.7	Very high	98.2	Very high	168 Å²	168	82 Å²	82	63%	0.634	39%	0.386	S	S	*	.	H	α-helix	trans	-63.9	-51.2	178.1	175	179.5	173.3	172.9	-1.7	111.6	D62 W63 A64 Q69 L70	D62-R66 WeakPolarHBondContact O-CB 3.34Å; D62-R66 PolarHBondContact O-N 3.04Å; W63-R66 PolarHBondContact O-N 3.06Å; A64-R66 VanDerWaalsContact C-N 3.34Å; A64-R66 PolarHBondContact O-N 3.04Å; R66-Q69 PolarHBondContact O-N 3.16Å; R66-L70 HydrophobicContact CG-CD1 4.12Å; R66-L70 WeakPolarHBondContact O-CG 3.46Å; R66-L70 PolarHBondContact O-N 2.84Å
67	W	98.7	Very high	98.1	Very high	93 Å²	93	80.8 Å²	80.8	35%	0.352	38%	0.381	S	S	.	.	H	α-helix	trans	-70.6	-37.2	-175	-83.4	103.4	0	0	0	113.1	W63 A64 Q69 L70 I71 W84 M88	W63-W67 AromaticContact CD1-CD1 3.62Å; W63-W67 AromaticContact CD1-NE1 3.74Å; W63-W67 AromaticContact CD2-CD1 3.9Å; W63-W67 AromaticContact CE2-CD1 3.43Å; W63-W67 VanDerWaalsContact CE2-CD1 3.43Å; W63-W67 AromaticContact CE2-NE1 3.84Å; W63-W67 AromaticContact CG-CD1 3.97Å; W63-W67 AromaticContact CZ2-CD1 3.93Å; W63-W67 HydrophobicContact CZ2-CG 4.44Å; W63-W67 AromaticContact NE1-CD1 3.29Å; W63-W67 VanDerWaalsContact NE1-CD1 3.29Å; W63-W67 AromaticContact NE1-NE1 3.28Å; W63-W67 PolarHBondContact O-N 2.91Å; A64-W67 PolarHBondContact O-N 2.78Å; W67-Q69 VanDerWaalsContact C-N 3.33Å; W67-Q69 PolarHBondContact O-N 3.3Å; W67-L70 HydrophobicContact CD2-CD1 4.29Å; W67-L70 HydrophobicContact CE3-CB 4.37Å; W67-L70 HydrophobicContact CE3-CD1 4.1Å; W67-L70 HydrophobicContact CZ3-CD1 4.34Å; W67-L70 PolarHBondContact O-N 2.72Å; W67-I71 WeakPolarHBondContact O-CG1 3.33Å; W67-I71 PolarHBondContact O-N 2.93Å; W67-W84 HydrophobicContact CZ3-CZ2 4.4Å; W67-M88 HydrophobicContact CB-CE 4.33Å; W67-M88 HydrophobicContact CB-CG 3.85Å; W67-M88 HydrophobicContact CB-SD 3.83Å
68	R	98.2	Very high	98.1	Very high	68 Å²	68	82 Å²	82	26%	0.257	39%	0.393	S	S	.	.	H	α-helix	trans	-52.8	-50.1	171.5	-172.7	173.7	-66.5	122.6	-2.6	111.5	A64 L70 I71 E72 M88 D92	A64-R68 WeakPolarHBondContact O-CB 3.39Å; A64-R68 PolarHBondContact O-N 2.97Å; R68-L70 VanDerWaalsContact C-N 3.3Å; R68-L70 PolarHBondContact O-N 2.85Å; R68-I71 PolarHBondContact O-N 3.17Å; R68-E72 WeakPolarHBondContact CG-OE1 3.25Å; R68-E72 WeakPolarHBondContact O-CB 3.23Å; R68-E72 VanDerWaalsContact O-CG 3.26Å; R68-E72 WeakPolarHBondContact O-CG 3.43Å; R68-E72 PolarHBondContact O-N 3.5Å; R68-M88 VanDerWaalsContact NH2-C 3.29Å; R68-M88 PolarHBondContact NH2-O 3.42Å; R68-D92 IonicContact CZ-OD2 4Å; R68-D92 IonicContact NH1-OD2 3.58Å; R68-D92 PolarHBondContact NH1-OD2 3.25Å; R68-D92 IonicContact NH2-OD2 2.76Å; R68-D92 PolarHBondContact NH2-OD2 3.16Å
69	Q	98.1	Very high	98	Very high	89 Å²	89	78.1 Å²	78.1	42%	0.416	38%	0.376	S	S	.	.	H	α-helix	trans	-65.9	-24.8	176.6	-69.7	-176.6	14.9	0	0	115	K65 R66 W67 K73	K65-Q69 WeakPolarHBondContact O-CG 3.5Å; K65-Q69 PolarHBondContact O-N 2.78Å; R66-Q69 PolarHBondContact O-N 3.16Å; W67-Q69 VanDerWaalsContact C-N 3.33Å; W67-Q69 PolarHBondContact O-N 3.3Å; Q69-K73 VanDerWaalsContact O-CD 3.32Å; Q69-K73 WeakPolarHBondContact O-CD 3.33Å; Q69-K73 VanDerWaalsContact O-CG 3.3Å; Q69-K73 WeakPolarHBondContact O-CG 3.44Å
70	L	98.3	Very high	98	Very high	89 Å²	89	75.8 Å²	75.8	47%	0.466	37%	0.367	S	S	.	.	H	α-helix	trans	-79.6	-36.4	177.2	-72.5	171.7	0	0	0	111.5	R66 W67 R68 G74	R66-L70 HydrophobicContact CG-CD1 4.12Å; R66-L70 WeakPolarHBondContact O-CG 3.46Å; R66-L70 PolarHBondContact O-N 2.84Å; W67-L70 HydrophobicContact CD2-CD1 4.29Å; W67-L70 HydrophobicContact CE3-CB 4.37Å; W67-L70 HydrophobicContact CE3-CD1 4.1Å; W67-L70 HydrophobicContact CZ3-CD1 4.34Å; W67-L70 PolarHBondContact O-N 2.72Å; R68-L70 VanDerWaalsContact C-N 3.3Å; R68-L70 PolarHBondContact O-N 2.85Å; L70-G74 PolarHBondContact O-N 2.93Å; L70-G74 VanDerWaalsContact O-N 3.09Å
71	I	97.3	Very high	98	Very high	11 Å²	11	77.2 Å²	77.2	6%	0.056	37%	0.373	C	S	.	.	H	α-helix	trans	-72.6	-48.6	176.6	-65.7	174.4	0	0	0	110.7	W67 R68 K73 G74 E81 W84 M88	W67-I71 WeakPolarHBondContact O-CG1 3.33Å; W67-I71 PolarHBondContact O-N 2.93Å; R68-I71 PolarHBondContact O-N 3.17Å; I71-K73 PolarHBondContact O-N 3.07Å; I71-G74 WeakPolarHBondContact O-CA 3.48Å; I71-G74 PolarHBondContact O-N 2.94Å; I71-E81 HydrophobicContact CG2-CG 3.66Å; I71-W84 HydrophobicContact CD1-CB 4.15Å; I71-W84 HydrophobicContact CD1-CD2 3.49Å; I71-W84 VanDerWaalsContact CD1-CD2 3.49Å; I71-W84 HydrophobicContact CD1-CE3 4.12Å; I71-W84 HydrophobicContact CD1-CG 3.48Å; I71-W84 VanDerWaalsContact CD1-CG 3.48Å; I71-W84 HydrophobicContact CD1-CZ2 4.32Å; I71-W84 HydrophobicContact CG1-CD2 4.17Å; I71-W84 HydrophobicContact CG1-CE3 4.38Å; I71-W84 HydrophobicContact CG1-CZ2 4.47Å; I71-M88 HydrophobicContact CD1-CE 3.33Å
72	E	95.2	Very high	97.9	Very high	122 Å²	122	82.6 Å²	82.6	57%	0.57	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-24.1	178.2	-72.6	168.9	175.7	0	0	113.6	R68	R68-E72 WeakPolarHBondContact CG-OE1 3.25Å; R68-E72 WeakPolarHBondContact O-CB 3.23Å; R68-E72 VanDerWaalsContact O-CG 3.26Å; R68-E72 WeakPolarHBondContact O-CG 3.43Å; R68-E72 PolarHBondContact O-N 3.5Å
73	K	97.3	Very high	97.9	Very high	163 Å²	163	79 Å²	79	71%	0.709	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-4.5	176.3	-64.5	174.5	-170.1	163.3	0	113.1	Q69 I71	Q69-K73 VanDerWaalsContact O-CD 3.32Å; Q69-K73 WeakPolarHBondContact O-CD 3.33Å; Q69-K73 VanDerWaalsContact O-CG 3.3Å; Q69-K73 WeakPolarHBondContact O-CG 3.44Å; I71-K73 PolarHBondContact O-N 3.07Å
74	G	97.3	Very high	97.9	Very high	35 Å²	35	79.4 Å²	79.4	36%	0.361	37%	0.372	S	S	.	.	S	Bend	trans	-81.6	179.2	-178.1	0	0	0	0	0	112.5	L70 I71 Q76	L70-G74 PolarHBondContact O-N 2.93Å; L70-G74 VanDerWaalsContact O-N 3.09Å; I71-G74 WeakPolarHBondContact O-CA 3.48Å; I71-G74 PolarHBondContact O-N 2.94Å; G74-Q76 VanDerWaalsContact C-N 3.3Å
75	P	97.7	Very high	97.9	Very high	125 Å²	125	80.4 Å²	80.4	81%	0.812	38%	0.382	S	S	*	.	S	Bend	trans	-85.5	0.4	176.2	35.7	-36	0	0	0	113.4	Y77	P75-Y77 VanDerWaalsContact O-CD1 3.22Å; P75-Y77 WeakPolarHBondContact O-CD1 3.37Å; P75-Y77 WeakPolarHBondContact O-CE1 3.47Å
76	Q	98	Very high	97.9	Very high	56 Å²	56	75.4 Å²	75.4	26%	0.262	36%	0.363	S	S	.	.			trans	-84.3	137	178.3	-175.7	58.3	61.4	0	0	110	G74 E81 W84	G74-Q76 VanDerWaalsContact C-N 3.3Å; Q76-E81 HydrophobicContact CG-CB 4.11Å; Q76-W84 HydrophobicContact CG-CE3 4.34Å
77	Y	96.7	Very high	97.9	Very high	84 Å²	84	70.3 Å²	70.3	33%	0.329	35%	0.347	S	S	.	.			trans	-141.3	175.5	179.6	45.4	-100.3	0	0	0	111.1	P75 E81 W286 F287	P75-Y77 VanDerWaalsContact O-CD1 3.22Å; P75-Y77 WeakPolarHBondContact O-CD1 3.37Å; P75-Y77 WeakPolarHBondContact O-CE1 3.47Å; Y77-E81 WeakPolarHBondContact CA-OE2 3.31Å; Y77-E81 PolarHBondContact O-N 3.12Å; Y77-W286 HydrophobicContact CD1-CZ3 4.33Å; Y77-W286 AromaticContact CD2-CE3 3.79Å; Y77-W286 HydrophobicContact CD2-CE3 3.79Å; Y77-W286 HydrophobicContact CD2-CH2 4.21Å; Y77-W286 AromaticContact CD2-CZ3 3.39Å; Y77-W286 HydrophobicContact CD2-CZ3 3.39Å; Y77-W286 HydrophobicContact CE1-CZ3 4.37Å; Y77-W286 AromaticContact CE2-CE3 3.77Å; Y77-W286 HydrophobicContact CE2-CE3 3.77Å; Y77-W286 AromaticContact CE2-CZ3 3.45Å; Y77-W286 HydrophobicContact CE2-CZ3 3.45Å; Y77-W286 VanDerWaalsContact CE2-CZ3 3.45Å; Y77-W286 HydrophobicContact CG-CH2 4.3Å; Y77-W286 AromaticContact CG-CZ3 3.87Å; Y77-W286 HydrophobicContact CG-CZ3 3.87Å; Y77-W286 AromaticContact CZ-CZ3 3.97Å; Y77-F287 HydrophobicContact CE2-CD2 4.37Å; Y77-F287 AromaticContact CZ-CD2 3.82Å; Y77-F287 WeakPolarHBondContact OH-CD2 3.28Å
78	G	97.4	Very high	97.9	Very high	25 Å²	25	66 Å²	66	26%	0.258	33%	0.331	S	S	.	.	H	α-helix	trans	83.8	-149	163.6	0	0	0	0	0	115.1	E81 R82 D283	G78-E81 PolarHBondContact N-OE2 2.92Å; G78-R82 PolarHBondContact O-N 2.88Å; G78-D283 WeakPolarHBondContact CA-OD1 3.47Å
79	S	98.3	Very high	97.9	Very high	3 Å²	3	65.7 Å²	65.7	2%	0.021	34%	0.337	C	S	.	.	H	α-helix	trans	-66	-38.6	179.5	75.2	0	0	0	0	112.2	R82 A83 D279 D283	S79-R82 PolarHBondContact O-N 2.95Å; S79-A83 PolarHBondContact O-N 2.82Å; S79-D279 PolarHBondContact OG-N 3.47Å; S79-D279 PolarHBondContact OG-O 3.02Å; S79-D283 WeakPolarHBondContact CB-OD1 3.22Å; S79-D283 VanDerWaalsContact N-CG 3.34Å; S79-D283 PolarHBondContact N-OD1 3.48Å; S79-D283 PolarHBondContact N-OD2 3.33Å; S79-D283 VanDerWaalsContact N-OD2 3.11Å; S79-D283 PolarHBondContact OG-OD1 3.21Å; S79-D283 PolarHBondContact OG-OD2 2.89Å
80	L	98.3	Very high	97.9	Very high	85 Å²	85	63 Å²	63	45%	0.445	33%	0.325	S	S	.	.	H	α-helix	trans	-69.5	-33.9	177.6	-177.1	60.7	0	0	0	112.8	A83 W84 D283	L80-A83 PolarHBondContact O-N 3.18Å; L80-W84 PolarHBondContact O-N 2.85Å; L80-D283 PolarHBondContact N-OD2 3.04Å; L80-D283 VanDerWaalsContact N-OD2 3.17Å
81	E	98.3	Very high	98	Very high	58 Å²	58	58.9 Å²	58.9	27%	0.271	30%	0.303	S	S	.	.	H	α-helix	trans	-60.5	-45.7	171.8	-172.7	-165.4	-176.9	0	0	111.2	I71 Q76 Y77 G78 A83 W84 G85	I71-E81 HydrophobicContact CG2-CG 3.66Å; Q76-E81 HydrophobicContact CG-CB 4.11Å; Y77-E81 WeakPolarHBondContact CA-OE2 3.31Å; Y77-E81 PolarHBondContact O-N 3.12Å; G78-E81 PolarHBondContact N-OE2 2.92Å; E81-A83 PolarHBondContact O-N 2.8Å; E81-W84 PolarHBondContact O-N 2.81Å; E81-G85 PolarHBondContact O-N 2.83Å
82	R	98.1	Very high	98	Very high	158 Å²	158	60 Å²	60	60%	0.596	31%	0.309	S	S	*	.	H	α-helix	trans	-62.3	-42	176.8	-68.7	-177.6	-70.9	148.7	-4.4	112.2	G78 S79 G85 A86 E282	G78-R82 PolarHBondContact O-N 2.88Å; S79-R82 PolarHBondContact O-N 2.95Å; R82-G85 PolarHBondContact O-N 3.23Å; R82-A86 PolarHBondContact O-N 2.87Å; R82-E282 IonicContact NH2-OE2 3.13Å
83	A	98.4	Very high	98.2	Very high	6 Å²	6	56.9 Å²	56.9	5%	0.05	29%	0.294	C	S	.	.	H	α-helix	trans	-62.8	-43.9	176.7	0	0	0	0	0	112.5	S79 L80 E81 A86 A278	S79-A83 PolarHBondContact O-N 2.82Å; L80-A83 PolarHBondContact O-N 3.18Å; E81-A83 PolarHBondContact O-N 2.8Å; A83-A86 WeakPolarHBondContact O-CB 3.15Å; A83-A86 PolarHBondContact O-N 3.13Å; A83-A278 HydrophobicContact CB-CB 4.04Å
84	W	98.4	Very high	98.3	Very high	110 Å²	110	49.2 Å²	49.2	42%	0.417	26%	0.261	S	S	.	.	H	α-helix	trans	-67.4	-41.4	174.7	-165.9	-6.1	0	0	0	111.1	W67 I71 Q76 L80 E81 A86 I87 M88	W67-W84 HydrophobicContact CZ3-CZ2 4.4Å; I71-W84 HydrophobicContact CD1-CB 4.15Å; I71-W84 HydrophobicContact CD1-CD2 3.49Å; I71-W84 VanDerWaalsContact CD1-CD2 3.49Å; I71-W84 HydrophobicContact CD1-CE3 4.12Å; I71-W84 HydrophobicContact CD1-CG 3.48Å; I71-W84 VanDerWaalsContact CD1-CG 3.48Å; I71-W84 HydrophobicContact CD1-CZ2 4.32Å; I71-W84 HydrophobicContact CG1-CD2 4.17Å; I71-W84 HydrophobicContact CG1-CE3 4.38Å; I71-W84 HydrophobicContact CG1-CZ2 4.47Å; Q76-W84 HydrophobicContact CG-CE3 4.34Å; L80-W84 PolarHBondContact O-N 2.85Å; E81-W84 PolarHBondContact O-N 2.81Å; W84-A86 PolarHBondContact O-N 2.59Å; W84-I87 WeakPolarHBondContact O-CG1 3.5Å; W84-I87 PolarHBondContact O-N 2.94Å; W84-I87 VanDerWaalsContact O-N 3.1Å; W84-M88 WeakPolarHBondContact O-CE 3.42Å
85	G	98.5	Very high	98.3	Very high	21 Å²	21	47.9 Å²	47.9	22%	0.216	25%	0.245	C	C	.	.	H	α-helix	trans	-52	-35.4	172.6	0	0	0	0	0	113.9	E81 R82 I87 M88 T89	E81-G85 PolarHBondContact O-N 2.83Å; R82-G85 PolarHBondContact O-N 3.23Å; G85-I87 VanDerWaalsContact C-N 3.28Å; G85-I87 PolarHBondContact O-N 3.44Å; G85-M88 PolarHBondContact O-N 3.24Å; G85-T89 PolarHBondContact O-N 3.1Å; G85-T89 PolarHBondContact O-OG1 2.86Å
86	A	98.6	Very high	98.4	Very high	14 Å²	14	48.5 Å²	48.5	12%	0.116	24%	0.237	C	C	.	.	H	α-helix	trans	-64.6	-26.2	179.9	0	0	0	0	0	113.9	R82 A83 W84 M88 T89 E90 L271 A274	R82-A86 PolarHBondContact O-N 2.87Å; A83-A86 WeakPolarHBondContact O-CB 3.15Å; A83-A86 PolarHBondContact O-N 3.13Å; W84-A86 PolarHBondContact O-N 2.59Å; A86-M88 VanDerWaalsContact C-N 3.32Å; A86-M88 PolarHBondContact O-N 3.15Å; A86-T89 CarbonylContact O-C 3.52Å; A86-T89 WeakPolarHBondContact O-CB 3.42Å; A86-T89 PolarHBondContact O-N 3.44Å; A86-T89 VanDerWaalsContact O-N 3.16Å; A86-E90 PolarHBondContact O-N 3.01Å; A86-L271 HydrophobicContact CB-CD1 3.89Å; A86-A274 HydrophobicContact CB-CB 3.45Å; A86-A274 VanDerWaalsContact CB-CB 3.45Å
87	I	98.6	Very high	98.4	Very high	62 Å²	62	46.3 Å²	46.3	32%	0.318	23%	0.228	S	C	.	.	H	α-helix	trans	-64.9	-39	175.7	-49.2	178.1	0	0	0	110.3	W63 W84 G85 T89 E90 A91 L271	W63-I87 HydrophobicContact CH2-CG2 3.84Å; W63-I87 HydrophobicContact CZ3-CG2 4.45Å; W84-I87 WeakPolarHBondContact O-CG1 3.5Å; W84-I87 PolarHBondContact O-N 2.94Å; W84-I87 VanDerWaalsContact O-N 3.1Å; G85-I87 VanDerWaalsContact C-N 3.28Å; G85-I87 PolarHBondContact O-N 3.44Å; I87-T89 VanDerWaalsContact C-N 3.31Å; I87-T89 PolarHBondContact O-N 2.92Å; I87-E90 WeakPolarHBondContact O-CB 3.08Å; I87-E90 PolarHBondContact O-N 2.9Å; I87-A91 PolarHBondContact O-N 2.89Å; I87-L271 HydrophobicContact CG1-CD1 4.11Å
88	M	98.8	Very high	98.5	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-72.7	-26.8	175.4	-70.4	71.9	69.4	0	0	112.1	W63 A64 W67 R68 I71 W84 G85 A86 D92	W63-M88 HydrophobicContact CE3-CG 4.32Å; W63-M88 HydrophobicContact CH2-CG 4.1Å; W63-M88 HydrophobicContact CH2-SD 3.87Å; W63-M88 HydrophobicContact CZ3-CB 4.45Å; W63-M88 HydrophobicContact CZ3-CG 3.74Å; W63-M88 HydrophobicContact CZ3-SD 4.13Å; A64-M88 HydrophobicContact CB-CB 3.89Å; A64-M88 HydrophobicContact CB-CG 4.21Å; A64-M88 WeakPolarHBondContact CB-O 3.44Å; A64-M88 WeakPolarHBondContact O-CG 3.25Å; W67-M88 HydrophobicContact CB-CE 4.33Å; W67-M88 HydrophobicContact CB-CG 3.85Å; W67-M88 HydrophobicContact CB-SD 3.83Å; R68-M88 VanDerWaalsContact NH2-C 3.29Å; R68-M88 PolarHBondContact NH2-O 3.42Å; I71-M88 HydrophobicContact CD1-CE 3.33Å; W84-M88 WeakPolarHBondContact O-CE 3.42Å; G85-M88 PolarHBondContact O-N 3.24Å; A86-M88 VanDerWaalsContact C-N 3.32Å; A86-M88 PolarHBondContact O-N 3.15Å; M88-D92 PolarHBondContact O-N 3.06Å; M88-D92 VanDerWaalsContact O-N 3.07Å
89	T	98.6	Very high	98.6	Very high	63 Å²	63	44.7 Å²	44.7	39%	0.387	22%	0.216	S	C	.	.	H	α-helix	trans	-70.7	-33.5	170.2	-56.5	0	0	0	0	112.1	G85 A86 I87 K93	G85-T89 PolarHBondContact O-N 3.1Å; G85-T89 PolarHBondContact O-OG1 2.86Å; A86-T89 CarbonylContact O-C 3.52Å; A86-T89 WeakPolarHBondContact O-CB 3.42Å; A86-T89 PolarHBondContact O-N 3.44Å; A86-T89 VanDerWaalsContact O-N 3.16Å; I87-T89 VanDerWaalsContact C-N 3.31Å; I87-T89 PolarHBondContact O-N 2.92Å; T89-K93 HydrophobicContact CG2-CD 4.47Å; T89-K93 WeakPolarHBondContact O-CG 3.46Å; T89-K93 PolarHBondContact O-N 2.91Å; T89-K93 VanDerWaalsContact O-N 3.14Å
90	E	98.7	Very high	98.6	Very high	33 Å²	33	49 Å²	49	15%	0.154	24%	0.236	C	C	.	.	H	α-helix	trans	-63	-51.8	169.7	175.5	-92.2	178.4	0	0	110.7	A86 I87 D92 K93 V94 V267 Y268 L271	A86-E90 PolarHBondContact O-N 3.01Å; I87-E90 WeakPolarHBondContact O-CB 3.08Å; I87-E90 PolarHBondContact O-N 2.9Å; E90-D92 VanDerWaalsContact C-N 3.31Å; E90-D92 PolarHBondContact O-N 3.18Å; E90-K93 PolarHBondContact O-N 3.21Å; E90-V94 HydrophobicContact CG-CG2 4.24Å; E90-V94 WeakPolarHBondContact O-CG2 3.17Å; E90-V94 PolarHBondContact O-N 3.42Å; E90-V267 HydrophobicContact CB-CG1 4.06Å; E90-V267 HydrophobicContact CG-CG1 3.52Å; E90-Y268 HydrophobicContact CG-CD1 4.4Å; E90-Y268 HydrophobicContact CG-CE1 3.85Å; E90-Y268 WeakPolarHBondContact OE1-CE1 3.43Å; E90-Y268 PolarHBondContact OE1-OH 2.86Å; E90-L271 HydrophobicContact CB-CD2 4.03Å; E90-L271 HydrophobicContact CG-CD2 4.02Å
91	A	98.8	Very high	98.6	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-59.5	-39	-179.6	0	0	0	0	0	113	L60 W63 A64 I87 S95	L60-A91 HydrophobicContact CB-CB 4.3Å; L60-A91 HydrophobicContact CD2-CB 4.23Å; W63-A91 HydrophobicContact CE3-CB 3.73Å; W63-A91 HydrophobicContact CZ3-CB 3.63Å; A64-A91 HydrophobicContact CB-CB 4.17Å; I87-A91 PolarHBondContact O-N 2.89Å; A91-S95 WeakPolarHBondContact O-CB 3.27Å; A91-S95 PolarHBondContact O-N 3.29Å
92	D	98.8	Very high	98.6	Very high	36 Å²	36	44.3 Å²	44.3	19%	0.193	21%	0.212	C	C	.	.	H	α-helix	trans	-64.4	-43.4	173.4	-76.9	-39.2	0	0	0	111.7	A64 R68 M88 E90 S95 E96	A64-D92 WeakPolarHBondContact CB-OD1 3.4Å; R68-D92 IonicContact CZ-OD2 4Å; R68-D92 IonicContact NH1-OD2 3.58Å; R68-D92 PolarHBondContact NH1-OD2 3.25Å; R68-D92 IonicContact NH2-OD2 2.76Å; R68-D92 PolarHBondContact NH2-OD2 3.16Å; M88-D92 PolarHBondContact O-N 3.06Å; M88-D92 VanDerWaalsContact O-N 3.07Å; E90-D92 VanDerWaalsContact C-N 3.31Å; E90-D92 PolarHBondContact O-N 3.18Å; D92-S95 WeakPolarHBondContact O-CB 3.41Å; D92-S95 PolarHBondContact O-N 2.82Å; D92-E96 WeakPolarHBondContact O-CG 3.26Å; D92-E96 PolarHBondContact O-N 2.8Å
93	K	98.7	Very high	98.7	Very high	56 Å²	56	39.6 Å²	39.6	24%	0.243	20%	0.198	C	C	.	.	H	α-helix	trans	-68.3	-36.5	176.8	-71.9	177	177.2	177.8	0	113.1	T89 E90 E96 L97 V267 E270	T89-K93 HydrophobicContact CG2-CD 4.47Å; T89-K93 WeakPolarHBondContact O-CG 3.46Å; T89-K93 PolarHBondContact O-N 2.91Å; T89-K93 VanDerWaalsContact O-N 3.14Å; E90-K93 PolarHBondContact O-N 3.21Å; K93-E96 PolarHBondContact O-N 3.49Å; K93-L97 WeakPolarHBondContact O-CG 3.43Å; K93-L97 PolarHBondContact O-N 2.82Å; K93-L97 VanDerWaalsContact O-N 3.14Å; K93-V267 HydrophobicContact CB-CG1 4.25Å; K93-V267 HydrophobicContact CB-CG2 3.68Å; K93-V267 HydrophobicContact CD-CG2 4.01Å; K93-V267 HydrophobicContact CG-CG2 4.46Å; K93-E270 IonicContact NZ-OE1 3.16Å; K93-E270 PolarHBondContact NZ-OE1 2.9Å; K93-E270 IonicContact NZ-OE2 3.82Å; K93-E270 PolarHBondContact NZ-OE2 3.42Å
94	V	98.8	Very high	98.7	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.012	20%	0.204	C	C	.	.	H	α-helix	trans	-67	-40.3	173.3	174.9	0	0	0	0	110.1	Y56 L60 E90 E96 L97 H98 Y264 V267	Y56-V94 HydrophobicContact CE1-CG1 4.25Å; L60-V94 HydrophobicContact CD1-CB 3.96Å; L60-V94 HydrophobicContact CD1-CG1 3.58Å; E90-V94 HydrophobicContact CG-CG2 4.24Å; E90-V94 WeakPolarHBondContact O-CG2 3.17Å; E90-V94 PolarHBondContact O-N 3.42Å; V94-E96 PolarHBondContact O-N 3.42Å; V94-L97 PolarHBondContact O-N 2.94Å; V94-H98 PolarHBondContact O-CD2 2.84Å; V94-H98 VanDerWaalsContact O-CD2 3.28Å; V94-H98 PolarHBondContact O-N 3.24Å; V94-Y264 HydrophobicContact CG2-CE2 4.43Å; V94-V267 HydrophobicContact CG2-CG1 4.22Å
95	S	98.8	Very high	98.7	Very high	6 Å²	6	35.7 Å²	35.7	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-55.7	-48.4	171.9	177.2	0	0	0	0	112	G57 T61 A91 D92 L97 H98 Q99	G57-S95 WeakPolarHBondContact CA-OG 3.33Å; G57-S95 WeakPolarHBondContact O-CB 3.22Å; G57-S95 PolarHBondContact O-OG 3.25Å; T61-S95 VanDerWaalsContact OG1-CB 3.3Å; T61-S95 WeakPolarHBondContact OG1-CB 3.5Å; T61-S95 PolarHBondContact OG1-OG 2.83Å; A91-S95 WeakPolarHBondContact O-CB 3.27Å; A91-S95 PolarHBondContact O-N 3.29Å; D92-S95 WeakPolarHBondContact O-CB 3.41Å; D92-S95 PolarHBondContact O-N 2.82Å; S95-L97 VanDerWaalsContact C-N 3.34Å; S95-L97 PolarHBondContact O-N 2.91Å; S95-H98 PolarHBondContact O-N 2.93Å; S95-H98 VanDerWaalsContact O-N 3.17Å; S95-Q99 WeakPolarHBondContact O-CG 3.42Å; S95-Q99 PolarHBondContact O-N 2.84Å
96	E	98.6	Very high	98.7	Very high	138 Å²	138	36.6 Å²	36.6	65%	0.645	19%	0.185	S	C	*	.	H	α-helix	trans	-56.2	-45.8	176.8	-72.6	174.4	175.5	0	0	112.1	D92 K93 V94 H98 Q99 E100	D92-E96 WeakPolarHBondContact O-CG 3.26Å; D92-E96 PolarHBondContact O-N 2.8Å; K93-E96 PolarHBondContact O-N 3.49Å; V94-E96 PolarHBondContact O-N 3.42Å; E96-H98 PolarHBondContact O-N 3.09Å; E96-Q99 PolarHBondContact O-N 2.88Å; E96-E100 PolarHBondContact O-N 3.3Å
97	L	98.6	Very high	98.7	Very high	11 Å²	11	41.2 Å²	41.2	6%	0.058	21%	0.207	C	C	.	.	H	α-helix	trans	-61.7	-42	176.4	-69	170	0	0	0	112.2	K93 V94 S95 Q99 E100 V101 L258 Y264 V267	K93-L97 WeakPolarHBondContact O-CG 3.43Å; K93-L97 PolarHBondContact O-N 2.82Å; K93-L97 VanDerWaalsContact O-N 3.14Å; V94-L97 PolarHBondContact O-N 2.94Å; S95-L97 VanDerWaalsContact C-N 3.34Å; S95-L97 PolarHBondContact O-N 2.91Å; L97-Q99 PolarHBondContact O-N 2.67Å; L97-E100 WeakPolarHBondContact O-CB 3.43Å; L97-E100 PolarHBondContact O-N 3.37Å; L97-E100 VanDerWaalsContact O-N 3.17Å; L97-V101 WeakPolarHBondContact O-CG2 3.46Å; L97-V101 PolarHBondContact O-N 3.29Å; L97-L258 HydrophobicContact CB-CD1 4.5Å; L97-L258 HydrophobicContact CB-CD2 4.21Å; L97-Y264 HydrophobicContact CD1-CD2 3.85Å; L97-Y264 HydrophobicContact CD1-CG 4.45Å; L97-V267 HydrophobicContact CD1-CG2 4.38Å
98	H	98.8	Very high	98.7	Very high	27 Å²	27	42.9 Å²	42.9	13%	0.125	21%	0.214	C	C	.	.	H	α-helix	trans	-69.1	-30.3	175.4	-80.1	-90.3	0	0	0	113.1	E53 Y56 V94 S95 E96 K102	E53-H98 IonicContact OE2-CE1 3.53Å; E53-H98 PolarHBondContact OE2-CE1 3.19Å; E53-H98 IonicContact OE2-CG 3.53Å; E53-H98 IonicContact OE2-ND1 3.59Å; E53-H98 PolarHBondContact OE2-ND1 2.84Å; Y56-H98 HydrophobicContact CD1-CB 4.49Å; Y56-H98 AromaticContact CD1-CD2 3.73Å; Y56-H98 AromaticContact CD1-CE1 3.69Å; Y56-H98 AromaticContact CD1-CG 3.75Å; Y56-H98 AromaticContact CD1-ND1 3.72Å; Y56-H98 AromaticContact CD1-NE2 3.7Å; Y56-H98 AromaticContact CE1-CD2 3.7Å; Y56-H98 AromaticContact CE1-CE1 3.85Å; Y56-H98 AromaticContact CE1-NE2 3.46Å; Y56-H98 WeakPolarHBondContact CE1-NE2 3.44Å; V94-H98 PolarHBondContact O-CD2 2.84Å; V94-H98 VanDerWaalsContact O-CD2 3.28Å; V94-H98 PolarHBondContact O-N 3.24Å; S95-H98 PolarHBondContact O-N 2.93Å; S95-H98 VanDerWaalsContact O-N 3.17Å; E96-H98 PolarHBondContact O-N 3.09Å; H98-K102 WeakPolarHBondContact O-CB 3.31Å; H98-K102 PolarHBondContact O-N 3.23Å
99	Q	98.6	Very high	98.7	Very high	47 Å²	47	42.9 Å²	42.9	22%	0.22	21%	0.214	C	C	.	.	H	α-helix	trans	-67.4	-35.6	168.6	-62.7	-55.4	-36.7	0	0	111.9	K54 S95 E96 L97 K102 N103	K54-Q99 PolarHBondContact O-NE2 2.93Å; S95-Q99 WeakPolarHBondContact O-CG 3.42Å; S95-Q99 PolarHBondContact O-N 2.84Å; E96-Q99 PolarHBondContact O-N 2.88Å; L97-Q99 PolarHBondContact O-N 2.67Å; Q99-K102 PolarHBondContact O-N 2.92Å; Q99-N103 WeakPolarHBondContact O-CB 3.29Å; Q99-N103 PolarHBondContact O-N 3.41Å; Q99-N103 PolarHBondContact O-ND2 3.44Å; Q99-N103 VanDerWaalsContact O-ND2 3.13Å
100	E	98.4	Very high	98.7	Very high	94 Å²	94	40.9 Å²	40.9	44%	0.439	20%	0.2	S	C	.	.	H	α-helix	trans	-63	-49.2	173.2	-167.7	-176.5	177.5	0	0	111.2	E96 L97 K102 N103 N104	E96-E100 PolarHBondContact O-N 3.3Å; L97-E100 WeakPolarHBondContact O-CB 3.43Å; L97-E100 PolarHBondContact O-N 3.37Å; L97-E100 VanDerWaalsContact O-N 3.17Å; E100-K102 VanDerWaalsContact C-N 3.31Å; E100-K102 PolarHBondContact O-N 3.35Å; E100-N103 WeakPolarHBondContact O-CA 3.44Å; E100-N103 WeakPolarHBondContact O-CB 3.33Å; E100-N103 PolarHBondContact O-N 3.04Å; E100-N104 VanDerWaalsContact O-CG 3.29Å; E100-N104 PolarHBondContact O-N 2.92Å; E100-N104 PolarHBondContact O-OD1 2.87Å
101	V	98.8	Very high	98.7	Very high	5 Å²	5	42.2 Å²	42.2	3%	0.03	21%	0.207	C	C	.	.	H	α-helix	trans	-52.1	-51.1	172.9	177.4	0	0	0	0	110.5	E53 L97 N103 N104 L105 H255 L256 L258	E53-V101 HydrophobicContact CG-CG1 3.99Å; L97-V101 WeakPolarHBondContact O-CG2 3.46Å; L97-V101 PolarHBondContact O-N 3.29Å; V101-N103 VanDerWaalsContact C-N 3.28Å; V101-N103 PolarHBondContact O-N 2.68Å; V101-N104 PolarHBondContact O-N 2.98Å; V101-L105 HydrophobicContact CG1-CD1 4.07Å; V101-L105 HydrophobicContact CG1-CG 4.4Å; V101-L105 VanDerWaalsContact O-CG 3.28Å; V101-L105 WeakPolarHBondContact O-CG 3.25Å; V101-L105 PolarHBondContact O-N 3.49Å; V101-H255 WeakPolarHBondContact CG2-O 3.43Å; V101-L256 HydrophobicContact CG1-CD2 3.7Å; V101-L258 HydrophobicContact CG2-CD1 4.41Å; V101-L258 HydrophobicContact CG2-CD2 3.79Å; V101-L258 HydrophobicContact CG2-CG 4.13Å
102	K	98.8	Very high	98.7	Very high	39 Å²	39	45.9 Å²	45.9	17%	0.17	22%	0.223	C	C	.	.	H	α-helix	trans	-59.3	-35.2	176.6	168.3	-94.8	147.2	-168.9	0	113.1	A50 E53 K54 H98 Q99 E100 L106	A50-K102 HydrophobicContact CB-CG 4.17Å; A50-K102 VanDerWaalsContact O-CG 3.31Å; A50-K102 WeakPolarHBondContact O-CG 3.43Å; E53-K102 HydrophobicContact CB-CB 3.94Å; K54-K102 HydrophobicContact CB-CG 4.16Å; H98-K102 WeakPolarHBondContact O-CB 3.31Å; H98-K102 PolarHBondContact O-N 3.23Å; Q99-K102 PolarHBondContact O-N 2.92Å; E100-K102 VanDerWaalsContact C-N 3.31Å; E100-K102 PolarHBondContact O-N 3.35Å; K102-L106 VanDerWaalsContact CE-CD1 3.49Å; K102-L106 WeakPolarHBondContact O-CG 3.25Å; K102-L106 PolarHBondContact O-N 2.99Å
103	N	98.7	Very high	98.7	Very high	59 Å²	59	44.2 Å²	44.2	32%	0.316	21%	0.214	S	C	.	.	H	α-helix	trans	-72.2	-42.8	178.4	-73.7	-29.3	0	0	0	111.1	Q99 E100 V101 L106 N107	Q99-N103 WeakPolarHBondContact O-CB 3.29Å; Q99-N103 PolarHBondContact O-N 3.41Å; Q99-N103 PolarHBondContact O-ND2 3.44Å; Q99-N103 VanDerWaalsContact O-ND2 3.13Å; E100-N103 WeakPolarHBondContact O-CA 3.44Å; E100-N103 WeakPolarHBondContact O-CB 3.33Å; E100-N103 PolarHBondContact O-N 3.04Å; V101-N103 VanDerWaalsContact C-N 3.28Å; V101-N103 PolarHBondContact O-N 2.68Å; N103-L106 PolarHBondContact O-N 3.39Å; N103-N107 WeakPolarHBondContact O-CB 3.42Å; N103-N107 VanDerWaalsContact O-CG 3.23Å; N103-N107 PolarHBondContact O-N 2.94Å; N103-N107 PolarHBondContact O-ND2 2.99Å
104	N	98.8	Very high	98.7	Very high	34 Å²	34	45.8 Å²	45.8	18%	0.182	22%	0.22	C	C	.	.	H	α-helix	trans	-67.5	-43.3	-179.5	-60	-9.5	0	0	0	110.7	E100 V101 L106 E108 D109 H255	E100-N104 VanDerWaalsContact O-CG 3.29Å; E100-N104 PolarHBondContact O-N 2.92Å; E100-N104 PolarHBondContact O-OD1 2.87Å; V101-N104 PolarHBondContact O-N 2.98Å; N104-L106 VanDerWaalsContact C-N 3.32Å; N104-L106 PolarHBondContact O-N 3.1Å; N104-E108 WeakPolarHBondContact O-CA 3.44Å; N104-E108 VanDerWaalsContact O-CB 3.31Å; N104-E108 WeakPolarHBondContact O-CB 3.16Å; N104-E108 PolarHBondContact O-N 2.89Å; N104-D109 PolarHBondContact O-N 2.85Å; N104-D109 VanDerWaalsContact O-N 3.1Å; N104-H255 HydrophobicContact CB-CB 4.07Å
105	L	98.9	Very high	98.7	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	24%	0.24	C	C	.	.	I	π-helix	trans	-55.2	-42.4	173.6	-71.9	174.6	0	0	0	113.1	V46 R49 A50 E53 V101 L110 I252 L256	V46-L105 HydrophobicContact CG1-CB 3.96Å; V46-L105 HydrophobicContact CG1-CD2 4.26Å; V46-L105 VanDerWaalsContact CG1-O 3.23Å; V46-L105 WeakPolarHBondContact CG1-O 3.46Å; R49-L105 HydrophobicContact CG-CD1 4.01Å; A50-L105 HydrophobicContact CB-CB 4.2Å; A50-L105 HydrophobicContact CB-CD1 4.15Å; E53-L105 HydrophobicContact CG-CD1 4.29Å; V101-L105 HydrophobicContact CG1-CD1 4.07Å; V101-L105 HydrophobicContact CG1-CG 4.4Å; V101-L105 VanDerWaalsContact O-CG 3.28Å; V101-L105 WeakPolarHBondContact O-CG 3.25Å; V101-L105 PolarHBondContact O-N 3.49Å; L105-L110 WeakPolarHBondContact O-CB 3.43Å; L105-L110 PolarHBondContact O-N 3.05Å; L105-I252 HydrophobicContact CD2-CG1 4.35Å; L105-I252 HydrophobicContact CD2-CG2 4.04Å; L105-L256 HydrophobicContact CD1-CD2 3.89Å; L105-L256 HydrophobicContact CD2-CD2 4.09Å; L105-L256 HydrophobicContact CD2-CG 4.36Å; L105-L256 HydrophobicContact CG-CD2 4.38Å
106	L	98.7	Very high	98.7	Very high	40 Å²	40	51.6 Å²	51.6	21%	0.209	25%	0.247	C	C	.	.	I	π-helix	trans	-86	-44.7	-177.3	-65.9	-172.2	0	0	0	113.5	Q47 A50 K102 N103 N104 L110	Q47-L106 HydrophobicContact CB-CD2 4.34Å; Q47-L106 HydrophobicContact CG-CD2 4.17Å; A50-L106 HydrophobicContact CB-CD1 4.27Å; A50-L106 HydrophobicContact CB-CD2 3.64Å; A50-L106 HydrophobicContact CB-CG 3.74Å; K102-L106 VanDerWaalsContact CE-CD1 3.49Å; K102-L106 WeakPolarHBondContact O-CG 3.25Å; K102-L106 PolarHBondContact O-N 2.99Å; N103-L106 PolarHBondContact O-N 3.39Å; N104-L106 VanDerWaalsContact C-N 3.32Å; N104-L106 PolarHBondContact O-N 3.1Å; L106-L110 HydrophobicContact CD2-CD1 3.87Å
107	N	98.6	Very high	98.7	Very high	110 Å²	110	46 Å²	46	59%	0.588	22%	0.221	S	C	*	.	I	π-helix	trans	-88.5	-23.7	-169.6	-56.5	-22.1	0	0	0	112.4	N103	N103-N107 WeakPolarHBondContact O-CB 3.42Å; N103-N107 VanDerWaalsContact O-CG 3.23Å; N103-N107 PolarHBondContact O-N 2.94Å; N103-N107 PolarHBondContact O-ND2 2.99Å
108	E	98.5	Very high	98.7	Very high	97 Å²	97	52.2 Å²	52.2	45%	0.453	25%	0.247	S	C	.	.	I	π-helix	trans	-105.9	-67.6	175	-56.4	-170.6	-157.3	0	0	110.7	N104 K112 H255	N104-E108 WeakPolarHBondContact O-CA 3.44Å; N104-E108 VanDerWaalsContact O-CB 3.31Å; N104-E108 WeakPolarHBondContact O-CB 3.16Å; N104-E108 PolarHBondContact O-N 2.89Å; E108-K112 WeakPolarHBondContact O-CB 3.39Å; E108-K112 PolarHBondContact O-N 3.24Å; E108-H255 IonicContact OE2-CE1 3.35Å; E108-H255 IonicContact OE2-NE2 3.98Å
109	D	98.8	Very high	98.7	Very high	2 Å²	2	56.3 Å²	56.3	1%	0.011	27%	0.27	C	S	.	.	I	π-helix	trans	-66.4	-49.2	-167.5	-58.6	-39.4	0	0	0	112.7	N104 K112 V113 D251 I252 H255	N104-D109 PolarHBondContact O-N 2.85Å; N104-D109 VanDerWaalsContact O-N 3.1Å; D109-K112 PolarHBondContact O-N 3.06Å; D109-V113 WeakPolarHBondContact O-CG2 3.49Å; D109-V113 PolarHBondContact O-N 3.03Å; D109-V113 VanDerWaalsContact O-N 3.11Å; D109-D251 WeakPolarHBondContact OD1-CB 3.22Å; D109-I252 HydrophobicContact CB-CD1 4.41Å; D109-I252 HydrophobicContact CB-CG1 3.79Å; D109-H255 VanDerWaalsContact CG-ND1 3.29Å; D109-H255 IonicContact OD1-CE1 3.96Å; D109-H255 PolarHBondContact OD1-CE1 2.91Å; D109-H255 VanDerWaalsContact OD1-CE1 3.26Å; D109-H255 IonicContact OD1-ND1 2.63Å; D109-H255 PolarHBondContact OD1-ND1 3.18Å; D109-H255 VanDerWaalsContact OD1-ND1 3.09Å; D109-H255 IonicContact OD2-CE1 2.88Å; D109-H255 IonicContact OD2-CG 2.76Å; D109-H255 IonicContact OD2-ND1 2.73Å; D109-H255 PolarHBondContact OD2-ND1 3Å
110	L	98.8	Very high	98.7	Very high	20 Å²	20	54.8 Å²	54.8	11%	0.105	27%	0.266	C	S	.	.	I	π-helix	trans	-66.1	-48.1	178.7	-175.6	159.9	0	0	0	111.7	M43 V46 Q47 L105 L106 K112 V113 K114	M43-L110 HydrophobicContact CB-CD1 4.4Å; M43-L110 HydrophobicContact CB-CG 4.08Å; M43-L110 HydrophobicContact CG-CG 4.04Å; M43-L110 WeakPolarHBondContact O-CD1 3.5Å; M43-L110 HydrophobicContact SD-CD2 4.38Å; V46-L110 HydrophobicContact CG1-CB 4.16Å; Q47-L110 HydrophobicContact CB-CD1 3.95Å; Q47-L110 HydrophobicContact CG-CD1 4.5Å; L105-L110 WeakPolarHBondContact O-CB 3.43Å; L105-L110 PolarHBondContact O-N 3.05Å; L106-L110 HydrophobicContact CD2-CD1 3.87Å; L110-K112 VanDerWaalsContact C-N 3.27Å; L110-K112 PolarHBondContact O-N 2.86Å; L110-V113 PolarHBondContact O-N 2.85Å; L110-K114 HydrophobicContact CD2-CD 4.32Å; L110-K114 WeakPolarHBondContact O-CB 3.43Å; L110-K114 PolarHBondContact O-N 2.77Å
111	E	98.7	Very high	98.7	Very high	62 Å²	62	50.8 Å²	50.8	29%	0.29	25%	0.247	S	C	.	.	H	α-helix	trans	-64.7	-31.2	177.5	-69.6	-63.5	133.2	0	0	112	K114 N115	E111-K114 PolarHBondContact O-N 3.27Å; E111-K114 WeakPolarHBondContact OE1-CD 3.48Å; E111-K114 IonicContact OE1-NZ 2.8Å; E111-K114 PolarHBondContact OE1-NZ 3.3Å; E111-K114 IonicContact OE2-NZ 3.43Å; E111-K114 PolarHBondContact OE2-NZ 3.05Å; E111-N115 VanDerWaalsContact O-CB 3.31Å; E111-N115 WeakPolarHBondContact O-CB 3.39Å; E111-N115 PolarHBondContact O-N 2.91Å; E111-N115 PolarHBondContact O-ND2 3.02Å
112	K	98.8	Very high	98.7	Very high	78 Å²	78	54.8 Å²	54.8	34%	0.339	27%	0.265	S	S	.	.	H	α-helix	trans	-61.7	-46.7	171.5	-179.7	174.1	174.7	-179.7	0	111.2	E108 D109 L110 W116 F244 V248 D251	E108-K112 WeakPolarHBondContact O-CB 3.39Å; E108-K112 PolarHBondContact O-N 3.24Å; D109-K112 PolarHBondContact O-N 3.06Å; L110-K112 VanDerWaalsContact C-N 3.27Å; L110-K112 PolarHBondContact O-N 2.86Å; K112-W116 WeakPolarHBondContact O-CB 3.44Å; K112-W116 PolarHBondContact O-N 2.87Å; K112-F244 HydrophobicContact CG-CE2 3.93Å; K112-F244 HydrophobicContact CG-CZ 4.06Å; K112-V248 HydrophobicContact CD-CG2 4.1Å; K112-V248 HydrophobicContact CG-CG2 4.24Å; K112-D251 IonicContact NZ-OD2 3.52Å; K112-D251 PolarHBondContact NZ-OD2 3.13Å
113	V	98.9	Very high	98.5	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-62.5	-44.9	174.2	178.1	0	0	0	0	111.7	C39 L42 M43 D109 L110 W116 Q117 F244 V248	C39-V113 HydrophobicContact CB-CG1 3.93Å; L42-V113 HydrophobicContact CD2-CG2 4Å; M43-V113 HydrophobicContact CG-CB 3.86Å; M43-V113 HydrophobicContact CG-CG1 3.61Å; M43-V113 HydrophobicContact SD-CB 4.33Å; M43-V113 HydrophobicContact SD-CG1 4.1Å; D109-V113 WeakPolarHBondContact O-CG2 3.49Å; D109-V113 PolarHBondContact O-N 3.03Å; D109-V113 VanDerWaalsContact O-N 3.11Å; L110-V113 PolarHBondContact O-N 2.85Å; V113-W116 PolarHBondContact O-N 3.39Å; V113-Q117 VanDerWaalsContact O-CB 3.3Å; V113-Q117 WeakPolarHBondContact O-CB 3.5Å; V113-Q117 PolarHBondContact O-N 3.17Å; V113-F244 HydrophobicContact CB-CE1 4.49Å; V113-F244 HydrophobicContact CG2-CE1 4.21Å; V113-F244 HydrophobicContact CG2-CZ 4.33Å; V113-V248 HydrophobicContact CG2-CB 4.38Å; V113-V248 HydrophobicContact CG2-CG1 3.7Å; V113-V248 HydrophobicContact CG2-CG2 4.05Å
114	K	98.8	Very high	98.3	Very high	88 Å²	88	61.2 Å²	61.2	38%	0.383	29%	0.291	S	S	.	.	H	α-helix	trans	-62.5	-43.9	-179	-174.1	175.5	158.3	-145.5	0	112.8	M43 L110 E111 K118	M43-K114 HydrophobicContact SD-CB 3.56Å; M43-K114 VanDerWaalsContact SD-CB 3.56Å; M43-K114 HydrophobicContact SD-CG 4.17Å; L110-K114 HydrophobicContact CD2-CD 4.32Å; L110-K114 WeakPolarHBondContact O-CB 3.43Å; L110-K114 PolarHBondContact O-N 2.77Å; E111-K114 PolarHBondContact O-N 3.27Å; E111-K114 WeakPolarHBondContact OE1-CD 3.48Å; E111-K114 IonicContact OE1-NZ 2.8Å; E111-K114 PolarHBondContact OE1-NZ 3.3Å; E111-K114 IonicContact OE2-NZ 3.43Å; E111-K114 PolarHBondContact OE2-NZ 3.05Å; K114-K118 WeakPolarHBondContact O-CB 3.38Å; K114-K118 PolarHBondContact O-N 3.15Å
115	N	98.8	Very high	97.9	Very high	79 Å²	79	68.3 Å²	68.3	42%	0.422	33%	0.327	S	S	.	.	H	α-helix	trans	-67.5	-46.6	176.7	-71.8	-40.6	0	0	0	110.8	E111 Q117 K118 D119	E111-N115 VanDerWaalsContact O-CB 3.31Å; E111-N115 WeakPolarHBondContact O-CB 3.39Å; E111-N115 PolarHBondContact O-N 2.91Å; E111-N115 PolarHBondContact O-ND2 3.02Å; N115-Q117 PolarHBondContact O-N 2.9Å; N115-K118 WeakPolarHBondContact O-CB 3.48Å; N115-K118 PolarHBondContact O-N 3.38Å; N115-D119 PolarHBondContact O-N 3.36Å
116	W	98.8	Very high	97.4	Very high	52 Å²	52	77 Å²	77	20%	0.197	37%	0.37	C	S	.	.	H	α-helix	trans	-59.7	-44.1	175.8	-176.3	93.6	0	0	0	112.4	K112 V113 K118 D119 A120 Y121 K240 R241 F244	K112-W116 WeakPolarHBondContact O-CB 3.44Å; K112-W116 PolarHBondContact O-N 2.87Å; V113-W116 PolarHBondContact O-N 3.39Å; W116-K118 VanDerWaalsContact C-N 3.34Å; W116-K118 PolarHBondContact O-N 2.71Å; W116-D119 PolarHBondContact O-N 3.22Å; W116-A120 HydrophobicContact CD2-CB 4.3Å; W116-A120 HydrophobicContact CE3-CB 4.19Å; W116-A120 HydrophobicContact CH2-CB 3.84Å; W116-A120 HydrophobicContact CZ2-CB 4.02Å; W116-A120 HydrophobicContact CZ3-CB 3.97Å; W116-A120 WeakPolarHBondContact O-CB 3.37Å; W116-A120 PolarHBondContact O-N 3.16Å; W116-Y121 HydrophobicContact CH2-CE2 4.3Å; W116-Y121 AromaticContact CZ3-CE2 3.88Å; W116-Y121 HydrophobicContact CZ3-CE2 3.88Å; W116-K240 HydrophobicContact CZ2-CB 4.5Å; W116-R241 HydrophobicContact CH2-CB 3.61Å; W116-R241 HydrophobicContact CH2-CG 3.63Å; W116-R241 HydrophobicContact CZ2-CB 4.18Å; W116-R241 HydrophobicContact CZ3-CB 4.41Å; W116-R241 HydrophobicContact CZ3-CG 3.93Å; W116-F244 HydrophobicContact CB-CD1 4.19Å; W116-F244 HydrophobicContact CB-CD2 4.34Å; W116-F244 HydrophobicContact CB-CE1 3.58Å; W116-F244 HydrophobicContact CB-CE2 3.73Å; W116-F244 HydrophobicContact CB-CZ 3.32Å; W116-F244 AromaticContact CD1-CD1 3.98Å; W116-F244 AromaticContact CD1-CD2 3.55Å; W116-F244 AromaticContact CD1-CE2 3.78Å; W116-F244 AromaticContact CD1-CG 3.66Å; W116-F244 AromaticContact CD2-CD1 3.42Å; W116-F244 HydrophobicContact CD2-CD1 3.42Å; W116-F244 VanDerWaalsContact CD2-CD1 3.42Å; W116-F244 HydrophobicContact CD2-CD2 4.41Å; W116-F244 AromaticContact CD2-CE1 3.67Å; W116-F244 HydrophobicContact CD2-CE1 3.67Å; W116-F244 AromaticContact CD2-CG 3.85Å; W116-F244 HydrophobicContact CD2-CG 3.85Å; W116-F244 HydrophobicContact CD2-CZ 4.26Å; W116-F244 AromaticContact CE2-CD1 3.84Å; W116-F244 AromaticContact CE2-CG 3.87Å; W116-F244 AromaticContact CE3-CD1 3.73Å; W116-F244 HydrophobicContact CE3-CD1 3.73Å; W116-F244 AromaticContact CE3-CE1 3.86Å; W116-F244 HydrophobicContact CE3-CE1 3.86Å; W116-F244 AromaticContact CG-CD1 3.6Å; W116-F244 HydrophobicContact CG-CD1 3.6Å; W116-F244 AromaticContact CG-CD2 3.85Å; W116-F244 HydrophobicContact CG-CD2 3.85Å; W116-F244 AromaticContact CG-CE1 3.52Å; W116-F244 HydrophobicContact CG-CE1 3.52Å; W116-F244 AromaticContact CG-CE2 3.75Å; W116-F244 HydrophobicContact CG-CE2 3.75Å; W116-F244 AromaticContact CG-CG 3.77Å; W116-F244 HydrophobicContact CG-CG 3.77Å; W116-F244 AromaticContact CG-CZ 3.6Å; W116-F244 HydrophobicContact CG-CZ 3.6Å; W116-F244 HydrophobicContact CZ2-CB 4.47Å; W116-F244 HydrophobicContact CZ3-CD1 4.42Å; W116-F244 AromaticContact NE1-CD2 3.97Å; W116-F244 AromaticContact NE1-CG 3.68Å
117	Q	98.7	Very high	97	Very high	19 Å²	19	77.4 Å²	77.4	9%	0.089	38%	0.384	C	S	.	.	H	α-helix	trans	-60.6	-43.6	177	-176.8	-163.1	57.7	0	0	111.2	H36 C39 N40 V113 N115 D119 A120 Y121	H36-Q117 PolarHBondContact CE1-NE2 3.35Å; H36-Q117 PolarHBondContact O-NE2 3.32Å; C39-Q117 HydrophobicContact CB-CB 4.15Å; C39-Q117 HydrophobicContact CB-CG 4Å; N40-Q117 PolarHBondContact OD1-NE2 3.16Å; V113-Q117 VanDerWaalsContact O-CB 3.3Å; V113-Q117 WeakPolarHBondContact O-CB 3.5Å; V113-Q117 PolarHBondContact O-N 3.17Å; N115-Q117 PolarHBondContact O-N 2.9Å; Q117-D119 VanDerWaalsContact C-N 3.33Å; Q117-D119 PolarHBondContact O-N 3.1Å; Q117-A120 PolarHBondContact O-N 3.14Å; Q117-Y121 HydrophobicContact CG-CD2 3.98Å; Q117-Y121 WeakPolarHBondContact O-CB 3.35Å; Q117-Y121 WeakPolarHBondContact O-CD2 3.45Å; Q117-Y121 PolarHBondContact O-N 2.93Å
118	K	98.3	Very high	96.8	Very high	142 Å²	142	74.5 Å²	74.5	62%	0.617	38%	0.38	S	S	*	.	H	α-helix	trans	-63.1	-38.2	177.9	179.9	-170.9	169.1	-159.9	0	112.6	K114 N115 W116	K114-K118 WeakPolarHBondContact O-CB 3.38Å; K114-K118 PolarHBondContact O-N 3.15Å; N115-K118 WeakPolarHBondContact O-CB 3.48Å; N115-K118 PolarHBondContact O-N 3.38Å; W116-K118 VanDerWaalsContact C-N 3.34Å; W116-K118 PolarHBondContact O-N 2.71Å
119	D	98.4	Very high	96.8	Very high	113 Å²	113	71 Å²	71	60%	0.604	36%	0.363	S	S	*	.	H	α-helix	trans	-82.2	-22.4	-179.3	-65.1	-14.6	0	0	0	112.6	N115 W116 Q117 H122	N115-D119 PolarHBondContact O-N 3.36Å; W116-D119 PolarHBondContact O-N 3.22Å; Q117-D119 VanDerWaalsContact C-N 3.33Å; Q117-D119 PolarHBondContact O-N 3.1Å; D119-H122 PolarHBondContact O-CE1 2.83Å
120	A	98.3	Very high	96.8	Very high	16 Å²	16	74.9 Å²	74.9	13%	0.132	38%	0.38	C	S	.	.	H	α-helix	trans	-88.8	-27.3	178	0	0	0	0	0	114.2	W116 Q117 F237	W116-A120 HydrophobicContact CD2-CB 4.3Å; W116-A120 HydrophobicContact CE3-CB 4.19Å; W116-A120 HydrophobicContact CH2-CB 3.84Å; W116-A120 HydrophobicContact CZ2-CB 4.02Å; W116-A120 HydrophobicContact CZ3-CB 3.97Å; W116-A120 WeakPolarHBondContact O-CB 3.37Å; W116-A120 PolarHBondContact O-N 3.16Å; Q117-A120 PolarHBondContact O-N 3.14Å; A120-F237 HydrophobicContact CB-CZ 4.49Å
121	Y	98.5	Very high	96.8	Very high	9 Å²	9	75.1 Å²	75.1	4%	0.035	38%	0.381	C	S	.	.			trans	-128.8	109.7	-170.3	-65.6	-78.3	0	0	0	113.2	I32 G35 H36 W116 Q117 F129 F237	I32-Y121 HydrophobicContact CG2-CD1 4.48Å; I32-Y121 HydrophobicContact CG2-CE1 3.94Å; I32-Y121 WeakPolarHBondContact O-CE1 3.48Å; I32-Y121 PolarHBondContact O-OH 3.34Å; G35-Y121 WeakPolarHBondContact CA-OH 3.17Å; H36-Y121 HydrophobicContact CB-CD1 3.87Å; H36-Y121 HydrophobicContact CB-CD2 3.9Å; H36-Y121 HydrophobicContact CB-CE1 3.86Å; H36-Y121 HydrophobicContact CB-CE2 3.9Å; H36-Y121 HydrophobicContact CB-CG 3.88Å; H36-Y121 AromaticContact CD2-CD2 3.91Å; H36-Y121 AromaticContact CD2-CG 3.8Å; H36-Y121 PolarHBondContact N-OH 2.84Å; W116-Y121 HydrophobicContact CH2-CE2 4.3Å; W116-Y121 AromaticContact CZ3-CE2 3.88Å; W116-Y121 HydrophobicContact CZ3-CE2 3.88Å; Q117-Y121 HydrophobicContact CG-CD2 3.98Å; Q117-Y121 WeakPolarHBondContact O-CB 3.35Å; Q117-Y121 WeakPolarHBondContact O-CD2 3.45Å; Q117-Y121 PolarHBondContact O-N 2.93Å; Y121-F129 HydrophobicContact CD1-CG 4.38Å; Y121-F237 HydrophobicContact CD1-CE1 4.46Å; Y121-F237 HydrophobicContact CD1-CZ 4.09Å; Y121-F237 AromaticContact CE1-CE1 3.6Å; Y121-F237 HydrophobicContact CE1-CE1 3.6Å; Y121-F237 AromaticContact CE1-CZ 3.62Å; Y121-F237 HydrophobicContact CE1-CZ 3.62Å; Y121-F237 AromaticContact CZ-CE1 3.8Å; Y121-F237 AromaticContact CZ-CZ 3.86Å
122	H	98.5	Very high	96.8	Very high	90 Å²	90	72.9 Å²	72.9	42%	0.417	37%	0.371	S	S	.	.			trans	-102.4	106.5	-173.8	-59.1	87.8	0	0	0	111.6	D119 F129 K130 E131	D119-H122 PolarHBondContact O-CE1 2.83Å; H122-F129 CarbonylContact O-C 3.5Å; H122-F129 WeakPolarHBondContact O-CA 3.06Å; H122-K130 HydrophobicContact CB-CB 4.03Å; H122-K130 HydrophobicContact CB-CD 4.41Å; H122-K130 WeakPolarHBondContact O-CB 3.34Å; H122-K130 PolarHBondContact O-N 3.22Å; H122-E131 IonicContact CE1-OE1 2.91Å; H122-E131 IonicContact CG-OE1 3.65Å; H122-E131 PolarHBondContact N-OE2 3.43Å; H122-E131 IonicContact ND1-OE1 3.21Å; H122-E131 PolarHBondContact ND1-OE1 2.99Å; H122-E131 IonicContact ND1-OE2 2.74Å
123	K	96.3	Very high	96.7	Very high	165 Å²	165	74 Å²	74	72%	0.717	38%	0.376	S	S	*	.	B	Isolated β-bridge	trans	-61.7	135.8	177.7	-69.4	-176.1	178.8	178.8	0	112.1	F129	K123-F129 HydrophobicContact CG-CD1 3.98Å; K123-F129 HydrophobicContact CG-CE1 3.62Å
124	Q	94.8	Very high	96.7	Very high	68 Å²	68	79.2 Å²	79.2	32%	0.318	40%	0.4	S	S	.	.			trans	-95	155.6	175.5	-58.4	-158.2	-27.6	0	0	112.7	M126 G127 G128 K130	Q124-M126 PolarHBondContact O-N 3.42Å; Q124-G127 PolarHBondContact O-N 2.88Å; Q124-G127 VanDerWaalsContact O-N 3.07Å; Q124-G128 PolarHBondContact N-O 3.27Å; Q124-K130 HydrophobicContact CG-CB 4.24Å
125	I	90.3	Very high	96.7	Very high	182 Å²	182	75.4 Å²	75.4	93%	0.933	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-34.8	179.4	-61.6	173.9	0	0	0	112.2	G127	I125-G127 VanDerWaalsContact C-N 3.33Å
126	M	87.9	Confident	96.7	Very high	185 Å²	185	74.5 Å²	74.5	91%	0.911	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	20.3	180	-61	-140.5	-79	0	0	113.5	Q124	Q124-M126 PolarHBondContact O-N 3.42Å
127	G	90.3	Very high	96.7	Very high	48 Å²	48	75.6 Å²	75.6	50%	0.495	39%	0.388	S	S	.	.	S	Bend	trans	83.4	166.1	-176.2	0	0	0	0	0	113.6	Q124 I125	Q124-G127 PolarHBondContact O-N 2.88Å; Q124-G127 VanDerWaalsContact O-N 3.07Å; I125-G127 VanDerWaalsContact C-N 3.33Å
128	G	94.7	Very high	96.6	Very high	49 Å²	49	75.7 Å²	75.7	51%	0.505	39%	0.394	S	S	.	.	S	Bend	trans	73.4	178.9	-173.9	0	0	0	0	0	114.1	Q124	Q124-G128 PolarHBondContact N-O 3.27Å
129	F	98.1	Very high	96.7	Very high	24 Å²	24	68.9 Å²	68.9	11%	0.105	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-101.9	150.8	176.1	-57.5	-75	0	0	0	111.7	D33 H36 Y121 H122 K123 E131 K133	D33-F129 WeakPolarHBondContact OD1-CD2 3.36Å; H36-F129 HydrophobicContact CB-CE2 3.92Å; H36-F129 HydrophobicContact CB-CZ 3.97Å; H36-F129 AromaticContact CD2-CE1 3.44Å; H36-F129 VanDerWaalsContact CD2-CE1 3.44Å; H36-F129 WeakPolarHBondContact CD2-CE1 3.37Å; H36-F129 AromaticContact CD2-CZ 3.24Å; H36-F129 WeakPolarHBondContact CD2-CZ 3.47Å; H36-F129 AromaticContact CE1-CZ 3.69Å; H36-F129 AromaticContact CG-CE2 3.8Å; H36-F129 AromaticContact CG-CZ 3.34Å; H36-F129 AromaticContact ND1-CZ 3.61Å; H36-F129 AromaticContact NE2-CE1 3.67Å; H36-F129 AromaticContact NE2-CZ 3.46Å; H36-F129 WeakPolarHBondContact NE2-CZ 2.88Å; Y121-F129 HydrophobicContact CD1-CG 4.38Å; H122-F129 CarbonylContact O-C 3.5Å; H122-F129 WeakPolarHBondContact O-CA 3.06Å; K123-F129 HydrophobicContact CG-CD1 3.98Å; K123-F129 HydrophobicContact CG-CE1 3.62Å; F129-E131 VanDerWaalsContact C-N 3.3Å; F129-E131 PolarHBondContact O-N 3.44Å; F129-K133 PolarHBondContact O-N 3.45Å
130	K	98.2	Very high	96.7	Very high	83 Å²	83	71 Å²	71	36%	0.361	36%	0.364	S	S	.	.	H	α-helix	trans	-60.1	-44	176.4	178.2	-165.3	161.2	-158.8	0	111	H122 Q124 K133 E134	H122-K130 HydrophobicContact CB-CB 4.03Å; H122-K130 HydrophobicContact CB-CD 4.41Å; H122-K130 WeakPolarHBondContact O-CB 3.34Å; H122-K130 PolarHBondContact O-N 3.22Å; Q124-K130 HydrophobicContact CG-CB 4.24Å; K130-K133 PolarHBondContact O-N 2.91Å; K130-E134 VanDerWaalsContact CE-CD 3.42Å; K130-E134 WeakPolarHBondContact CE-OE1 3.35Å; K130-E134 WeakPolarHBondContact CE-OE2 3.19Å; K130-E134 HydrophobicContact CG-CG 4.42Å; K130-E134 IonicContact NZ-OE1 3.56Å; K130-E134 WeakPolarHBondContact O-CG 3.39Å; K130-E134 PolarHBondContact O-N 2.96Å
131	E	98.4	Very high	96.7	Very high	25 Å²	25	78.4 Å²	78.4	12%	0.117	39%	0.393	C	S	.	.	H	α-helix	trans	-62.5	-45.3	-177.2	-64.2	65.4	-141.4	0	0	110.8	I32 H122 F129 K133 E134 A135 F237	I32-E131 HydrophobicContact CG2-CB 4.02Å; H122-E131 IonicContact CE1-OE1 2.91Å; H122-E131 IonicContact CG-OE1 3.65Å; H122-E131 PolarHBondContact N-OE2 3.43Å; H122-E131 IonicContact ND1-OE1 3.21Å; H122-E131 PolarHBondContact ND1-OE1 2.99Å; H122-E131 IonicContact ND1-OE2 2.74Å; F129-E131 VanDerWaalsContact C-N 3.3Å; F129-E131 PolarHBondContact O-N 3.44Å; E131-K133 VanDerWaalsContact C-N 3.34Å; E131-K133 PolarHBondContact O-N 3.44Å; E131-E134 PolarHBondContact O-N 3.22Å; E131-A135 PolarHBondContact O-N 3.17Å; E131-F237 HydrophobicContact CB-CZ 4.44Å; E131-F237 HydrophobicContact CG-CE2 4.1Å; E131-F237 HydrophobicContact CG-CZ 4.23Å
132	T	98.4	Very high	96.7	Very high	15 Å²	15	78.4 Å²	78.4	9%	0.092	40%	0.395	C	S	.	.	H	α-helix	trans	-59.5	-43.8	174.5	-48.8	0	0	0	0	111.5	V29 I32 D33 A135 E136	V29-T132 HydrophobicContact CG1-CG2 3.55Å; I32-T132 WeakPolarHBondContact CG2-OG1 3.06Å; D33-T132 WeakPolarHBondContact OD1-CB 3.07Å; D33-T132 WeakPolarHBondContact OD1-CG2 3.27Å; D33-T132 PolarHBondContact OD1-OG1 3.03Å; D33-T132 WeakPolarHBondContact OD2-CG2 3.41Å; T132-A135 PolarHBondContact O-N 2.66Å; T132-E136 PolarHBondContact O-N 2.95Å
133	K	98	Very high	96.7	Very high	100 Å²	100	74.4 Å²	74.4	44%	0.435	38%	0.376	S	S	.	.	H	α-helix	trans	-68.2	-41	178.7	-177.6	173.7	179.8	175.3	0	112.7	F129 K130 E131 A135 E136 D137	F129-K133 PolarHBondContact O-N 3.45Å; K130-K133 PolarHBondContact O-N 2.91Å; E131-K133 VanDerWaalsContact C-N 3.34Å; E131-K133 PolarHBondContact O-N 3.44Å; K133-A135 VanDerWaalsContact C-N 3.29Å; K133-A135 PolarHBondContact O-N 3.49Å; K133-E136 PolarHBondContact O-N 3.42Å; K133-D137 WeakPolarHBondContact CE-OD2 3.48Å; K133-D137 WeakPolarHBondContact O-CB 3.27Å; K133-D137 PolarHBondContact O-N 3.15Å
134	E	98.3	Very high	96.7	Very high	112 Å²	112	74 Å²	74	52%	0.523	38%	0.375	S	S	.	.	H	α-helix	trans	-62.6	-38.1	177.4	-75.2	177.5	164.2	0	0	111.3	K130 E131 G138	K130-E134 VanDerWaalsContact CE-CD 3.42Å; K130-E134 WeakPolarHBondContact CE-OE1 3.35Å; K130-E134 WeakPolarHBondContact CE-OE2 3.19Å; K130-E134 HydrophobicContact CG-CG 4.42Å; K130-E134 IonicContact NZ-OE1 3.56Å; K130-E134 WeakPolarHBondContact O-CG 3.39Å; K130-E134 PolarHBondContact O-N 2.96Å; E131-E134 PolarHBondContact O-N 3.22Å; E134-G138 PolarHBondContact O-N 3.21Å
135	A	98.5	Very high	96.9	Very high	8 Å²	8	74.7 Å²	74.7	7%	0.066	39%	0.385	C	S	.	.	H	α-helix	trans	-66.1	-47.8	172.1	0	0	0	0	0	113	V29 I32 E131 T132 K133 G138 F139	V29-A135 HydrophobicContact CG2-CB 4.24Å; I32-A135 HydrophobicContact CD1-CB 3.5Å; E131-A135 PolarHBondContact O-N 3.17Å; T132-A135 PolarHBondContact O-N 2.66Å; K133-A135 VanDerWaalsContact C-N 3.29Å; K133-A135 PolarHBondContact O-N 3.49Å; A135-G138 PolarHBondContact O-N 3.45Å; A135-F139 VanDerWaalsContact O-CD2 3.24Å; A135-F139 WeakPolarHBondContact O-CD2 3.44Å; A135-F139 PolarHBondContact O-N 2.89Å
136	E	98.4	Very high	97.2	Very high	59 Å²	59	67.2 Å²	67.2	28%	0.276	35%	0.345	S	S	.	.	H	α-helix	trans	-59.7	-49.6	177.6	-179.2	69.6	-166.9	0	0	111.8	Y25 V29 T132 K133 G138 F139 R140	Y25-E136 WeakPolarHBondContact CE2-OE2 3.47Å; V29-E136 HydrophobicContact CG1-CB 4.16Å; T132-E136 PolarHBondContact O-N 2.95Å; K133-E136 PolarHBondContact O-N 3.42Å; E136-G138 VanDerWaalsContact C-N 3.29Å; E136-G138 PolarHBondContact O-N 3.36Å; E136-F139 PolarHBondContact O-N 2.76Å; E136-R140 WeakPolarHBondContact O-CB 3.46Å; E136-R140 PolarHBondContact O-N 3.36Å
137	D	98.4	Very high	97.6	Very high	76 Å²	76	59.5 Å²	59.5	41%	0.406	31%	0.311	S	S	.	.	H	α-helix	trans	-65.3	-33.5	177.6	-81.8	-34.9	0	0	0	111.4	K133 K141	K133-D137 WeakPolarHBondContact CE-OD2 3.48Å; K133-D137 WeakPolarHBondContact O-CB 3.27Å; K133-D137 PolarHBondContact O-N 3.15Å; D137-K141 WeakPolarHBondContact O-CB 3.13Å; D137-K141 PolarHBondContact O-N 2.86Å
138	G	98.6	Very high	98	Very high	20 Å²	20	63.8 Å²	63.8	21%	0.206	32%	0.316	C	S	.	.	H	α-helix	trans	-61	-58.2	172.5	0	0	0	0	0	112.9	E134 A135 E136 R140 K141 A142	E134-G138 PolarHBondContact O-N 3.21Å; A135-G138 PolarHBondContact O-N 3.45Å; E136-G138 VanDerWaalsContact C-N 3.29Å; E136-G138 PolarHBondContact O-N 3.36Å; G138-R140 VanDerWaalsContact C-N 3.34Å; G138-R140 PolarHBondContact O-N 3.09Å; G138-K141 WeakPolarHBondContact O-CB 3.48Å; G138-K141 PolarHBondContact O-N 3.36Å; G138-K141 VanDerWaalsContact O-N 3.17Å; G138-A142 PolarHBondContact O-N 2.86Å
139	F	98.8	Very high	98	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-41.9	178.2	-76	-59.5	0	0	0	112	F19 Y25 T28 V29 A135 E136 K141 A142 Q143 M227 V230 F231	F19-F139 HydrophobicContact CE2-CE1 4.1Å; F19-F139 HydrophobicContact CE2-CZ 4.37Å; F19-F139 AromaticContact CZ-CE1 3.86Å; F19-F139 HydrophobicContact CZ-CE1 3.86Å; F19-F139 HydrophobicContact CZ-CZ 4.49Å; Y25-F139 HydrophobicContact CD1-CB 3.84Å; Y25-F139 HydrophobicContact CD1-CG 4.34Å; Y25-F139 HydrophobicContact CD2-CB 3.37Å; Y25-F139 AromaticContact CD2-CD2 3.65Å; Y25-F139 HydrophobicContact CD2-CD2 3.65Å; Y25-F139 AromaticContact CD2-CG 3.65Å; Y25-F139 HydrophobicContact CD2-CG 3.65Å; Y25-F139 HydrophobicContact CE1-CB 3.96Å; Y25-F139 HydrophobicContact CE2-CB 3.54Å; Y25-F139 HydrophobicContact CE2-CD2 4.44Å; Y25-F139 HydrophobicContact CE2-CG 4.31Å; Y25-F139 HydrophobicContact CG-CB 3.54Å; Y25-F139 HydrophobicContact CG-CD1 4.17Å; Y25-F139 HydrophobicContact CG-CD2 4.01Å; Y25-F139 AromaticContact CG-CG 3.67Å; Y25-F139 HydrophobicContact CG-CG 3.67Å; T28-F139 HydrophobicContact CG2-CE2 4.16Å; T28-F139 HydrophobicContact CG2-CZ 4.07Å; V29-F139 HydrophobicContact CG2-CD2 3.63Å; V29-F139 HydrophobicContact CG2-CE2 3.9Å; A135-F139 VanDerWaalsContact O-CD2 3.24Å; A135-F139 WeakPolarHBondContact O-CD2 3.44Å; A135-F139 PolarHBondContact O-N 2.89Å; E136-F139 PolarHBondContact O-N 2.76Å; F139-K141 VanDerWaalsContact C-N 3.29Å; F139-K141 PolarHBondContact O-N 3.2Å; F139-A142 PolarHBondContact O-N 3.11Å; F139-Q143 WeakPolarHBondContact O-CB 3.29Å; F139-Q143 PolarHBondContact O-N 3Å; F139-M227 HydrophobicContact CD1-CE 3.73Å; F139-M227 HydrophobicContact CD1-SD 3.86Å; F139-M227 HydrophobicContact CE1-CE 4.29Å; F139-V230 HydrophobicContact CD1-CB 3.9Å; F139-V230 HydrophobicContact CD1-CG1 3.76Å; F139-V230 HydrophobicContact CD2-CG1 3.83Å; F139-V230 HydrophobicContact CE1-CB 3.81Å; F139-V230 HydrophobicContact CE1-CG1 3.76Å; F139-V230 HydrophobicContact CE2-CG1 3.84Å; F139-V230 HydrophobicContact CG-CB 4.41Å; F139-V230 HydrophobicContact CG-CG1 3.8Å; F139-V230 HydrophobicContact CZ-CB 4.26Å; F139-V230 HydrophobicContact CZ-CG1 3.81Å; F139-F231 HydrophobicContact CE1-CB 4.12Å; F139-F231 HydrophobicContact CZ-CB 4.14Å; F139-F231 HydrophobicContact CZ-CD2 4.47Å
140	R	98.4	Very high	98	Very high	157 Å²	157	64.7 Å²	64.7	59%	0.592	31%	0.307	S	S	*	.	H	α-helix	trans	-60.4	-38.8	176	-174.2	-178.7	-178.6	-158.9	4.7	111.8	E136 G138 K144	E136-R140 WeakPolarHBondContact O-CB 3.46Å; E136-R140 PolarHBondContact O-N 3.36Å; G138-R140 VanDerWaalsContact C-N 3.34Å; G138-R140 PolarHBondContact O-N 3.09Å; R140-K144 WeakPolarHBondContact O-CB 3.48Å; R140-K144 PolarHBondContact O-N 3.19Å; R140-K144 VanDerWaalsContact O-N 3.15Å
141	K	98.6	Very high	97.9	Very high	172 Å²	172	68.7 Å²	68.7	75%	0.748	33%	0.325	S	S	*	.	H	α-helix	trans	-67.3	-44	175	-177.9	-174.6	174.9	-167.7	0	111.6	D137 G138 F139	D137-K141 WeakPolarHBondContact O-CB 3.13Å; D137-K141 PolarHBondContact O-N 2.86Å; G138-K141 WeakPolarHBondContact O-CB 3.48Å; G138-K141 PolarHBondContact O-N 3.36Å; G138-K141 VanDerWaalsContact O-N 3.17Å; F139-K141 VanDerWaalsContact C-N 3.29Å; F139-K141 PolarHBondContact O-N 3.2Å
142	A	98.4	Very high	97.9	Very high	8 Å²	8	70.7 Å²	70.7	7%	0.066	33%	0.334	C	S	.	.	H	α-helix	trans	-63.4	-46.2	178.3	0	0	0	0	0	112.9	G138 F139 P145 N226 M227	G138-A142 PolarHBondContact O-N 2.86Å; F139-A142 PolarHBondContact O-N 3.11Å; A142-P145 WeakPolarHBondContact O-CD 3.13Å; A142-N226 HydrophobicContact CB-CB 3.67Å; A142-M227 HydrophobicContact CB-CG 4.25Å; A142-M227 HydrophobicContact CB-SD 3.77Å
143	Q	98.4	Very high	97.8	Very high	7 Å²	7	70.5 Å²	70.5	3%	0.033	33%	0.332	C	S	.	.	H	α-helix	trans	-81.2	-26.7	-174.5	-169.4	172.1	78.4	0	0	114	E21 V22 Y25 F139 P145 W146 A147 Y223 M227	E21-Q143 PolarHBondContact O-NE2 2.92Å; V22-Q143 VanDerWaalsContact CA-OE1 3.31Å; Y25-Q143 VanDerWaalsContact CE1-OE1 3.31Å; F139-Q143 WeakPolarHBondContact O-CB 3.29Å; F139-Q143 PolarHBondContact O-N 3Å; Q143-P145 VanDerWaalsContact C-CD 3.49Å; Q143-W146 HydrophobicContact CG-CE3 4.48Å; Q143-W146 PolarHBondContact O-N 3.39Å; Q143-W146 VanDerWaalsContact O-N 3.16Å; Q143-A147 HydrophobicContact CG-CB 4.3Å; Q143-A147 WeakPolarHBondContact O-CB 3.44Å; Q143-A147 PolarHBondContact O-N 3.26Å; Q143-Y223 HydrophobicContact CB-CE2 3.85Å; Q143-Y223 HydrophobicContact CG-CE2 3.62Å; Q143-Y223 PolarHBondContact NE2-OH 3.42Å; Q143-M227 HydrophobicContact CB-SD 3.91Å
144	K	97.8	Very high	97.7	Very high	157 Å²	157	68.1 Å²	68.1	68%	0.683	32%	0.323	S	S	*	.	H	α-helix	trans	-52.2	-42.6	-173.5	176.1	179.4	-177.4	-176	0	115.6	R140 K148	R140-K144 WeakPolarHBondContact O-CB 3.48Å; R140-K144 PolarHBondContact O-N 3.19Å; R140-K144 VanDerWaalsContact O-N 3.15Å; K144-K148 PolarHBondContact O-N 3.08Å
145	P	97.2	Very high	97.7	Very high	81 Å²	81	65.8 Å²	65.8	53%	0.526	32%	0.323	S	S	.	.	H	α-helix	trans	-64.6	-44.7	178.5	-20.9	33.9	0	0	0	112.3	A142 Q143 K148 K149	A142-P145 WeakPolarHBondContact O-CD 3.13Å; Q143-P145 VanDerWaalsContact C-CD 3.49Å; P145-K148 PolarHBondContact O-N 3.43Å; P145-K149 PolarHBondContact O-N 3.07Å
146	W	98	Very high	97.7	Very high	25 Å²	25	65.5 Å²	65.5	10%	0.095	32%	0.32	C	S	.	.	H	α-helix	trans	-70.8	-44.1	-179	-176.2	84.9	0	0	0	112	V22 Q143 K148 K149 M150 T220 Y223	V22-W146 HydrophobicContact CG2-CE3 4.4Å; V22-W146 HydrophobicContact CG2-CZ3 3.89Å; Q143-W146 HydrophobicContact CG-CE3 4.48Å; Q143-W146 PolarHBondContact O-N 3.39Å; Q143-W146 VanDerWaalsContact O-N 3.16Å; W146-K148 PolarHBondContact O-N 3.4Å; W146-K149 CarbonylContact O-C 3.53Å; W146-K149 WeakPolarHBondContact O-CA 3.22Å; W146-K149 WeakPolarHBondContact O-CB 3.15Å; W146-K149 PolarHBondContact O-N 3.19Å; W146-M150 HydrophobicContact CD2-CG 3.8Å; W146-M150 HydrophobicContact CE3-CG 3.87Å; W146-M150 HydrophobicContact CH2-CE 4.25Å; W146-M150 HydrophobicContact CH2-CG 3.67Å; W146-M150 HydrophobicContact CH2-SD 4.12Å; W146-M150 HydrophobicContact CZ2-CE 4.24Å; W146-M150 HydrophobicContact CZ2-CG 3.59Å; W146-M150 HydrophobicContact CZ2-SD 3.65Å; W146-M150 HydrophobicContact CZ3-CG 3.82Å; W146-M150 PolarHBondContact O-N 3.18Å; W146-T220 PolarHBondContact NE1-OG1 2.88Å; W146-Y223 HydrophobicContact CB-CD1 4.21Å; W146-Y223 HydrophobicContact CB-CD2 3.85Å; W146-Y223 HydrophobicContact CB-CE2 4.49Å; W146-Y223 HydrophobicContact CB-CG 3.68Å; W146-Y223 AromaticContact CD1-CD1 3.83Å; W146-Y223 AromaticContact CD2-CD1 3.62Å; W146-Y223 HydrophobicContact CD2-CD1 3.62Å; W146-Y223 HydrophobicContact CD2-CD2 4.43Å; W146-Y223 AromaticContact CD2-CE1 3.64Å; W146-Y223 HydrophobicContact CD2-CE1 3.64Å; W146-Y223 HydrophobicContact CD2-CE2 4.46Å; W146-Y223 HydrophobicContact CD2-CG 4.02Å; W146-Y223 AromaticContact CE2-CD1 3.84Å; W146-Y223 AromaticContact CE2-CE1 3.88Å; W146-Y223 HydrophobicContact CE3-CD1 4.12Å; W146-Y223 AromaticContact CE3-CE1 3.68Å; W146-Y223 HydrophobicContact CE3-CE1 3.68Å; W146-Y223 HydrophobicContact CE3-CE2 4.16Å; W146-Y223 AromaticContact CE3-CZ 3.7Å; W146-Y223 AromaticContact CG-CD1 3.64Å; W146-Y223 HydrophobicContact CG-CD1 3.64Å; W146-Y223 HydrophobicContact CG-CD2 4.15Å; W146-Y223 HydrophobicContact CG-CE1 4.15Å; W146-Y223 AromaticContact CG-CG 3.63Å; W146-Y223 HydrophobicContact CG-CG 3.63Å; W146-Y223 HydrophobicContact CH2-CE1 4.22Å; W146-Y223 HydrophobicContact CZ2-CE1 4.18Å; W146-Y223 AromaticContact CZ3-CE1 3.97Å; W146-Y223 HydrophobicContact CZ3-CE1 3.97Å; W146-Y223 AromaticContact NE1-CD1 3.92Å
147	A	96.7	Very high	97.7	Very high	24 Å²	24	64.8 Å²	64.8	20%	0.198	32%	0.316	C	S	.	.	H	α-helix	trans	-59.1	-33.8	174.5	0	0	0	0	0	112.7	V22 Q143 K151	V22-A147 HydrophobicContact CG1-CB 4Å; V22-A147 HydrophobicContact CG2-CB 3.98Å; Q143-A147 HydrophobicContact CG-CB 4.3Å; Q143-A147 WeakPolarHBondContact O-CB 3.44Å; Q143-A147 PolarHBondContact O-N 3.26Å; A147-K151 PolarHBondContact O-N 2.88Å; A147-K151 VanDerWaalsContact O-N 3.09Å
148	K	96.9	Very high	97.6	Very high	138 Å²	138	67 Å²	67	60%	0.6	32%	0.322	S	S	*	.	H	α-helix	trans	-64.4	-44.2	171.4	-174.1	-171.3	172.6	-162.8	0	111.3	K144 P145 W146 K151 E152	K144-K148 PolarHBondContact O-N 3.08Å; P145-K148 PolarHBondContact O-N 3.43Å; W146-K148 PolarHBondContact O-N 3.4Å; K148-K151 PolarHBondContact O-N 3.02Å; K148-E152 VanDerWaalsContact CE-OE1 3.25Å; K148-E152 WeakPolarHBondContact CE-OE1 3.31Å; K148-E152 IonicContact NZ-OE1 3.8Å; K148-E152 PolarHBondContact O-N 3.25Å
149	K	96.3	Very high	97.6	Very high	44 Å²	44	68 Å²	68	19%	0.191	33%	0.328	C	S	.	.	H	α-helix	trans	-67.3	-38.7	178.1	-80.5	-74.4	174.3	-168.2	0	112.9	P145 W146 K151 E152 L153 D215 V216	P145-K149 PolarHBondContact O-N 3.07Å; W146-K149 CarbonylContact O-C 3.53Å; W146-K149 WeakPolarHBondContact O-CA 3.22Å; W146-K149 WeakPolarHBondContact O-CB 3.15Å; W146-K149 PolarHBondContact O-N 3.19Å; K149-K151 VanDerWaalsContact C-N 3.31Å; K149-K151 PolarHBondContact O-N 3.46Å; K149-E152 WeakPolarHBondContact CD-OE2 3.31Å; K149-E152 WeakPolarHBondContact CE-OE2 3.47Å; K149-E152 IonicContact NZ-OE2 2.62Å; K149-E152 PolarHBondContact NZ-OE2 3.43Å; K149-E152 WeakPolarHBondContact O-CB 3.48Å; K149-E152 PolarHBondContact O-N 3.33Å; K149-E152 VanDerWaalsContact O-N 3.13Å; K149-L153 PolarHBondContact O-N 2.92Å; K149-D215 HydrophobicContact CD-CB 4.22Å; K149-D215 IonicContact NZ-OD2 3.16Å; K149-D215 PolarHBondContact NZ-OD2 3.44Å; K149-V216 HydrophobicContact CB-CG2 3.9Å
150	M	96.8	Very high	97.6	Very high	48 Å²	48	70.7 Å²	70.7	24%	0.236	34%	0.339	C	S	.	.	H	α-helix	trans	-61.1	-38.1	171	-70.4	-58.8	-70	0	0	112.4	W146 L153 E154 V216	W146-M150 HydrophobicContact CD2-CG 3.8Å; W146-M150 HydrophobicContact CE3-CG 3.87Å; W146-M150 HydrophobicContact CH2-CE 4.25Å; W146-M150 HydrophobicContact CH2-CG 3.67Å; W146-M150 HydrophobicContact CH2-SD 4.12Å; W146-M150 HydrophobicContact CZ2-CE 4.24Å; W146-M150 HydrophobicContact CZ2-CG 3.59Å; W146-M150 HydrophobicContact CZ2-SD 3.65Å; W146-M150 HydrophobicContact CZ3-CG 3.82Å; W146-M150 PolarHBondContact O-N 3.18Å; M150-L153 HydrophobicContact CE-CD2 4.33Å; M150-L153 WeakPolarHBondContact O-CB 3.38Å; M150-L153 PolarHBondContact O-N 3.21Å; M150-L153 HydrophobicContact SD-CD2 4.09Å; M150-E154 PolarHBondContact O-N 3.08Å; M150-V216 HydrophobicContact SD-CG1 3.8Å; M150-V216 HydrophobicContact SD-CG2 4.26Å
151	K	96.6	Very high	97.6	Very high	167 Å²	167	67.9 Å²	67.9	73%	0.726	33%	0.332	S	S	*	.	H	α-helix	trans	-66.6	-36.2	172.9	-171	176	-178	175.7	0	112.9	A147 K148 K149 L153 A155	A147-K151 PolarHBondContact O-N 2.88Å; A147-K151 VanDerWaalsContact O-N 3.09Å; K148-K151 PolarHBondContact O-N 3.02Å; K149-K151 VanDerWaalsContact C-N 3.31Å; K149-K151 PolarHBondContact O-N 3.46Å; K151-L153 VanDerWaalsContact C-N 3.35Å; K151-A155 WeakPolarHBondContact O-CB 3.23Å; K151-A155 PolarHBondContact O-N 3.1Å
152	E	97.4	Very high	97.5	Very high	66 Å²	66	64.3 Å²	64.3	31%	0.308	32%	0.321	S	S	.	.	H	α-helix	trans	-64.5	-39.9	171.4	-70.7	170.6	-161.8	0	0	111	K148 K149 A155 A156 V212	K148-E152 VanDerWaalsContact CE-OE1 3.25Å; K148-E152 WeakPolarHBondContact CE-OE1 3.31Å; K148-E152 IonicContact NZ-OE1 3.8Å; K148-E152 PolarHBondContact O-N 3.25Å; K149-E152 WeakPolarHBondContact CD-OE2 3.31Å; K149-E152 WeakPolarHBondContact CE-OE2 3.47Å; K149-E152 IonicContact NZ-OE2 2.62Å; K149-E152 PolarHBondContact NZ-OE2 3.43Å; K149-E152 WeakPolarHBondContact O-CB 3.48Å; K149-E152 PolarHBondContact O-N 3.33Å; K149-E152 VanDerWaalsContact O-N 3.13Å; E152-A155 PolarHBondContact O-N 3.03Å; E152-A156 PolarHBondContact O-N 3.01Å; E152-V212 HydrophobicContact CB-CG1 3.99Å
153	L	97.4	Very high	97.5	Very high	12 Å²	12	64.5 Å²	64.5	6%	0.063	32%	0.322	C	S	.	.	H	α-helix	trans	-64.3	-50.9	178.6	-174.3	68.7	0	0	0	111.9	K149 M150 K151 A155 A156 K157 Y209 V212 L213 V216	K149-L153 PolarHBondContact O-N 2.92Å; M150-L153 HydrophobicContact CE-CD2 4.33Å; M150-L153 WeakPolarHBondContact O-CB 3.38Å; M150-L153 PolarHBondContact O-N 3.21Å; M150-L153 HydrophobicContact SD-CD2 4.09Å; K151-L153 VanDerWaalsContact C-N 3.35Å; L153-A155 VanDerWaalsContact C-N 3.28Å; L153-A155 PolarHBondContact O-N 3.2Å; L153-A156 PolarHBondContact O-N 3.47Å; L153-K157 WeakPolarHBondContact O-CB 3.39Å; L153-K157 PolarHBondContact O-N 3.33Å; L153-Y209 HydrophobicContact CD1-CD2 3.81Å; L153-Y209 HydrophobicContact CD1-CE2 3.47Å; L153-Y209 VanDerWaalsContact CD1-CE2 3.47Å; L153-Y209 HydrophobicContact CG-CE2 4.04Å; L153-V212 HydrophobicContact CB-CG1 3.94Å; L153-V212 HydrophobicContact CD1-CB 4.34Å; L153-V212 HydrophobicContact CD1-CG1 4.03Å; L153-L213 HydrophobicContact CD1-CB 3.84Å; L153-L213 HydrophobicContact CD1-CD1 3.97Å; L153-L213 HydrophobicContact CD2-CD1 4Å; L153-V216 HydrophobicContact CB-CG2 4.16Å; L153-V216 HydrophobicContact CD2-CG2 4.24Å
154	E	96.5	Very high	97.5	Very high	50 Å²	50	65.9 Å²	65.9	23%	0.234	33%	0.332	C	S	.	.	H	α-helix	trans	-61.6	-35.2	178.2	-81.3	-57.5	134.8	0	0	112.7	M150 K157 K158	M150-E154 PolarHBondContact O-N 3.08Å; E154-K157 VanDerWaalsContact CD-NZ 3.35Å; E154-K157 WeakPolarHBondContact OE1-CD 3.48Å; E154-K157 IonicContact OE1-NZ 2.84Å; E154-K157 PolarHBondContact OE1-NZ 2.96Å; E154-K157 IonicContact OE2-NZ 3.76Å; E154-K157 PolarHBondContact OE2-NZ 2.61Å; E154-K158 WeakPolarHBondContact O-CB 3.36Å; E154-K158 WeakPolarHBondContact O-CD 3.47Å; E154-K158 VanDerWaalsContact O-CG 3.23Å; E154-K158 WeakPolarHBondContact O-CG 3.4Å; E154-K158 PolarHBondContact O-N 2.89Å; E154-K158 WeakPolarHBondContact OE2-CE 3.47Å; E154-K158 IonicContact OE2-NZ 2.82Å
155	A	97.8	Very high	97.4	Very high	63 Å²	63	65.3 Å²	65.3	52%	0.521	33%	0.33	S	S	.	.	H	α-helix	trans	-67	-37.8	173	0	0	0	0	0	112.3	K151 E152 L153 A159	K151-A155 WeakPolarHBondContact O-CB 3.23Å; K151-A155 PolarHBondContact O-N 3.1Å; E152-A155 PolarHBondContact O-N 3.03Å; L153-A155 VanDerWaalsContact C-N 3.28Å; L153-A155 PolarHBondContact O-N 3.2Å; A155-A159 WeakPolarHBondContact O-CB 3.42Å; A155-A159 PolarHBondContact O-N 3.43Å; A155-A159 VanDerWaalsContact O-N 3.13Å
156	A	98.1	Very high	97.4	Very high	2 Å²	2	66.4 Å²	66.4	2%	0.017	33%	0.328	C	S	.	.	H	α-helix	trans	-71.9	-44.1	177.1	0	0	0	0	0	112.4	E152 L153 K158 A159 Y160 Y209 V212	E152-A156 PolarHBondContact O-N 3.01Å; L153-A156 PolarHBondContact O-N 3.47Å; A156-K158 PolarHBondContact O-N 3.12Å; A156-A159 PolarHBondContact O-N 2.93Å; A156-Y160 PolarHBondContact O-N 2.91Å; A156-Y209 HydrophobicContact CB-CD2 4.06Å; A156-V212 HydrophobicContact CB-CG2 4.5Å
157	K	97.9	Very high	97.3	Very high	44 Å²	44	67 Å²	67	19%	0.191	33%	0.332	C	S	.	.	H	α-helix	trans	-52.8	-50.7	172.1	178.7	179.6	155.5	-156.3	0	111.2	E13 L153 E154 A159 Y160 H161 Y209	E13-K157 IonicContact OE1-NZ 3.26Å; E13-K157 PolarHBondContact OE1-NZ 3.44Å; L153-K157 WeakPolarHBondContact O-CB 3.39Å; L153-K157 PolarHBondContact O-N 3.33Å; E154-K157 VanDerWaalsContact CD-NZ 3.35Å; E154-K157 WeakPolarHBondContact OE1-CD 3.48Å; E154-K157 IonicContact OE1-NZ 2.84Å; E154-K157 PolarHBondContact OE1-NZ 2.96Å; E154-K157 IonicContact OE2-NZ 3.76Å; E154-K157 PolarHBondContact OE2-NZ 2.61Å; K157-A159 PolarHBondContact O-N 2.88Å; K157-Y160 PolarHBondContact O-N 3.26Å; K157-H161 WeakPolarHBondContact O-CB 3.45Å; K157-H161 PolarHBondContact O-CD2 2.85Å; K157-H161 VanDerWaalsContact O-CG 3.31Å; K157-H161 PolarHBondContact O-N 3.47Å; K157-Y209 HydrophobicContact CB-CD2 4.04Å; K157-Y209 HydrophobicContact CB-CE2 3.59Å; K157-Y209 HydrophobicContact CG-CE2 4.27Å
158	K	98	Very high	97.3	Very high	123 Å²	123	73.2 Å²	73.2	54%	0.535	35%	0.354	S	S	.	.	H	α-helix	trans	-64.1	-38.1	178.5	-71.9	171	-172.5	-179.4	0	112.6	E154 A156 L162	E154-K158 WeakPolarHBondContact O-CB 3.36Å; E154-K158 WeakPolarHBondContact O-CD 3.47Å; E154-K158 VanDerWaalsContact O-CG 3.23Å; E154-K158 WeakPolarHBondContact O-CG 3.4Å; E154-K158 PolarHBondContact O-N 2.89Å; E154-K158 WeakPolarHBondContact OE2-CE 3.47Å; E154-K158 IonicContact OE2-NZ 2.82Å; A156-K158 PolarHBondContact O-N 3.12Å; K158-L162 WeakPolarHBondContact O-CB 3.48Å; K158-L162 PolarHBondContact O-N 3.25Å
159	A	98	Very high	97.2	Very high	40 Å²	40	70 Å²	70	33%	0.331	34%	0.343	S	S	.	.	H	α-helix	trans	-66.5	-42.9	175.3	0	0	0	0	0	112.6	A155 A156 K157 L162 A163 T205	A155-A159 WeakPolarHBondContact O-CB 3.42Å; A155-A159 PolarHBondContact O-N 3.43Å; A155-A159 VanDerWaalsContact O-N 3.13Å; A156-A159 PolarHBondContact O-N 2.93Å; K157-A159 PolarHBondContact O-N 2.88Å; A159-L162 PolarHBondContact O-N 3.26Å; A159-A163 PolarHBondContact O-N 2.72Å; A159-T205 HydrophobicContact CB-CG2 4.37Å
160	Y	98.4	Very high	97.1	Very high	57 Å²	57	68.1 Å²	68.1	22%	0.224	34%	0.336	C	S	.	.	H	α-helix	trans	-63.5	-49.5	175.6	170.5	-115.8	0	0	0	111.9	A156 K157 L162 A163 C164 V202 Q206 Y209	A156-Y160 PolarHBondContact O-N 2.91Å; K157-Y160 PolarHBondContact O-N 3.26Å; Y160-L162 VanDerWaalsContact C-N 3.27Å; Y160-L162 PolarHBondContact O-N 3.47Å; Y160-A163 PolarHBondContact O-N 3.26Å; Y160-A163 VanDerWaalsContact O-N 3.1Å; Y160-C164 WeakPolarHBondContact CE2-SG 3.46Å; Y160-C164 PolarHBondContact O-N 2.89Å; Y160-C164 PolarHBondContact O-SG 2.95Å; Y160-C164 VanDerWaalsContact O-SG 3.38Å; Y160-V202 HydrophobicContact CE2-CG1 4.06Å; Y160-Q206 HydrophobicContact CD2-CB 3.82Å; Y160-Q206 HydrophobicContact CE2-CB 3.65Å; Y160-Q206 HydrophobicContact CE2-CG 4.03Å; Y160-Y209 HydrophobicContact CD1-CD1 4.18Å
161	H	97.8	Very high	97	Very high	97 Å²	97	69.4 Å²	69.4	45%	0.449	34%	0.342	S	S	.	.	H	α-helix	trans	-59	-37.2	176.6	-69	-175.8	0	0	0	112.6	K157 K165	K157-H161 WeakPolarHBondContact O-CB 3.45Å; K157-H161 PolarHBondContact O-CD2 2.85Å; K157-H161 VanDerWaalsContact O-CG 3.31Å; K157-H161 PolarHBondContact O-N 3.47Å; H161-K165 WeakPolarHBondContact O-CB 3.21Å; H161-K165 PolarHBondContact O-N 2.94Å; H161-K165 VanDerWaalsContact O-N 3.09Å
162	L	97.7	Very high	96.8	Very high	98 Å²	98	64 Å²	64	51%	0.513	32%	0.324	S	S	.	.	H	α-helix	trans	-66.2	-45.1	174.6	-178.9	60.7	0	0	0	111.6	K158 A159 Y160 C164 K165 E166	K158-L162 WeakPolarHBondContact O-CB 3.48Å; K158-L162 PolarHBondContact O-N 3.25Å; A159-L162 PolarHBondContact O-N 3.26Å; Y160-L162 VanDerWaalsContact C-N 3.27Å; Y160-L162 PolarHBondContact O-N 3.47Å; L162-C164 PolarHBondContact O-N 3.12Å; L162-K165 WeakPolarHBondContact O-CB 3.32Å; L162-K165 PolarHBondContact O-N 3.32Å; L162-K165 VanDerWaalsContact O-N 3.15Å; L162-E166 HydrophobicContact CD1-CG 4.41Å; L162-E166 PolarHBondContact O-N 3.16Å
163	A	97.7	Very high	96.5	Very high	11 Å²	11	68 Å²	68	9%	0.091	34%	0.336	C	S	.	.	H	α-helix	trans	-59.1	-44.9	176.9	0	0	0	0	0	111.6	A159 Y160 K165 E166 E167 V202 T205	A159-A163 PolarHBondContact O-N 2.72Å; Y160-A163 PolarHBondContact O-N 3.26Å; Y160-A163 VanDerWaalsContact O-N 3.1Å; A163-K165 VanDerWaalsContact C-N 3.31Å; A163-K165 PolarHBondContact O-N 3.49Å; A163-E166 PolarHBondContact O-N 2.83Å; A163-E167 WeakPolarHBondContact O-CB 3.34Å; A163-E167 PolarHBondContact O-N 3.48Å; A163-V202 HydrophobicContact CB-CB 4.47Å; A163-V202 HydrophobicContact CB-CG2 3.71Å; A163-V202 WeakPolarHBondContact O-CG2 3.31Å; A163-T205 HydrophobicContact CB-CG2 4.4Å; A163-T205 WeakPolarHBondContact CB-OG1 3.4Å
164	C	97.6	Very high	96.2	Very high	37 Å²	37	68.2 Å²	68.2	25%	0.25	34%	0.337	C	S	.	.	H	α-helix	trans	-62.2	-37.2	175.9	-64.4	0	0	0	0	112.5	Y160 L162 K168	Y160-C164 WeakPolarHBondContact CE2-SG 3.46Å; Y160-C164 PolarHBondContact O-N 2.89Å; Y160-C164 PolarHBondContact O-SG 2.95Å; Y160-C164 VanDerWaalsContact O-SG 3.38Å; L162-C164 PolarHBondContact O-N 3.12Å; C164-K168 WeakPolarHBondContact O-CB 3.24Å; C164-K168 PolarHBondContact O-N 2.86Å
165	K	97.5	Very high	95.8	Very high	145 Å²	145	72.3 Å²	72.3	63%	0.63	36%	0.357	S	S	*	.	H	α-helix	trans	-66.4	-41.9	174.8	-171.8	174.8	-177.7	173.5	0	111.4	H161 L162 A163 L169	H161-K165 WeakPolarHBondContact O-CB 3.21Å; H161-K165 PolarHBondContact O-N 2.94Å; H161-K165 VanDerWaalsContact O-N 3.09Å; L162-K165 WeakPolarHBondContact O-CB 3.32Å; L162-K165 PolarHBondContact O-N 3.32Å; L162-K165 VanDerWaalsContact O-N 3.15Å; A163-K165 VanDerWaalsContact C-N 3.31Å; A163-K165 PolarHBondContact O-N 3.49Å; K165-L169 HydrophobicContact CG-CD1 4.32Å; K165-L169 WeakPolarHBondContact O-CB 3.37Å; K165-L169 VanDerWaalsContact O-CG 3.25Å; K165-L169 WeakPolarHBondContact O-CG 3.31Å; K165-L169 PolarHBondContact O-N 3.45Å
166	E	96.6	Very high	95.4	Very high	103 Å²	103	73.3 Å²	73.3	48%	0.481	35%	0.354	S	S	.	.	H	α-helix	trans	-67.8	-40.2	176.8	-71.5	-167.8	170	0	0	112.8	L162 A163 L169 A170	L162-E166 HydrophobicContact CD1-CG 4.41Å; L162-E166 PolarHBondContact O-N 3.16Å; A163-E166 PolarHBondContact O-N 2.83Å; E166-L169 PolarHBondContact O-N 2.96Å; E166-A170 WeakPolarHBondContact O-CB 3.41Å; E166-A170 PolarHBondContact O-N 3.21Å
167	E	96.5	Very high	94.8	Very high	39 Å²	39	73.6 Å²	73.6	18%	0.182	36%	0.356	C	S	.	.	H	α-helix	trans	-58.6	-52	172.8	-175.3	-165.8	-164.9	0	0	111	A163 L169 A170 M171 C198 K199 V202	A163-E167 WeakPolarHBondContact O-CB 3.34Å; A163-E167 PolarHBondContact O-N 3.48Å; E167-L169 VanDerWaalsContact C-N 3.29Å; E167-L169 PolarHBondContact O-N 2.88Å; E167-A170 WeakPolarHBondContact O-CB 3.37Å; E167-A170 PolarHBondContact O-N 3.29Å; E167-M171 HydrophobicContact CG-CE 3.79Å; E167-M171 HydrophobicContact CG-CG 4.5Å; E167-M171 HydrophobicContact CG-SD 4.29Å; E167-M171 WeakPolarHBondContact O-CG 3.47Å; E167-M171 PolarHBondContact O-N 2.94Å; E167-M171 WeakPolarHBondContact OE1-CE 3.42Å; E167-C198 HydrophobicContact CB-CB 3.96Å; E167-C198 HydrophobicContact CG-CB 4.28Å; E167-K199 HydrophobicContact CG-CG 4.43Å; E167-K199 WeakPolarHBondContact OE1-CG 3.44Å; E167-V202 HydrophobicContact CB-CG2 3.9Å
168	K	96.1	Very high	94	Very high	154 Å²	154	77.8 Å²	77.8	67%	0.67	37%	0.374	S	S	*	.	H	α-helix	trans	-57.6	-42.4	177.9	-170.5	173.8	-177.9	177.9	0	111.6	C164 M171 T172	C164-K168 WeakPolarHBondContact O-CB 3.24Å; C164-K168 PolarHBondContact O-N 2.86Å; K168-M171 PolarHBondContact O-N 3.39Å; K168-T172 PolarHBondContact O-N 3.35Å; K168-T172 PolarHBondContact O-OG1 3.37Å
169	L	95.3	Very high	93.1	Very high	69 Å²	69	77.6 Å²	77.6	36%	0.361	38%	0.383	S	S	.	.	H	α-helix	trans	-66.6	-35	175.2	-72.6	169.7	0	0	0	113.3	K165 E166 E167 R173	K165-L169 HydrophobicContact CG-CD1 4.32Å; K165-L169 WeakPolarHBondContact O-CB 3.37Å; K165-L169 VanDerWaalsContact O-CG 3.25Å; K165-L169 WeakPolarHBondContact O-CG 3.31Å; K165-L169 PolarHBondContact O-N 3.45Å; E166-L169 PolarHBondContact O-N 2.96Å; E167-L169 VanDerWaalsContact C-N 3.29Å; E167-L169 PolarHBondContact O-N 2.88Å; L169-R173 WeakPolarHBondContact O-CB 3.46Å; L169-R173 VanDerWaalsContact O-CG 3.3Å; L169-R173 WeakPolarHBondContact O-CG 3.24Å; L169-R173 PolarHBondContact O-N 3.28Å
170	A	94.1	Very high	92	Very high	5 Å²	5	81.2 Å²	81.2	4%	0.041	39%	0.393	C	S	.	.	H	α-helix	trans	-68.7	-46.1	174.9	0	0	0	0	0	111.1	E166 E167 R173 E174 K194 V195 C198	E166-A170 WeakPolarHBondContact O-CB 3.41Å; E166-A170 PolarHBondContact O-N 3.21Å; E167-A170 WeakPolarHBondContact O-CB 3.37Å; E167-A170 PolarHBondContact O-N 3.29Å; A170-R173 PolarHBondContact O-N 3.26Å; A170-E174 WeakPolarHBondContact O-CB 3.44Å; A170-E174 PolarHBondContact O-N 3.47Å; A170-K194 HydrophobicContact CB-CG 4.47Å; A170-V195 HydrophobicContact CB-CG2 3.93Å; A170-C198 HydrophobicContact CB-CB 4.49Å
171	M	93.4	Very high	90.5	Very high	75 Å²	75	88.4 Å²	88.4	37%	0.369	43%	0.429	S	S	.	.	H	α-helix	trans	-59.7	-46.3	176.1	-72.1	-179.1	174	0	0	111.9	E167 K168 R173 E174 M175 V195 K199	E167-M171 HydrophobicContact CG-CE 3.79Å; E167-M171 HydrophobicContact CG-CG 4.5Å; E167-M171 HydrophobicContact CG-SD 4.29Å; E167-M171 WeakPolarHBondContact O-CG 3.47Å; E167-M171 PolarHBondContact O-N 2.94Å; E167-M171 WeakPolarHBondContact OE1-CE 3.42Å; K168-M171 PolarHBondContact O-N 3.39Å; M171-R173 VanDerWaalsContact C-N 3.31Å; M171-R173 PolarHBondContact O-N 3.2Å; M171-E174 PolarHBondContact O-N 3.2Å; M171-M175 WeakPolarHBondContact O-CB 3.42Å; M171-M175 PolarHBondContact O-N 3.06Å; M171-V195 HydrophobicContact CE-CG1 4.35Å; M171-V195 HydrophobicContact CG-CG1 3.93Å; M171-V195 HydrophobicContact CG-CG2 4.37Å; M171-K199 HydrophobicContact CE-CG 4.44Å
172	T	93.8	Very high	89.4	Confident	55 Å²	55	88.4 Å²	88.4	34%	0.337	44%	0.44	S	S	.	.	H	α-helix	trans	-61.8	-38.7	176.9	-56.9	0	0	0	0	111.9	K168 N176	K168-T172 PolarHBondContact O-N 3.35Å; K168-T172 PolarHBondContact O-OG1 3.37Å; T172-N176 WeakPolarHBondContact O-CB 3.41Å; T172-N176 PolarHBondContact O-N 3.29Å; T172-N176 PolarHBondContact O-OD1 2.9Å
173	R	90.6	Very high	88.3	Confident	149 Å²	149	85.5 Å²	85.5	56%	0.562	43%	0.426	S	S	*	.	H	α-helix	trans	-67.9	-40.5	176.6	-76.7	171	170.6	156.1	-4.7	112.8	L169 A170 M171 S177	L169-R173 WeakPolarHBondContact O-CB 3.46Å; L169-R173 VanDerWaalsContact O-CG 3.3Å; L169-R173 WeakPolarHBondContact O-CG 3.24Å; L169-R173 PolarHBondContact O-N 3.28Å; A170-R173 PolarHBondContact O-N 3.26Å; M171-R173 VanDerWaalsContact C-N 3.31Å; M171-R173 PolarHBondContact O-N 3.2Å; R173-S177 PolarHBondContact O-N 3.38Å; R173-S177 VanDerWaalsContact O-N 3.08Å
174	E	91.3	Very high	87.7	Confident	17 Å²	17	88 Å²	88	8%	0.079	44%	0.441	C	S	.	.	H	α-helix	trans	-66.6	-40.8	176.1	-164.4	-73.1	147	0	0	111.4	A170 M171 S177 K178 Q188 L191 V195	A170-E174 WeakPolarHBondContact O-CB 3.44Å; A170-E174 PolarHBondContact O-N 3.47Å; M171-E174 PolarHBondContact O-N 3.2Å; E174-S177 PolarHBondContact O-N 2.8Å; E174-S177 PolarHBondContact O-OG 3.14Å; E174-K178 PolarHBondContact O-N 3.07Å; E174-K178 WeakPolarHBondContact OE1-CE 3.48Å; E174-K178 IonicContact OE1-NZ 2.77Å; E174-K178 PolarHBondContact OE1-NZ 3.38Å; E174-K178 IonicContact OE2-NZ 2.67Å; E174-K178 PolarHBondContact OE2-NZ 3.4Å; E174-Q188 PolarHBondContact OE1-NE2 3.38Å; E174-L191 HydrophobicContact CB-CB 4.23Å; E174-L191 HydrophobicContact CG-CB 4Å; E174-V195 HydrophobicContact CB-CG2 3.82Å; E174-V195 HydrophobicContact CG-CG2 4.17Å
175	M	88.6	Confident	87	Confident	135 Å²	135	91.8 Å²	91.8	67%	0.665	46%	0.464	S	S	*	.	H	α-helix	trans	-64.8	-45	175.5	-174.1	174.5	-178	0	0	112.1	M171 S177 K178	M171-M175 WeakPolarHBondContact O-CB 3.42Å; M171-M175 PolarHBondContact O-N 3.06Å; M175-S177 VanDerWaalsContact C-N 3.32Å; M175-S177 PolarHBondContact O-N 3.19Å; M175-K178 WeakPolarHBondContact O-CB 3.44Å; M175-K178 PolarHBondContact O-N 3.05Å
176	N	88.7	Confident	86.5	Confident	84 Å²	84	92.8 Å²	92.8	45%	0.449	47%	0.471	S	S	.	.	H	α-helix	trans	-66.5	-33.7	179.1	-69	-3	0	0	0	112	T172 K178 T179	T172-N176 WeakPolarHBondContact O-CB 3.41Å; T172-N176 PolarHBondContact O-N 3.29Å; T172-N176 PolarHBondContact O-OD1 2.9Å; N176-K178 VanDerWaalsContact C-N 3.25Å; N176-K178 PolarHBondContact O-N 3Å; N176-T179 PolarHBondContact O-N 3.32Å; N176-T179 VanDerWaalsContact O-N 3.11Å; N176-T179 PolarHBondContact O-OG1 2.7Å
177	S	84.7	Confident	85.9	Confident	8 Å²	8	92.5 Å²	92.5	6%	0.056	47%	0.47	C	S	.	.	H	α-helix	trans	-64.7	-28.9	178.3	85.2	0	0	0	0	112.9	R173 E174 M175 T179 E180 Q188 L191	R173-S177 PolarHBondContact O-N 3.38Å; R173-S177 VanDerWaalsContact O-N 3.08Å; E174-S177 PolarHBondContact O-N 2.8Å; E174-S177 PolarHBondContact O-OG 3.14Å; M175-S177 VanDerWaalsContact C-N 3.32Å; M175-S177 PolarHBondContact O-N 3.19Å; S177-T179 PolarHBondContact O-N 3.04Å; S177-E180 PolarHBondContact O-N 3.42Å; S177-Q188 PolarHBondContact OG-NE2 2.87Å; S177-Q188 PolarHBondContact OG-OE1 2.76Å; S177-L191 VanDerWaalsContact CB-CD1 3.43Å; S177-L191 WeakPolarHBondContact OG-CD1 3.37Å
178	K	80.7	Confident	85.4	Confident	133 Å²	133	92.7 Å²	92.7	58%	0.578	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-19	175.2	-70.2	170.9	167.8	143.8	0	113.7	E174 M175 N176	E174-K178 PolarHBondContact O-N 3.07Å; E174-K178 WeakPolarHBondContact OE1-CE 3.48Å; E174-K178 IonicContact OE1-NZ 2.77Å; E174-K178 PolarHBondContact OE1-NZ 3.38Å; E174-K178 IonicContact OE2-NZ 2.67Å; E174-K178 PolarHBondContact OE2-NZ 3.4Å; M175-K178 WeakPolarHBondContact O-CB 3.44Å; M175-K178 PolarHBondContact O-N 3.05Å; N176-K178 VanDerWaalsContact C-N 3.25Å; N176-K178 PolarHBondContact O-N 3Å
179	T	79.1	Confident	85.1	Confident	118 Å²	118	91.9 Å²	91.9	72%	0.724	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-7.1	177.1	42.2	0	0	0	0	114	N176 S177	N176-T179 PolarHBondContact O-N 3.32Å; N176-T179 VanDerWaalsContact O-N 3.11Å; N176-T179 PolarHBondContact O-OG1 2.7Å; S177-T179 PolarHBondContact O-N 3.04Å
180	E	76.1	Confident	84.9	Confident	116 Å²	116	96.1 Å²	96.1	54%	0.542	48%	0.483	S	S	.	.			trans	-95.2	121.4	179.5	-72.6	-178.7	176.4	0	0	111.7	S177 S182 V183	S177-E180 PolarHBondContact O-N 3.42Å; E180-S182 PolarHBondContact O-N 3Å; E180-V183 HydrophobicContact CB-CG2 3.78Å
181	Q	67.3	Low	84.8	Confident	209 Å²	209	98.1 Å²	98.1	98%	0.977	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-3.1	-177.5	-65.4	-178.4	-3	0	0	114.7
182	S	74.3	Confident	84.7	Confident	97 Å²	97	97.7 Å²	97.7	68%	0.678	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-0.2	-174.7	52	0	0	0	0	115.2	E180	E180-S182 PolarHBondContact O-N 3Å
183	V	75.3	Confident	84.7	Confident	37 Å²	37	99.4 Å²	99.4	22%	0.224	50%	0.497	C	S	.	.			trans	-84.9	127.8	-174.6	-178.6	0	0	0	0	110.6	E180 Q187 Q188	E180-V183 HydrophobicContact CB-CG2 3.78Å; V183-Q187 HydrophobicContact CG1-CB 3.83Å; V183-Q188 HydrophobicContact CG1-CB 4.43Å
184	T	84.9	Confident	84.9	Confident	64 Å²	64	97.4 Å²	97.4	39%	0.393	49%	0.492	S	S	.	.			trans	-79.6	155.3	179.4	74.9	0	0	0	0	111.8	E186 Q187 Q188	T184-E186 PolarHBondContact O-N 2.87Å; T184-E186 VanDerWaalsContact O-N 3.11Å; T184-Q187 WeakPolarHBondContact O-CB 3.49Å; T184-Q187 PolarHBondContact O-N 3.15Å; T184-Q187 WeakPolarHBondContact OG1-CG 3.29Å; T184-Q187 PolarHBondContact OG1-N 3.46Å; T184-Q188 PolarHBondContact O-N 3.28Å
185	P	82.8	Confident	85.1	Confident	115 Å²	115	96.9 Å²	96.9	75%	0.747	49%	0.49	S	S	*	.	H	α-helix	trans	-55.5	-31.5	176.4	-27.2	35.6	0	0	0	113.8	K189	P185-K189 WeakPolarHBondContact O-CB 3.4Å; P185-K189 PolarHBondContact O-N 3.4Å
186	E	85.5	Confident	85.4	Confident	166 Å²	166	93 Å²	93	78%	0.776	47%	0.472	S	S	*	.	H	α-helix	trans	-76.6	-34	178.4	-166.1	163	-161.5	0	0	112.4	T184 K190	T184-E186 PolarHBondContact O-N 2.87Å; T184-E186 VanDerWaalsContact O-N 3.11Å; E186-K190 WeakPolarHBondContact O-CB 3.46Å; E186-K190 PolarHBondContact O-N 3.32Å
187	Q	85.1	Confident	85.8	Confident	98 Å²	98	95.1 Å²	95.1	46%	0.458	48%	0.477	S	S	.	.	H	α-helix	trans	-67.6	-42.5	169	-71.2	167.4	-13.3	0	0	111.5	V183 T184 K190 L191	V183-Q187 HydrophobicContact CG1-CB 3.83Å; T184-Q187 WeakPolarHBondContact O-CB 3.49Å; T184-Q187 PolarHBondContact O-N 3.15Å; T184-Q187 WeakPolarHBondContact OG1-CG 3.29Å; T184-Q187 PolarHBondContact OG1-N 3.46Å; Q187-K190 PolarHBondContact O-N 2.91Å; Q187-L191 WeakPolarHBondContact O-CG 3.22Å; Q187-L191 PolarHBondContact O-N 2.82Å
188	Q	85.6	Confident	86.4	Confident	43 Å²	43	95.2 Å²	95.2	20%	0.201	48%	0.478	C	S	.	.	H	α-helix	trans	-59.2	-47.6	175.3	-165.8	70.1	41	0	0	110.9	E174 S177 V183 T184 K190 L191 Q192	E174-Q188 PolarHBondContact OE1-NE2 3.38Å; S177-Q188 PolarHBondContact OG-NE2 2.87Å; S177-Q188 PolarHBondContact OG-OE1 2.76Å; V183-Q188 HydrophobicContact CG1-CB 4.43Å; T184-Q188 PolarHBondContact O-N 3.28Å; Q188-K190 PolarHBondContact O-N 3.13Å; Q188-L191 PolarHBondContact O-N 3.13Å; Q188-Q192 PolarHBondContact O-N 3.39Å
189	K	89.6	Confident	87.1	Confident	136 Å²	136	92.9 Å²	92.9	59%	0.591	47%	0.468	S	S	*	.	H	α-helix	trans	-58.5	-44.9	175.3	-174	179.4	177.1	-176.7	0	112	P185 L191 Q192 D193	P185-K189 WeakPolarHBondContact O-CB 3.4Å; P185-K189 PolarHBondContact O-N 3.4Å; K189-L191 VanDerWaalsContact C-N 3.27Å; K189-L191 PolarHBondContact O-N 3.43Å; K189-Q192 WeakPolarHBondContact O-CB 3.29Å; K189-Q192 PolarHBondContact O-N 2.88Å; K189-Q192 VanDerWaalsContact O-N 3.13Å; K189-D193 VanDerWaalsContact O-CG 3.24Å; K189-D193 PolarHBondContact O-N 2.84Å
190	K	92.1	Very high	88	Confident	158 Å²	158	93.7 Å²	93.7	69%	0.687	46%	0.463	S	S	*	.	H	α-helix	trans	-63.1	-30.4	178.2	-172.8	175.6	-177.3	175.7	0	113.5	E186 Q187 Q188 K194	E186-K190 WeakPolarHBondContact O-CB 3.46Å; E186-K190 PolarHBondContact O-N 3.32Å; Q187-K190 PolarHBondContact O-N 2.91Å; Q188-K190 PolarHBondContact O-N 3.13Å; K190-K194 WeakPolarHBondContact O-CB 3.34Å; K190-K194 PolarHBondContact O-N 3.48Å
191	L	91.1	Very high	89	Confident	48 Å²	48	91 Å²	91	25%	0.251	45%	0.453	S	S	.	.	H	α-helix	trans	-73.3	-41.5	172.6	-70.6	170.2	0	0	0	111.4	E174 S177 Q187 Q188 K189 K194 V195	E174-L191 HydrophobicContact CB-CB 4.23Å; E174-L191 HydrophobicContact CG-CB 4Å; S177-L191 VanDerWaalsContact CB-CD1 3.43Å; S177-L191 WeakPolarHBondContact OG-CD1 3.37Å; Q187-L191 WeakPolarHBondContact O-CG 3.22Å; Q187-L191 PolarHBondContact O-N 2.82Å; Q188-L191 PolarHBondContact O-N 3.13Å; K189-L191 VanDerWaalsContact C-N 3.27Å; K189-L191 PolarHBondContact O-N 3.43Å; L191-K194 WeakPolarHBondContact O-CB 3.32Å; L191-K194 PolarHBondContact O-N 3.47Å; L191-V195 PolarHBondContact O-N 3.39Å
192	Q	91.6	Very high	90.5	Very high	66 Å²	66	81.8 Å²	81.8	31%	0.308	41%	0.41	S	S	.	.	H	α-helix	trans	-61.6	-49.8	173.8	-175.9	59.5	53.7	0	0	111.9	Q188 K189 K194 V195 D196	Q188-Q192 PolarHBondContact O-N 3.39Å; K189-Q192 WeakPolarHBondContact O-CB 3.29Å; K189-Q192 PolarHBondContact O-N 2.88Å; K189-Q192 VanDerWaalsContact O-N 3.13Å; Q192-K194 PolarHBondContact O-N 3.14Å; Q192-K194 VanDerWaalsContact O-N 3.15Å; Q192-V195 WeakPolarHBondContact O-CB 3.42Å; Q192-V195 PolarHBondContact O-N 3Å; Q192-D196 VanDerWaalsContact NE2-CG 3.31Å; Q192-D196 PolarHBondContact NE2-OD1 3.27Å; Q192-D196 PolarHBondContact NE2-OD2 3.25Å; Q192-D196 PolarHBondContact O-N 2.97Å
193	D	94.2	Very high	91.6	Very high	90 Å²	90	82.5 Å²	82.5	48%	0.481	40%	0.403	S	S	.	.	H	α-helix	trans	-55.6	-34.3	175.7	-66.3	-23.4	0	0	0	111.4	K189 K197	K189-D193 VanDerWaalsContact O-CG 3.24Å; K189-D193 PolarHBondContact O-N 2.84Å; D193-K197 WeakPolarHBondContact O-CB 3.43Å; D193-K197 PolarHBondContact O-N 2.9Å
194	K	94.6	Very high	92.7	Very high	108 Å²	108	87.7 Å²	87.7	47%	0.47	42%	0.422	S	S	.	.	H	α-helix	trans	-72.5	-40.4	175.9	-176	170.3	-178.8	168.7	0	112.7	A170 K190 L191 Q192 K197 C198	A170-K194 HydrophobicContact CB-CG 4.47Å; K190-K194 WeakPolarHBondContact O-CB 3.34Å; K190-K194 PolarHBondContact O-N 3.48Å; L191-K194 WeakPolarHBondContact O-CB 3.32Å; L191-K194 PolarHBondContact O-N 3.47Å; Q192-K194 PolarHBondContact O-N 3.14Å; Q192-K194 VanDerWaalsContact O-N 3.15Å; K194-K197 PolarHBondContact O-N 3.36Å; K194-C198 PolarHBondContact O-N 3.03Å; K194-C198 PolarHBondContact O-SG 2.8Å; K194-C198 VanDerWaalsContact O-SG 3.34Å
195	V	95	Very high	93.3	Very high	5 Å²	5	86 Å²	86	3%	0.03	41%	0.412	C	S	.	.	H	α-helix	trans	-60.8	-46.6	173.5	168.6	0	0	0	0	110.4	A170 M171 E174 L191 Q192 K197 C198 K199	A170-V195 HydrophobicContact CB-CG2 3.93Å; M171-V195 HydrophobicContact CE-CG1 4.35Å; M171-V195 HydrophobicContact CG-CG1 3.93Å; M171-V195 HydrophobicContact CG-CG2 4.37Å; E174-V195 HydrophobicContact CB-CG2 3.82Å; E174-V195 HydrophobicContact CG-CG2 4.17Å; L191-V195 PolarHBondContact O-N 3.39Å; Q192-V195 WeakPolarHBondContact O-CB 3.42Å; Q192-V195 PolarHBondContact O-N 3Å; V195-K197 VanDerWaalsContact C-N 3.33Å; V195-K197 PolarHBondContact O-N 3.4Å; V195-C198 PolarHBondContact O-N 3.42Å; V195-C198 VanDerWaalsContact O-N 3.17Å; V195-K199 HydrophobicContact CG1-CD 4.49Å; V195-K199 PolarHBondContact O-N 2.9Å
196	D	95.6	Very high	94	Very high	55 Å²	55	83.8 Å²	83.8	29%	0.294	39%	0.392	S	S	.	.	H	α-helix	trans	-71	-29.8	-177.5	-64	-34.9	0	0	0	112.5	Q192 K199 Q200	Q192-D196 VanDerWaalsContact NE2-CG 3.31Å; Q192-D196 PolarHBondContact NE2-OD1 3.27Å; Q192-D196 PolarHBondContact NE2-OD2 3.25Å; Q192-D196 PolarHBondContact O-N 2.97Å; D196-K199 IonicContact OD1-NZ 2.71Å; D196-K199 PolarHBondContact OD1-NZ 2.92Å; D196-Q200 WeakPolarHBondContact O-CG 3.39Å; D196-Q200 PolarHBondContact O-N 3.37Å
197	K	96.6	Very high	94.6	Very high	127 Å²	127	80.9 Å²	80.9	55%	0.552	38%	0.378	S	S	*	.	H	α-helix	trans	-63.4	-48.8	166	-174.3	-178.9	175.4	-175.2	0	112.1	D193 K194 V195 K199 Q200 D201	D193-K197 WeakPolarHBondContact O-CB 3.43Å; D193-K197 PolarHBondContact O-N 2.9Å; K194-K197 PolarHBondContact O-N 3.36Å; V195-K197 VanDerWaalsContact C-N 3.33Å; V195-K197 PolarHBondContact O-N 3.4Å; K197-K199 VanDerWaalsContact C-N 3.28Å; K197-K199 PolarHBondContact O-N 3.5Å; K197-Q200 WeakPolarHBondContact O-CB 3.48Å; K197-Q200 PolarHBondContact O-N 3.15Å; K197-Q200 VanDerWaalsContact O-N 3.09Å; K197-D201 WeakPolarHBondContact CE-OD2 3.41Å; K197-D201 PolarHBondContact O-N 2.91Å
198	C	96.7	Very high	95.2	Very high	10 Å²	10	82.4 Å²	82.4	7%	0.068	38%	0.383	C	S	.	.	H	α-helix	trans	-60.4	-37	179.5	-70.8	0	0	0	0	112.2	E167 A170 K194 V195 D201 V202	E167-C198 HydrophobicContact CB-CB 3.96Å; E167-C198 HydrophobicContact CG-CB 4.28Å; A170-C198 HydrophobicContact CB-CB 4.49Å; K194-C198 PolarHBondContact O-N 3.03Å; K194-C198 PolarHBondContact O-SG 2.8Å; K194-C198 VanDerWaalsContact O-SG 3.34Å; V195-C198 PolarHBondContact O-N 3.42Å; V195-C198 VanDerWaalsContact O-N 3.17Å; C198-D201 PolarHBondContact O-N 3.43Å; C198-V202 WeakPolarHBondContact O-CG2 3.28Å; C198-V202 PolarHBondContact O-N 2.89Å
199	K	96.5	Very high	95.8	Very high	85 Å²	85	82.9 Å²	82.9	37%	0.37	38%	0.384	S	S	.	.	H	α-helix	trans	-58.2	-45.7	171.4	-73.8	171.6	-171.1	161.2	0	112.8	E167 M171 V195 D196 K197 D201 V202 Q203	E167-K199 HydrophobicContact CG-CG 4.43Å; E167-K199 WeakPolarHBondContact OE1-CG 3.44Å; M171-K199 HydrophobicContact CE-CG 4.44Å; V195-K199 HydrophobicContact CG1-CD 4.49Å; V195-K199 PolarHBondContact O-N 2.9Å; D196-K199 IonicContact OD1-NZ 2.71Å; D196-K199 PolarHBondContact OD1-NZ 2.92Å; K197-K199 VanDerWaalsContact C-N 3.28Å; K197-K199 PolarHBondContact O-N 3.5Å; K199-D201 VanDerWaalsContact C-N 3.34Å; K199-V202 PolarHBondContact O-N 2.81Å; K199-Q203 PolarHBondContact O-N 3.32Å
200	Q	97.1	Very high	96.3	Very high	135 Å²	135	81.1 Å²	81.1	63%	0.631	38%	0.378	S	S	*	.	H	α-helix	trans	-64.6	-39.6	177	-69.4	176.6	12.9	0	0	111.7	D196 K197 Q203 K204	D196-Q200 WeakPolarHBondContact O-CG 3.39Å; D196-Q200 PolarHBondContact O-N 3.37Å; K197-Q200 WeakPolarHBondContact O-CB 3.48Å; K197-Q200 PolarHBondContact O-N 3.15Å; K197-Q200 VanDerWaalsContact O-N 3.09Å; Q200-Q203 PolarHBondContact O-N 3.07Å; Q200-K204 VanDerWaalsContact O-CB 3.22Å; Q200-K204 WeakPolarHBondContact O-CB 3.38Å; Q200-K204 PolarHBondContact O-N 3.37Å
201	D	97.3	Very high	96.5	Very high	60 Å²	60	80 Å²	80	32%	0.321	37%	0.373	S	S	.	.	H	α-helix	trans	-67.2	-35.7	176.2	-73.3	-36.3	0	0	0	111.8	K197 C198 K199 T205	K197-D201 WeakPolarHBondContact CE-OD2 3.41Å; K197-D201 PolarHBondContact O-N 2.91Å; C198-D201 PolarHBondContact O-N 3.43Å; K199-D201 VanDerWaalsContact C-N 3.34Å; D201-T205 WeakPolarHBondContact O-CB 3.39Å; D201-T205 WeakPolarHBondContact O-CG2 3.44Å; D201-T205 PolarHBondContact O-N 2.71Å; D201-T205 PolarHBondContact O-OG1 3Å
202	V	98.3	Very high	96.8	Very high	14 Å²	14	78.5 Å²	78.5	9%	0.085	37%	0.366	C	S	.	.	H	α-helix	trans	-63	-53.9	170.9	167.8	0	0	0	0	111.2	Y160 A163 E167 C198 K199 K204 T205 Q206	Y160-V202 HydrophobicContact CE2-CG1 4.06Å; A163-V202 HydrophobicContact CB-CB 4.47Å; A163-V202 HydrophobicContact CB-CG2 3.71Å; A163-V202 WeakPolarHBondContact O-CG2 3.31Å; E167-V202 HydrophobicContact CB-CG2 3.9Å; C198-V202 WeakPolarHBondContact O-CG2 3.28Å; C198-V202 PolarHBondContact O-N 2.89Å; K199-V202 PolarHBondContact O-N 2.81Å; V202-K204 VanDerWaalsContact C-N 3.32Å; V202-K204 PolarHBondContact O-N 3.37Å; V202-T205 PolarHBondContact O-N 2.64Å; V202-T205 VanDerWaalsContact O-N 3.16Å; V202-T205 PolarHBondContact O-OG1 3.47Å; V202-Q206 WeakPolarHBondContact O-CB 3.36Å; V202-Q206 PolarHBondContact O-N 3.44Å
203	Q	97.9	Very high	97.1	Very high	113 Å²	113	79.4 Å²	79.4	53%	0.528	37%	0.372	S	S	.	.	H	α-helix	trans	-56.8	-46.8	179.4	-177.9	-176.8	-14	0	0	111.3	K199 Q200 T205 Q206 E207	K199-Q203 PolarHBondContact O-N 3.32Å; Q200-Q203 PolarHBondContact O-N 3.07Å; Q203-T205 VanDerWaalsContact C-N 3.33Å; Q203-T205 PolarHBondContact O-N 3.27Å; Q203-Q206 WeakPolarHBondContact O-CB 3.44Å; Q203-Q206 PolarHBondContact O-N 3.22Å; Q203-E207 HydrophobicContact CG-CG 4.48Å; Q203-E207 WeakPolarHBondContact CG-OE1 3.31Å; Q203-E207 PolarHBondContact NE2-OE1 3.46Å; Q203-E207 WeakPolarHBondContact O-CG 2.86Å; Q203-E207 PolarHBondContact O-N 3.15Å
204	K	98.1	Very high	97.2	Very high	145 Å²	145	80.5 Å²	80.5	63%	0.63	37%	0.374	S	S	*	.	H	α-helix	trans	-64.5	-34.2	179.8	-178.6	179.3	177.2	-177.9	0	113.4	Q200 V202 K208	Q200-K204 VanDerWaalsContact O-CB 3.22Å; Q200-K204 WeakPolarHBondContact O-CB 3.38Å; Q200-K204 PolarHBondContact O-N 3.37Å; V202-K204 VanDerWaalsContact C-N 3.32Å; V202-K204 PolarHBondContact O-N 3.37Å; K204-K208 WeakPolarHBondContact O-CB 3.31Å; K204-K208 PolarHBondContact O-N 2.87Å
205	T	98.1	Very high	97.3	Very high	28 Å²	28	77.6 Å²	77.6	17%	0.172	36%	0.364	C	S	.	.	H	α-helix	trans	-78.4	-32.5	176	49.2	0	0	0	0	112	A159 A163 D201 V202 Q203 K208 Y209	A159-T205 HydrophobicContact CB-CG2 4.37Å; A163-T205 HydrophobicContact CB-CG2 4.4Å; A163-T205 WeakPolarHBondContact CB-OG1 3.4Å; D201-T205 WeakPolarHBondContact O-CB 3.39Å; D201-T205 WeakPolarHBondContact O-CG2 3.44Å; D201-T205 PolarHBondContact O-N 2.71Å; D201-T205 PolarHBondContact O-OG1 3Å; V202-T205 PolarHBondContact O-N 2.64Å; V202-T205 VanDerWaalsContact O-N 3.16Å; V202-T205 PolarHBondContact O-OG1 3.47Å; Q203-T205 VanDerWaalsContact C-N 3.33Å; Q203-T205 PolarHBondContact O-N 3.27Å; T205-K208 PolarHBondContact O-N 2.99Å; T205-Y209 WeakPolarHBondContact O-CB 3.42Å; T205-Y209 PolarHBondContact O-N 3.08Å
206	Q	98.3	Very high	97.3	Very high	69 Å²	69	77.9 Å²	77.9	32%	0.322	37%	0.365	S	S	.	.	H	α-helix	trans	-62	-56.1	171	-173.5	-177.3	-15.8	0	0	111.5	Y160 V202 Q203 K208 Y209 E210	Y160-Q206 HydrophobicContact CD2-CB 3.82Å; Y160-Q206 HydrophobicContact CE2-CB 3.65Å; Y160-Q206 HydrophobicContact CE2-CG 4.03Å; V202-Q206 WeakPolarHBondContact O-CB 3.36Å; V202-Q206 PolarHBondContact O-N 3.44Å; Q203-Q206 WeakPolarHBondContact O-CB 3.44Å; Q203-Q206 PolarHBondContact O-N 3.22Å; Q206-K208 PolarHBondContact O-N 3.29Å; Q206-K208 VanDerWaalsContact O-N 3.17Å; Q206-Y209 WeakPolarHBondContact O-CA 3.3Å; Q206-Y209 WeakPolarHBondContact O-CB 3.42Å; Q206-Y209 PolarHBondContact O-N 3.37Å; Q206-E210 HydrophobicContact CG-CG 4.35Å; Q206-E210 WeakPolarHBondContact CG-OE1 3.31Å; Q206-E210 PolarHBondContact NE2-OE1 3.05Å; Q206-E210 WeakPolarHBondContact O-CG 3.49Å; Q206-E210 PolarHBondContact O-N 2.88Å
207	E	98.2	Very high	97.4	Very high	106 Å²	106	77.3 Å²	77.3	50%	0.495	37%	0.373	S	S	.	.	H	α-helix	trans	-54.7	-38.1	178	-72	171.5	-170.1	0	0	111.7	Q203 K211	Q203-E207 HydrophobicContact CG-CG 4.48Å; Q203-E207 WeakPolarHBondContact CG-OE1 3.31Å; Q203-E207 PolarHBondContact NE2-OE1 3.46Å; Q203-E207 WeakPolarHBondContact O-CG 2.86Å; Q203-E207 PolarHBondContact O-N 3.15Å; E207-K211 VanDerWaalsContact O-CB 3.28Å; E207-K211 WeakPolarHBondContact O-CB 3.48Å; E207-K211 PolarHBondContact O-N 3.21Å
208	K	97.7	Very high	97.4	Very high	130 Å²	130	77.1 Å²	77.1	57%	0.565	37%	0.372	S	S	*	.	H	α-helix	trans	-68.2	-42	174.7	-175.4	-176.8	175.6	-171.1	0	112.3	K204 T205 Q206 V212	K204-K208 WeakPolarHBondContact O-CB 3.31Å; K204-K208 PolarHBondContact O-N 2.87Å; T205-K208 PolarHBondContact O-N 2.99Å; Q206-K208 PolarHBondContact O-N 3.29Å; Q206-K208 VanDerWaalsContact O-N 3.17Å; K208-V212 VanDerWaalsContact O-CG2 3.31Å; K208-V212 WeakPolarHBondContact O-CG2 3.4Å; K208-V212 PolarHBondContact O-N 3.4Å; K208-V212 VanDerWaalsContact O-N 3.1Å
209	Y	98.4	Very high	97.3	Very high	53 Å²	53	78.9 Å²	78.9	21%	0.208	38%	0.382	C	S	.	.	H	α-helix	trans	-66.2	-47.7	178.9	174.2	-127.7	0	0	0	111.4	L153 A156 K157 Y160 T205 Q206 K211 V212 L213	L153-Y209 HydrophobicContact CD1-CD2 3.81Å; L153-Y209 HydrophobicContact CD1-CE2 3.47Å; L153-Y209 VanDerWaalsContact CD1-CE2 3.47Å; L153-Y209 HydrophobicContact CG-CE2 4.04Å; A156-Y209 HydrophobicContact CB-CD2 4.06Å; K157-Y209 HydrophobicContact CB-CD2 4.04Å; K157-Y209 HydrophobicContact CB-CE2 3.59Å; K157-Y209 HydrophobicContact CG-CE2 4.27Å; Y160-Y209 HydrophobicContact CD1-CD1 4.18Å; T205-Y209 WeakPolarHBondContact O-CB 3.42Å; T205-Y209 PolarHBondContact O-N 3.08Å; Q206-Y209 WeakPolarHBondContact O-CA 3.3Å; Q206-Y209 WeakPolarHBondContact O-CB 3.42Å; Q206-Y209 PolarHBondContact O-N 3.37Å; Y209-K211 VanDerWaalsContact C-N 3.34Å; Y209-K211 PolarHBondContact O-N 3.2Å; Y209-V212 PolarHBondContact O-N 2.91Å; Y209-V212 VanDerWaalsContact O-N 3.15Å; Y209-L213 WeakPolarHBondContact O-CB 3.2Å; Y209-L213 PolarHBondContact O-N 3.06Å
210	E	98.2	Very high	97.4	Very high	99 Å²	99	76.7 Å²	76.7	46%	0.463	38%	0.376	S	S	.	.	H	α-helix	trans	-58	-44.5	175.5	-70.1	173.3	178.5	0	0	111.7	Q206 V212 L213 E214	Q206-E210 HydrophobicContact CG-CG 4.35Å; Q206-E210 WeakPolarHBondContact CG-OE1 3.31Å; Q206-E210 PolarHBondContact NE2-OE1 3.05Å; Q206-E210 WeakPolarHBondContact O-CG 3.49Å; Q206-E210 PolarHBondContact O-N 2.88Å; E210-V212 PolarHBondContact O-N 3.42Å; E210-L213 WeakPolarHBondContact O-CB 3.48Å; E210-L213 PolarHBondContact O-N 3.08Å; E210-E214 PolarHBondContact O-N 3.4Å
211	K	97.7	Very high	97.4	Very high	135 Å²	135	74.2 Å²	74.2	59%	0.587	37%	0.372	S	S	*	.	H	α-helix	trans	-61.1	-41.5	175	-179.4	173.4	-179.2	172.2	0	113.1	E207 Y209 L213 E214 D215	E207-K211 VanDerWaalsContact O-CB 3.28Å; E207-K211 WeakPolarHBondContact O-CB 3.48Å; E207-K211 PolarHBondContact O-N 3.21Å; Y209-K211 VanDerWaalsContact C-N 3.34Å; Y209-K211 PolarHBondContact O-N 3.2Å; K211-L213 VanDerWaalsContact C-N 3.34Å; K211-E214 PolarHBondContact O-N 2.84Å; K211-D215 PolarHBondContact O-N 2.98Å
212	V	97.2	Very high	97.4	Very high	16 Å²	16	76.1 Å²	76.1	10%	0.097	38%	0.379	C	S	.	.	H	α-helix	trans	-71.2	-32.8	178.1	177.6	0	0	0	0	111.1	E152 L153 A156 K208 Y209 E210 D215 V216	E152-V212 HydrophobicContact CB-CG1 3.99Å; L153-V212 HydrophobicContact CB-CG1 3.94Å; L153-V212 HydrophobicContact CD1-CB 4.34Å; L153-V212 HydrophobicContact CD1-CG1 4.03Å; A156-V212 HydrophobicContact CB-CG2 4.5Å; K208-V212 VanDerWaalsContact O-CG2 3.31Å; K208-V212 WeakPolarHBondContact O-CG2 3.4Å; K208-V212 PolarHBondContact O-N 3.4Å; K208-V212 VanDerWaalsContact O-N 3.1Å; Y209-V212 PolarHBondContact O-N 2.91Å; Y209-V212 VanDerWaalsContact O-N 3.15Å; E210-V212 PolarHBondContact O-N 3.42Å; V212-D215 PolarHBondContact O-N 2.88Å; V212-V216 WeakPolarHBondContact O-CG2 3.3Å; V212-V216 PolarHBondContact O-N 3.42Å
213	L	97.4	Very high	97.4	Very high	85 Å²	85	75.8 Å²	75.8	45%	0.445	38%	0.376	S	S	.	.	H	α-helix	trans	-64.7	-42	173	-173.2	66.2	0	0	0	111.6	L153 Y209 E210 K211 V216 G217	L153-L213 HydrophobicContact CD1-CB 3.84Å; L153-L213 HydrophobicContact CD1-CD1 3.97Å; L153-L213 HydrophobicContact CD2-CD1 4Å; Y209-L213 WeakPolarHBondContact O-CB 3.2Å; Y209-L213 PolarHBondContact O-N 3.06Å; E210-L213 WeakPolarHBondContact O-CB 3.48Å; E210-L213 PolarHBondContact O-N 3.08Å; K211-L213 VanDerWaalsContact C-N 3.34Å; L213-V216 PolarHBondContact O-N 3.08Å; L213-G217 PolarHBondContact O-N 3.14Å
214	E	97.3	Very high	97.5	Very high	112 Å²	112	73.8 Å²	73.8	52%	0.523	37%	0.368	S	S	.	.	H	α-helix	trans	-63.2	-44	173.5	-159.1	-153.6	167.6	0	0	111.9	E210 K211 V216 G217 K218	E210-E214 PolarHBondContact O-N 3.4Å; K211-E214 PolarHBondContact O-N 2.84Å; E214-V216 PolarHBondContact O-N 3.38Å; E214-G217 PolarHBondContact O-N 3.06Å; E214-K218 WeakPolarHBondContact O-CG 3.38Å; E214-K218 PolarHBondContact O-N 3.46Å; E214-K218 WeakPolarHBondContact OE1-CE 3.35Å; E214-K218 IonicContact OE1-NZ 3.44Å; E214-K218 PolarHBondContact OE1-NZ 2.91Å; E214-K218 IonicContact OE2-NZ 3.69Å; E214-K218 PolarHBondContact OE2-NZ 2.97Å
215	D	95.1	Very high	97.5	Very high	47 Å²	47	72.6 Å²	72.6	25%	0.251	37%	0.365	S	S	.	.	H	α-helix	trans	-59.2	-42.8	173.5	-89.9	7.5	0	0	0	112.2	K149 K211 V212 K218 T219	K149-D215 HydrophobicContact CD-CB 4.22Å; K149-D215 IonicContact NZ-OD2 3.16Å; K149-D215 PolarHBondContact NZ-OD2 3.44Å; K211-D215 PolarHBondContact O-N 2.98Å; V212-D215 PolarHBondContact O-N 2.88Å; D215-K218 PolarHBondContact O-N 3.22Å; D215-T219 WeakPolarHBondContact O-CG2 3.39Å; D215-T219 PolarHBondContact O-N 3.11Å; D215-T219 PolarHBondContact O-OG1 3.34Å
216	V	96.8	Very high	97.5	Very high	11 Å²	11	73.8 Å²	73.8	7%	0.067	37%	0.37	C	S	.	.	H	α-helix	trans	-59.5	-52.9	174.4	165.6	0	0	0	0	109.4	K149 M150 L153 V212 L213 E214 K218 T219 T220	K149-V216 HydrophobicContact CB-CG2 3.9Å; M150-V216 HydrophobicContact SD-CG1 3.8Å; M150-V216 HydrophobicContact SD-CG2 4.26Å; L153-V216 HydrophobicContact CB-CG2 4.16Å; L153-V216 HydrophobicContact CD2-CG2 4.24Å; V212-V216 WeakPolarHBondContact O-CG2 3.3Å; V212-V216 PolarHBondContact O-N 3.42Å; L213-V216 PolarHBondContact O-N 3.08Å; E214-V216 PolarHBondContact O-N 3.38Å; V216-K218 VanDerWaalsContact C-N 3.26Å; V216-K218 PolarHBondContact O-N 3.12Å; V216-T219 WeakPolarHBondContact O-CA 3.39Å; V216-T219 PolarHBondContact O-N 2.71Å; V216-T219 PolarHBondContact O-OG1 3.48Å; V216-T220 PolarHBondContact O-N 2.95Å; V216-T220 PolarHBondContact O-OG1 3.24Å; V216-T220 VanDerWaalsContact O-OG1 3.1Å
217	G	95.9	Very high	97.6	Very high	44 Å²	44	70.5 Å²	70.5	45%	0.454	35%	0.354	S	S	.	.	H	α-helix	trans	-53.5	-39.2	178.7	0	0	0	0	0	113.8	L213 E214 T219 P221	L213-G217 PolarHBondContact O-N 3.14Å; E214-G217 PolarHBondContact O-N 3.06Å; G217-T219 VanDerWaalsContact C-N 3.32Å; G217-T219 PolarHBondContact O-N 2.71Å; G217-P221 VanDerWaalsContact O-CD 3.29Å; G217-P221 WeakPolarHBondContact O-CD 3.44Å
218	K	96.6	Very high	97.6	Very high	123 Å²	123	70 Å²	70	54%	0.535	35%	0.352	S	S	.	.	H	α-helix	trans	-66.2	-29.5	174.9	-71.7	164.3	-175.5	162.7	0	113.6	E214 D215 V216	E214-K218 WeakPolarHBondContact O-CG 3.38Å; E214-K218 PolarHBondContact O-N 3.46Å; E214-K218 WeakPolarHBondContact OE1-CE 3.35Å; E214-K218 IonicContact OE1-NZ 3.44Å; E214-K218 PolarHBondContact OE1-NZ 2.91Å; E214-K218 IonicContact OE2-NZ 3.69Å; E214-K218 PolarHBondContact OE2-NZ 2.97Å; D215-K218 PolarHBondContact O-N 3.22Å; V216-K218 VanDerWaalsContact C-N 3.26Å; V216-K218 PolarHBondContact O-N 3.12Å
219	T	95.6	Very high	97.6	Very high	46 Å²	46	69.5 Å²	69.5	28%	0.282	35%	0.352	S	S	.	.	H	α-helix	trans	-91.2	-21.4	-179.5	60.5	0	0	0	0	114.3	D215 V216 G217 Q222 Y223	D215-T219 WeakPolarHBondContact O-CG2 3.39Å; D215-T219 PolarHBondContact O-N 3.11Å; D215-T219 PolarHBondContact O-OG1 3.34Å; V216-T219 WeakPolarHBondContact O-CA 3.39Å; V216-T219 PolarHBondContact O-N 2.71Å; V216-T219 PolarHBondContact O-OG1 3.48Å; G217-T219 VanDerWaalsContact C-N 3.32Å; G217-T219 PolarHBondContact O-N 2.71Å; T219-Q222 PolarHBondContact O-N 3.45Å; T219-Y223 PolarHBondContact O-N 3.41Å; T219-Y223 VanDerWaalsContact O-N 3.08Å
220	T	97.6	Very high	97.7	Very high	39 Å²	39	67.7 Å²	67.7	24%	0.239	35%	0.346	C	S	.	.	H	α-helix	trans	-57.7	-42.8	-177.1	-60.4	0	0	0	0	114.1	W146 V216 Q222 Y223 M224	W146-T220 PolarHBondContact NE1-OG1 2.88Å; V216-T220 PolarHBondContact O-N 2.95Å; V216-T220 PolarHBondContact O-OG1 3.24Å; V216-T220 VanDerWaalsContact O-OG1 3.1Å; T220-Q222 PolarHBondContact O-N 3.01Å; T220-Y223 WeakPolarHBondContact O-CB 3.48Å; T220-Y223 PolarHBondContact O-N 3.13Å; T220-M224 HydrophobicContact CG2-CG 4.27Å; T220-M224 HydrophobicContact CG2-SD 3.99Å; T220-M224 WeakPolarHBondContact O-CG 3.49Å; T220-M224 PolarHBondContact O-N 2.99Å
221	P	98.3	Very high	97.7	Very high	84 Å²	84	66 Å²	66	55%	0.545	34%	0.337	S	S	.	.	H	α-helix	trans	-60.5	-45.7	179.6	-25.6	35.3	0	0	0	113.1	G217 Y223 M224 E225	G217-P221 VanDerWaalsContact O-CD 3.29Å; G217-P221 WeakPolarHBondContact O-CD 3.44Å; P221-Y223 VanDerWaalsContact C-N 3.3Å; P221-Y223 PolarHBondContact O-N 3.2Å; P221-M224 PolarHBondContact O-N 3.04Å; P221-E225 PolarHBondContact O-N 3.36Å
222	Q	97.8	Very high	97.7	Very high	99 Å²	99	64 Å²	64	46%	0.463	33%	0.33	S	S	.	.	H	α-helix	trans	-67.6	-31.9	177.8	-172.3	65.3	85.8	0	0	112.1	T219 T220 E225 N226	T219-Q222 PolarHBondContact O-N 3.45Å; T220-Q222 PolarHBondContact O-N 3.01Å; Q222-E225 PolarHBondContact NE2-OE2 3.06Å; Q222-N226 WeakPolarHBondContact O-CB 3.49Å; Q222-N226 PolarHBondContact O-N 3.06Å; Q222-N226 VanDerWaalsContact O-N 3.16Å; Q222-N226 PolarHBondContact O-ND2 3.29Å
223	Y	98.3	Very high	97.8	Very high	8 Å²	8	68.7 Å²	68.7	3%	0.031	35%	0.351	C	S	.	.	H	α-helix	trans	-63.4	-48.8	171.7	162.2	-120.2	0	0	0	111.4	W20 Q143 W146 T219 T220 P221 N226 M227	W20-Y223 HydrophobicContact CE3-CE1 4.03Å; W20-Y223 PolarHBondContact O-OH 3.43Å; Q143-Y223 HydrophobicContact CB-CE2 3.85Å; Q143-Y223 HydrophobicContact CG-CE2 3.62Å; Q143-Y223 PolarHBondContact NE2-OH 3.42Å; W146-Y223 HydrophobicContact CB-CD1 4.21Å; W146-Y223 HydrophobicContact CB-CD2 3.85Å; W146-Y223 HydrophobicContact CB-CE2 4.49Å; W146-Y223 HydrophobicContact CB-CG 3.68Å; W146-Y223 AromaticContact CD1-CD1 3.83Å; W146-Y223 AromaticContact CD2-CD1 3.62Å; W146-Y223 HydrophobicContact CD2-CD1 3.62Å; W146-Y223 HydrophobicContact CD2-CD2 4.43Å; W146-Y223 AromaticContact CD2-CE1 3.64Å; W146-Y223 HydrophobicContact CD2-CE1 3.64Å; W146-Y223 HydrophobicContact CD2-CE2 4.46Å; W146-Y223 HydrophobicContact CD2-CG 4.02Å; W146-Y223 AromaticContact CE2-CD1 3.84Å; W146-Y223 AromaticContact CE2-CE1 3.88Å; W146-Y223 HydrophobicContact CE3-CD1 4.12Å; W146-Y223 AromaticContact CE3-CE1 3.68Å; W146-Y223 HydrophobicContact CE3-CE1 3.68Å; W146-Y223 HydrophobicContact CE3-CE2 4.16Å; W146-Y223 AromaticContact CE3-CZ 3.7Å; W146-Y223 AromaticContact CG-CD1 3.64Å; W146-Y223 HydrophobicContact CG-CD1 3.64Å; W146-Y223 HydrophobicContact CG-CD2 4.15Å; W146-Y223 HydrophobicContact CG-CE1 4.15Å; W146-Y223 AromaticContact CG-CG 3.63Å; W146-Y223 HydrophobicContact CG-CG 3.63Å; W146-Y223 HydrophobicContact CH2-CE1 4.22Å; W146-Y223 HydrophobicContact CZ2-CE1 4.18Å; W146-Y223 AromaticContact CZ3-CE1 3.97Å; W146-Y223 HydrophobicContact CZ3-CE1 3.97Å; W146-Y223 AromaticContact NE1-CD1 3.92Å; T219-Y223 PolarHBondContact O-N 3.41Å; T219-Y223 VanDerWaalsContact O-N 3.08Å; T220-Y223 WeakPolarHBondContact O-CB 3.48Å; T220-Y223 PolarHBondContact O-N 3.13Å; P221-Y223 VanDerWaalsContact C-N 3.3Å; P221-Y223 PolarHBondContact O-N 3.2Å; Y223-N226 PolarHBondContact O-N 3.45Å; Y223-M227 HydrophobicContact CD2-CG 3.6Å; Y223-M227 HydrophobicContact CD2-SD 4.42Å; Y223-M227 HydrophobicContact CE2-CE 4.3Å; Y223-M227 HydrophobicContact CE2-CG 3.21Å; Y223-M227 HydrophobicContact CE2-SD 3.73Å; Y223-M227 WeakPolarHBondContact O-CB 3.35Å; Y223-M227 VanDerWaalsContact O-CG 3.23Å; Y223-M227 WeakPolarHBondContact O-CG 3.36Å; Y223-M227 PolarHBondContact O-N 3.17Å
224	M	98.6	Very high	97.9	Very high	71 Å²	71	65 Å²	65	35%	0.35	33%	0.332	S	S	.	.	H	α-helix	trans	-59.8	-51.5	178.8	-68.8	176.5	67.5	0	0	111.6	W20 T220 P221 N226 M227 E228	W20-M224 HydrophobicContact CE3-CG 4.35Å; W20-M224 HydrophobicContact CH2-CB 4.03Å; W20-M224 HydrophobicContact CH2-CE 4.11Å; W20-M224 HydrophobicContact CH2-CG 3.95Å; W20-M224 HydrophobicContact CZ2-CE 3.97Å; W20-M224 HydrophobicContact CZ3-CB 4.1Å; W20-M224 HydrophobicContact CZ3-CG 3.85Å; T220-M224 HydrophobicContact CG2-CG 4.27Å; T220-M224 HydrophobicContact CG2-SD 3.99Å; T220-M224 WeakPolarHBondContact O-CG 3.49Å; T220-M224 PolarHBondContact O-N 2.99Å; P221-M224 PolarHBondContact O-N 3.04Å; M224-N226 VanDerWaalsContact C-N 3.34Å; M224-N226 PolarHBondContact O-N 3.23Å; M224-M227 PolarHBondContact O-N 2.97Å; M224-M227 VanDerWaalsContact O-N 3.12Å; M224-E228 WeakPolarHBondContact O-CB 3.38Å; M224-E228 WeakPolarHBondContact O-CG 3.43Å; M224-E228 PolarHBondContact O-N 3.35Å
225	E	98.6	Very high	97.9	Very high	120 Å²	120	62.9 Å²	62.9	56%	0.561	32%	0.322	S	S	*	.	H	α-helix	trans	-53.9	-47.4	177.3	-177.3	-176.2	-155.6	0	0	112.4	P221 Q222 M227 E228 Q229	P221-E225 PolarHBondContact O-N 3.36Å; Q222-E225 PolarHBondContact NE2-OE2 3.06Å; E225-M227 PolarHBondContact O-N 3.49Å; E225-E228 PolarHBondContact O-N 3.29Å; E225-Q229 WeakPolarHBondContact O-CB 3.4Å; E225-Q229 PolarHBondContact O-N 2.98Å
226	N	98.6	Very high	98.1	Very high	52 Å²	52	65 Å²	65	28%	0.278	33%	0.331	S	S	.	.	H	α-helix	trans	-67.3	-35	-180	-72.4	-33.1	0	0	0	112.8	A142 Q222 Y223 M224 V230	A142-N226 HydrophobicContact CB-CB 3.67Å; Q222-N226 WeakPolarHBondContact O-CB 3.49Å; Q222-N226 PolarHBondContact O-N 3.06Å; Q222-N226 VanDerWaalsContact O-N 3.16Å; Q222-N226 PolarHBondContact O-ND2 3.29Å; Y223-N226 PolarHBondContact O-N 3.45Å; M224-N226 VanDerWaalsContact C-N 3.34Å; M224-N226 PolarHBondContact O-N 3.23Å; N226-V230 WeakPolarHBondContact O-CG2 3.34Å; N226-V230 PolarHBondContact O-N 2.86Å
227	M	98.8	Very high	98.2	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-72.9	-42.6	177.1	-71.4	-68.1	-72	0	0	111.5	F19 W20 Y25 F139 A142 Q143 Y223 M224 E225 Q229 V230 F231	F19-M227 HydrophobicContact CE1-CB 4.24Å; F19-M227 HydrophobicContact CE1-CE 4.1Å; F19-M227 HydrophobicContact CE2-CE 4.35Å; F19-M227 HydrophobicContact CZ-CB 4.41Å; F19-M227 HydrophobicContact CZ-CE 3.76Å; W20-M227 HydrophobicContact CZ3-CB 3.89Å; W20-M227 HydrophobicContact CZ3-CG 4.42Å; Y25-M227 HydrophobicContact CD1-CE 3.9Å; Y25-M227 HydrophobicContact CG-CE 4.35Å; F139-M227 HydrophobicContact CD1-CE 3.73Å; F139-M227 HydrophobicContact CD1-SD 3.86Å; F139-M227 HydrophobicContact CE1-CE 4.29Å; A142-M227 HydrophobicContact CB-CG 4.25Å; A142-M227 HydrophobicContact CB-SD 3.77Å; Q143-M227 HydrophobicContact CB-SD 3.91Å; Y223-M227 HydrophobicContact CD2-CG 3.6Å; Y223-M227 HydrophobicContact CD2-SD 4.42Å; Y223-M227 HydrophobicContact CE2-CE 4.3Å; Y223-M227 HydrophobicContact CE2-CG 3.21Å; Y223-M227 HydrophobicContact CE2-SD 3.73Å; Y223-M227 WeakPolarHBondContact O-CB 3.35Å; Y223-M227 VanDerWaalsContact O-CG 3.23Å; Y223-M227 WeakPolarHBondContact O-CG 3.36Å; Y223-M227 PolarHBondContact O-N 3.17Å; M224-M227 PolarHBondContact O-N 2.97Å; M224-M227 VanDerWaalsContact O-N 3.12Å; E225-M227 PolarHBondContact O-N 3.49Å; M227-Q229 VanDerWaalsContact C-N 3.33Å; M227-V230 PolarHBondContact O-N 3.35Å; M227-F231 VanDerWaalsContact O-CB 3.31Å; M227-F231 WeakPolarHBondContact O-CB 3.36Å; M227-F231 PolarHBondContact O-N 3.31Å
228	E	98.8	Very high	98.4	Very high	97 Å²	97	65.3 Å²	65.3	45%	0.453	32%	0.319	S	S	.	.	H	α-helix	trans	-61.7	-41.2	175.8	-74.4	170.2	-165.5	0	0	110.9	W20 M224 E225 V230 F231 E232	W20-E228 HydrophobicContact CH2-CG 3.94Å; W20-E228 WeakPolarHBondContact CH2-OE1 3.39Å; M224-E228 WeakPolarHBondContact O-CB 3.38Å; M224-E228 WeakPolarHBondContact O-CG 3.43Å; M224-E228 PolarHBondContact O-N 3.35Å; E225-E228 PolarHBondContact O-N 3.29Å; E228-V230 PolarHBondContact O-N 2.8Å; E228-F231 PolarHBondContact O-N 3.38Å; E228-E232 VanDerWaalsContact O-CB 3.28Å; E228-E232 WeakPolarHBondContact O-CB 3.4Å; E228-E232 PolarHBondContact O-N 3.41Å
229	Q	98.8	Very high	98.5	Very high	118 Å²	118	65.2 Å²	65.2	55%	0.551	32%	0.32	S	S	*	.	H	α-helix	trans	-58	-44.5	175.7	-172.5	-178	39.5	0	0	112.8	E225 M227 Q233	E225-Q229 WeakPolarHBondContact O-CB 3.4Å; E225-Q229 PolarHBondContact O-N 2.98Å; M227-Q229 VanDerWaalsContact C-N 3.33Å; Q229-Q233 WeakPolarHBondContact O-CG 3.5Å; Q229-Q233 PolarHBondContact O-N 2.93Å
230	V	98.8	Very high	98.6	Very high	15 Å²	15	69.5 Å²	69.5	9%	0.091	34%	0.335	C	S	.	.	H	α-helix	trans	-74	-37.4	178.4	-179.4	0	0	0	0	111	F139 N226 M227 E228 Q233 C234	F139-V230 HydrophobicContact CD1-CB 3.9Å; F139-V230 HydrophobicContact CD1-CG1 3.76Å; F139-V230 HydrophobicContact CD2-CG1 3.83Å; F139-V230 HydrophobicContact CE1-CB 3.81Å; F139-V230 HydrophobicContact CE1-CG1 3.76Å; F139-V230 HydrophobicContact CE2-CG1 3.84Å; F139-V230 HydrophobicContact CG-CB 4.41Å; F139-V230 HydrophobicContact CG-CG1 3.8Å; F139-V230 HydrophobicContact CZ-CB 4.26Å; F139-V230 HydrophobicContact CZ-CG1 3.81Å; N226-V230 WeakPolarHBondContact O-CG2 3.34Å; N226-V230 PolarHBondContact O-N 2.86Å; M227-V230 PolarHBondContact O-N 3.35Å; E228-V230 PolarHBondContact O-N 2.8Å; V230-Q233 PolarHBondContact O-N 3.34Å; V230-C234 PolarHBondContact O-N 3.36Å; V230-C234 VanDerWaalsContact O-N 3.14Å; V230-C234 PolarHBondContact O-SG 3.16Å
231	F	98.8	Very high	98.7	Very high	64 Å²	64	68.4 Å²	68.4	28%	0.281	33%	0.327	S	S	.	.	H	α-helix	trans	-61.7	-43.3	175.5	-177.7	-94.8	0	0	0	112	F19 T28 F139 M227 E228 Q233 C234 Q235	F19-F231 AromaticContact CE2-CD2 3.9Å; F19-F231 HydrophobicContact CE2-CD2 3.9Å; F19-F231 HydrophobicContact CZ-CB 4.23Å; F19-F231 HydrophobicContact CZ-CD2 4.06Å; F19-F231 HydrophobicContact CZ-CG 4.42Å; T28-F231 HydrophobicContact CG2-CD2 3.79Å; T28-F231 HydrophobicContact CG2-CE2 3.93Å; F139-F231 HydrophobicContact CE1-CB 4.12Å; F139-F231 HydrophobicContact CZ-CB 4.14Å; F139-F231 HydrophobicContact CZ-CD2 4.47Å; M227-F231 VanDerWaalsContact O-CB 3.31Å; M227-F231 WeakPolarHBondContact O-CB 3.36Å; M227-F231 PolarHBondContact O-N 3.31Å; E228-F231 PolarHBondContact O-N 3.38Å; F231-Q233 VanDerWaalsContact C-N 3.35Å; F231-Q233 PolarHBondContact O-N 2.82Å; F231-C234 CarbonylContact O-C 3.58Å; F231-C234 WeakPolarHBondContact O-CA 3.36Å; F231-C234 WeakPolarHBondContact O-CB 3.23Å; F231-C234 PolarHBondContact O-N 2.94Å; F231-Q235 HydrophobicContact CD1-CG 3.81Å; F231-Q235 HydrophobicContact CE1-CG 3.44Å; F231-Q235 VanDerWaalsContact CE1-CG 3.44Å; F231-Q235 HydrophobicContact CZ-CG 3.98Å; F231-Q235 WeakPolarHBondContact O-CG 3.22Å; F231-Q235 PolarHBondContact O-N 3.08Å
232	E	98.8	Very high	98.7	Very high	92 Å²	92	69 Å²	69	43%	0.43	33%	0.325	S	S	.	.	H	α-helix	trans	-66	-36.1	179.2	-178.3	50.3	-149.1	0	0	112	E228 C234 Q235 Q236	E228-E232 VanDerWaalsContact O-CB 3.28Å; E228-E232 WeakPolarHBondContact O-CB 3.4Å; E228-E232 PolarHBondContact O-N 3.41Å; E232-C234 VanDerWaalsContact C-N 3.31Å; E232-C234 PolarHBondContact O-N 2.99Å; E232-Q235 WeakPolarHBondContact O-CB 3.46Å; E232-Q235 PolarHBondContact O-N 3.34Å; E232-Q235 VanDerWaalsContact O-N 3.15Å; E232-Q236 WeakPolarHBondContact O-CG 3.38Å; E232-Q236 PolarHBondContact O-N 2.96Å; E232-Q236 WeakPolarHBondContact OE1-CG 3.22Å; E232-Q236 PolarHBondContact OE1-NE2 3.15Å
233	Q	98.8	Very high	98.7	Very high	115 Å²	115	67.6 Å²	67.6	54%	0.537	32%	0.323	S	S	.	.	H	α-helix	trans	-61.1	-39.3	169.3	-69.4	170.7	5.5	0	0	112	Q229 V230 F231 Q235 F237	Q229-Q233 WeakPolarHBondContact O-CG 3.5Å; Q229-Q233 PolarHBondContact O-N 2.93Å; V230-Q233 PolarHBondContact O-N 3.34Å; F231-Q233 VanDerWaalsContact C-N 3.35Å; F231-Q233 PolarHBondContact O-N 2.82Å; Q233-Q235 VanDerWaalsContact C-N 3.33Å; Q233-F237 PolarHBondContact O-N 2.97Å; Q233-F237 VanDerWaalsContact O-N 3.07Å
234	C	98.8	Very high	98.8	Very high	7 Å²	7	68 Å²	68	5%	0.047	33%	0.325	C	S	.	.	H	α-helix	trans	-70.6	-27.2	174.9	-59.5	0	0	0	0	113	T28 R31 V230 F231 E232 E238	T28-C234 HydrophobicContact CG2-CB 3.62Å; R31-C234 PolarHBondContact NH2-O 2.67Å; V230-C234 PolarHBondContact O-N 3.36Å; V230-C234 VanDerWaalsContact O-N 3.14Å; V230-C234 PolarHBondContact O-SG 3.16Å; F231-C234 CarbonylContact O-C 3.58Å; F231-C234 WeakPolarHBondContact O-CA 3.36Å; F231-C234 WeakPolarHBondContact O-CB 3.23Å; F231-C234 PolarHBondContact O-N 2.94Å; E232-C234 VanDerWaalsContact C-N 3.31Å; E232-C234 PolarHBondContact O-N 2.99Å; C234-E238 WeakPolarHBondContact O-CB 3.45Å; C234-E238 PolarHBondContact O-N 2.81Å
235	Q	98.8	Very high	98.8	Very high	69 Å²	69	65.8 Å²	65.8	32%	0.322	31%	0.314	S	S	.	.	H	α-helix	trans	-72	-47.5	172.8	-71.7	-74.3	100.8	0	0	110.9	R31 F231 E232 Q233 F237 E238 E239	R31-Q235 VanDerWaalsContact CZ-OE1 3.29Å; F231-Q235 HydrophobicContact CD1-CG 3.81Å; F231-Q235 HydrophobicContact CE1-CG 3.44Å; F231-Q235 VanDerWaalsContact CE1-CG 3.44Å; F231-Q235 HydrophobicContact CZ-CG 3.98Å; F231-Q235 WeakPolarHBondContact O-CG 3.22Å; F231-Q235 PolarHBondContact O-N 3.08Å; E232-Q235 WeakPolarHBondContact O-CB 3.46Å; E232-Q235 PolarHBondContact O-N 3.34Å; E232-Q235 VanDerWaalsContact O-N 3.15Å; Q233-Q235 VanDerWaalsContact C-N 3.33Å; Q235-F237 VanDerWaalsContact C-N 3.3Å; Q235-F237 PolarHBondContact O-N 3.35Å; Q235-E238 PolarHBondContact O-N 3.18Å; Q235-E238 VanDerWaalsContact O-N 3.15Å; Q235-E239 WeakPolarHBondContact O-CB 3.47Å; Q235-E239 PolarHBondContact O-N 3.04Å
236	Q	98.8	Very high	98.8	Very high	91 Å²	91	66.8 Å²	66.8	43%	0.425	32%	0.317	S	S	.	.	H	α-helix	trans	-64.6	-31.4	177.7	-69	169.5	16.6	0	0	113.1	E232 K240	E232-Q236 WeakPolarHBondContact O-CG 3.38Å; E232-Q236 PolarHBondContact O-N 2.96Å; E232-Q236 WeakPolarHBondContact OE1-CG 3.22Å; E232-Q236 PolarHBondContact OE1-NE2 3.15Å; Q236-K240 WeakPolarHBondContact O-CG 3.29Å; Q236-K240 PolarHBondContact O-N 2.98Å
237	F	98.8	Very high	98.8	Very high	41 Å²	41	69 Å²	69	18%	0.18	33%	0.325	C	S	.	.	H	α-helix	trans	-68.3	-44	171.8	-175.5	-98.2	0	0	0	111.9	I32 A120 Y121 E131 Q233 Q235 K240	I32-F237 HydrophobicContact CG2-CD1 4.44Å; I32-F237 HydrophobicContact CG2-CE1 3.92Å; A120-F237 HydrophobicContact CB-CZ 4.49Å; Y121-F237 HydrophobicContact CD1-CE1 4.46Å; Y121-F237 HydrophobicContact CD1-CZ 4.09Å; Y121-F237 AromaticContact CE1-CE1 3.6Å; Y121-F237 HydrophobicContact CE1-CE1 3.6Å; Y121-F237 AromaticContact CE1-CZ 3.62Å; Y121-F237 HydrophobicContact CE1-CZ 3.62Å; Y121-F237 AromaticContact CZ-CE1 3.8Å; Y121-F237 AromaticContact CZ-CZ 3.86Å; E131-F237 HydrophobicContact CB-CZ 4.44Å; E131-F237 HydrophobicContact CG-CE2 4.1Å; E131-F237 HydrophobicContact CG-CZ 4.23Å; Q233-F237 PolarHBondContact O-N 2.97Å; Q233-F237 VanDerWaalsContact O-N 3.07Å; Q235-F237 VanDerWaalsContact C-N 3.3Å; Q235-F237 PolarHBondContact O-N 3.35Å; F237-K240 PolarHBondContact O-N 2.81Å
238	E	98.8	Very high	98.8	Very high	20 Å²	20	69 Å²	69	9%	0.093	33%	0.325	C	S	.	.	H	α-helix	trans	-67.7	-38	176.8	174.9	64.3	176.5	0	0	112.4	C234 Q235 K240 R241 L242	C234-E238 WeakPolarHBondContact O-CB 3.45Å; C234-E238 PolarHBondContact O-N 2.81Å; Q235-E238 PolarHBondContact O-N 3.18Å; Q235-E238 VanDerWaalsContact O-N 3.15Å; E238-K240 VanDerWaalsContact C-N 3.32Å; E238-K240 PolarHBondContact O-N 2.87Å; E238-R241 WeakPolarHBondContact O-CB 3.42Å; E238-R241 PolarHBondContact O-N 3.34Å; E238-R241 IonicContact OE1-CZ 2.68Å; E238-R241 IonicContact OE1-NE 3.67Å; E238-R241 IonicContact OE1-NH2 2.76Å; E238-R241 PolarHBondContact OE1-NH2 3.1Å; E238-R241 IonicContact OE2-CZ 3.04Å; E238-R241 IonicContact OE2-NE 2.67Å; E238-R241 PolarHBondContact OE2-NE 2.8Å; E238-R241 IonicContact OE2-NH2 2.66Å; E238-L242 HydrophobicContact CG-CD1 3.95Å; E238-L242 HydrophobicContact CG-CG 4.19Å; E238-L242 WeakPolarHBondContact O-CG 3.34Å; E238-L242 PolarHBondContact O-N 3.26Å
239	E	98.8	Very high	98.8	Very high	121 Å²	121	69 Å²	69	57%	0.565	33%	0.328	S	S	*	.	H	α-helix	trans	-56.6	-45.1	176.5	-177.7	180	-148.9	0	0	111.4	Q235 R241 L242 V243	Q235-E239 WeakPolarHBondContact O-CB 3.47Å; Q235-E239 PolarHBondContact O-N 3.04Å; E239-R241 VanDerWaalsContact C-N 3.27Å; E239-R241 PolarHBondContact O-N 3.43Å; E239-L242 PolarHBondContact O-N 3.09Å; E239-L242 VanDerWaalsContact O-N 3.15Å; E239-V243 HydrophobicContact CG-CG2 4.29Å; E239-V243 WeakPolarHBondContact O-CG2 3.13Å; E239-V243 PolarHBondContact O-N 3.32Å
240	K	98.8	Very high	98.8	Very high	136 Å²	136	68.5 Å²	68.5	59%	0.591	33%	0.329	S	S	*	.	H	α-helix	trans	-56.1	-42.6	175.4	-69.3	167.9	-172.9	175.7	0	111.8	W116 Q236 F237 E238 F244	W116-K240 HydrophobicContact CZ2-CB 4.5Å; Q236-K240 WeakPolarHBondContact O-CG 3.29Å; Q236-K240 PolarHBondContact O-N 2.98Å; F237-K240 PolarHBondContact O-N 2.81Å; E238-K240 VanDerWaalsContact C-N 3.32Å; E238-K240 PolarHBondContact O-N 2.87Å; K240-F244 WeakPolarHBondContact O-CB 3.42Å; K240-F244 PolarHBondContact O-N 3.47Å
241	R	98.8	Very high	98.8	Very high	17 Å²	17	69.4 Å²	69.4	6%	0.064	33%	0.333	C	S	.	.	H	α-helix	trans	-65.1	-46.7	176.6	-166.9	-173.6	71.9	80.5	7.7	111.3	W116 E238 E239 F244 L245	W116-R241 HydrophobicContact CH2-CB 3.61Å; W116-R241 HydrophobicContact CH2-CG 3.63Å; W116-R241 HydrophobicContact CZ2-CB 4.18Å; W116-R241 HydrophobicContact CZ3-CB 4.41Å; W116-R241 HydrophobicContact CZ3-CG 3.93Å; E238-R241 WeakPolarHBondContact O-CB 3.42Å; E238-R241 PolarHBondContact O-N 3.34Å; E238-R241 IonicContact OE1-CZ 2.68Å; E238-R241 IonicContact OE1-NE 3.67Å; E238-R241 IonicContact OE1-NH2 2.76Å; E238-R241 PolarHBondContact OE1-NH2 3.1Å; E238-R241 IonicContact OE2-CZ 3.04Å; E238-R241 IonicContact OE2-NE 2.67Å; E238-R241 PolarHBondContact OE2-NE 2.8Å; E238-R241 IonicContact OE2-NH2 2.66Å; E239-R241 VanDerWaalsContact C-N 3.27Å; E239-R241 PolarHBondContact O-N 3.43Å; R241-F244 PolarHBondContact O-N 3.28Å; R241-L245 HydrophobicContact CG-CD1 4.24Å; R241-L245 HydrophobicContact CG-CG 4.4Å; R241-L245 VanDerWaalsContact NH1-CD1 3.26Å; R241-L245 WeakPolarHBondContact O-CB 3.19Å; R241-L245 VanDerWaalsContact O-CG 3.3Å; R241-L245 WeakPolarHBondContact O-CG 3.23Å; R241-L245 PolarHBondContact O-N 3Å
242	L	98.8	Very high	98.8	Very high	96 Å²	96	67.3 Å²	67.3	50%	0.503	32%	0.324	S	S	.	.	H	α-helix	trans	-63.8	-43.5	-178.7	-67.7	174	0	0	0	112.3	E238 E239 K246	E238-L242 HydrophobicContact CG-CD1 3.95Å; E238-L242 HydrophobicContact CG-CG 4.19Å; E238-L242 WeakPolarHBondContact O-CG 3.34Å; E238-L242 PolarHBondContact O-N 3.26Å; E239-L242 PolarHBondContact O-N 3.09Å; E239-L242 VanDerWaalsContact O-N 3.15Å; L242-K246 WeakPolarHBondContact O-CB 3.4Å; L242-K246 PolarHBondContact O-N 2.97Å; L242-K246 VanDerWaalsContact O-N 3.13Å
243	V	98.8	Very high	98.8	Very high	70 Å²	70	67.7 Å²	67.7	42%	0.424	32%	0.324	S	S	.	.	H	α-helix	trans	-65.3	-48.4	175.5	174.8	0	0	0	0	110.6	E239 L245 K246 E247	E239-V243 HydrophobicContact CG-CG2 4.29Å; E239-V243 WeakPolarHBondContact O-CG2 3.13Å; E239-V243 PolarHBondContact O-N 3.32Å; V243-L245 PolarHBondContact O-N 3.43Å; V243-K246 WeakPolarHBondContact O-CB 3.38Å; V243-K246 PolarHBondContact O-N 3.38Å; V243-E247 PolarHBondContact O-N 3.28Å
244	F	98.9	Very high	98.8	Very high	17 Å²	17	68.9 Å²	68.9	8%	0.075	32%	0.324	C	S	.	.	H	α-helix	trans	-58.3	-47.6	178.7	171.5	-105.7	0	0	0	112.9	K112 V113 W116 K240 R241 K246 E247 V248	K112-F244 HydrophobicContact CG-CE2 3.93Å; K112-F244 HydrophobicContact CG-CZ 4.06Å; V113-F244 HydrophobicContact CB-CE1 4.49Å; V113-F244 HydrophobicContact CG2-CE1 4.21Å; V113-F244 HydrophobicContact CG2-CZ 4.33Å; W116-F244 HydrophobicContact CB-CD1 4.19Å; W116-F244 HydrophobicContact CB-CD2 4.34Å; W116-F244 HydrophobicContact CB-CE1 3.58Å; W116-F244 HydrophobicContact CB-CE2 3.73Å; W116-F244 HydrophobicContact CB-CZ 3.32Å; W116-F244 AromaticContact CD1-CD1 3.98Å; W116-F244 AromaticContact CD1-CD2 3.55Å; W116-F244 AromaticContact CD1-CE2 3.78Å; W116-F244 AromaticContact CD1-CG 3.66Å; W116-F244 AromaticContact CD2-CD1 3.42Å; W116-F244 HydrophobicContact CD2-CD1 3.42Å; W116-F244 VanDerWaalsContact CD2-CD1 3.42Å; W116-F244 HydrophobicContact CD2-CD2 4.41Å; W116-F244 AromaticContact CD2-CE1 3.67Å; W116-F244 HydrophobicContact CD2-CE1 3.67Å; W116-F244 AromaticContact CD2-CG 3.85Å; W116-F244 HydrophobicContact CD2-CG 3.85Å; W116-F244 HydrophobicContact CD2-CZ 4.26Å; W116-F244 AromaticContact CE2-CD1 3.84Å; W116-F244 AromaticContact CE2-CG 3.87Å; W116-F244 AromaticContact CE3-CD1 3.73Å; W116-F244 HydrophobicContact CE3-CD1 3.73Å; W116-F244 AromaticContact CE3-CE1 3.86Å; W116-F244 HydrophobicContact CE3-CE1 3.86Å; W116-F244 AromaticContact CG-CD1 3.6Å; W116-F244 HydrophobicContact CG-CD1 3.6Å; W116-F244 AromaticContact CG-CD2 3.85Å; W116-F244 HydrophobicContact CG-CD2 3.85Å; W116-F244 AromaticContact CG-CE1 3.52Å; W116-F244 HydrophobicContact CG-CE1 3.52Å; W116-F244 AromaticContact CG-CE2 3.75Å; W116-F244 HydrophobicContact CG-CE2 3.75Å; W116-F244 AromaticContact CG-CG 3.77Å; W116-F244 HydrophobicContact CG-CG 3.77Å; W116-F244 AromaticContact CG-CZ 3.6Å; W116-F244 HydrophobicContact CG-CZ 3.6Å; W116-F244 HydrophobicContact CZ2-CB 4.47Å; W116-F244 HydrophobicContact CZ3-CD1 4.42Å; W116-F244 AromaticContact NE1-CD2 3.97Å; W116-F244 AromaticContact NE1-CG 3.68Å; K240-F244 WeakPolarHBondContact O-CB 3.42Å; K240-F244 PolarHBondContact O-N 3.47Å; R241-F244 PolarHBondContact O-N 3.28Å; F244-K246 VanDerWaalsContact C-N 3.3Å; F244-K246 PolarHBondContact O-N 3.28Å; F244-E247 WeakPolarHBondContact O-CB 3.31Å; F244-E247 PolarHBondContact O-N 2.69Å; F244-V248 HydrophobicContact CD2-CG2 4.35Å; F244-V248 HydrophobicContact CE1-CG2 3.97Å; F244-V248 HydrophobicContact CE2-CG2 3.76Å; F244-V248 HydrophobicContact CZ-CG2 3.53Å; F244-V248 PolarHBondContact O-N 3.26Å
245	L	98.7	Very high	98.8	Very high	23 Å²	23	69.5 Å²	69.5	12%	0.12	33%	0.326	C	S	.	.	H	α-helix	trans	-66.3	-33.6	179.1	-67.2	-172.8	0	0	0	112.1	L42 R241 V243 V248 L249	L42-L245 HydrophobicContact CD2-CD2 3.68Å; R241-L245 HydrophobicContact CG-CD1 4.24Å; R241-L245 HydrophobicContact CG-CG 4.4Å; R241-L245 VanDerWaalsContact NH1-CD1 3.26Å; R241-L245 WeakPolarHBondContact O-CB 3.19Å; R241-L245 VanDerWaalsContact O-CG 3.3Å; R241-L245 WeakPolarHBondContact O-CG 3.23Å; R241-L245 PolarHBondContact O-N 3Å; V243-L245 PolarHBondContact O-N 3.43Å; L245-V248 PolarHBondContact O-N 3.01Å; L245-L249 WeakPolarHBondContact O-CB 3.31Å; L245-L249 VanDerWaalsContact O-CG 3.22Å; L245-L249 WeakPolarHBondContact O-CG 3.36Å; L245-L249 PolarHBondContact O-N 3.04Å
246	K	98.8	Very high	98.7	Very high	142 Å²	142	68.4 Å²	68.4	62%	0.617	32%	0.322	S	S	*	.	H	α-helix	trans	-62.4	-41.6	172.1	178.8	-173	172.5	-171.4	0	111.8	L242 V243 F244 L249 L250	L242-K246 WeakPolarHBondContact O-CB 3.4Å; L242-K246 PolarHBondContact O-N 2.97Å; L242-K246 VanDerWaalsContact O-N 3.13Å; V243-K246 WeakPolarHBondContact O-CB 3.38Å; V243-K246 PolarHBondContact O-N 3.38Å; F244-K246 VanDerWaalsContact C-N 3.3Å; F244-K246 PolarHBondContact O-N 3.28Å; K246-L249 PolarHBondContact O-N 3.23Å; K246-L250 WeakPolarHBondContact O-CG 3.23Å; K246-L250 PolarHBondContact O-N 3.04Å
247	E	98.8	Very high	98.7	Very high	98 Å²	98	66.2 Å²	66.2	46%	0.458	31%	0.314	S	S	.	.	H	α-helix	trans	-62.8	-48.9	175.5	-69.6	175.2	-176.1	0	0	111.4	V243 F244 L249 L250 D251	V243-E247 PolarHBondContact O-N 3.28Å; F244-E247 WeakPolarHBondContact O-CB 3.31Å; F244-E247 PolarHBondContact O-N 2.69Å; E247-L249 VanDerWaalsContact C-N 3.31Å; E247-L249 PolarHBondContact O-N 3.36Å; E247-L250 WeakPolarHBondContact O-CB 3.48Å; E247-L250 PolarHBondContact O-N 2.9Å; E247-D251 PolarHBondContact O-N 3.35Å
248	V	98.8	Very high	98.6	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-59.5	-39.6	177.3	172.9	0	0	0	0	112	L42 K112 V113 F244 L245 L250 D251 I252	L42-V248 HydrophobicContact CD2-CG1 4.28Å; K112-V248 HydrophobicContact CD-CG2 4.1Å; K112-V248 HydrophobicContact CG-CG2 4.24Å; V113-V248 HydrophobicContact CG2-CB 4.38Å; V113-V248 HydrophobicContact CG2-CG1 3.7Å; V113-V248 HydrophobicContact CG2-CG2 4.05Å; F244-V248 HydrophobicContact CD2-CG2 4.35Å; F244-V248 HydrophobicContact CE1-CG2 3.97Å; F244-V248 HydrophobicContact CE2-CG2 3.76Å; F244-V248 HydrophobicContact CZ-CG2 3.53Å; F244-V248 PolarHBondContact O-N 3.26Å; L245-V248 PolarHBondContact O-N 3.01Å; V248-L250 VanDerWaalsContact C-N 3.26Å; V248-L250 PolarHBondContact O-N 3.41Å; V248-D251 PolarHBondContact O-N 3Å; V248-I252 HydrophobicContact CG1-CD1 3.74Å; V248-I252 HydrophobicContact CG1-CG1 4.31Å; V248-I252 VanDerWaalsContact O-CG1 3.29Å; V248-I252 WeakPolarHBondContact O-CG1 3.31Å; V248-I252 PolarHBondContact O-N 2.62Å
249	L	98.9	Very high	98.4	Very high	98 Å²	98	67.9 Å²	67.9	51%	0.513	34%	0.336	S	S	.	.	H	α-helix	trans	-64.7	-29.5	176.3	-72.6	168.6	0	0	0	112.9	L42 L245 K246 E247 K253	L42-L249 HydrophobicContact CD1-CD2 4.34Å; L245-L249 WeakPolarHBondContact O-CB 3.31Å; L245-L249 VanDerWaalsContact O-CG 3.22Å; L245-L249 WeakPolarHBondContact O-CG 3.36Å; L245-L249 PolarHBondContact O-N 3.04Å; K246-L249 PolarHBondContact O-N 3.23Å; E247-L249 VanDerWaalsContact C-N 3.31Å; E247-L249 PolarHBondContact O-N 3.36Å; L249-K253 PolarHBondContact O-N 3.18Å
250	L	98.8	Very high	98.2	Very high	107 Å²	107	68.3 Å²	68.3	56%	0.56	34%	0.338	S	S	*	.	H	α-helix	trans	-75.9	-37.3	173.4	-68.5	169.1	0	0	0	112	K246 E247 V248 K253 R254	K246-L250 WeakPolarHBondContact O-CG 3.23Å; K246-L250 PolarHBondContact O-N 3.04Å; E247-L250 WeakPolarHBondContact O-CB 3.48Å; E247-L250 PolarHBondContact O-N 2.9Å; V248-L250 VanDerWaalsContact C-N 3.26Å; V248-L250 PolarHBondContact O-N 3.41Å; L250-K253 PolarHBondContact O-N 2.74Å; L250-R254 PolarHBondContact O-N 3.37Å
251	D	98.7	Very high	97.9	Very high	33 Å²	33	63.7 Å²	63.7	18%	0.176	32%	0.319	C	S	.	.	H	α-helix	trans	-62.9	-46.3	172.4	-66.1	-36.6	0	0	0	110.8	D109 K112 E247 V248 K253 R254 H255	D109-D251 WeakPolarHBondContact OD1-CB 3.22Å; K112-D251 IonicContact NZ-OD2 3.52Å; K112-D251 PolarHBondContact NZ-OD2 3.13Å; E247-D251 PolarHBondContact O-N 3.35Å; V248-D251 PolarHBondContact O-N 3Å; D251-K253 PolarHBondContact O-N 3.41Å; D251-R254 WeakPolarHBondContact O-CA 3.38Å; D251-R254 VanDerWaalsContact O-CB 3.31Å; D251-R254 WeakPolarHBondContact O-CB 3.39Å; D251-R254 PolarHBondContact O-N 2.81Å; D251-H255 PolarHBondContact O-N 3.39Å; D251-H255 PolarHBondContact O-ND1 3.42Å
252	I	98.8	Very high	97.7	Very high	21 Å²	21	67.3 Å²	67.3	11%	0.108	35%	0.347	C	S	.	.	H	α-helix	trans	-57	-46.7	172.9	-68.6	163.3	0	0	0	110.9	V46 L105 D109 V248 R254 H255 L256	V46-I252 HydrophobicContact CG2-CD1 3.58Å; V46-I252 HydrophobicContact CG2-CG1 4.43Å; L105-I252 HydrophobicContact CD2-CG1 4.35Å; L105-I252 HydrophobicContact CD2-CG2 4.04Å; D109-I252 HydrophobicContact CB-CD1 4.41Å; D109-I252 HydrophobicContact CB-CG1 3.79Å; V248-I252 HydrophobicContact CG1-CD1 3.74Å; V248-I252 HydrophobicContact CG1-CG1 4.31Å; V248-I252 VanDerWaalsContact O-CG1 3.29Å; V248-I252 WeakPolarHBondContact O-CG1 3.31Å; V248-I252 PolarHBondContact O-N 2.62Å; I252-R254 PolarHBondContact O-N 3.33Å; I252-H255 PolarHBondContact O-N 3.21Å; I252-L256 HydrophobicContact CG2-CD1 3.68Å; I252-L256 HydrophobicContact CG2-CG 4.15Å; I252-L256 WeakPolarHBondContact O-CB 3.28Å; I252-L256 WeakPolarHBondContact O-CG 3.41Å; I252-L256 PolarHBondContact O-N 3.22Å
253	K	98.5	Very high	97.6	Very high	99 Å²	99	65.8 Å²	65.8	43%	0.43	34%	0.344	S	S	.	.	H	α-helix	trans	-53.9	-43.3	174.3	175.4	-90.2	164.6	-176.8	0	111.2	L249 L250 D251 N257 E260	L249-K253 PolarHBondContact O-N 3.18Å; L250-K253 PolarHBondContact O-N 2.74Å; D251-K253 PolarHBondContact O-N 3.41Å; K253-N257 PolarHBondContact NZ-ND2 2.97Å; K253-N257 WeakPolarHBondContact O-CB 3.08Å; K253-N257 PolarHBondContact O-N 2.81Å; K253-E260 VanDerWaalsContact NZ-CD 3.26Å; K253-E260 IonicContact NZ-OE1 2.7Å; K253-E260 PolarHBondContact NZ-OE1 2.91Å; K253-E260 IonicContact NZ-OE2 3.53Å; K253-E260 PolarHBondContact NZ-OE2 3.4Å
254	R	98.4	Very high	97.4	Very high	141 Å²	141	65.9 Å²	65.9	53%	0.532	34%	0.338	S	S	.	.	H	α-helix	trans	-66.5	-47.6	-177.9	-175.9	-172.9	69	-179.3	3.7	110.7	L250 D251 I252 L256 N257	L250-R254 PolarHBondContact O-N 3.37Å; D251-R254 WeakPolarHBondContact O-CA 3.38Å; D251-R254 VanDerWaalsContact O-CB 3.31Å; D251-R254 WeakPolarHBondContact O-CB 3.39Å; D251-R254 PolarHBondContact O-N 2.81Å; I252-R254 PolarHBondContact O-N 3.33Å; R254-L256 VanDerWaalsContact C-N 3.32Å; R254-L256 PolarHBondContact O-N 2.96Å; R254-N257 PolarHBondContact O-N 3.39Å
255	H	98.6	Very high	97.3	Very high	20 Å²	20	68.7 Å²	68.7	9%	0.093	35%	0.353	C	S	.	.	H	α-helix	trans	-67	-31.3	-179.3	-61.3	149.4	0	0	0	113.3	V101 N104 E108 D109 D251 I252 N257	V101-H255 WeakPolarHBondContact CG2-O 3.43Å; N104-H255 HydrophobicContact CB-CB 4.07Å; E108-H255 IonicContact OE2-CE1 3.35Å; E108-H255 IonicContact OE2-NE2 3.98Å; D109-H255 VanDerWaalsContact CG-ND1 3.29Å; D109-H255 IonicContact OD1-CE1 3.96Å; D109-H255 PolarHBondContact OD1-CE1 2.91Å; D109-H255 VanDerWaalsContact OD1-CE1 3.26Å; D109-H255 IonicContact OD1-ND1 2.63Å; D109-H255 PolarHBondContact OD1-ND1 3.18Å; D109-H255 VanDerWaalsContact OD1-ND1 3.09Å; D109-H255 IonicContact OD2-CE1 2.88Å; D109-H255 IonicContact OD2-CG 2.76Å; D109-H255 IonicContact OD2-ND1 2.73Å; D109-H255 PolarHBondContact OD2-ND1 3Å; D251-H255 PolarHBondContact O-N 3.39Å; D251-H255 PolarHBondContact O-ND1 3.42Å; I252-H255 PolarHBondContact O-N 3.21Å; H255-N257 VanDerWaalsContact C-N 3.35Å
256	L	98.6	Very high	97.2	Very high	45 Å²	45	72.5 Å²	72.5	24%	0.236	37%	0.37	C	S	.	.	H	α-helix	trans	-75.6	-17.1	175.6	-67.8	177.7	0	0	0	114.3	R49 V101 L105 I252 R254 L258	R49-L256 HydrophobicContact CG-CD2 4.29Å; V101-L256 HydrophobicContact CG1-CD2 3.7Å; L105-L256 HydrophobicContact CD1-CD2 3.89Å; L105-L256 HydrophobicContact CD2-CD2 4.09Å; L105-L256 HydrophobicContact CD2-CG 4.36Å; L105-L256 HydrophobicContact CG-CD2 4.38Å; I252-L256 HydrophobicContact CG2-CD1 3.68Å; I252-L256 HydrophobicContact CG2-CG 4.15Å; I252-L256 WeakPolarHBondContact O-CB 3.28Å; I252-L256 WeakPolarHBondContact O-CG 3.41Å; I252-L256 PolarHBondContact O-N 3.22Å; R254-L256 VanDerWaalsContact C-N 3.32Å; R254-L256 PolarHBondContact O-N 2.96Å; L256-L258 PolarHBondContact O-N 3.44Å
257	N	98	Very high	97.2	Very high	46 Å²	46	66.2 Å²	66.2	25%	0.246	34%	0.343	C	S	.	.			trans	-93	76.9	-165.6	-166.9	15.7	0	0	0	114.5	K253 R254 H255 A259 E260	K253-N257 PolarHBondContact NZ-ND2 2.97Å; K253-N257 WeakPolarHBondContact O-CB 3.08Å; K253-N257 PolarHBondContact O-N 2.81Å; R254-N257 PolarHBondContact O-N 3.39Å; H255-N257 VanDerWaalsContact C-N 3.35Å; N257-A259 PolarHBondContact O-N 3.13Å; N257-A259 VanDerWaalsContact O-N 3.14Å; N257-A259 WeakPolarHBondContact OD1-CB 3.45Å; N257-A259 PolarHBondContact OD1-N 3.05Å; N257-E260 VanDerWaalsContact ND2-CG 3.33Å; N257-E260 WeakPolarHBondContact ND2-CG 3.46Å; N257-E260 PolarHBondContact ND2-OE1 3.09Å; N257-E260 VanDerWaalsContact ND2-OE1 3.13Å; N257-E260 PolarHBondContact ND2-OE2 3.3Å; N257-E260 PolarHBondContact O-N 3.31Å; N257-E260 VanDerWaalsContact O-N 3.15Å
258	L	97.1	Very high	97.2	Very high	19 Å²	19	65.6 Å²	65.6	10%	0.099	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-60.8	-19.6	175.6	-65.4	-179.4	0	0	0	114.2	L97 V101 L256 E260 N261 Y264	L97-L258 HydrophobicContact CB-CD1 4.5Å; L97-L258 HydrophobicContact CB-CD2 4.21Å; V101-L258 HydrophobicContact CG2-CD1 4.41Å; V101-L258 HydrophobicContact CG2-CD2 3.79Å; V101-L258 HydrophobicContact CG2-CG 4.13Å; L256-L258 PolarHBondContact O-N 3.44Å; L258-E260 VanDerWaalsContact C-N 3.26Å; L258-E260 PolarHBondContact O-N 2.99Å; L258-N261 HydrophobicContact CD2-CB 4.44Å; L258-N261 WeakPolarHBondContact O-CB 3.41Å; L258-N261 PolarHBondContact O-N 3.41Å; L258-Y264 HydrophobicContact CB-CD2 4.24Å; L258-Y264 HydrophobicContact CB-CG 4.24Å; L258-Y264 HydrophobicContact CD1-CD2 4.35Å; L258-Y264 HydrophobicContact CD1-CE2 4.43Å; L258-Y264 WeakPolarHBondContact O-CB 3.43Å
259	A	94.9	Very high	97.2	Very high	77 Å²	77	73.4 Å²	73.4	64%	0.636	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-68.9	-23	176.6	0	0	0	0	0	113.4	N257	N257-A259 PolarHBondContact O-N 3.13Å; N257-A259 VanDerWaalsContact O-N 3.14Å; N257-A259 WeakPolarHBondContact OD1-CB 3.45Å; N257-A259 PolarHBondContact OD1-N 3.05Å
260	E	93.3	Very high	97.1	Very high	130 Å²	130	71.9 Å²	71.9	61%	0.607	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-89.7	-3.5	171.7	-76.9	164.1	-174.6	0	0	112.2	K253 N257 L258	K253-E260 VanDerWaalsContact NZ-CD 3.26Å; K253-E260 IonicContact NZ-OE1 2.7Å; K253-E260 PolarHBondContact NZ-OE1 2.91Å; K253-E260 IonicContact NZ-OE2 3.53Å; K253-E260 PolarHBondContact NZ-OE2 3.4Å; N257-E260 VanDerWaalsContact ND2-CG 3.33Å; N257-E260 WeakPolarHBondContact ND2-CG 3.46Å; N257-E260 PolarHBondContact ND2-OE1 3.09Å; N257-E260 VanDerWaalsContact ND2-OE1 3.13Å; N257-E260 PolarHBondContact ND2-OE2 3.3Å; N257-E260 PolarHBondContact O-N 3.31Å; N257-E260 VanDerWaalsContact O-N 3.15Å; L258-E260 VanDerWaalsContact C-N 3.26Å; L258-E260 PolarHBondContact O-N 2.99Å
261	N	92.8	Very high	97.1	Very high	39 Å²	39	68.1 Å²	68.1	21%	0.209	34%	0.337	C	S	.	.			trans	-87.5	120.4	-177.7	-171.6	-35.2	0	0	0	111.5	L258 S263 Y264 I265	L258-N261 HydrophobicContact CD2-CB 4.44Å; L258-N261 WeakPolarHBondContact O-CB 3.41Å; L258-N261 PolarHBondContact O-N 3.41Å; N261-S263 VanDerWaalsContact C-N 3.32Å; N261-S263 PolarHBondContact O-N 3.31Å; N261-S263 VanDerWaalsContact OD1-CB 3.26Å; N261-S263 WeakPolarHBondContact OD1-CB 3.41Å; N261-S263 PolarHBondContact OD1-N 3.07Å; N261-Y264 WeakPolarHBondContact O-CB 3.36Å; N261-Y264 PolarHBondContact O-N 2.91Å; N261-I265 PolarHBondContact O-N 3.02Å
262	S	94.3	Very high	97.1	Very high	93 Å²	93	71 Å²	71	65%	0.65	35%	0.35	S	S	*	.	H	α-helix	trans	-66.3	-29.8	-179.3	53.2	0	0	0	0	113.8	I265 H266	S262-I265 PolarHBondContact O-N 3.41Å; S262-H266 PolarHBondContact O-N 3.17Å
263	S	96.1	Very high	97.1	Very high	63 Å²	63	77 Å²	77	44%	0.441	38%	0.377	S	S	.	.	H	α-helix	trans	-65.6	-40.7	175.1	-58.6	0	0	0	0	111.1	N261 I265 H266 V267	N261-S263 VanDerWaalsContact C-N 3.32Å; N261-S263 PolarHBondContact O-N 3.31Å; N261-S263 VanDerWaalsContact OD1-CB 3.26Å; N261-S263 WeakPolarHBondContact OD1-CB 3.41Å; N261-S263 PolarHBondContact OD1-N 3.07Å; S263-I265 VanDerWaalsContact C-N 3.31Å; S263-I265 PolarHBondContact O-N 3.44Å; S263-H266 WeakPolarHBondContact O-CA 3.31Å; S263-H266 WeakPolarHBondContact O-CB 3.46Å; S263-H266 PolarHBondContact O-N 2.9Å; S263-V267 WeakPolarHBondContact O-CG2 3.32Å; S263-V267 PolarHBondContact O-N 2.93Å
264	Y	96.4	Very high	97.1	Very high	72 Å²	72	74 Å²	74	28%	0.282	37%	0.371	S	S	.	.	H	α-helix	trans	-59.5	-41.8	175.9	-170.8	-104.3	0	0	0	111.5	V94 L97 L258 N261 H266 V267 Y268	V94-Y264 HydrophobicContact CG2-CE2 4.43Å; L97-Y264 HydrophobicContact CD1-CD2 3.85Å; L97-Y264 HydrophobicContact CD1-CG 4.45Å; L258-Y264 HydrophobicContact CB-CD2 4.24Å; L258-Y264 HydrophobicContact CB-CG 4.24Å; L258-Y264 HydrophobicContact CD1-CD2 4.35Å; L258-Y264 HydrophobicContact CD1-CE2 4.43Å; L258-Y264 WeakPolarHBondContact O-CB 3.43Å; N261-Y264 WeakPolarHBondContact O-CB 3.36Å; N261-Y264 PolarHBondContact O-N 2.91Å; Y264-H266 VanDerWaalsContact C-N 3.33Å; Y264-H266 PolarHBondContact O-N 3.4Å; Y264-V267 PolarHBondContact O-N 3.17Å; Y264-Y268 HydrophobicContact CD1-CE2 4.24Å; Y264-Y268 HydrophobicContact CD2-CE2 4.27Å; Y264-Y268 HydrophobicContact CE1-CD2 4.44Å; Y264-Y268 AromaticContact CE1-CE2 3.79Å; Y264-Y268 HydrophobicContact CE1-CE2 3.79Å; Y264-Y268 AromaticContact CE2-CE2 3.84Å; Y264-Y268 HydrophobicContact CE2-CE2 3.84Å; Y264-Y268 HydrophobicContact CG-CE2 4.46Å; Y264-Y268 AromaticContact CZ-CE2 3.58Å; Y264-Y268 VanDerWaalsContact O-CD2 3.28Å; Y264-Y268 WeakPolarHBondContact O-CD2 3.39Å
265	I	96	Very high	97.1	Very high	77 Å²	77	71.5 Å²	71.5	40%	0.395	37%	0.367	S	S	.	.	H	α-helix	trans	-65.4	-35.7	173.9	-60.3	172.3	0	0	0	111.6	N261 S262 S263 R269	N261-I265 PolarHBondContact O-N 3.02Å; S262-I265 PolarHBondContact O-N 3.41Å; S263-I265 VanDerWaalsContact C-N 3.31Å; S263-I265 PolarHBondContact O-N 3.44Å; I265-R269 WeakPolarHBondContact O-CG 3.49Å; I265-R269 PolarHBondContact O-N 3.47Å
266	H	97.3	Very high	97.1	Very high	103 Å²	103	79.5 Å²	79.5	48%	0.477	40%	0.397	S	S	.	.	H	α-helix	trans	-66.5	-41.6	179.8	-171.2	47.9	0	0	0	112.3	S262 S263 Y264 Y268 R269 E270	S262-H266 PolarHBondContact O-N 3.17Å; S263-H266 WeakPolarHBondContact O-CA 3.31Å; S263-H266 WeakPolarHBondContact O-CB 3.46Å; S263-H266 PolarHBondContact O-N 2.9Å; Y264-H266 VanDerWaalsContact C-N 3.33Å; Y264-H266 PolarHBondContact O-N 3.4Å; H266-Y268 VanDerWaalsContact C-N 3.34Å; H266-Y268 PolarHBondContact O-N 3.25Å; H266-R269 WeakPolarHBondContact O-CB 3.33Å; H266-R269 PolarHBondContact O-N 3.31Å; H266-E270 IonicContact CD2-OE2 3.8Å; H266-E270 PolarHBondContact CD2-OE2 3.48Å; H266-E270 IonicContact CG-OE2 3.68Å; H266-E270 IonicContact NE2-OE1 2.69Å; H266-E270 IonicContact NE2-OE2 2.77Å; H266-E270 PolarHBondContact O-N 2.97Å
267	V	98.4	Very high	97.1	Very high	9 Å²	9	79.6 Å²	79.6	6%	0.055	41%	0.409	C	S	.	.	H	α-helix	trans	-50.5	-51.4	178.3	171.9	0	0	0	0	111.8	E90 K93 V94 L97 S263 Y264 R269 E270 L271	E90-V267 HydrophobicContact CB-CG1 4.06Å; E90-V267 HydrophobicContact CG-CG1 3.52Å; K93-V267 HydrophobicContact CB-CG1 4.25Å; K93-V267 HydrophobicContact CB-CG2 3.68Å; K93-V267 HydrophobicContact CD-CG2 4.01Å; K93-V267 HydrophobicContact CG-CG2 4.46Å; V94-V267 HydrophobicContact CG2-CG1 4.22Å; L97-V267 HydrophobicContact CD1-CG2 4.38Å; S263-V267 WeakPolarHBondContact O-CG2 3.32Å; S263-V267 PolarHBondContact O-N 2.93Å; Y264-V267 PolarHBondContact O-N 3.17Å; V267-R269 PolarHBondContact O-N 3.19Å; V267-E270 PolarHBondContact O-N 3.5Å; V267-L271 PolarHBondContact O-N 3.14Å
268	Y	98.1	Very high	97.1	Very high	86 Å²	86	79.3 Å²	79.3	34%	0.337	41%	0.412	S	S	.	.	H	α-helix	trans	-70.8	-28.7	-178.9	-66.4	-70.7	0	0	0	113.6	E90 Y264 H266 L271 E272	E90-Y268 HydrophobicContact CG-CD1 4.4Å; E90-Y268 HydrophobicContact CG-CE1 3.85Å; E90-Y268 WeakPolarHBondContact OE1-CE1 3.43Å; E90-Y268 PolarHBondContact OE1-OH 2.86Å; Y264-Y268 HydrophobicContact CD1-CE2 4.24Å; Y264-Y268 HydrophobicContact CD2-CE2 4.27Å; Y264-Y268 HydrophobicContact CE1-CD2 4.44Å; Y264-Y268 AromaticContact CE1-CE2 3.79Å; Y264-Y268 HydrophobicContact CE1-CE2 3.79Å; Y264-Y268 AromaticContact CE2-CE2 3.84Å; Y264-Y268 HydrophobicContact CE2-CE2 3.84Å; Y264-Y268 HydrophobicContact CG-CE2 4.46Å; Y264-Y268 AromaticContact CZ-CE2 3.58Å; Y264-Y268 VanDerWaalsContact O-CD2 3.28Å; Y264-Y268 WeakPolarHBondContact O-CD2 3.39Å; H266-Y268 VanDerWaalsContact C-N 3.34Å; H266-Y268 PolarHBondContact O-N 3.25Å; Y268-L271 HydrophobicContact CD1-CD2 4.42Å; Y268-E272 WeakPolarHBondContact O-CB 3.3Å; Y268-E272 PolarHBondContact O-N 3.05Å
269	R	98.2	Very high	97.2	Very high	164 Å²	164	81.4 Å²	81.4	62%	0.619	42%	0.423	S	S	*	.	H	α-helix	trans	-69.3	-41.5	173.4	-70.6	176.1	179.7	173.8	2.7	112	I265 H266 V267 E272 Q273	I265-R269 WeakPolarHBondContact O-CG 3.49Å; I265-R269 PolarHBondContact O-N 3.47Å; H266-R269 WeakPolarHBondContact O-CB 3.33Å; H266-R269 PolarHBondContact O-N 3.31Å; V267-R269 PolarHBondContact O-N 3.19Å; R269-E272 PolarHBondContact O-N 2.82Å; R269-Q273 WeakPolarHBondContact O-CB 3.42Å; R269-Q273 PolarHBondContact O-N 3Å
270	E	98.4	Very high	97.3	Very high	66 Å²	66	80.8 Å²	80.8	31%	0.308	42%	0.419	S	S	.	.	H	α-helix	trans	-65.3	-40.5	174.7	-70	179.3	92.3	0	0	111.4	K93 H266 V267 Q273 A274	K93-E270 IonicContact NZ-OE1 3.16Å; K93-E270 PolarHBondContact NZ-OE1 2.9Å; K93-E270 IonicContact NZ-OE2 3.82Å; K93-E270 PolarHBondContact NZ-OE2 3.42Å; H266-E270 IonicContact CD2-OE2 3.8Å; H266-E270 PolarHBondContact CD2-OE2 3.48Å; H266-E270 IonicContact CG-OE2 3.68Å; H266-E270 IonicContact NE2-OE1 2.69Å; H266-E270 IonicContact NE2-OE2 2.77Å; H266-E270 PolarHBondContact O-N 2.97Å; V267-E270 PolarHBondContact O-N 3.5Å; E270-Q273 PolarHBondContact O-N 3.39Å; E270-A274 WeakPolarHBondContact O-CB 3.45Å; E270-A274 PolarHBondContact O-N 3.36Å
271	L	98.7	Very high	97.6	Very high	27 Å²	27	80.5 Å²	80.5	14%	0.141	42%	0.417	C	S	.	.	H	α-helix	trans	-60.2	-49.3	174.1	178.1	60.9	0	0	0	111.5	A86 I87 E90 V267 Y268 Q273 A274 I275	A86-L271 HydrophobicContact CB-CD1 3.89Å; I87-L271 HydrophobicContact CG1-CD1 4.11Å; E90-L271 HydrophobicContact CB-CD2 4.03Å; E90-L271 HydrophobicContact CG-CD2 4.02Å; V267-L271 PolarHBondContact O-N 3.14Å; Y268-L271 HydrophobicContact CD1-CD2 4.42Å; L271-Q273 VanDerWaalsContact C-N 3.32Å; L271-Q273 PolarHBondContact O-N 3.25Å; L271-A274 PolarHBondContact O-N 3.04Å; L271-I275 HydrophobicContact CD1-CD1 3.83Å; L271-I275 HydrophobicContact CD1-CG1 4.26Å; L271-I275 HydrophobicContact CG-CD1 3.9Å; L271-I275 WeakPolarHBondContact O-CG1 3.23Å; L271-I275 PolarHBondContact O-N 3.06Å
272	E	98.7	Very high	97.8	Very high	94 Å²	94	83 Å²	83	44%	0.439	43%	0.428	S	S	.	.	H	α-helix	trans	-58.8	-43.8	176.5	-174.5	-175.8	178.5	0	0	111.5	Y268 R269 A274 I275 R276	Y268-E272 WeakPolarHBondContact O-CB 3.3Å; Y268-E272 PolarHBondContact O-N 3.05Å; R269-E272 PolarHBondContact O-N 2.82Å; E272-A274 PolarHBondContact O-N 3.15Å; E272-I275 PolarHBondContact O-N 3.05Å; E272-R276 HydrophobicContact CG-CG 4.38Å; E272-R276 WeakPolarHBondContact O-CB 3.4Å; E272-R276 WeakPolarHBondContact O-CG 3.3Å; E272-R276 PolarHBondContact O-N 3Å; E272-R276 IonicContact OE1-CZ 3.78Å; E272-R276 IonicContact OE1-NE 2.64Å; E272-R276 PolarHBondContact OE1-NE 3.22Å; E272-R276 IonicContact OE1-NH2 2.71Å; E272-R276 PolarHBondContact OE1-NH2 2.73Å
273	Q	98.5	Very high	98	Very high	147 Å²	147	79.5 Å²	79.5	69%	0.687	40%	0.402	S	S	*	.	H	α-helix	trans	-62.4	-41.7	177.8	-176.8	177.6	-8.1	0	0	112.1	R269 E270 L271 G277	R269-Q273 WeakPolarHBondContact O-CB 3.42Å; R269-Q273 PolarHBondContact O-N 3Å; E270-Q273 PolarHBondContact O-N 3.39Å; L271-Q273 VanDerWaalsContact C-N 3.32Å; L271-Q273 PolarHBondContact O-N 3.25Å; Q273-G277 PolarHBondContact O-N 2.65Å; Q273-G277 VanDerWaalsContact O-N 3.07Å
274	A	98.3	Very high	98.2	Very high	37 Å²	37	81.6 Å²	81.6	31%	0.306	41%	0.407	S	S	.	.	H	α-helix	trans	-65.5	-41.6	177.6	0	0	0	0	0	112.1	A86 E270 L271 E272 G277	A86-A274 HydrophobicContact CB-CB 3.45Å; A86-A274 VanDerWaalsContact CB-CB 3.45Å; E270-A274 WeakPolarHBondContact O-CB 3.45Å; E270-A274 PolarHBondContact O-N 3.36Å; L271-A274 PolarHBondContact O-N 3.04Å; E272-A274 PolarHBondContact O-N 3.15Å; A274-G277 PolarHBondContact O-N 3.14Å
275	I	98.6	Very high	98.3	Very high	87 Å²	87	85.5 Å²	85.5	45%	0.446	42%	0.422	S	S	.	.	H	α-helix	trans	-66.1	-45.6	177.1	-66.9	167.7	0	0	0	111.1	L271 E272 G277 A278	L271-I275 HydrophobicContact CD1-CD1 3.83Å; L271-I275 HydrophobicContact CD1-CG1 4.26Å; L271-I275 HydrophobicContact CG-CD1 3.9Å; L271-I275 WeakPolarHBondContact O-CG1 3.23Å; L271-I275 PolarHBondContact O-N 3.06Å; E272-I275 PolarHBondContact O-N 3.05Å; I275-G277 PolarHBondContact O-N 2.83Å; I275-A278 PolarHBondContact O-N 2.76Å
276	R	98.4	Very high	98.4	Very high	189 Å²	189	87.7 Å²	87.7	71%	0.713	43%	0.425	S	S	*	.	H	α-helix	trans	-64.4	-17.5	174.8	-71.6	179.3	-178.8	-84.7	3.4	113.5	E272 A278	E272-R276 HydrophobicContact CG-CG 4.38Å; E272-R276 WeakPolarHBondContact O-CB 3.4Å; E272-R276 WeakPolarHBondContact O-CG 3.3Å; E272-R276 PolarHBondContact O-N 3Å; E272-R276 IonicContact OE1-CZ 3.78Å; E272-R276 IonicContact OE1-NE 2.64Å; E272-R276 PolarHBondContact OE1-NE 3.22Å; E272-R276 IonicContact OE1-NH2 2.71Å; E272-R276 PolarHBondContact OE1-NH2 2.73Å; R276-A278 VanDerWaalsContact C-N 3.32Å
277	G	98.1	Very high	98.4	Very high	47 Å²	47	87 Å²	87	49%	0.485	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-1.4	176.1	0	0	0	0	0	115.1	Q273 A274 I275	Q273-G277 PolarHBondContact O-N 2.65Å; Q273-G277 VanDerWaalsContact O-N 3.07Å; A274-G277 PolarHBondContact O-N 3.14Å; I275-G277 PolarHBondContact O-N 2.83Å
278	A	98.4	Very high	98.4	Very high	39 Å²	39	94.3 Å²	94.3	32%	0.322	45%	0.447	S	S	.	.			trans	-74	123.5	172.9	0	0	0	0	0	111.3	A83 I275 R276	A83-A278 HydrophobicContact CB-CB 4.04Å; I275-A278 PolarHBondContact O-N 2.76Å; R276-A278 VanDerWaalsContact C-N 3.32Å
279	D	98.5	Very high	98.4	Very high	63 Å²	63	93.1 Å²	93.1	34%	0.337	45%	0.452	S	S	.	.			trans	-120.6	102.7	177.8	179.8	1.2	0	0	0	110.5	S79 Q281 E282 D283 R285	S79-D279 PolarHBondContact OG-N 3.47Å; S79-D279 PolarHBondContact OG-O 3.02Å; D279-Q281 PolarHBondContact O-N 3.35Å; D279-Q281 WeakPolarHBondContact OD1-CA 3.48Å; D279-Q281 WeakPolarHBondContact OD1-CB 3.46Å; D279-Q281 PolarHBondContact OD1-N 2.81Å; D279-E282 HydrophobicContact CB-CB 3.82Å; D279-E282 VanDerWaalsContact CG-N 3.32Å; D279-E282 WeakPolarHBondContact O-CB 3.42Å; D279-E282 PolarHBondContact O-N 3.1Å; D279-E282 VanDerWaalsContact O-N 3.14Å; D279-E282 PolarHBondContact OD1-N 3.19Å; D279-E282 PolarHBondContact OD2-N 3.49Å; D279-D283 PolarHBondContact O-N 3.16Å; D279-R285 IonicContact OD2-NH2 2.71Å
280	A	98.5	Very high	98.3	Very high	65 Å²	65	88 Å²	88	54%	0.537	44%	0.438	S	S	.	.	H	α-helix	trans	-60.7	-28.2	176	0	0	0	0	0	113.2	L284	A280-L284 VanDerWaalsContact O-CB 3.26Å; A280-L284 WeakPolarHBondContact O-CB 3.47Å; A280-L284 WeakPolarHBondContact O-CD1 3.34Å; A280-L284 WeakPolarHBondContact O-CG 3.36Å; A280-L284 PolarHBondContact O-N 3.34Å
281	Q	98.6	Very high	98.2	Very high	123 Å²	123	88 Å²	88	58%	0.575	45%	0.446	S	S	*	.	H	α-helix	trans	-77.9	-31.6	176.6	-62.9	-62.4	-35.6	0	0	111.8	D279 R285	D279-Q281 PolarHBondContact O-N 3.35Å; D279-Q281 WeakPolarHBondContact OD1-CA 3.48Å; D279-Q281 WeakPolarHBondContact OD1-CB 3.46Å; D279-Q281 PolarHBondContact OD1-N 2.81Å; Q281-R285 VanDerWaalsContact O-CB 3.28Å; Q281-R285 WeakPolarHBondContact O-CB 3.46Å; Q281-R285 WeakPolarHBondContact O-CG 3.36Å; Q281-R285 PolarHBondContact O-N 2.97Å; Q281-R285 VanDerWaalsContact O-N 3.16Å; Q281-R285 PolarHBondContact O-NE 3.37Å
282	E	98.2	Very high	98.1	Very high	91 Å²	91	87.6 Å²	87.6	43%	0.425	45%	0.449	S	S	.	.	H	α-helix	trans	-60.6	-54.3	166.5	-173.4	176.3	-152.8	0	0	110.5	R82 D279 L284 R285 W286	R82-E282 IonicContact NH2-OE2 3.13Å; D279-E282 HydrophobicContact CB-CB 3.82Å; D279-E282 VanDerWaalsContact CG-N 3.32Å; D279-E282 WeakPolarHBondContact O-CB 3.42Å; D279-E282 PolarHBondContact O-N 3.1Å; D279-E282 VanDerWaalsContact O-N 3.14Å; D279-E282 PolarHBondContact OD1-N 3.19Å; D279-E282 PolarHBondContact OD2-N 3.49Å; E282-L284 PolarHBondContact O-N 3.14Å; E282-R285 PolarHBondContact O-N 3.02Å; E282-W286 PolarHBondContact O-N 3.46Å
283	D	98.5	Very high	98	Very high	20 Å²	20	89 Å²	89	11%	0.107	47%	0.466	C	S	.	.	H	α-helix	trans	-63.4	-41.7	-175.4	-69.6	-9.8	0	0	0	112.5	G78 S79 L80 D279 W286 F287	G78-D283 WeakPolarHBondContact CA-OD1 3.47Å; S79-D283 WeakPolarHBondContact CB-OD1 3.22Å; S79-D283 VanDerWaalsContact N-CG 3.34Å; S79-D283 PolarHBondContact N-OD1 3.48Å; S79-D283 PolarHBondContact N-OD2 3.33Å; S79-D283 VanDerWaalsContact N-OD2 3.11Å; S79-D283 PolarHBondContact OG-OD1 3.21Å; S79-D283 PolarHBondContact OG-OD2 2.89Å; L80-D283 PolarHBondContact N-OD2 3.04Å; L80-D283 VanDerWaalsContact N-OD2 3.17Å; D279-D283 PolarHBondContact O-N 3.16Å; D283-W286 PolarHBondContact O-N 3.32Å; D283-F287 PolarHBondContact O-N 3.04Å
284	L	98.5	Very high	98	Very high	107 Å²	107	84.1 Å²	84.1	56%	0.56	46%	0.455	S	S	*	.	H	α-helix	trans	-67.6	-36.2	175.4	-72.3	171.8	0	0	0	112.9	A280 E282 R288	A280-L284 VanDerWaalsContact O-CB 3.26Å; A280-L284 WeakPolarHBondContact O-CB 3.47Å; A280-L284 WeakPolarHBondContact O-CD1 3.34Å; A280-L284 WeakPolarHBondContact O-CG 3.36Å; A280-L284 PolarHBondContact O-N 3.34Å; E282-L284 PolarHBondContact O-N 3.14Å; L284-R288 WeakPolarHBondContact O-CB 3.49Å; L284-R288 PolarHBondContact O-N 3.02Å
285	R	98.4	Very high	97.9	Very high	154 Å²	154	87.1 Å²	87.1	58%	0.581	46%	0.464	S	S	*	.	H	α-helix	trans	-65.7	-43.1	174.4	-80.3	177.9	-67.1	158.7	-1.6	111.1	D279 Q281 E282 R288 S289	D279-R285 IonicContact OD2-NH2 2.71Å; Q281-R285 VanDerWaalsContact O-CB 3.28Å; Q281-R285 WeakPolarHBondContact O-CB 3.46Å; Q281-R285 WeakPolarHBondContact O-CG 3.36Å; Q281-R285 PolarHBondContact O-N 2.97Å; Q281-R285 VanDerWaalsContact O-N 3.16Å; Q281-R285 PolarHBondContact O-NE 3.37Å; E282-R285 PolarHBondContact O-N 3.02Å; R285-R288 PolarHBondContact O-N 3.04Å; R285-S289 PolarHBondContact O-N 3.38Å; R285-S289 VanDerWaalsContact O-N 3.16Å; R285-S289 PolarHBondContact O-OG 3.38Å
286	W	98.3	Very high	97.8	Very high	123 Å²	123	88.9 Å²	88.9	47%	0.466	48%	0.481	S	S	.	.	H	α-helix	trans	-60.5	-47.6	175.2	176.4	89.8	0	0	0	111.4	Y77 E282 D283 R288 S289 T290	Y77-W286 HydrophobicContact CD1-CZ3 4.33Å; Y77-W286 AromaticContact CD2-CE3 3.79Å; Y77-W286 HydrophobicContact CD2-CE3 3.79Å; Y77-W286 HydrophobicContact CD2-CH2 4.21Å; Y77-W286 AromaticContact CD2-CZ3 3.39Å; Y77-W286 HydrophobicContact CD2-CZ3 3.39Å; Y77-W286 HydrophobicContact CE1-CZ3 4.37Å; Y77-W286 AromaticContact CE2-CE3 3.77Å; Y77-W286 HydrophobicContact CE2-CE3 3.77Å; Y77-W286 AromaticContact CE2-CZ3 3.45Å; Y77-W286 HydrophobicContact CE2-CZ3 3.45Å; Y77-W286 VanDerWaalsContact CE2-CZ3 3.45Å; Y77-W286 HydrophobicContact CG-CH2 4.3Å; Y77-W286 AromaticContact CG-CZ3 3.87Å; Y77-W286 HydrophobicContact CG-CZ3 3.87Å; Y77-W286 AromaticContact CZ-CZ3 3.97Å; E282-W286 PolarHBondContact O-N 3.46Å; D283-W286 PolarHBondContact O-N 3.32Å; W286-R288 PolarHBondContact O-N 3.32Å; W286-S289 PolarHBondContact O-N 3.49Å; W286-S289 PolarHBondContact O-OG 3.45Å; W286-T290 HydrophobicContact CD2-CG2 4.27Å; W286-T290 HydrophobicContact CG-CG2 4.43Å; W286-T290 HydrophobicContact CZ2-CG2 4.24Å; W286-T290 WeakPolarHBondContact O-CG2 3.47Å; W286-T290 PolarHBondContact O-N 3.28Å; W286-T290 PolarHBondContact O-OG1 3.4Å
287	F	98.3	Very high	97.6	Very high	88 Å²	88	84.7 Å²	84.7	39%	0.386	47%	0.471	S	S	.	.	H	α-helix	trans	-64.8	-39.7	179.4	-171.4	-103.9	0	0	0	112.2	Y77 D283 S289 S291 G292	Y77-F287 HydrophobicContact CE2-CD2 4.37Å; Y77-F287 AromaticContact CZ-CD2 3.82Å; Y77-F287 WeakPolarHBondContact OH-CD2 3.28Å; D283-F287 PolarHBondContact O-N 3.04Å; F287-S289 VanDerWaalsContact C-N 3.31Å; F287-S289 PolarHBondContact O-N 3.46Å; F287-S291 CarbonylContact O-C 3.57Å; F287-S291 WeakPolarHBondContact O-CA 3.42Å; F287-S291 WeakPolarHBondContact O-CB 3.44Å; F287-S291 PolarHBondContact O-N 2.88Å; F287-G292 PolarHBondContact O-N 2.96Å
288	R	98	Very high	97.5	Very high	164 Å²	164	89.9 Å²	89.9	62%	0.619	49%	0.488	S	S	*	.	H	α-helix	trans	-60.7	-37.4	176.8	-178.3	178.8	176.2	-176.2	-0	112.7	L284 R285 W286 G292 G294	L284-R288 WeakPolarHBondContact O-CB 3.49Å; L284-R288 PolarHBondContact O-N 3.02Å; R285-R288 PolarHBondContact O-N 3.04Å; W286-R288 PolarHBondContact O-N 3.32Å; R288-G292 CarbonylContact O-C 3.17Å; R288-G292 WeakPolarHBondContact O-CA 3.1Å; R288-G292 PolarHBondContact O-N 3.48Å; R288-G294 WeakPolarHBondContact O-CA 3.48Å; R288-G294 PolarHBondContact O-N 3.48Å
289	S	97.7	Very high	97.3	Very high	61 Å²	61	96.9 Å²	96.9	43%	0.427	51%	0.506	S	S	.	.	H	α-helix	trans	-82.8	-33.3	-178.5	62	0	0	0	0	113.6	R285 W286 F287 M295	R285-S289 PolarHBondContact O-N 3.38Å; R285-S289 VanDerWaalsContact O-N 3.16Å; R285-S289 PolarHBondContact O-OG 3.38Å; W286-S289 PolarHBondContact O-N 3.49Å; W286-S289 PolarHBondContact O-OG 3.45Å; F287-S289 VanDerWaalsContact C-N 3.31Å; F287-S289 PolarHBondContact O-N 3.46Å; S289-M295 WeakPolarHBondContact O-CG 3.33Å
290	T	97	Very high	97	Very high	55 Å²	55	99.4 Å²	99.4	34%	0.337	53%	0.526	S	S	.	.	H	α-helix	trans	-91	-26.9	-177	61.5	0	0	0	0	114.4	W286 M295	W286-T290 HydrophobicContact CD2-CG2 4.27Å; W286-T290 HydrophobicContact CG-CG2 4.43Å; W286-T290 HydrophobicContact CZ2-CG2 4.24Å; W286-T290 WeakPolarHBondContact O-CG2 3.47Å; W286-T290 PolarHBondContact O-N 3.28Å; W286-T290 PolarHBondContact O-OG1 3.4Å; T290-M295 WeakPolarHBondContact O-CE 3.45Å
291	S	96.6	Very high	96.7	Very high	66 Å²	66	104.4 Å²	104.4	46%	0.462	54%	0.538	S	S	.	.	H	α-helix	trans	-139.6	4.7	-167.4	-53.9	0	0	0	0	113.7	F287	F287-S291 CarbonylContact O-C 3.57Å; F287-S291 WeakPolarHBondContact O-CA 3.42Å; F287-S291 WeakPolarHBondContact O-CB 3.44Å; F287-S291 PolarHBondContact O-N 2.88Å
292	G	95.9	Very high	96.3	Very high	20 Å²	20	107 Å²	107	21%	0.206	55%	0.548	C	S	.	.	S	Bend	trans	-135.9	-160.4	-173.5	0	0	0	0	0	113.9	F287 R288 G294 M295	F287-G292 PolarHBondContact O-N 2.96Å; R288-G292 CarbonylContact O-C 3.17Å; R288-G292 WeakPolarHBondContact O-CA 3.1Å; R288-G292 PolarHBondContact O-N 3.48Å; G292-G294 PolarHBondContact O-N 3.44Å; G292-M295 WeakPolarHBondContact O-CB 3.28Å; G292-M295 WeakPolarHBondContact O-CG 3.49Å; G292-M295 PolarHBondContact O-N 3.1Å
293	P	97.7	Very high	95.8	Very high	123 Å²	123	110.9 Å²	110.9	80%	0.799	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-1.6	-175.6	-25.2	35.1	0	0	0	116.6
294	G	96.6	Very high	95.2	Very high	45 Å²	45	117.7 Å²	117.7	46%	0.464	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.1	-6.7	171.4	0	0	0	0	0	114.2	R288 G292	R288-G294 WeakPolarHBondContact O-CA 3.48Å; R288-G294 PolarHBondContact O-N 3.48Å; G292-G294 PolarHBondContact O-N 3.44Å
295	M	97.4	Very high	94.2	Very high	100 Å²	100	121.5 Å²	121.5	49%	0.493	60%	0.604	S	S	.	*	S	Bend	trans	-66.1	144.6	173.8	-67	-177.5	81.1	0	0	111.2	S289 T290 G292 M297	S289-M295 WeakPolarHBondContact O-CG 3.33Å; T290-M295 WeakPolarHBondContact O-CE 3.45Å; G292-M295 WeakPolarHBondContact O-CB 3.28Å; G292-M295 WeakPolarHBondContact O-CG 3.49Å; G292-M295 PolarHBondContact O-N 3.1Å; M295-M297 PolarHBondContact O-N 3.5Å
296	P	95.4	Very high	93.2	Very high	124 Å²	124	117.6 Å²	117.6	81%	0.805	59%	0.594	S	S	*	*			trans	-65.3	135.3	172.4	28.5	-34.1	0	0	0	110.4
297	M	95.6	Very high	91.9	Very high	101 Å²	101	115.6 Å²	115.6	50%	0.498	60%	0.597	S	S	.	*			trans	-123.5	122.1	175.6	178.3	56.7	-172.4	0	0	110.3	M295 W299	M295-M297 PolarHBondContact O-N 3.5Å; M297-W299 VanDerWaalsContact C-N 3.27Å; M297-W299 HydrophobicContact CB-CD2 4.31Å; M297-W299 HydrophobicContact CB-CZ2 4.03Å; M297-W299 HydrophobicContact CE-CE3 4.15Å; M297-W299 HydrophobicContact CE-CZ3 4.4Å; M297-W299 HydrophobicContact CG-CD2 3.53Å; M297-W299 VanDerWaalsContact CG-CE2 3.47Å; M297-W299 HydrophobicContact CG-CE3 3.82Å; M297-W299 HydrophobicContact CG-CG 4.03Å; M297-W299 HydrophobicContact CG-CH2 4.01Å; M297-W299 HydrophobicContact CG-CZ2 3.73Å; M297-W299 HydrophobicContact CG-CZ3 4.05Å; M297-W299 PolarHBondContact O-N 3.32Å
298	N	94.8	Very high	90.4	Very high	156 Å²	156	118.3 Å²	118.3	83%	0.834	62%	0.616	S	S	*	*			trans	-79.7	81.4	169.4	-65.4	-19.4	0	0	0	107.9
299	W	94.1	Very high	88.7	Confident	186 Å²	186	115.7 Å²	115.7	71%	0.705	61%	0.614	S	S	*	*			trans	-57.7	141.4	177.5	-65.1	107.1	0	0	0	110.7	M297 Q301	M297-W299 VanDerWaalsContact C-N 3.27Å; M297-W299 HydrophobicContact CB-CD2 4.31Å; M297-W299 HydrophobicContact CB-CZ2 4.03Å; M297-W299 HydrophobicContact CE-CE3 4.15Å; M297-W299 HydrophobicContact CE-CZ3 4.4Å; M297-W299 HydrophobicContact CG-CD2 3.53Å; M297-W299 VanDerWaalsContact CG-CE2 3.47Å; M297-W299 HydrophobicContact CG-CE3 3.82Å; M297-W299 HydrophobicContact CG-CG 4.03Å; M297-W299 HydrophobicContact CG-CH2 4.01Å; M297-W299 HydrophobicContact CG-CZ2 3.73Å; M297-W299 HydrophobicContact CG-CZ3 4.05Å; M297-W299 PolarHBondContact O-N 3.32Å; W299-Q301 PolarHBondContact O-N 3.31Å
300	P	93.9	Very high	86.8	Confident	116 Å²	116	117.9 Å²	117.9	75%	0.753	63%	0.627	S	S	*	*			trans	-54.1	124.1	178.7	-26.9	35	0	0	0	111.6
301	Q	91.9	Very high	85	Confident	169 Å²	169	121.1 Å²	121.1	79%	0.79	64%	0.637	S	S	*	*			trans	-112.7	172.2	171.4	-64.5	-168.8	-11.2	0	0	109.1	W299 E303	W299-Q301 PolarHBondContact O-N 3.31Å; Q301-E303 PolarHBondContact O-N 3.49Å
302	F	89.1	Confident	82.5	Confident	179 Å²	179	123.3 Å²	123.3	79%	0.785	65%	0.648	S	S	*	*			trans	-68.6	115.8	173.9	177.7	-103.5	0	0	0	109.6	E304	F302-E304 HydrophobicContact CD1-CG 4.24Å; F302-E304 HydrophobicContact CE1-CG 3.65Å
303	E	88.4	Confident	80.2	Confident	171 Å²	171	128.6 Å²	128.6	80%	0.799	68%	0.677	S	S	*	*			trans	-93.6	118.4	174	-68.5	176.1	-160	0	0	109	Q301 W305	Q301-E303 PolarHBondContact O-N 3.49Å; E303-W305 PolarHBondContact O-N 3.37Å
304	E	85.2	Confident	77.6	Confident	164 Å²	164	128.9 Å²	128.9	77%	0.766	68%	0.676	S	S	*	*			trans	-67.3	131.1	174.2	-81	-174	169.7	0	0	110.7	F302 N306	F302-E304 HydrophobicContact CD1-CG 4.24Å; F302-E304 HydrophobicContact CE1-CG 3.65Å; E304-N306 PolarHBondContact O-N 2.88Å
305	W	78.1	Confident	75	Confident	187 Å²	187	135.9 Å²	135.9	71%	0.708	69%	0.694	S	S	*	*			trans	-68.9	103.3	175.9	-179.3	79	0	0	0	110.1	E303 P307 H311	E303-W305 PolarHBondContact O-N 3.37Å; W305-P307 HydrophobicContact CH2-CB 3.74Å; W305-P307 HydrophobicContact CH2-CG 4.49Å; W305-P307 HydrophobicContact CZ2-CB 4.31Å; W305-P307 HydrophobicContact CZ3-CB 3.94Å; W305-P307 HydrophobicContact CZ3-CG 4.21Å; W305-H311 AromaticContact CD1-CE1 3.87Å; W305-H311 AromaticContact CD1-NE2 3.84Å; W305-H311 AromaticContact CE2-NE2 3.51Å; W305-H311 AromaticContact CZ2-NE2 3.72Å; W305-H311 AromaticContact NE1-CE1 3.25Å; W305-H311 PolarHBondContact NE1-CE1 3.22Å; W305-H311 AromaticContact NE1-NE2 2.84Å; W305-H311 PolarHBondContact NE1-NE2 3.25Å
306	N	77.9	Confident	72.6	Confident	71 Å²	71	141.3 Å²	141.3	38%	0.38	72%	0.715	S	S	.	*			trans	-96.9	116.4	176.3	-175.4	-9.2	0	0	0	110.4	E304 D308 L309	E304-N306 PolarHBondContact O-N 2.88Å; N306-D308 PolarHBondContact O-N 2.63Å; N306-D308 PolarHBondContact OD1-N 3.17Å; N306-L309 HydrophobicContact CB-CB 4.46Å; N306-L309 HydrophobicContact CB-CD1 4.01Å; N306-L309 HydrophobicContact CB-CG 4.14Å; N306-L309 PolarHBondContact O-N 2.76Å
307	P	69.5	Low	69.9	Low	82 Å²	82	144.1 Å²	144.1	53%	0.532	72%	0.717	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.6	-20	179	26.6	-34.5	0	0	0	114.2	W305	W305-P307 HydrophobicContact CH2-CB 3.74Å; W305-P307 HydrophobicContact CH2-CG 4.49Å; W305-P307 HydrophobicContact CZ2-CB 4.31Å; W305-P307 HydrophobicContact CZ3-CB 3.94Å; W305-P307 HydrophobicContact CZ3-CG 4.21Å
308	D	68.6	Low	67.4	Low	144 Å²	144	149.3 Å²	149.3	77%	0.77	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-6.3	179.4	-63.6	-40	0	0	0	113.1	N306	N306-D308 PolarHBondContact O-N 2.63Å; N306-D308 PolarHBondContact OD1-N 3.17Å
309	L	62.2	Low	64.6	Low	110 Å²	110	150.9 Å²	150.9	58%	0.576	74%	0.739	S	S	*	*	S	Bend	trans	-86.5	117.3	169.5	-75.3	176	0	0	0	109.9	N306 H311	N306-L309 HydrophobicContact CB-CB 4.46Å; N306-L309 HydrophobicContact CB-CD1 4.01Å; N306-L309 HydrophobicContact CB-CG 4.14Å; N306-L309 PolarHBondContact O-N 2.76Å; L309-H311 PolarHBondContact O-N 3.11Å; L309-H311 VanDerWaalsContact O-N 3.09Å; L309-H311 PolarHBondContact O-ND1 3.04Å; L309-H311 VanDerWaalsContact O-ND1 3.16Å
310	P	57.1	Low	61.6	Low	107 Å²	107	147.2 Å²	147.2	70%	0.695	74%	0.742	S	S	*	*			trans	-61	119.4	-178.1	24.4	-33.3	0	0	0	110.4	T312	P310-T312 PolarHBondContact O-N 3.48Å
311	H	58.6	Low	59.2	Low	122 Å²	122	151.6 Å²	151.6	57%	0.565	75%	0.749	S	S	*	*			trans	-72	67	178.5	-63.5	-13.8	0	0	0	112.3	W305 L309 T313	W305-H311 AromaticContact CD1-CE1 3.87Å; W305-H311 AromaticContact CD1-NE2 3.84Å; W305-H311 AromaticContact CE2-NE2 3.51Å; W305-H311 AromaticContact CZ2-NE2 3.72Å; W305-H311 AromaticContact NE1-CE1 3.25Å; W305-H311 PolarHBondContact NE1-CE1 3.22Å; W305-H311 AromaticContact NE1-NE2 2.84Å; W305-H311 PolarHBondContact NE1-NE2 3.25Å; L309-H311 PolarHBondContact O-N 3.11Å; L309-H311 VanDerWaalsContact O-N 3.09Å; L309-H311 PolarHBondContact O-ND1 3.04Å; L309-H311 VanDerWaalsContact O-ND1 3.16Å; H311-T313 VanDerWaalsContact C-N 3.29Å; H311-T313 PolarHBondContact O-N 3.38Å
312	T	43.8	Very low	56.4	Low	112 Å²	112	153.6 Å²	153.6	69%	0.687	76%	0.755	S	S	*	*			trans	-71.1	91.1	160.2	52.2	0	0	0	0	108.2	P310 T314	P310-T312 PolarHBondContact O-N 3.48Å; T312-T314 PolarHBondContact O-N 2.92Å
313	T	47.9	Very low	54.2	Low	131 Å²	131	149.6 Å²	149.6	80%	0.804	76%	0.756	S	S	*	*			trans	-54.3	105.8	157.9	47.6	0	0	0	0	107.4	H311 K315	H311-T313 VanDerWaalsContact C-N 3.29Å; H311-T313 PolarHBondContact O-N 3.38Å; T313-K315 PolarHBondContact O-N 3.41Å
314	T	43	Very low	51.5	Low	130 Å²	130	150.7 Å²	150.7	80%	0.798	76%	0.761	S	S	*	*			trans	-71.3	80.1	-179.7	38	0	0	0	0	110	T312 K316	T312-T314 PolarHBondContact O-N 2.92Å; T314-K316 PolarHBondContact O-N 3Å
315	K	41.6	Very low	49	Very low	191 Å²	191	146.3 Å²	146.3	83%	0.83	76%	0.759	S	S	*	*			trans	-43.2	126.1	147.8	-121.3	-179.1	-177.3	176.4	0	106.6	T313 E317	T313-K315 PolarHBondContact O-N 3.41Å; K315-E317 PolarHBondContact O-N 3.35Å
316	K	48.3	Very low	46.8	Very low	214 Å²	214	144.6 Å²	144.6	93%	0.93	77%	0.769	S	S	*	*			trans	-43.3	90.5	-176.5	-132	178.4	-173.8	177.2	0	112.1	T314	T314-K316 PolarHBondContact O-N 3Å
317	E	37.7	Very low	44.6	Very low	183 Å²	183	145 Å²	145	86%	0.855	78%	0.783	S	S	*	*			trans	-79.9	129.5	168.6	-91.1	-163.7	146.4	0	0	108.9	K315 Q319	K315-E317 PolarHBondContact O-N 3.35Å; E317-Q319 VanDerWaalsContact C-N 3.31Å; E317-Q319 PolarHBondContact O-N 3.35Å
318	K	44.7	Very low	42.8	Very low	210 Å²	210	149.4 Å²	149.4	91%	0.913	80%	0.8	S	S	*	*			trans	-82	78	-171	-166.8	-179.5	-175.8	-176.5	0	108.6	S320	K318-S320 PolarHBondContact O-N 2.96Å; K318-S320 VanDerWaalsContact O-N 3.1Å
319	Q	35	Very low	40.9	Very low	189 Å²	189	148.2 Å²	148.2	88%	0.883	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-55.4	117.9	177	-93.4	-174.6	-7.2	0	0	110.6	E317	E317-Q319 VanDerWaalsContact C-N 3.31Å; E317-Q319 PolarHBondContact O-N 3.35Å
320	S	31.6	Very low	39.3	Very low	109 Å²	109	150.1 Å²	150.1	76%	0.762	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-70.8	132.1	173.9	53.6	0	0	0	0	110.4	K318 K322	K318-S320 PolarHBondContact O-N 2.96Å; K318-S320 VanDerWaalsContact O-N 3.1Å; S320-K322 PolarHBondContact O-N 3.07Å
321	K	43.7	Very low	38	Very low	208 Å²	208	149 Å²	149	90%	0.904	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-58.8	126.3	165.3	-73.2	-174.9	173.7	-173.7	0	110
322	K	32.3	Very low	36.6	Very low	212 Å²	212	150.1 Å²	150.1	92%	0.922	83%	0.825	S	S	*	*			trans	-142.4	152	147.2	-116	-176.3	-179.7	-174.3	0	109.9	S320	S320-K322 PolarHBondContact O-N 3.07Å
323	A	42.9	Very low	35.8	Very low	95 Å²	95	148.3 Å²	148.3	79%	0.785	83%	0.828	S	S	*	*			trans	-95.5	150.2	-164.6	0	0	0	0	0	112.6
324	E	32.4	Very low	34.8	Very low	194 Å²	194	146.6 Å²	146.6	91%	0.907	83%	0.828	S	S	*	*			trans	-128.3	130.5	150.1	-67.5	-175.2	156	0	0	105.9
325	G	31.1	Very low	34.1	Very low	71 Å²	71	146 Å²	146	73%	0.732	82%	0.824	S	S	*	*			cis	92.3	75.9	13.5	0	0	0	0	0	110.1	A327	G325-A327 PolarHBondContact O-N 3.2Å
326	V	32.3	Very low	33.5	Very low	151 Å²	151	145.2 Å²	145.2	92%	0.915	82%	0.823	S	S	*	*			trans	-67.1	120.5	177.7	175.3	0	0	0	0	110.2
327	A	31.5	Very low	32.5	Very low	81 Å²	81	139.6 Å²	139.6	67%	0.669	81%	0.81	S	S	*	*			trans	173.5	125.9	131.9	0	0	0	0	0	115.1	G325	G325-A327 PolarHBondContact O-N 3.2Å
328	L	31.6	Very low	32	Very low	173 Å²	173	137 Å²	137	91%	0.906	81%	0.807	S	S	*	*			trans	44.8	122.8	132.1	-65.6	159.8	0	0	0	122.3
329	T	29.1	Very low	31.2	Very low	120 Å²	120	132.1 Å²	132.1	74%	0.736	80%	0.799	S	S	*	*			trans	-85	156.6	150.4	51.2	0	0	0	0	110.1
330	N	29.7	Very low	30.9	Very low	150 Å²	150	132 Å²	132	80%	0.802	80%	0.799	S	S	*	*			cis	-162.3	157.5	5.5	-124.9	-6.7	0	0	0	113.1
331	A	29.2	Very low	30.7	Very low	84 Å²	84	131.9 Å²	131.9	69%	0.694	81%	0.805	S	S	*	*			trans	59.2	123.6	151.7	0	0	0	0	0	119.7
332	T	29.8	Very low	30	Very low	144 Å²	144	125.5 Å²	125.5	88%	0.883	80%	0.798	S	S	*	*			cis	-165.6	151.1	46.3	44.2	0	0	0	0	112.3
333	G	26	Very low	29.9	Very low	74 Å²	74	123 Å²	123	76%	0.763	80%	0.795	S	S	*	*			trans	120.1	92.2	150.3	0	0	0	0	0	120.2
334	A	27.5	Very low	29.3	Very low	96 Å²	96	130.4 Å²	130.4	79%	0.793	80%	0.803	S	S	*	*			trans	83.6	128.6	132.6	0	0	0	0	0	123.6
335	V	28.9	Very low	29.1	Very low	117 Å²	117	124.8 Å²	124.8	71%	0.709	80%	0.796	S	S	*	*			trans	75.8	116.8	148.3	-139.6	0	0	0	0	121.9
336	E	27.4	Very low	29.1	Very low	175 Å²	175	126.8 Å²	126.8	82%	0.818	80%	0.799	S	S	*	*			trans	41.1	152.7	141	-60.1	173.9	170.1	0	0	122.5
337	S	27.6	Very low	29.3	Very low	95 Å²	95	125.3 Å²	125.3	66%	0.664	79%	0.79	S	S	*	*			cis	-169.6	159	-14.5	-94.9	0	0	0	0	111
338	T	26.8	Very low	29.4	Very low	129 Å²	129	126.3 Å²	126.3	79%	0.791	79%	0.792	S	S	*	*			trans	66	116.4	152.8	36.3	0	0	0	0	124.1
339	S	28.8	Very low	29.4	Very low	107 Å²	107	123.7 Å²	123.7	75%	0.748	79%	0.788	S	S	*	*			trans	63.8	151.3	132.9	67.4	0	0	0	0	121.7
340	Q	28	Very low	29.6	Very low	186 Å²	186	127.5 Å²	127.5	87%	0.869	79%	0.791	S	S	*	*			cis	-167.8	161.8	-11.6	-115.9	-174.9	-2.3	0	0	109.6
341	A	28.5	Very low	29.5	Very low	108 Å²	108	127.8 Å²	127.8	89%	0.893	79%	0.792	S	S	*	*			trans	62	161.9	164	0	0	0	0	0	118.2
342	G	29.1	Very low	29.8	Very low	74 Å²	74	135.2 Å²	135.2	76%	0.763	80%	0.802	S	S	*	*			cis	179.6	112.2	-6.6	0	0	0	0	0	113.1
343	D	29.3	Very low	29.7	Very low	159 Å²	159	131.7 Å²	131.7	85%	0.85	79%	0.794	S	S	*	*			trans	30.6	140.9	147.3	-159.9	30.5	0	0	0	125.1
344	R	30.1	Very low	29.9	Very low	251 Å²	251	137 Å²	137	95%	0.947	80%	0.799	S	S	*	*			trans	-164.9	131	151.3	-115.6	176.4	177.7	154.5	1.3	111.4
345	G	29.3	Very low	30.6	Very low	75 Å²	75	137.1 Å²	137.1	77%	0.773	79%	0.792	S	S	*	*			trans	-121.4	-171.3	-173.1	0	0	0	0	0	117
346	S	30.9	Very low	30.5	Very low	113 Å²	113	142 Å²	142	79%	0.79	80%	0.799	S	S	*	*			trans	-147.7	-173.7	-176.7	-151	0	0	0	0	108.9
347	V	35.3	Very low	30.6	Very low	121 Å²	121	137.3 Å²	137.3	73%	0.733	79%	0.791	S	S	*	*			cis	-163.7	153.3	29	-130.9	0	0	0	0	111
348	S	34.6	Very low	30.6	Very low	102 Å²	102	138.6 Å²	138.6	71%	0.713	79%	0.794	S	S	*	*			trans	55.3	146.4	137.6	-169.9	0	0	0	0	123
349	S	32.5	Very low	30.9	Very low	117 Å²	117	139.7 Å²	139.7	82%	0.818	79%	0.791	S	S	*	*			trans	-153.6	168.2	139	69.7	0	0	0	0	112
350	Y	32.5	Very low	30.8	Very low	201 Å²	201	145.4 Å²	145.4	79%	0.788	80%	0.796	S	S	*	*			trans	-140.1	164.2	-167.3	47.4	-98.9	0	0	0	111.2
351	D	27.6	Very low	30.8	Very low	156 Å²	156	142.6 Å²	142.6	83%	0.834	80%	0.796	S	S	*	*			trans	-156.1	172.5	150.6	-135.4	-36.1	0	0	0	114.5
352	R	34.3	Very low	30.9	Very low	240 Å²	240	144.4 Å²	144.4	91%	0.906	79%	0.791	S	S	*	*			trans	-106.9	162.6	-156.6	-74.3	171.8	161.5	176.3	-4.1	117.3
353	G	28.6	Very low	31.1	Very low	69 Å²	69	147.3 Å²	147.3	71%	0.711	79%	0.789	S	S	*	*				152.4	98.9	129.5	0	0	0	0	0	121
354	Q	30.4	Very low	31.3	Very low	186 Å²	186	148 Å²	148	87%	0.869	79%	0.787	S	S	*	*			trans	42.6	162.8	136.7	-69.8	-110.1	-39.2	0	0	123.1
355	P	41.4	Very low	31.4	Very low	99 Å²	99	142 Å²	142	64%	0.643	78%	0.784	S	S	*	*			cis	-140.7	163.7	-40.9	39.6	-22.2	0	0	0	116.4
356	Y	28.2	Very low	31.4	Very low	219 Å²	219	142 Å²	142	86%	0.859	78%	0.783	S	S	*	*			trans	36.3	125.8	147.3	-160.3	-102.7	0	0	0	122.9
357	A	28.6	Very low	31.6	Very low	77 Å²	77	144.2 Å²	144.2	64%	0.636	79%	0.787	S	S	*	*				168	131.4	114.4	0	0	0	0	0	116.3
358	T	28.7	Very low	31.9	Very low	121 Å²	121	143 Å²	143	74%	0.742	78%	0.781	S	S	*	*			trans	74.2	142.2	144.7	-41.8	0	0	0	0	122
359	E	31.2	Very low	31.8	Very low	153 Å²	153	148.4 Å²	148.4	72%	0.715	79%	0.792	S	S	*	*			trans	-95.6	-170.9	-174.1	-50.3	158.2	131.8	0	0	113.7
360	W	27.3	Very low	31.6	Very low	227 Å²	227	146.8 Å²	146.8	86%	0.86	79%	0.794	S	S	*	*			trans	86.1	111	162.4	-54.3	90.6	0	0	0	119.2
361	S	28.3	Very low	31.6	Very low	126 Å²	126	140.9 Å²	140.9	88%	0.881	79%	0.794	S	S	*	*				-159.7	141.8	128.6	-161.2	0	0	0	0	110
362	D	29.9	Very low	32	Very low	146 Å²	146	139.3 Å²	139.3	78%	0.781	80%	0.796	S	S	*	*			trans	-133.4	172.1	171.9	-156.1	-3	0	0	0	109.4
363	D	33.7	Very low	32	Very low	135 Å²	135	137.4 Å²	137.4	72%	0.722	80%	0.797	S	S	*	*			trans	75.4	96.5	173.9	-74.3	-38	0	0	0	120.9
364	E	33.8	Very low	32.2	Very low	174 Å²	174	138.2 Å²	138.2	81%	0.813	80%	0.797	S	S	*	*			trans	35.6	128.8	131.2	-63.1	-150.5	105.5	0	0	123.9
365	S	32.2	Very low	32.4	Very low	126 Å²	126	137.5 Å²	137.5	88%	0.881	80%	0.799	S	S	*	*				-152.3	109	127.5	-40.5	0	0	0	0	111.3
366	G	28.7	Very low	32.2	Very low	73 Å²	73	136.8 Å²	136.8	75%	0.753	81%	0.809	S	S	*	*			trans	-78.7	174.3	-164.8	0	0	0	0	0	119.8
367	N	35.2	Very low	32.4	Very low	161 Å²	161	129.7 Å²	129.7	86%	0.861	80%	0.803	S	S	*	*			trans	-161.6	152.4	131	-153.1	42.7	0	0	0	109.2
368	P	42.4	Very low	32.8	Very low	94 Å²	94	130.9 Å²	130.9	61%	0.61	81%	0.813	S	S	*	*			trans	-97.8	172.2	-165.5	37.7	-34.3	0	0	0	115.1
369	F	32.4	Very low	33.3	Very low	216 Å²	216	130.2 Å²	130.2	95%	0.947	81%	0.805	S	S	*	*			trans	84.7	114.8	-177.5	-69.2	-87.7	0	0	0	116.4
370	G	28.8	Very low	33.9	Very low	83 Å²	83	128.7 Å²	128.7	86%	0.856	81%	0.808	S	S	*	*			trans	145.8	91.3	175.1	0	0	0	0	0	110.8
371	G	32.8	Very low	34.5	Very low	77 Å²	77	126.8 Å²	126.8	79%	0.794	81%	0.806	S	S	*	*			trans	-96.4	147.3	-179.7	0	0	0	0	0	113.1
372	S	35.5	Very low	35.2	Very low	124 Å²	124	128.4 Å²	128.4	87%	0.867	80%	0.8	S	S	*	*			trans	73.4	103.1	157.3	-162.4	0	0	0	0	118.6
373	E	33.8	Very low	35.9	Very low	199 Å²	199	125.4 Å²	125.4	93%	0.93	78%	0.784	S	S	*	*			trans	-108.9	123.9	149.3	-72.2	-163.7	142.1	0	0	110
374	A	33	Very low	36.3	Very low	86 Å²	86	125.3 Å²	125.3	71%	0.711	78%	0.783	S	S	*	*				159	113.9	126.5	0	0	0	0	0	112.1
375	N	33.9	Very low	36.9	Very low	172 Å²	172	122.3 Å²	122.3	92%	0.92	78%	0.782	S	S	*	*			trans	48	124	153.5	-62	-23.5	0	0	0	119.9
376	G	37.3	Very low	38.5	Very low	83 Å²	83	124.6 Å²	124.6	86%	0.856	78%	0.776	S	S	*	*			cis	176.3	112.2	-0.4	0	0	0	0	0	111.6
377	G	32.1	Very low	40.7	Very low	71 Å²	71	122.5 Å²	122.5	73%	0.732	75%	0.754	S	S	*	*			trans	-142.9	132.2	167.5	0	0	0	0	0	107	N379	G377-N379 PolarHBondContact O-N 2.91Å
378	A	38.2	Very low	43.3	Very low	101 Å²	101	118.7 Å²	118.7	84%	0.835	74%	0.736	S	S	*	*			trans	-61.7	131.2	-173	0	0	0	0	0	111.1
379	N	37.8	Very low	45.8	Very low	108 Å²	108	117.9 Å²	117.9	58%	0.578	72%	0.721	S	S	*	*			trans	-64.9	134	172.4	-87.6	-39.3	0	0	0	109.4	G377 F381 E382	G377-N379 PolarHBondContact O-N 2.91Å; N379-F381 PolarHBondContact O-N 3.2Å; N379-E382 PolarHBondContact O-N 3.37Å
380	P	44.2	Very low	48.8	Very low	120 Å²	120	107.9 Å²	107.9	78%	0.779	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	15.8	177.4	29	-33.2	0	0	0	114.1
381	F	40.4	Very low	52	Low	187 Å²	187	107.8 Å²	107.8	82%	0.82	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	6.8	177.9	-69.7	-79.6	0	0	0	113.3	N379	N379-F381 PolarHBondContact O-N 3.2Å
382	E	43	Very low	55	Low	161 Å²	161	104.2 Å²	104.2	75%	0.752	61%	0.614	S	S	*	*			trans	-110.9	65.2	174.7	-68.5	-169.4	140.3	0	0	112.1	N379	N379-E382 PolarHBondContact O-N 3.37Å
383	D	44.2	Very low	57.7	Low	83 Å²	83	101.5 Å²	101.5	44%	0.444	59%	0.59	S	S	.	*			trans	-141.9	67.8	161	-165.8	29.3	0	0	0	111.4	R427	D383-R427 PolarHBondContact O-NH2 3.16Å; D383-R427 VanDerWaalsContact O-NH2 3.11Å
384	D	42.9	Very low	60.6	Low	133 Å²	133	98.5 Å²	98.5	71%	0.711	57%	0.571	S	S	*	*	S	Bend	trans	-111.5	15	174.8	-92.3	11.1	0	0	0	112.4	R427	D384-R427 IonicContact OD1-CZ 3.5Å; D384-R427 IonicContact OD1-NH1 2.92Å; D384-R427 PolarHBondContact OD1-NH1 2.9Å; D384-R427 IonicContact OD1-NH2 2.84Å
385	S	46.9	Very low	63.5	Low	111 Å²	111	98.3 Å²	98.3	78%	0.776	56%	0.558	S	S	*	*	S	Bend	trans	-131	8.1	-173.1	58.5	0	0	0	0	116.5
386	K	64.2	Low	66.5	Low	174 Å²	174	91.4 Å²	91.4	76%	0.757	52%	0.519	S	S	*	.	S	Bend	trans	-119.1	3.4	177.1	-74.9	-176	178.2	175.3	0	115.9
387	G	76.2	Confident	69.3	Low	28 Å²	28	92 Å²	92	29%	0.289	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-88.6	145	177	0	0	0	0	0	113.4	K414	G387-K414 CarbonylContact C-O 3.51Å; G387-K414 WeakPolarHBondContact CA-O 3.34Å
388	V	90	Very high	72.1	Confident	82 Å²	82	89.8 Å²	89.8	50%	0.497	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	131.9	172.9	179.6	0	0	0	0	108.8	V390 K414	V388-V390 HydrophobicContact CG1-CG1 4.36Å; V388-K414 HydrophobicContact CB-CB 4.46Å; V388-K414 PolarHBondContact N-O 3.07Å; V388-K414 PolarHBondContact O-N 2.97Å
389	R	94.3	Very high	74.6	Confident	77 Å²	77	92.5 Å²	92.5	29%	0.291	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	130.6	173	-71.2	-65.2	-71.5	-174.6	-12.3	110.1	E411 T413 D429 I444	R389-E411 IonicContact CZ-OE2 3.47Å; R389-E411 IonicContact NE-OE2 2.69Å; R389-E411 IonicContact NH2-OE2 3.09Å; R389-E411 PolarHBondContact NH2-OE2 2.85Å; R389-T413 PolarHBondContact NH1-OG1 3.14Å; R389-D429 IonicContact CZ-OD1 3.3Å; R389-D429 IonicContact CZ-OD2 2.72Å; R389-D429 IonicContact NH1-OD1 3.01Å; R389-D429 PolarHBondContact NH1-OD1 2.69Å; R389-D429 IonicContact NH1-OD2 3.75Å; R389-D429 IonicContact NH2-OD1 3.76Å; R389-D429 PolarHBondContact NH2-OD1 2.77Å; R389-D429 IonicContact NH2-OD2 3.79Å; R389-D429 PolarHBondContact NH2-OD2 2.76Å; R389-I444 HydrophobicContact CB-CB 4.47Å; R389-I444 HydrophobicContact CB-CD1 4.28Å; R389-I444 PolarHBondContact O-N 3.03Å
390	V	95.1	Very high	77	Confident	5 Å²	5	93.9 Å²	93.9	3%	0.03	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	146.9	178.3	-55.1	0	0	0	0	109.9	V388 E411 L412 K414 V441 E442	V388-V390 HydrophobicContact CG1-CG1 4.36Å; V390-E411 WeakPolarHBondContact O-CA 3.26Å; V390-L412 HydrophobicContact CG2-CD1 3.79Å; V390-L412 HydrophobicContact CG2-CD2 4.24Å; V390-L412 HydrophobicContact CG2-CG 3.6Å; V390-L412 PolarHBondContact N-O 3.22Å; V390-L412 PolarHBondContact O-N 2.75Å; V390-K414 HydrophobicContact CG1-CB 4.05Å; V390-K414 HydrophobicContact CG2-CB 4.43Å; V390-V441 HydrophobicContact CB-CB 3.98Å; V390-V441 HydrophobicContact CB-CG2 3.84Å; V390-V441 HydrophobicContact CG1-CG2 4.29Å; V390-V441 HydrophobicContact CG2-CB 3.87Å; V390-V441 HydrophobicContact CG2-CG1 4.11Å; V390-V441 HydrophobicContact CG2-CG2 3.74Å; V390-E442 CarbonylContact C-O 3.48Å; V390-E442 WeakPolarHBondContact CA-O 3.28Å; V390-E442 VanDerWaalsContact CB-O 3.25Å; V390-E442 WeakPolarHBondContact CB-O 3.45Å
391	R	95.8	Very high	79	Confident	81 Å²	81	98.1 Å²	98.1	31%	0.306	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	135	178	-177.3	175.2	-65.4	125.9	6.9	110.2	L393 D410 E411 V441 E442 I444	R391-L393 PolarHBondContact O-N 3.36Å; R391-D410 CarbonylContact C-O 3.6Å; R391-D410 WeakPolarHBondContact CA-O 3.44Å; R391-E411 IonicContact CZ-OE1 2.86Å; R391-E411 IonicContact NE-OE1 3.91Å; R391-E411 IonicContact NH2-OE1 3.93Å; R391-E411 PolarHBondContact NH2-OE1 2.96Å; R391-V441 CarbonylContact O-C 3.6Å; R391-V441 WeakPolarHBondContact O-CA 3.39Å; R391-V441 WeakPolarHBondContact O-CB 3.37Å; R391-E442 HydrophobicContact CB-CG 4.19Å; R391-E442 PolarHBondContact N-O 3.47Å; R391-E442 IonicContact NH1-OE1 3.76Å; R391-E442 PolarHBondContact O-N 3.3Å; R391-I444 HydrophobicContact CB-CD1 3.85Å; R391-I444 HydrophobicContact CB-CG1 3.95Å
392	A	95.6	Very high	81.4	Confident	3 Å²	3	93.3 Å²	93.3	3%	0.025	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	124.6	172.9	0	0	0	0	0	111.5	F406 K407 G409 D410	A392-F406 HydrophobicContact CB-CD2 3.43Å; A392-F406 VanDerWaalsContact CB-CD2 3.43Å; A392-F406 HydrophobicContact CB-CE2 3.66Å; A392-F406 HydrophobicContact CB-CG 4.5Å; A392-K407 WeakPolarHBondContact CB-O 3.22Å; A392-G409 PolarHBondContact O-N 3.3Å; A392-D410 HydrophobicContact CB-CB 4.46Å; A392-D410 PolarHBondContact N-O 3.3Å
393	L	94.1	Very high	83.9	Confident	67 Å²	67	86.7 Å²	86.7	35%	0.351	44%	0.44	S	S	.	.	S	Bend	trans	-83.2	-27	175.1	-66.9	174.5	0	0	0	112.2	R391 Y440 E442	R391-L393 PolarHBondContact O-N 3.36Å; L393-Y440 PolarHBondContact N-O 2.97Å; L393-E442 HydrophobicContact CD1-CB 4.32Å; L393-E442 HydrophobicContact CD2-CB 4.1Å; L393-E442 HydrophobicContact CD2-CG 3.76Å; L393-E442 HydrophobicContact CG-CB 4.29Å; L393-E442 HydrophobicContact CG-CG 4.29Å
394	Y	93.3	Very high	86.3	Confident	135 Å²	135	82.8 Å²	82.8	53%	0.529	42%	0.419	S	S	.	.	S	Bend	trans	-140.1	158.4	-175.2	-50.1	-73.1	0	0	0	110.8	Y440	Y394-Y440 HydrophobicContact CD2-CD1 4.25Å; Y394-Y440 HydrophobicContact CD2-CG 4.33Å
395	D	95.3	Very high	88.8	Confident	83 Å²	83	79.2 Å²	79.2	44%	0.444	40%	0.404	S	S	.	.			trans	-62	138.9	165.4	-83.8	24.9	0	0	0	110.7	K407 A408	D395-K407 HydrophobicContact CB-CD 4.24Å; D395-K407 WeakPolarHBondContact OD1-CA 3.33Å; D395-K407 WeakPolarHBondContact OD1-CD 3.33Å; D395-K407 WeakPolarHBondContact OD2-CD 3.49Å; D395-K407 WeakPolarHBondContact OD2-CE 3.41Å; D395-K407 IonicContact OD2-NZ 2.8Å; D395-K407 PolarHBondContact OD2-NZ 3.37Å; D395-A408 PolarHBondContact OD1-N 2.93Å
396	Y	95.6	Very high	91.1	Very high	27 Å²	27	74.3 Å²	74.3	11%	0.106	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-138.7	121.8	174.7	-172	-104.6	0	0	0	110.2	E403 L404 S405 F406 W423 P437 Y440	Y396-E403 PolarHBondContact OH-OE2 3Å; Y396-L404 WeakPolarHBondContact CD1-O 3.35Å; Y396-L404 VanDerWaalsContact CE1-O 3.26Å; Y396-L404 WeakPolarHBondContact CE1-O 3.26Å; Y396-S405 CarbonylContact O-C 3.54Å; Y396-S405 VanDerWaalsContact O-CA 3.25Å; Y396-S405 WeakPolarHBondContact O-CA 3.38Å; Y396-F406 HydrophobicContact CD1-CD1 4.47Å; Y396-F406 AromaticContact CD1-CE1 3.81Å; Y396-F406 HydrophobicContact CD1-CE1 3.81Å; Y396-F406 HydrophobicContact CD1-CZ 4.07Å; Y396-F406 HydrophobicContact CG-CE1 4.18Å; Y396-F406 AromaticContact CG-CZ 3.98Å; Y396-F406 HydrophobicContact CG-CZ 3.98Å; Y396-F406 PolarHBondContact N-O 2.95Å; Y396-F406 PolarHBondContact O-N 3.2Å; Y396-F406 VanDerWaalsContact O-O 3.11Å; Y396-W423 WeakPolarHBondContact OH-CH2 3.32Å; Y396-W423 WeakPolarHBondContact OH-CZ3 3.4Å; Y396-P437 HydrophobicContact CD2-CG 4.06Å; Y396-P437 HydrophobicContact CE2-CG 3.54Å; Y396-Y440 AromaticContact CD2-CD1 3.94Å; Y396-Y440 HydrophobicContact CD2-CD1 3.94Å; Y396-Y440 AromaticContact CD2-CE1 3.84Å; Y396-Y440 HydrophobicContact CD2-CE1 3.84Å; Y396-Y440 HydrophobicContact CG-CD1 4.34Å
397	D	95.5	Very high	92.5	Very high	96 Å²	96	70.2 Å²	70.2	51%	0.513	35%	0.351	S	S	.	.			trans	-111.8	111.1	175.3	-60.3	-48.3	0	0	0	107.7	Q399 K407	D397-Q399 PolarHBondContact O-NE2 3.43Å; D397-K407 IonicContact OD1-NZ 3.73Å; D397-K407 PolarHBondContact OD1-NZ 2.78Å; D397-K407 VanDerWaalsContact OD1-NZ 3.16Å; D397-K407 IonicContact OD2-NZ 3.21Å
398	G	92.6	Very high	93.4	Very high	24 Å²	24	71.5 Å²	71.5	25%	0.247	36%	0.359	C	S	.	.			trans	-64.6	138.8	-174	0	0	0	0	0	112.9	E403 S405	G398-E403 VanDerWaalsContact CA-OE2 3.27Å; G398-E403 WeakPolarHBondContact CA-OE2 3.4Å; G398-S405 PolarHBondContact N-OG 2.96Å
399	Q	89.6	Confident	93.5	Very high	158 Å²	158	69.6 Å²	69.6	74%	0.738	36%	0.356	S	S	*	.	S	Bend	trans	-95.4	-34.3	-176.5	-57.3	-58.9	-64.8	0	0	112.5	D397 E403	D397-Q399 PolarHBondContact O-NE2 3.43Å; Q399-E403 PolarHBondContact N-OE2 2.98Å
400	E	88.7	Confident	93.5	Very high	137 Å²	137	69.4 Å²	69.4	64%	0.64	36%	0.361	S	S	*	.	S	Bend	trans	-107.4	164.6	177.4	-58.6	-159.3	-164.7	0	0	112.6	D402 E403	E400-D402 VanDerWaalsContact C-N 3.26Å; E400-D402 PolarHBondContact O-N 3.17Å; E400-E403 HydrophobicContact CB-CG 4.28Å; E400-E403 PolarHBondContact N-OE1 3.42Å; E400-E403 PolarHBondContact O-N 3.16Å
401	Q	85.9	Confident	93.5	Very high	208 Å²	208	72.4 Å²	72.4	97%	0.972	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-16.9	-169.8	-69.9	-173.8	3.5	0	0	114.5
402	D	91.3	Very high	93.4	Very high	87 Å²	87	68.5 Å²	68.5	47%	0.465	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-1.2	177	60.4	-36.5	0	0	0	113.1	E400 G434 L435	E400-D402 VanDerWaalsContact C-N 3.26Å; E400-D402 PolarHBondContact O-N 3.17Å; D402-G434 CarbonylContact O-C 3.59Å; D402-G434 WeakPolarHBondContact O-CA 3.4Å; D402-L435 PolarHBondContact O-N 3.03Å
403	E	94.6	Very high	93.4	Very high	22 Å²	22	70 Å²	70	10%	0.103	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-84.8	147	174	-64.1	-179.8	-156.5	0	0	112.5	Y396 G398 Q399 E400 W423 L435	Y396-E403 PolarHBondContact OH-OE2 3Å; G398-E403 VanDerWaalsContact CA-OE2 3.27Å; G398-E403 WeakPolarHBondContact CA-OE2 3.4Å; Q399-E403 PolarHBondContact N-OE2 2.98Å; E400-E403 HydrophobicContact CB-CG 4.28Å; E400-E403 PolarHBondContact N-OE1 3.42Å; E400-E403 PolarHBondContact O-N 3.16Å; E403-W423 HydrophobicContact CG-CH2 4.1Å; E403-W423 HydrophobicContact CG-CZ3 3.9Å; E403-L435 CarbonylContact C-O 3.4Å; E403-L435 WeakPolarHBondContact CA-O 3.26Å
404	L	94.3	Very high	93.4	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	36%	0.364	C	S	.	.			trans	-81.6	158	170.9	-66.7	178.5	0	0	0	111.3	Y396 F406 L428 Q432 L435 Y436	Y396-L404 WeakPolarHBondContact CD1-O 3.35Å; Y396-L404 VanDerWaalsContact CE1-O 3.26Å; Y396-L404 WeakPolarHBondContact CE1-O 3.26Å; L404-F406 HydrophobicContact CB-CD1 4.09Å; L404-F406 HydrophobicContact CB-CE1 4.3Å; L404-L428 HydrophobicContact CD1-CD2 4.26Å; L404-L428 HydrophobicContact CD1-CG 4.2Å; L404-L428 HydrophobicContact CD2-CD1 4.2Å; L404-L428 HydrophobicContact CD2-CG 4.07Å; L404-Q432 HydrophobicContact CD2-CB 4.38Å; L404-Q432 HydrophobicContact CD2-CG 3.86Å; L404-L435 PolarHBondContact N-O 3.49Å; L404-Y436 HydrophobicContact CD1-CD1 4.28Å
405	S	95.4	Very high	93.3	Very high	59 Å²	59	65.7 Å²	65.7	41%	0.413	35%	0.352	S	S	.	.			trans	-127.1	133.2	167	-56.8	0	0	0	0	109.5	Y396 G398	Y396-S405 CarbonylContact O-C 3.54Å; Y396-S405 VanDerWaalsContact O-CA 3.25Å; Y396-S405 WeakPolarHBondContact O-CA 3.38Å; G398-S405 PolarHBondContact N-OG 2.96Å
406	F	95.1	Very high	92.9	Very high	7 Å²	7	63.3 Å²	63.3	3%	0.031	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-156.8	166.5	-174.4	52.7	-96.4	0	0	0	111.7	A392 Y396 L404 D410 L428 Y436	A392-F406 HydrophobicContact CB-CD2 3.43Å; A392-F406 VanDerWaalsContact CB-CD2 3.43Å; A392-F406 HydrophobicContact CB-CE2 3.66Å; A392-F406 HydrophobicContact CB-CG 4.5Å; Y396-F406 HydrophobicContact CD1-CD1 4.47Å; Y396-F406 AromaticContact CD1-CE1 3.81Å; Y396-F406 HydrophobicContact CD1-CE1 3.81Å; Y396-F406 HydrophobicContact CD1-CZ 4.07Å; Y396-F406 HydrophobicContact CG-CE1 4.18Å; Y396-F406 AromaticContact CG-CZ 3.98Å; Y396-F406 HydrophobicContact CG-CZ 3.98Å; Y396-F406 PolarHBondContact N-O 2.95Å; Y396-F406 PolarHBondContact O-N 3.2Å; Y396-F406 VanDerWaalsContact O-O 3.11Å; L404-F406 HydrophobicContact CB-CD1 4.09Å; L404-F406 HydrophobicContact CB-CE1 4.3Å; F406-D410 HydrophobicContact CB-CB 4.34Å; F406-L428 HydrophobicContact CB-CD2 4.15Å; F406-L428 HydrophobicContact CD1-CD2 4.44Å; F406-Y436 HydrophobicContact CE1-CG 4.36Å
407	K	95.4	Very high	92.4	Very high	88 Å²	88	70.6 Å²	70.6	38%	0.383	38%	0.382	S	S	.	.			trans	-112.7	154.2	-178.1	-62.8	-61.3	174	-158.6	0	112.3	A392 D395 D397 G409 D410	A392-K407 WeakPolarHBondContact CB-O 3.22Å; D395-K407 HydrophobicContact CB-CD 4.24Å; D395-K407 WeakPolarHBondContact OD1-CA 3.33Å; D395-K407 WeakPolarHBondContact OD1-CD 3.33Å; D395-K407 WeakPolarHBondContact OD2-CD 3.49Å; D395-K407 WeakPolarHBondContact OD2-CE 3.41Å; D395-K407 IonicContact OD2-NZ 2.8Å; D395-K407 PolarHBondContact OD2-NZ 3.37Å; D397-K407 IonicContact OD1-NZ 3.73Å; D397-K407 PolarHBondContact OD1-NZ 2.78Å; D397-K407 VanDerWaalsContact OD1-NZ 3.16Å; D397-K407 IonicContact OD2-NZ 3.21Å; K407-G409 PolarHBondContact O-N 3.42Å; K407-D410 PolarHBondContact N-OD2 3.32Å; K407-D410 VanDerWaalsContact O-CB 3.25Å; K407-D410 WeakPolarHBondContact O-CB 3.5Å; K407-D410 PolarHBondContact O-N 3.06Å
408	A	94.8	Very high	92.2	Very high	55 Å²	55	71.7 Å²	71.7	46%	0.455	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	125.6	178.4	0	0	0	0	0	110.7	D395	D395-A408 PolarHBondContact OD1-N 2.93Å
409	G	92.3	Very high	92	Very high	43 Å²	43	73.8 Å²	73.8	44%	0.443	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.4	-14	-173.7	0	0	0	0	0	115.1	A392 K407	A392-G409 PolarHBondContact O-N 3.3Å; K407-G409 PolarHBondContact O-N 3.42Å
410	D	94.3	Very high	91.8	Very high	73 Å²	73	76 Å²	76	39%	0.39	40%	0.4	S	S	.	.			trans	-63	146.9	173.5	-71.5	-14.5	0	0	0	110.9	R391 A392 F406 K407	R391-D410 CarbonylContact C-O 3.6Å; R391-D410 WeakPolarHBondContact CA-O 3.44Å; A392-D410 HydrophobicContact CB-CB 4.46Å; A392-D410 PolarHBondContact N-O 3.3Å; F406-D410 HydrophobicContact CB-CB 4.34Å; K407-D410 PolarHBondContact N-OD2 3.32Å; K407-D410 VanDerWaalsContact O-CB 3.25Å; K407-D410 WeakPolarHBondContact O-CB 3.5Å; K407-D410 PolarHBondContact O-N 3.06Å
411	E	94.5	Very high	91.7	Very high	67 Å²	67	76.9 Å²	76.9	31%	0.313	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	142.3	175.2	-60.7	-168.7	173.1	0	0	111.1	R389 V390 R391 I444	R389-E411 IonicContact CZ-OE2 3.47Å; R389-E411 IonicContact NE-OE2 2.69Å; R389-E411 IonicContact NH2-OE2 3.09Å; R389-E411 PolarHBondContact NH2-OE2 2.85Å; V390-E411 WeakPolarHBondContact O-CA 3.26Å; R391-E411 IonicContact CZ-OE1 2.86Å; R391-E411 IonicContact NE-OE1 3.91Å; R391-E411 IonicContact NH2-OE1 3.93Å; R391-E411 PolarHBondContact NH2-OE1 2.96Å; E411-I444 HydrophobicContact CB-CD1 4.34Å; E411-I444 VanDerWaalsContact CD-CD1 3.41Å; E411-I444 HydrophobicContact CG-CD1 3.73Å; E411-I444 WeakPolarHBondContact OE1-CD1 3.16Å
412	L	94.5	Very high	91.9	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	168.5	179.1	61.1	130.6	0	0	0	111	V390 R427 L428 Y436 V441	V390-L412 HydrophobicContact CG2-CD1 3.79Å; V390-L412 HydrophobicContact CG2-CD2 4.24Å; V390-L412 HydrophobicContact CG2-CG 3.6Å; V390-L412 PolarHBondContact N-O 3.22Å; V390-L412 PolarHBondContact O-N 2.75Å; L412-R427 WeakPolarHBondContact CA-O 3.45Å; L412-R427 WeakPolarHBondContact CB-O 3.35Å; L412-L428 HydrophobicContact CB-CD2 4.06Å; L412-Y436 HydrophobicContact CD1-CD1 3.92Å; L412-Y436 HydrophobicContact CD1-CE1 3.61Å; L412-Y436 HydrophobicContact CD1-CE2 4.35Å; L412-Y436 HydrophobicContact CD1-CG 4.4Å; L412-V441 HydrophobicContact CD2-CG1 4.13Å
413	T	95.5	Very high	92.1	Very high	34 Å²	34	66.9 Å²	66.9	21%	0.209	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	113.5	-177.3	-61	0	0	0	0	109.5	R389 L415 G426 R427	R389-T413 PolarHBondContact NH1-OG1 3.14Å; T413-L415 HydrophobicContact CG2-CD2 3.93Å; T413-G426 CarbonylContact O-C 3.57Å; T413-G426 VanDerWaalsContact O-CA 3.27Å; T413-G426 WeakPolarHBondContact O-CA 3.46Å; T413-R427 PolarHBondContact N-O 3.43Å; T413-R427 PolarHBondContact O-N 3.17Å
414	K	93.3	Very high	92.1	Very high	58 Å²	58	65.9 Å²	65.9	25%	0.252	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	123.9	174.3	178.5	169.5	178.2	163.6	0	109.8	G387 V388 V390 G416 C424 Y436	G387-K414 CarbonylContact C-O 3.51Å; G387-K414 WeakPolarHBondContact CA-O 3.34Å; V388-K414 HydrophobicContact CB-CB 4.46Å; V388-K414 PolarHBondContact N-O 3.07Å; V388-K414 PolarHBondContact O-N 2.97Å; V390-K414 HydrophobicContact CG1-CB 4.05Å; V390-K414 HydrophobicContact CG2-CB 4.43Å; K414-G416 WeakPolarHBondContact CE-O 3.45Å; K414-G416 WeakPolarHBondContact CG-O 3.11Å; K414-C424 WeakPolarHBondContact CE-SG 3.49Å; K414-C424 PolarHBondContact NZ-SG 2.77Å; K414-Y436 WeakPolarHBondContact CB-OH 3.44Å; K414-Y436 WeakPolarHBondContact CG-OH 3.34Å
415	L	90.8	Very high	92.1	Very high	54 Å²	54	72.7 Å²	72.7	28%	0.283	38%	0.378	S	S	.	.			trans	-112.3	-1.6	-172.4	-65.7	179.3	0	0	0	114.6	T413 R425 R427 L433	T413-L415 HydrophobicContact CG2-CD2 3.93Å; L415-R425 PolarHBondContact N-O 3.24Å; L415-R427 HydrophobicContact CD1-CB 4Å; L415-L433 HydrophobicContact CD1-CD2 3.4Å
416	G	86.1	Confident	92	Very high	33 Å²	33	69.9 Å²	69.9	34%	0.34	36%	0.359	S	S	.	.	S	Bend	trans	-156.5	169.5	177.7	0	0	0	0	0	111.2	K414	K414-G416 WeakPolarHBondContact CE-O 3.45Å; K414-G416 WeakPolarHBondContact CG-O 3.11Å
417	E	86.6	Confident	92	Very high	180 Å²	180	72.5 Å²	72.5	84%	0.841	37%	0.368	S	S	*	.			trans	-74	173.6	171.4	-63.4	-163.8	160	0	0	111.6
418	E	91	Very high	91.8	Very high	118 Å²	118	69.4 Å²	69.4	55%	0.551	36%	0.356	S	S	*	.			trans	-74.5	135.9	175.7	-174	177	150.9	0	0	110	W423 A438	E418-W423 WeakPolarHBondContact CA-O 3.36Å; E418-A438 HydrophobicContact CB-CB 4.28Å; E418-A438 HydrophobicContact CG-CB 3.72Å; E418-A438 VanDerWaalsContact OE2-CB 3.29Å; E418-A438 WeakPolarHBondContact OE2-CB 3.37Å
419	D	89.1	Confident	91.4	Very high	68 Å²	68	72.1 Å²	72.1	36%	0.364	36%	0.363	S	S	.	.			trans	-84.8	178.2	176.4	79	-1.6	0	0	0	113	Q421 G422 W423	D419-Q421 PolarHBondContact O-N 3.4Å; D419-Q421 WeakPolarHBondContact OD1-CA 3.4Å; D419-Q421 WeakPolarHBondContact OD1-CB 3.48Å; D419-Q421 PolarHBondContact OD1-N 2.9Å; D419-G422 PolarHBondContact O-N 2.99Å; D419-G422 PolarHBondContact OD1-N 3.03Å; D419-W423 PolarHBondContact N-O 2.94Å; D419-W423 PolarHBondContact OD1-N 3.3Å
420	E	84.7	Confident	91	Very high	205 Å²	205	74.6 Å²	74.6	96%	0.958	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-8.3	-179.9	-60.2	-175.8	171.3	0	0	114.2
421	Q	86.3	Confident	90.6	Very high	156 Å²	156	73.4 Å²	73.4	73%	0.729	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.4	0.4	-176.8	-67.7	162.4	96.1	0	0	112.6	D419	D419-Q421 PolarHBondContact O-N 3.4Å; D419-Q421 WeakPolarHBondContact OD1-CA 3.4Å; D419-Q421 WeakPolarHBondContact OD1-CB 3.48Å; D419-Q421 PolarHBondContact OD1-N 2.9Å
422	G	90.3	Very high	90.4	Very high	19 Å²	19	75 Å²	75	20%	0.196	39%	0.385	C	S	.	.	S	Bend	trans	90.1	15	177.8	0	0	0	0	0	114.9	D419 A438	D419-G422 PolarHBondContact O-N 2.99Å; D419-G422 PolarHBondContact OD1-N 3.03Å; G422-A438 WeakPolarHBondContact O-CB 3.37Å; G422-A438 PolarHBondContact O-N 3.01Å
423	W	95.1	Very high	90.3	Very high	66 Å²	66	79 Å²	79	25%	0.25	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	145	-177.6	-64.7	83.3	0	0	0	112.4	Y396 E403 E418 D419 L435 Y436 P437	Y396-W423 WeakPolarHBondContact OH-CH2 3.32Å; Y396-W423 WeakPolarHBondContact OH-CZ3 3.4Å; E403-W423 HydrophobicContact CG-CH2 4.1Å; E403-W423 HydrophobicContact CG-CZ3 3.9Å; E418-W423 WeakPolarHBondContact CA-O 3.36Å; D419-W423 PolarHBondContact N-O 2.94Å; D419-W423 PolarHBondContact OD1-N 3.3Å; W423-L435 HydrophobicContact CE3-CB 3.89Å; W423-L435 HydrophobicContact CZ3-CB 4.4Å; W423-Y436 VanDerWaalsContact CE3-C 3.44Å; W423-P437 HydrophobicContact CE3-CG 4.4Å; W423-P437 HydrophobicContact CH2-CG 4.36Å; W423-P437 HydrophobicContact CZ3-CG 4.1Å
424	C	93.9	Very high	90.2	Very high	1 Å²	1	77.8 Å²	77.8	1%	0.007	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	145.8	172.9	-78.6	0	0	0	0	110.2	K414 L435 Y436 A438	K414-C424 WeakPolarHBondContact CE-SG 3.49Å; K414-C424 PolarHBondContact NZ-SG 2.77Å; C424-L435 CarbonylContact O-C 3.57Å; C424-L435 WeakPolarHBondContact O-CA 3.35Å; C424-Y436 HydrophobicContact CB-CD1 4.35Å; C424-Y436 HydrophobicContact CB-CD2 4.45Å; C424-Y436 HydrophobicContact CB-CE1 3.71Å; C424-Y436 HydrophobicContact CB-CE2 3.81Å; C424-Y436 VanDerWaalsContact CB-CZ 3.41Å; C424-Y436 PolarHBondContact N-O 3.25Å; C424-Y436 VanDerWaalsContact O-CD1 3.22Å; C424-Y436 WeakPolarHBondContact O-CD1 3.33Å; C424-Y436 WeakPolarHBondContact O-CE1 3.37Å; C424-Y436 PolarHBondContact O-N 2.84Å; C424-A438 HydrophobicContact CB-CB 4.5Å; C424-A438 VanDerWaalsContact SG-CB 3.55Å
425	R	94.2	Very high	90.3	Very high	143 Å²	143	77.4 Å²	77.4	54%	0.54	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	132.8	169.6	-166	176.9	-176.5	-167.9	0.7	110.4	L415 L435	L415-R425 PolarHBondContact N-O 3.24Å; R425-L435 HydrophobicContact CB-CD2 4.26Å
426	G	93.4	Very high	90.5	Very high	0 Å²	0	74.9 Å²	74.9	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	169.6	-177.8	0	0	0	0	0	114.2	T413 L433 G434	T413-G426 CarbonylContact O-C 3.57Å; T413-G426 VanDerWaalsContact O-CA 3.27Å; T413-G426 WeakPolarHBondContact O-CA 3.46Å; G426-L433 WeakPolarHBondContact O-CA 3.48Å; G426-G434 PolarHBondContact N-O 3.28Å; G426-G434 PolarHBondContact O-N 3.43Å; G426-G434 VanDerWaalsContact O-N 3.14Å
427	R	95.3	Very high	91	Very high	62 Å²	62	74 Å²	74	23%	0.234	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	127.1	168.4	-159.2	-172.7	-54.5	168.7	10.3	110	D383 D384 L412 T413 L415 Q432 L433	D383-R427 PolarHBondContact O-NH2 3.16Å; D383-R427 VanDerWaalsContact O-NH2 3.11Å; D384-R427 IonicContact OD1-CZ 3.5Å; D384-R427 IonicContact OD1-NH1 2.92Å; D384-R427 PolarHBondContact OD1-NH1 2.9Å; D384-R427 IonicContact OD1-NH2 2.84Å; L412-R427 WeakPolarHBondContact CA-O 3.45Å; L412-R427 WeakPolarHBondContact CB-O 3.35Å; T413-R427 PolarHBondContact N-O 3.43Å; T413-R427 PolarHBondContact O-N 3.17Å; L415-R427 HydrophobicContact CD1-CB 4Å; R427-Q432 CarbonylContact C-O 3.39Å; R427-Q432 VanDerWaalsContact CA-O 3.27Å; R427-Q432 WeakPolarHBondContact CA-O 3.15Å; R427-L433 HydrophobicContact CB-CD2 3.76Å; R427-L433 HydrophobicContact CG-CD2 3.73Å; R427-L433 HydrophobicContact CG-CG 4.07Å
428	L	92.2	Very high	91.3	Very high	22 Å²	22	66.1 Å²	66.1	12%	0.115	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	159.2	169.4	-60.9	179.4	0	0	0	110.5	L404 F406 L412 S430 G431 Q432	L404-L428 HydrophobicContact CD1-CD2 4.26Å; L404-L428 HydrophobicContact CD1-CG 4.2Å; L404-L428 HydrophobicContact CD2-CD1 4.2Å; L404-L428 HydrophobicContact CD2-CG 4.07Å; F406-L428 HydrophobicContact CB-CD2 4.15Å; F406-L428 HydrophobicContact CD1-CD2 4.44Å; L412-L428 HydrophobicContact CB-CD2 4.06Å; L428-S430 WeakPolarHBondContact CB-OG 3.46Å; L428-S430 PolarHBondContact O-N 2.8Å; L428-S430 VanDerWaalsContact O-N 3.1Å; L428-G431 WeakPolarHBondContact O-CA 3.46Å; L428-G431 PolarHBondContact O-N 2.77Å; L428-Q432 HydrophobicContact CD1-CB 4.39Å; L428-Q432 PolarHBondContact N-O 2.94Å
429	D	86	Confident	91.4	Very high	112 Å²	112	65.9 Å²	65.9	60%	0.599	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-14.4	175.3	-71.8	-10.1	0	0	0	113.3	R389 G431	R389-D429 IonicContact CZ-OD1 3.3Å; R389-D429 IonicContact CZ-OD2 2.72Å; R389-D429 IonicContact NH1-OD1 3.01Å; R389-D429 PolarHBondContact NH1-OD1 2.69Å; R389-D429 IonicContact NH1-OD2 3.75Å; R389-D429 IonicContact NH2-OD1 3.76Å; R389-D429 PolarHBondContact NH2-OD1 2.77Å; R389-D429 IonicContact NH2-OD2 3.79Å; R389-D429 PolarHBondContact NH2-OD2 2.76Å; D429-G431 PolarHBondContact O-N 2.99Å
430	S	84.9	Confident	91.7	Very high	96 Å²	96	66.2 Å²	66.2	67%	0.671	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-7.6	167.6	63.2	0	0	0	0	114.4	L428	L428-S430 WeakPolarHBondContact CB-OG 3.46Å; L428-S430 PolarHBondContact O-N 2.8Å; L428-S430 VanDerWaalsContact O-N 3.1Å
431	G	85.1	Confident	92.1	Very high	47 Å²	47	57.4 Å²	57.4	49%	0.485	30%	0.301	S	S	.	.	S	Bend	trans	87.3	-6.4	-174	0	0	0	0	0	114.9	L428 D429 L433	L428-G431 WeakPolarHBondContact O-CA 3.46Å; L428-G431 PolarHBondContact O-N 2.77Å; D429-G431 PolarHBondContact O-N 2.99Å; G431-L433 PolarHBondContact O-N 3.09Å
432	Q	89.7	Confident	92.5	Very high	101 Å²	101	54.2 Å²	54.2	47%	0.472	29%	0.287	S	S	.	.			trans	-66.7	130.4	178.8	-172.7	176.3	-6.8	0	0	111.4	L404 R427 L428	L404-Q432 HydrophobicContact CD2-CB 4.38Å; L404-Q432 HydrophobicContact CD2-CG 3.86Å; R427-Q432 CarbonylContact C-O 3.39Å; R427-Q432 VanDerWaalsContact CA-O 3.27Å; R427-Q432 WeakPolarHBondContact CA-O 3.15Å; L428-Q432 HydrophobicContact CD1-CB 4.39Å; L428-Q432 PolarHBondContact N-O 2.94Å
433	L	93.3	Very high	92.5	Very high	83 Å²	83	56.9 Å²	56.9	44%	0.435	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	141.9	176.3	-74.4	165.7	0	0	0	110.4	L415 G426 R427 G431	L415-L433 HydrophobicContact CD1-CD2 3.4Å; G426-L433 WeakPolarHBondContact O-CA 3.48Å; R427-L433 HydrophobicContact CB-CD2 3.76Å; R427-L433 HydrophobicContact CG-CD2 3.73Å; R427-L433 HydrophobicContact CG-CG 4.07Å; G431-L433 PolarHBondContact O-N 3.09Å
434	G	93.9	Very high	92	Very high	9 Å²	9	59.4 Å²	59.4	9%	0.093	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.6	-173.3	175.4	0	0	0	0	0	113.5	D402 G426	D402-G434 CarbonylContact O-C 3.59Å; D402-G434 WeakPolarHBondContact O-CA 3.4Å; G426-G434 PolarHBondContact N-O 3.28Å; G426-G434 PolarHBondContact O-N 3.43Å; G426-G434 VanDerWaalsContact O-N 3.14Å
435	L	95.3	Very high	92	Very high	51 Å²	51	62.4 Å²	62.4	27%	0.267	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	150.6	175.7	-61.5	179.1	0	0	0	111.3	D402 E403 L404 W423 C424 R425	D402-L435 PolarHBondContact O-N 3.03Å; E403-L435 CarbonylContact C-O 3.4Å; E403-L435 WeakPolarHBondContact CA-O 3.26Å; L404-L435 PolarHBondContact N-O 3.49Å; W423-L435 HydrophobicContact CE3-CB 3.89Å; W423-L435 HydrophobicContact CZ3-CB 4.4Å; C424-L435 CarbonylContact O-C 3.57Å; C424-L435 WeakPolarHBondContact O-CA 3.35Å; R425-L435 HydrophobicContact CB-CD2 4.26Å
436	Y	94.8	Very high	91.8	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	155.2	171.1	67.8	-85.9	0	0	0	111	L404 F406 L412 K414 W423 C424 A438 V441	L404-Y436 HydrophobicContact CD1-CD1 4.28Å; F406-Y436 HydrophobicContact CE1-CG 4.36Å; L412-Y436 HydrophobicContact CD1-CD1 3.92Å; L412-Y436 HydrophobicContact CD1-CE1 3.61Å; L412-Y436 HydrophobicContact CD1-CE2 4.35Å; L412-Y436 HydrophobicContact CD1-CG 4.4Å; K414-Y436 WeakPolarHBondContact CB-OH 3.44Å; K414-Y436 WeakPolarHBondContact CG-OH 3.34Å; W423-Y436 VanDerWaalsContact CE3-C 3.44Å; C424-Y436 HydrophobicContact CB-CD1 4.35Å; C424-Y436 HydrophobicContact CB-CD2 4.45Å; C424-Y436 HydrophobicContact CB-CE1 3.71Å; C424-Y436 HydrophobicContact CB-CE2 3.81Å; C424-Y436 VanDerWaalsContact CB-CZ 3.41Å; C424-Y436 PolarHBondContact N-O 3.25Å; C424-Y436 VanDerWaalsContact O-CD1 3.22Å; C424-Y436 WeakPolarHBondContact O-CD1 3.33Å; C424-Y436 WeakPolarHBondContact O-CE1 3.37Å; C424-Y436 PolarHBondContact O-N 2.84Å; Y436-A438 PolarHBondContact O-N 3.16Å; Y436-V441 HydrophobicContact CD2-CG1 3.86Å; Y436-V441 HydrophobicContact CE2-CB 4.3Å; Y436-V441 HydrophobicContact CE2-CG1 3.64Å; Y436-V441 HydrophobicContact CE2-CG2 3.6Å
437	P	95.4	Very high	91.7	Very high	14 Å²	14	61.3 Å²	61.3	9%	0.091	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	127.1	177.5	-19.1	32.2	0	0	0	111.5	Y396 W423 N439 Y440	Y396-P437 HydrophobicContact CD2-CG 4.06Å; Y396-P437 HydrophobicContact CE2-CG 3.54Å; W423-P437 HydrophobicContact CE3-CG 4.4Å; W423-P437 HydrophobicContact CH2-CG 4.36Å; W423-P437 HydrophobicContact CZ3-CG 4.1Å; P437-N439 VanDerWaalsContact CB-OD1 3.31Å; P437-N439 WeakPolarHBondContact CB-OD1 3.48Å; P437-N439 PolarHBondContact O-N 3.22Å; P437-N439 VanDerWaalsContact O-N 3.12Å; P437-Y440 HydrophobicContact CB-CD2 3.74Å; P437-Y440 HydrophobicContact CB-CE2 4.33Å; P437-Y440 HydrophobicContact CB-CG 4.28Å; P437-Y440 HydrophobicContact CG-CD2 4.15Å; P437-Y440 HydrophobicContact CG-CG 4.44Å; P437-Y440 WeakPolarHBondContact O-CB 3.37Å; P437-Y440 PolarHBondContact O-N 3.18Å
438	A	93	Very high	91.5	Very high	15 Å²	15	61.3 Å²	61.3	12%	0.124	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-59.9	-29.2	-174.3	0	0	0	0	0	113.5	E418 G422 C424 Y436 Y440	E418-A438 HydrophobicContact CB-CB 4.28Å; E418-A438 HydrophobicContact CG-CB 3.72Å; E418-A438 VanDerWaalsContact OE2-CB 3.29Å; E418-A438 WeakPolarHBondContact OE2-CB 3.37Å; G422-A438 WeakPolarHBondContact O-CB 3.37Å; G422-A438 PolarHBondContact O-N 3.01Å; C424-A438 HydrophobicContact CB-CB 4.5Å; C424-A438 VanDerWaalsContact SG-CB 3.55Å; Y436-A438 PolarHBondContact O-N 3.16Å; A438-Y440 VanDerWaalsContact C-N 3.31Å; A438-Y440 PolarHBondContact O-N 3.28Å
439	N	94.4	Very high	91.5	Very high	114 Å²	114	63.8 Å²	63.8	61%	0.61	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-80.9	-1.5	179	65.9	-36.6	0	0	0	114.7	P437	P437-N439 VanDerWaalsContact CB-OD1 3.31Å; P437-N439 WeakPolarHBondContact CB-OD1 3.48Å; P437-N439 PolarHBondContact O-N 3.22Å; P437-N439 VanDerWaalsContact O-N 3.12Å
440	Y	94.1	Very high	91.9	Very high	75 Å²	75	60.5 Å²	60.5	29%	0.294	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-91.6	-0.5	177.4	-87.4	-121.7	0	0	0	113.4	L393 Y394 Y396 P437 A438	L393-Y440 PolarHBondContact N-O 2.97Å; Y394-Y440 HydrophobicContact CD2-CD1 4.25Å; Y394-Y440 HydrophobicContact CD2-CG 4.33Å; Y396-Y440 AromaticContact CD2-CD1 3.94Å; Y396-Y440 HydrophobicContact CD2-CD1 3.94Å; Y396-Y440 AromaticContact CD2-CE1 3.84Å; Y396-Y440 HydrophobicContact CD2-CE1 3.84Å; Y396-Y440 HydrophobicContact CG-CD1 4.34Å; P437-Y440 HydrophobicContact CB-CD2 3.74Å; P437-Y440 HydrophobicContact CB-CE2 4.33Å; P437-Y440 HydrophobicContact CB-CG 4.28Å; P437-Y440 HydrophobicContact CG-CD2 4.15Å; P437-Y440 HydrophobicContact CG-CG 4.44Å; P437-Y440 WeakPolarHBondContact O-CB 3.37Å; P437-Y440 PolarHBondContact O-N 3.18Å; A438-Y440 VanDerWaalsContact C-N 3.31Å; A438-Y440 PolarHBondContact O-N 3.28Å
441	V	94.1	Very high	92.4	Very high	19 Å²	19	58 Å²	58	12%	0.115	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	156.7	-177.8	-51	0	0	0	0	112.5	V390 R391 L412 Y436	V390-V441 HydrophobicContact CB-CB 3.98Å; V390-V441 HydrophobicContact CB-CG2 3.84Å; V390-V441 HydrophobicContact CG1-CG2 4.29Å; V390-V441 HydrophobicContact CG2-CB 3.87Å; V390-V441 HydrophobicContact CG2-CG1 4.11Å; V390-V441 HydrophobicContact CG2-CG2 3.74Å; R391-V441 CarbonylContact O-C 3.6Å; R391-V441 WeakPolarHBondContact O-CA 3.39Å; R391-V441 WeakPolarHBondContact O-CB 3.37Å; L412-V441 HydrophobicContact CD2-CG1 4.13Å; Y436-V441 HydrophobicContact CD2-CG1 3.86Å; Y436-V441 HydrophobicContact CE2-CB 4.3Å; Y436-V441 HydrophobicContact CE2-CG1 3.64Å; Y436-V441 HydrophobicContact CE2-CG2 3.6Å
442	E	94.2	Very high	92.9	Very high	90 Å²	90	58.8 Å²	58.8	42%	0.421	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	151.2	167.2	63.4	178.2	-176.2	0	0	111	V390 R391 L393	V390-E442 CarbonylContact C-O 3.48Å; V390-E442 WeakPolarHBondContact CA-O 3.28Å; V390-E442 VanDerWaalsContact CB-O 3.25Å; V390-E442 WeakPolarHBondContact CB-O 3.45Å; R391-E442 HydrophobicContact CB-CG 4.19Å; R391-E442 PolarHBondContact N-O 3.47Å; R391-E442 IonicContact NH1-OE1 3.76Å; R391-E442 PolarHBondContact O-N 3.3Å; L393-E442 HydrophobicContact CD1-CB 4.32Å; L393-E442 HydrophobicContact CD2-CB 4.1Å; L393-E442 HydrophobicContact CD2-CG 3.76Å; L393-E442 HydrophobicContact CG-CB 4.29Å; L393-E442 HydrophobicContact CG-CG 4.29Å
443	A	90.6	Very high	93.2	Very high	74 Å²	74	55.3 Å²	55.3	61%	0.612	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	144	171.2	0	0	0	0	0	111.1
444	I	85.1	Confident	93.2	Very high	120 Å²	120	52.8 Å²	52.8	62%	0.615	30%	0.295	S	S	*	.			trans	-98.4	0	-177.9	-49.5	179.6	0	0	0	111.1	R389 R391 E411	R389-I444 HydrophobicContact CB-CB 4.47Å; R389-I444 HydrophobicContact CB-CD1 4.28Å; R389-I444 PolarHBondContact O-N 3.03Å; R391-I444 HydrophobicContact CB-CD1 3.85Å; R391-I444 HydrophobicContact CB-CG1 3.95Å; E411-I444 HydrophobicContact CB-CD1 4.34Å; E411-I444 VanDerWaalsContact CD-CD1 3.41Å; E411-I444 HydrophobicContact CG-CD1 3.73Å; E411-I444 WeakPolarHBondContact OE1-CD1 3.16Å

Retrieved 444 of 444 residues in 147.1 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).