UBA3_HUMAN Loading...

NEDD8-activating enzyme E1 catalytic subunit

Catalytic subunit of the dimeric UBA3-NAE1 E1 enzyme. E1 activates NEDD8 by first adenylating its C-terminal glycine residue with ATP, thereafter linking this residue to the side chain of the catalytic cysteine, yielding a NEDD8-UBA3 thioester and free AMP. E1 finally transfers NEDD8 to the catalytic cysteine of UBE2M. Down-regulates steroid receptor activity. Necessary for cell cycle progression.

AlphaFold DB , UniProt , Accession Q8TBC4, Species HUMAN (Homo sapiens, Human), Gene UBA3, Length 463 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.6	Very low	48.8	Very low	253 Å²	253	132.5 Å²	132.5	100%	1.246	68%	0.682	S	S	*	*				0	40.3	0	-70.3	-165.8	-81.2	0	0	110.8
2	A	46.2	Very low	49.7	Very low	84 Å²	84	134.8 Å²	134.8	69%	0.694	68%	0.676	S	S	*	*			trans	-127	-4.6	-177.3	0	0	0	0	0	113.9	G4	A2-G4 VanDerWaalsContact C-N 3.26Å; A2-G4 PolarHBondContact O-N 3.28Å
3	D	50.4	Low	50.6	Low	161 Å²	161	136.8 Å²	136.8	86%	0.861	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	13.8	-175.3	-62.6	-30.8	0	0	0	114.7
4	G	45.4	Very low	50.9	Low	54 Å²	54	131.4 Å²	131.4	56%	0.557	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	-19.1	-177.7	0	0	0	0	0	115.4	A2	A2-G4 VanDerWaalsContact C-N 3.26Å; A2-G4 PolarHBondContact O-N 3.28Å
5	E	48.4	Very low	51.1	Low	135 Å²	135	129.6 Å²	129.6	63%	0.631	63%	0.634	S	S	*	*	H	α-helix	trans	-87.1	-21.9	-170.6	-77.1	-170.8	161.4	0	0	114.3	E8 K9	E5-E8 PolarHBondContact O-N 3.29Å; E5-K9 PolarHBondContact O-N 2.9Å
6	E	49.5	Very low	51.6	Low	127 Å²	127	130.1 Å²	130.1	59%	0.593	64%	0.635	S	S	*	*	H	α-helix	trans	-72.7	-41.9	-172.4	-162.1	162.1	-176	0	0	114.3	E8 K9 K10	E6-E8 PolarHBondContact O-N 2.76Å; E6-K9 PolarHBondContact O-N 3.48Å; E6-K10 PolarHBondContact O-N 2.76Å; E6-K10 VanDerWaalsContact O-N 3.13Å
7	P	43.9	Very low	51.6	Low	86 Å²	86	127.1 Å²	127.1	56%	0.558	62%	0.622	S	S	*	*	H	α-helix	trans	-61.4	-35.5	172.8	-19.2	31.2	0	0	0	112	K10 R11	P7-K10 PolarHBondContact O-N 3.12Å; P7-R11 WeakPolarHBondContact O-CB 3.41Å; P7-R11 PolarHBondContact O-N 3.37Å
8	E	45.5	Very low	51.3	Low	115 Å²	115	124.5 Å²	124.5	54%	0.537	61%	0.611	S	S	.	*	H	α-helix	trans	-74.6	-35.1	-177	-154.9	164.6	-179.2	0	0	112.1	E5 E6 R11 R12	E5-E8 PolarHBondContact O-N 3.29Å; E6-E8 PolarHBondContact O-N 2.76Å; E8-R11 PolarHBondContact O-N 2.83Å; E8-R12 WeakPolarHBondContact O-CG 3.49Å; E8-R12 PolarHBondContact O-N 2.9Å
9	K	56.1	Low	51	Low	146 Å²	146	121.6 Å²	121.6	64%	0.635	61%	0.609	S	S	*	*	H	α-helix	trans	-64.8	-42.6	169.6	-83.4	179.3	178.1	172.7	0	112.3	E5 E6 R11 R12 R13	E5-K9 PolarHBondContact O-N 2.9Å; E6-K9 PolarHBondContact O-N 3.48Å; K9-R11 VanDerWaalsContact C-N 3.3Å; K9-R11 PolarHBondContact O-N 3.04Å; K9-R12 PolarHBondContact O-N 3.09Å; K9-R13 PolarHBondContact O-N 3.06Å; K9-R13 VanDerWaalsContact O-N 3.08Å
10	K	53.5	Low	50.9	Low	126 Å²	126	123.4 Å²	123.4	55%	0.548	62%	0.615	S	S	.	*	H	α-helix	trans	-61.8	-41.9	176.3	-144.9	174.7	-174.5	178.4	0	110.4	E6 P7 R13 I14	E6-K10 PolarHBondContact O-N 2.76Å; E6-K10 VanDerWaalsContact O-N 3.13Å; P7-K10 PolarHBondContact O-N 3.12Å; K10-R13 PolarHBondContact O-N 3.3Å; K10-I14 WeakPolarHBondContact O-CD1 3.27Å; K10-I14 WeakPolarHBondContact O-CG1 3.21Å; K10-I14 PolarHBondContact O-N 3.19Å; K10-I14 VanDerWaalsContact O-N 3.09Å
11	R	56.6	Low	50.8	Low	171 Å²	171	123 Å²	123	65%	0.645	61%	0.61	S	S	*	*	H	α-helix	trans	-64.6	-46	176.8	-159.4	178.4	-176.2	172.6	5.5	113.1	P7 E8 K9 R13 I14 E15	P7-R11 WeakPolarHBondContact O-CB 3.41Å; P7-R11 PolarHBondContact O-N 3.37Å; E8-R11 PolarHBondContact O-N 2.83Å; K9-R11 VanDerWaalsContact C-N 3.3Å; K9-R11 PolarHBondContact O-N 3.04Å; R11-R13 VanDerWaalsContact C-N 3.34Å; R11-R13 PolarHBondContact O-N 3.06Å; R11-I14 WeakPolarHBondContact O-CB 3.18Å; R11-I14 PolarHBondContact O-N 3.12Å; R11-E15 IonicContact NE-OE1 2.79Å; R11-E15 WeakPolarHBondContact O-CG 3.38Å; R11-E15 PolarHBondContact O-N 2.77Å
12	R	59.3	Low	51	Low	159 Å²	159	119.1 Å²	119.1	60%	0.6	59%	0.591	S	S	*	*	H	α-helix	trans	-61.7	-40.6	176.4	-77.4	-175.6	-176.4	-175.8	5	112.7	E8 K9 I14 E15 E16	E8-R12 WeakPolarHBondContact O-CG 3.49Å; E8-R12 PolarHBondContact O-N 2.9Å; K9-R12 PolarHBondContact O-N 3.09Å; R12-I14 VanDerWaalsContact C-N 3.3Å; R12-I14 PolarHBondContact O-N 3.43Å; R12-E15 PolarHBondContact O-N 3.24Å; R12-E16 WeakPolarHBondContact O-CB 3.24Å; R12-E16 WeakPolarHBondContact O-CG 3.22Å; R12-E16 PolarHBondContact O-N 3.05Å
13	R	61.2	Low	50.8	Low	161 Å²	161	119.2 Å²	119.2	61%	0.608	59%	0.591	S	S	*	*	H	α-helix	trans	-65.6	-35.4	176.9	-157.7	175	-173.6	-178.5	1.3	111.7	K9 K10 R11 L17	K9-R13 PolarHBondContact O-N 3.06Å; K9-R13 VanDerWaalsContact O-N 3.08Å; K10-R13 PolarHBondContact O-N 3.3Å; R11-R13 VanDerWaalsContact C-N 3.34Å; R11-R13 PolarHBondContact O-N 3.06Å; R13-L17 HydrophobicContact CG-CD1 4.47Å; R13-L17 WeakPolarHBondContact O-CB 3.45Å; R13-L17 WeakPolarHBondContact O-CD1 3.38Å; R13-L17 WeakPolarHBondContact O-CG 3.15Å; R13-L17 PolarHBondContact O-N 3.47Å; R13-L17 VanDerWaalsContact O-N 3.16Å
14	I	54.6	Low	50.4	Low	61 Å²	61	116.4 Å²	116.4	31%	0.313	58%	0.58	S	S	.	*	H	α-helix	trans	-67.3	-44.9	173.2	-69.1	163.9	0	0	0	110.7	K10 R11 R12 L17 L18 F65	K10-I14 WeakPolarHBondContact O-CD1 3.27Å; K10-I14 WeakPolarHBondContact O-CG1 3.21Å; K10-I14 PolarHBondContact O-N 3.19Å; K10-I14 VanDerWaalsContact O-N 3.09Å; R11-I14 WeakPolarHBondContact O-CB 3.18Å; R11-I14 PolarHBondContact O-N 3.12Å; R12-I14 VanDerWaalsContact C-N 3.3Å; R12-I14 PolarHBondContact O-N 3.43Å; I14-L17 PolarHBondContact O-N 3.41Å; I14-L18 HydrophobicContact CG2-CD1 3.71Å; I14-L18 HydrophobicContact CG2-CG 4.41Å; I14-L18 WeakPolarHBondContact O-CB 3.41Å; I14-L18 WeakPolarHBondContact O-CD1 3.44Å; I14-L18 VanDerWaalsContact O-CG 3.25Å; I14-L18 WeakPolarHBondContact O-CG 3.46Å; I14-L18 PolarHBondContact O-N 3.41Å; I14-F65 HydrophobicContact CG1-CE2 4.19Å; I14-F65 HydrophobicContact CG1-CZ 4.34Å
15	E	54.2	Low	50.2	Low	105 Å²	105	121.2 Å²	121.2	49%	0.491	59%	0.593	S	S	.	*	H	α-helix	trans	-63.8	-41.5	178.1	-73.4	172.7	178.1	0	0	112.5	R11 R12 L18 A19	R11-E15 IonicContact NE-OE1 2.79Å; R11-E15 WeakPolarHBondContact O-CG 3.38Å; R11-E15 PolarHBondContact O-N 2.77Å; R12-E15 PolarHBondContact O-N 3.24Å; E15-L18 PolarHBondContact O-N 3.33Å; E15-A19 WeakPolarHBondContact O-CB 3.15Å; E15-A19 PolarHBondContact O-N 3.32Å
16	E	59.6	Low	49.4	Very low	137 Å²	137	119.3 Å²	119.3	64%	0.64	61%	0.609	S	S	*	*	H	α-helix	trans	-63.8	-43	175.4	-75.4	175.3	173	0	0	111.9	R12 L18 A19 E20	R12-E16 WeakPolarHBondContact O-CB 3.24Å; R12-E16 WeakPolarHBondContact O-CG 3.22Å; R12-E16 PolarHBondContact O-N 3.05Å; E16-L18 VanDerWaalsContact C-N 3.34Å; E16-L18 PolarHBondContact O-N 2.78Å; E16-A19 PolarHBondContact O-N 3.43Å; E16-E20 PolarHBondContact O-N 3.48Å
17	L	51.6	Low	48.7	Very low	80 Å²	80	116.3 Å²	116.3	42%	0.419	61%	0.613	S	S	.	*	H	α-helix	trans	-67.9	-31	177.3	-73.4	167.8	0	0	0	113.2	R13 I14	R13-L17 HydrophobicContact CG-CD1 4.47Å; R13-L17 WeakPolarHBondContact O-CB 3.45Å; R13-L17 WeakPolarHBondContact O-CD1 3.38Å; R13-L17 WeakPolarHBondContact O-CG 3.15Å; R13-L17 PolarHBondContact O-N 3.47Å; R13-L17 VanDerWaalsContact O-N 3.16Å; I14-L17 PolarHBondContact O-N 3.41Å
18	L	45.6	Very low	48.1	Very low	80 Å²	80	119.3 Å²	119.3	42%	0.419	63%	0.634	S	S	.	*	H	α-helix	trans	-74.8	-40.6	175.8	-74	166.5	0	0	0	111.7	I14 E15 E16 E20 K21 M22	I14-L18 HydrophobicContact CG2-CD1 3.71Å; I14-L18 HydrophobicContact CG2-CG 4.41Å; I14-L18 WeakPolarHBondContact O-CB 3.41Å; I14-L18 WeakPolarHBondContact O-CD1 3.44Å; I14-L18 VanDerWaalsContact O-CG 3.25Å; I14-L18 WeakPolarHBondContact O-CG 3.46Å; I14-L18 PolarHBondContact O-N 3.41Å; E15-L18 PolarHBondContact O-N 3.33Å; E16-L18 VanDerWaalsContact C-N 3.34Å; E16-L18 PolarHBondContact O-N 2.78Å; L18-E20 VanDerWaalsContact C-N 3.34Å; L18-E20 PolarHBondContact O-N 3.15Å; L18-K21 PolarHBondContact O-N 2.81Å; L18-M22 WeakPolarHBondContact O-CG 3.23Å; L18-M22 PolarHBondContact O-N 2.84Å; L18-M22 VanDerWaalsContact O-N 3.16Å
19	A	46.7	Very low	47.8	Very low	70 Å²	70	116.1 Å²	116.1	58%	0.579	63%	0.632	S	S	*	*	H	α-helix	trans	-64.8	-35.4	179.1	0	0	0	0	0	112.8	E15 E16	E15-A19 WeakPolarHBondContact O-CB 3.15Å; E15-A19 PolarHBondContact O-N 3.32Å; E16-A19 PolarHBondContact O-N 3.43Å
20	E	47.4	Very low	47.6	Very low	157 Å²	157	116.9 Å²	116.9	73%	0.734	64%	0.643	S	S	*	*	H	α-helix	trans	-71.3	-29.6	178	-120	178.8	179.6	0	0	113.1	E16 L18	E16-E20 PolarHBondContact O-N 3.48Å; L18-E20 VanDerWaalsContact C-N 3.34Å; L18-E20 PolarHBondContact O-N 3.15Å
21	K	50	Low	48	Very low	116 Å²	116	115.3 Å²	115.3	50%	0.504	64%	0.644	S	S	.	*	H	α-helix	trans	-88.7	-25.5	-178.9	-80.7	-174	173.9	-174.2	0	114.6	L18 A23 V24 D68	L18-K21 PolarHBondContact O-N 2.81Å; K21-A23 PolarHBondContact O-N 2.77Å; K21-A23 VanDerWaalsContact O-N 3.15Å; K21-V24 PolarHBondContact O-N 2.96Å; K21-D68 PolarHBondContact NZ-O 3.19Å
22	M	44.7	Very low	48.8	Very low	170 Å²	170	107.9 Å²	107.9	84%	0.837	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-6.4	177.7	-71.8	-176.8	74.3	0	0	114	L18	L18-M22 WeakPolarHBondContact O-CG 3.23Å; L18-M22 PolarHBondContact O-N 2.84Å; L18-M22 VanDerWaalsContact O-N 3.16Å
23	A	43.6	Very low	50.3	Low	86 Å²	86	102.4 Å²	102.4	71%	0.711	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-3.3	178.8	0	0	0	0	0	114.6	K21	K21-A23 PolarHBondContact O-N 2.77Å; K21-A23 VanDerWaalsContact O-N 3.15Å
24	V	41.8	Very low	52	Low	103 Å²	103	102.1 Å²	102.1	62%	0.624	60%	0.603	S	S	*	*	S	Bend	trans	-135.2	118.7	-174.2	-166.6	0	0	0	0	111.2	K21	K21-V24 PolarHBondContact O-N 2.96Å
25	D	39.6	Very low	54	Low	154 Å²	154	108.6 Å²	108.6	82%	0.824	63%	0.632	S	S	*	*			trans	79.9	87.5	166.8	-63.9	-20.8	0	0	0	120.7	G27	D25-G27 PolarHBondContact O-N 2.87Å
26	G	32	Very low	56	Low	95 Å²	95	105.1 Å²	105.1	98%	0.979	62%	0.624	S	S	*	*			trans	-82.1	92.2	148.1	0	0	0	0	0	110.9
27	G	34.4	Very low	57.8	Low	64 Å²	64	100.2 Å²	100.2	66%	0.66	60%	0.599	S	S	*	*			trans	-131	110.2	176.8	0	0	0	0	0	112.1	D25 G29	D25-G27 PolarHBondContact O-N 2.87Å; G27-G29 PolarHBondContact O-N 3.11Å; G27-G29 VanDerWaalsContact O-N 3.08Å
28	C	31.5	Very low	60	Low	149 Å²	149	97.6 Å²	97.6	100%	1.007	58%	0.584	S	S	*	*			trans	-76	85.2	174.2	-178.7	0	0	0	0	110.3
29	G	39.5	Very low	62.5	Low	49 Å²	49	97.8 Å²	97.8	51%	0.505	59%	0.586	S	S	.	*	S	Bend	trans	-115.9	155.8	165.4	0	0	0	0	0	110.2	G27 T31	G27-G29 PolarHBondContact O-N 3.11Å; G27-G29 VanDerWaalsContact O-N 3.08Å; G29-T31 WeakPolarHBondContact O-CG2 3.39Å; G29-T31 PolarHBondContact O-N 3.05Å
30	D	51.2	Low	65	Low	161 Å²	161	101.4 Å²	101.4	86%	0.861	59%	0.59	S	S	*	*			trans	-54.1	103.1	170.8	-177.9	8.5	0	0	0	108.4	G32	D30-G32 PolarHBondContact O-N 2.83Å
31	T	62	Low	67.4	Low	93 Å²	93	94.6 Å²	94.6	57%	0.571	56%	0.559	S	S	*	*			trans	-72.8	5.9	-166.8	52.5	0	0	0	0	112.2	G29 D33 N138	G29-T31 WeakPolarHBondContact O-CG2 3.39Å; G29-T31 PolarHBondContact O-N 3.05Å; T31-D33 PolarHBondContact O-N 3.22Å; T31-N138 PolarHBondContact O-ND2 3.19Å
32	G	74.3	Confident	69.7	Low	16 Å²	16	92.6 Å²	92.6	17%	0.165	55%	0.55	C	S	.	*	S	Bend	trans	63.7	-1.8	-174.3	0	0	0	0	0	114.1	D30 W34 R37 N138	D30-G32 PolarHBondContact O-N 2.83Å; G32-W34 VanDerWaalsContact O-CE3 3.25Å; G32-W34 WeakPolarHBondContact O-CZ3 3.34Å; G32-R37 PolarHBondContact O-NH1 2.77Å; G32-N138 WeakPolarHBondContact CA-ND2 3.37Å
33	D	91.3	Very high	72.3	Confident	44 Å²	44	89.3 Å²	89.3	24%	0.235	53%	0.532	C	S	.	.			trans	-101.4	82.5	177.8	-70.5	-38.3	0	0	0	110.4	T31 R37 W38 R94	T31-D33 PolarHBondContact O-N 3.22Å; D33-R37 IonicContact OD1-CZ 3.16Å; D33-R37 IonicContact OD1-NE 2.84Å; D33-R37 IonicContact OD1-NH1 3.9Å; D33-R37 PolarHBondContact OD1-NH1 2.84Å; D33-W38 PolarHBondContact OD1-NE1 2.92Å; D33-R94 IonicContact OD1-NH2 2.87Å; D33-R94 PolarHBondContact OD1-NH2 3.35Å; D33-R94 IonicContact OD2-CZ 2.88Å; D33-R94 IonicContact OD2-NH1 3.51Å; D33-R94 IonicContact OD2-NH2 2.62Å; D33-R94 PolarHBondContact OD2-NH2 3.16Å
34	W	95.9	Very high	74.9	Confident	154 Å²	154	89.6 Å²	89.6	58%	0.583	52%	0.517	S	S	*	.			trans	-68	161.4	178.3	63.5	89.4	0	0	0	112.8	G32 G36 R37 P137	G32-W34 VanDerWaalsContact O-CE3 3.25Å; G32-W34 WeakPolarHBondContact O-CZ3 3.34Å; W34-G36 PolarHBondContact O-N 2.98Å; W34-R37 HydrophobicContact CD2-CB 3.96Å; W34-R37 HydrophobicContact CD2-CG 4.11Å; W34-R37 HydrophobicContact CE3-CG 4.39Å; W34-R37 HydrophobicContact CG-CB 4.14Å; W34-R37 HydrophobicContact CH2-CG 3.99Å; W34-R37 HydrophobicContact CZ2-CB 4.19Å; W34-R37 HydrophobicContact CZ2-CG 3.68Å; W34-R37 HydrophobicContact CZ3-CG 4.32Å; W34-R37 VanDerWaalsContact O-CB 3.23Å; W34-R37 WeakPolarHBondContact O-CB 3.26Å; W34-R37 PolarHBondContact O-N 3.13Å; W34-R37 VanDerWaalsContact O-N 3.11Å; W34-P137 HydrophobicContact CZ3-CB 4.39Å; W34-P137 HydrophobicContact CZ3-CG 3.97Å
35	E	96.2	Very high	77.6	Confident	198 Å²	198	84.7 Å²	84.7	93%	0.925	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	126.8	179	-168.5	-171.6	170.1	0	0	111.4	R37	E35-R37 VanDerWaalsContact C-N 3.26Å; E35-R37 PolarHBondContact O-N 2.87Å
36	G	96.5	Very high	80.4	Confident	31 Å²	31	80.8 Å²	80.8	32%	0.32	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	0.1	176.4	0	0	0	0	0	116	W34 W38 N39	W34-G36 PolarHBondContact O-N 2.98Å; G36-W38 PolarHBondContact O-N 3.48Å; G36-W38 VanDerWaalsContact O-N 3.15Å; G36-N39 VanDerWaalsContact CA-CG 3.46Å; G36-N39 VanDerWaalsContact CA-ND2 3.33Å; G36-N39 WeakPolarHBondContact CA-ND2 3.39Å; G36-N39 WeakPolarHBondContact CA-OD1 3.39Å; G36-N39 VanDerWaalsContact O-CB 3.31Å; G36-N39 WeakPolarHBondContact O-CB 3.41Å; G36-N39 PolarHBondContact O-N 2.99Å; G36-N39 VanDerWaalsContact O-N 3.08Å; G36-N39 PolarHBondContact O-ND2 3.19Å
37	R	97.5	Very high	83.6	Confident	34 Å²	34	84 Å²	84	13%	0.128	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.3	-46.9	178.6	-178.9	176.7	-176.8	-175.8	7	113.1	G32 D33 W34 E35 P137 N138	G32-R37 PolarHBondContact O-NH1 2.77Å; D33-R37 IonicContact OD1-CZ 3.16Å; D33-R37 IonicContact OD1-NE 2.84Å; D33-R37 IonicContact OD1-NH1 3.9Å; D33-R37 PolarHBondContact OD1-NH1 2.84Å; W34-R37 HydrophobicContact CD2-CB 3.96Å; W34-R37 HydrophobicContact CD2-CG 4.11Å; W34-R37 HydrophobicContact CE3-CG 4.39Å; W34-R37 HydrophobicContact CG-CB 4.14Å; W34-R37 HydrophobicContact CH2-CG 3.99Å; W34-R37 HydrophobicContact CZ2-CB 4.19Å; W34-R37 HydrophobicContact CZ2-CG 3.68Å; W34-R37 HydrophobicContact CZ3-CG 4.32Å; W34-R37 VanDerWaalsContact O-CB 3.23Å; W34-R37 WeakPolarHBondContact O-CB 3.26Å; W34-R37 PolarHBondContact O-N 3.13Å; W34-R37 VanDerWaalsContact O-N 3.11Å; E35-R37 VanDerWaalsContact C-N 3.26Å; E35-R37 PolarHBondContact O-N 2.87Å; R37-P137 VanDerWaalsContact CZ-O 3.27Å; R37-P137 PolarHBondContact NH1-O 3.38Å; R37-P137 PolarHBondContact NH2-O 3.2Å; R37-N138 PolarHBondContact NH1-ND2 2.97Å
38	W	98.2	Very high	86.6	Confident	26 Å²	26	85.5 Å²	85.5	10%	0.098	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	16.3	-174.5	-58.5	114.9	0	0	0	114.2	D33 G36 H40 V41 K42 L63 L67 A89	D33-W38 PolarHBondContact OD1-NE1 2.92Å; G36-W38 PolarHBondContact O-N 3.48Å; G36-W38 VanDerWaalsContact O-N 3.15Å; W38-H40 PolarHBondContact O-N 3.02Å; W38-H40 VanDerWaalsContact O-N 3.11Å; W38-V41 HydrophobicContact CE3-CG2 4.15Å; W38-V41 PolarHBondContact O-N 3.27Å; W38-K42 HydrophobicContact CB-CG 4.39Å; W38-K42 WeakPolarHBondContact O-CG 3.14Å; W38-K42 PolarHBondContact O-N 3.46Å; W38-L63 HydrophobicContact CB-CD1 4.43Å; W38-L63 HydrophobicContact CB-CD2 3.54Å; W38-L63 HydrophobicContact CG-CD1 4.41Å; W38-L63 HydrophobicContact CG-CD2 3.88Å; W38-L67 HydrophobicContact CH2-CD2 4.31Å; W38-L67 HydrophobicContact CZ2-CD2 3.8Å; W38-A89 WeakPolarHBondContact CH2-O 3.42Å
39	N	98.5	Very high	89.7	Confident	84 Å²	84	79.9 Å²	79.9	45%	0.449	41%	0.414	S	S	.	.	H	α-helix	trans	-56.6	-31.6	-175.1	-82.3	-7.4	0	0	0	114.1	G36 K43	G36-N39 VanDerWaalsContact CA-CG 3.46Å; G36-N39 VanDerWaalsContact CA-ND2 3.33Å; G36-N39 WeakPolarHBondContact CA-ND2 3.39Å; G36-N39 WeakPolarHBondContact CA-OD1 3.39Å; G36-N39 VanDerWaalsContact O-CB 3.31Å; G36-N39 WeakPolarHBondContact O-CB 3.41Å; G36-N39 PolarHBondContact O-N 2.99Å; G36-N39 VanDerWaalsContact O-N 3.08Å; G36-N39 PolarHBondContact O-ND2 3.19Å; N39-K43 WeakPolarHBondContact O-CG 3.49Å
40	H	98.7	Very high	92.5	Very high	146 Å²	146	83.3 Å²	83.3	68%	0.676	43%	0.427	S	S	*	.	H	α-helix	trans	-72.7	-39.3	178	-66.8	-76.5	0	0	0	112.3	W38 F44	W38-H40 PolarHBondContact O-N 3.02Å; W38-H40 VanDerWaalsContact O-N 3.11Å; H40-F44 VanDerWaalsContact O-CD2 3.23Å; H40-F44 WeakPolarHBondContact O-CD2 3.49Å; H40-F44 WeakPolarHBondContact O-CE2 3.44Å
41	V	98.6	Very high	94.8	Very high	13 Å²	13	83 Å²	83	8%	0.079	42%	0.418	C	S	.	.	H	α-helix	trans	-72.8	-45.8	178.6	178.3	0	0	0	0	110.8	W38 K43 F44 L45 L63 F329	W38-V41 HydrophobicContact CE3-CG2 4.15Å; W38-V41 PolarHBondContact O-N 3.27Å; V41-K43 PolarHBondContact O-N 3.21Å; V41-K43 VanDerWaalsContact O-N 3.12Å; V41-F44 PolarHBondContact O-N 3.44Å; V41-L45 HydrophobicContact CG1-CD1 3.78Å; V41-L45 HydrophobicContact CG1-CG 4.28Å; V41-L63 HydrophobicContact CG1-CD1 3.88Å; V41-F329 HydrophobicContact CG1-CE2 3.71Å; V41-F329 HydrophobicContact CG1-CZ 3.91Å
42	K	98.5	Very high	96.5	Very high	74 Å²	74	80.3 Å²	80.3	32%	0.322	40%	0.402	S	S	.	.	H	α-helix	trans	-51.5	-38.8	-178.8	-76.8	-176.7	168.7	-163.1	0	113.7	W38 F44 L45 E46 L63	W38-K42 HydrophobicContact CB-CG 4.39Å; W38-K42 WeakPolarHBondContact O-CG 3.14Å; W38-K42 PolarHBondContact O-N 3.46Å; K42-F44 PolarHBondContact O-N 3.01Å; K42-F44 VanDerWaalsContact O-N 3.09Å; K42-L45 PolarHBondContact O-N 3.36Å; K42-L45 VanDerWaalsContact O-N 3.08Å; K42-E46 HydrophobicContact CB-CG 4.35Å; K42-E46 VanDerWaalsContact CD-OE1 3.28Å; K42-E46 WeakPolarHBondContact CD-OE1 3.32Å; K42-E46 WeakPolarHBondContact CG-OE1 3.36Å; K42-E46 WeakPolarHBondContact O-CB 3.17Å; K42-E46 WeakPolarHBondContact O-CG 3.45Å; K42-E46 PolarHBondContact O-N 2.77Å; K42-L63 HydrophobicContact CD-CD2 4.36Å; K42-L63 HydrophobicContact CG-CD2 3.81Å
43	K	98.6	Very high	97.6	Very high	102 Å²	102	81.9 Å²	81.9	44%	0.443	41%	0.405	S	S	.	.	H	α-helix	trans	-56.5	-28.5	178.7	-71.9	173.5	-173.3	-179.7	0	113.9	N39 V41 R47	N39-K43 WeakPolarHBondContact O-CG 3.49Å; V41-K43 PolarHBondContact O-N 3.21Å; V41-K43 VanDerWaalsContact O-N 3.12Å; K43-R47 WeakPolarHBondContact O-CB 3.49Å
44	F	98.6	Very high	98	Very high	91 Å²	91	85 Å²	85	40%	0.399	43%	0.428	S	S	.	.	H	α-helix	trans	-94.5	-15.8	-178.9	-60.2	-73.3	0	0	0	113.6	H40 V41 K42 F56 F329 Y336	H40-F44 VanDerWaalsContact O-CD2 3.23Å; H40-F44 WeakPolarHBondContact O-CD2 3.49Å; H40-F44 WeakPolarHBondContact O-CE2 3.44Å; V41-F44 PolarHBondContact O-N 3.44Å; K42-F44 PolarHBondContact O-N 3.01Å; K42-F44 VanDerWaalsContact O-N 3.09Å; F44-F56 WeakPolarHBondContact O-CZ 3.5Å; F44-F329 HydrophobicContact CB-CE1 4.27Å; F44-F329 HydrophobicContact CB-CZ 4.47Å; F44-Y336 AromaticContact CD1-CE2 3.82Å; F44-Y336 HydrophobicContact CD1-CE2 3.82Å; F44-Y336 HydrophobicContact CE1-CE2 4.3Å
45	L	98.5	Very high	98	Very high	0 Å²	0	82.7 Å²	82.7	0%	0	43%	0.427	C	S	.	.	H	α-helix	trans	-103.3	-32.2	-178.3	-57.4	-175.5	0	0	0	112.3	V41 K42 P58 S59 L63 F329 T333	V41-L45 HydrophobicContact CG1-CD1 3.78Å; V41-L45 HydrophobicContact CG1-CG 4.28Å; K42-L45 PolarHBondContact O-N 3.36Å; K42-L45 VanDerWaalsContact O-N 3.08Å; L45-P58 CarbonylContact O-C 3.41Å; L45-P58 WeakPolarHBondContact O-CA 3.32Å; L45-S59 PolarHBondContact O-N 2.83Å; L45-L63 HydrophobicContact CD1-CB 4.02Å; L45-L63 HydrophobicContact CD1-CD1 4.39Å; L45-F329 HydrophobicContact CD2-CE1 4.48Å; L45-F329 HydrophobicContact CD2-CZ 3.83Å; L45-F329 HydrophobicContact CG-CZ 4.22Å; L45-T333 HydrophobicContact CD2-CG2 3.66Å
46	E	98.5	Very high	98.1	Very high	73 Å²	73	74 Å²	74	34%	0.341	39%	0.386	S	S	.	.	S	Bend	trans	-93.3	-11.6	-175.6	-62.6	175.9	178.8	0	0	113.2	K42 T60	K42-E46 HydrophobicContact CB-CG 4.35Å; K42-E46 VanDerWaalsContact CD-OE1 3.28Å; K42-E46 WeakPolarHBondContact CD-OE1 3.32Å; K42-E46 WeakPolarHBondContact CG-OE1 3.36Å; K42-E46 WeakPolarHBondContact O-CB 3.17Å; K42-E46 WeakPolarHBondContact O-CG 3.45Å; K42-E46 PolarHBondContact O-N 2.77Å; E46-T60 HydrophobicContact CG-CG2 4.25Å
47	R	98.4	Very high	98.2	Very high	162 Å²	162	79.6 Å²	79.6	61%	0.611	40%	0.404	S	S	*	.	S	Bend	trans	-122.3	137.3	-175.4	-53.7	179.2	-176.7	-168.1	-2.8	110.3	K43 F56	K43-R47 WeakPolarHBondContact O-CB 3.49Å; R47-F56 WeakPolarHBondContact O-CE1 3.48Å
48	S	97.5	Very high	98.2	Very high	96 Å²	96	80.7 Å²	80.7	67%	0.671	42%	0.415	S	S	*	.			trans	-72.7	163.2	167.5	56.1	0	0	0	0	111.9
49	G	97.6	Very high	98.2	Very high	30 Å²	30	81.1 Å²	81.1	31%	0.309	42%	0.422	S	S	.	.			trans	-157.2	166.1	171.2	0	0	0	0	0	111.8	F51 T52	G49-F51 PolarHBondContact O-N 2.75Å; G49-T52 WeakPolarHBondContact O-CG2 3.48Å; G49-T52 PolarHBondContact O-OG1 2.87Å
50	P	98.1	Very high	98.1	Very high	121 Å²	121	82.3 Å²	82.3	79%	0.786	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-9	-176.6	29.4	-35.8	0	0	0	114.5
51	F	98.4	Very high	98	Very high	154 Å²	154	81.8 Å²	81.8	68%	0.675	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.1	14.1	-176.6	-55.2	-62.7	0	0	0	112.9	G49 Y336	G49-F51 PolarHBondContact O-N 2.75Å; F51-Y336 HydrophobicContact CB-CD1 4.1Å; F51-Y336 HydrophobicContact CB-CE1 4.03Å; F51-Y336 VanDerWaalsContact O-CD1 3.31Å; F51-Y336 WeakPolarHBondContact O-CD1 3.32Å
52	T	98.3	Very high	98	Very high	38 Å²	38	82.8 Å²	82.8	23%	0.233	44%	0.438	C	S	.	.	S	Bend	trans	-68.2	157.3	178.9	55.9	0	0	0	0	110.8	G49 F56 A335	G49-T52 WeakPolarHBondContact O-CG2 3.48Å; G49-T52 PolarHBondContact O-OG1 2.87Å; T52-F56 HydrophobicContact CG2-CD1 3.48Å; T52-F56 VanDerWaalsContact CG2-CD1 3.48Å; T52-F56 HydrophobicContact CG2-CE1 3.91Å; T52-F56 HydrophobicContact CG2-CG 4.11Å; T52-A335 WeakPolarHBondContact CA-O 3.43Å
53	H	98.3	Very high	97.9	Very high	49 Å²	49	79.9 Å²	79.9	23%	0.227	43%	0.426	C	S	.	.			trans	-60.2	149.1	169.4	-168.6	-98.6	0	0	0	109.8	D55 F56 S334	H53-D55 IonicContact CE1-OD2 3.65Å; H53-D55 PolarHBondContact CE1-OD2 2.85Å; H53-D55 WeakPolarHBondContact ND1-CB 3.29Å; H53-D55 PolarHBondContact ND1-N 2.9Å; H53-D55 VanDerWaalsContact ND1-N 3.15Å; H53-D55 IonicContact ND1-OD2 3.81Å; H53-D55 PolarHBondContact O-N 3.36Å; H53-F56 WeakPolarHBondContact O-CB 3.43Å; H53-F56 PolarHBondContact O-N 2.86Å; H53-S334 WeakPolarHBondContact CB-O 3.44Å; H53-S334 PolarHBondContact N-O 3.06Å
54	P	98.1	Very high	97.8	Very high	109 Å²	109	79.3 Å²	79.3	71%	0.708	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-32.7	176	-29.7	37.2	0	0	0	114.5	F56	P54-F56 VanDerWaalsContact C-N 3.31Å; P54-F56 PolarHBondContact O-N 3.19Å
55	D	97.5	Very high	97.7	Very high	106 Å²	106	78.5 Å²	78.5	57%	0.567	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	8.2	178.9	-54.8	-30	0	0	0	114.2	H53	H53-D55 IonicContact CE1-OD2 3.65Å; H53-D55 PolarHBondContact CE1-OD2 2.85Å; H53-D55 WeakPolarHBondContact ND1-CB 3.29Å; H53-D55 PolarHBondContact ND1-N 2.9Å; H53-D55 VanDerWaalsContact ND1-N 3.15Å; H53-D55 IonicContact ND1-OD2 3.81Å; H53-D55 PolarHBondContact O-N 3.36Å
56	F	98.3	Very high	97.7	Very high	14 Å²	14	78.7 Å²	78.7	6%	0.061	42%	0.423	C	S	.	.			trans	-77.7	126.8	-178.3	-177.8	-108.7	0	0	0	112	F44 R47 T52 H53 P54 P58 S334 A335	F44-F56 WeakPolarHBondContact O-CZ 3.5Å; R47-F56 WeakPolarHBondContact O-CE1 3.48Å; T52-F56 HydrophobicContact CG2-CD1 3.48Å; T52-F56 VanDerWaalsContact CG2-CD1 3.48Å; T52-F56 HydrophobicContact CG2-CE1 3.91Å; T52-F56 HydrophobicContact CG2-CG 4.11Å; H53-F56 WeakPolarHBondContact O-CB 3.43Å; H53-F56 PolarHBondContact O-N 2.86Å; P54-F56 VanDerWaalsContact C-N 3.31Å; P54-F56 PolarHBondContact O-N 3.19Å; F56-P58 HydrophobicContact CD1-CG 4.34Å; F56-P58 HydrophobicContact CE1-CB 4.26Å; F56-P58 HydrophobicContact CE1-CG 3.85Å; F56-S334 WeakPolarHBondContact CB-O 3.14Å; F56-A335 HydrophobicContact CE2-CB 4.33Å
57	E	97.9	Very high	97.7	Very high	150 Å²	150	75.3 Å²	75.3	70%	0.701	41%	0.407	S	S	*	.			trans	-119.2	116.7	172.5	-73.4	-66.2	146.5	0	0	109.8	S59	E57-S59 PolarHBondContact O-N 3Å
58	P	97.8	Very high	97.6	Very high	56 Å²	56	70.1 Å²	70.1	36%	0.364	39%	0.391	S	S	.	.			trans	-61.1	124.2	176.2	-17.1	27.8	0	0	0	110.8	L45 F56	L45-P58 CarbonylContact O-C 3.41Å; L45-P58 WeakPolarHBondContact O-CA 3.32Å; F56-P58 HydrophobicContact CD1-CG 4.34Å; F56-P58 HydrophobicContact CE1-CB 4.26Å; F56-P58 HydrophobicContact CE1-CG 3.85Å
59	S	97.8	Very high	97.6	Very high	35 Å²	35	66.9 Å²	66.9	25%	0.245	37%	0.368	C	S	.	.			trans	-152	143	-178	173	0	0	0	0	112.6	L45 E57 E61 S62	L45-S59 PolarHBondContact O-N 2.83Å; E57-S59 PolarHBondContact O-N 3Å; S59-E61 PolarHBondContact OG-N 2.75Å; S59-S62 WeakPolarHBondContact CB-OG 3.41Å
60	T	96.6	Very high	97.6	Very high	109 Å²	109	65.9 Å²	65.9	67%	0.669	36%	0.356	S	S	*	.	S	Bend	trans	-74.3	-15.4	171.6	52.6	0	0	0	0	112.8	E46	E46-T60 HydrophobicContact CG-CG2 4.25Å
61	E	96.6	Very high	97.7	Very high	135 Å²	135	63.6 Å²	63.6	63%	0.631	33%	0.333	S	S	*	.	S	Bend	trans	-89	-22.6	-179.6	-60.5	-178.5	168	0	0	112.6	S59 L63 Q64 F65	S59-E61 PolarHBondContact OG-N 2.75Å; E61-L63 PolarHBondContact O-N 3.39Å; E61-L63 VanDerWaalsContact O-N 3.15Å; E61-Q64 PolarHBondContact O-N 2.83Å; E61-F65 PolarHBondContact O-N 2.89Å
62	S	97.4	Very high	97.7	Very high	35 Å²	35	56.2 Å²	56.2	25%	0.245	30%	0.301	C	S	.	.	H	α-helix	trans	-55.5	-36.2	-176.4	-63.2	0	0	0	0	113.4	S59 L66	S59-S62 WeakPolarHBondContact CB-OG 3.41Å; S62-L66 WeakPolarHBondContact O-CB 3.5Å; S62-L66 PolarHBondContact O-N 3.04Å
63	L	97.7	Very high	97.7	Very high	12 Å²	12	54.4 Å²	54.4	6%	0.063	29%	0.29	C	S	.	.	H	α-helix	trans	-65.2	-44.4	176.7	176.1	61.9	0	0	0	111.7	W38 V41 K42 L45 E61 F65 L66 L67	W38-L63 HydrophobicContact CB-CD1 4.43Å; W38-L63 HydrophobicContact CB-CD2 3.54Å; W38-L63 HydrophobicContact CG-CD1 4.41Å; W38-L63 HydrophobicContact CG-CD2 3.88Å; V41-L63 HydrophobicContact CG1-CD1 3.88Å; K42-L63 HydrophobicContact CD-CD2 4.36Å; K42-L63 HydrophobicContact CG-CD2 3.81Å; L45-L63 HydrophobicContact CD1-CB 4.02Å; L45-L63 HydrophobicContact CD1-CD1 4.39Å; E61-L63 PolarHBondContact O-N 3.39Å; E61-L63 VanDerWaalsContact O-N 3.15Å; L63-F65 VanDerWaalsContact C-N 3.34Å; L63-L66 WeakPolarHBondContact O-CB 3.41Å; L63-L66 PolarHBondContact O-N 2.83Å; L63-L67 HydrophobicContact CD1-CD1 4.05Å; L63-L67 HydrophobicContact CD1-CG 4.22Å; L63-L67 HydrophobicContact CG-CD1 3.88Å; L63-L67 HydrophobicContact CG-CG 4.49Å; L63-L67 VanDerWaalsContact O-CG 3.3Å; L63-L67 WeakPolarHBondContact O-CG 3.49Å; L63-L67 PolarHBondContact O-N 2.93Å
64	Q	97.1	Very high	97.8	Very high	90 Å²	90	52.1 Å²	52.1	42%	0.421	28%	0.279	S	S	.	.	H	α-helix	trans	-67.4	-40.3	-179.1	-164.6	62.7	39.2	0	0	110.7	E61 L66 L67 D68	E61-Q64 PolarHBondContact O-N 2.83Å; Q64-L66 VanDerWaalsContact C-N 3.34Å; Q64-L66 PolarHBondContact O-N 2.86Å; Q64-L67 PolarHBondContact O-N 3.44Å; Q64-D68 WeakPolarHBondContact CG-OD2 3.4Å; Q64-D68 PolarHBondContact NE2-OD1 2.89Å; Q64-D68 VanDerWaalsContact NE2-OD1 3.17Å; Q64-D68 PolarHBondContact NE2-OD2 2.97Å; Q64-D68 WeakPolarHBondContact O-CB 3.43Å; Q64-D68 PolarHBondContact O-N 2.95Å
65	F	95.9	Very high	97.8	Very high	75 Å²	75	47 Å²	47	33%	0.329	25%	0.246	S	C	.	.	H	α-helix	trans	-58.4	-45.2	173.4	-176.6	-99.7	0	0	0	111.9	I14 E61 L63 D68 T69	I14-F65 HydrophobicContact CG1-CE2 4.19Å; I14-F65 HydrophobicContact CG1-CZ 4.34Å; E61-F65 PolarHBondContact O-N 2.89Å; L63-F65 VanDerWaalsContact C-N 3.34Å; F65-D68 PolarHBondContact O-N 2.77Å; F65-T69 HydrophobicContact CD2-CG2 3.95Å; F65-T69 WeakPolarHBondContact CD2-OG1 3.29Å; F65-T69 HydrophobicContact CE2-CG2 4.01Å; F65-T69 VanDerWaalsContact CE2-OG1 3.3Å; F65-T69 WeakPolarHBondContact CE2-OG1 3.4Å; F65-T69 WeakPolarHBondContact CZ-OG1 3.4Å; F65-T69 WeakPolarHBondContact O-CB 3.2Å; F65-T69 PolarHBondContact O-N 3.41Å; F65-T69 PolarHBondContact O-OG1 2.91Å
66	L	97.6	Very high	97.8	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.021	22%	0.222	C	C	.	.	H	α-helix	trans	-60.2	-47	176.2	-172.7	68.2	0	0	0	112.1	S62 L63 Q64 C70 G92 F93 F329 A332 T333	S62-L66 WeakPolarHBondContact O-CB 3.5Å; S62-L66 PolarHBondContact O-N 3.04Å; L63-L66 WeakPolarHBondContact O-CB 3.41Å; L63-L66 PolarHBondContact O-N 2.83Å; Q64-L66 VanDerWaalsContact C-N 3.34Å; Q64-L66 PolarHBondContact O-N 2.86Å; L66-C70 HydrophobicContact CD1-CB 3.91Å; L66-C70 WeakPolarHBondContact O-CB 3.28Å; L66-G92 CarbonylContact C-O 3.55Å; L66-F93 HydrophobicContact CD1-CD1 4Å; L66-F93 HydrophobicContact CD1-CE1 3.49Å; L66-F93 VanDerWaalsContact CD1-CE1 3.49Å; L66-F93 HydrophobicContact CD1-CE2 4.5Å; L66-F93 HydrophobicContact CD1-CZ 3.78Å; L66-F93 HydrophobicContact CG-CD1 4.45Å; L66-F93 HydrophobicContact CG-CE1 4.34Å; L66-F329 HydrophobicContact CD2-CD2 4.19Å; L66-F329 HydrophobicContact CD2-CE2 3.87Å; L66-A332 HydrophobicContact CD1-CB 3.68Å; L66-T333 HydrophobicContact CD1-CG2 4.06Å; L66-T333 HydrophobicContact CD2-CG2 4.03Å
67	L	97.9	Very high	97.8	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-62.6	-42.8	180	-72.4	164.2	0	0	0	112	W38 L63 Q64 G92 R94	W38-L67 HydrophobicContact CH2-CD2 4.31Å; W38-L67 HydrophobicContact CZ2-CD2 3.8Å; L63-L67 HydrophobicContact CD1-CD1 4.05Å; L63-L67 HydrophobicContact CD1-CG 4.22Å; L63-L67 HydrophobicContact CG-CD1 3.88Å; L63-L67 HydrophobicContact CG-CG 4.49Å; L63-L67 VanDerWaalsContact O-CG 3.3Å; L63-L67 WeakPolarHBondContact O-CG 3.49Å; L63-L67 PolarHBondContact O-N 2.93Å; Q64-L67 PolarHBondContact O-N 3.44Å; L67-G92 WeakPolarHBondContact CA-O 3.33Å; L67-G92 VanDerWaalsContact CD2-O 3.24Å; L67-G92 WeakPolarHBondContact CD2-O 3.48Å; L67-G92 PolarHBondContact N-O 2.83Å; L67-R94 HydrophobicContact CB-CG 4.38Å; L67-R94 HydrophobicContact CD2-CG 3.79Å; L67-R94 WeakPolarHBondContact O-CB 3.06Å
68	D	97.2	Very high	97.6	Very high	53 Å²	53	35 Å²	35	28%	0.283	19%	0.192	S	C	.	.	H	α-helix	trans	-98.5	-20.8	-165.4	-67.4	-15.2	0	0	0	115.1	K21 Q64 F65 R94	K21-D68 PolarHBondContact NZ-O 3.19Å; Q64-D68 WeakPolarHBondContact CG-OD2 3.4Å; Q64-D68 PolarHBondContact NE2-OD1 2.89Å; Q64-D68 VanDerWaalsContact NE2-OD1 3.17Å; Q64-D68 PolarHBondContact NE2-OD2 2.97Å; Q64-D68 WeakPolarHBondContact O-CB 3.43Å; Q64-D68 PolarHBondContact O-N 2.95Å; F65-D68 PolarHBondContact O-N 2.77Å; D68-R94 IonicContact OD1-NH1 3.77Å
69	T	97.6	Very high	97.5	Very high	28 Å²	28	32.7 Å²	32.7	17%	0.172	18%	0.178	C	C	.	.	H	α-helix	trans	-123.9	-31.4	-169.8	73.2	0	0	0	0	113.7	F65 K71 H160	F65-T69 HydrophobicContact CD2-CG2 3.95Å; F65-T69 WeakPolarHBondContact CD2-OG1 3.29Å; F65-T69 HydrophobicContact CE2-CG2 4.01Å; F65-T69 VanDerWaalsContact CE2-OG1 3.3Å; F65-T69 WeakPolarHBondContact CE2-OG1 3.4Å; F65-T69 WeakPolarHBondContact CZ-OG1 3.4Å; F65-T69 WeakPolarHBondContact O-CB 3.2Å; F65-T69 PolarHBondContact O-N 3.41Å; F65-T69 PolarHBondContact O-OG1 2.91Å; T69-K71 PolarHBondContact O-N 3.27Å; T69-H160 PolarHBondContact O-CE1 2.81Å
70	C	98.4	Very high	97.4	Very high	9 Å²	9	31.3 Å²	31.3	6%	0.061	17%	0.168	C	C	.	.			trans	-75	88.7	-171.9	-169.6	0	0	0	0	112	L66 V72 F93	L66-C70 HydrophobicContact CD1-CB 3.91Å; L66-C70 WeakPolarHBondContact O-CB 3.28Å; C70-V72 PolarHBondContact O-N 3.3Å; C70-F93 HydrophobicContact CB-CD1 4.36Å; C70-F93 HydrophobicContact CB-CE1 4.38Å
71	K	98.8	Very high	97.5	Very high	72 Å²	72	26.1 Å²	26.1	31%	0.313	14%	0.136	S	C	.	.			trans	-66.8	119.7	171.5	-66.6	-174.7	173.3	-172.2	0	112.2	T69 Q95 Q158 F159 H160	T69-K71 PolarHBondContact O-N 3.27Å; K71-Q95 WeakPolarHBondContact CA-O 3.43Å; K71-Q95 HydrophobicContact CG-CB 4.06Å; K71-Q158 WeakPolarHBondContact CD-O 3.48Å; K71-F159 HydrophobicContact CB-CD1 4.08Å; K71-H160 PolarHBondContact N-ND1 3.08Å; K71-H160 PolarHBondContact O-N 3Å
72	V	98.9	Very high	97.6	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	134.8	175.7	-179.1	0	0	0	0	109.9	C70 L88 F93 Q95 I96 H97 I161 V163 V328	C70-V72 PolarHBondContact O-N 3.3Å; V72-L88 HydrophobicContact CG1-CD1 3.89Å; V72-F93 HydrophobicContact CG2-CD1 3.5Å; V72-F93 VanDerWaalsContact CG2-CD1 3.5Å; V72-F93 HydrophobicContact CG2-CE1 3.67Å; V72-F93 HydrophobicContact CG2-CG 4.4Å; V72-Q95 PolarHBondContact N-O 3.06Å; V72-I96 CarbonylContact O-C 3.53Å; V72-I96 WeakPolarHBondContact O-CA 3.34Å; V72-H97 PolarHBondContact O-N 3.38Å; V72-I161 WeakPolarHBondContact CA-O 3.45Å; V72-I161 HydrophobicContact CG2-CB 4.45Å; V72-V163 HydrophobicContact CG1-CG1 4.38Å; V72-V328 HydrophobicContact CG1-CG1 4.34Å; V72-V328 HydrophobicContact CG2-CG1 4.28Å
73	L	98.9	Very high	97.7	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.5	171.7	167.8	66.9	0	0	0	110.3	I75 H97 I99 F155 Y156 F159 I161 I162 V163	L73-I75 HydrophobicContact CD1-CG1 4.43Å; L73-I75 HydrophobicContact CD2-CD1 4.02Å; L73-I75 HydrophobicContact CD2-CG1 3.94Å; L73-I75 HydrophobicContact CG-CD1 4.47Å; L73-I75 HydrophobicContact CG-CG1 3.87Å; L73-H97 HydrophobicContact CD1-CB 3.82Å; L73-I99 HydrophobicContact CD1-CD1 3.64Å; L73-I99 HydrophobicContact CD1-CG1 3.77Å; L73-I99 HydrophobicContact CD2-CD1 3.93Å; L73-I99 HydrophobicContact CG-CD1 4.37Å; L73-F155 HydrophobicContact CD2-CE1 4.09Å; L73-Y156 HydrophobicContact CD2-CD1 3.82Å; L73-Y156 HydrophobicContact CD2-CE1 3.74Å; L73-F159 HydrophobicContact CB-CB 4.39Å; L73-F159 HydrophobicContact CB-CD1 3.62Å; L73-F159 HydrophobicContact CB-CD2 3.79Å; L73-F159 HydrophobicContact CB-CE1 3.77Å; L73-F159 HydrophobicContact CB-CE2 3.92Å; L73-F159 HydrophobicContact CB-CG 3.64Å; L73-F159 HydrophobicContact CB-CZ 3.92Å; L73-F159 HydrophobicContact CD1-CZ 4.27Å; L73-F159 HydrophobicContact CD2-CD2 3.93Å; L73-F159 HydrophobicContact CD2-CE2 3.78Å; L73-F159 HydrophobicContact CD2-CZ 4.34Å; L73-F159 HydrophobicContact CG-CD2 4.45Å; L73-F159 HydrophobicContact CG-CE2 4.28Å; L73-F159 HydrophobicContact CG-CZ 4.4Å; L73-I161 PolarHBondContact N-O 3.11Å; L73-I161 VanDerWaalsContact N-O 3.09Å; L73-I162 HydrophobicContact CB-CG1 4.15Å; L73-I162 HydrophobicContact CD2-CD1 4.28Å; L73-I162 HydrophobicContact CD2-CG1 4.32Å; L73-I162 HydrophobicContact CD2-CG2 4.36Å; L73-I162 HydrophobicContact CG-CG2 4.5Å; L73-I162 CarbonylContact O-C 3.59Å; L73-I162 WeakPolarHBondContact O-CA 3.39Å; L73-V163 PolarHBondContact O-N 3.16Å
74	V	98.9	Very high	97.7	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	125.2	168.9	-175.8	0	0	0	0	108.8	L84 L85 L88 I96 H97 V98 I99 V163	V74-L84 HydrophobicContact CG1-CB 4.24Å; V74-L84 HydrophobicContact CG1-CD1 4.22Å; V74-L85 HydrophobicContact CB-CD2 4.42Å; V74-L85 HydrophobicContact CG2-CD2 4.04Å; V74-L88 HydrophobicContact CG2-CD1 3.67Å; V74-I96 HydrophobicContact CG2-CG2 3.9Å; V74-H97 PolarHBondContact N-O 3.47Å; V74-V98 HydrophobicContact CB-CG2 4.45Å; V74-V98 VanDerWaalsContact O-CA 3.29Å; V74-V98 WeakPolarHBondContact O-CA 3.4Å; V74-I99 PolarHBondContact O-N 2.81Å; V74-V163 CarbonylContact C-O 3.03Å; V74-V163 WeakPolarHBondContact CA-O 3.36Å; V74-V163 HydrophobicContact CB-CG1 4.19Å; V74-V163 HydrophobicContact CG1-CG1 4.32Å; V74-V163 HydrophobicContact CG2-CG1 3.72Å
75	I	98.8	Very high	97.8	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.005	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	117.8	177.2	-55	-174.6	0	0	0	109.3	L73 I148 Y156 I162 V163 G165 L166 I175	L73-I75 HydrophobicContact CD1-CG1 4.43Å; L73-I75 HydrophobicContact CD2-CD1 4.02Å; L73-I75 HydrophobicContact CD2-CG1 3.94Å; L73-I75 HydrophobicContact CG-CD1 4.47Å; L73-I75 HydrophobicContact CG-CG1 3.87Å; I75-I148 HydrophobicContact CD1-CG2 4.18Å; I75-I148 HydrophobicContact CG2-CG2 3.35Å; I75-Y156 HydrophobicContact CD1-CE1 4.45Å; I75-I162 HydrophobicContact CD1-CG2 3.72Å; I75-I162 HydrophobicContact CG1-CG2 4.09Å; I75-V163 PolarHBondContact N-O 3.37Å; I75-G165 PolarHBondContact O-N 2.9Å; I75-L166 HydrophobicContact CG2-CD1 4.13Å; I75-L166 HydrophobicContact CG2-CD2 3.58Å; I75-L166 HydrophobicContact CG2-CG 3.9Å; I75-I175 HydrophobicContact CD1-CB 4.47Å; I75-I175 HydrophobicContact CD1-CD1 3.67Å; I75-I175 HydrophobicContact CD1-CG1 3.71Å
76	G	98.1	Very high	97.9	Very high	6 Å²	6	13.7 Å²	13.7	6%	0.062	7%	0.074	C	C	.	.			trans	91.5	129.3	-170.7	0	0	0	0	0	111.3	G81 I99	G76-G81 WeakPolarHBondContact O-CA 3.29Å; G76-I99 WeakPolarHBondContact CA-O 3.37Å; G76-I99 PolarHBondContact N-O 2.78Å
77	A	97.3	Very high	98	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.08	C	C	.	.			trans	-109.5	16.1	174.6	0	0	0	0	0	111.8	C82 V98 D100 F115 K124 A128	A77-C82 PolarHBondContact O-SG 2.85Å; A77-C82 VanDerWaalsContact O-SG 3.35Å; A77-V98 HydrophobicContact CB-CG2 3.98Å; A77-D100 WeakPolarHBondContact CA-OD2 3.24Å; A77-D100 HydrophobicContact CB-CB 3.68Å; A77-D100 PolarHBondContact N-OD2 3.37Å; A77-F115 WeakPolarHBondContact O-CZ 3.37Å; A77-K124 HydrophobicContact CB-CB 3.96Å; A77-A128 HydrophobicContact CB-CB 4.32Å
78	G	94.6	Very high	98	Very high	13 Å²	13	14.6 Å²	14.6	13%	0.134	8%	0.079	C	C	.	.	S	Bend	trans	-70	-159.7	170.6	0	0	0	0	0	113.3	L80 G81 C82	G78-L80 PolarHBondContact O-N 2.96Å; G78-G81 CarbonylContact O-C 3.56Å; G78-G81 WeakPolarHBondContact O-CA 3.19Å; G78-G81 PolarHBondContact O-N 2.89Å; G78-C82 PolarHBondContact O-N 2.86Å
79	G	94.5	Very high	98.1	Very high	8 Å²	8	12.2 Å²	12.2	8%	0.082	7%	0.066	C	C	.	.	H	α-helix	trans	-50.6	-51.8	-174.8	0	0	0	0	0	113.9	E83	G79-E83 PolarHBondContact O-N 3.01Å
80	L	97.1	Very high	98.2	Very high	6 Å²	6	15.8 Å²	15.8	3%	0.031	8%	0.084	C	C	.	.	H	α-helix	trans	-62.5	-45.1	173.2	-75.8	175.5	0	0	0	112.2	G78 C82 E83 L84 G201 T203 N317 I320 A321	G78-L80 PolarHBondContact O-N 2.96Å; L80-C82 PolarHBondContact O-N 3.09Å; L80-E83 PolarHBondContact O-N 3.45Å; L80-L84 WeakPolarHBondContact O-CB 3.47Å; L80-L84 WeakPolarHBondContact O-CG 3.39Å; L80-L84 PolarHBondContact O-N 3.09Å; L80-G201 WeakPolarHBondContact CD1-O 3.29Å; L80-T203 HydrophobicContact CD1-CG2 4.19Å; L80-T203 HydrophobicContact CD2-CG2 3.88Å; L80-T203 HydrophobicContact CG-CG2 4.15Å; L80-N317 HydrophobicContact CD2-CB 4.39Å; L80-N317 WeakPolarHBondContact CD2-O 3.11Å; L80-N317 WeakPolarHBondContact CG-OD1 3.47Å; L80-N317 PolarHBondContact N-OD1 3.34Å; L80-I320 HydrophobicContact CD1-CG2 4.48Å; L80-I320 HydrophobicContact CD2-CB 3.83Å; L80-I320 HydrophobicContact CD2-CG2 3.73Å; L80-A321 HydrophobicContact CD2-CB 4.03Å
81	G	98.2	Very high	98.2	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-56.7	-48.5	-179.9	0	0	0	0	0	114	G76 G78 E83 L84 L85	G76-G81 WeakPolarHBondContact O-CA 3.29Å; G78-G81 CarbonylContact O-C 3.56Å; G78-G81 WeakPolarHBondContact O-CA 3.19Å; G78-G81 PolarHBondContact O-N 2.89Å; G81-E83 VanDerWaalsContact C-N 3.33Å; G81-E83 PolarHBondContact O-N 3.31Å; G81-L84 PolarHBondContact O-N 3.28Å; G81-L85 WeakPolarHBondContact O-CB 3.38Å; G81-L85 WeakPolarHBondContact O-CG 3.5Å; G81-L85 PolarHBondContact O-N 2.7Å
82	C	98.6	Very high	98.1	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-57.4	-45.8	175.8	-69.4	0	0	0	0	112.2	A77 G78 L80 K86 F113 L114	A77-C82 PolarHBondContact O-SG 2.85Å; A77-C82 VanDerWaalsContact O-SG 3.35Å; G78-C82 PolarHBondContact O-N 2.86Å; L80-C82 PolarHBondContact O-N 3.09Å; C82-K86 PolarHBondContact O-N 2.97Å; C82-F113 HydrophobicContact CB-CD1 4.34Å; C82-F113 HydrophobicContact CB-CE1 3.96Å; C82-F113 HydrophobicContact CB-CZ 4.43Å; C82-L114 HydrophobicContact CB-CD1 3.89Å; C82-L114 HydrophobicContact CB-CG 3.87Å
83	E	98.9	Very high	98.1	Very high	25 Å²	25	13.5 Å²	13.5	12%	0.117	8%	0.077	C	C	.	.	H	α-helix	trans	-67.5	-43.3	178.6	-81.1	-69.4	167.4	0	0	112	G79 L80 G81 L85 K86 N87 F113 A318 A321	G79-E83 PolarHBondContact O-N 3.01Å; L80-E83 PolarHBondContact O-N 3.45Å; G81-E83 VanDerWaalsContact C-N 3.33Å; G81-E83 PolarHBondContact O-N 3.31Å; E83-L85 PolarHBondContact O-N 2.75Å; E83-K86 PolarHBondContact O-N 3.03Å; E83-K86 WeakPolarHBondContact OE2-CE 3.38Å; E83-K86 IonicContact OE2-NZ 2.74Å; E83-K86 PolarHBondContact OE2-NZ 3.18Å; E83-N87 WeakPolarHBondContact O-CB 2.97Å; E83-N87 PolarHBondContact O-N 2.87Å; E83-N87 PolarHBondContact O-ND2 3.47Å; E83-N87 PolarHBondContact O-OD1 2.9Å; E83-F113 HydrophobicContact CG-CE1 4.05Å; E83-A318 HydrophobicContact CG-CB 4.28Å; E83-A321 HydrophobicContact CB-CB 3.33Å; E83-A321 HydrophobicContact CG-CB 4.39Å
84	L	98.8	Very high	98.1	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-58	-48.8	176.5	-76.8	168.8	0	0	0	111.3	V74 L80 G81 K86 N87 L88 V163 A321 C324 A325	V74-L84 HydrophobicContact CG1-CB 4.24Å; V74-L84 HydrophobicContact CG1-CD1 4.22Å; L80-L84 WeakPolarHBondContact O-CB 3.47Å; L80-L84 WeakPolarHBondContact O-CG 3.39Å; L80-L84 PolarHBondContact O-N 3.09Å; G81-L84 PolarHBondContact O-N 3.28Å; L84-K86 PolarHBondContact O-N 3.36Å; L84-N87 PolarHBondContact O-N 2.87Å; L84-N87 VanDerWaalsContact O-N 3.15Å; L84-L88 WeakPolarHBondContact O-CB 3.22Å; L84-L88 VanDerWaalsContact O-CG 3.26Å; L84-L88 WeakPolarHBondContact O-CG 3.49Å; L84-L88 PolarHBondContact O-N 3.33Å; L84-V163 HydrophobicContact CD1-CG1 4.25Å; L84-V163 HydrophobicContact CD1-CG2 3.74Å; L84-V163 HydrophobicContact CD2-CG1 4.48Å; L84-V163 HydrophobicContact CD2-CG2 3.64Å; L84-V163 HydrophobicContact CG-CG2 4.33Å; L84-A321 HydrophobicContact CD2-CB 4.19Å; L84-A321 HydrophobicContact CG-CB 4.02Å; L84-C324 HydrophobicContact CD2-CB 3.7Å; L84-A325 HydrophobicContact CD2-CB 4.44Å
85	L	98.8	Very high	98.1	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-54.6	-52.9	177.2	-79.5	175.1	0	0	0	111.4	V74 G81 E83 N87 L88 A89 I96 V98 L114 A128 L132 V141	V74-L85 HydrophobicContact CB-CD2 4.42Å; V74-L85 HydrophobicContact CG2-CD2 4.04Å; G81-L85 WeakPolarHBondContact O-CB 3.38Å; G81-L85 WeakPolarHBondContact O-CG 3.5Å; G81-L85 PolarHBondContact O-N 2.7Å; E83-L85 PolarHBondContact O-N 2.75Å; L85-N87 VanDerWaalsContact C-N 3.34Å; L85-N87 PolarHBondContact O-N 3.27Å; L85-L88 PolarHBondContact O-N 2.8Å; L85-A89 VanDerWaalsContact O-CB 3.31Å; L85-A89 WeakPolarHBondContact O-CB 3.1Å; L85-A89 PolarHBondContact O-N 2.75Å; L85-I96 HydrophobicContact CD2-CG2 3.77Å; L85-V98 HydrophobicContact CD1-CG2 4.28Å; L85-V98 HydrophobicContact CD2-CB 4.35Å; L85-L114 HydrophobicContact CD1-CD1 4.02Å; L85-A128 HydrophobicContact CD1-CB 3.78Å; L85-L132 HydrophobicContact CB-CD1 4.43Å; L85-L132 HydrophobicContact CB-CD2 3.78Å; L85-L132 HydrophobicContact CD2-CD2 4.3Å; L85-L132 WeakPolarHBondContact O-CD2 3.42Å; L85-V141 HydrophobicContact CD2-CG1 4.03Å; L85-V141 HydrophobicContact CD2-CG2 4.45Å
86	K	98.8	Very high	98.1	Very high	60 Å²	60	17.2 Å²	17.2	26%	0.261	9%	0.093	S	C	.	.	H	α-helix	trans	-55.4	-48.7	174.8	172.3	-177.5	58.1	67.4	0	111.7	C82 E83 L84 L90 F113	C82-K86 PolarHBondContact O-N 2.97Å; E83-K86 PolarHBondContact O-N 3.03Å; E83-K86 WeakPolarHBondContact OE2-CE 3.38Å; E83-K86 IonicContact OE2-NZ 2.74Å; E83-K86 PolarHBondContact OE2-NZ 3.18Å; L84-K86 PolarHBondContact O-N 3.36Å; K86-L90 HydrophobicContact CG-CD1 3.92Å; K86-L90 WeakPolarHBondContact O-CB 3.46Å; K86-L90 WeakPolarHBondContact O-CG 3.46Å; K86-L90 PolarHBondContact O-N 3.37Å; K86-L90 VanDerWaalsContact O-N 3.09Å; K86-F113 HydrophobicContact CB-CZ 3.95Å; K86-F113 HydrophobicContact CD-CE2 4.29Å; K86-F113 HydrophobicContact CD-CZ 3.88Å
87	N	98.8	Very high	98.1	Very high	25 Å²	25	18 Å²	18	13%	0.134	10%	0.095	C	C	.	.	H	α-helix	trans	-64.8	-43.9	-174.1	-66.7	-14.9	0	0	0	111.7	E83 L84 L85 S91 A321 A322 A325	E83-N87 WeakPolarHBondContact O-CB 2.97Å; E83-N87 PolarHBondContact O-N 2.87Å; E83-N87 PolarHBondContact O-ND2 3.47Å; E83-N87 PolarHBondContact O-OD1 2.9Å; L84-N87 PolarHBondContact O-N 2.87Å; L84-N87 VanDerWaalsContact O-N 3.15Å; L85-N87 VanDerWaalsContact C-N 3.34Å; L85-N87 PolarHBondContact O-N 3.27Å; N87-S91 WeakPolarHBondContact O-CB 3.48Å; N87-S91 PolarHBondContact O-N 3.23Å; N87-S91 PolarHBondContact O-OG 3.15Å; N87-A321 PolarHBondContact ND2-O 3.28Å; N87-A322 PolarHBondContact ND2-N 3.49Å; N87-A325 HydrophobicContact CB-CB 3.38Å
88	L	98.8	Very high	98.2	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-66.1	-47.7	177.9	-66.7	175	0	0	0	111.4	V72 V74 L84 L85 L90 S91 G92 F93 I96 V163 A325 V328	V72-L88 HydrophobicContact CG1-CD1 3.89Å; V74-L88 HydrophobicContact CG2-CD1 3.67Å; L84-L88 WeakPolarHBondContact O-CB 3.22Å; L84-L88 VanDerWaalsContact O-CG 3.26Å; L84-L88 WeakPolarHBondContact O-CG 3.49Å; L84-L88 PolarHBondContact O-N 3.33Å; L85-L88 PolarHBondContact O-N 2.8Å; L88-L90 VanDerWaalsContact C-N 3.26Å; L88-L90 PolarHBondContact O-N 2.94Å; L88-S91 PolarHBondContact O-N 2.79Å; L88-G92 PolarHBondContact O-N 3.22Å; L88-F93 HydrophobicContact CB-CB 4.29Å; L88-F93 HydrophobicContact CB-CD2 4.17Å; L88-F93 HydrophobicContact CB-CG 4.46Å; L88-F93 HydrophobicContact CD2-CD2 3.92Å; L88-F93 HydrophobicContact CD2-CE2 3.98Å; L88-F93 HydrophobicContact CD2-CG 4.48Å; L88-F93 WeakPolarHBondContact O-CD2 3.5Å; L88-F93 PolarHBondContact O-N 3.32Å; L88-I96 HydrophobicContact CB-CD1 3.83Å; L88-V163 HydrophobicContact CD1-CG1 4.16Å; L88-A325 HydrophobicContact CD2-CB 4.29Å; L88-V328 HydrophobicContact CD2-CB 3.86Å; L88-V328 HydrophobicContact CD2-CG1 3.55Å; L88-V328 HydrophobicContact CD2-CG2 4.34Å
89	A	98.7	Very high	98.4	Very high	2 Å²	2	17.5 Å²	17.5	2%	0.017	9%	0.089	C	C	.	.	H	α-helix	trans	-59	-38.1	179.8	0	0	0	0	0	112.2	W38 L85 S91 I96 L132 V136	W38-A89 WeakPolarHBondContact CH2-O 3.42Å; L85-A89 VanDerWaalsContact O-CB 3.31Å; L85-A89 WeakPolarHBondContact O-CB 3.1Å; L85-A89 PolarHBondContact O-N 2.75Å; A89-S91 VanDerWaalsContact C-N 3.29Å; A89-S91 PolarHBondContact O-N 3.01Å; A89-I96 HydrophobicContact CB-CD1 4.5Å; A89-L132 HydrophobicContact CB-CD2 3.77Å; A89-L132 HydrophobicContact CB-CG 4.33Å; A89-V136 HydrophobicContact CB-CB 4.35Å; A89-V136 HydrophobicContact CB-CG1 4.12Å; A89-V136 HydrophobicContact CB-CG2 4.18Å
90	L	98.7	Very high	98.6	Very high	104 Å²	104	17.7 Å²	17.7	55%	0.545	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-2.3	176.5	-64.3	176.9	0	0	0	114.2	K86 L88 V136	K86-L90 HydrophobicContact CG-CD1 3.92Å; K86-L90 WeakPolarHBondContact O-CB 3.46Å; K86-L90 WeakPolarHBondContact O-CG 3.46Å; K86-L90 PolarHBondContact O-N 3.37Å; K86-L90 VanDerWaalsContact O-N 3.09Å; L88-L90 VanDerWaalsContact C-N 3.26Å; L88-L90 PolarHBondContact O-N 2.94Å; L90-V136 HydrophobicContact CD2-CG1 4.47Å; L90-V136 HydrophobicContact CD2-CG2 4.3Å
91	S	98.8	Very high	98.6	Very high	32 Å²	32	22.9 Å²	22.9	22%	0.224	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	9.3	177.9	-58	0	0	0	0	113.5	N87 L88 A89	N87-S91 WeakPolarHBondContact O-CB 3.48Å; N87-S91 PolarHBondContact O-N 3.23Å; N87-S91 PolarHBondContact O-OG 3.15Å; L88-S91 PolarHBondContact O-N 2.79Å; A89-S91 VanDerWaalsContact C-N 3.29Å; A89-S91 PolarHBondContact O-N 3.01Å
92	G	98	Very high	98.5	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.1	16.2	174.9	0	0	0	0	0	115	L66 L67 L88	L66-G92 CarbonylContact C-O 3.55Å; L67-G92 WeakPolarHBondContact CA-O 3.33Å; L67-G92 VanDerWaalsContact CD2-O 3.24Å; L67-G92 WeakPolarHBondContact CD2-O 3.48Å; L67-G92 PolarHBondContact N-O 2.83Å; L88-G92 PolarHBondContact O-N 3.22Å
93	F	98.6	Very high	98.5	Very high	1 Å²	1	28.9 Å²	28.9	0%	0.004	15%	0.149	C	C	.	.			trans	-94.9	125.6	172.2	-63.1	-90	0	0	0	110.2	L66 C70 V72 L88 I96 V328 F329 A332	L66-F93 HydrophobicContact CD1-CD1 4Å; L66-F93 HydrophobicContact CD1-CE1 3.49Å; L66-F93 VanDerWaalsContact CD1-CE1 3.49Å; L66-F93 HydrophobicContact CD1-CE2 4.5Å; L66-F93 HydrophobicContact CD1-CZ 3.78Å; L66-F93 HydrophobicContact CG-CD1 4.45Å; L66-F93 HydrophobicContact CG-CE1 4.34Å; C70-F93 HydrophobicContact CB-CD1 4.36Å; C70-F93 HydrophobicContact CB-CE1 4.38Å; V72-F93 HydrophobicContact CG2-CD1 3.5Å; V72-F93 VanDerWaalsContact CG2-CD1 3.5Å; V72-F93 HydrophobicContact CG2-CE1 3.67Å; V72-F93 HydrophobicContact CG2-CG 4.4Å; L88-F93 HydrophobicContact CB-CB 4.29Å; L88-F93 HydrophobicContact CB-CD2 4.17Å; L88-F93 HydrophobicContact CB-CG 4.46Å; L88-F93 HydrophobicContact CD2-CD2 3.92Å; L88-F93 HydrophobicContact CD2-CE2 3.98Å; L88-F93 HydrophobicContact CD2-CG 4.48Å; L88-F93 WeakPolarHBondContact O-CD2 3.5Å; L88-F93 PolarHBondContact O-N 3.32Å; F93-I96 HydrophobicContact CB-CD1 3.99Å; F93-I96 HydrophobicContact CB-CG1 4.08Å; F93-V328 HydrophobicContact CE1-CG1 4.08Å; F93-V328 HydrophobicContact CE2-CG1 4.24Å; F93-V328 HydrophobicContact CZ-CG1 3.71Å; F93-F329 HydrophobicContact CE2-CB 4.38Å; F93-F329 HydrophobicContact CE2-CD2 4.21Å; F93-A332 HydrophobicContact CE1-CB 3.77Å; F93-A332 HydrophobicContact CZ-CB 3.75Å
94	R	98.5	Very high	98.4	Very high	29 Å²	29	27.9 Å²	27.9	11%	0.109	14%	0.144	C	C	.	.			trans	-106.6	-38.3	171.6	-60.9	178.3	164.9	159.4	-3.1	113.4	D33 L67 D68 I96 N138 N140	D33-R94 IonicContact OD1-NH2 2.87Å; D33-R94 PolarHBondContact OD1-NH2 3.35Å; D33-R94 IonicContact OD2-CZ 2.88Å; D33-R94 IonicContact OD2-NH1 3.51Å; D33-R94 IonicContact OD2-NH2 2.62Å; D33-R94 PolarHBondContact OD2-NH2 3.16Å; L67-R94 HydrophobicContact CB-CG 4.38Å; L67-R94 HydrophobicContact CD2-CG 3.79Å; L67-R94 WeakPolarHBondContact O-CB 3.06Å; D68-R94 IonicContact OD1-NH1 3.77Å; R94-I96 VanDerWaalsContact C-N 3.29Å; R94-I96 PolarHBondContact O-N 3.47Å; R94-N138 VanDerWaalsContact CD-O 3.24Å; R94-N138 WeakPolarHBondContact CD-O 3.46Å; R94-N138 VanDerWaalsContact CG-O 3.31Å; R94-N138 WeakPolarHBondContact CG-O 3.43Å; R94-N138 PolarHBondContact NE-O 2.86Å; R94-N138 PolarHBondContact NH2-ND2 3.44Å; R94-N140 CarbonylContact O-C 3.22Å; R94-N140 VanDerWaalsContact O-C 3.22Å; R94-N140 WeakPolarHBondContact O-CA 3.35Å; R94-N140 WeakPolarHBondContact O-CB 3.45Å; R94-N140 PolarHBondContact O-N 3.3Å
95	Q	98.6	Very high	98.3	Very high	49 Å²	49	30.2 Å²	30.2	23%	0.229	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	73.9	-174.7	-56.1	-53.2	-46.6	0	0	110.5	K71 V72 N140	K71-Q95 WeakPolarHBondContact CA-O 3.43Å; K71-Q95 HydrophobicContact CG-CB 4.06Å; V72-Q95 PolarHBondContact N-O 3.06Å; Q95-N140 PolarHBondContact OE1-ND2 3.08Å; Q95-N140 VanDerWaalsContact OE1-ND2 3.15Å
96	I	98.9	Very high	98.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	131.6	-174.7	-55.5	173.4	0	0	0	109.1	V72 V74 L85 L88 A89 F93 R94 N140 V141 V142	V72-I96 CarbonylContact O-C 3.53Å; V72-I96 WeakPolarHBondContact O-CA 3.34Å; V74-I96 HydrophobicContact CG2-CG2 3.9Å; L85-I96 HydrophobicContact CD2-CG2 3.77Å; L88-I96 HydrophobicContact CB-CD1 3.83Å; A89-I96 HydrophobicContact CB-CD1 4.5Å; F93-I96 HydrophobicContact CB-CD1 3.99Å; F93-I96 HydrophobicContact CB-CG1 4.08Å; R94-I96 VanDerWaalsContact C-N 3.29Å; R94-I96 PolarHBondContact O-N 3.47Å; I96-N140 PolarHBondContact N-O 3Å; I96-V141 HydrophobicContact CB-CG2 4.34Å; I96-V141 CarbonylContact O-C 3.51Å; I96-V141 VanDerWaalsContact O-CA 3.24Å; I96-V141 WeakPolarHBondContact O-CA 3.45Å; I96-V142 PolarHBondContact O-N 2.93Å
97	H	98.9	Very high	97.9	Very high	23 Å²	23	34.6 Å²	34.6	11%	0.106	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	147.7	167.9	-74.1	-138.8	0	0	0	109.1	V72 L73 V74 V142 H144 F159	V72-H97 PolarHBondContact O-N 3.38Å; L73-H97 HydrophobicContact CD1-CB 3.82Å; V74-H97 PolarHBondContact N-O 3.47Å; H97-V142 WeakPolarHBondContact CA-O 3.45Å; H97-H144 AromaticContact CE1-NE2 3.83Å; H97-H144 AromaticContact CG-NE2 3.74Å; H97-H144 AromaticContact ND1-CD2 3.91Å; H97-H144 AromaticContact ND1-CE1 3.83Å; H97-H144 AromaticContact ND1-NE2 2.98Å; H97-H144 PolarHBondContact ND1-NE2 3.37Å; H97-F159 HydrophobicContact CB-CE1 3.66Å; H97-F159 HydrophobicContact CB-CZ 3.86Å; H97-F159 AromaticContact CD2-CE1 3.84Å; H97-F159 AromaticContact CG-CE1 3.52Å; H97-F159 AromaticContact CG-CZ 3.76Å; H97-F159 AromaticContact ND1-CE1 3.83Å; H97-F159 AromaticContact ND1-CZ 3.67Å
98	V	98.9	Very high	97.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	128.2	173.1	61.7	0	0	0	0	111.1	V74 A77 L85 A125 V141 V142 P143 H144	V74-V98 HydrophobicContact CB-CG2 4.45Å; V74-V98 VanDerWaalsContact O-CA 3.29Å; V74-V98 WeakPolarHBondContact O-CA 3.4Å; A77-V98 HydrophobicContact CB-CG2 3.98Å; L85-V98 HydrophobicContact CD1-CG2 4.28Å; L85-V98 HydrophobicContact CD2-CB 4.35Å; V98-A125 HydrophobicContact CG1-CB 4.3Å; V98-V141 HydrophobicContact CB-CG1 4.44Å; V98-V141 HydrophobicContact CG1-CG1 3.81Å; V98-V142 PolarHBondContact N-O 3.47Å; V98-P143 HydrophobicContact CG1-CB 4.32Å; V98-P143 CarbonylContact O-C 3.53Å; V98-H144 WeakPolarHBondContact O-CB 3.49Å; V98-H144 PolarHBondContact O-N 3.14Å
99	I	98.8	Very high	97.8	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	126.8	173.7	-62.5	165.8	0	0	0	109	L73 V74 G76 H144 N146 I148 F151 F155 Y156	L73-I99 HydrophobicContact CD1-CD1 3.64Å; L73-I99 HydrophobicContact CD1-CG1 3.77Å; L73-I99 HydrophobicContact CD2-CD1 3.93Å; L73-I99 HydrophobicContact CG-CD1 4.37Å; V74-I99 PolarHBondContact O-N 2.81Å; G76-I99 WeakPolarHBondContact CA-O 3.37Å; G76-I99 PolarHBondContact N-O 2.78Å; I99-H144 WeakPolarHBondContact CA-O 3.49Å; I99-H144 HydrophobicContact CB-CB 4.38Å; I99-H144 HydrophobicContact CG1-CB 3.73Å; I99-N146 WeakPolarHBondContact CG2-O 3.44Å; I99-I148 HydrophobicContact CG2-CG2 4.08Å; I99-F151 HydrophobicContact CD1-CD2 3.99Å; I99-F151 HydrophobicContact CD1-CE2 3.88Å; I99-F151 HydrophobicContact CG1-CE2 4.12Å; I99-F151 HydrophobicContact CG2-CE2 4.39Å; I99-F155 HydrophobicContact CD1-CE1 3.68Å; I99-F155 HydrophobicContact CD1-CZ 3.95Å; I99-Y156 HydrophobicContact CD1-CE1 4.43Å
100	D	98.6	Very high	97.6	Very high	13 Å²	13	40.9 Å²	40.9	7%	0.07	22%	0.224	C	C	.	.			trans	-152.8	137.8	168.6	-164	-67.5	0	0	0	109.1	A77 D102 K124 A125 H144 F145 N146	A77-D100 WeakPolarHBondContact CA-OD2 3.24Å; A77-D100 HydrophobicContact CB-CB 3.68Å; A77-D100 PolarHBondContact N-OD2 3.37Å; D100-D102 WeakPolarHBondContact OD1-CA 3.44Å; D100-D102 VanDerWaalsContact OD1-CB 3.25Å; D100-D102 WeakPolarHBondContact OD1-CB 3.42Å; D100-D102 PolarHBondContact OD1-N 2.76Å; D100-K124 HydrophobicContact CB-CB 4.37Å; D100-A125 HydrophobicContact CB-CB 4.1Å; D100-H144 PolarHBondContact N-O 3.13Å; D100-H144 VanDerWaalsContact N-O 3.14Å; D100-F145 WeakPolarHBondContact O-CA 3.24Å; D100-F145 WeakPolarHBondContact O-CD2 3.23Å; D100-N146 CarbonylContact C-O 3.5Å; D100-N146 PolarHBondContact O-N 3.03Å
101	M	96.9	Very high	97.6	Very high	114 Å²	114	38.5 Å²	38.5	56%	0.562	21%	0.208	S	C	*	.			trans	-98.6	-5.9	-178.1	68.6	179.8	-172.6	0	0	113.4	F145 N146 K147	M101-F145 VanDerWaalsContact O-CE2 3.24Å; M101-F145 WeakPolarHBondContact O-CE2 3.47Å; M101-N146 PolarHBondContact N-O 3.36Å; M101-K147 HydrophobicContact CB-CB 4.14Å; M101-K147 HydrophobicContact SD-CB 3.73Å
102	D	97.1	Very high	97.5	Very high	56 Å²	56	37.2 Å²	37.2	30%	0.299	20%	0.198	S	C	.	.	P	Polyproline II helix	trans	-90.8	158.1	-175.7	-63.6	-20	0	0	0	111.9	D100 K124	D100-D102 WeakPolarHBondContact OD1-CA 3.44Å; D100-D102 VanDerWaalsContact OD1-CB 3.25Å; D100-D102 WeakPolarHBondContact OD1-CB 3.42Å; D100-D102 PolarHBondContact OD1-N 2.76Å; D102-K124 HydrophobicContact CB-CD 3.85Å; D102-K124 HydrophobicContact CB-CG 4.39Å; D102-K124 VanDerWaalsContact CB-NZ 3.26Å; D102-K124 PolarHBondContact O-N 3.32Å; D102-K124 IonicContact OD2-NZ 3.83Å; D102-K124 PolarHBondContact OD2-NZ 2.74Å
103	T	97.5	Very high	97.5	Very high	71 Å²	71	40.4 Å²	40.4	44%	0.436	21%	0.212	S	C	.	.	B	Isolated β-bridge	trans	-97.5	159.8	165.6	55.6	0	0	0	0	110.8	D105 R122 K124 F145	T103-D105 PolarHBondContact O-N 2.81Å; T103-R122 CarbonylContact C-O 3.57Å; T103-R122 WeakPolarHBondContact CA-O 3.39Å; T103-K124 VanDerWaalsContact O-CE 3.23Å; T103-K124 WeakPolarHBondContact O-CE 3.07Å; T103-F145 HydrophobicContact CG2-CE2 4.48Å; T103-F145 HydrophobicContact CG2-CZ 4.21Å
104	I	98.1	Very high	97.5	Very high	3 Å²	3	40.4 Å²	40.4	2%	0.015	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-73.7	123.8	-179.7	-64.2	163.6	0	0	0	109.7	L109 F115 D119 I120 G121 R122 K124 V127	I104-L109 HydrophobicContact CG2-CD2 4.44Å; I104-F115 HydrophobicContact CD1-CB 4.08Å; I104-F115 HydrophobicContact CD1-CD1 3.55Å; I104-F115 HydrophobicContact CD1-CD2 4.41Å; I104-F115 HydrophobicContact CD1-CE1 4.11Å; I104-F115 HydrophobicContact CD1-CG 3.75Å; I104-F115 HydrophobicContact CG1-CB 4.39Å; I104-F115 HydrophobicContact CG1-CD1 4.05Å; I104-F115 HydrophobicContact CG1-CD2 4.06Å; I104-F115 HydrophobicContact CG1-CE1 4.39Å; I104-F115 HydrophobicContact CG1-CE2 4.4Å; I104-F115 HydrophobicContact CG1-CG 3.89Å; I104-F115 HydrophobicContact CG2-CB 3.99Å; I104-F115 HydrophobicContact CG2-CD2 4.44Å; I104-F115 HydrophobicContact CG2-CG 4.29Å; I104-D119 HydrophobicContact CD1-CB 3.7Å; I104-D119 WeakPolarHBondContact CD1-O 3.24Å; I104-I120 HydrophobicContact CG2-CG1 4.46Å; I104-G121 PolarHBondContact O-N 3.11Å; I104-R122 HydrophobicContact CD1-CB 4.45Å; I104-R122 WeakPolarHBondContact CG1-O 3.29Å; I104-R122 PolarHBondContact N-O 3.14Å; I104-K124 HydrophobicContact CG1-CB 4.46Å; I104-K124 HydrophobicContact CG1-CG 3.75Å; I104-V127 HydrophobicContact CD1-CB 3.75Å; I104-V127 HydrophobicContact CD1-CG1 4Å; I104-V127 HydrophobicContact CD1-CG2 3.59Å
105	D	95.2	Very high	97.5	Very high	50 Å²	50	39.3 Å²	39.3	27%	0.267	21%	0.208	S	C	.	.			trans	-107.8	154.6	173	180	-102.6	0	0	0	111.6	T103 S107 N108	T103-D105 PolarHBondContact O-N 2.81Å; D105-S107 PolarHBondContact O-N 3.33Å; D105-S107 WeakPolarHBondContact OD1-CB 3.45Å; D105-S107 PolarHBondContact OD1-N 3.26Å; D105-S107 PolarHBondContact OD1-OG 2.78Å; D105-N108 PolarHBondContact N-OD1 2.9Å; D105-N108 WeakPolarHBondContact O-CB 3.5Å; D105-N108 PolarHBondContact O-N 3.45Å
106	V	95.9	Very high	97.5	Very high	94 Å²	94	42.9 Å²	42.9	57%	0.57	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-56.7	-34.4	178.7	67	0	0	0	0	112.7	N108 L109 I120	V106-N108 PolarHBondContact O-N 3.45Å; V106-N108 VanDerWaalsContact O-N 3.17Å; V106-L109 WeakPolarHBondContact O-CG 3.29Å; V106-L109 PolarHBondContact O-N 3.34Å; V106-I120 HydrophobicContact CB-CD1 4.13Å; V106-I120 HydrophobicContact CG2-CD1 4.37Å
107	S	94.7	Very high	97.5	Very high	58 Å²	58	47.5 Å²	47.5	41%	0.406	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-68.6	-10.6	178.8	69.5	0	0	0	0	113.8	D105 N110 R111	D105-S107 PolarHBondContact O-N 3.33Å; D105-S107 WeakPolarHBondContact OD1-CB 3.45Å; D105-S107 PolarHBondContact OD1-N 3.26Å; D105-S107 PolarHBondContact OD1-OG 2.78Å; S107-N110 PolarHBondContact O-OD1 2.79Å; S107-R111 PolarHBondContact O-NH1 3.42Å
108	N	96.5	Very high	97.5	Very high	11 Å²	11	53.7 Å²	53.7	6%	0.059	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-79.4	-28.8	178.8	-61	168.4	0	0	0	112.1	D105 V106 N110 R111 Q112 K124	D105-N108 PolarHBondContact N-OD1 2.9Å; D105-N108 WeakPolarHBondContact O-CB 3.5Å; D105-N108 PolarHBondContact O-N 3.45Å; V106-N108 PolarHBondContact O-N 3.45Å; V106-N108 VanDerWaalsContact O-N 3.17Å; N108-N110 PolarHBondContact O-N 2.83Å; N108-N110 VanDerWaalsContact O-N 3.08Å; N108-R111 PolarHBondContact O-N 3.34Å; N108-R111 VanDerWaalsContact O-N 3.14Å; N108-Q112 HydrophobicContact CB-CB 4.33Å; N108-Q112 HydrophobicContact CB-CG 4.27Å; N108-Q112 WeakPolarHBondContact O-CB 3.46Å; N108-Q112 PolarHBondContact O-N 2.87Å; N108-K124 WeakPolarHBondContact OD1-CE 3.46Å
109	L	97.4	Very high	97.5	Very high	51 Å²	51	53.8 Å²	53.8	27%	0.267	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-15.1	-167.5	-56	-176.4	0	0	0	114.4	I104 V106 R111 F115 P117 I120	I104-L109 HydrophobicContact CG2-CD2 4.44Å; V106-L109 WeakPolarHBondContact O-CG 3.29Å; V106-L109 PolarHBondContact O-N 3.34Å; L109-R111 VanDerWaalsContact C-N 3.25Å; L109-R111 PolarHBondContact O-N 3.15Å; L109-F115 HydrophobicContact CD2-CB 3.87Å; L109-P117 HydrophobicContact CD1-CB 4.43Å; L109-P117 HydrophobicContact CD1-CG 4.02Å; L109-I120 HydrophobicContact CD1-CD1 4.4Å
110	N	96.3	Very high	97.5	Very high	97 Å²	97	57.6 Å²	57.6	52%	0.519	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-15	176.5	80.7	-42.9	0	0	0	113.6	S107 N108 A312	S107-N110 PolarHBondContact O-OD1 2.79Å; N108-N110 PolarHBondContact O-N 2.83Å; N108-N110 VanDerWaalsContact O-N 3.08Å; N110-A312 PolarHBondContact ND2-O 2.73Å
111	R	96.9	Very high	97.4	Very high	55 Å²	55	59.4 Å²	59.4	21%	0.208	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-145.7	-17.6	-173.8	69.8	-166.5	176.8	-81.6	6.1	115.3	S107 N108 L109 F113 A312 A314	S107-R111 PolarHBondContact O-NH1 3.42Å; N108-R111 PolarHBondContact O-N 3.34Å; N108-R111 VanDerWaalsContact O-N 3.14Å; L109-R111 VanDerWaalsContact C-N 3.25Å; L109-R111 PolarHBondContact O-N 3.15Å; R111-F113 PolarHBondContact O-N 2.93Å; R111-A312 VanDerWaalsContact NE-CB 3.32Å; R111-A314 HydrophobicContact CB-CB 4.2Å
112	Q	97.9	Very high	97.5	Very high	5 Å²	5	57.2 Å²	57.2	2%	0.023	30%	0.303	C	S	.	.			trans	-101.5	75.5	-177.8	-60.6	175.4	27.5	0	0	109.6	N108 L114 F115	N108-Q112 HydrophobicContact CB-CB 4.33Å; N108-Q112 HydrophobicContact CB-CG 4.27Å; N108-Q112 WeakPolarHBondContact O-CB 3.46Å; N108-Q112 PolarHBondContact O-N 2.87Å; Q112-L114 PolarHBondContact O-N 3.04Å; Q112-L114 VanDerWaalsContact O-N 3.09Å; Q112-F115 HydrophobicContact CB-CD2 3.46Å; Q112-F115 VanDerWaalsContact CB-CD2 3.46Å; Q112-F115 HydrophobicContact CB-CE2 3.69Å; Q112-F115 HydrophobicContact CG-CD2 4.45Å; Q112-F115 HydrophobicContact CG-CE2 4.34Å; Q112-F115 PolarHBondContact O-N 3.36Å; Q112-F115 VanDerWaalsContact O-N 3.08Å
113	F	98.5	Very high	97.5	Very high	67 Å²	67	55.6 Å²	55.6	29%	0.294	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-11.3	-165.7	67.2	-91.1	0	0	0	115.6	C82 E83 K86 R111 F115	C82-F113 HydrophobicContact CB-CD1 4.34Å; C82-F113 HydrophobicContact CB-CE1 3.96Å; C82-F113 HydrophobicContact CB-CZ 4.43Å; E83-F113 HydrophobicContact CG-CE1 4.05Å; K86-F113 HydrophobicContact CB-CZ 3.95Å; K86-F113 HydrophobicContact CD-CE2 4.29Å; K86-F113 HydrophobicContact CD-CZ 3.88Å; R111-F113 PolarHBondContact O-N 2.93Å; F113-F115 PolarHBondContact O-N 3.44Å
114	L	98.6	Very high	97.6	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-18.3	173.3	-59.2	-176.5	0	0	0	111.9	C82 L85 Q112 A128 F131 L132	C82-L114 HydrophobicContact CB-CD1 3.89Å; C82-L114 HydrophobicContact CB-CG 3.87Å; L85-L114 HydrophobicContact CD1-CD1 4.02Å; Q112-L114 PolarHBondContact O-N 3.04Å; Q112-L114 VanDerWaalsContact O-N 3.09Å; L114-A128 HydrophobicContact CD1-CB 3.86Å; L114-F131 HydrophobicContact CB-CB 4.44Å; L114-F131 HydrophobicContact CB-CG 4.4Å; L114-F131 HydrophobicContact CD2-CB 4.45Å; L114-F131 HydrophobicContact CD2-CD1 3.35Å; L114-F131 HydrophobicContact CD2-CE1 3.72Å; L114-F131 HydrophobicContact CD2-CG 3.99Å; L114-F131 WeakPolarHBondContact O-CD2 3.37Å; L114-L132 HydrophobicContact CD2-CD1 4.21Å
115	F	98.6	Very high	97.6	Very high	6 Å²	6	52.7 Å²	52.7	3%	0.026	28%	0.276	C	S	.	.			trans	-103.9	143.8	-174.8	-47.9	-37.9	0	0	0	111.5	A77 I104 L109 Q112 F113 K124 V127 A128	A77-F115 WeakPolarHBondContact O-CZ 3.37Å; I104-F115 HydrophobicContact CD1-CB 4.08Å; I104-F115 HydrophobicContact CD1-CD1 3.55Å; I104-F115 HydrophobicContact CD1-CD2 4.41Å; I104-F115 HydrophobicContact CD1-CE1 4.11Å; I104-F115 HydrophobicContact CD1-CG 3.75Å; I104-F115 HydrophobicContact CG1-CB 4.39Å; I104-F115 HydrophobicContact CG1-CD1 4.05Å; I104-F115 HydrophobicContact CG1-CD2 4.06Å; I104-F115 HydrophobicContact CG1-CE1 4.39Å; I104-F115 HydrophobicContact CG1-CE2 4.4Å; I104-F115 HydrophobicContact CG1-CG 3.89Å; I104-F115 HydrophobicContact CG2-CB 3.99Å; I104-F115 HydrophobicContact CG2-CD2 4.44Å; I104-F115 HydrophobicContact CG2-CG 4.29Å; L109-F115 HydrophobicContact CD2-CB 3.87Å; Q112-F115 HydrophobicContact CB-CD2 3.46Å; Q112-F115 VanDerWaalsContact CB-CD2 3.46Å; Q112-F115 HydrophobicContact CB-CE2 3.69Å; Q112-F115 HydrophobicContact CG-CD2 4.45Å; Q112-F115 HydrophobicContact CG-CE2 4.34Å; Q112-F115 PolarHBondContact O-N 3.36Å; Q112-F115 VanDerWaalsContact O-N 3.08Å; F113-F115 PolarHBondContact O-N 3.44Å; F115-K124 HydrophobicContact CE1-CB 4.47Å; F115-K124 WeakPolarHBondContact CE1-O 3.26Å; F115-K124 HydrophobicContact CE2-CB 4.28Å; F115-K124 HydrophobicContact CE2-CD 4.19Å; F115-K124 HydrophobicContact CE2-CG 4.01Å; F115-K124 HydrophobicContact CZ-CB 3.81Å; F115-K124 HydrophobicContact CZ-CD 4.5Å; F115-K124 HydrophobicContact CZ-CG 4.04Å; F115-V127 HydrophobicContact CD1-CB 4.07Å; F115-V127 HydrophobicContact CD1-CG1 3.78Å; F115-V127 HydrophobicContact CE1-CB 4.17Å; F115-V127 HydrophobicContact CE1-CG1 4.31Å; F115-A128 HydrophobicContact CE1-CB 3.97Å; F115-A128 HydrophobicContact CZ-CB 4.29Å
116	R	98.5	Very high	97.8	Very high	125 Å²	125	54.2 Å²	54.2	47%	0.472	28%	0.282	S	S	.	.			trans	-120.3	164.2	177.5	-54	-61.8	-179.9	177	-1.8	110.4	K118 D119	R116-K118 HydrophobicContact CB-CG 4.04Å; R116-K118 PolarHBondContact O-N 3.16Å; R116-K118 VanDerWaalsContact O-N 3.09Å; R116-D119 WeakPolarHBondContact CA-OD2 3.02Å; R116-D119 VanDerWaalsContact CB-OD2 3.23Å; R116-D119 WeakPolarHBondContact CB-OD2 3.24Å; R116-D119 PolarHBondContact N-OD2 2.93Å; R116-D119 WeakPolarHBondContact O-CB 3.2Å; R116-D119 PolarHBondContact O-N 3.2Å
117	P	98.4	Very high	98	Very high	96 Å²	96	50 Å²	50	62%	0.623	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-53.5	-31.8	176.6	-28.5	35.5	0	0	0	114.5	L109 D119 I120	L109-P117 HydrophobicContact CD1-CB 4.43Å; L109-P117 HydrophobicContact CD1-CG 4.02Å; P117-D119 PolarHBondContact O-N 3.43Å; P117-I120 WeakPolarHBondContact O-CD1 3.34Å; P117-I120 WeakPolarHBondContact O-CG1 3.3Å
118	K	98.5	Very high	98.1	Very high	153 Å²	153	47.2 Å²	47.2	67%	0.665	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-68.9	-15.2	176.6	66.8	173.6	-174.5	69.8	0	114.2	R116	R116-K118 HydrophobicContact CB-CG 4.04Å; R116-K118 PolarHBondContact O-N 3.16Å; R116-K118 VanDerWaalsContact O-N 3.09Å
119	D	98.6	Very high	98.3	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.016	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-97.6	-2.3	-174.7	-52.4	-51.5	0	0	0	112.4	I104 R116 P117 G121 R122 V127	I104-D119 HydrophobicContact CD1-CB 3.7Å; I104-D119 WeakPolarHBondContact CD1-O 3.24Å; R116-D119 WeakPolarHBondContact CA-OD2 3.02Å; R116-D119 VanDerWaalsContact CB-OD2 3.23Å; R116-D119 WeakPolarHBondContact CB-OD2 3.24Å; R116-D119 PolarHBondContact N-OD2 2.93Å; R116-D119 WeakPolarHBondContact O-CB 3.2Å; R116-D119 PolarHBondContact O-N 3.2Å; P117-D119 PolarHBondContact O-N 3.43Å; D119-G121 PolarHBondContact O-N 3.04Å; D119-R122 VanDerWaalsContact O-CB 3.28Å; D119-R122 WeakPolarHBondContact O-CB 3.47Å; D119-R122 PolarHBondContact O-N 3.47Å; D119-R122 IonicContact OD1-NH1 3.28Å; D119-R122 PolarHBondContact OD1-NH1 2.88Å; D119-V127 HydrophobicContact CB-CG1 4Å; D119-V127 HydrophobicContact CB-CG2 4.28Å
120	I	98.2	Very high	98.3	Very high	82 Å²	82	49 Å²	49	42%	0.421	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	132.7	179	-66.6	170.8	0	0	0	110.3	I104 V106 L109 P117 R122	I104-I120 HydrophobicContact CG2-CG1 4.46Å; V106-I120 HydrophobicContact CB-CD1 4.13Å; V106-I120 HydrophobicContact CG2-CD1 4.37Å; L109-I120 HydrophobicContact CD1-CD1 4.4Å; P117-I120 WeakPolarHBondContact O-CD1 3.34Å; P117-I120 WeakPolarHBondContact O-CG1 3.3Å; I120-R122 VanDerWaalsContact C-N 3.31Å
121	G	97.4	Very high	98.4	Very high	50 Å²	50	46.4 Å²	46.4	52%	0.515	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	86	-13.1	-176.7	0	0	0	0	0	114.9	I104 D119	I104-G121 PolarHBondContact O-N 3.11Å; D119-G121 PolarHBondContact O-N 3.04Å
122	R	98.6	Very high	98.5	Very high	69 Å²	69	44 Å²	44	26%	0.26	22%	0.22	S	C	.	.	S	Bend	trans	-78.7	155.6	174.7	-62.4	-179.6	66.1	-158.8	-0.8	111.4	T103 I104 D119 I120 K124 E126 V127 E130	T103-R122 CarbonylContact C-O 3.57Å; T103-R122 WeakPolarHBondContact CA-O 3.39Å; I104-R122 HydrophobicContact CD1-CB 4.45Å; I104-R122 WeakPolarHBondContact CG1-O 3.29Å; I104-R122 PolarHBondContact N-O 3.14Å; D119-R122 VanDerWaalsContact O-CB 3.28Å; D119-R122 WeakPolarHBondContact O-CB 3.47Å; D119-R122 PolarHBondContact O-N 3.47Å; D119-R122 IonicContact OD1-NH1 3.28Å; D119-R122 PolarHBondContact OD1-NH1 2.88Å; I120-R122 VanDerWaalsContact C-N 3.31Å; R122-K124 PolarHBondContact O-N 3.21Å; R122-E126 IonicContact CZ-OE1 3.7Å; R122-E126 IonicContact NE-OE1 3.94Å; R122-E126 IonicContact NH2-OE1 2.86Å; R122-E126 PolarHBondContact NH2-OE1 3.26Å; R122-V127 HydrophobicContact CB-CG2 3.71Å; R122-E130 IonicContact CZ-OE2 2.78Å; R122-E130 IonicContact NH1-OE2 3.82Å; R122-E130 PolarHBondContact NH1-OE2 3.13Å; R122-E130 IonicContact NH2-OE2 3.97Å; R122-E130 PolarHBondContact NH2-OE2 3.48Å
123	P	98.6	Very high	98.5	Very high	22 Å²	22	46.4 Å²	46.4	14%	0.143	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-58.9	130.4	173.1	-26.7	37.1	0	0	0	112.9	A125 E126 V127 F145	P123-A125 PolarHBondContact O-N 3.2Å; P123-E126 HydrophobicContact CB-CB 4.07Å; P123-E126 PolarHBondContact O-N 2.67Å; P123-V127 PolarHBondContact O-N 3.37Å; P123-F145 HydrophobicContact CB-CB 4.15Å; P123-F145 HydrophobicContact CB-CD1 4.13Å; P123-F145 HydrophobicContact CB-CD2 3.63Å; P123-F145 HydrophobicContact CB-CE1 4.45Å; P123-F145 HydrophobicContact CB-CE2 3.97Å; P123-F145 HydrophobicContact CB-CG 3.7Å; P123-F145 HydrophobicContact CB-CZ 4.38Å; P123-F145 HydrophobicContact CG-CD1 3.87Å; P123-F145 HydrophobicContact CG-CD2 4.22Å; P123-F145 HydrophobicContact CG-CE1 4Å; P123-F145 HydrophobicContact CG-CE2 4.32Å; P123-F145 HydrophobicContact CG-CG 3.98Å; P123-F145 HydrophobicContact CG-CZ 4.23Å
124	K	98.7	Very high	98.5	Very high	12 Å²	12	49.2 Å²	49.2	5%	0.052	25%	0.251	C	S	.	.	H	α-helix	trans	-59.9	-44.9	179.8	-70.1	-176.2	-168.7	157.9	0	112.3	A77 D100 D102 T103 I104 N108 F115 R122 E126 V127 A128	A77-K124 HydrophobicContact CB-CB 3.96Å; D100-K124 HydrophobicContact CB-CB 4.37Å; D102-K124 HydrophobicContact CB-CD 3.85Å; D102-K124 HydrophobicContact CB-CG 4.39Å; D102-K124 VanDerWaalsContact CB-NZ 3.26Å; D102-K124 PolarHBondContact O-N 3.32Å; D102-K124 IonicContact OD2-NZ 3.83Å; D102-K124 PolarHBondContact OD2-NZ 2.74Å; T103-K124 VanDerWaalsContact O-CE 3.23Å; T103-K124 WeakPolarHBondContact O-CE 3.07Å; I104-K124 HydrophobicContact CG1-CB 4.46Å; I104-K124 HydrophobicContact CG1-CG 3.75Å; N108-K124 WeakPolarHBondContact OD1-CE 3.46Å; F115-K124 HydrophobicContact CE1-CB 4.47Å; F115-K124 WeakPolarHBondContact CE1-O 3.26Å; F115-K124 HydrophobicContact CE2-CB 4.28Å; F115-K124 HydrophobicContact CE2-CD 4.19Å; F115-K124 HydrophobicContact CE2-CG 4.01Å; F115-K124 HydrophobicContact CZ-CB 3.81Å; F115-K124 HydrophobicContact CZ-CD 4.5Å; F115-K124 HydrophobicContact CZ-CG 4.04Å; R122-K124 PolarHBondContact O-N 3.21Å; K124-E126 VanDerWaalsContact C-N 3.34Å; K124-E126 PolarHBondContact O-N 3.44Å; K124-V127 PolarHBondContact O-N 3.12Å; K124-A128 WeakPolarHBondContact O-CB 3.35Å; K124-A128 PolarHBondContact O-N 3.02Å
125	A	98.7	Very high	98.5	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-57.4	-46.1	-178.8	0	0	0	0	0	111.9	V98 D100 P123 A128 A129 P143	V98-A125 HydrophobicContact CG1-CB 4.3Å; D100-A125 HydrophobicContact CB-CB 4.1Å; P123-A125 PolarHBondContact O-N 3.2Å; A125-A128 PolarHBondContact O-N 3.2Å; A125-A129 PolarHBondContact O-N 3.23Å; A125-P143 HydrophobicContact CB-CB 4.16Å; A125-P143 WeakPolarHBondContact O-CB 3.41Å
126	E	98.8	Very high	98.5	Very high	83 Å²	83	57 Å²	57	39%	0.388	28%	0.281	S	S	.	.	H	α-helix	trans	-62.7	-52.9	-179.3	-172.9	-168.6	134.1	0	0	111.7	R122 P123 K124 A128 A129 E130	R122-E126 IonicContact CZ-OE1 3.7Å; R122-E126 IonicContact NE-OE1 3.94Å; R122-E126 IonicContact NH2-OE1 2.86Å; R122-E126 PolarHBondContact NH2-OE1 3.26Å; P123-E126 HydrophobicContact CB-CB 4.07Å; P123-E126 PolarHBondContact O-N 2.67Å; K124-E126 VanDerWaalsContact C-N 3.34Å; K124-E126 PolarHBondContact O-N 3.44Å; E126-A128 VanDerWaalsContact C-N 3.3Å; E126-A128 PolarHBondContact O-N 2.8Å; E126-A129 PolarHBondContact O-N 3.31Å; E126-E130 WeakPolarHBondContact O-CB 3.31Å; E126-E130 PolarHBondContact O-N 3.27Å
127	V	98.8	Very high	98.4	Very high	4 Å²	4	53.4 Å²	53.4	2%	0.024	27%	0.274	C	S	.	.	H	α-helix	trans	-66.3	-35.3	-178.6	-177.3	0	0	0	0	111.2	I104 F115 D119 R122 P123 K124 E130 F131	I104-V127 HydrophobicContact CD1-CB 3.75Å; I104-V127 HydrophobicContact CD1-CG1 4Å; I104-V127 HydrophobicContact CD1-CG2 3.59Å; F115-V127 HydrophobicContact CD1-CB 4.07Å; F115-V127 HydrophobicContact CD1-CG1 3.78Å; F115-V127 HydrophobicContact CE1-CB 4.17Å; F115-V127 HydrophobicContact CE1-CG1 4.31Å; D119-V127 HydrophobicContact CB-CG1 4Å; D119-V127 HydrophobicContact CB-CG2 4.28Å; R122-V127 HydrophobicContact CB-CG2 3.71Å; P123-V127 PolarHBondContact O-N 3.37Å; K124-V127 PolarHBondContact O-N 3.12Å; V127-E130 PolarHBondContact O-N 2.66Å; V127-F131 WeakPolarHBondContact O-CB 3.49Å; V127-F131 PolarHBondContact O-N 2.56Å
128	A	98.8	Very high	98.3	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.6	-44.9	176	0	0	0	0	0	111.5	A77 L85 L114 F115 K124 A125 E126 L132	A77-A128 HydrophobicContact CB-CB 4.32Å; L85-A128 HydrophobicContact CD1-CB 3.78Å; L114-A128 HydrophobicContact CD1-CB 3.86Å; F115-A128 HydrophobicContact CE1-CB 3.97Å; F115-A128 HydrophobicContact CZ-CB 4.29Å; K124-A128 WeakPolarHBondContact O-CB 3.35Å; K124-A128 PolarHBondContact O-N 3.02Å; A125-A128 PolarHBondContact O-N 3.2Å; E126-A128 VanDerWaalsContact C-N 3.3Å; E126-A128 PolarHBondContact O-N 2.8Å; A128-L132 WeakPolarHBondContact O-CB 3.31Å; A128-L132 PolarHBondContact O-N 3.09Å; A128-L132 VanDerWaalsContact O-N 3.15Å
129	A	98.8	Very high	98.2	Very high	3 Å²	3	45.4 Å²	45.4	3%	0.025	23%	0.234	C	C	.	.	H	α-helix	trans	-66.3	-46	175.9	0	0	0	0	0	112.1	A125 E126 F131 L132 N133 V141 P143	A125-A129 PolarHBondContact O-N 3.23Å; E126-A129 PolarHBondContact O-N 3.31Å; A129-F131 PolarHBondContact O-N 3.08Å; A129-L132 PolarHBondContact O-N 3.15Å; A129-N133 WeakPolarHBondContact O-CB 3.46Å; A129-N133 VanDerWaalsContact O-CG 3.23Å; A129-N133 PolarHBondContact O-N 2.98Å; A129-N133 PolarHBondContact O-ND2 3.38Å; A129-V141 HydrophobicContact CB-CB 3.93Å; A129-V141 HydrophobicContact CB-CG1 3.67Å; A129-P143 HydrophobicContact CB-CB 3.81Å; A129-P143 HydrophobicContact CB-CG 3.89Å
130	E	98.7	Very high	98.2	Very high	96 Å²	96	48.6 Å²	48.6	45%	0.449	25%	0.251	S	S	.	.	H	α-helix	trans	-53.4	-53.5	176.5	-176.2	-170.2	159	0	0	111	R122 E126 V127 L132 D134	R122-E130 IonicContact CZ-OE2 2.78Å; R122-E130 IonicContact NH1-OE2 3.82Å; R122-E130 PolarHBondContact NH1-OE2 3.13Å; R122-E130 IonicContact NH2-OE2 3.97Å; R122-E130 PolarHBondContact NH2-OE2 3.48Å; E126-E130 WeakPolarHBondContact O-CB 3.31Å; E126-E130 PolarHBondContact O-N 3.27Å; V127-E130 PolarHBondContact O-N 2.66Å; E130-L132 VanDerWaalsContact C-N 3.34Å; E130-L132 PolarHBondContact O-N 3.12Å; E130-D134 PolarHBondContact O-N 3.22Å
131	F	98.7	Very high	98.2	Very high	44 Å²	44	44.8 Å²	44.8	19%	0.193	23%	0.232	C	C	.	.	H	α-helix	trans	-60.9	-43.4	-179	-173.2	-76.2	0	0	0	111.8	L114 V127 A129 R135	L114-F131 HydrophobicContact CB-CB 4.44Å; L114-F131 HydrophobicContact CB-CG 4.4Å; L114-F131 HydrophobicContact CD2-CB 4.45Å; L114-F131 HydrophobicContact CD2-CD1 3.35Å; L114-F131 HydrophobicContact CD2-CE1 3.72Å; L114-F131 HydrophobicContact CD2-CG 3.99Å; L114-F131 WeakPolarHBondContact O-CD2 3.37Å; V127-F131 WeakPolarHBondContact O-CB 3.49Å; V127-F131 PolarHBondContact O-N 2.56Å; A129-F131 PolarHBondContact O-N 3.08Å; F131-R135 HydrophobicContact CD1-CB 4.19Å; F131-R135 HydrophobicContact CE1-CB 4.02Å; F131-R135 HydrophobicContact CE1-CG 4.18Å; F131-R135 VanDerWaalsContact O-CB 3.22Å; F131-R135 WeakPolarHBondContact O-CB 3.34Å; F131-R135 PolarHBondContact O-N 2.82Å
132	L	98.5	Very high	98.3	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-75.1	-39.1	-172.7	-149.7	78.9	0	0	0	112.6	L85 A89 L114 A128 A129 E130 D134 R135 V136 V141	L85-L132 HydrophobicContact CB-CD1 4.43Å; L85-L132 HydrophobicContact CB-CD2 3.78Å; L85-L132 HydrophobicContact CD2-CD2 4.3Å; L85-L132 WeakPolarHBondContact O-CD2 3.42Å; A89-L132 HydrophobicContact CB-CD2 3.77Å; A89-L132 HydrophobicContact CB-CG 4.33Å; L114-L132 HydrophobicContact CD2-CD1 4.21Å; A128-L132 WeakPolarHBondContact O-CB 3.31Å; A128-L132 PolarHBondContact O-N 3.09Å; A128-L132 VanDerWaalsContact O-N 3.15Å; A129-L132 PolarHBondContact O-N 3.15Å; E130-L132 VanDerWaalsContact C-N 3.34Å; E130-L132 PolarHBondContact O-N 3.12Å; L132-D134 VanDerWaalsContact C-N 3.28Å; L132-D134 PolarHBondContact O-N 2.93Å; L132-R135 PolarHBondContact O-N 3.41Å; L132-V136 HydrophobicContact CG-CG2 4.49Å; L132-V136 PolarHBondContact O-N 3.01Å; L132-V141 HydrophobicContact CB-CG2 4.1Å; L132-V141 HydrophobicContact CD2-CG2 3.52Å; L132-V141 HydrophobicContact CG-CG2 4.37Å
133	N	98.4	Very high	98.3	Very high	55 Å²	55	43.8 Å²	43.8	29%	0.294	22%	0.224	S	C	.	.	H	α-helix	trans	-66.2	-31.6	176.5	-68.8	-21.2	0	0	0	111.8	A129 C139 V141	A129-N133 WeakPolarHBondContact O-CB 3.46Å; A129-N133 VanDerWaalsContact O-CG 3.23Å; A129-N133 PolarHBondContact O-N 2.98Å; A129-N133 PolarHBondContact O-ND2 3.38Å; N133-C139 PolarHBondContact OD1-O 3.35Å; N133-C139 VanDerWaalsContact OD1-O 3.04Å; N133-V141 PolarHBondContact ND2-O 3.14Å; N133-V141 WeakPolarHBondContact OD1-CB 3.34Å; N133-V141 WeakPolarHBondContact OD1-CG2 3.38Å; N133-V141 PolarHBondContact OD1-N 2.65Å
134	D	98.3	Very high	98.3	Very high	126 Å²	126	44.2 Å²	44.2	67%	0.674	22%	0.224	S	C	*	.	H	α-helix	trans	-71	-51.5	170	178.1	118.1	0	0	0	111.4	E130 L132 V136	E130-D134 PolarHBondContact O-N 3.22Å; L132-D134 VanDerWaalsContact C-N 3.28Å; L132-D134 PolarHBondContact O-N 2.93Å; D134-V136 PolarHBondContact O-N 3.01Å
135	R	98.1	Very high	98.3	Very high	158 Å²	158	48.6 Å²	48.6	60%	0.596	24%	0.243	S	C	*	.	H	α-helix	trans	-70.3	-34.7	-171.2	-177.7	58	60.9	-162.8	-4.6	113.5	F131 L132	F131-R135 HydrophobicContact CD1-CB 4.19Å; F131-R135 HydrophobicContact CE1-CB 4.02Å; F131-R135 HydrophobicContact CE1-CG 4.18Å; F131-R135 VanDerWaalsContact O-CB 3.22Å; F131-R135 WeakPolarHBondContact O-CB 3.34Å; F131-R135 PolarHBondContact O-N 2.82Å; L132-R135 PolarHBondContact O-N 3.41Å
136	V	97.7	Very high	98.3	Very high	11 Å²	11	51.3 Å²	51.3	7%	0.067	26%	0.258	C	S	.	.	S	Bend	trans	-116.1	102.8	-175.5	-174.6	0	0	0	0	109	A89 L90 L132 D134 N138 C139	A89-V136 HydrophobicContact CB-CB 4.35Å; A89-V136 HydrophobicContact CB-CG1 4.12Å; A89-V136 HydrophobicContact CB-CG2 4.18Å; L90-V136 HydrophobicContact CD2-CG1 4.47Å; L90-V136 HydrophobicContact CD2-CG2 4.3Å; L132-V136 HydrophobicContact CG-CG2 4.49Å; L132-V136 PolarHBondContact O-N 3.01Å; D134-V136 PolarHBondContact O-N 3.01Å; V136-N138 PolarHBondContact O-N 3.36Å; V136-C139 HydrophobicContact CB-CB 4.05Å; V136-C139 HydrophobicContact CG1-CB 4.21Å; V136-C139 WeakPolarHBondContact O-CB 3.11Å; V136-C139 PolarHBondContact O-N 3.29Å
137	P	96.6	Very high	98.2	Very high	50 Å²	50	52 Å²	52	33%	0.325	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	137.9	-175.4	-31.6	39.2	0	0	0	113.4	W34 R37 C139	W34-P137 HydrophobicContact CZ3-CB 4.39Å; W34-P137 HydrophobicContact CZ3-CG 3.97Å; R37-P137 VanDerWaalsContact CZ-O 3.27Å; R37-P137 PolarHBondContact NH1-O 3.38Å; R37-P137 PolarHBondContact NH2-O 3.2Å; P137-C139 PolarHBondContact O-N 3.49Å; P137-C139 VanDerWaalsContact O-N 3.14Å
138	N	96.2	Very high	98.2	Very high	68 Å²	68	52.2 Å²	52.2	36%	0.364	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.3	11.3	-176.4	-41.4	-42.4	0	0	0	115.8	T31 G32 R37 R94 V136	T31-N138 PolarHBondContact O-ND2 3.19Å; G32-N138 WeakPolarHBondContact CA-ND2 3.37Å; R37-N138 PolarHBondContact NH1-ND2 2.97Å; R94-N138 VanDerWaalsContact CD-O 3.24Å; R94-N138 WeakPolarHBondContact CD-O 3.46Å; R94-N138 VanDerWaalsContact CG-O 3.31Å; R94-N138 WeakPolarHBondContact CG-O 3.43Å; R94-N138 PolarHBondContact NE-O 2.86Å; R94-N138 PolarHBondContact NH2-ND2 3.44Å; V136-N138 PolarHBondContact O-N 3.36Å
139	C	96.9	Very high	98.1	Very high	13 Å²	13	55.6 Å²	55.6	9%	0.088	28%	0.276	C	S	.	.			trans	-66.2	140.7	164	-156.7	0	0	0	0	108.4	N133 V136 P137	N133-C139 PolarHBondContact OD1-O 3.35Å; N133-C139 VanDerWaalsContact OD1-O 3.04Å; V136-C139 HydrophobicContact CB-CB 4.05Å; V136-C139 HydrophobicContact CG1-CB 4.21Å; V136-C139 WeakPolarHBondContact O-CB 3.11Å; V136-C139 PolarHBondContact O-N 3.29Å; P137-C139 PolarHBondContact O-N 3.49Å; P137-C139 VanDerWaalsContact O-N 3.14Å
140	N	98.4	Very high	98	Very high	70 Å²	70	59.4 Å²	59.4	37%	0.374	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	70.4	178.6	-178.6	39	0	0	0	109.2	R94 Q95 I96	R94-N140 CarbonylContact O-C 3.22Å; R94-N140 VanDerWaalsContact O-C 3.22Å; R94-N140 WeakPolarHBondContact O-CA 3.35Å; R94-N140 WeakPolarHBondContact O-CB 3.45Å; R94-N140 PolarHBondContact O-N 3.3Å; Q95-N140 PolarHBondContact OE1-ND2 3.08Å; Q95-N140 VanDerWaalsContact OE1-ND2 3.15Å; I96-N140 PolarHBondContact N-O 3Å
141	V	98.8	Very high	98	Very high	3 Å²	3	56.6 Å²	56.6	2%	0.018	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	120.1	173.6	-171.6	0	0	0	0	109.4	L85 I96 V98 A129 L132 N133	L85-V141 HydrophobicContact CD2-CG1 4.03Å; L85-V141 HydrophobicContact CD2-CG2 4.45Å; I96-V141 HydrophobicContact CB-CG2 4.34Å; I96-V141 CarbonylContact O-C 3.51Å; I96-V141 VanDerWaalsContact O-CA 3.24Å; I96-V141 WeakPolarHBondContact O-CA 3.45Å; V98-V141 HydrophobicContact CB-CG1 4.44Å; V98-V141 HydrophobicContact CG1-CG1 3.81Å; A129-V141 HydrophobicContact CB-CB 3.93Å; A129-V141 HydrophobicContact CB-CG1 3.67Å; L132-V141 HydrophobicContact CB-CG2 4.1Å; L132-V141 HydrophobicContact CD2-CG2 3.52Å; L132-V141 HydrophobicContact CG-CG2 4.37Å; N133-V141 PolarHBondContact ND2-O 3.14Å; N133-V141 WeakPolarHBondContact OD1-CB 3.34Å; N133-V141 WeakPolarHBondContact OD1-CG2 3.38Å; N133-V141 PolarHBondContact OD1-N 2.65Å
142	V	98.9	Very high	97.8	Very high	43 Å²	43	58.8 Å²	58.8	26%	0.261	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	113.6	176.2	-176.4	0	0	0	0	109.4	I96 H97 V98 H144	I96-V142 PolarHBondContact O-N 2.93Å; H97-V142 WeakPolarHBondContact CA-O 3.45Å; V98-V142 PolarHBondContact N-O 3.47Å; V142-H144 PolarHBondContact O-CD2 3.34Å
143	P	98.8	Very high	97.7	Very high	54 Å²	54	61.7 Å²	61.7	35%	0.351	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	146.7	-179.2	33.3	-34.6	0	0	0	112.6	V98 A125 A129	V98-P143 HydrophobicContact CG1-CB 4.32Å; V98-P143 CarbonylContact O-C 3.53Å; A125-P143 HydrophobicContact CB-CB 4.16Å; A125-P143 WeakPolarHBondContact O-CB 3.41Å; A129-P143 HydrophobicContact CB-CB 3.81Å; A129-P143 HydrophobicContact CB-CG 3.89Å
144	H	98.8	Very high	97.6	Very high	32 Å²	32	63.9 Å²	63.9	15%	0.148	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	103.6	173.2	-62.4	-85.8	0	0	0	108.5	H97 V98 I99 D100 V142 N146 F151 F155	H97-H144 AromaticContact CE1-NE2 3.83Å; H97-H144 AromaticContact CG-NE2 3.74Å; H97-H144 AromaticContact ND1-CD2 3.91Å; H97-H144 AromaticContact ND1-CE1 3.83Å; H97-H144 AromaticContact ND1-NE2 2.98Å; H97-H144 PolarHBondContact ND1-NE2 3.37Å; V98-H144 WeakPolarHBondContact O-CB 3.49Å; V98-H144 PolarHBondContact O-N 3.14Å; I99-H144 WeakPolarHBondContact CA-O 3.49Å; I99-H144 HydrophobicContact CB-CB 4.38Å; I99-H144 HydrophobicContact CG1-CB 3.73Å; D100-H144 PolarHBondContact N-O 3.13Å; D100-H144 VanDerWaalsContact N-O 3.14Å; V142-H144 PolarHBondContact O-CD2 3.34Å; H144-N146 PolarHBondContact O-N 3.31Å; H144-F151 HydrophobicContact CB-CE2 4.42Å; H144-F151 HydrophobicContact CB-CZ 4.07Å; H144-F151 AromaticContact ND1-CZ 3.78Å; H144-F155 AromaticContact CE1-CE2 3.99Å
145	F	98.6	Very high	97.6	Very high	103 Å²	103	59.1 Å²	59.1	45%	0.452	30%	0.301	S	S	.	.			trans	-82.1	73.1	174.2	-179.4	-134	0	0	0	110	D100 M101 T103 P123	D100-F145 WeakPolarHBondContact O-CA 3.24Å; D100-F145 WeakPolarHBondContact O-CD2 3.23Å; M101-F145 VanDerWaalsContact O-CE2 3.24Å; M101-F145 WeakPolarHBondContact O-CE2 3.47Å; T103-F145 HydrophobicContact CG2-CE2 4.48Å; T103-F145 HydrophobicContact CG2-CZ 4.21Å; P123-F145 HydrophobicContact CB-CB 4.15Å; P123-F145 HydrophobicContact CB-CD1 4.13Å; P123-F145 HydrophobicContact CB-CD2 3.63Å; P123-F145 HydrophobicContact CB-CE1 4.45Å; P123-F145 HydrophobicContact CB-CE2 3.97Å; P123-F145 HydrophobicContact CB-CG 3.7Å; P123-F145 HydrophobicContact CB-CZ 4.38Å; P123-F145 HydrophobicContact CG-CD1 3.87Å; P123-F145 HydrophobicContact CG-CD2 4.22Å; P123-F145 HydrophobicContact CG-CE1 4Å; P123-F145 HydrophobicContact CG-CE2 4.32Å; P123-F145 HydrophobicContact CG-CG 3.98Å; P123-F145 HydrophobicContact CG-CZ 4.23Å
146	N	98.5	Very high	97.7	Very high	58 Å²	58	51.6 Å²	51.6	31%	0.31	27%	0.273	S	S	.	.	S	Bend	trans	-146.9	160	-171.2	-75.2	100.3	0	0	0	110.1	I99 D100 M101 H144 D150 F151	I99-N146 WeakPolarHBondContact CG2-O 3.44Å; D100-N146 CarbonylContact C-O 3.5Å; D100-N146 PolarHBondContact O-N 3.03Å; M101-N146 PolarHBondContact N-O 3.36Å; H144-N146 PolarHBondContact O-N 3.31Å; N146-D150 HydrophobicContact CB-CB 4.41Å; N146-D150 PolarHBondContact ND2-OD2 3.43Å; N146-D150 VanDerWaalsContact ND2-OD2 3.14Å; N146-F151 HydrophobicContact CB-CE2 3.51Å; N146-F151 HydrophobicContact CB-CZ 3.85Å
147	K	97.4	Very high	97.7	Very high	98 Å²	98	56 Å²	56	43%	0.426	29%	0.288	S	S	.	.			trans	-84.2	151.7	163.2	61.6	177.2	175.9	-176.8	0	109.1	M101 Q149 D150	M101-K147 HydrophobicContact CB-CB 4.14Å; M101-K147 HydrophobicContact SD-CB 3.73Å; K147-Q149 HydrophobicContact CD-CB 4.28Å; K147-Q149 HydrophobicContact CG-CB 4.4Å; K147-Q149 PolarHBondContact O-N 3.3Å; K147-Q149 VanDerWaalsContact O-N 3.09Å; K147-D150 WeakPolarHBondContact CE-OD1 3.45Å; K147-D150 HydrophobicContact CG-CB 4.41Å; K147-D150 VanDerWaalsContact CG-OD1 3.27Å; K147-D150 WeakPolarHBondContact CG-OD1 3.28Å; K147-D150 WeakPolarHBondContact CG-OD2 3.26Å; K147-D150 PolarHBondContact N-OD2 2.88Å; K147-D150 IonicContact NZ-OD1 3.84Å; K147-D150 WeakPolarHBondContact O-CB 3.48Å; K147-D150 PolarHBondContact O-N 3.36Å
148	I	98.1	Very high	97.8	Very high	8 Å²	8	56.8 Å²	56.8	4%	0.041	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-57	-30.2	179.6	59.7	179	0	0	0	112.7	I75 I99 D150 F151 Y156 A171 W174 I175	I75-I148 HydrophobicContact CD1-CG2 4.18Å; I75-I148 HydrophobicContact CG2-CG2 3.35Å; I99-I148 HydrophobicContact CG2-CG2 4.08Å; I148-D150 PolarHBondContact O-N 2.99Å; I148-F151 PolarHBondContact O-N 2.69Å; I148-Y156 VanDerWaalsContact C-OH 3.29Å; I148-Y156 VanDerWaalsContact CA-OH 3.29Å; I148-Y156 WeakPolarHBondContact CA-OH 3.46Å; I148-Y156 WeakPolarHBondContact CB-OH 3.39Å; I148-Y156 PolarHBondContact O-OH 3.49Å; I148-A171 HydrophobicContact CD1-CB 3.87Å; I148-A171 WeakPolarHBondContact CD1-O 3.32Å; I148-W174 HydrophobicContact CB-CE3 4.26Å; I148-W174 HydrophobicContact CB-CZ3 4.19Å; I148-W174 HydrophobicContact CD1-CB 4.42Å; I148-W174 HydrophobicContact CD1-CD2 4.46Å; I148-W174 HydrophobicContact CD1-CE3 3.81Å; I148-W174 HydrophobicContact CG1-CD2 4.47Å; I148-W174 HydrophobicContact CG1-CE3 3.85Å; I148-W174 HydrophobicContact CG1-CZ3 4.26Å; I148-W174 VanDerWaalsContact O-CH2 3.27Å; I148-W174 WeakPolarHBondContact O-CH2 3.47Å; I148-W174 WeakPolarHBondContact O-CZ3 3.4Å; I148-I175 HydrophobicContact CD1-CB 4.38Å
149	Q	96.7	Very high	97.9	Very high	70 Å²	70	53.8 Å²	53.8	33%	0.327	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-71.7	-10.5	-179.4	-58.7	82.9	-0.2	0	0	113.8	K147 F151 W174	K147-Q149 HydrophobicContact CD-CB 4.28Å; K147-Q149 HydrophobicContact CG-CB 4.4Å; K147-Q149 PolarHBondContact O-N 3.3Å; K147-Q149 VanDerWaalsContact O-N 3.09Å; Q149-F151 VanDerWaalsContact C-N 3.25Å; Q149-W174 HydrophobicContact CB-CZ2 4.2Å; Q149-W174 HydrophobicContact CG-CD2 3.86Å; Q149-W174 HydrophobicContact CG-CG 4Å; Q149-W174 HydrophobicContact CG-CZ2 4.2Å
150	D	97.4	Very high	98	Very high	83 Å²	83	57.7 Å²	57.7	44%	0.444	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-76.2	-16.7	176.1	-65	-24.1	0	0	0	112.5	N146 K147 I148	N146-D150 HydrophobicContact CB-CB 4.41Å; N146-D150 PolarHBondContact ND2-OD2 3.43Å; N146-D150 VanDerWaalsContact ND2-OD2 3.14Å; K147-D150 WeakPolarHBondContact CE-OD1 3.45Å; K147-D150 HydrophobicContact CG-CB 4.41Å; K147-D150 VanDerWaalsContact CG-OD1 3.27Å; K147-D150 WeakPolarHBondContact CG-OD1 3.28Å; K147-D150 WeakPolarHBondContact CG-OD2 3.26Å; K147-D150 PolarHBondContact N-OD2 2.88Å; K147-D150 IonicContact NZ-OD1 3.84Å; K147-D150 WeakPolarHBondContact O-CB 3.48Å; K147-D150 PolarHBondContact O-N 3.36Å; I148-D150 PolarHBondContact O-N 2.99Å
151	F	98	Very high	98	Very high	38 Å²	38	54.5 Å²	54.5	17%	0.167	27%	0.271	C	S	.	.			trans	-104	153.7	-178.2	-60.4	-77.9	0	0	0	111.5	I99 H144 N146 I148 Q149 F155 Y156 W174	I99-F151 HydrophobicContact CD1-CD2 3.99Å; I99-F151 HydrophobicContact CD1-CE2 3.88Å; I99-F151 HydrophobicContact CG1-CE2 4.12Å; I99-F151 HydrophobicContact CG2-CE2 4.39Å; H144-F151 HydrophobicContact CB-CE2 4.42Å; H144-F151 HydrophobicContact CB-CZ 4.07Å; H144-F151 AromaticContact ND1-CZ 3.78Å; N146-F151 HydrophobicContact CB-CE2 3.51Å; N146-F151 HydrophobicContact CB-CZ 3.85Å; I148-F151 PolarHBondContact O-N 2.69Å; Q149-F151 VanDerWaalsContact C-N 3.25Å; F151-F155 HydrophobicContact CB-CB 3.96Å; F151-F155 HydrophobicContact CB-CD1 3.61Å; F151-F155 HydrophobicContact CB-CE1 4.3Å; F151-F155 HydrophobicContact CB-CG 3.86Å; F151-F155 HydrophobicContact CD1-CB 4Å; F151-F155 AromaticContact CD1-CD1 3.78Å; F151-F155 HydrophobicContact CD1-CD1 3.78Å; F151-F155 AromaticContact CD1-CD2 3.49Å; F151-F155 HydrophobicContact CD1-CD2 3.49Å; F151-F155 VanDerWaalsContact CD1-CD2 3.49Å; F151-F155 HydrophobicContact CD1-CE1 4.1Å; F151-F155 AromaticContact CD1-CE2 3.82Å; F151-F155 HydrophobicContact CD1-CE2 3.82Å; F151-F155 AromaticContact CD1-CG 3.46Å; F151-F155 HydrophobicContact CD1-CG 3.46Å; F151-F155 VanDerWaalsContact CD1-CG 3.46Å; F151-F155 HydrophobicContact CD1-CZ 4.11Å; F151-F155 HydrophobicContact CD2-CD1 4.34Å; F151-F155 HydrophobicContact CD2-CE1 4.21Å; F151-F155 AromaticContact CE1-CD2 3.79Å; F151-F155 HydrophobicContact CE1-CD2 3.79Å; F151-F155 HydrophobicContact CE1-CE1 4.49Å; F151-F155 AromaticContact CE1-CE2 3.71Å; F151-F155 HydrophobicContact CE1-CE2 3.71Å; F151-F155 HydrophobicContact CE1-CG 4.22Å; F151-F155 HydrophobicContact CE1-CZ 4.08Å; F151-F155 HydrophobicContact CE2-CZ 4.5Å; F151-F155 HydrophobicContact CG-CB 4.35Å; F151-F155 AromaticContact CG-CD1 3.65Å; F151-F155 HydrophobicContact CG-CD1 3.65Å; F151-F155 HydrophobicContact CG-CD2 4.24Å; F151-F155 AromaticContact CG-CE1 3.94Å; F151-F155 HydrophobicContact CG-CE1 3.94Å; F151-F155 HydrophobicContact CG-CE2 4.48Å; F151-F155 AromaticContact CG-CG 3.82Å; F151-F155 HydrophobicContact CG-CG 3.82Å; F151-F155 HydrophobicContact CG-CZ 4.34Å; F151-F155 HydrophobicContact CZ-CE2 4.29Å; F151-F155 HydrophobicContact CZ-CZ 4.28Å; F151-Y156 HydrophobicContact CB-CD2 4.36Å; F151-Y156 HydrophobicContact CB-CE2 3.56Å; F151-W174 WeakPolarHBondContact O-CH2 3.42Å
152	N	95.3	Very high	98	Very high	89 Å²	89	54.4 Å²	54.4	48%	0.476	27%	0.27	S	S	.	.			trans	-113.3	-177.4	177	65.1	18.7	0	0	0	111.6	T154 F155 Y156	N152-T154 PolarHBondContact O-N 3.45Å; N152-T154 WeakPolarHBondContact OD1-CB 3.39Å; N152-T154 PolarHBondContact OD1-N 3.31Å; N152-T154 VanDerWaalsContact OD1-N 3.16Å; N152-F155 WeakPolarHBondContact O-CB 3.41Å; N152-F155 PolarHBondContact O-N 3.15Å; N152-Y156 WeakPolarHBondContact O-CD2 3.4Å; N152-Y156 PolarHBondContact O-N 2.74Å
153	D	95.4	Very high	98	Very high	66 Å²	66	52.3 Å²	52.3	35%	0.353	26%	0.257	S	S	.	.	H	α-helix	trans	-51.1	-39	178.9	64.8	-49.3	0	0	0	113.7	F155 Y156 R157 M178 L182	D153-F155 VanDerWaalsContact C-N 3.27Å; D153-F155 PolarHBondContact O-N 2.77Å; D153-Y156 PolarHBondContact O-N 3.07Å; D153-R157 VanDerWaalsContact O-CB 3.26Å; D153-R157 WeakPolarHBondContact O-CB 3.39Å; D153-R157 PolarHBondContact O-N 3.08Å; D153-M178 HydrophobicContact CB-SD 4.09Å; D153-L182 HydrophobicContact CB-CD2 3.62Å
154	T	97.4	Very high	98	Very high	101 Å²	101	49.8 Å²	49.8	62%	0.62	24%	0.241	S	C	*	.	H	α-helix	trans	-59.2	-40.8	178.8	-60.3	0	0	0	0	111.5	N152	N152-T154 PolarHBondContact O-N 3.45Å; N152-T154 WeakPolarHBondContact OD1-CB 3.39Å; N152-T154 PolarHBondContact OD1-N 3.31Å; N152-T154 VanDerWaalsContact OD1-N 3.16Å
155	F	98.7	Very high	97.9	Very high	26 Å²	26	48.8 Å²	48.8	11%	0.114	24%	0.239	C	C	.	.	H	α-helix	trans	-70	-45.5	177.2	172.9	-90.8	0	0	0	111.7	L73 I99 H144 F151 N152 D153 R157 Q158 F159	L73-F155 HydrophobicContact CD2-CE1 4.09Å; I99-F155 HydrophobicContact CD1-CE1 3.68Å; I99-F155 HydrophobicContact CD1-CZ 3.95Å; H144-F155 AromaticContact CE1-CE2 3.99Å; F151-F155 HydrophobicContact CB-CB 3.96Å; F151-F155 HydrophobicContact CB-CD1 3.61Å; F151-F155 HydrophobicContact CB-CE1 4.3Å; F151-F155 HydrophobicContact CB-CG 3.86Å; F151-F155 HydrophobicContact CD1-CB 4Å; F151-F155 AromaticContact CD1-CD1 3.78Å; F151-F155 HydrophobicContact CD1-CD1 3.78Å; F151-F155 AromaticContact CD1-CD2 3.49Å; F151-F155 HydrophobicContact CD1-CD2 3.49Å; F151-F155 VanDerWaalsContact CD1-CD2 3.49Å; F151-F155 HydrophobicContact CD1-CE1 4.1Å; F151-F155 AromaticContact CD1-CE2 3.82Å; F151-F155 HydrophobicContact CD1-CE2 3.82Å; F151-F155 AromaticContact CD1-CG 3.46Å; F151-F155 HydrophobicContact CD1-CG 3.46Å; F151-F155 VanDerWaalsContact CD1-CG 3.46Å; F151-F155 HydrophobicContact CD1-CZ 4.11Å; F151-F155 HydrophobicContact CD2-CD1 4.34Å; F151-F155 HydrophobicContact CD2-CE1 4.21Å; F151-F155 AromaticContact CE1-CD2 3.79Å; F151-F155 HydrophobicContact CE1-CD2 3.79Å; F151-F155 HydrophobicContact CE1-CE1 4.49Å; F151-F155 AromaticContact CE1-CE2 3.71Å; F151-F155 HydrophobicContact CE1-CE2 3.71Å; F151-F155 HydrophobicContact CE1-CG 4.22Å; F151-F155 HydrophobicContact CE1-CZ 4.08Å; F151-F155 HydrophobicContact CE2-CZ 4.5Å; F151-F155 HydrophobicContact CG-CB 4.35Å; F151-F155 AromaticContact CG-CD1 3.65Å; F151-F155 HydrophobicContact CG-CD1 3.65Å; F151-F155 HydrophobicContact CG-CD2 4.24Å; F151-F155 AromaticContact CG-CE1 3.94Å; F151-F155 HydrophobicContact CG-CE1 3.94Å; F151-F155 HydrophobicContact CG-CE2 4.48Å; F151-F155 AromaticContact CG-CG 3.82Å; F151-F155 HydrophobicContact CG-CG 3.82Å; F151-F155 HydrophobicContact CG-CZ 4.34Å; F151-F155 HydrophobicContact CZ-CE2 4.29Å; F151-F155 HydrophobicContact CZ-CZ 4.28Å; N152-F155 WeakPolarHBondContact O-CB 3.41Å; N152-F155 PolarHBondContact O-N 3.15Å; D153-F155 VanDerWaalsContact C-N 3.27Å; D153-F155 PolarHBondContact O-N 2.77Å; F155-R157 PolarHBondContact O-N 3.34Å; F155-Q158 VanDerWaalsContact CD2-NE2 3.25Å; F155-Q158 WeakPolarHBondContact O-CG 3.24Å; F155-Q158 PolarHBondContact O-N 3.12Å; F155-Q158 PolarHBondContact O-NE2 3.24Å; F155-F159 HydrophobicContact CD1-CE2 4.01Å; F155-F159 AromaticContact CE1-CE2 3.54Å; F155-F159 HydrophobicContact CE1-CE2 3.54Å; F155-F159 HydrophobicContact CE1-CZ 4.06Å; F155-F159 HydrophobicContact CE2-CE2 4.33Å; F155-F159 HydrophobicContact CE2-CZ 4.26Å; F155-F159 AromaticContact CZ-CE2 3.73Å; F155-F159 HydrophobicContact CZ-CE2 3.73Å; F155-F159 AromaticContact CZ-CZ 3.76Å; F155-F159 HydrophobicContact CZ-CZ 3.76Å; F155-F159 WeakPolarHBondContact O-CE2 3.3Å
156	Y	98.5	Very high	97.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-72.8	-29.2	-175.2	-68.8	-72.6	0	0	0	113.3	L73 I75 I99 I148 F151 N152 D153 Q158 F159 I162 W174 I175 M178	L73-Y156 HydrophobicContact CD2-CD1 3.82Å; L73-Y156 HydrophobicContact CD2-CE1 3.74Å; I75-Y156 HydrophobicContact CD1-CE1 4.45Å; I99-Y156 HydrophobicContact CD1-CE1 4.43Å; I148-Y156 VanDerWaalsContact C-OH 3.29Å; I148-Y156 VanDerWaalsContact CA-OH 3.29Å; I148-Y156 WeakPolarHBondContact CA-OH 3.46Å; I148-Y156 WeakPolarHBondContact CB-OH 3.39Å; I148-Y156 PolarHBondContact O-OH 3.49Å; F151-Y156 HydrophobicContact CB-CD2 4.36Å; F151-Y156 HydrophobicContact CB-CE2 3.56Å; N152-Y156 WeakPolarHBondContact O-CD2 3.4Å; N152-Y156 PolarHBondContact O-N 2.74Å; D153-Y156 PolarHBondContact O-N 3.07Å; Y156-Q158 PolarHBondContact O-N 2.81Å; Y156-Q158 VanDerWaalsContact O-N 3.16Å; Y156-F159 PolarHBondContact O-N 2.87Å; Y156-I162 HydrophobicContact CD1-CD1 4.12Å; Y156-W174 AromaticContact CE2-CH2 3.9Å; Y156-W174 HydrophobicContact CE2-CH2 3.9Å; Y156-W174 AromaticContact CE2-CZ3 3.81Å; Y156-W174 HydrophobicContact CE2-CZ3 3.81Å; Y156-W174 AromaticContact CZ-CZ3 3.95Å; Y156-I175 HydrophobicContact CD1-CD1 3.85Å; Y156-I175 HydrophobicContact CE1-CD1 3.57Å; Y156-M178 HydrophobicContact CD2-CE 3.9Å; Y156-M178 HydrophobicContact CD2-CG 3.35Å; Y156-M178 HydrophobicContact CD2-SD 3.71Å; Y156-M178 HydrophobicContact CE2-CE 4.08Å; Y156-M178 HydrophobicContact CE2-CG 3.91Å; Y156-M178 HydrophobicContact CE2-SD 4.42Å; Y156-M178 HydrophobicContact CG-CG 3.73Å; Y156-M178 HydrophobicContact CG-SD 4.42Å
157	R	97.8	Very high	97.5	Very high	103 Å²	103	48 Å²	48	39%	0.389	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-18.5	178.4	-168.8	177.4	-63.8	-80.3	5.6	113.7	D153 F155 F159 L182	D153-R157 VanDerWaalsContact O-CB 3.26Å; D153-R157 WeakPolarHBondContact O-CB 3.39Å; D153-R157 PolarHBondContact O-N 3.08Å; F155-R157 PolarHBondContact O-N 3.34Å; R157-F159 VanDerWaalsContact C-N 3.28Å; R157-F159 PolarHBondContact O-N 3.4Å; R157-L182 HydrophobicContact CB-CD1 4.47Å; R157-L182 HydrophobicContact CB-CD2 4.38Å; R157-L182 PolarHBondContact NH1-O 3.41Å; R157-L182 PolarHBondContact NH2-O 3.27Å
158	Q	98.4	Very high	97.3	Very high	66 Å²	66	45.5 Å²	45.5	31%	0.308	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-14.5	-178.2	84.6	-171.3	-69.1	0	0	114.1	K71 F155 Y156	K71-Q158 WeakPolarHBondContact CD-O 3.48Å; F155-Q158 VanDerWaalsContact CD2-NE2 3.25Å; F155-Q158 WeakPolarHBondContact O-CG 3.24Å; F155-Q158 PolarHBondContact O-N 3.12Å; F155-Q158 PolarHBondContact O-NE2 3.24Å; Y156-Q158 PolarHBondContact O-N 2.81Å; Y156-Q158 VanDerWaalsContact O-N 3.16Å
159	F	98.8	Very high	97.1	Very high	5 Å²	5	47.1 Å²	47.1	2%	0.022	24%	0.243	C	C	.	.			trans	-95.4	143.6	-175.5	-58.5	-73.6	0	0	0	111	K71 L73 H97 F155 Y156 R157 I162	K71-F159 HydrophobicContact CB-CD1 4.08Å; L73-F159 HydrophobicContact CB-CB 4.39Å; L73-F159 HydrophobicContact CB-CD1 3.62Å; L73-F159 HydrophobicContact CB-CD2 3.79Å; L73-F159 HydrophobicContact CB-CE1 3.77Å; L73-F159 HydrophobicContact CB-CE2 3.92Å; L73-F159 HydrophobicContact CB-CG 3.64Å; L73-F159 HydrophobicContact CB-CZ 3.92Å; L73-F159 HydrophobicContact CD1-CZ 4.27Å; L73-F159 HydrophobicContact CD2-CD2 3.93Å; L73-F159 HydrophobicContact CD2-CE2 3.78Å; L73-F159 HydrophobicContact CD2-CZ 4.34Å; L73-F159 HydrophobicContact CG-CD2 4.45Å; L73-F159 HydrophobicContact CG-CE2 4.28Å; L73-F159 HydrophobicContact CG-CZ 4.4Å; H97-F159 HydrophobicContact CB-CE1 3.66Å; H97-F159 HydrophobicContact CB-CZ 3.86Å; H97-F159 AromaticContact CD2-CE1 3.84Å; H97-F159 AromaticContact CG-CE1 3.52Å; H97-F159 AromaticContact CG-CZ 3.76Å; H97-F159 AromaticContact ND1-CE1 3.83Å; H97-F159 AromaticContact ND1-CZ 3.67Å; F155-F159 HydrophobicContact CD1-CE2 4.01Å; F155-F159 AromaticContact CE1-CE2 3.54Å; F155-F159 HydrophobicContact CE1-CE2 3.54Å; F155-F159 HydrophobicContact CE1-CZ 4.06Å; F155-F159 HydrophobicContact CE2-CE2 4.33Å; F155-F159 HydrophobicContact CE2-CZ 4.26Å; F155-F159 AromaticContact CZ-CE2 3.73Å; F155-F159 HydrophobicContact CZ-CE2 3.73Å; F155-F159 AromaticContact CZ-CZ 3.76Å; F155-F159 HydrophobicContact CZ-CZ 3.76Å; F155-F159 WeakPolarHBondContact O-CE2 3.3Å; Y156-F159 PolarHBondContact O-N 2.87Å; R157-F159 VanDerWaalsContact C-N 3.28Å; R157-F159 PolarHBondContact O-N 3.4Å; F159-I162 HydrophobicContact CB-CG1 4.14Å
160	H	98.7	Very high	96.9	Very high	96 Å²	96	47 Å²	47	44%	0.444	24%	0.244	S	C	.	.	S	Bend	trans	-81.6	-34.8	174.1	-57.7	95.4	0	0	0	111.2	T69 K71 P197	T69-H160 PolarHBondContact O-CE1 2.81Å; K71-H160 PolarHBondContact N-ND1 3.08Å; K71-H160 PolarHBondContact O-N 3Å; H160-P197 WeakPolarHBondContact O-CD 3.3Å
161	I	98.8	Very high	96.9	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.015	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	141.2	-178.3	-55.4	173.3	0	0	0	108.7	V72 L73 P197 I199 V328 I331 A332	V72-I161 WeakPolarHBondContact CA-O 3.45Å; V72-I161 HydrophobicContact CG2-CB 4.45Å; L73-I161 PolarHBondContact N-O 3.11Å; L73-I161 VanDerWaalsContact N-O 3.09Å; I161-P197 HydrophobicContact CG2-CB 4.49Å; I161-I199 HydrophobicContact CG2-CD1 3.34Å; I161-V328 HydrophobicContact CD1-CG1 4.06Å; I161-V328 WeakPolarHBondContact CD1-O 3.45Å; I161-V328 HydrophobicContact CG2-CG1 4.08Å; I161-V328 HydrophobicContact CG2-CG2 4.08Å; I161-I331 HydrophobicContact CD1-CB 3.97Å; I161-I331 HydrophobicContact CD1-CG2 3.65Å; I161-I331 HydrophobicContact CG1-CG2 4.03Å; I161-A332 HydrophobicContact CD1-CB 3.71Å
162	I	98.9	Very high	96.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	134.8	175	-62.5	176.1	0	0	0	108.9	L73 I75 Y156 F159 L179 V196 P197 L198 I199	L73-I162 HydrophobicContact CB-CG1 4.15Å; L73-I162 HydrophobicContact CD2-CD1 4.28Å; L73-I162 HydrophobicContact CD2-CG1 4.32Å; L73-I162 HydrophobicContact CD2-CG2 4.36Å; L73-I162 HydrophobicContact CG-CG2 4.5Å; L73-I162 CarbonylContact O-C 3.59Å; L73-I162 WeakPolarHBondContact O-CA 3.39Å; I75-I162 HydrophobicContact CD1-CG2 3.72Å; I75-I162 HydrophobicContact CG1-CG2 4.09Å; Y156-I162 HydrophobicContact CD1-CD1 4.12Å; F159-I162 HydrophobicContact CB-CG1 4.14Å; I162-L179 HydrophobicContact CB-CD1 4.4Å; I162-L179 HydrophobicContact CD1-CD1 4Å; I162-L179 HydrophobicContact CD1-CD2 3.41Å; I162-L179 VanDerWaalsContact CD1-CD2 3.41Å; I162-L179 HydrophobicContact CD1-CG 4.29Å; I162-V196 HydrophobicContact CD1-CG1 3.82Å; I162-V196 HydrophobicContact CG1-CG1 3.86Å; I162-P197 PolarHBondContact N-O 3.35Å; I162-L198 HydrophobicContact CB-CD1 4.39Å; I162-L198 HydrophobicContact CG2-CD1 4.03Å; I162-L198 CarbonylContact O-C 3.53Å; I162-L198 WeakPolarHBondContact O-CA 3.4Å; I162-I199 PolarHBondContact O-N 3.5Å
163	V	98.8	Very high	97	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	130.5	175.7	65	0	0	0	0	111.3	V72 L73 V74 I75 L84 L88 I199 C324 V328	V72-V163 HydrophobicContact CG1-CG1 4.38Å; L73-V163 PolarHBondContact O-N 3.16Å; V74-V163 CarbonylContact C-O 3.03Å; V74-V163 WeakPolarHBondContact CA-O 3.36Å; V74-V163 HydrophobicContact CB-CG1 4.19Å; V74-V163 HydrophobicContact CG1-CG1 4.32Å; V74-V163 HydrophobicContact CG2-CG1 3.72Å; I75-V163 PolarHBondContact N-O 3.37Å; L84-V163 HydrophobicContact CD1-CG1 4.25Å; L84-V163 HydrophobicContact CD1-CG2 3.74Å; L84-V163 HydrophobicContact CD2-CG1 4.48Å; L84-V163 HydrophobicContact CD2-CG2 3.64Å; L84-V163 HydrophobicContact CG-CG2 4.33Å; L88-V163 HydrophobicContact CD1-CG1 4.16Å; V163-I199 CarbonylContact C-O 3.59Å; V163-I199 VanDerWaalsContact CA-O 3.23Å; V163-I199 WeakPolarHBondContact CA-O 3.35Å; V163-I199 HydrophobicContact CB-CB 4.31Å; V163-I199 HydrophobicContact CG2-CB 3.97Å; V163-I199 HydrophobicContact CG2-CG2 4.02Å; V163-C324 HydrophobicContact CG2-CB 4.13Å; V163-V328 HydrophobicContact CB-CG2 4.09Å; V163-V328 HydrophobicContact CG2-CG2 4.32Å
164	C	98.6	Very high	97.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.8	-175.8	-67.3	0	0	0	0	111.7	L166 L198 I199 D200 G201	C164-L166 HydrophobicContact CB-CD1 4.13Å; C164-L166 HydrophobicContact CB-CG 4.27Å; C164-L198 HydrophobicContact CB-CD1 4.47Å; C164-L198 VanDerWaalsContact SG-CD1 3.53Å; C164-I199 PolarHBondContact N-O 3Å; C164-D200 HydrophobicContact CB-CB 4.4Å; C164-G201 PolarHBondContact O-N 2.84Å
165	G	97.2	Very high	97.2	Very high	11 Å²	11	32.1 Å²	32.1	11%	0.113	16%	0.159	C	C	.	.			trans	-118.9	46.2	165.6	0	0	0	0	0	110.7	I75	I75-G165 PolarHBondContact O-N 2.9Å
166	L	95.6	Very high	97.2	Very high	22 Å²	22	30.9 Å²	30.9	12%	0.115	15%	0.154	C	C	.	.			trans	-75.7	163	-175.8	-73.2	167.9	0	0	0	111.9	I75 C164 A171 R172 I175	I75-L166 HydrophobicContact CG2-CD1 4.13Å; I75-L166 HydrophobicContact CG2-CD2 3.58Å; I75-L166 HydrophobicContact CG2-CG 3.9Å; C164-L166 HydrophobicContact CB-CD1 4.13Å; C164-L166 HydrophobicContact CB-CG 4.27Å; L166-A171 HydrophobicContact CD1-CB 3.82Å; L166-A171 HydrophobicContact CD2-CB 3.85Å; L166-A171 HydrophobicContact CG-CB 4.3Å; L166-R172 HydrophobicContact CB-CG 4.1Å; L166-R172 HydrophobicContact CD1-CG 4.03Å; L166-R172 PolarHBondContact O-NH1 3.08Å; L166-R172 VanDerWaalsContact O-NH1 3.14Å; L166-R172 PolarHBondContact O-NH2 3.35Å; L166-I175 HydrophobicContact CD1-CG2 4.22Å
167	D	92.7	Very high	97.1	Very high	124 Å²	124	30.9 Å²	30.9	66%	0.663	15%	0.154	S	C	*	.	S	Bend	trans	-119.1	-1.3	-178	66.9	-16.5	0	0	0	113.4
168	S	92.9	Very high	97.1	Very high	45 Å²	45	26.4 Å²	26.4	32%	0.315	14%	0.138	S	C	.	.			trans	-126.5	146.1	176.9	73.8	0	0	0	0	112.7	I170 A171 R172	S168-I170 VanDerWaalsContact C-N 3.33Å; S168-A171 VanDerWaalsContact OG-CB 3.22Å; S168-A171 WeakPolarHBondContact OG-CB 3.48Å; S168-A171 PolarHBondContact OG-N 3.18Å; S168-R172 PolarHBondContact O-N 3.4Å; S168-R172 PolarHBondContact O-NH1 3.35Å
169	I	93.6	Very high	97.1	Very high	42 Å²	42	23.3 Å²	23.3	22%	0.215	12%	0.123	C	C	.	.	H	α-helix	trans	-65.2	-40.9	175	-62	172.3	0	0	0	109.7	A171 R172 R173 L225 Y228	I169-A171 VanDerWaalsContact C-N 3.34Å; I169-A171 PolarHBondContact O-N 2.98Å; I169-R172 WeakPolarHBondContact O-CB 3.27Å; I169-R172 PolarHBondContact O-N 3.48Å; I169-R172 VanDerWaalsContact O-N 3.16Å; I169-R173 HydrophobicContact CG2-CG 4.03Å; I169-R173 VanDerWaalsContact O-CG 3.26Å; I169-R173 WeakPolarHBondContact O-CG 3.28Å; I169-R173 PolarHBondContact O-N 3.25Å; I169-L225 HydrophobicContact CG2-CD1 3.89Å; I169-Y228 HydrophobicContact CD1-CD1 3.66Å; I169-Y228 HydrophobicContact CD1-CD2 4.14Å; I169-Y228 HydrophobicContact CD1-CE1 4.34Å; I169-Y228 HydrophobicContact CD1-CG 3.56Å; I169-Y228 HydrophobicContact CG1-CD1 3.71Å; I169-Y228 HydrophobicContact CG1-CD2 4.3Å; I169-Y228 HydrophobicContact CG1-CE1 3.87Å; I169-Y228 HydrophobicContact CG1-CE2 4.43Å; I169-Y228 HydrophobicContact CG1-CG 3.95Å; I169-Y228 HydrophobicContact CG2-CD2 4.22Å; I169-Y228 HydrophobicContact CG2-CE2 4.17Å
170	I	94	Very high	97.1	Very high	68 Å²	68	23.4 Å²	23.4	35%	0.349	12%	0.124	S	C	.	.	H	α-helix	trans	-59.1	-44.9	-178.9	-61.1	174.8	0	0	0	111.1	S168 R172 R173 W174	S168-I170 VanDerWaalsContact C-N 3.33Å; I170-R172 PolarHBondContact O-N 3.45Å; I170-R173 PolarHBondContact O-N 2.99Å; I170-W174 WeakPolarHBondContact O-CB 3.38Å; I170-W174 PolarHBondContact O-N 3.03Å
171	A	96.4	Very high	96.9	Very high	10 Å²	10	21.3 Å²	21.3	8%	0.083	12%	0.12	C	C	.	.	H	α-helix	trans	-63.9	-40.6	178.2	0	0	0	0	0	112.1	I148 L166 S168 I169 W174 I175	I148-A171 HydrophobicContact CD1-CB 3.87Å; I148-A171 WeakPolarHBondContact CD1-O 3.32Å; L166-A171 HydrophobicContact CD1-CB 3.82Å; L166-A171 HydrophobicContact CD2-CB 3.85Å; L166-A171 HydrophobicContact CG-CB 4.3Å; S168-A171 VanDerWaalsContact OG-CB 3.22Å; S168-A171 WeakPolarHBondContact OG-CB 3.48Å; S168-A171 PolarHBondContact OG-N 3.18Å; I169-A171 VanDerWaalsContact C-N 3.34Å; I169-A171 PolarHBondContact O-N 2.98Å; A171-W174 PolarHBondContact O-N 2.91Å; A171-I175 WeakPolarHBondContact O-CG2 3.35Å; A171-I175 PolarHBondContact O-N 3.31Å
172	R	98.2	Very high	96.8	Very high	16 Å²	16	21.1 Å²	21.1	6%	0.06	12%	0.119	C	C	.	.	H	α-helix	trans	-62.3	-44.5	175.4	-72.2	-178.6	173.9	84.1	-2.6	112.5	L166 S168 I169 I170 W174 I175 N176 D200 G201 I221 Y228	L166-R172 HydrophobicContact CB-CG 4.1Å; L166-R172 HydrophobicContact CD1-CG 4.03Å; L166-R172 PolarHBondContact O-NH1 3.08Å; L166-R172 VanDerWaalsContact O-NH1 3.14Å; L166-R172 PolarHBondContact O-NH2 3.35Å; S168-R172 PolarHBondContact O-N 3.4Å; S168-R172 PolarHBondContact O-NH1 3.35Å; I169-R172 WeakPolarHBondContact O-CB 3.27Å; I169-R172 PolarHBondContact O-N 3.48Å; I169-R172 VanDerWaalsContact O-N 3.16Å; I170-R172 PolarHBondContact O-N 3.45Å; R172-W174 VanDerWaalsContact C-N 3.32Å; R172-I175 VanDerWaalsContact O-CG2 3.3Å; R172-I175 WeakPolarHBondContact O-CG2 3.48Å; R172-N176 VanDerWaalsContact O-CB 3.24Å; R172-N176 WeakPolarHBondContact O-CB 3.19Å; R172-N176 PolarHBondContact O-N 3.36Å; R172-D200 WeakPolarHBondContact CD-OD1 3.35Å; R172-D200 IonicContact CZ-OD1 3.49Å; R172-D200 IonicContact NE-OD1 2.92Å; R172-D200 PolarHBondContact NE-OD1 3.08Å; R172-D200 IonicContact NE-OD2 2.7Å; R172-D200 PolarHBondContact NE-OD2 3.02Å; R172-G201 PolarHBondContact NH2-O 2.83Å; R172-I221 HydrophobicContact CB-CD1 4.41Å; R172-I221 HydrophobicContact CB-CG2 4.35Å; R172-Y228 WeakPolarHBondContact CD-OH 3.31Å
173	R	97.6	Very high	96.7	Very high	14 Å²	14	21.9 Å²	21.9	5%	0.053	12%	0.123	C	C	.	.	H	α-helix	trans	-62.4	-40.6	175.5	-66.3	179.1	68.5	179.4	5.2	111.6	I169 I170 N176 G177 I221 E222 L225 L395 Q396 T450	I169-R173 HydrophobicContact CG2-CG 4.03Å; I169-R173 VanDerWaalsContact O-CG 3.26Å; I169-R173 WeakPolarHBondContact O-CG 3.28Å; I169-R173 PolarHBondContact O-N 3.25Å; I170-R173 PolarHBondContact O-N 2.99Å; R173-N176 WeakPolarHBondContact O-CB 3.39Å; R173-N176 PolarHBondContact O-N 3.47Å; R173-G177 PolarHBondContact O-N 2.67Å; R173-I221 HydrophobicContact CG-CG2 4.12Å; R173-E222 WeakPolarHBondContact CB-OE1 3.47Å; R173-E222 VanDerWaalsContact CG-OE1 3.24Å; R173-E222 WeakPolarHBondContact CG-OE1 3.39Å; R173-E222 IonicContact CZ-OE1 2.73Å; R173-E222 IonicContact NE-OE1 3.94Å; R173-E222 PolarHBondContact NE-OE1 3.36Å; R173-E222 IonicContact NH2-OE1 2.56Å; R173-E222 PolarHBondContact NH2-OE1 3.24Å; R173-L225 HydrophobicContact CG-CD1 4.22Å; R173-L395 PolarHBondContact NH1-O 3.31Å; R173-L395 PolarHBondContact NH2-O 3.39Å; R173-Q396 PolarHBondContact NH1-O 3.4Å; R173-T450 CarbonylContact C-O 3.58Å; R173-T450 VanDerWaalsContact CB-O 3.26Å; R173-T450 WeakPolarHBondContact CB-O 3.37Å
174	W	98.1	Very high	96.5	Very high	22 Å²	22	25.5 Å²	25.5	8%	0.083	14%	0.142	C	C	.	.	H	α-helix	trans	-65.2	-50.1	-179.8	-169	96.4	0	0	0	111.9	I148 Q149 F151 Y156 I170 A171 R172 N176 G177 M178 T450 P452	I148-W174 HydrophobicContact CB-CE3 4.26Å; I148-W174 HydrophobicContact CB-CZ3 4.19Å; I148-W174 HydrophobicContact CD1-CB 4.42Å; I148-W174 HydrophobicContact CD1-CD2 4.46Å; I148-W174 HydrophobicContact CD1-CE3 3.81Å; I148-W174 HydrophobicContact CG1-CD2 4.47Å; I148-W174 HydrophobicContact CG1-CE3 3.85Å; I148-W174 HydrophobicContact CG1-CZ3 4.26Å; I148-W174 VanDerWaalsContact O-CH2 3.27Å; I148-W174 WeakPolarHBondContact O-CH2 3.47Å; I148-W174 WeakPolarHBondContact O-CZ3 3.4Å; Q149-W174 HydrophobicContact CB-CZ2 4.2Å; Q149-W174 HydrophobicContact CG-CD2 3.86Å; Q149-W174 HydrophobicContact CG-CG 4Å; Q149-W174 HydrophobicContact CG-CZ2 4.2Å; F151-W174 WeakPolarHBondContact O-CH2 3.42Å; Y156-W174 AromaticContact CE2-CH2 3.9Å; Y156-W174 HydrophobicContact CE2-CH2 3.9Å; Y156-W174 AromaticContact CE2-CZ3 3.81Å; Y156-W174 HydrophobicContact CE2-CZ3 3.81Å; Y156-W174 AromaticContact CZ-CZ3 3.95Å; I170-W174 WeakPolarHBondContact O-CB 3.38Å; I170-W174 PolarHBondContact O-N 3.03Å; A171-W174 PolarHBondContact O-N 2.91Å; R172-W174 VanDerWaalsContact C-N 3.32Å; W174-N176 VanDerWaalsContact C-N 3.28Å; W174-N176 PolarHBondContact O-N 3.34Å; W174-G177 PolarHBondContact O-N 3.48Å; W174-M178 HydrophobicContact CE3-CB 4.44Å; W174-M178 HydrophobicContact CH2-CE 3.57Å; W174-M178 HydrophobicContact CZ2-CE 4.1Å; W174-M178 HydrophobicContact CZ3-CB 4.08Å; W174-M178 HydrophobicContact CZ3-CE 4.23Å; W174-M178 HydrophobicContact CZ3-CG 4.4Å; W174-M178 PolarHBondContact O-N 3.35Å; W174-T450 WeakPolarHBondContact CA-O 3.28Å; W174-T450 PolarHBondContact N-O 2.96Å; W174-T450 VanDerWaalsContact N-O 3.09Å; W174-P452 HydrophobicContact CD2-CG 4.33Å; W174-P452 HydrophobicContact CZ2-CB 3.94Å; W174-P452 HydrophobicContact CZ2-CG 4.29Å; W174-P452 WeakPolarHBondContact O-CD 3.31Å
175	I	98.4	Very high	96.3	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-65.4	-34.4	177.3	-170.9	65.7	0	0	0	111.3	I75 I148 Y156 L166 A171 R172 G177 M178 L179	I75-I175 HydrophobicContact CD1-CB 4.47Å; I75-I175 HydrophobicContact CD1-CD1 3.67Å; I75-I175 HydrophobicContact CD1-CG1 3.71Å; I148-I175 HydrophobicContact CD1-CB 4.38Å; Y156-I175 HydrophobicContact CD1-CD1 3.85Å; Y156-I175 HydrophobicContact CE1-CD1 3.57Å; L166-I175 HydrophobicContact CD1-CG2 4.22Å; A171-I175 WeakPolarHBondContact O-CG2 3.35Å; A171-I175 PolarHBondContact O-N 3.31Å; R172-I175 VanDerWaalsContact O-CG2 3.3Å; R172-I175 WeakPolarHBondContact O-CG2 3.48Å; I175-G177 PolarHBondContact O-N 3.46Å; I175-M178 HydrophobicContact CD1-CB 4.29Å; I175-M178 HydrophobicContact CD1-CG 4.43Å; I175-M178 WeakPolarHBondContact O-CB 3.41Å; I175-M178 PolarHBondContact O-N 2.78Å; I175-L179 HydrophobicContact CD1-CD2 4.41Å; I175-L179 HydrophobicContact CD1-CG 4.42Å; I175-L179 HydrophobicContact CG1-CD1 4.39Å; I175-L179 HydrophobicContact CG1-CG 4.38Å; I175-L179 WeakPolarHBondContact O-CG 3.31Å; I175-L179 PolarHBondContact O-N 3.05Å
176	N	98.4	Very high	96	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-57.5	-49.2	173	-178.8	71.9	0	0	0	112	R172 R173 W174 M178 L179 I180 C220 I221 E222	R172-N176 VanDerWaalsContact O-CB 3.24Å; R172-N176 WeakPolarHBondContact O-CB 3.19Å; R172-N176 PolarHBondContact O-N 3.36Å; R173-N176 WeakPolarHBondContact O-CB 3.39Å; R173-N176 PolarHBondContact O-N 3.47Å; W174-N176 VanDerWaalsContact C-N 3.28Å; W174-N176 PolarHBondContact O-N 3.34Å; N176-M178 VanDerWaalsContact C-N 3.33Å; N176-M178 PolarHBondContact O-N 3.24Å; N176-L179 PolarHBondContact O-N 3.11Å; N176-I180 WeakPolarHBondContact ND2-CD1 3.43Å; N176-I180 WeakPolarHBondContact O-CD1 2.99Å; N176-I180 VanDerWaalsContact O-CG1 3.29Å; N176-I180 WeakPolarHBondContact O-CG1 3.15Å; N176-I180 PolarHBondContact O-N 3.14Å; N176-I180 VanDerWaalsContact O-N 3.08Å; N176-C220 VanDerWaalsContact OD1-CB 3.29Å; N176-C220 WeakPolarHBondContact OD1-CB 3.34Å; N176-I221 HydrophobicContact CB-CB 3.74Å; N176-I221 HydrophobicContact CB-CG1 3.62Å; N176-I221 PolarHBondContact OD1-N 3.35Å; N176-I221 VanDerWaalsContact OD1-N 3.08Å; N176-E222 PolarHBondContact ND2-OE2 3.47Å
177	G	97.3	Very high	95.7	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.4	-38.5	175.8	0	0	0	0	0	112.7	R173 W174 I175 L179 I180 S181 Q453	R173-G177 PolarHBondContact O-N 2.67Å; W174-G177 PolarHBondContact O-N 3.48Å; I175-G177 PolarHBondContact O-N 3.46Å; G177-L179 PolarHBondContact O-N 3.33Å; G177-I180 PolarHBondContact O-N 3.02Å; G177-S181 PolarHBondContact O-N 3.01Å; G177-Q453 WeakPolarHBondContact O-CG 3.43Å; G177-Q453 PolarHBondContact O-NE2 3.35Å
178	M	98.2	Very high	95.5	Very high	9 Å²	9	39.2 Å²	39.2	4%	0.044	22%	0.22	C	C	.	.	H	α-helix	trans	-59.2	-48.1	175.8	176.3	54	70.8	0	0	111.5	D153 Y156 W174 I175 N176 I180 S181 L182 P452	D153-M178 HydrophobicContact CB-SD 4.09Å; Y156-M178 HydrophobicContact CD2-CE 3.9Å; Y156-M178 HydrophobicContact CD2-CG 3.35Å; Y156-M178 HydrophobicContact CD2-SD 3.71Å; Y156-M178 HydrophobicContact CE2-CE 4.08Å; Y156-M178 HydrophobicContact CE2-CG 3.91Å; Y156-M178 HydrophobicContact CE2-SD 4.42Å; Y156-M178 HydrophobicContact CG-CG 3.73Å; Y156-M178 HydrophobicContact CG-SD 4.42Å; W174-M178 HydrophobicContact CE3-CB 4.44Å; W174-M178 HydrophobicContact CH2-CE 3.57Å; W174-M178 HydrophobicContact CZ2-CE 4.1Å; W174-M178 HydrophobicContact CZ3-CB 4.08Å; W174-M178 HydrophobicContact CZ3-CE 4.23Å; W174-M178 HydrophobicContact CZ3-CG 4.4Å; W174-M178 PolarHBondContact O-N 3.35Å; I175-M178 HydrophobicContact CD1-CB 4.29Å; I175-M178 HydrophobicContact CD1-CG 4.43Å; I175-M178 WeakPolarHBondContact O-CB 3.41Å; I175-M178 PolarHBondContact O-N 2.78Å; N176-M178 VanDerWaalsContact C-N 3.33Å; N176-M178 PolarHBondContact O-N 3.24Å; M178-I180 PolarHBondContact O-N 2.79Å; M178-S181 PolarHBondContact O-N 3.4Å; M178-S181 PolarHBondContact O-OG 3.21Å; M178-L182 WeakPolarHBondContact O-CG 3.35Å; M178-L182 PolarHBondContact O-N 2.99Å; M178-L182 HydrophobicContact SD-CD2 4.41Å; M178-P452 HydrophobicContact CB-CG 3.92Å; M178-P452 HydrophobicContact CE-CB 4.33Å; M178-P452 HydrophobicContact CE-CG 4.34Å; M178-P452 VanDerWaalsContact N-CG 3.26Å
179	L	98.3	Very high	95.5	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-72.4	-31	-177	-56.7	-176.6	0	0	0	113	I162 I175 N176 G177 S181 L182 V196 L198 P215	I162-L179 HydrophobicContact CB-CD1 4.4Å; I162-L179 HydrophobicContact CD1-CD1 4Å; I162-L179 HydrophobicContact CD1-CD2 3.41Å; I162-L179 VanDerWaalsContact CD1-CD2 3.41Å; I162-L179 HydrophobicContact CD1-CG 4.29Å; I175-L179 HydrophobicContact CD1-CD2 4.41Å; I175-L179 HydrophobicContact CD1-CG 4.42Å; I175-L179 HydrophobicContact CG1-CD1 4.39Å; I175-L179 HydrophobicContact CG1-CG 4.38Å; I175-L179 WeakPolarHBondContact O-CG 3.31Å; I175-L179 PolarHBondContact O-N 3.05Å; N176-L179 PolarHBondContact O-N 3.11Å; G177-L179 PolarHBondContact O-N 3.33Å; L179-S181 PolarHBondContact O-N 3.16Å; L179-L182 HydrophobicContact CD2-CD1 3.86Å; L179-L182 PolarHBondContact O-N 3.43Å; L179-V196 HydrophobicContact CD2-CB 4.37Å; L179-V196 HydrophobicContact CD2-CG1 4.41Å; L179-L198 HydrophobicContact CD1-CB 3.66Å; L179-L198 HydrophobicContact CD1-CD1 4.17Å; L179-L198 HydrophobicContact CD1-CD2 4.06Å; L179-L198 HydrophobicContact CD1-CG 4.17Å; L179-P215 HydrophobicContact CB-CG 3.92Å
180	I	97.8	Very high	95.6	Very high	8 Å²	8	41.5 Å²	41.5	4%	0.041	23%	0.233	C	C	.	.	H	α-helix	trans	-65.1	-30.3	169.5	-64.1	164.8	0	0	0	110.4	N176 G177 M178 L182 L183 P215 C220 A366 C367 Q453	N176-I180 WeakPolarHBondContact ND2-CD1 3.43Å; N176-I180 WeakPolarHBondContact O-CD1 2.99Å; N176-I180 VanDerWaalsContact O-CG1 3.29Å; N176-I180 WeakPolarHBondContact O-CG1 3.15Å; N176-I180 PolarHBondContact O-N 3.14Å; N176-I180 VanDerWaalsContact O-N 3.08Å; G177-I180 PolarHBondContact O-N 3.02Å; M178-I180 PolarHBondContact O-N 2.79Å; I180-L182 PolarHBondContact O-N 2.96Å; I180-L183 HydrophobicContact CG2-CD1 4.28Å; I180-L183 WeakPolarHBondContact O-CB 3.41Å; I180-L183 VanDerWaalsContact O-CG 3.3Å; I180-L183 WeakPolarHBondContact O-CG 3.17Å; I180-L183 PolarHBondContact O-N 2.89Å; I180-P215 HydrophobicContact CG1-CB 4.18Å; I180-C220 HydrophobicContact CD1-CB 4.14Å; I180-A366 HydrophobicContact CD1-CB 3.74Å; I180-A366 WeakPolarHBondContact CG2-O 3.18Å; I180-C367 HydrophobicContact CD1-CB 3.8Å; I180-C367 HydrophobicContact CG1-CB 4.37Å; I180-Q453 VanDerWaalsContact CB-NE2 3.29Å; I180-Q453 VanDerWaalsContact CG2-NE2 3.27Å
181	S	95.9	Very high	95.7	Very high	51 Å²	51	40 Å²	40	36%	0.357	23%	0.226	S	C	.	.	H	α-helix	trans	-78.5	-11.5	-177.7	75.9	0	0	0	0	112.4	G177 M178 L179 L183	G177-S181 PolarHBondContact O-N 3.01Å; M178-S181 PolarHBondContact O-N 3.4Å; M178-S181 PolarHBondContact O-OG 3.21Å; L179-S181 PolarHBondContact O-N 3.16Å; S181-L183 VanDerWaalsContact C-N 3.29Å
182	L	96.5	Very high	95.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-17.7	174.4	-56.8	-175.1	0	0	0	112.5	D153 R157 M178 L179 I180 V196	D153-L182 HydrophobicContact CB-CD2 3.62Å; R157-L182 HydrophobicContact CB-CD1 4.47Å; R157-L182 HydrophobicContact CB-CD2 4.38Å; R157-L182 PolarHBondContact NH1-O 3.41Å; R157-L182 PolarHBondContact NH2-O 3.27Å; M178-L182 WeakPolarHBondContact O-CG 3.35Å; M178-L182 PolarHBondContact O-N 2.99Å; M178-L182 HydrophobicContact SD-CD2 4.41Å; L179-L182 HydrophobicContact CD2-CD1 3.86Å; L179-L182 PolarHBondContact O-N 3.43Å; I180-L182 PolarHBondContact O-N 2.96Å; L182-V196 HydrophobicContact CD1-CG2 3.87Å
183	L	96.9	Very high	95.7	Very high	16 Å²	16	46 Å²	46	8%	0.084	27%	0.268	C	S	.	.			trans	-65.7	133.3	-175.4	-61.2	-176.4	0	0	0	111.1	I180 S181 Y185 L190 S194 I195 P215	I180-L183 HydrophobicContact CG2-CD1 4.28Å; I180-L183 WeakPolarHBondContact O-CB 3.41Å; I180-L183 VanDerWaalsContact O-CG 3.3Å; I180-L183 WeakPolarHBondContact O-CG 3.17Å; I180-L183 PolarHBondContact O-N 2.89Å; S181-L183 VanDerWaalsContact C-N 3.29Å; L183-Y185 HydrophobicContact CB-CD2 4.36Å; L183-Y185 HydrophobicContact CB-CE2 3.73Å; L183-Y185 HydrophobicContact CD1-CE2 4.12Å; L183-L190 HydrophobicContact CB-CD1 4.08Å; L183-L190 HydrophobicContact CD1-CD1 4.29Å; L183-L190 HydrophobicContact CD2-CD1 4Å; L183-L190 HydrophobicContact CG-CD1 4.34Å; L183-S194 WeakPolarHBondContact CA-OG 3.14Å; L183-I195 HydrophobicContact CD2-CB 4.5Å; L183-I195 HydrophobicContact CD2-CG1 4.01Å; L183-P215 HydrophobicContact CD1-CB 4.09Å; L183-P215 HydrophobicContact CD2-CB 4.04Å; L183-P215 HydrophobicContact CG-CB 4.31Å
184	N	94.4	Very high	95.7	Very high	76 Å²	76	45.6 Å²	45.6	41%	0.406	27%	0.267	S	S	.	.			trans	-107.5	130.1	172.9	-66.2	-28.6	0	0	0	108.9	D191 S194	N184-D191 HydrophobicContact CB-CB 4.3Å; N184-D191 PolarHBondContact O-N 3.43Å; N184-S194 PolarHBondContact N-OG 2.87Å
185	Y	93.3	Very high	95.7	Very high	62 Å²	62	45.8 Å²	45.8	24%	0.243	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	114.5	173.6	-68.6	-99.2	0	0	0	108.5	L183 V189 L190 Q369	L183-Y185 HydrophobicContact CB-CD2 4.36Å; L183-Y185 HydrophobicContact CB-CE2 3.73Å; L183-Y185 HydrophobicContact CD1-CE2 4.12Å; Y185-V189 CarbonylContact C-O 3.58Å; Y185-V189 WeakPolarHBondContact CA-O 3.34Å; Y185-L190 HydrophobicContact CD1-CB 4.03Å; Y185-L190 HydrophobicContact CE1-CB 3.75Å; Y185-L190 HydrophobicContact CE1-CD1 4.13Å; Y185-L190 HydrophobicContact CE1-CG 4.42Å; Y185-L190 HydrophobicContact CE2-CD1 4.15Å; Y185-Q369 HydrophobicContact CD1-CG 4.25Å; Y185-Q369 HydrophobicContact CE1-CG 3.79Å; Y185-Q369 HydrophobicContact CE2-CG 4.23Å; Y185-Q369 VanDerWaalsContact CZ-CD 3.43Å; Y185-Q369 VanDerWaalsContact CZ-NE2 3.32Å; Y185-Q369 PolarHBondContact OH-NE2 3.34Å
186	E	91	Very high	95.7	Very high	140 Å²	140	46.2 Å²	46.2	65%	0.654	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	111.7	174.1	-64.6	-174.3	174.3	0	0	107.9	G188 V189	E186-G188 PolarHBondContact O-N 3.15Å; E186-G188 VanDerWaalsContact O-N 3.09Å; E186-V189 PolarHBondContact N-O 3.19Å; E186-V189 WeakPolarHBondContact O-CB 3.48Å; E186-V189 PolarHBondContact O-N 3.05Å
187	D	89.7	Confident	95.7	Very high	176 Å²	176	47 Å²	47	94%	0.941	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	35.6	-177.4	-63.2	-42.3	0	0	0	114.5	V189	D187-V189 VanDerWaalsContact C-N 3.32Å
188	G	88.7	Confident	95.8	Very high	66 Å²	66	47 Å²	47	68%	0.68	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	-2.5	-179.7	0	0	0	0	0	114.8	E186	E186-G188 PolarHBondContact O-N 3.15Å; E186-G188 VanDerWaalsContact O-N 3.09Å
189	V	93.5	Very high	95.8	Very high	105 Å²	105	46.7 Å²	46.7	64%	0.636	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	126.9	172.7	-174.6	0	0	0	0	109.1	Y185 E186 D187 D191	Y185-V189 CarbonylContact C-O 3.58Å; Y185-V189 WeakPolarHBondContact CA-O 3.34Å; E186-V189 PolarHBondContact N-O 3.19Å; E186-V189 WeakPolarHBondContact O-CB 3.48Å; E186-V189 PolarHBondContact O-N 3.05Å; D187-V189 VanDerWaalsContact C-N 3.32Å; V189-D191 PolarHBondContact O-N 3.21Å
190	L	95.2	Very high	95.8	Very high	30 Å²	30	46.8 Å²	46.8	16%	0.157	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	123.7	178.4	172.5	58.5	0	0	0	110.3	L183 Y185 P192 I195 M217	L183-L190 HydrophobicContact CB-CD1 4.08Å; L183-L190 HydrophobicContact CD1-CD1 4.29Å; L183-L190 HydrophobicContact CD2-CD1 4Å; L183-L190 HydrophobicContact CG-CD1 4.34Å; Y185-L190 HydrophobicContact CD1-CB 4.03Å; Y185-L190 HydrophobicContact CE1-CB 3.75Å; Y185-L190 HydrophobicContact CE1-CD1 4.13Å; Y185-L190 HydrophobicContact CE1-CG 4.42Å; Y185-L190 HydrophobicContact CE2-CD1 4.15Å; L190-P192 VanDerWaalsContact O-CD 3.24Å; L190-P192 WeakPolarHBondContact O-CD 3.42Å; L190-I195 HydrophobicContact CD1-CG1 4.45Å; L190-I195 HydrophobicContact CD2-CD1 3.91Å; L190-I195 HydrophobicContact CD2-CG1 4.3Å; L190-I195 HydrophobicContact CG-CD1 4.32Å; L190-I195 HydrophobicContact CG-CG1 4.47Å; L190-M217 HydrophobicContact CD2-CG 3.9Å
191	D	96.6	Very high	95.9	Very high	38 Å²	38	46.4 Å²	46.4	20%	0.203	27%	0.274	C	S	.	.			trans	-71.5	113.2	169.8	168.2	20.6	0	0	0	109.8	N184 V189 S193 S194	N184-D191 HydrophobicContact CB-CB 4.3Å; N184-D191 PolarHBondContact O-N 3.43Å; V189-D191 PolarHBondContact O-N 3.21Å; D191-S193 VanDerWaalsContact CG-OG 3.27Å; D191-S193 PolarHBondContact O-N 3.45Å; D191-S193 VanDerWaalsContact O-N 3.14Å; D191-S193 VanDerWaalsContact OD1-CB 3.32Å; D191-S193 WeakPolarHBondContact OD1-CB 3.38Å; D191-S193 PolarHBondContact OD1-N 3.24Å; D191-S193 PolarHBondContact OD1-OG 3.16Å; D191-S193 PolarHBondContact OD2-OG 3.14Å; D191-S194 WeakPolarHBondContact O-CB 3.22Å; D191-S194 PolarHBondContact O-N 3.24Å; D191-S194 VanDerWaalsContact O-N 3.11Å; D191-S194 PolarHBondContact O-OG 3.24Å
192	P	96.3	Very high	95.9	Very high	69 Å²	69	44.2 Å²	44.2	45%	0.448	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-60	-26.5	-179.3	-22.5	34.7	0	0	0	113.4	L190 S194 I195	L190-P192 VanDerWaalsContact O-CD 3.24Å; L190-P192 WeakPolarHBondContact O-CD 3.42Å; P192-S194 PolarHBondContact O-N 3.4Å; P192-I195 WeakPolarHBondContact O-CB 3.46Å; P192-I195 WeakPolarHBondContact O-CG1 3.36Å; P192-I195 PolarHBondContact O-N 2.99Å
193	S	96.7	Very high	95.9	Very high	83 Å²	83	45.8 Å²	45.8	58%	0.58	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-73.5	-15.9	-178.7	88.4	0	0	0	0	113.7	D191 I195	D191-S193 VanDerWaalsContact CG-OG 3.27Å; D191-S193 PolarHBondContact O-N 3.45Å; D191-S193 VanDerWaalsContact O-N 3.14Å; D191-S193 VanDerWaalsContact OD1-CB 3.32Å; D191-S193 WeakPolarHBondContact OD1-CB 3.38Å; D191-S193 PolarHBondContact OD1-N 3.24Å; D191-S193 PolarHBondContact OD1-OG 3.16Å; D191-S193 PolarHBondContact OD2-OG 3.14Å; S193-I195 VanDerWaalsContact C-N 3.34Å
194	S	97.7	Very high	95.9	Very high	5 Å²	5	50 Å²	50	4%	0.035	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-84	-10.6	175	74.1	0	0	0	0	113.4	L183 N184 D191 P192 V196	L183-S194 WeakPolarHBondContact CA-OG 3.14Å; N184-S194 PolarHBondContact N-OG 2.87Å; D191-S194 WeakPolarHBondContact O-CB 3.22Å; D191-S194 PolarHBondContact O-N 3.24Å; D191-S194 VanDerWaalsContact O-N 3.11Å; D191-S194 PolarHBondContact O-OG 3.24Å; P192-S194 PolarHBondContact O-N 3.4Å; S194-V196 PolarHBondContact O-N 3.36Å
195	I	98.4	Very high	95.9	Very high	26 Å²	26	47.1 Å²	47.1	13%	0.133	28%	0.277	C	S	.	.			trans	-77.8	121.9	-179.1	-55.4	176.8	0	0	0	109.3	L183 L190 P192 S193 P197 L214 M217	L183-I195 HydrophobicContact CD2-CB 4.5Å; L183-I195 HydrophobicContact CD2-CG1 4.01Å; L190-I195 HydrophobicContact CD1-CG1 4.45Å; L190-I195 HydrophobicContact CD2-CD1 3.91Å; L190-I195 HydrophobicContact CD2-CG1 4.3Å; L190-I195 HydrophobicContact CG-CD1 4.32Å; L190-I195 HydrophobicContact CG-CG1 4.47Å; P192-I195 WeakPolarHBondContact O-CB 3.46Å; P192-I195 WeakPolarHBondContact O-CG1 3.36Å; P192-I195 PolarHBondContact O-N 2.99Å; S193-I195 VanDerWaalsContact C-N 3.34Å; I195-P197 WeakPolarHBondContact O-CD 3.49Å; I195-L214 HydrophobicContact CG2-CB 4.41Å; I195-M217 HydrophobicContact CD1-CG 3.94Å; I195-M217 HydrophobicContact CD1-SD 3.45Å; I195-M217 WeakPolarHBondContact CD1-SD 3.38Å
196	V	98.7	Very high	96.1	Very high	10 Å²	10	49.1 Å²	49.1	6%	0.061	29%	0.286	C	S	.	.			trans	-105.2	105.8	167	-177.9	0	0	0	0	108.3	I162 L179 L182 S194 L198 P215	I162-V196 HydrophobicContact CD1-CG1 3.82Å; I162-V196 HydrophobicContact CG1-CG1 3.86Å; L179-V196 HydrophobicContact CD2-CB 4.37Å; L179-V196 HydrophobicContact CD2-CG1 4.41Å; L182-V196 HydrophobicContact CD1-CG2 3.87Å; S194-V196 PolarHBondContact O-N 3.36Å; V196-L198 PolarHBondContact O-N 2.86Å; V196-P215 WeakPolarHBondContact O-CD 3.48Å
197	P	98.8	Very high	96.4	Very high	16 Å²	16	48 Å²	48	10%	0.104	28%	0.28	C	S	.	.			trans	-53.9	134.1	175.3	-28.3	34.5	0	0	0	112.9	H160 I161 I162 I195 L214 I331	H160-P197 WeakPolarHBondContact O-CD 3.3Å; I161-P197 HydrophobicContact CG2-CB 4.49Å; I162-P197 PolarHBondContact N-O 3.35Å; I195-P197 WeakPolarHBondContact O-CD 3.49Å; P197-L214 HydrophobicContact CB-CD2 3.82Å; P197-L214 HydrophobicContact CG-CD2 3.82Å; P197-I331 HydrophobicContact CB-CD1 4.21Å; P197-I331 HydrophobicContact CB-CG2 3.96Å; P197-I331 HydrophobicContact CG-CG2 3.77Å
198	L	98.8	Very high	96.8	Very high	2 Å²	2	40 Å²	40	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	122.1	177.4	172	61.1	0	0	0	110	I162 C164 L179 V196 I213	I162-L198 HydrophobicContact CB-CD1 4.39Å; I162-L198 HydrophobicContact CG2-CD1 4.03Å; I162-L198 CarbonylContact O-C 3.53Å; I162-L198 WeakPolarHBondContact O-CA 3.4Å; C164-L198 HydrophobicContact CB-CD1 4.47Å; C164-L198 VanDerWaalsContact SG-CD1 3.53Å; L179-L198 HydrophobicContact CD1-CB 3.66Å; L179-L198 HydrophobicContact CD1-CD1 4.17Å; L179-L198 HydrophobicContact CD1-CD2 4.06Å; L179-L198 HydrophobicContact CD1-CG 4.17Å; V196-L198 PolarHBondContact O-N 2.86Å; L198-I213 HydrophobicContact CB-CB 4.15Å; L198-I213 HydrophobicContact CD2-CD1 3.88Å; L198-I213 HydrophobicContact CG-CD1 4.26Å; L198-I213 PolarHBondContact N-O 2.86Å; L198-I213 PolarHBondContact O-N 3.09Å
199	I	98.8	Very high	97.3	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	120.5	171.7	-61.9	73.3	0	0	0	107.2	I161 I162 V163 C164 R211 V212 C324 E327 V328 I331	I161-I199 HydrophobicContact CG2-CD1 3.34Å; I162-I199 PolarHBondContact O-N 3.5Å; V163-I199 CarbonylContact C-O 3.59Å; V163-I199 VanDerWaalsContact CA-O 3.23Å; V163-I199 WeakPolarHBondContact CA-O 3.35Å; V163-I199 HydrophobicContact CB-CB 4.31Å; V163-I199 HydrophobicContact CG2-CB 3.97Å; V163-I199 HydrophobicContact CG2-CG2 4.02Å; C164-I199 PolarHBondContact N-O 3Å; I199-R211 CarbonylContact C-O 3.59Å; I199-R211 WeakPolarHBondContact CA-O 3.26Å; I199-V212 HydrophobicContact CG1-CG2 4.36Å; I199-C324 HydrophobicContact CG2-CB 3.55Å; I199-E327 HydrophobicContact CG1-CB 4.32Å; I199-V328 HydrophobicContact CB-CG2 4.25Å; I199-V328 HydrophobicContact CD1-CG2 3.85Å; I199-V328 HydrophobicContact CG1-CG2 3.89Å; I199-I331 HydrophobicContact CD1-CD1 3.81Å; I199-I331 HydrophobicContact CG1-CD1 4.24Å
200	D	98.8	Very high	97.5	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.011	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	133.1	179.4	173.4	70.9	0	0	0	110.7	C164 R172 A210 R211 I221	C164-D200 HydrophobicContact CB-CB 4.4Å; R172-D200 WeakPolarHBondContact CD-OD1 3.35Å; R172-D200 IonicContact CZ-OD1 3.49Å; R172-D200 IonicContact NE-OD1 2.92Å; R172-D200 PolarHBondContact NE-OD1 3.08Å; R172-D200 IonicContact NE-OD2 2.7Å; R172-D200 PolarHBondContact NE-OD2 3.02Å; D200-A210 CarbonylContact O-C 3.59Å; D200-A210 WeakPolarHBondContact O-CA 3.18Å; D200-R211 HydrophobicContact CB-CG 3.7Å; D200-R211 PolarHBondContact N-O 2.91Å; D200-R211 WeakPolarHBondContact O-CG 3.15Å; D200-R211 PolarHBondContact O-N 3.27Å; D200-I221 HydrophobicContact CB-CD1 4.39Å
201	G	98.4	Very high	97.7	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	141.8	172.9	0	0	0	0	0	111.2	L80 C164 R172 N209	L80-G201 WeakPolarHBondContact CD1-O 3.29Å; C164-G201 PolarHBondContact O-N 2.84Å; R172-G201 PolarHBondContact NH2-O 2.83Å; G201-N209 WeakPolarHBondContact CA-O 3.38Å
202	G	97.3	Very high	97.8	Very high	5 Å²	5	30.3 Å²	30.3	5%	0.052	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	143.9	172.9	0	0	0	0	0	111.3	G208 N209	G202-G208 CarbonylContact O-C 3.58Å; G202-G208 WeakPolarHBondContact O-CA 3.27Å; G202-N209 PolarHBondContact N-O 2.93Å; G202-N209 PolarHBondContact O-N 3.24Å
203	T	96.8	Very high	97.9	Very high	33 Å²	33	27 Å²	27	20%	0.202	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	136.6	178	57.3	0	0	0	0	111.4	L80 T316 N317 I320	L80-T203 HydrophobicContact CD1-CG2 4.19Å; L80-T203 HydrophobicContact CD2-CG2 3.88Å; L80-T203 HydrophobicContact CG-CG2 4.15Å; T203-T316 HydrophobicContact CG2-CG2 4.01Å; T203-N317 PolarHBondContact OG1-OD1 3.32Å; T203-N317 VanDerWaalsContact OG1-OD1 3.06Å; T203-I320 HydrophobicContact CG2-CB 3.95Å; T203-I320 HydrophobicContact CG2-CG1 3.78Å; T203-I320 HydrophobicContact CG2-CG2 4.35Å
204	E	95.2	Very high	98	Very high	106 Å²	106	25.4 Å²	25.4	50%	0.495	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	108.8	172.5	-62.8	-169.5	-171.4	0	0	109.2	F206 K207 I310	E204-F206 PolarHBondContact O-N 2.84Å; E204-K207 PolarHBondContact N-O 3.11Å; E204-K207 PolarHBondContact O-N 3.28Å; E204-I310 HydrophobicContact CB-CG2 3.94Å; E204-I310 HydrophobicContact CG-CG2 3.8Å
205	G	95.5	Very high	98	Very high	15 Å²	15	25.2 Å²	25.2	16%	0.155	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	56	-111.2	-176.6	0	0	0	0	0	112.4	P311 T316	G205-P311 VanDerWaalsContact CA-O 3.25Å; G205-P311 WeakPolarHBondContact CA-O 3.44Å; G205-P311 PolarHBondContact N-O 3.33Å; G205-T316 WeakPolarHBondContact O-CB 3.42Å; G205-T316 PolarHBondContact O-OG1 3.15Å
206	F	97.5	Very high	97.9	Very high	103 Å²	103	24.2 Å²	24.2	45%	0.452	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	18.4	-177.3	-70	-54	0	0	0	112.4	E204 V313 N346 D347 V348	E204-F206 PolarHBondContact O-N 2.84Å; F206-V313 HydrophobicContact CD1-CG2 4.35Å; F206-V313 HydrophobicContact CE1-CG2 4.12Å; F206-N346 WeakPolarHBondContact O-CA 3.32Å; F206-D347 WeakPolarHBondContact CA-OD1 3.29Å; F206-D347 WeakPolarHBondContact CB-OD1 3.45Å; F206-D347 WeakPolarHBondContact CD1-OD1 3.44Å; F206-D347 WeakPolarHBondContact CG-OD1 3.46Å; F206-D347 PolarHBondContact O-N 2.99Å; F206-V348 HydrophobicContact CB-CG2 3.57Å; F206-V348 HydrophobicContact CD2-CG2 4.44Å; F206-V348 HydrophobicContact CG-CG2 4.4Å
207	K	97.8	Very high	97.8	Very high	117 Å²	117	29.1 Å²	29.1	51%	0.509	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	151	178.2	-61.1	-179	-176.2	179	0	109.6	E204 T316 F345 N346	E204-K207 PolarHBondContact N-O 3.11Å; E204-K207 PolarHBondContact O-N 3.28Å; K207-T316 VanDerWaalsContact O-CG2 3.31Å; K207-T316 WeakPolarHBondContact O-CG2 3.32Å; K207-F345 VanDerWaalsContact CA-O 3.31Å; K207-F345 WeakPolarHBondContact CA-O 3.41Å; K207-N346 HydrophobicContact CG-CB 4.38Å
208	G	97.9	Very high	97.7	Very high	8 Å²	8	29.9 Å²	29.9	8%	0.082	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	171.4	172	0	0	0	0	0	111.8	G202 F345	G202-G208 CarbonylContact O-C 3.58Å; G202-G208 WeakPolarHBondContact O-CA 3.27Å; G208-F345 PolarHBondContact N-O 3.37Å; G208-F345 PolarHBondContact O-N 2.98Å
209	N	98.2	Very high	97.7	Very high	26 Å²	26	29.8 Å²	29.8	14%	0.139	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	150	174.3	67.9	-80.1	0	0	0	109.8	G201 G202 I320 Y342 L343	G201-N209 WeakPolarHBondContact CA-O 3.38Å; G202-N209 PolarHBondContact N-O 2.93Å; G202-N209 PolarHBondContact O-N 3.24Å; N209-I320 VanDerWaalsContact O-CG2 3.29Å; N209-I320 WeakPolarHBondContact O-CG2 3.35Å; N209-Y342 HydrophobicContact CB-CE1 3.7Å; N209-Y342 PolarHBondContact ND2-OH 3.36Å; N209-L343 CarbonylContact C-O 3.52Å; N209-L343 WeakPolarHBondContact CA-O 3.44Å; N209-L343 WeakPolarHBondContact CB-O 3.43Å
210	A	98.6	Very high	97.7	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.008	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	143.2	170.1	0	0	0	0	0	108	D200 I320 V323 L343	D200-A210 CarbonylContact O-C 3.59Å; D200-A210 WeakPolarHBondContact O-CA 3.18Å; A210-I320 HydrophobicContact CB-CG2 4.4Å; A210-V323 HydrophobicContact CB-CB 4.06Å; A210-V323 HydrophobicContact CB-CG1 3.59Å; A210-L343 PolarHBondContact N-O 2.85Å; A210-L343 PolarHBondContact O-N 2.68Å
211	R	98	Very high	97.6	Very high	3 Å²	3	29.7 Å²	29.7	1%	0.011	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	146.7	179.2	60	-177	-67.4	176.8	-0.4	112.7	I199 D200 A219 C220 T224 N341 Y342	I199-R211 CarbonylContact C-O 3.59Å; I199-R211 WeakPolarHBondContact CA-O 3.26Å; D200-R211 HydrophobicContact CB-CG 3.7Å; D200-R211 PolarHBondContact N-O 2.91Å; D200-R211 WeakPolarHBondContact O-CG 3.15Å; D200-R211 PolarHBondContact O-N 3.27Å; R211-A219 PolarHBondContact NH2-O 3.28Å; R211-A219 VanDerWaalsContact NH2-O 3.11Å; R211-C220 PolarHBondContact NH2-O 2.88Å; R211-T224 PolarHBondContact NH1-OG1 3.45Å; R211-T224 PolarHBondContact NH2-OG1 3.18Å; R211-N341 CarbonylContact C-O 3.38Å; R211-N341 WeakPolarHBondContact CA-O 3.33Å; R211-N341 WeakPolarHBondContact CB-O 3.09Å; R211-Y342 HydrophobicContact CB-CD2 4.02Å; R211-Y342 HydrophobicContact CB-CE2 4.38Å
212	V	98.8	Very high	97.5	Very high	6 Å²	6	30.1 Å²	30.1	4%	0.036	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	125.5	173.7	178.1	0	0	0	0	108.3	I199 E327 I331 L339 N341	I199-V212 HydrophobicContact CG1-CG2 4.36Å; V212-E327 HydrophobicContact CG2-CB 3.7Å; V212-E327 HydrophobicContact CG2-CG 3.78Å; V212-I331 HydrophobicContact CG1-CD1 3.77Å; V212-L339 HydrophobicContact CG2-CB 3.91Å; V212-L339 HydrophobicContact CG2-CD2 4.38Å; V212-L339 HydrophobicContact CG2-CG 4.49Å; V212-N341 PolarHBondContact N-O 3Å; V212-N341 PolarHBondContact O-ND2 3.14Å
213	I	98.8	Very high	97.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	120.2	180	-54.5	170.6	0	0	0	107.5	L198 P215 C220 I221	L198-I213 HydrophobicContact CB-CB 4.15Å; L198-I213 HydrophobicContact CD2-CD1 3.88Å; L198-I213 HydrophobicContact CG-CD1 4.26Å; L198-I213 PolarHBondContact N-O 2.86Å; L198-I213 PolarHBondContact O-N 3.09Å; I213-P215 WeakPolarHBondContact O-CD 2.77Å; I213-C220 HydrophobicContact CG2-CB 4.3Å; I213-I221 HydrophobicContact CD1-CD1 3.59Å; I213-I221 HydrophobicContact CD1-CG1 3.78Å
214	L	98.6	Very high	97.5	Very high	49 Å²	49	29 Å²	29	26%	0.257	15%	0.147	S	C	.	.			trans	-100.4	102	163.8	-55.7	179	0	0	0	107.4	I195 P197 G216 M217 T218	I195-L214 HydrophobicContact CG2-CB 4.41Å; P197-L214 HydrophobicContact CB-CD2 3.82Å; P197-L214 HydrophobicContact CG-CD2 3.82Å; L214-G216 PolarHBondContact O-N 3.36Å; L214-M217 HydrophobicContact CB-CB 4.15Å; L214-M217 PolarHBondContact O-N 2.81Å; L214-M217 VanDerWaalsContact O-N 3.08Å; L214-T218 HydrophobicContact CB-CG2 4.01Å; L214-T218 HydrophobicContact CD1-CG2 4.27Å; L214-T218 HydrophobicContact CG-CG2 4.23Å; L214-T218 PolarHBondContact N-OG1 2.76Å; L214-T218 PolarHBondContact O-N 2.89Å; L214-T218 PolarHBondContact O-OG1 2.9Å; L214-T218 VanDerWaalsContact O-OG1 3.12Å
215	P	98.2	Very high	97.4	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.006	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	133.4	-178.1	-27.5	35.2	0	0	0	111.8	L179 I180 L183 V196 I213 M217	L179-P215 HydrophobicContact CB-CG 3.92Å; I180-P215 HydrophobicContact CG1-CB 4.18Å; L183-P215 HydrophobicContact CD1-CB 4.09Å; L183-P215 HydrophobicContact CD2-CB 4.04Å; L183-P215 HydrophobicContact CG-CB 4.31Å; V196-P215 WeakPolarHBondContact O-CD 3.48Å; I213-P215 WeakPolarHBondContact O-CD 2.77Å; P215-M217 PolarHBondContact O-N 2.78Å
216	G	96	Very high	97.2	Very high	5 Å²	5	28.4 Å²	28.4	5%	0.052	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.6	-9.2	-179.4	0	0	0	0	0	115.5	L214 R360	L214-G216 PolarHBondContact O-N 3.36Å; G216-R360 PolarHBondContact O-NH1 2.96Å; G216-R360 PolarHBondContact O-NH2 3.17Å
217	M	96.7	Very high	96.9	Very high	113 Å²	113	28.1 Å²	28.1	56%	0.557	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.1	-51.1	177.3	-62.1	-179	74.1	0	0	112.7	L190 I195 L214 P215	L190-M217 HydrophobicContact CD2-CG 3.9Å; I195-M217 HydrophobicContact CD1-CG 3.94Å; I195-M217 HydrophobicContact CD1-SD 3.45Å; I195-M217 WeakPolarHBondContact CD1-SD 3.38Å; L214-M217 HydrophobicContact CB-CB 4.15Å; L214-M217 PolarHBondContact O-N 2.81Å; L214-M217 VanDerWaalsContact O-N 3.08Å; P215-M217 PolarHBondContact O-N 2.78Å
218	T	97.9	Very high	96.6	Very high	31 Å²	31	24.6 Å²	24.6	19%	0.19	13%	0.127	C	C	.	.	S	Bend	trans	-104.7	174.7	-174.7	62.3	0	0	0	0	112.2	L214 C220	L214-T218 HydrophobicContact CB-CG2 4.01Å; L214-T218 HydrophobicContact CD1-CG2 4.27Å; L214-T218 HydrophobicContact CG-CG2 4.23Å; L214-T218 PolarHBondContact N-OG1 2.76Å; L214-T218 PolarHBondContact O-N 2.89Å; L214-T218 PolarHBondContact O-OG1 2.9Å; L214-T218 VanDerWaalsContact O-OG1 3.12Å; T218-C220 PolarHBondContact O-N 3.21Å
219	A	98.2	Very high	96.1	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.008	15%	0.146	C	C	.	.			trans	-63.3	116.5	174	0	0	0	0	0	112.3	R211 C223 N341 A358 R360	R211-A219 PolarHBondContact NH2-O 3.28Å; R211-A219 VanDerWaalsContact NH2-O 3.11Å; A219-C223 HydrophobicContact CB-CB 3.84Å; A219-N341 PolarHBondContact O-ND2 2.77Å; A219-N341 VanDerWaalsContact O-ND2 3.15Å; A219-A358 HydrophobicContact CB-CB 4.02Å; A219-A358 VanDerWaalsContact CB-O 3.23Å; A219-A358 WeakPolarHBondContact CB-O 3.48Å; A219-R360 HydrophobicContact CB-CB 4.47Å
220	C	98.2	Very high	95.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.177	C	C	.	.			trans	-79	178.8	177.7	80.6	0	0	0	0	112.5	N176 I180 R211 I213 T218 E222 C223 T224 C367	N176-C220 VanDerWaalsContact OD1-CB 3.29Å; N176-C220 WeakPolarHBondContact OD1-CB 3.34Å; I180-C220 HydrophobicContact CD1-CB 4.14Å; R211-C220 PolarHBondContact NH2-O 2.88Å; I213-C220 HydrophobicContact CG2-CB 4.3Å; T218-C220 PolarHBondContact O-N 3.21Å; C220-E222 PolarHBondContact O-N 3.14Å; C220-C223 WeakPolarHBondContact O-CB 3.48Å; C220-C223 PolarHBondContact O-N 2.93Å; C220-C223 VanDerWaalsContact SG-SG 3.68Å; C220-T224 PolarHBondContact O-OG1 3.36Å; C220-C367 HydrophobicContact CB-CB 4.19Å; C220-C367 VanDerWaalsContact SG-SG 3.61Å
221	I	97.8	Very high	94.2	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-50.7	179.2	-62.1	-68.6	0	0	0	110.4	R172 R173 N176 D200 I213 C223 T224 L225 Y228	R172-I221 HydrophobicContact CB-CD1 4.41Å; R172-I221 HydrophobicContact CB-CG2 4.35Å; R173-I221 HydrophobicContact CG-CG2 4.12Å; N176-I221 HydrophobicContact CB-CB 3.74Å; N176-I221 HydrophobicContact CB-CG1 3.62Å; N176-I221 PolarHBondContact OD1-N 3.35Å; N176-I221 VanDerWaalsContact OD1-N 3.08Å; D200-I221 HydrophobicContact CB-CD1 4.39Å; I213-I221 HydrophobicContact CD1-CD1 3.59Å; I213-I221 HydrophobicContact CD1-CG1 3.78Å; I221-C223 VanDerWaalsContact C-N 3.28Å; I221-C223 PolarHBondContact O-N 3.16Å; I221-T224 CarbonylContact O-C 3.6Å; I221-T224 PolarHBondContact O-N 2.84Å; I221-T224 PolarHBondContact O-OG1 3.03Å; I221-T224 VanDerWaalsContact O-OG1 3.07Å; I221-L225 PolarHBondContact O-N 3.04Å; I221-Y228 HydrophobicContact CG2-CE2 4.49Å
222	E	96.3	Very high	93.4	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.037	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-56.5	-33.9	177.3	-96.6	61.2	-142.4	0	0	114.4	R173 N176 C220 T224 L225 P365 A366	R173-E222 WeakPolarHBondContact CB-OE1 3.47Å; R173-E222 VanDerWaalsContact CG-OE1 3.24Å; R173-E222 WeakPolarHBondContact CG-OE1 3.39Å; R173-E222 IonicContact CZ-OE1 2.73Å; R173-E222 IonicContact NE-OE1 3.94Å; R173-E222 PolarHBondContact NE-OE1 3.36Å; R173-E222 IonicContact NH2-OE1 2.56Å; R173-E222 PolarHBondContact NH2-OE1 3.24Å; N176-E222 PolarHBondContact ND2-OE2 3.47Å; C220-E222 PolarHBondContact O-N 3.14Å; E222-T224 PolarHBondContact O-N 2.95Å; E222-T224 VanDerWaalsContact O-N 3.12Å; E222-L225 PolarHBondContact O-N 2.61Å; E222-P365 HydrophobicContact CG-CG 4.24Å; E222-A366 HydrophobicContact CB-CB 3.87Å; E222-A366 HydrophobicContact CG-CB 3.83Å
223	C	97.2	Very high	92.6	Very high	5 Å²	5	47.6 Å²	47.6	3%	0.034	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-59.8	-27.3	177.8	-70.7	0	0	0	0	112.4	A219 C220 I221 K361 C364 C367	A219-C223 HydrophobicContact CB-CB 3.84Å; C220-C223 WeakPolarHBondContact O-CB 3.48Å; C220-C223 PolarHBondContact O-N 2.93Å; C220-C223 VanDerWaalsContact SG-SG 3.68Å; I221-C223 VanDerWaalsContact C-N 3.28Å; I221-C223 PolarHBondContact O-N 3.16Å; C223-K361 HydrophobicContact CB-CG 4.45Å; C223-K361 WeakPolarHBondContact O-CD 3.45Å; C223-K361 WeakPolarHBondContact O-CE 3.45Å; C223-K361 PolarHBondContact O-NZ 3.45Å; C223-C364 VanDerWaalsContact SG-SG 3.63Å; C223-C367 VanDerWaalsContact SG-SG 3.63Å
224	T	95.8	Very high	92	Very high	10 Å²	10	50.1 Å²	50.1	6%	0.061	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-120.4	18	-171.3	48.8	0	0	0	0	112.1	R211 C220 I221 E222 E226 L227 A358	R211-T224 PolarHBondContact NH1-OG1 3.45Å; R211-T224 PolarHBondContact NH2-OG1 3.18Å; C220-T224 PolarHBondContact O-OG1 3.36Å; I221-T224 CarbonylContact O-C 3.6Å; I221-T224 PolarHBondContact O-N 2.84Å; I221-T224 PolarHBondContact O-OG1 3.03Å; I221-T224 VanDerWaalsContact O-OG1 3.07Å; E222-T224 PolarHBondContact O-N 2.95Å; E222-T224 VanDerWaalsContact O-N 3.12Å; T224-E226 PolarHBondContact O-N 3.09Å; T224-E226 VanDerWaalsContact O-N 3.13Å; T224-L227 HydrophobicContact CG2-CD1 3.95Å; T224-L227 VanDerWaalsContact O-CB 3.31Å; T224-L227 WeakPolarHBondContact O-CB 3.41Å; T224-L227 PolarHBondContact O-N 3.33Å; T224-A358 HydrophobicContact CG2-CB 3.73Å
225	L	93.5	Very high	91.5	Very high	3 Å²	3	51.3 Å²	51.3	2%	0.016	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-58	-30.2	-177.1	-171.6	64.7	0	0	0	112.8	I169 R173 I221 E222 L227 Y228 Q396	I169-L225 HydrophobicContact CG2-CD1 3.89Å; R173-L225 HydrophobicContact CG-CD1 4.22Å; I221-L225 PolarHBondContact O-N 3.04Å; E222-L225 PolarHBondContact O-N 2.61Å; L225-L227 PolarHBondContact O-N 3.43Å; L225-Y228 HydrophobicContact CD1-CD2 4.07Å; L225-Y228 HydrophobicContact CD1-CE2 4.31Å; L225-Y228 WeakPolarHBondContact O-CD2 3.15Å; L225-Y228 PolarHBondContact O-N 3.13Å; L225-Q396 HydrophobicContact CD2-CB 4.24Å; L225-Q396 HydrophobicContact CD2-CG 4.31Å
226	E	90.6	Very high	91.1	Very high	106 Å²	106	56 Å²	56	50%	0.495	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-71	-13.5	177.4	-67.3	150.4	-158.9	0	0	113.7	T224 Y228 K361	T224-E226 PolarHBondContact O-N 3.09Å; T224-E226 VanDerWaalsContact O-N 3.13Å; E226-Y228 VanDerWaalsContact C-N 3.29Å; E226-K361 IonicContact OE1-NZ 3.35Å; E226-K361 PolarHBondContact OE1-NZ 2.77Å; E226-K361 IonicContact OE2-NZ 3.45Å; E226-K361 PolarHBondContact OE2-NZ 3.4Å
227	L	92.4	Very high	90.8	Very high	97 Å²	97	60 Å²	60	51%	0.508	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-76.7	-17.7	176	-60.7	-174.7	0	0	0	112.6	T224 L225 Y342 F356	T224-L227 HydrophobicContact CG2-CD1 3.95Å; T224-L227 VanDerWaalsContact O-CB 3.31Å; T224-L227 WeakPolarHBondContact O-CB 3.41Å; T224-L227 PolarHBondContact O-N 3.33Å; L225-L227 PolarHBondContact O-N 3.43Å; L227-Y342 HydrophobicContact CD1-CE2 4.1Å; L227-F356 HydrophobicContact CD1-CZ 4.29Å
228	Y	90.3	Very high	90.7	Very high	42 Å²	42	55.2 Å²	55.2	17%	0.165	31%	0.306	C	S	.	.	S	Bend	trans	-68.6	139.6	173.4	-71.1	-74.9	0	0	0	110.2	I169 R172 I221 L225 E226	I169-Y228 HydrophobicContact CD1-CD1 3.66Å; I169-Y228 HydrophobicContact CD1-CD2 4.14Å; I169-Y228 HydrophobicContact CD1-CE1 4.34Å; I169-Y228 HydrophobicContact CD1-CG 3.56Å; I169-Y228 HydrophobicContact CG1-CD1 3.71Å; I169-Y228 HydrophobicContact CG1-CD2 4.3Å; I169-Y228 HydrophobicContact CG1-CE1 3.87Å; I169-Y228 HydrophobicContact CG1-CE2 4.43Å; I169-Y228 HydrophobicContact CG1-CG 3.95Å; I169-Y228 HydrophobicContact CG2-CD2 4.22Å; I169-Y228 HydrophobicContact CG2-CE2 4.17Å; R172-Y228 WeakPolarHBondContact CD-OH 3.31Å; I221-Y228 HydrophobicContact CG2-CE2 4.49Å; L225-Y228 HydrophobicContact CD1-CD2 4.07Å; L225-Y228 HydrophobicContact CD1-CE2 4.31Å; L225-Y228 WeakPolarHBondContact O-CD2 3.15Å; L225-Y228 PolarHBondContact O-N 3.13Å; E226-Y228 VanDerWaalsContact C-N 3.29Å
229	P	87.5	Confident	90.4	Very high	75 Å²	75	53.7 Å²	53.7	49%	0.487	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-62.6	149.8	177.7	27.3	-34.2	0	0	0	110.7	Q231	P229-Q231 PolarHBondContact O-N 2.98Å
230	P	80.8	Confident	90.1	Very high	120 Å²	120	55.4 Å²	55.4	78%	0.779	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-59.4	131.7	175.8	25.5	-33.6	0	0	0	110	V232	P230-V232 PolarHBondContact O-N 3.39Å
231	Q	77.3	Confident	89.9	Confident	126 Å²	126	59.2 Å²	59.2	59%	0.589	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-63.3	131	176.2	-67	-175.9	-0.5	0	0	110.1	P229 N233	P229-Q231 PolarHBondContact O-N 2.98Å; Q231-N233 PolarHBondContact O-N 3.16Å
232	V	80.4	Confident	89.8	Confident	96 Å²	96	65.3 Å²	65.3	58%	0.582	37%	0.368	S	S	*	.			trans	-70	103.4	175	-175.3	0	0	0	0	108.8	P230 F234 R308	P230-V232 PolarHBondContact O-N 3.39Å; V232-F234 HydrophobicContact CG1-CE1 4.11Å; V232-F234 HydrophobicContact CG1-CE2 4.25Å; V232-F234 HydrophobicContact CG1-CZ 3.9Å; V232-R308 PolarHBondContact O-NH1 3.41Å
233	N	82.8	Confident	89.7	Confident	110 Å²	110	65.5 Å²	65.5	59%	0.588	37%	0.369	S	S	*	.			trans	-118.3	115.5	172.6	-77.3	-39	0	0	0	109.2	Q231	Q231-N233 PolarHBondContact O-N 3.16Å
234	F	85.7	Confident	89.7	Confident	54 Å²	54	73.2 Å²	73.2	24%	0.237	40%	0.398	C	S	.	.			trans	-77.6	130.3	177.1	-62.7	-66.5	0	0	0	110.2	V232 M236 I239 E247 H248 E251	V232-F234 HydrophobicContact CG1-CE1 4.11Å; V232-F234 HydrophobicContact CG1-CE2 4.25Å; V232-F234 HydrophobicContact CG1-CZ 3.9Å; F234-M236 PolarHBondContact O-N 3.49Å; F234-I239 HydrophobicContact CB-CD1 3.72Å; F234-I239 HydrophobicContact CB-CG1 3.68Å; F234-I239 WeakPolarHBondContact O-CD1 3.5Å; F234-E247 HydrophobicContact CE2-CB 4.08Å; F234-E247 HydrophobicContact CZ-CB 3.81Å; F234-H248 AromaticContact CD1-CD2 3.54Å; F234-H248 AromaticContact CD1-NE2 3.49Å; F234-H248 WeakPolarHBondContact CD1-NE2 3.38Å; F234-H248 AromaticContact CE1-CD2 3.67Å; F234-H248 AromaticContact CE1-NE2 3.61Å; F234-E251 HydrophobicContact CD2-CB 4.31Å; F234-E251 HydrophobicContact CD2-CG 4.1Å
235	P	89	Confident	89.7	Confident	74 Å²	74	76.7 Å²	76.7	48%	0.481	42%	0.415	S	S	.	.			trans	-61.7	135.6	177.7	-24.6	34.2	0	0	0	112.3	C237 T238 I239	P235-C237 VanDerWaalsContact C-N 3.26Å; P235-C237 PolarHBondContact O-N 3.5Å; P235-C237 VanDerWaalsContact O-N 3.16Å; P235-T238 WeakPolarHBondContact O-CA 3.19Å; P235-T238 WeakPolarHBondContact O-CB 3.46Å; P235-T238 PolarHBondContact O-N 2.91Å; P235-I239 PolarHBondContact O-N 2.84Å
236	M	88.5	Confident	89.9	Confident	99 Å²	99	77.6 Å²	77.6	49%	0.488	42%	0.421	S	S	.	.	H	α-helix	trans	-55.3	-37	-177.8	-75.3	-58.4	-66.8	0	0	113.7	F234 T238 I239 A240 M255 L256	F234-M236 PolarHBondContact O-N 3.49Å; M236-T238 VanDerWaalsContact C-N 3.33Å; M236-T238 PolarHBondContact O-N 3.35Å; M236-I239 PolarHBondContact O-N 3.33Å; M236-I239 HydrophobicContact SD-CD1 4.22Å; M236-A240 VanDerWaalsContact O-CB 3.24Å; M236-A240 WeakPolarHBondContact O-CB 3.08Å; M236-A240 PolarHBondContact O-N 3.23Å; M236-M255 HydrophobicContact SD-CE 4.13Å; M236-L256 HydrophobicContact CE-CD1 3.99Å; M236-L256 HydrophobicContact CE-CD2 3.82Å; M236-L256 HydrophobicContact CE-CG 4.16Å
237	C	90.8	Very high	90.3	Very high	88 Å²	88	75.1 Å²	75.1	60%	0.595	41%	0.41	S	S	*	.	H	α-helix	trans	-62.7	-37.9	176	59.1	0	0	0	0	112.8	P235 S241 M242	P235-C237 VanDerWaalsContact C-N 3.26Å; P235-C237 PolarHBondContact O-N 3.5Å; P235-C237 VanDerWaalsContact O-N 3.16Å; C237-S241 WeakPolarHBondContact O-CB 3.31Å; C237-S241 PolarHBondContact O-N 3.06Å; C237-M242 PolarHBondContact O-N 3.22Å
238	T	93.1	Very high	90.5	Very high	13 Å²	13	71 Å²	71	8%	0.08	39%	0.388	C	S	.	.	H	α-helix	trans	-70.2	-45.9	176.6	-64.4	0	0	0	0	110.1	P235 M236 M242 P243 R244 H248	P235-T238 WeakPolarHBondContact O-CA 3.19Å; P235-T238 WeakPolarHBondContact O-CB 3.46Å; P235-T238 PolarHBondContact O-N 2.91Å; M236-T238 VanDerWaalsContact C-N 3.33Å; M236-T238 PolarHBondContact O-N 3.35Å; T238-M242 WeakPolarHBondContact CG2-O 3.4Å; T238-M242 CarbonylContact O-C 3.47Å; T238-M242 PolarHBondContact O-N 3.31Å; T238-P243 VanDerWaalsContact O-N 3.13Å; T238-R244 PolarHBondContact OG1-NH2 3.01Å; T238-H248 VanDerWaalsContact CG2-CE1 3.43Å; T238-H248 WeakPolarHBondContact CG2-CE1 3.13Å; T238-H248 WeakPolarHBondContact CG2-ND1 3.37Å
239	I	92.6	Very high	90.9	Very high	0 Å²	0	69 Å²	69	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-60.8	-49.1	179.1	-61.2	175.1	0	0	0	110.5	F234 P235 M236 E251 Y252 M255 L256 R288	F234-I239 HydrophobicContact CB-CD1 3.72Å; F234-I239 HydrophobicContact CB-CG1 3.68Å; F234-I239 WeakPolarHBondContact O-CD1 3.5Å; P235-I239 PolarHBondContact O-N 2.84Å; M236-I239 PolarHBondContact O-N 3.33Å; M236-I239 HydrophobicContact SD-CD1 4.22Å; I239-E251 HydrophobicContact CD1-CB 4.42Å; I239-E251 HydrophobicContact CD1-CG 3.77Å; I239-E251 HydrophobicContact CG1-CG 4.48Å; I239-Y252 VanDerWaalsContact CG2-CA 3.46Å; I239-Y252 HydrophobicContact CG2-CD2 4.34Å; I239-M255 HydrophobicContact CD1-CE 3.19Å; I239-L256 HydrophobicContact CG2-CD1 4.44Å; I239-R288 PolarHBondContact O-NH2 3.15Å
240	A	92.4	Very high	91.4	Very high	36 Å²	36	65.4 Å²	65.4	30%	0.298	36%	0.357	S	S	.	.	H	α-helix	trans	-75.6	-44.5	-171.8	0	0	0	0	0	113.1	M236 L256 R288	M236-A240 VanDerWaalsContact O-CB 3.24Å; M236-A240 WeakPolarHBondContact O-CB 3.08Å; M236-A240 PolarHBondContact O-N 3.23Å; A240-L256 HydrophobicContact CB-CD1 4.26Å; A240-R288 PolarHBondContact O-NH2 3.26Å
241	S	92.9	Very high	92.2	Very high	80 Å²	80	59.9 Å²	59.9	56%	0.559	32%	0.321	S	S	*	.	H	α-helix	trans	-120	-25.9	-164.3	-54.7	0	0	0	0	115.1	C237	C237-S241 WeakPolarHBondContact O-CB 3.31Å; C237-S241 PolarHBondContact O-N 3.06Å
242	M	95	Very high	93.2	Very high	130 Å²	130	56.5 Å²	56.5	64%	0.64	30%	0.303	S	S	*	.			trans	-134.6	58.5	-173.4	-59	178.4	73.7	0	0	111.9	C237 T238	C237-M242 PolarHBondContact O-N 3.22Å; T238-M242 WeakPolarHBondContact CG2-O 3.4Å; T238-M242 CarbonylContact O-C 3.47Å; T238-M242 PolarHBondContact O-N 3.31Å
243	P	96.1	Very high	94	Very high	11 Å²	11	51.9 Å²	51.9	7%	0.071	28%	0.275	C	S	.	.			trans	-64.7	147.7	176.3	32	-36.6	0	0	0	109.8	T238 H248 Y292 I294	T238-P243 VanDerWaalsContact O-N 3.13Å; P243-H248 HydrophobicContact CB-CB 3.85Å; P243-Y292 HydrophobicContact CG-CD1 3.47Å; P243-Y292 VanDerWaalsContact CG-CD1 3.47Å; P243-Y292 HydrophobicContact CG-CD2 3.57Å; P243-Y292 HydrophobicContact CG-CE1 3.69Å; P243-Y292 HydrophobicContact CG-CE2 3.8Å; P243-Y292 HydrophobicContact CG-CG 3.4Å; P243-Y292 VanDerWaalsContact CG-CG 3.4Å; P243-I294 HydrophobicContact CB-CD1 3.76Å; P243-I294 HydrophobicContact CG-CD1 4.11Å
244	R	95.9	Very high	94.6	Very high	168 Å²	168	49.9 Å²	49.9	63%	0.634	26%	0.259	S	S	*	.			trans	-142.1	-33.2	-171.4	-71	175.7	-77	168.4	-1.7	111.9	T238 H248	T238-R244 PolarHBondContact OG1-NH2 3.01Å; R244-H248 PolarHBondContact N-ND1 3.25Å
245	L	96.9	Very high	95.1	Very high	83 Å²	83	50.5 Å²	50.5	44%	0.435	26%	0.263	S	S	.	.	S	Bend	trans	-113.5	153.3	178.7	-57.5	178.3	0	0	0	109.7	E247 H248	L245-E247 VanDerWaalsContact CB-OE2 3.28Å; L245-E247 WeakPolarHBondContact CB-OE2 3.14Å; L245-E247 PolarHBondContact O-N 2.94Å; L245-H248 PolarHBondContact N-ND1 3.08Å; L245-H248 WeakPolarHBondContact O-CB 3.37Å; L245-H248 PolarHBondContact O-N 3.4Å
246	P	97.9	Very high	95.4	Very high	21 Å²	21	49.7 Å²	49.7	14%	0.136	26%	0.255	C	S	.	.	H	α-helix	trans	-58.5	-30.7	176.4	23.3	-32.8	0	0	0	112.7	H248 C249 I250 I294 V297 L301	P246-H248 VanDerWaalsContact C-N 3.3Å; P246-H248 PolarHBondContact O-N 3.03Å; P246-C249 WeakPolarHBondContact O-CB 3.24Å; P246-C249 PolarHBondContact O-N 3.43Å; P246-C249 VanDerWaalsContact O-N 3.14Å; P246-I250 PolarHBondContact O-N 2.94Å; P246-I250 VanDerWaalsContact O-N 3.16Å; P246-I294 HydrophobicContact CB-CG2 4.27Å; P246-V297 HydrophobicContact CB-CB 4.43Å; P246-V297 HydrophobicContact CB-CG2 3.58Å; P246-L301 HydrophobicContact CB-CD2 3.71Å; P246-L301 HydrophobicContact CG-CD2 3.66Å
247	E	97.3	Very high	95.8	Very high	55 Å²	55	46 Å²	46	26%	0.257	24%	0.236	S	C	.	.	H	α-helix	trans	-60.1	-37.7	173.3	-63.3	84	170.6	0	0	111.9	F234 L245 C249 I250 E251 L301 V305	F234-E247 HydrophobicContact CE2-CB 4.08Å; F234-E247 HydrophobicContact CZ-CB 3.81Å; L245-E247 VanDerWaalsContact CB-OE2 3.28Å; L245-E247 WeakPolarHBondContact CB-OE2 3.14Å; L245-E247 PolarHBondContact O-N 2.94Å; E247-C249 VanDerWaalsContact C-N 3.26Å; E247-C249 PolarHBondContact O-N 3.26Å; E247-I250 PolarHBondContact O-N 3.41Å; E247-E251 VanDerWaalsContact O-CB 3.31Å; E247-E251 WeakPolarHBondContact O-CB 3.19Å; E247-E251 PolarHBondContact O-N 3.11Å; E247-L301 HydrophobicContact CG-CD1 4.17Å; E247-L301 HydrophobicContact CG-CD2 4.48Å; E247-V305 HydrophobicContact CB-CG2 4.1Å; E247-V305 HydrophobicContact CG-CG2 3.77Å
248	H	97.7	Very high	96.1	Very high	9 Å²	9	42.3 Å²	42.3	4%	0.042	21%	0.21	C	C	.	.	H	α-helix	trans	-64.5	-34.1	177.5	-57.9	172.3	0	0	0	111.5	F234 T238 P243 R244 L245 P246 Y252	F234-H248 AromaticContact CD1-CD2 3.54Å; F234-H248 AromaticContact CD1-NE2 3.49Å; F234-H248 WeakPolarHBondContact CD1-NE2 3.38Å; F234-H248 AromaticContact CE1-CD2 3.67Å; F234-H248 AromaticContact CE1-NE2 3.61Å; T238-H248 VanDerWaalsContact CG2-CE1 3.43Å; T238-H248 WeakPolarHBondContact CG2-CE1 3.13Å; T238-H248 WeakPolarHBondContact CG2-ND1 3.37Å; P243-H248 HydrophobicContact CB-CB 3.85Å; R244-H248 PolarHBondContact N-ND1 3.25Å; L245-H248 PolarHBondContact N-ND1 3.08Å; L245-H248 WeakPolarHBondContact O-CB 3.37Å; L245-H248 PolarHBondContact O-N 3.4Å; P246-H248 VanDerWaalsContact C-N 3.3Å; P246-H248 PolarHBondContact O-N 3.03Å; H248-Y252 PolarHBondContact O-N 3Å; H248-Y252 VanDerWaalsContact O-N 3.14Å
249	C	98	Very high	96.3	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-68	-46.1	176.6	-60.7	0	0	0	0	110.7	P246 E247 Y252 V253 R288 A289 V297	P246-C249 WeakPolarHBondContact O-CB 3.24Å; P246-C249 PolarHBondContact O-N 3.43Å; P246-C249 VanDerWaalsContact O-N 3.14Å; E247-C249 VanDerWaalsContact C-N 3.26Å; E247-C249 PolarHBondContact O-N 3.26Å; C249-Y252 PolarHBondContact O-N 2.79Å; C249-V253 WeakPolarHBondContact O-CG2 3.29Å; C249-V253 PolarHBondContact O-N 3.44Å; C249-R288 HydrophobicContact CB-CB 4.42Å; C249-R288 HydrophobicContact CB-CG 4.32Å; C249-A289 HydrophobicContact CB-CB 4.26Å; C249-V297 HydrophobicContact CB-CG2 4.46Å
250	I	98.3	Very high	96.5	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.5	-44.8	178.6	-61.7	156.9	0	0	0	110.9	P246 E247 Y252 V253 R254 I281 S285 V297 L301 T302 V305 V306	P246-I250 PolarHBondContact O-N 2.94Å; P246-I250 VanDerWaalsContact O-N 3.16Å; E247-I250 PolarHBondContact O-N 3.41Å; I250-Y252 VanDerWaalsContact C-N 3.3Å; I250-Y252 PolarHBondContact O-N 2.92Å; I250-V253 PolarHBondContact O-N 3.38Å; I250-V253 VanDerWaalsContact O-N 3.11Å; I250-R254 WeakPolarHBondContact O-CB 3.23Å; I250-R254 PolarHBondContact O-N 3.38Å; I250-I281 HydrophobicContact CG2-CG2 4.05Å; I250-S285 WeakPolarHBondContact CA-OG 3.47Å; I250-V297 HydrophobicContact CG1-CG1 4.44Å; I250-L301 HydrophobicContact CD1-CB 4.3Å; I250-L301 HydrophobicContact CD1-CD2 3.97Å; I250-L301 HydrophobicContact CD1-CG 3.75Å; I250-T302 HydrophobicContact CG2-CG2 4.15Å; I250-V305 HydrophobicContact CB-CB 4.3Å; I250-V305 HydrophobicContact CB-CG1 4.08Å; I250-V305 HydrophobicContact CD1-CG2 4.14Å; I250-V305 HydrophobicContact CG2-CB 3.75Å; I250-V305 HydrophobicContact CG2-CG1 3.65Å; I250-V305 HydrophobicContact CG2-CG2 4.46Å; I250-V306 HydrophobicContact CG2-CG2 4.19Å
251	E	96.9	Very high	96.7	Very high	5 Å²	5	56.1 Å²	56.1	2%	0.023	27%	0.271	C	S	.	.	H	α-helix	trans	-63.8	-36.3	-179.1	-162.5	65.8	-156.2	0	0	112	F234 I239 E247 R254 M255 V305 R308	F234-E251 HydrophobicContact CD2-CB 4.31Å; F234-E251 HydrophobicContact CD2-CG 4.1Å; I239-E251 HydrophobicContact CD1-CB 4.42Å; I239-E251 HydrophobicContact CD1-CG 3.77Å; I239-E251 HydrophobicContact CG1-CG 4.48Å; E247-E251 VanDerWaalsContact O-CB 3.31Å; E247-E251 WeakPolarHBondContact O-CB 3.19Å; E247-E251 PolarHBondContact O-N 3.11Å; E251-R254 IonicContact OE1-CZ 3.72Å; E251-R254 IonicContact OE1-NH1 2.76Å; E251-R254 PolarHBondContact OE1-NH1 2.98Å; E251-M255 HydrophobicContact CG-CE 3.5Å; E251-M255 HydrophobicContact CG-CG 4.27Å; E251-M255 HydrophobicContact CG-SD 4.44Å; E251-M255 WeakPolarHBondContact O-CB 3.46Å; E251-M255 PolarHBondContact O-N 3.24Å; E251-M255 WeakPolarHBondContact OE1-CE 3.4Å; E251-M255 WeakPolarHBondContact OE1-CG 3.48Å; E251-M255 VanDerWaalsContact OE1-SD 3.35Å; E251-V305 WeakPolarHBondContact OE2-CG1 3.37Å; E251-R308 IonicContact OE1-NH2 2.7Å
252	Y	98.1	Very high	96.8	Very high	54 Å²	54	56 Å²	56	21%	0.212	26%	0.262	C	S	.	.	H	α-helix	trans	-60.7	-47.5	172.4	171.9	-89.3	0	0	0	111.7	I239 H248 C249 I250 R254 L256 Q257 R288	I239-Y252 VanDerWaalsContact CG2-CA 3.46Å; I239-Y252 HydrophobicContact CG2-CD2 4.34Å; H248-Y252 PolarHBondContact O-N 3Å; H248-Y252 VanDerWaalsContact O-N 3.14Å; C249-Y252 PolarHBondContact O-N 2.79Å; I250-Y252 VanDerWaalsContact C-N 3.3Å; I250-Y252 PolarHBondContact O-N 2.92Å; Y252-R254 VanDerWaalsContact C-N 3.33Å; Y252-R254 PolarHBondContact O-N 2.9Å; Y252-L256 HydrophobicContact CD2-CB 4.06Å; Y252-L256 HydrophobicContact CD2-CD1 3.59Å; Y252-L256 HydrophobicContact CD2-CG 4.4Å; Y252-L256 HydrophobicContact CE2-CB 4.01Å; Y252-L256 HydrophobicContact CE2-CD1 3.76Å; Y252-L256 WeakPolarHBondContact O-CA 3.45Å; Y252-L256 WeakPolarHBondContact O-CB 3.21Å; Y252-L256 PolarHBondContact O-N 3.01Å; Y252-Q257 HydrophobicContact CD1-CB 4.25Å; Y252-Q257 HydrophobicContact CE1-CB 3.86Å; Y252-Q257 HydrophobicContact CE1-CG 4.37Å; Y252-Q257 PolarHBondContact O-N 2.86Å; Y252-Q257 VanDerWaalsContact O-N 3.08Å; Y252-R288 VanDerWaalsContact CB-NE 3.28Å; Y252-R288 VanDerWaalsContact CD1-CZ 3.46Å; Y252-R288 VanDerWaalsContact CG-NE 3.25Å
253	V	98	Very high	96.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.244	C	C	.	.	I	π-helix	trans	-63.3	-46.7	-177.2	175.5	0	0	0	0	109.6	C249 I250 Q257 W258 W280 I281 K284	C249-V253 WeakPolarHBondContact O-CG2 3.29Å; C249-V253 PolarHBondContact O-N 3.44Å; I250-V253 PolarHBondContact O-N 3.38Å; I250-V253 VanDerWaalsContact O-N 3.11Å; V253-Q257 HydrophobicContact CG1-CB 4.44Å; V253-Q257 PolarHBondContact O-N 2.92Å; V253-W258 WeakPolarHBondContact O-CB 3.41Å; V253-W258 PolarHBondContact O-N 2.89Å; V253-W280 HydrophobicContact CG1-CE3 4.18Å; V253-W280 HydrophobicContact CG1-CH2 4.33Å; V253-W280 HydrophobicContact CG1-CZ3 3.57Å; V253-I281 HydrophobicContact CB-CG2 4.21Å; V253-I281 HydrophobicContact CG1-CB 4.15Å; V253-I281 HydrophobicContact CG1-CG1 4.11Å; V253-I281 HydrophobicContact CG1-CG2 3.87Å; V253-K284 HydrophobicContact CB-CB 4.41Å; V253-K284 HydrophobicContact CG1-CB 3.65Å; V253-K284 HydrophobicContact CG1-CG 4.45Å; V253-K284 HydrophobicContact CG2-CB 3.78Å
254	R	96.4	Very high	97	Very high	68 Å²	68	54.5 Å²	54.5	26%	0.257	26%	0.255	S	S	.	.	I	π-helix	trans	-59.5	-50.8	177.1	172.2	-179	175.5	-75.3	-17.2	113.2	I250 E251 Y252 L270	I250-R254 WeakPolarHBondContact O-CB 3.23Å; I250-R254 PolarHBondContact O-N 3.38Å; E251-R254 IonicContact OE1-CZ 3.72Å; E251-R254 IonicContact OE1-NH1 2.76Å; E251-R254 PolarHBondContact OE1-NH1 2.98Å; Y252-R254 VanDerWaalsContact C-N 3.33Å; Y252-R254 PolarHBondContact O-N 2.9Å; R254-L270 HydrophobicContact CB-CD2 4.37Å; R254-L270 HydrophobicContact CG-CD2 3.72Å
255	M	94.4	Very high	96.9	Very high	66 Å²	66	48.1 Å²	48.1	33%	0.325	24%	0.241	S	C	.	.	I	π-helix	trans	-91.3	-28.2	-169.4	-68.7	-151.1	-69.9	0	0	114.8	M236 I239 E251 P259	M236-M255 HydrophobicContact SD-CE 4.13Å; I239-M255 HydrophobicContact CD1-CE 3.19Å; E251-M255 HydrophobicContact CG-CE 3.5Å; E251-M255 HydrophobicContact CG-CG 4.27Å; E251-M255 HydrophobicContact CG-SD 4.44Å; E251-M255 WeakPolarHBondContact O-CB 3.46Å; E251-M255 PolarHBondContact O-N 3.24Å; E251-M255 WeakPolarHBondContact OE1-CE 3.4Å; E251-M255 WeakPolarHBondContact OE1-CG 3.48Å; E251-M255 VanDerWaalsContact OE1-SD 3.35Å; M255-P259 WeakPolarHBondContact O-CG 3.39Å
256	L	95.7	Very high	96.8	Very high	57 Å²	57	52.6 Å²	52.6	30%	0.298	26%	0.26	S	S	.	.	I	π-helix	trans	-116.6	-48.5	-173.2	-68.5	175.5	0	0	0	112.1	M236 I239 A240 Y252 K260	M236-L256 HydrophobicContact CE-CD1 3.99Å; M236-L256 HydrophobicContact CE-CD2 3.82Å; M236-L256 HydrophobicContact CE-CG 4.16Å; I239-L256 HydrophobicContact CG2-CD1 4.44Å; A240-L256 HydrophobicContact CB-CD1 4.26Å; Y252-L256 HydrophobicContact CD2-CB 4.06Å; Y252-L256 HydrophobicContact CD2-CD1 3.59Å; Y252-L256 HydrophobicContact CD2-CG 4.4Å; Y252-L256 HydrophobicContact CE2-CB 4.01Å; Y252-L256 HydrophobicContact CE2-CD1 3.76Å; Y252-L256 WeakPolarHBondContact O-CA 3.45Å; Y252-L256 WeakPolarHBondContact O-CB 3.21Å; Y252-L256 PolarHBondContact O-N 3.01Å; L256-K260 VanDerWaalsContact O-CB 3.28Å; L256-K260 WeakPolarHBondContact O-CB 2.98Å; L256-K260 PolarHBondContact O-N 2.95Å
257	Q	97.2	Very high	96.6	Very high	22 Å²	22	54.8 Å²	54.8	10%	0.103	29%	0.286	C	S	.	.	I	π-helix	trans	-73.9	-42.8	-174.6	-160.7	171.3	-12.2	0	0	112.4	Y252 V253 K260 E261 W280	Y252-Q257 HydrophobicContact CD1-CB 4.25Å; Y252-Q257 HydrophobicContact CE1-CB 3.86Å; Y252-Q257 HydrophobicContact CE1-CG 4.37Å; Y252-Q257 PolarHBondContact O-N 2.86Å; Y252-Q257 VanDerWaalsContact O-N 3.08Å; V253-Q257 HydrophobicContact CG1-CB 4.44Å; V253-Q257 PolarHBondContact O-N 2.92Å; Q257-K260 PolarHBondContact O-N 3.42Å; Q257-E261 HydrophobicContact CG-CG 4.24Å; Q257-E261 WeakPolarHBondContact CG-OE1 3.38Å; Q257-E261 PolarHBondContact NE2-OE1 3.16Å; Q257-E261 PolarHBondContact O-N 3.48Å; Q257-W280 HydrophobicContact CG-CH2 4.15Å
258	W	97.9	Very high	96.5	Very high	11 Å²	11	55 Å²	55	4%	0.042	29%	0.291	C	S	.	.	H	α-helix	trans	-58.8	-53.6	178.6	178.2	-70.3	0	0	0	112.4	V253 K260 E261 Q262 P263 F264 V268 L270 H277 W280 I281	V253-W258 WeakPolarHBondContact O-CB 3.41Å; V253-W258 PolarHBondContact O-N 2.89Å; W258-K260 PolarHBondContact O-N 2.64Å; W258-E261 PolarHBondContact O-N 3.25Å; W258-Q262 PolarHBondContact O-N 2.85Å; W258-P263 HydrophobicContact CD2-CG 3.96Å; W258-P263 HydrophobicContact CE3-CG 3.68Å; W258-P263 HydrophobicContact CH2-CG 4.09Å; W258-P263 HydrophobicContact CZ2-CG 4.36Å; W258-P263 HydrophobicContact CZ3-CG 3.75Å; W258-F264 AromaticContact CH2-CD2 3.44Å; W258-F264 HydrophobicContact CH2-CD2 3.44Å; W258-F264 VanDerWaalsContact CH2-CD2 3.44Å; W258-F264 AromaticContact CH2-CE2 3.85Å; W258-F264 HydrophobicContact CH2-CE2 3.85Å; W258-F264 HydrophobicContact CH2-CG 4.36Å; W258-F264 HydrophobicContact CZ2-CD2 4.21Å; W258-F264 AromaticContact CZ3-CD2 3.96Å; W258-F264 HydrophobicContact CZ3-CD2 3.96Å; W258-F264 AromaticContact CZ3-CE2 3.98Å; W258-F264 HydrophobicContact CZ3-CE2 3.98Å; W258-V268 PolarHBondContact NE1-O 3.08Å; W258-L270 HydrophobicContact CD2-CB 3.89Å; W258-L270 HydrophobicContact CD2-CD1 4.1Å; W258-L270 HydrophobicContact CD2-CG 4.45Å; W258-L270 HydrophobicContact CE3-CB 4.49Å; W258-L270 HydrophobicContact CE3-CD1 3.82Å; W258-L270 HydrophobicContact CG-CB 4.2Å; W258-L270 HydrophobicContact CH2-CD1 3.84Å; W258-L270 HydrophobicContact CZ2-CB 4.02Å; W258-L270 HydrophobicContact CZ2-CD1 4.12Å; W258-L270 HydrophobicContact CZ3-CD1 3.68Å; W258-H277 HydrophobicContact CH2-CB 3.78Å; W258-H277 AromaticContact CH2-CD2 3.58Å; W258-H277 AromaticContact CH2-CE1 3.88Å; W258-H277 AromaticContact CH2-CG 3.4Å; W258-H277 VanDerWaalsContact CH2-CG 3.4Å; W258-H277 AromaticContact CH2-ND1 3.63Å; W258-H277 AromaticContact CH2-NE2 3.82Å; W258-H277 HydrophobicContact CZ3-CB 4.02Å; W258-W280 HydrophobicContact CB-CZ3 4.3Å; W258-W280 AromaticContact CE3-CE3 3.67Å; W258-W280 HydrophobicContact CE3-CE3 3.67Å; W258-W280 AromaticContact CE3-CZ3 3.77Å; W258-W280 HydrophobicContact CE3-CZ3 3.77Å; W258-W280 AromaticContact CZ3-CE3 3.96Å; W258-W280 HydrophobicContact CZ3-CE3 3.96Å; W258-W280 HydrophobicContact CZ3-CZ3 4.49Å; W258-I281 HydrophobicContact CE3-CD1 4.24Å; W258-I281 HydrophobicContact CE3-CG1 4.05Å; W258-I281 HydrophobicContact CZ3-CG1 4.33Å
259	P	96.1	Very high	96.4	Very high	73 Å²	73	59.2 Å²	59.2	47%	0.474	32%	0.319	S	S	.	.	H	α-helix	trans	-62.2	-26.6	178	-25	36.8	0	0	0	113.7	M255	M255-P259 WeakPolarHBondContact O-CG 3.39Å
260	K	96.5	Very high	96.4	Very high	170 Å²	170	61.3 Å²	61.3	74%	0.739	33%	0.33	S	S	*	.	H	α-helix	trans	-79.2	-42.1	-179.4	-176.8	-179.7	178.2	-176.7	0	113.1	L256 Q257 W258	L256-K260 VanDerWaalsContact O-CB 3.28Å; L256-K260 WeakPolarHBondContact O-CB 2.98Å; L256-K260 PolarHBondContact O-N 2.95Å; Q257-K260 PolarHBondContact O-N 3.42Å; W258-K260 PolarHBondContact O-N 2.64Å
261	E	96.9	Very high	96.2	Very high	96 Å²	96	64.9 Å²	64.9	45%	0.449	35%	0.349	S	S	.	.	H	α-helix	trans	-94.1	-22	-174.2	-69.6	-177	-154.7	0	0	113.2	Q257 W258 W280	Q257-E261 HydrophobicContact CG-CG 4.24Å; Q257-E261 WeakPolarHBondContact CG-OE1 3.38Å; Q257-E261 PolarHBondContact NE2-OE1 3.16Å; Q257-E261 PolarHBondContact O-N 3.48Å; W258-E261 PolarHBondContact O-N 3.25Å; E261-W280 HydrophobicContact CB-CZ2 4.44Å; E261-W280 WeakPolarHBondContact OE2-CZ2 3.37Å
262	Q	96.1	Very high	96.1	Very high	76 Å²	76	65.4 Å²	65.4	36%	0.355	36%	0.356	S	S	.	.			trans	46.3	57.5	-179.3	-59.7	179.7	-1.3	0	0	112.4	W258 F264 G265 E266	W258-Q262 PolarHBondContact O-N 2.85Å; Q262-F264 PolarHBondContact O-N 3.39Å; Q262-G265 PolarHBondContact O-N 3.4Å; Q262-E266 VanDerWaalsContact OE1-CB 3.3Å; Q262-E266 VanDerWaalsContact OE1-CG 3.28Å
263	P	96.8	Very high	95.8	Very high	43 Å²	43	67.3 Å²	67.3	28%	0.279	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-21	-162.3	20.9	-31.6	0	0	0	115.7	W258 W280	W258-P263 HydrophobicContact CD2-CG 3.96Å; W258-P263 HydrophobicContact CE3-CG 3.68Å; W258-P263 HydrophobicContact CH2-CG 4.09Å; W258-P263 HydrophobicContact CZ2-CG 4.36Å; W258-P263 HydrophobicContact CZ3-CG 3.75Å; P263-W280 HydrophobicContact CB-CD2 3.89Å; P263-W280 HydrophobicContact CB-CG 4.23Å; P263-W280 HydrophobicContact CB-CH2 4.34Å; P263-W280 HydrophobicContact CB-CZ2 3.64Å; P263-W280 HydrophobicContact CG-CD2 3.78Å; P263-W280 HydrophobicContact CG-CE3 3.94Å; P263-W280 HydrophobicContact CG-CG 4.43Å; P263-W280 HydrophobicContact CG-CH2 3.84Å; P263-W280 HydrophobicContact CG-CZ2 3.66Å; P263-W280 HydrophobicContact CG-CZ3 3.98Å
264	F	97.4	Very high	95.7	Very high	68 Å²	68	69.5 Å²	69.5	30%	0.298	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112	15.7	-179.3	-69.2	-99.5	0	0	0	112.7	W258 Q262 V268 E276 H277 W280	W258-F264 AromaticContact CH2-CD2 3.44Å; W258-F264 HydrophobicContact CH2-CD2 3.44Å; W258-F264 VanDerWaalsContact CH2-CD2 3.44Å; W258-F264 AromaticContact CH2-CE2 3.85Å; W258-F264 HydrophobicContact CH2-CE2 3.85Å; W258-F264 HydrophobicContact CH2-CG 4.36Å; W258-F264 HydrophobicContact CZ2-CD2 4.21Å; W258-F264 AromaticContact CZ3-CD2 3.96Å; W258-F264 HydrophobicContact CZ3-CD2 3.96Å; W258-F264 AromaticContact CZ3-CE2 3.98Å; W258-F264 HydrophobicContact CZ3-CE2 3.98Å; Q262-F264 PolarHBondContact O-N 3.39Å; F264-V268 HydrophobicContact CB-CG1 4.17Å; F264-V268 WeakPolarHBondContact O-CG2 3.29Å; F264-E276 HydrophobicContact CE1-CB 3.8Å; F264-E276 HydrophobicContact CZ-CB 3.96Å; F264-H277 AromaticContact CD1-CD2 3.65Å; F264-H277 AromaticContact CD1-NE2 3.74Å; F264-H277 AromaticContact CD2-CD2 3.52Å; F264-H277 AromaticContact CD2-NE2 3.81Å; F264-H277 AromaticContact CE1-CD2 3.71Å; F264-H277 AromaticContact CE2-CD2 3.61Å; F264-H277 AromaticContact CG-CD2 3.56Å; F264-H277 AromaticContact CG-NE2 3.49Å; F264-H277 WeakPolarHBondContact CG-NE2 3.39Å; F264-H277 AromaticContact CZ-CD2 3.71Å; F264-W280 HydrophobicContact CE2-CB 3.8Å; F264-W280 HydrophobicContact CE2-CG 4.03Å; F264-W280 HydrophobicContact CZ-CB 4.13Å
265	G	94.9	Very high	95.6	Very high	33 Å²	33	70.4 Å²	70.4	34%	0.34	40%	0.396	S	S	.	.	S	Bend	trans	116.4	155.9	177.9	0	0	0	0	0	113.4	Q262 G267 V268	Q262-G265 PolarHBondContact O-N 3.4Å; G265-G267 PolarHBondContact O-N 3.44Å; G265-V268 WeakPolarHBondContact O-CB 3.48Å; G265-V268 PolarHBondContact O-N 2.83Å
266	E	95	Very high	95.8	Very high	178 Å²	178	73.5 Å²	73.5	83%	0.832	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	128	-177.5	179.2	169.2	-164.5	0	0	111.8	Q262 V268	Q262-E266 VanDerWaalsContact OE1-CB 3.3Å; Q262-E266 VanDerWaalsContact OE1-CG 3.28Å; E266-V268 VanDerWaalsContact C-N 3.28Å; E266-V268 PolarHBondContact O-N 3.39Å
267	G	93	Very high	95.9	Very high	66 Å²	66	71.3 Å²	71.3	68%	0.68	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	-3.1	-177.7	0	0	0	0	0	115.6	G265 P269	G265-G267 PolarHBondContact O-N 3.44Å; G267-P269 VanDerWaalsContact O-CD 3.3Å; G267-P269 WeakPolarHBondContact O-CD 3.23Å
268	V	95.7	Very high	95.9	Very high	59 Å²	59	70.3 Å²	70.3	36%	0.358	39%	0.394	S	S	.	.			trans	-73.2	115.2	177.2	-179.3	0	0	0	0	109.9	W258 F264 G265 E266	W258-V268 PolarHBondContact NE1-O 3.08Å; F264-V268 HydrophobicContact CB-CG1 4.17Å; F264-V268 WeakPolarHBondContact O-CG2 3.29Å; G265-V268 WeakPolarHBondContact O-CB 3.48Å; G265-V268 PolarHBondContact O-N 2.83Å; E266-V268 VanDerWaalsContact C-N 3.28Å; E266-V268 PolarHBondContact O-N 3.39Å
269	P	95.9	Very high	96	Very high	98 Å²	98	74 Å²	74	64%	0.636	41%	0.411	S	S	*	.			trans	-72.2	158.1	179.9	31.5	-35	0	0	0	111.1	G267 D271	G267-P269 VanDerWaalsContact O-CD 3.3Å; G267-P269 WeakPolarHBondContact O-CD 3.23Å; P269-D271 PolarHBondContact O-N 3.38Å; P269-D271 VanDerWaalsContact O-N 3.15Å
270	L	97	Very high	96.1	Very high	45 Å²	45	72.8 Å²	72.8	24%	0.236	40%	0.397	C	S	.	.			trans	-67.3	112.5	170	172.1	58	0	0	0	109.9	R254 W258 H277 I281 V306	R254-L270 HydrophobicContact CB-CD2 4.37Å; R254-L270 HydrophobicContact CG-CD2 3.72Å; W258-L270 HydrophobicContact CD2-CB 3.89Å; W258-L270 HydrophobicContact CD2-CD1 4.1Å; W258-L270 HydrophobicContact CD2-CG 4.45Å; W258-L270 HydrophobicContact CE3-CB 4.49Å; W258-L270 HydrophobicContact CE3-CD1 3.82Å; W258-L270 HydrophobicContact CG-CB 4.2Å; W258-L270 HydrophobicContact CH2-CD1 3.84Å; W258-L270 HydrophobicContact CZ2-CB 4.02Å; W258-L270 HydrophobicContact CZ2-CD1 4.12Å; W258-L270 HydrophobicContact CZ3-CD1 3.68Å; L270-H277 HydrophobicContact CD1-CB 3.96Å; L270-I281 HydrophobicContact CD1-CD1 3.42Å; L270-I281 VanDerWaalsContact CD1-CD1 3.42Å; L270-I281 HydrophobicContact CD1-CG1 4.42Å; L270-I281 HydrophobicContact CD2-CD1 3.49Å; L270-I281 VanDerWaalsContact CD2-CD1 3.49Å; L270-I281 HydrophobicContact CG-CD1 4.09Å; L270-V306 HydrophobicContact CD2-CG1 3.99Å; L270-V306 HydrophobicContact CG-CG1 4.42Å
271	D	95.4	Very high	96.2	Very high	74 Å²	74	64.7 Å²	64.7	40%	0.396	36%	0.362	S	S	.	.			trans	-89.6	121.5	164.7	-171.2	-5.3	0	0	0	110.4	P269 D273 D274 H277	P269-D271 PolarHBondContact O-N 3.38Å; P269-D271 VanDerWaalsContact O-N 3.15Å; D271-D273 VanDerWaalsContact C-N 3.3Å; D271-D273 WeakPolarHBondContact OD1-CB 3.36Å; D271-D273 PolarHBondContact OD1-N 2.84Å; D271-D274 HydrophobicContact CB-CB 3.9Å; D271-H277 WeakPolarHBondContact CB-ND1 3.48Å; D271-H277 PolarHBondContact N-ND1 2.97Å; D271-H277 WeakPolarHBondContact O-CB 3.35Å; D271-H277 PolarHBondContact O-ND1 3.05Å
272	G	94.3	Very high	96.3	Very high	16 Å²	16	61.8 Å²	61.8	17%	0.165	35%	0.348	C	S	.	.	S	Bend	trans	-78	-14.7	177.7	0	0	0	0	0	113.8	I278 K307	G272-I278 WeakPolarHBondContact O-CG1 3.49Å; G272-K307 WeakPolarHBondContact O-CD 3.33Å; G272-K307 WeakPolarHBondContact O-CG 3.25Å
273	D	91.6	Very high	96.4	Very high	94 Å²	94	62.7 Å²	62.7	50%	0.503	35%	0.352	S	S	.	.	S	Bend	trans	-94.1	-14.8	178.3	-68.9	-58.9	0	0	0	112.8	D271 P275 K307	D271-D273 VanDerWaalsContact C-N 3.3Å; D271-D273 WeakPolarHBondContact OD1-CB 3.36Å; D271-D273 PolarHBondContact OD1-N 2.84Å; D273-P275 VanDerWaalsContact O-CD 3.28Å; D273-P275 WeakPolarHBondContact O-CD 3.43Å; D273-K307 VanDerWaalsContact OD1-CE 3.25Å; D273-K307 WeakPolarHBondContact OD1-CE 3.31Å; D273-K307 IonicContact OD1-NZ 3.26Å; D273-K307 PolarHBondContact OD1-NZ 3.26Å
274	D	95	Very high	96.5	Very high	46 Å²	46	62.7 Å²	62.7	25%	0.246	35%	0.348	C	S	.	.			trans	-75.4	115.8	174.3	-173.3	-42.7	0	0	0	111.1	D271 E276 H277 I278	D271-D274 HydrophobicContact CB-CB 3.9Å; D274-E276 VanDerWaalsContact C-N 3.28Å; D274-E276 PolarHBondContact O-N 3.23Å; D274-E276 WeakPolarHBondContact OD1-CA 3.26Å; D274-E276 VanDerWaalsContact OD1-CB 3.3Å; D274-E276 WeakPolarHBondContact OD1-CB 3.48Å; D274-E276 PolarHBondContact OD1-N 2.7Å; D274-H277 HydrophobicContact CB-CB 3.9Å; D274-H277 PolarHBondContact O-N 2.84Å; D274-H277 IonicContact OD1-CD2 2.66Å; D274-H277 PolarHBondContact OD1-N 2.9Å; D274-H277 IonicContact OD2-CD2 3.95Å; D274-H277 IonicContact OD2-NE2 3.18Å; D274-I278 WeakPolarHBondContact O-CG1 3.43Å; D274-I278 PolarHBondContact O-N 3.47Å; D274-I278 VanDerWaalsContact O-N 3.1Å
275	P	95.5	Very high	96.5	Very high	87 Å²	87	59.4 Å²	59.4	57%	0.565	33%	0.333	S	S	*	.	H	α-helix	trans	-61.5	-32.1	-179.6	-23.7	35.5	0	0	0	114.2	D273 Q279	D273-P275 VanDerWaalsContact O-CD 3.28Å; D273-P275 WeakPolarHBondContact O-CD 3.43Å; P275-Q279 VanDerWaalsContact O-CB 3.24Å; P275-Q279 WeakPolarHBondContact O-CB 3.43Å; P275-Q279 PolarHBondContact O-N 3.31Å
276	E	97.6	Very high	96.7	Very high	132 Å²	132	61 Å²	61	62%	0.617	33%	0.333	S	S	*	.	H	α-helix	trans	-71.2	-42	179	-58.6	-169.7	174.9	0	0	110.7	F264 D274 Q279 W280	F264-E276 HydrophobicContact CE1-CB 3.8Å; F264-E276 HydrophobicContact CZ-CB 3.96Å; D274-E276 VanDerWaalsContact C-N 3.28Å; D274-E276 PolarHBondContact O-N 3.23Å; D274-E276 WeakPolarHBondContact OD1-CA 3.26Å; D274-E276 VanDerWaalsContact OD1-CB 3.3Å; D274-E276 WeakPolarHBondContact OD1-CB 3.48Å; D274-E276 PolarHBondContact OD1-N 2.7Å; E276-Q279 PolarHBondContact O-N 3.45Å; E276-W280 PolarHBondContact O-N 3.27Å
277	H	98.2	Very high	96.8	Very high	11 Å²	11	56.1 Å²	56.1	5%	0.051	31%	0.311	C	S	.	.	H	α-helix	trans	-59.5	-48.6	173.9	-69.9	-172.1	0	0	0	111.5	W258 F264 L270 D271 D274 Q279 W280 I281	W258-H277 HydrophobicContact CH2-CB 3.78Å; W258-H277 AromaticContact CH2-CD2 3.58Å; W258-H277 AromaticContact CH2-CE1 3.88Å; W258-H277 AromaticContact CH2-CG 3.4Å; W258-H277 VanDerWaalsContact CH2-CG 3.4Å; W258-H277 AromaticContact CH2-ND1 3.63Å; W258-H277 AromaticContact CH2-NE2 3.82Å; W258-H277 HydrophobicContact CZ3-CB 4.02Å; F264-H277 AromaticContact CD1-CD2 3.65Å; F264-H277 AromaticContact CD1-NE2 3.74Å; F264-H277 AromaticContact CD2-CD2 3.52Å; F264-H277 AromaticContact CD2-NE2 3.81Å; F264-H277 AromaticContact CE1-CD2 3.71Å; F264-H277 AromaticContact CE2-CD2 3.61Å; F264-H277 AromaticContact CG-CD2 3.56Å; F264-H277 AromaticContact CG-NE2 3.49Å; F264-H277 WeakPolarHBondContact CG-NE2 3.39Å; F264-H277 AromaticContact CZ-CD2 3.71Å; L270-H277 HydrophobicContact CD1-CB 3.96Å; D271-H277 WeakPolarHBondContact CB-ND1 3.48Å; D271-H277 PolarHBondContact N-ND1 2.97Å; D271-H277 WeakPolarHBondContact O-CB 3.35Å; D271-H277 PolarHBondContact O-ND1 3.05Å; D274-H277 HydrophobicContact CB-CB 3.9Å; D274-H277 PolarHBondContact O-N 2.84Å; D274-H277 IonicContact OD1-CD2 2.66Å; D274-H277 PolarHBondContact OD1-N 2.9Å; D274-H277 IonicContact OD2-CD2 3.95Å; D274-H277 IonicContact OD2-NE2 3.18Å; H277-Q279 VanDerWaalsContact C-N 3.32Å; H277-Q279 PolarHBondContact O-N 3.31Å; H277-W280 PolarHBondContact O-N 3.36Å; H277-I281 WeakPolarHBondContact O-CG1 3.36Å; H277-I281 PolarHBondContact O-N 3Å
278	I	98.1	Very high	97.1	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-63	-40.3	177.4	-64.2	-56.3	0	0	0	111.1	G272 D274 W280 I281 F282 Y299 T302 Q303 V306	G272-I278 WeakPolarHBondContact O-CG1 3.49Å; D274-I278 WeakPolarHBondContact O-CG1 3.43Å; D274-I278 PolarHBondContact O-N 3.47Å; D274-I278 VanDerWaalsContact O-N 3.1Å; I278-W280 VanDerWaalsContact C-N 3.33Å; I278-W280 PolarHBondContact O-N 2.99Å; I278-I281 PolarHBondContact O-N 3.18Å; I278-F282 VanDerWaalsContact O-CB 3.31Å; I278-F282 WeakPolarHBondContact O-CB 3.15Å; I278-F282 PolarHBondContact O-N 2.96Å; I278-Y299 HydrophobicContact CB-CE2 4.34Å; I278-Y299 HydrophobicContact CG2-CD2 4.21Å; I278-Y299 HydrophobicContact CG2-CE1 4.21Å; I278-Y299 HydrophobicContact CG2-CE2 3.57Å; I278-T302 HydrophobicContact CG2-CG2 4.13Å; I278-Q303 HydrophobicContact CG2-CG 3.66Å; I278-V306 HydrophobicContact CD1-CB 3.84Å; I278-V306 HydrophobicContact CD1-CG1 3.6Å; I278-V306 HydrophobicContact CD1-CG2 4.11Å
279	Q	98.4	Very high	97.2	Very high	87 Å²	87	51 Å²	51	41%	0.407	27%	0.265	S	S	.	.	H	α-helix	trans	-62.6	-41.3	177.4	-176.1	61.1	23.8	0	0	111.5	P275 E276 H277 F282 Q283 Y299	P275-Q279 VanDerWaalsContact O-CB 3.24Å; P275-Q279 WeakPolarHBondContact O-CB 3.43Å; P275-Q279 PolarHBondContact O-N 3.31Å; E276-Q279 PolarHBondContact O-N 3.45Å; H277-Q279 VanDerWaalsContact C-N 3.32Å; H277-Q279 PolarHBondContact O-N 3.31Å; Q279-F282 PolarHBondContact O-N 2.78Å; Q279-Q283 PolarHBondContact O-N 2.83Å; Q279-Y299 HydrophobicContact CB-CE2 4.36Å; Q279-Y299 VanDerWaalsContact OE1-CE2 3.3Å
280	W	98.6	Very high	97.3	Very high	49 Å²	49	50.7 Å²	50.7	19%	0.186	27%	0.265	C	S	.	.	H	α-helix	trans	-62	-47.7	174.6	-175.4	95.7	0	0	0	111.5	V253 Q257 W258 E261 P263 F264 E276 H277 I278 F282 Q283 K284	V253-W280 HydrophobicContact CG1-CE3 4.18Å; V253-W280 HydrophobicContact CG1-CH2 4.33Å; V253-W280 HydrophobicContact CG1-CZ3 3.57Å; Q257-W280 HydrophobicContact CG-CH2 4.15Å; W258-W280 HydrophobicContact CB-CZ3 4.3Å; W258-W280 AromaticContact CE3-CE3 3.67Å; W258-W280 HydrophobicContact CE3-CE3 3.67Å; W258-W280 AromaticContact CE3-CZ3 3.77Å; W258-W280 HydrophobicContact CE3-CZ3 3.77Å; W258-W280 AromaticContact CZ3-CE3 3.96Å; W258-W280 HydrophobicContact CZ3-CE3 3.96Å; W258-W280 HydrophobicContact CZ3-CZ3 4.49Å; E261-W280 HydrophobicContact CB-CZ2 4.44Å; E261-W280 WeakPolarHBondContact OE2-CZ2 3.37Å; P263-W280 HydrophobicContact CB-CD2 3.89Å; P263-W280 HydrophobicContact CB-CG 4.23Å; P263-W280 HydrophobicContact CB-CH2 4.34Å; P263-W280 HydrophobicContact CB-CZ2 3.64Å; P263-W280 HydrophobicContact CG-CD2 3.78Å; P263-W280 HydrophobicContact CG-CE3 3.94Å; P263-W280 HydrophobicContact CG-CG 4.43Å; P263-W280 HydrophobicContact CG-CH2 3.84Å; P263-W280 HydrophobicContact CG-CZ2 3.66Å; P263-W280 HydrophobicContact CG-CZ3 3.98Å; F264-W280 HydrophobicContact CE2-CB 3.8Å; F264-W280 HydrophobicContact CE2-CG 4.03Å; F264-W280 HydrophobicContact CZ-CB 4.13Å; E276-W280 PolarHBondContact O-N 3.27Å; H277-W280 PolarHBondContact O-N 3.36Å; I278-W280 VanDerWaalsContact C-N 3.33Å; I278-W280 PolarHBondContact O-N 2.99Å; W280-F282 VanDerWaalsContact C-N 3.31Å; W280-F282 PolarHBondContact O-N 2.8Å; W280-Q283 PolarHBondContact O-N 2.66Å; W280-K284 HydrophobicContact CD2-CG 4.06Å; W280-K284 HydrophobicContact CE3-CG 4.18Å; W280-K284 HydrophobicContact CH2-CG 3.84Å; W280-K284 HydrophobicContact CZ2-CD 4.46Å; W280-K284 HydrophobicContact CZ2-CG 3.69Å; W280-K284 HydrophobicContact CZ3-CG 4.08Å; W280-K284 PolarHBondContact O-N 3.34Å
281	I	98.6	Very high	97.3	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-59.9	-45.1	177.6	-68.3	-178.4	0	0	0	110.4	I250 V253 W258 L270 H277 I278 Q283 K284 S285 T302 V306	I250-I281 HydrophobicContact CG2-CG2 4.05Å; V253-I281 HydrophobicContact CB-CG2 4.21Å; V253-I281 HydrophobicContact CG1-CB 4.15Å; V253-I281 HydrophobicContact CG1-CG1 4.11Å; V253-I281 HydrophobicContact CG1-CG2 3.87Å; W258-I281 HydrophobicContact CE3-CD1 4.24Å; W258-I281 HydrophobicContact CE3-CG1 4.05Å; W258-I281 HydrophobicContact CZ3-CG1 4.33Å; L270-I281 HydrophobicContact CD1-CD1 3.42Å; L270-I281 VanDerWaalsContact CD1-CD1 3.42Å; L270-I281 HydrophobicContact CD1-CG1 4.42Å; L270-I281 HydrophobicContact CD2-CD1 3.49Å; L270-I281 VanDerWaalsContact CD2-CD1 3.49Å; L270-I281 HydrophobicContact CG-CD1 4.09Å; H277-I281 WeakPolarHBondContact O-CG1 3.36Å; H277-I281 PolarHBondContact O-N 3Å; I278-I281 PolarHBondContact O-N 3.18Å; I281-Q283 VanDerWaalsContact C-N 3.34Å; I281-Q283 PolarHBondContact O-N 3.38Å; I281-K284 PolarHBondContact O-N 3.46Å; I281-S285 VanDerWaalsContact O-CB 3.23Å; I281-S285 WeakPolarHBondContact O-CB 3.22Å; I281-S285 PolarHBondContact O-N 3.33Å; I281-S285 PolarHBondContact O-OG 3.47Å; I281-T302 HydrophobicContact CB-CG2 4Å; I281-T302 HydrophobicContact CG2-CG2 3.54Å; I281-V306 HydrophobicContact CD1-CG1 4.44Å; I281-V306 HydrophobicContact CD1-CG2 3.75Å; I281-V306 HydrophobicContact CG2-CG2 4.06Å
282	F	98.7	Very high	97.4	Very high	35 Å²	35	56.2 Å²	56.2	15%	0.154	28%	0.284	C	S	.	.	H	α-helix	trans	-58	-46.6	179	169.3	-124.8	0	0	0	111.5	I278 Q279 W280 S285 L286 V297 Y299 T302	I278-F282 VanDerWaalsContact O-CB 3.31Å; I278-F282 WeakPolarHBondContact O-CB 3.15Å; I278-F282 PolarHBondContact O-N 2.96Å; Q279-F282 PolarHBondContact O-N 2.78Å; W280-F282 VanDerWaalsContact C-N 3.31Å; W280-F282 PolarHBondContact O-N 2.8Å; F282-S285 WeakPolarHBondContact O-CB 3.35Å; F282-S285 PolarHBondContact O-N 2.94Å; F282-L286 HydrophobicContact CD2-CD1 4.32Å; F282-L286 HydrophobicContact CD2-CG 4.28Å; F282-L286 HydrophobicContact CE1-CD1 3.99Å; F282-L286 HydrophobicContact CE2-CD1 3.69Å; F282-L286 HydrophobicContact CE2-CD2 4.18Å; F282-L286 HydrophobicContact CE2-CG 3.82Å; F282-L286 HydrophobicContact CZ-CD1 3.52Å; F282-L286 HydrophobicContact CZ-CG 4.18Å; F282-L286 PolarHBondContact O-N 3.15Å; F282-V297 HydrophobicContact CD2-CG1 4.01Å; F282-V297 HydrophobicContact CE2-CG1 4.11Å; F282-Y299 HydrophobicContact CB-CD2 4.21Å; F282-Y299 AromaticContact CD1-CD2 3.97Å; F282-Y299 HydrophobicContact CD1-CD2 3.97Å; F282-Y299 HydrophobicContact CG-CD2 4.16Å; F282-T302 HydrophobicContact CB-CG2 4.11Å
283	Q	98.5	Very high	97.5	Very high	94 Å²	94	62.5 Å²	62.5	44%	0.439	31%	0.314	S	S	.	.	H	α-helix	trans	-62.5	-47.5	179.3	-170.6	62.3	30.3	0	0	112	Q279 W280 I281 S285 L286 E287	Q279-Q283 PolarHBondContact O-N 2.83Å; W280-Q283 PolarHBondContact O-N 2.66Å; I281-Q283 VanDerWaalsContact C-N 3.34Å; I281-Q283 PolarHBondContact O-N 3.38Å; Q283-S285 VanDerWaalsContact C-N 3.27Å; Q283-S285 PolarHBondContact O-N 3.1Å; Q283-L286 WeakPolarHBondContact O-CB 3.42Å; Q283-L286 PolarHBondContact O-N 3.32Å; Q283-E287 PolarHBondContact O-N 3.45Å; Q283-E287 VanDerWaalsContact O-N 3.11Å
284	K	98.4	Very high	97.8	Very high	43 Å²	43	59.1 Å²	59.1	19%	0.187	30%	0.295	C	S	.	.	H	α-helix	trans	-65.3	-31.7	176.3	-68.2	-46.4	-167.3	-172.1	0	113	V253 W280 I281 E287 R288	V253-K284 HydrophobicContact CB-CB 4.41Å; V253-K284 HydrophobicContact CG1-CB 3.65Å; V253-K284 HydrophobicContact CG1-CG 4.45Å; V253-K284 HydrophobicContact CG2-CB 3.78Å; W280-K284 HydrophobicContact CD2-CG 4.06Å; W280-K284 HydrophobicContact CE3-CG 4.18Å; W280-K284 HydrophobicContact CH2-CG 3.84Å; W280-K284 HydrophobicContact CZ2-CD 4.46Å; W280-K284 HydrophobicContact CZ2-CG 3.69Å; W280-K284 HydrophobicContact CZ3-CG 4.08Å; W280-K284 PolarHBondContact O-N 3.34Å; I281-K284 PolarHBondContact O-N 3.46Å; K284-E287 WeakPolarHBondContact CD-OE2 3.39Å; K284-E287 IonicContact NZ-OE1 2.8Å; K284-E287 PolarHBondContact NZ-OE1 2.79Å; K284-E287 IonicContact NZ-OE2 3.34Å; K284-E287 PolarHBondContact NZ-OE2 2.87Å; K284-E287 PolarHBondContact O-N 3.39Å; K284-R288 PolarHBondContact O-N 2.84Å
285	S	98.5	Very high	97.9	Very high	0 Å²	0	68 Å²	68	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-68.4	-38	176.2	-59.3	0	0	0	0	111.4	I250 I281 F282 Q283 A289	I250-S285 WeakPolarHBondContact CA-OG 3.47Å; I281-S285 VanDerWaalsContact O-CB 3.23Å; I281-S285 WeakPolarHBondContact O-CB 3.22Å; I281-S285 PolarHBondContact O-N 3.33Å; I281-S285 PolarHBondContact O-OG 3.47Å; F282-S285 WeakPolarHBondContact O-CB 3.35Å; F282-S285 PolarHBondContact O-N 2.94Å; Q283-S285 VanDerWaalsContact C-N 3.27Å; Q283-S285 PolarHBondContact O-N 3.1Å; S285-A289 WeakPolarHBondContact O-CB 3.46Å; S285-A289 PolarHBondContact O-N 3.09Å
286	L	98.5	Very high	98	Very high	65 Å²	65	66.1 Å²	66.1	34%	0.34	32%	0.322	S	S	.	.	H	α-helix	trans	-63.6	-44.4	172.5	-76	172.3	0	0	0	111.9	F282 Q283 R288 A289 S290 V297	F282-L286 HydrophobicContact CD2-CD1 4.32Å; F282-L286 HydrophobicContact CD2-CG 4.28Å; F282-L286 HydrophobicContact CE1-CD1 3.99Å; F282-L286 HydrophobicContact CE2-CD1 3.69Å; F282-L286 HydrophobicContact CE2-CD2 4.18Å; F282-L286 HydrophobicContact CE2-CG 3.82Å; F282-L286 HydrophobicContact CZ-CD1 3.52Å; F282-L286 HydrophobicContact CZ-CG 4.18Å; F282-L286 PolarHBondContact O-N 3.15Å; Q283-L286 WeakPolarHBondContact O-CB 3.42Å; Q283-L286 PolarHBondContact O-N 3.32Å; L286-R288 PolarHBondContact O-N 2.83Å; L286-A289 PolarHBondContact O-N 3.4Å; L286-S290 WeakPolarHBondContact O-CB 3.41Å; L286-S290 PolarHBondContact O-N 3.47Å; L286-V297 HydrophobicContact CD2-CB 3.98Å; L286-V297 HydrophobicContact CD2-CG1 4.05Å; L286-V297 HydrophobicContact CG-CG1 4.16Å
287	E	98.2	Very high	98	Very high	77 Å²	77	60.5 Å²	60.5	36%	0.36	30%	0.297	S	S	.	.	H	α-helix	trans	-57.4	-50	176.1	-70.1	170.5	-161.9	0	0	111	Q283 K284 S290 Q291	Q283-E287 PolarHBondContact O-N 3.45Å; Q283-E287 VanDerWaalsContact O-N 3.11Å; K284-E287 WeakPolarHBondContact CD-OE2 3.39Å; K284-E287 IonicContact NZ-OE1 2.8Å; K284-E287 PolarHBondContact NZ-OE1 2.79Å; K284-E287 IonicContact NZ-OE2 3.34Å; K284-E287 PolarHBondContact NZ-OE2 2.87Å; K284-E287 PolarHBondContact O-N 3.39Å; E287-S290 WeakPolarHBondContact O-CB 3.34Å; E287-S290 PolarHBondContact O-N 3.43Å; E287-Q291 WeakPolarHBondContact O-CG 3.5Å; E287-Q291 PolarHBondContact O-N 3.09Å
288	R	97.7	Very high	98	Very high	14 Å²	14	63.2 Å²	63.2	5%	0.053	31%	0.314	C	S	.	.	H	α-helix	trans	-64.2	-43.5	177.6	-175.9	175.2	-178.4	90	1.8	112.2	I239 A240 C249 Y252 K284 L286 S290 Q291 Y292	I239-R288 PolarHBondContact O-NH2 3.15Å; A240-R288 PolarHBondContact O-NH2 3.26Å; C249-R288 HydrophobicContact CB-CB 4.42Å; C249-R288 HydrophobicContact CB-CG 4.32Å; Y252-R288 VanDerWaalsContact CB-NE 3.28Å; Y252-R288 VanDerWaalsContact CD1-CZ 3.46Å; Y252-R288 VanDerWaalsContact CG-NE 3.25Å; K284-R288 PolarHBondContact O-N 2.84Å; L286-R288 PolarHBondContact O-N 2.83Å; R288-S290 VanDerWaalsContact C-N 3.29Å; R288-S290 PolarHBondContact O-N 3.47Å; R288-Q291 WeakPolarHBondContact O-CB 3.43Å; R288-Q291 PolarHBondContact O-N 3.09Å; R288-Y292 HydrophobicContact CG-CD2 4.42Å; R288-Y292 HydrophobicContact CG-CE2 4.49Å; R288-Y292 WeakPolarHBondContact O-CD2 3.19Å; R288-Y292 PolarHBondContact O-N 2.9Å
289	A	98.2	Very high	98	Very high	3 Å²	3	66.6 Å²	66.6	3%	0.025	33%	0.327	C	S	.	.	H	α-helix	trans	-62.2	-39.5	179.6	0	0	0	0	0	111.7	C249 S285 L286 Q291 Y292 N293 I294 V297	C249-A289 HydrophobicContact CB-CB 4.26Å; S285-A289 WeakPolarHBondContact O-CB 3.46Å; S285-A289 PolarHBondContact O-N 3.09Å; L286-A289 PolarHBondContact O-N 3.4Å; A289-Q291 PolarHBondContact O-N 3.02Å; A289-Y292 CarbonylContact O-C 3.57Å; A289-Y292 PolarHBondContact O-N 3.19Å; A289-N293 PolarHBondContact O-N 3.02Å; A289-I294 HydrophobicContact CB-CB 4.18Å; A289-I294 WeakPolarHBondContact CB-O 3.3Å; A289-I294 PolarHBondContact O-N 3.26Å; A289-V297 HydrophobicContact CB-CG2 3.6Å
290	S	97.7	Very high	97.9	Very high	91 Å²	91	72.3 Å²	72.3	64%	0.636	35%	0.345	S	S	*	.	H	α-helix	trans	-58.8	-43.9	174.6	-172.4	0	0	0	0	112.2	L286 E287 R288 Y292 N293	L286-S290 WeakPolarHBondContact O-CB 3.41Å; L286-S290 PolarHBondContact O-N 3.47Å; E287-S290 WeakPolarHBondContact O-CB 3.34Å; E287-S290 PolarHBondContact O-N 3.43Å; R288-S290 VanDerWaalsContact C-N 3.29Å; R288-S290 PolarHBondContact O-N 3.47Å; S290-Y292 PolarHBondContact O-N 3.14Å; S290-N293 PolarHBondContact O-N 3.43Å; S290-N293 VanDerWaalsContact O-N 3.15Å
291	Q	97.2	Very high	97.9	Very high	139 Å²	139	71.9 Å²	71.9	65%	0.65	35%	0.347	S	S	*	.	H	α-helix	trans	-59	-31.1	178.4	-68.3	169	5.8	0	0	113.5	E287 R288 A289	E287-Q291 WeakPolarHBondContact O-CG 3.5Å; E287-Q291 PolarHBondContact O-N 3.09Å; R288-Q291 WeakPolarHBondContact O-CB 3.43Å; R288-Q291 PolarHBondContact O-N 3.09Å; A289-Q291 PolarHBondContact O-N 3.02Å
292	Y	97.3	Very high	97.9	Very high	97 Å²	97	71.9 Å²	71.9	38%	0.38	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	10.5	-178.7	-69.5	-93.3	0	0	0	113.3	P243 R288 A289 S290 I294	P243-Y292 HydrophobicContact CG-CD1 3.47Å; P243-Y292 VanDerWaalsContact CG-CD1 3.47Å; P243-Y292 HydrophobicContact CG-CD2 3.57Å; P243-Y292 HydrophobicContact CG-CE1 3.69Å; P243-Y292 HydrophobicContact CG-CE2 3.8Å; P243-Y292 HydrophobicContact CG-CG 3.4Å; P243-Y292 VanDerWaalsContact CG-CG 3.4Å; R288-Y292 HydrophobicContact CG-CD2 4.42Å; R288-Y292 HydrophobicContact CG-CE2 4.49Å; R288-Y292 WeakPolarHBondContact O-CD2 3.19Å; R288-Y292 PolarHBondContact O-N 2.9Å; A289-Y292 CarbonylContact O-C 3.57Å; A289-Y292 PolarHBondContact O-N 3.19Å; S290-Y292 PolarHBondContact O-N 3.14Å; Y292-I294 PolarHBondContact O-N 2.89Å
293	N	97.4	Very high	97.7	Very high	148 Å²	148	73.3 Å²	73.3	79%	0.791	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	33.1	-175.9	-60.4	-70.6	0	0	0	114.2	A289 S290	A289-N293 PolarHBondContact O-N 3.02Å; S290-N293 PolarHBondContact O-N 3.43Å; S290-N293 VanDerWaalsContact O-N 3.15Å
294	I	97.7	Very high	97.6	Very high	22 Å²	22	70 Å²	70	11%	0.113	34%	0.344	C	S	.	.			trans	-90	129.8	178.3	-63	168.2	0	0	0	108.9	P243 P246 A289 Y292	P243-I294 HydrophobicContact CB-CD1 3.76Å; P243-I294 HydrophobicContact CG-CD1 4.11Å; P246-I294 HydrophobicContact CB-CG2 4.27Å; A289-I294 HydrophobicContact CB-CB 4.18Å; A289-I294 WeakPolarHBondContact CB-O 3.3Å; A289-I294 PolarHBondContact O-N 3.26Å; Y292-I294 PolarHBondContact O-N 2.89Å
295	R	96.9	Very high	97.5	Very high	232 Å²	232	68.7 Å²	68.7	88%	0.875	34%	0.34	S	S	*	.			trans	-102.8	165.2	175.1	-61.9	-176.1	-179.6	-174.7	0	110.5
296	G	97.3	Very high	97.3	Very high	48 Å²	48	69.3 Å²	69.3	50%	0.495	34%	0.344	S	S	.	.			trans	97.4	2.2	171.6	0	0	0	0	0	115.9	T298 L301	G296-T298 PolarHBondContact O-N 3.44Å; G296-L301 WeakPolarHBondContact O-CD2 3.42Å
297	V	98.1	Very high	97.1	Very high	15 Å²	15	69.6 Å²	69.6	9%	0.091	34%	0.342	C	S	.	.			trans	-67.6	119.3	169.2	179.3	0	0	0	0	108.8	P246 C249 I250 F282 L286 A289	P246-V297 HydrophobicContact CB-CB 4.43Å; P246-V297 HydrophobicContact CB-CG2 3.58Å; C249-V297 HydrophobicContact CB-CG2 4.46Å; I250-V297 HydrophobicContact CG1-CG1 4.44Å; F282-V297 HydrophobicContact CD2-CG1 4.01Å; F282-V297 HydrophobicContact CE2-CG1 4.11Å; L286-V297 HydrophobicContact CD2-CB 3.98Å; L286-V297 HydrophobicContact CD2-CG1 4.05Å; L286-V297 HydrophobicContact CG-CG1 4.16Å; A289-V297 HydrophobicContact CB-CG2 3.6Å
298	T	98.2	Very high	96.8	Very high	68 Å²	68	72 Å²	72	42%	0.417	35%	0.348	S	S	.	.			trans	-133.4	154.9	177.5	64.5	0	0	0	0	109.1	G296 R300 L301 T302	G296-T298 PolarHBondContact O-N 3.44Å; T298-R300 PolarHBondContact O-N 3.18Å; T298-L301 PolarHBondContact O-N 2.92Å; T298-L301 WeakPolarHBondContact OG1-CB 3.34Å; T298-L301 PolarHBondContact OG1-N 2.88Å; T298-T302 PolarHBondContact O-N 2.95Å; T298-T302 PolarHBondContact O-OG1 2.77Å; T298-T302 VanDerWaalsContact O-OG1 3.08Å
299	Y	98	Very high	96.5	Very high	71 Å²	71	75.6 Å²	75.6	28%	0.278	37%	0.367	S	S	.	.	H	α-helix	trans	-54.7	-41.6	176.8	-173.3	-90.7	0	0	0	112.3	I278 Q279 F282 L301 T302 Q303	I278-Y299 HydrophobicContact CB-CE2 4.34Å; I278-Y299 HydrophobicContact CG2-CD2 4.21Å; I278-Y299 HydrophobicContact CG2-CE1 4.21Å; I278-Y299 HydrophobicContact CG2-CE2 3.57Å; Q279-Y299 HydrophobicContact CB-CE2 4.36Å; Q279-Y299 VanDerWaalsContact OE1-CE2 3.3Å; F282-Y299 HydrophobicContact CB-CD2 4.21Å; F282-Y299 AromaticContact CD1-CD2 3.97Å; F282-Y299 HydrophobicContact CD1-CD2 3.97Å; F282-Y299 HydrophobicContact CG-CD2 4.16Å; Y299-L301 PolarHBondContact O-N 3.01Å; Y299-T302 WeakPolarHBondContact O-CB 3.22Å; Y299-T302 PolarHBondContact O-N 3.04Å; Y299-Q303 HydrophobicContact CD1-CG 4.21Å; Y299-Q303 HydrophobicContact CE1-CG 3.9Å; Y299-Q303 PolarHBondContact O-N 3.4Å
300	R	96.8	Very high	96.1	Very high	207 Å²	207	79 Å²	79	78%	0.781	39%	0.385	S	S	*	.	H	α-helix	trans	-61	-43.5	176.1	-175.4	-175.7	-64.6	158.2	0.6	112.4	T298 T302 Q303 G304	T298-R300 PolarHBondContact O-N 3.18Å; R300-T302 VanDerWaalsContact C-N 3.33Å; R300-Q303 PolarHBondContact O-N 3.16Å; R300-G304 PolarHBondContact O-N 3.44Å
301	L	97.7	Very high	95.9	Very high	41 Å²	41	79.2 Å²	79.2	22%	0.215	38%	0.384	C	S	.	.	H	α-helix	trans	-66.3	-38.6	176.3	-176.4	63.9	0	0	0	110.9	P246 E247 I250 G296 T298 Y299 Q303 G304 V305	P246-L301 HydrophobicContact CB-CD2 3.71Å; P246-L301 HydrophobicContact CG-CD2 3.66Å; E247-L301 HydrophobicContact CG-CD1 4.17Å; E247-L301 HydrophobicContact CG-CD2 4.48Å; I250-L301 HydrophobicContact CD1-CB 4.3Å; I250-L301 HydrophobicContact CD1-CD2 3.97Å; I250-L301 HydrophobicContact CD1-CG 3.75Å; G296-L301 WeakPolarHBondContact O-CD2 3.42Å; T298-L301 PolarHBondContact O-N 2.92Å; T298-L301 WeakPolarHBondContact OG1-CB 3.34Å; T298-L301 PolarHBondContact OG1-N 2.88Å; Y299-L301 PolarHBondContact O-N 3.01Å; L301-Q303 PolarHBondContact O-N 2.93Å; L301-G304 PolarHBondContact O-N 2.96Å; L301-G304 VanDerWaalsContact O-N 3.16Å; L301-V305 HydrophobicContact CD1-CG2 4.2Å; L301-V305 HydrophobicContact CG-CG2 4.33Å; L301-V305 WeakPolarHBondContact O-CG2 3.33Å; L301-V305 PolarHBondContact O-N 2.92Å
302	T	98.2	Very high	95.7	Very high	0 Å²	0	73.7 Å²	73.7	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-56.7	-50	174.2	-53.7	0	0	0	0	111.3	I250 I278 I281 F282 T298 Y299 R300 G304 V305 V306	I250-T302 HydrophobicContact CG2-CG2 4.15Å; I278-T302 HydrophobicContact CG2-CG2 4.13Å; I281-T302 HydrophobicContact CB-CG2 4Å; I281-T302 HydrophobicContact CG2-CG2 3.54Å; F282-T302 HydrophobicContact CB-CG2 4.11Å; T298-T302 PolarHBondContact O-N 2.95Å; T298-T302 PolarHBondContact O-OG1 2.77Å; T298-T302 VanDerWaalsContact O-OG1 3.08Å; Y299-T302 WeakPolarHBondContact O-CB 3.22Å; Y299-T302 PolarHBondContact O-N 3.04Å; R300-T302 VanDerWaalsContact C-N 3.33Å; T302-G304 VanDerWaalsContact C-N 3.32Å; T302-G304 PolarHBondContact O-N 3.18Å; T302-V305 PolarHBondContact O-N 3.47Å; T302-V306 HydrophobicContact CG2-CG2 4.18Å; T302-V306 WeakPolarHBondContact O-CB 3.45Å; T302-V306 VanDerWaalsContact O-CG2 3.24Å; T302-V306 WeakPolarHBondContact O-CG2 2.92Å; T302-V306 PolarHBondContact O-N 2.72Å
303	Q	96.2	Very high	95.7	Very high	65 Å²	65	71.2 Å²	71.2	30%	0.304	36%	0.357	S	S	.	.	H	α-helix	trans	-57.9	-46	174.6	-69.1	-178.9	-61.8	0	0	111.5	I278 Y299 R300 L301 V305 V306 K307 I309	I278-Q303 HydrophobicContact CG2-CG 3.66Å; Y299-Q303 HydrophobicContact CD1-CG 4.21Å; Y299-Q303 HydrophobicContact CE1-CG 3.9Å; Y299-Q303 PolarHBondContact O-N 3.4Å; R300-Q303 PolarHBondContact O-N 3.16Å; L301-Q303 PolarHBondContact O-N 2.93Å; Q303-V305 PolarHBondContact O-N 3.06Å; Q303-V306 PolarHBondContact O-N 2.99Å; Q303-K307 WeakPolarHBondContact O-CB 3.38Å; Q303-K307 PolarHBondContact O-N 3Å; Q303-I309 HydrophobicContact CB-CD1 4.07Å
304	G	95.3	Very high	95.7	Very high	23 Å²	23	66.2 Å²	66.2	24%	0.237	34%	0.336	C	S	.	.	H	α-helix	trans	-56	-47.7	178.7	0	0	0	0	0	113.3	R300 L301 T302 R308 I309	R300-G304 PolarHBondContact O-N 3.44Å; L301-G304 PolarHBondContact O-N 2.96Å; L301-G304 VanDerWaalsContact O-N 3.16Å; T302-G304 VanDerWaalsContact C-N 3.32Å; T302-G304 PolarHBondContact O-N 3.18Å; G304-R308 CarbonylContact O-C 3.53Å; G304-R308 WeakPolarHBondContact O-CA 3.01Å; G304-R308 PolarHBondContact O-N 2.98Å; G304-I309 PolarHBondContact O-N 3.19Å
305	V	95.6	Very high	95.7	Very high	17 Å²	17	68 Å²	68	10%	0.103	35%	0.351	C	S	.	.	H	α-helix	trans	-72.2	-46.4	-179.8	174.6	0	0	0	0	111.3	E247 I250 E251 L301 T302 Q303 R308	E247-V305 HydrophobicContact CB-CG2 4.1Å; E247-V305 HydrophobicContact CG-CG2 3.77Å; I250-V305 HydrophobicContact CB-CB 4.3Å; I250-V305 HydrophobicContact CB-CG1 4.08Å; I250-V305 HydrophobicContact CD1-CG2 4.14Å; I250-V305 HydrophobicContact CG2-CB 3.75Å; I250-V305 HydrophobicContact CG2-CG1 3.65Å; I250-V305 HydrophobicContact CG2-CG2 4.46Å; E251-V305 WeakPolarHBondContact OE2-CG1 3.37Å; L301-V305 HydrophobicContact CD1-CG2 4.2Å; L301-V305 HydrophobicContact CG-CG2 4.33Å; L301-V305 WeakPolarHBondContact O-CG2 3.33Å; L301-V305 PolarHBondContact O-N 2.92Å; T302-V305 PolarHBondContact O-N 3.47Å; Q303-V305 PolarHBondContact O-N 3.06Å; V305-R308 PolarHBondContact O-N 3.26Å
306	V	96	Very high	95.8	Very high	12 Å²	12	57 Å²	57	7%	0.073	31%	0.309	C	S	.	.	H	α-helix	trans	-64	-48.4	-176.2	172.5	0	0	0	0	111.9	I250 L270 I278 I281 T302 Q303 R308	I250-V306 HydrophobicContact CG2-CG2 4.19Å; L270-V306 HydrophobicContact CD2-CG1 3.99Å; L270-V306 HydrophobicContact CG-CG1 4.42Å; I278-V306 HydrophobicContact CD1-CB 3.84Å; I278-V306 HydrophobicContact CD1-CG1 3.6Å; I278-V306 HydrophobicContact CD1-CG2 4.11Å; I281-V306 HydrophobicContact CD1-CG1 4.44Å; I281-V306 HydrophobicContact CD1-CG2 3.75Å; I281-V306 HydrophobicContact CG2-CG2 4.06Å; T302-V306 HydrophobicContact CG2-CG2 4.18Å; T302-V306 WeakPolarHBondContact O-CB 3.45Å; T302-V306 VanDerWaalsContact O-CG2 3.24Å; T302-V306 WeakPolarHBondContact O-CG2 2.92Å; T302-V306 PolarHBondContact O-N 2.72Å; Q303-V306 PolarHBondContact O-N 2.99Å; V306-R308 VanDerWaalsContact C-N 3.35Å
307	K	92.9	Very high	95.8	Very high	72 Å²	72	55 Å²	55	31%	0.313	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-3.1	-179.3	-59.6	-179.6	65.7	164.8	0	113.3	G272 D273 Q303 I309	G272-K307 WeakPolarHBondContact O-CD 3.33Å; G272-K307 WeakPolarHBondContact O-CG 3.25Å; D273-K307 VanDerWaalsContact OD1-CE 3.25Å; D273-K307 WeakPolarHBondContact OD1-CE 3.31Å; D273-K307 IonicContact OD1-NZ 3.26Å; D273-K307 PolarHBondContact OD1-NZ 3.26Å; Q303-K307 WeakPolarHBondContact O-CB 3.38Å; Q303-K307 PolarHBondContact O-N 3Å; K307-I309 VanDerWaalsContact C-N 3.29Å; K307-I309 HydrophobicContact CB-CD1 4.37Å; K307-I309 HydrophobicContact CB-CG1 3.72Å; K307-I309 HydrophobicContact CD-CD1 4.34Å; K307-I309 HydrophobicContact CD-CG1 4.5Å; K307-I309 PolarHBondContact O-N 3.16Å
308	R	92.4	Very high	95.9	Very high	126 Å²	126	55.9 Å²	55.9	48%	0.475	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	48.3	-171.6	-60.5	-177.3	176.2	-98.7	-3.6	112	V232 E251 G304 V305 V306 I310	V232-R308 PolarHBondContact O-NH1 3.41Å; E251-R308 IonicContact OE1-NH2 2.7Å; G304-R308 CarbonylContact O-C 3.53Å; G304-R308 WeakPolarHBondContact O-CA 3.01Å; G304-R308 PolarHBondContact O-N 2.98Å; V305-R308 PolarHBondContact O-N 3.26Å; V306-R308 VanDerWaalsContact C-N 3.35Å; R308-I310 PolarHBondContact O-N 3.27Å
309	I	91.3	Very high	95.9	Very high	90 Å²	90	55.3 Å²	55.3	46%	0.462	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-62	125.7	-172.4	-58.1	-178.9	0	0	0	110.7	Q303 G304 K307	Q303-I309 HydrophobicContact CB-CD1 4.07Å; G304-I309 PolarHBondContact O-N 3.19Å; K307-I309 VanDerWaalsContact C-N 3.29Å; K307-I309 HydrophobicContact CB-CD1 4.37Å; K307-I309 HydrophobicContact CB-CG1 3.72Å; K307-I309 HydrophobicContact CD-CD1 4.34Å; K307-I309 HydrophobicContact CD-CG1 4.5Å; K307-I309 PolarHBondContact O-N 3.16Å
310	I	90.7	Very high	95.9	Very high	76 Å²	76	52 Å²	52	39%	0.39	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-90.8	122.3	167.3	-60.9	176.2	0	0	0	108.1	E204 R308 A312	E204-I310 HydrophobicContact CB-CG2 3.94Å; E204-I310 HydrophobicContact CG-CG2 3.8Å; R308-I310 PolarHBondContact O-N 3.27Å; I310-A312 PolarHBondContact O-N 3.45Å
311	P	92.4	Very high	96	Very high	94 Å²	94	42.1 Å²	42.1	61%	0.61	24%	0.242	S	C	*	.	P	Polyproline II helix	trans	-55.1	134.8	172.9	-25.1	34.6	0	0	0	111.1	G205	G205-P311 VanDerWaalsContact CA-O 3.25Å; G205-P311 WeakPolarHBondContact CA-O 3.44Å; G205-P311 PolarHBondContact N-O 3.33Å
312	A	94.1	Very high	96.1	Very high	24 Å²	24	42.2 Å²	42.2	20%	0.198	25%	0.248	C	C	.	.			trans	-146.9	134.7	-175.4	0	0	0	0	0	112.4	N110 R111 I310	N110-A312 PolarHBondContact ND2-O 2.73Å; R111-A312 VanDerWaalsContact NE-CB 3.32Å; I310-A312 PolarHBondContact O-N 3.45Å
313	V	96.3	Very high	96.1	Very high	44 Å²	44	43.7 Å²	43.7	27%	0.267	26%	0.258	S	S	.	.			trans	-129.5	154.7	-179.3	-65.9	0	0	0	0	111	F206 S315 T316 N317	F206-V313 HydrophobicContact CD1-CG2 4.35Å; F206-V313 HydrophobicContact CE1-CG2 4.12Å; V313-S315 VanDerWaalsContact C-N 3.35Å; V313-S315 WeakPolarHBondContact CG2-OG 3.36Å; V313-S315 PolarHBondContact O-N 3.14Å; V313-T316 WeakPolarHBondContact CG2-OG1 3.37Å; V313-N317 PolarHBondContact O-ND2 3.04Å
314	A	97.9	Very high	96.2	Very high	44 Å²	44	40.7 Å²	40.7	36%	0.364	24%	0.244	S	C	.	.	H	α-helix	trans	-63.2	-37.8	-178.2	0	0	0	0	0	113	R111 T316 N317 A318	R111-A314 HydrophobicContact CB-CB 4.2Å; A314-T316 PolarHBondContact O-N 2.91Å; A314-N317 PolarHBondContact O-N 3.35Å; A314-A318 WeakPolarHBondContact O-CB 3.32Å; A314-A318 PolarHBondContact O-N 2.91Å
315	S	98.2	Very high	96.4	Very high	59 Å²	59	39.7 Å²	39.7	41%	0.413	23%	0.233	S	C	.	.	H	α-helix	trans	-57.2	-53.3	-176.6	51.2	0	0	0	0	112.9	V313 N317 A318 V319	V313-S315 VanDerWaalsContact C-N 3.35Å; V313-S315 WeakPolarHBondContact CG2-OG 3.36Å; V313-S315 PolarHBondContact O-N 3.14Å; S315-N317 VanDerWaalsContact C-N 3.32Å; S315-N317 PolarHBondContact O-N 3.38Å; S315-A318 WeakPolarHBondContact O-CB 3.31Å; S315-A318 PolarHBondContact O-N 2.73Å; S315-A318 VanDerWaalsContact O-N 3.17Å; S315-V319 WeakPolarHBondContact O-CG2 3.46Å; S315-V319 PolarHBondContact O-N 2.99Å
316	T	98.2	Very high	96.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-39.9	-179.8	-43	0	0	0	0	111.9	T203 G205 K207 V313 A314 V319 I320 F345	T203-T316 HydrophobicContact CG2-CG2 4.01Å; G205-T316 WeakPolarHBondContact O-CB 3.42Å; G205-T316 PolarHBondContact O-OG1 3.15Å; K207-T316 VanDerWaalsContact O-CG2 3.31Å; K207-T316 WeakPolarHBondContact O-CG2 3.32Å; V313-T316 WeakPolarHBondContact CG2-OG1 3.37Å; A314-T316 PolarHBondContact O-N 2.91Å; T316-V319 PolarHBondContact O-N 3.22Å; T316-I320 PolarHBondContact O-N 3.42Å; T316-I320 VanDerWaalsContact O-N 3.1Å; T316-F345 HydrophobicContact CG2-CD1 4.16Å; T316-F345 HydrophobicContact CG2-CE1 4.14Å
317	N	98.3	Very high	96.7	Very high	8 Å²	8	42.1 Å²	42.1	4%	0.043	25%	0.248	C	C	.	.	H	α-helix	trans	-63.6	-43.2	175.2	-73.6	-77.8	0	0	0	111.4	L80 T203 V313 A314 S315 A321	L80-N317 HydrophobicContact CD2-CB 4.39Å; L80-N317 WeakPolarHBondContact CD2-O 3.11Å; L80-N317 WeakPolarHBondContact CG-OD1 3.47Å; L80-N317 PolarHBondContact N-OD1 3.34Å; T203-N317 PolarHBondContact OG1-OD1 3.32Å; T203-N317 VanDerWaalsContact OG1-OD1 3.06Å; V313-N317 PolarHBondContact O-ND2 3.04Å; A314-N317 PolarHBondContact O-N 3.35Å; S315-N317 VanDerWaalsContact C-N 3.32Å; S315-N317 PolarHBondContact O-N 3.38Å; N317-A321 WeakPolarHBondContact O-CB 3.43Å; N317-A321 PolarHBondContact O-N 2.93Å
318	A	98.7	Very high	97	Very high	33 Å²	33	38.7 Å²	38.7	27%	0.273	23%	0.233	S	C	.	.	H	α-helix	trans	-62.9	-42.4	176.6	0	0	0	0	0	112.3	E83 A314 S315 A322	E83-A318 HydrophobicContact CG-CB 4.28Å; A314-A318 WeakPolarHBondContact O-CB 3.32Å; A314-A318 PolarHBondContact O-N 2.91Å; S315-A318 WeakPolarHBondContact O-CB 3.31Å; S315-A318 PolarHBondContact O-N 2.73Å; S315-A318 VanDerWaalsContact O-N 3.17Å; A318-A322 WeakPolarHBondContact O-CB 3.24Å; A318-A322 PolarHBondContact O-N 3.1Å
319	V	98.7	Very high	97.3	Very high	56 Å²	56	33.9 Å²	33.9	34%	0.339	22%	0.215	S	C	.	.	H	α-helix	trans	-60.4	-54.1	177.5	171.8	0	0	0	0	111	S315 T316 A322 V323 F345	S315-V319 WeakPolarHBondContact O-CG2 3.46Å; S315-V319 PolarHBondContact O-N 2.99Å; T316-V319 PolarHBondContact O-N 3.22Å; V319-A322 PolarHBondContact O-N 3.1Å; V319-V323 PolarHBondContact O-N 2.98Å; V319-V323 VanDerWaalsContact O-N 3.15Å; V319-F345 HydrophobicContact CB-CE1 4.4Å; V319-F345 HydrophobicContact CB-CZ 4.41Å; V319-F345 HydrophobicContact CG1-CD1 4.15Å; V319-F345 HydrophobicContact CG1-CD2 3.88Å; V319-F345 HydrophobicContact CG1-CE1 4.24Å; V319-F345 HydrophobicContact CG1-CE2 3.95Å; V319-F345 HydrophobicContact CG1-CG 3.96Å; V319-F345 HydrophobicContact CG1-CZ 4.12Å; V319-F345 HydrophobicContact CG2-CE1 4.42Å; V319-F345 HydrophobicContact CG2-CE2 4.47Å; V319-F345 HydrophobicContact CG2-CZ 4.07Å
320	I	98.7	Very high	97.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-68.2	-42.9	-176.5	-65.2	-53.7	0	0	0	111.5	L80 T203 N209 A210 T316 A322 V323 C324 F345	L80-I320 HydrophobicContact CD1-CG2 4.48Å; L80-I320 HydrophobicContact CD2-CB 3.83Å; L80-I320 HydrophobicContact CD2-CG2 3.73Å; T203-I320 HydrophobicContact CG2-CB 3.95Å; T203-I320 HydrophobicContact CG2-CG1 3.78Å; T203-I320 HydrophobicContact CG2-CG2 4.35Å; N209-I320 VanDerWaalsContact O-CG2 3.29Å; N209-I320 WeakPolarHBondContact O-CG2 3.35Å; A210-I320 HydrophobicContact CB-CG2 4.4Å; T316-I320 PolarHBondContact O-N 3.42Å; T316-I320 VanDerWaalsContact O-N 3.1Å; I320-A322 VanDerWaalsContact C-N 3.27Å; I320-A322 PolarHBondContact O-N 3.06Å; I320-V323 PolarHBondContact O-N 3.4Å; I320-C324 PolarHBondContact O-N 3.4Å; I320-C324 PolarHBondContact O-SG 3.25Å; I320-C324 VanDerWaalsContact O-SG 3.34Å; I320-F345 HydrophobicContact CD1-CB 3.93Å
321	A	98.8	Very high	98	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.4	-30.9	176.8	0	0	0	0	0	112.8	L80 E83 L84 N87 N317 A325	L80-A321 HydrophobicContact CD2-CB 4.03Å; E83-A321 HydrophobicContact CB-CB 3.33Å; E83-A321 HydrophobicContact CG-CB 4.39Å; L84-A321 HydrophobicContact CD2-CB 4.19Å; L84-A321 HydrophobicContact CG-CB 4.02Å; N87-A321 PolarHBondContact ND2-O 3.28Å; N317-A321 WeakPolarHBondContact O-CB 3.43Å; N317-A321 PolarHBondContact O-N 2.93Å; A321-A325 VanDerWaalsContact O-CB 3.27Å; A321-A325 WeakPolarHBondContact O-CB 3.47Å; A321-A325 PolarHBondContact O-N 2.99Å
322	A	98.8	Very high	98.3	Very high	43 Å²	43	26.6 Å²	26.6	36%	0.355	18%	0.175	S	C	.	.	H	α-helix	trans	-67.6	-43.9	173.8	0	0	0	0	0	111.6	N87 A318 V319 I320 T326	N87-A322 PolarHBondContact ND2-N 3.49Å; A318-A322 WeakPolarHBondContact O-CB 3.24Å; A318-A322 PolarHBondContact O-N 3.1Å; V319-A322 PolarHBondContact O-N 3.1Å; I320-A322 VanDerWaalsContact C-N 3.27Å; I320-A322 PolarHBondContact O-N 3.06Å; A322-T326 WeakPolarHBondContact O-CB 3.37Å; A322-T326 PolarHBondContact O-N 2.9Å; A322-T326 PolarHBondContact O-OG1 3.14Å
323	V	98.8	Very high	98.5	Very high	32 Å²	32	26.6 Å²	26.6	19%	0.194	17%	0.172	C	C	.	.	H	α-helix	trans	-59.9	-52.5	173.6	176.8	0	0	0	0	109.6	A210 V319 I320 A325 T326 E327 L343	A210-V323 HydrophobicContact CB-CB 4.06Å; A210-V323 HydrophobicContact CB-CG1 3.59Å; V319-V323 PolarHBondContact O-N 2.98Å; V319-V323 VanDerWaalsContact O-N 3.15Å; I320-V323 PolarHBondContact O-N 3.4Å; V323-A325 PolarHBondContact O-N 2.98Å; V323-T326 WeakPolarHBondContact O-CB 3.3Å; V323-T326 PolarHBondContact O-N 3.17Å; V323-T326 VanDerWaalsContact O-N 3.14Å; V323-E327 WeakPolarHBondContact O-CG 3.36Å; V323-E327 PolarHBondContact O-N 3.29Å; V323-L343 HydrophobicContact CG1-CD1 4.35Å
324	C	98.9	Very high	98.6	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.007	17%	0.167	C	C	.	.	H	α-helix	trans	-57.2	-48.1	-179.7	-68.7	0	0	0	0	112.7	L84 V163 I199 I320 T326 E327 V328	L84-C324 HydrophobicContact CD2-CB 3.7Å; V163-C324 HydrophobicContact CG2-CB 4.13Å; I199-C324 HydrophobicContact CG2-CB 3.55Å; I320-C324 PolarHBondContact O-N 3.4Å; I320-C324 PolarHBondContact O-SG 3.25Å; I320-C324 VanDerWaalsContact O-SG 3.34Å; C324-T326 VanDerWaalsContact C-N 3.3Å; C324-T326 PolarHBondContact O-N 3.24Å; C324-E327 PolarHBondContact O-N 3.27Å; C324-E327 VanDerWaalsContact O-N 3.17Å; C324-V328 WeakPolarHBondContact O-CG2 3.39Å; C324-V328 PolarHBondContact O-N 3.29Å
325	A	98.9	Very high	98.6	Very high	3 Å²	3	23.5 Å²	23.5	3%	0.025	15%	0.15	C	C	.	.	H	α-helix	trans	-65.3	-33.3	179.1	0	0	0	0	0	112.8	L84 N87 L88 A321 V323 E327 V328 F329	L84-A325 HydrophobicContact CD2-CB 4.44Å; N87-A325 HydrophobicContact CB-CB 3.38Å; L88-A325 HydrophobicContact CD2-CB 4.29Å; A321-A325 VanDerWaalsContact O-CB 3.27Å; A321-A325 WeakPolarHBondContact O-CB 3.47Å; A321-A325 PolarHBondContact O-N 2.99Å; V323-A325 PolarHBondContact O-N 2.98Å; A325-E327 VanDerWaalsContact C-N 3.33Å; A325-V328 PolarHBondContact O-N 2.76Å; A325-F329 PolarHBondContact O-N 2.93Å
326	T	98.9	Very high	98.7	Very high	69 Å²	69	24.8 Å²	24.8	42%	0.423	15%	0.146	S	C	.	.	H	α-helix	trans	-61.9	-43.5	172.9	-59.8	0	0	0	0	110.8	A322 V323 C324 F329 K330	A322-T326 WeakPolarHBondContact O-CB 3.37Å; A322-T326 PolarHBondContact O-N 2.9Å; A322-T326 PolarHBondContact O-OG1 3.14Å; V323-T326 WeakPolarHBondContact O-CB 3.3Å; V323-T326 PolarHBondContact O-N 3.17Å; V323-T326 VanDerWaalsContact O-N 3.14Å; C324-T326 VanDerWaalsContact C-N 3.3Å; C324-T326 PolarHBondContact O-N 3.24Å; T326-F329 PolarHBondContact O-N 2.95Å; T326-K330 HydrophobicContact CG2-CD 4.44Å; T326-K330 WeakPolarHBondContact O-CG 3.28Å; T326-K330 PolarHBondContact O-N 3.3Å
327	E	98.9	Very high	98.7	Very high	11 Å²	11	30 Å²	30	5%	0.051	17%	0.173	C	C	.	.	H	α-helix	trans	-68.8	-36.7	178.1	-59.3	-45	129.6	0	0	112.7	I199 V212 V323 C324 A325 F329 K330 I331 P338 L339	I199-E327 HydrophobicContact CG1-CB 4.32Å; V212-E327 HydrophobicContact CG2-CB 3.7Å; V212-E327 HydrophobicContact CG2-CG 3.78Å; V323-E327 WeakPolarHBondContact O-CG 3.36Å; V323-E327 PolarHBondContact O-N 3.29Å; C324-E327 PolarHBondContact O-N 3.27Å; C324-E327 VanDerWaalsContact O-N 3.17Å; A325-E327 VanDerWaalsContact C-N 3.33Å; E327-F329 VanDerWaalsContact C-N 3.33Å; E327-F329 PolarHBondContact O-N 2.56Å; E327-K330 PolarHBondContact O-N 2.85Å; E327-K330 IonicContact OE1-NZ 3.39Å; E327-K330 PolarHBondContact OE1-NZ 2.67Å; E327-K330 WeakPolarHBondContact OE2-CD 3.25Å; E327-K330 IonicContact OE2-NZ 2.75Å; E327-K330 PolarHBondContact OE2-NZ 3.15Å; E327-I331 WeakPolarHBondContact O-CB 3.27Å; E327-I331 VanDerWaalsContact O-CG1 3.29Å; E327-I331 WeakPolarHBondContact O-CG1 3.21Å; E327-I331 PolarHBondContact O-N 3.2Å; E327-P338 WeakPolarHBondContact OE2-CA 3.41Å; E327-L339 HydrophobicContact CG-CB 3.87Å; E327-L339 WeakPolarHBondContact OE2-CB 3.33Å; E327-L339 PolarHBondContact OE2-N 3.43Å
328	V	98.9	Very high	98.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.1	-45.5	171.1	175.3	0	0	0	0	110.7	V72 L88 F93 I161 V163 I199 C324 A325 I331 A332	V72-V328 HydrophobicContact CG1-CG1 4.34Å; V72-V328 HydrophobicContact CG2-CG1 4.28Å; L88-V328 HydrophobicContact CD2-CB 3.86Å; L88-V328 HydrophobicContact CD2-CG1 3.55Å; L88-V328 HydrophobicContact CD2-CG2 4.34Å; F93-V328 HydrophobicContact CE1-CG1 4.08Å; F93-V328 HydrophobicContact CE2-CG1 4.24Å; F93-V328 HydrophobicContact CZ-CG1 3.71Å; I161-V328 HydrophobicContact CD1-CG1 4.06Å; I161-V328 WeakPolarHBondContact CD1-O 3.45Å; I161-V328 HydrophobicContact CG2-CG1 4.08Å; I161-V328 HydrophobicContact CG2-CG2 4.08Å; V163-V328 HydrophobicContact CB-CG2 4.09Å; V163-V328 HydrophobicContact CG2-CG2 4.32Å; I199-V328 HydrophobicContact CB-CG2 4.25Å; I199-V328 HydrophobicContact CD1-CG2 3.85Å; I199-V328 HydrophobicContact CG1-CG2 3.89Å; C324-V328 WeakPolarHBondContact O-CG2 3.39Å; C324-V328 PolarHBondContact O-N 3.29Å; A325-V328 PolarHBondContact O-N 2.76Å; V328-I331 PolarHBondContact O-N 3.42Å; V328-A332 WeakPolarHBondContact O-CB 3.5Å; V328-A332 PolarHBondContact O-N 2.69Å
329	F	98.8	Very high	98.7	Very high	25 Å²	25	31 Å²	31	11%	0.11	18%	0.176	C	C	.	.	H	α-helix	trans	-61.4	-45.9	177	-177.4	-95.8	0	0	0	112.3	V41 F44 L45 L66 F93 A325 T326 E327 A332 T333 A335	V41-F329 HydrophobicContact CG1-CE2 3.71Å; V41-F329 HydrophobicContact CG1-CZ 3.91Å; F44-F329 HydrophobicContact CB-CE1 4.27Å; F44-F329 HydrophobicContact CB-CZ 4.47Å; L45-F329 HydrophobicContact CD2-CE1 4.48Å; L45-F329 HydrophobicContact CD2-CZ 3.83Å; L45-F329 HydrophobicContact CG-CZ 4.22Å; L66-F329 HydrophobicContact CD2-CD2 4.19Å; L66-F329 HydrophobicContact CD2-CE2 3.87Å; F93-F329 HydrophobicContact CE2-CB 4.38Å; F93-F329 HydrophobicContact CE2-CD2 4.21Å; A325-F329 PolarHBondContact O-N 2.93Å; T326-F329 PolarHBondContact O-N 2.95Å; E327-F329 VanDerWaalsContact C-N 3.33Å; E327-F329 PolarHBondContact O-N 2.56Å; F329-A332 PolarHBondContact O-N 2.79Å; F329-T333 HydrophobicContact CD2-CG2 4.21Å; F329-T333 HydrophobicContact CE1-CG2 4.44Å; F329-T333 HydrophobicContact CE2-CG2 3.93Å; F329-T333 HydrophobicContact CZ-CG2 4.06Å; F329-T333 WeakPolarHBondContact O-CB 3.4Å; F329-T333 WeakPolarHBondContact O-CG2 3.3Å; F329-T333 PolarHBondContact O-N 2.76Å; F329-T333 VanDerWaalsContact O-N 3.15Å; F329-T333 PolarHBondContact O-OG1 2.76Å; F329-A335 HydrophobicContact CE1-CB 4.15Å
330	K	98.8	Very high	98.6	Very high	42 Å²	42	32.2 Å²	32.2	18%	0.183	18%	0.18	C	C	.	.	H	α-helix	trans	-60.4	-46.7	177.9	-70.8	173.7	-178.8	168.7	0	112.1	T326 E327 T333 S334	T326-K330 HydrophobicContact CG2-CD 4.44Å; T326-K330 WeakPolarHBondContact O-CG 3.28Å; T326-K330 PolarHBondContact O-N 3.3Å; E327-K330 PolarHBondContact O-N 2.85Å; E327-K330 IonicContact OE1-NZ 3.39Å; E327-K330 PolarHBondContact OE1-NZ 2.67Å; E327-K330 WeakPolarHBondContact OE2-CD 3.25Å; E327-K330 IonicContact OE2-NZ 2.75Å; E327-K330 PolarHBondContact OE2-NZ 3.15Å; K330-T333 PolarHBondContact O-N 3.2Å; K330-S334 VanDerWaalsContact O-CA 3.26Å; K330-S334 WeakPolarHBondContact O-CA 3.21Å; K330-S334 PolarHBondContact O-N 3.12Å
331	I	98.6	Very high	98.5	Very high	35 Å²	35	32.3 Å²	32.3	18%	0.179	18%	0.181	C	C	.	.	H	α-helix	trans	-64.6	-43.4	180	-69.1	165.4	0	0	0	110.9	I161 P197 I199 V212 E327 V328 T333 P338	I161-I331 HydrophobicContact CD1-CB 3.97Å; I161-I331 HydrophobicContact CD1-CG2 3.65Å; I161-I331 HydrophobicContact CG1-CG2 4.03Å; P197-I331 HydrophobicContact CB-CD1 4.21Å; P197-I331 HydrophobicContact CB-CG2 3.96Å; P197-I331 HydrophobicContact CG-CG2 3.77Å; I199-I331 HydrophobicContact CD1-CD1 3.81Å; I199-I331 HydrophobicContact CG1-CD1 4.24Å; V212-I331 HydrophobicContact CG1-CD1 3.77Å; E327-I331 WeakPolarHBondContact O-CB 3.27Å; E327-I331 VanDerWaalsContact O-CG1 3.29Å; E327-I331 WeakPolarHBondContact O-CG1 3.21Å; E327-I331 PolarHBondContact O-N 3.2Å; V328-I331 PolarHBondContact O-N 3.42Å; I331-T333 VanDerWaalsContact C-N 3.26Å; I331-T333 PolarHBondContact O-N 2.98Å; I331-P338 HydrophobicContact CD1-CB 4.43Å; I331-P338 HydrophobicContact CG1-CB 3.97Å; I331-P338 HydrophobicContact CG1-CG 3.65Å
332	A	98.5	Very high	98.4	Very high	30 Å²	30	33.3 Å²	33.3	25%	0.248	19%	0.185	C	C	.	.	H	α-helix	trans	-65.7	-28.5	-178.7	0	0	0	0	0	113.4	L66 F93 I161 V328 F329	L66-A332 HydrophobicContact CD1-CB 3.68Å; F93-A332 HydrophobicContact CE1-CB 3.77Å; F93-A332 HydrophobicContact CZ-CB 3.75Å; I161-A332 HydrophobicContact CD1-CB 3.71Å; V328-A332 WeakPolarHBondContact O-CB 3.5Å; V328-A332 PolarHBondContact O-N 2.69Å; F329-A332 PolarHBondContact O-N 2.79Å
333	T	98.5	Very high	98.4	Very high	23 Å²	23	32.2 Å²	32.2	14%	0.141	17%	0.173	C	C	.	.	H	α-helix	trans	-117.3	-13.2	-167.6	63.7	0	0	0	0	113.9	L45 L66 F329 K330 I331 A335	L45-T333 HydrophobicContact CD2-CG2 3.66Å; L66-T333 HydrophobicContact CD1-CG2 4.06Å; L66-T333 HydrophobicContact CD2-CG2 4.03Å; F329-T333 HydrophobicContact CD2-CG2 4.21Å; F329-T333 HydrophobicContact CE1-CG2 4.44Å; F329-T333 HydrophobicContact CE2-CG2 3.93Å; F329-T333 HydrophobicContact CZ-CG2 4.06Å; F329-T333 WeakPolarHBondContact O-CB 3.4Å; F329-T333 WeakPolarHBondContact O-CG2 3.3Å; F329-T333 PolarHBondContact O-N 2.76Å; F329-T333 VanDerWaalsContact O-N 3.15Å; F329-T333 PolarHBondContact O-OG1 2.76Å; K330-T333 PolarHBondContact O-N 3.2Å; I331-T333 VanDerWaalsContact C-N 3.26Å; I331-T333 PolarHBondContact O-N 2.98Å; T333-A335 PolarHBondContact O-N 3.28Å; T333-A335 VanDerWaalsContact O-N 3.12Å; T333-A335 VanDerWaalsContact OG1-CB 3.3Å; T333-A335 WeakPolarHBondContact OG1-CB 3.37Å; T333-A335 PolarHBondContact OG1-N 2.87Å
334	S	98.5	Very high	98.4	Very high	22 Å²	22	33.2 Å²	33.2	15%	0.154	18%	0.179	C	C	.	.			trans	55.7	17.7	-167.6	-53.8	0	0	0	0	113.6	H53 F56 K330 Y336	H53-S334 WeakPolarHBondContact CB-O 3.44Å; H53-S334 PolarHBondContact N-O 3.06Å; F56-S334 WeakPolarHBondContact CB-O 3.14Å; K330-S334 VanDerWaalsContact O-CA 3.26Å; K330-S334 WeakPolarHBondContact O-CA 3.21Å; K330-S334 PolarHBondContact O-N 3.12Å; S334-Y336 PolarHBondContact O-N 2.94Å; S334-Y336 VanDerWaalsContact O-N 3.14Å
335	A	98.3	Very high	98.4	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.008	18%	0.18	C	C	.	.	S	Bend	trans	-59.5	-31.7	-176.5	0	0	0	0	0	113.1	T52 F56 F329 T333	T52-A335 WeakPolarHBondContact CA-O 3.43Å; F56-A335 HydrophobicContact CE2-CB 4.33Å; F329-A335 HydrophobicContact CE1-CB 4.15Å; T333-A335 PolarHBondContact O-N 3.28Å; T333-A335 VanDerWaalsContact O-N 3.12Å; T333-A335 VanDerWaalsContact OG1-CB 3.3Å; T333-A335 WeakPolarHBondContact OG1-CB 3.37Å; T333-A335 PolarHBondContact OG1-N 2.87Å
336	Y	98.7	Very high	98.3	Very high	87 Å²	87	35.7 Å²	35.7	34%	0.341	19%	0.191	S	C	.	.	S	Bend	trans	-146.3	163.4	174	-66.1	-94.2	0	0	0	109.8	F44 F51 S334	F44-Y336 AromaticContact CD1-CE2 3.82Å; F44-Y336 HydrophobicContact CD1-CE2 3.82Å; F44-Y336 HydrophobicContact CE1-CE2 4.3Å; F51-Y336 HydrophobicContact CB-CD1 4.1Å; F51-Y336 HydrophobicContact CB-CE1 4.03Å; F51-Y336 VanDerWaalsContact O-CD1 3.31Å; F51-Y336 WeakPolarHBondContact O-CD1 3.32Å; S334-Y336 PolarHBondContact O-N 2.94Å; S334-Y336 VanDerWaalsContact O-N 3.14Å
337	I	98.3	Very high	98.2	Very high	109 Å²	109	34.2 Å²	34.2	56%	0.559	18%	0.181	S	C	*	.	P	Polyproline II helix	trans	-62.4	129.5	170.3	-57.7	171.9	0	0	0	109.2
338	P	98.4	Very high	98.1	Very high	38 Å²	38	38.5 Å²	38.5	25%	0.247	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-62.2	159.8	176	-22.6	33.8	0	0	0	113	E327 I331 N340	E327-P338 WeakPolarHBondContact OE2-CA 3.41Å; I331-P338 HydrophobicContact CD1-CB 4.43Å; I331-P338 HydrophobicContact CG1-CB 3.97Å; I331-P338 HydrophobicContact CG1-CG 3.65Å; P338-N340 PolarHBondContact O-N 2.79Å
339	L	98.2	Very high	97.9	Very high	24 Å²	24	45.6 Å²	45.6	13%	0.126	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-51.1	126.2	169.4	170.2	66.7	0	0	0	109.4	V212 E327 N341 L343 T355	V212-L339 HydrophobicContact CG2-CB 3.91Å; V212-L339 HydrophobicContact CG2-CD2 4.38Å; V212-L339 HydrophobicContact CG2-CG 4.49Å; E327-L339 HydrophobicContact CG-CB 3.87Å; E327-L339 WeakPolarHBondContact OE2-CB 3.33Å; E327-L339 PolarHBondContact OE2-N 3.43Å; L339-N341 VanDerWaalsContact C-N 3.31Å; L339-N341 PolarHBondContact O-N 2.96Å; L339-L343 HydrophobicContact CD1-CB 4.4Å; L339-L343 HydrophobicContact CD2-CB 3.97Å; L339-T355 HydrophobicContact CD1-CG2 3.44Å; L339-T355 VanDerWaalsContact CD1-CG2 3.44Å
340	N	97.5	Very high	97.8	Very high	81 Å²	81	47 Å²	47	43%	0.433	27%	0.267	S	S	.	.			trans	-78.2	85.7	177.6	-162.6	-3.4	0	0	0	110.5	P338 Y342 F356 E357	P338-N340 PolarHBondContact O-N 2.79Å; N340-Y342 PolarHBondContact O-N 3.02Å; N340-Y342 VanDerWaalsContact O-N 3.09Å; N340-F356 CarbonylContact O-C 3.37Å; N340-E357 VanDerWaalsContact ND2-CD 3.31Å; N340-E357 PolarHBondContact ND2-OE2 3.49Å; N340-E357 WeakPolarHBondContact O-CA 3.5Å; N340-E357 WeakPolarHBondContact OD1-CG 3.25Å
341	N	96.1	Very high	97.7	Very high	2 Å²	2	51.8 Å²	51.8	1%	0.011	29%	0.294	C	S	.	.	S	Bend	trans	69.8	-71.6	178.7	-161.8	-92.1	0	0	0	117.6	R211 V212 A219 L339 A358	R211-N341 CarbonylContact C-O 3.38Å; R211-N341 WeakPolarHBondContact CA-O 3.33Å; R211-N341 WeakPolarHBondContact CB-O 3.09Å; V212-N341 PolarHBondContact N-O 3Å; V212-N341 PolarHBondContact O-ND2 3.14Å; A219-N341 PolarHBondContact O-ND2 2.77Å; A219-N341 VanDerWaalsContact O-ND2 3.15Å; L339-N341 VanDerWaalsContact C-N 3.31Å; L339-N341 PolarHBondContact O-N 2.96Å; N341-A358 WeakPolarHBondContact OD1-CB 3.47Å
342	Y	98.2	Very high	97.6	Very high	21 Å²	21	56.1 Å²	56.1	8%	0.082	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	139.4	-159.8	-145.6	-77.9	0	0	0	114.3	N209 R211 L227 N340 V344 T355 F356	N209-Y342 HydrophobicContact CB-CE1 3.7Å; N209-Y342 PolarHBondContact ND2-OH 3.36Å; R211-Y342 HydrophobicContact CB-CD2 4.02Å; R211-Y342 HydrophobicContact CB-CE2 4.38Å; L227-Y342 HydrophobicContact CD1-CE2 4.1Å; N340-Y342 PolarHBondContact O-N 3.02Å; N340-Y342 VanDerWaalsContact O-N 3.09Å; Y342-V344 HydrophobicContact CD1-CG2 3.98Å; Y342-V344 HydrophobicContact CE1-CG2 3.68Å; Y342-T355 VanDerWaalsContact O-CA 3.31Å; Y342-T355 WeakPolarHBondContact O-CA 3.34Å; Y342-F356 WeakPolarHBondContact CB-O 3.36Å; Y342-F356 HydrophobicContact CD1-CD1 4.47Å; Y342-F356 AromaticContact CD1-CE1 3.52Å; Y342-F356 HydrophobicContact CD1-CE1 3.52Å; Y342-F356 AromaticContact CD1-CZ 3.69Å; Y342-F356 HydrophobicContact CD1-CZ 3.69Å; Y342-F356 HydrophobicContact CD2-CZ 4.3Å; Y342-F356 HydrophobicContact CE1-CE1 4.33Å; Y342-F356 HydrophobicContact CE1-CZ 4.38Å; Y342-F356 AromaticContact CG-CE1 3.84Å; Y342-F356 HydrophobicContact CG-CE1 3.84Å; Y342-F356 HydrophobicContact CG-CE2 4.35Å; Y342-F356 AromaticContact CG-CZ 3.65Å; Y342-F356 HydrophobicContact CG-CZ 3.65Å; Y342-F356 PolarHBondContact N-O 3.47Å; Y342-F356 VanDerWaalsContact N-O 3.08Å; Y342-F356 PolarHBondContact O-N 3.43Å
343	L	98.6	Very high	97.6	Very high	21 Å²	21	58.7 Å²	58.7	11%	0.11	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	134	170.1	-178.8	151.7	0	0	0	110.2	N209 A210 V323 L339 F345 T353 Y354	N209-L343 CarbonylContact C-O 3.52Å; N209-L343 WeakPolarHBondContact CA-O 3.44Å; N209-L343 WeakPolarHBondContact CB-O 3.43Å; A210-L343 PolarHBondContact N-O 2.85Å; A210-L343 PolarHBondContact O-N 2.68Å; V323-L343 HydrophobicContact CG1-CD1 4.35Å; L339-L343 HydrophobicContact CD1-CB 4.4Å; L339-L343 HydrophobicContact CD2-CB 3.97Å; L343-F345 HydrophobicContact CD2-CB 4.45Å; L343-T353 HydrophobicContact CD2-CG2 4.47Å; L343-Y354 CarbonylContact C-O 3.5Å; L343-Y354 WeakPolarHBondContact CA-O 3.47Å
344	V	98.1	Very high	97.6	Very high	52 Å²	52	63.6 Å²	63.6	32%	0.315	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	144.8	169.9	178.9	0	0	0	0	109.4	Y342 T353 Y354 F356	Y342-V344 HydrophobicContact CD1-CG2 3.98Å; Y342-V344 HydrophobicContact CE1-CG2 3.68Å; V344-T353 CarbonylContact O-C 3.55Å; V344-T353 WeakPolarHBondContact O-CA 3.44Å; V344-Y354 PolarHBondContact N-O 3.44Å; V344-Y354 PolarHBondContact O-N 3.25Å; V344-F356 HydrophobicContact CG2-CE1 4.41Å
345	F	98.5	Very high	97.6	Very high	10 Å²	10	66 Å²	66	4%	0.044	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	141.1	175	171.1	-104	0	0	0	110.8	K207 G208 T316 V319 I320 L343 D347 L351 Y352 T353	K207-F345 VanDerWaalsContact CA-O 3.31Å; K207-F345 WeakPolarHBondContact CA-O 3.41Å; G208-F345 PolarHBondContact N-O 3.37Å; G208-F345 PolarHBondContact O-N 2.98Å; T316-F345 HydrophobicContact CG2-CD1 4.16Å; T316-F345 HydrophobicContact CG2-CE1 4.14Å; V319-F345 HydrophobicContact CB-CE1 4.4Å; V319-F345 HydrophobicContact CB-CZ 4.41Å; V319-F345 HydrophobicContact CG1-CD1 4.15Å; V319-F345 HydrophobicContact CG1-CD2 3.88Å; V319-F345 HydrophobicContact CG1-CE1 4.24Å; V319-F345 HydrophobicContact CG1-CE2 3.95Å; V319-F345 HydrophobicContact CG1-CG 3.96Å; V319-F345 HydrophobicContact CG1-CZ 4.12Å; V319-F345 HydrophobicContact CG2-CE1 4.42Å; V319-F345 HydrophobicContact CG2-CE2 4.47Å; V319-F345 HydrophobicContact CG2-CZ 4.07Å; I320-F345 HydrophobicContact CD1-CB 3.93Å; L343-F345 HydrophobicContact CD2-CB 4.45Å; F345-D347 HydrophobicContact CE1-CB 4.06Å; F345-D347 HydrophobicContact CE2-CB 4.36Å; F345-D347 HydrophobicContact CZ-CB 3.6Å; F345-L351 HydrophobicContact CE2-CD2 4.18Å; F345-L351 HydrophobicContact CZ-CD2 4.22Å; F345-Y352 WeakPolarHBondContact CA-O 3.25Å; F345-T353 HydrophobicContact CB-CG2 4.45Å; F345-T353 HydrophobicContact CD2-CG2 3.93Å
346	N	98.1	Very high	97.6	Very high	46 Å²	46	68.7 Å²	68.7	25%	0.246	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	127.9	173.7	-175	-4.9	0	0	0	110.4	F206 K207 V348 Y352	F206-N346 WeakPolarHBondContact O-CA 3.32Å; K207-N346 HydrophobicContact CG-CB 4.38Å; N346-V348 WeakPolarHBondContact OD1-CB 3.42Å; N346-V348 WeakPolarHBondContact OD1-CG2 3.24Å; N346-V348 PolarHBondContact OD1-N 3.38Å; N346-Y352 PolarHBondContact N-O 3.37Å; N346-Y352 PolarHBondContact O-N 2.99Å
347	D	96.4	Very high	97.6	Very high	39 Å²	39	70.6 Å²	70.6	21%	0.209	38%	0.376	C	S	.	.			trans	-119.1	20.7	176.8	68.4	-18.5	0	0	0	114.7	F206 F345 G350 L351	F206-D347 WeakPolarHBondContact CA-OD1 3.29Å; F206-D347 WeakPolarHBondContact CB-OD1 3.45Å; F206-D347 WeakPolarHBondContact CD1-OD1 3.44Å; F206-D347 WeakPolarHBondContact CG-OD1 3.46Å; F206-D347 PolarHBondContact O-N 2.99Å; F345-D347 HydrophobicContact CE1-CB 4.06Å; F345-D347 HydrophobicContact CE2-CB 4.36Å; F345-D347 HydrophobicContact CZ-CB 3.6Å; D347-G350 CarbonylContact C-O 3.18Å; D347-G350 VanDerWaalsContact CA-O 3.3Å; D347-G350 WeakPolarHBondContact CA-O 3.36Å; D347-L351 HydrophobicContact CB-CD2 3.45Å; D347-L351 VanDerWaalsContact CB-CD2 3.45Å
348	V	96.1	Very high	97.5	Very high	100 Å²	100	66 Å²	66	61%	0.606	35%	0.354	S	S	*	.	S	Bend	trans	-70.3	-38	174.9	177.5	0	0	0	0	112.2	F206 N346	F206-V348 HydrophobicContact CB-CG2 3.57Å; F206-V348 HydrophobicContact CD2-CG2 4.44Å; F206-V348 HydrophobicContact CG-CG2 4.4Å; N346-V348 WeakPolarHBondContact OD1-CB 3.42Å; N346-V348 WeakPolarHBondContact OD1-CG2 3.24Å; N346-V348 PolarHBondContact OD1-N 3.38Å
349	D	95	Very high	97.5	Very high	149 Å²	149	72.4 Å²	72.4	80%	0.797	38%	0.38	S	S	*	.	S	Bend	trans	-133.4	100.7	178.4	-172.9	5.7	0	0	0	109.3
350	G	95.7	Very high	97.4	Very high	55 Å²	55	75.6 Å²	75.6	57%	0.567	39%	0.391	S	S	*	.	S	Bend	trans	64.3	-148.7	-168.7	0	0	0	0	0	112.2	D347	D347-G350 CarbonylContact C-O 3.18Å; D347-G350 VanDerWaalsContact CA-O 3.3Å; D347-G350 WeakPolarHBondContact CA-O 3.36Å
351	L	96.9	Very high	97.3	Very high	143 Å²	143	74.6 Å²	74.6	75%	0.749	38%	0.383	S	S	*	.			trans	-124.2	122.6	170.9	-63.9	177.6	0	0	0	108.2	F345 D347	F345-L351 HydrophobicContact CE2-CD2 4.18Å; F345-L351 HydrophobicContact CZ-CD2 4.22Å; D347-L351 HydrophobicContact CB-CD2 3.45Å; D347-L351 VanDerWaalsContact CB-CD2 3.45Å
352	Y	97.8	Very high	97.1	Very high	126 Å²	126	83 Å²	83	49%	0.494	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	133.8	-178.7	176.1	-101.9	0	0	0	111	F345 N346 Y354	F345-Y352 WeakPolarHBondContact CA-O 3.25Å; N346-Y352 PolarHBondContact N-O 3.37Å; N346-Y352 PolarHBondContact O-N 2.99Å; Y352-Y354 WeakPolarHBondContact OH-CB 3.3Å
353	T	98.5	Very high	96.8	Very high	84 Å²	84	87.1 Å²	87.1	52%	0.515	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	148.9	166.3	58	0	0	0	0	111	L343 V344 F345	L343-T353 HydrophobicContact CD2-CG2 4.47Å; V344-T353 CarbonylContact O-C 3.55Å; V344-T353 WeakPolarHBondContact O-CA 3.44Å; F345-T353 HydrophobicContact CB-CG2 4.45Å; F345-T353 HydrophobicContact CD2-CG2 3.93Å
354	Y	98.1	Very high	96.7	Very high	125 Å²	125	86.1 Å²	86.1	49%	0.49	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	127.9	172	-178	-115.9	0	0	0	109.4	L343 V344 Y352 F356	L343-Y354 CarbonylContact C-O 3.5Å; L343-Y354 WeakPolarHBondContact CA-O 3.47Å; V344-Y354 PolarHBondContact N-O 3.44Å; V344-Y354 PolarHBondContact O-N 3.25Å; Y352-Y354 WeakPolarHBondContact OH-CB 3.3Å; Y354-F356 AromaticContact CD1-CD1 3.59Å; Y354-F356 HydrophobicContact CD1-CD1 3.59Å; Y354-F356 HydrophobicContact CD1-CE1 4.24Å; Y354-F356 HydrophobicContact CD1-CG 4.42Å; Y354-F356 HydrophobicContact CE1-CB 3.82Å; Y354-F356 AromaticContact CE1-CD1 3.46Å; Y354-F356 HydrophobicContact CE1-CD1 3.46Å; Y354-F356 VanDerWaalsContact CE1-CD1 3.46Å; Y354-F356 HydrophobicContact CE1-CE1 4.3Å; Y354-F356 AromaticContact CE1-CG 3.87Å; Y354-F356 HydrophobicContact CE1-CG 3.87Å
355	T	98.6	Very high	96.4	Very high	74 Å²	74	84.7 Å²	84.7	45%	0.454	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.9	-179.8	-65.5	0	0	0	0	109.2	L339 Y342	L339-T355 HydrophobicContact CD1-CG2 3.44Å; L339-T355 VanDerWaalsContact CD1-CG2 3.44Å; Y342-T355 VanDerWaalsContact O-CA 3.31Å; Y342-T355 WeakPolarHBondContact O-CA 3.34Å
356	F	98	Very high	96.2	Very high	57 Å²	57	84.6 Å²	84.6	25%	0.25	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	153.1	178.5	68.2	-82.3	0	0	0	110.9	L227 N340 Y342 V344 Y354 A358	L227-F356 HydrophobicContact CD1-CZ 4.29Å; N340-F356 CarbonylContact O-C 3.37Å; Y342-F356 WeakPolarHBondContact CB-O 3.36Å; Y342-F356 HydrophobicContact CD1-CD1 4.47Å; Y342-F356 AromaticContact CD1-CE1 3.52Å; Y342-F356 HydrophobicContact CD1-CE1 3.52Å; Y342-F356 AromaticContact CD1-CZ 3.69Å; Y342-F356 HydrophobicContact CD1-CZ 3.69Å; Y342-F356 HydrophobicContact CD2-CZ 4.3Å; Y342-F356 HydrophobicContact CE1-CE1 4.33Å; Y342-F356 HydrophobicContact CE1-CZ 4.38Å; Y342-F356 AromaticContact CG-CE1 3.84Å; Y342-F356 HydrophobicContact CG-CE1 3.84Å; Y342-F356 HydrophobicContact CG-CE2 4.35Å; Y342-F356 AromaticContact CG-CZ 3.65Å; Y342-F356 HydrophobicContact CG-CZ 3.65Å; Y342-F356 PolarHBondContact N-O 3.47Å; Y342-F356 VanDerWaalsContact N-O 3.08Å; Y342-F356 PolarHBondContact O-N 3.43Å; V344-F356 HydrophobicContact CG2-CE1 4.41Å; Y354-F356 AromaticContact CD1-CD1 3.59Å; Y354-F356 HydrophobicContact CD1-CD1 3.59Å; Y354-F356 HydrophobicContact CD1-CE1 4.24Å; Y354-F356 HydrophobicContact CD1-CG 4.42Å; Y354-F356 HydrophobicContact CE1-CB 3.82Å; Y354-F356 AromaticContact CE1-CD1 3.46Å; Y354-F356 HydrophobicContact CE1-CD1 3.46Å; Y354-F356 VanDerWaalsContact CE1-CD1 3.46Å; Y354-F356 HydrophobicContact CE1-CE1 4.3Å; Y354-F356 AromaticContact CE1-CG 3.87Å; Y354-F356 HydrophobicContact CE1-CG 3.87Å; F356-A358 HydrophobicContact CD2-CB 4.41Å; F356-A358 HydrophobicContact CE2-CB 3.87Å
357	E	98.2	Very high	96	Very high	127 Å²	127	82.4 Å²	82.4	59%	0.593	42%	0.422	S	S	*	.			trans	-84.5	111.4	170.8	-179.3	176	171.1	0	0	108.9	N340	N340-E357 VanDerWaalsContact ND2-CD 3.31Å; N340-E357 PolarHBondContact ND2-OE2 3.49Å; N340-E357 WeakPolarHBondContact O-CA 3.5Å; N340-E357 WeakPolarHBondContact OD1-CG 3.25Å
358	A	97.3	Very high	95.8	Very high	11 Å²	11	81.6 Å²	81.6	9%	0.091	42%	0.419	C	S	.	.			trans	-74.3	131.1	172.3	0	0	0	0	0	109.9	A219 T224 N341 F356	A219-A358 HydrophobicContact CB-CB 4.02Å; A219-A358 VanDerWaalsContact CB-O 3.23Å; A219-A358 WeakPolarHBondContact CB-O 3.48Å; T224-A358 HydrophobicContact CG2-CB 3.73Å; N341-A358 WeakPolarHBondContact OD1-CB 3.47Å; F356-A358 HydrophobicContact CD2-CB 4.41Å; F356-A358 HydrophobicContact CE2-CB 3.87Å
359	E	96.9	Very high	95.3	Very high	173 Å²	173	82.1 Å²	82.1	81%	0.808	42%	0.415	S	S	*	.			trans	-68.5	135	179	-64.8	-173.8	162.1	0	0	111.4	K361	E359-K361 PolarHBondContact O-N 3.4Å
360	R	97.2	Very high	94.7	Very high	91 Å²	91	81.2 Å²	81.2	34%	0.343	41%	0.409	S	S	.	.			trans	-73.6	115.6	171.7	-179.1	-175.2	172.6	-165.1	4.8	108.7	G216 A219 E362 C367	G216-R360 PolarHBondContact O-NH1 2.96Å; G216-R360 PolarHBondContact O-NH2 3.17Å; A219-R360 HydrophobicContact CB-CB 4.47Å; R360-E362 PolarHBondContact O-N 3.27Å; R360-C367 PolarHBondContact NH2-O 2.81Å
361	K	95.1	Very high	94.2	Very high	61 Å²	61	80.3 Å²	80.3	27%	0.265	39%	0.393	S	S	.	.			trans	-62	119.6	173.8	-67.9	-177.2	176	171.8	0	110.1	C223 E226 E359 N363 C364	C223-K361 HydrophobicContact CB-CG 4.45Å; C223-K361 WeakPolarHBondContact O-CD 3.45Å; C223-K361 WeakPolarHBondContact O-CE 3.45Å; C223-K361 PolarHBondContact O-NZ 3.45Å; E226-K361 IonicContact OE1-NZ 3.35Å; E226-K361 PolarHBondContact OE1-NZ 2.77Å; E226-K361 IonicContact OE2-NZ 3.45Å; E226-K361 PolarHBondContact OE2-NZ 3.4Å; E359-K361 PolarHBondContact O-N 3.4Å; K361-N363 PolarHBondContact O-N 3.46Å; K361-C364 HydrophobicContact CB-CB 4.14Å; K361-C364 VanDerWaalsContact O-CB 3.22Å; K361-C364 WeakPolarHBondContact O-CB 3.49Å; K361-C364 PolarHBondContact O-N 3.3Å
362	E	92.8	Very high	93.9	Very high	178 Å²	178	74.9 Å²	74.9	83%	0.832	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-34	179.2	-64.7	-173.4	162.2	0	0	112.3	R360 S368	R360-E362 PolarHBondContact O-N 3.27Å; E362-S368 VanDerWaalsContact O-CB 3.28Å; E362-S368 WeakPolarHBondContact O-CB 3.42Å; E362-S368 PolarHBondContact O-OG 2.95Å
363	N	92.2	Very high	93.7	Very high	107 Å²	107	73.6 Å²	73.6	57%	0.572	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	27.1	176.3	67.1	-16.4	0	0	0	112.8	K361 Q372	K361-N363 PolarHBondContact O-N 3.46Å; N363-Q372 VanDerWaalsContact O-CD 3.26Å; N363-Q372 PolarHBondContact O-NE2 3.48Å; N363-Q372 PolarHBondContact O-OE1 2.88Å
364	C	94.4	Very high	93.4	Very high	1 Å²	1	69.8 Å²	69.8	1%	0.007	34%	0.342	C	S	.	.			trans	-60.1	129.6	177.7	178.4	0	0	0	0	111.7	C223 K361 A366 C367 S368 Q372	C223-C364 VanDerWaalsContact SG-SG 3.63Å; K361-C364 HydrophobicContact CB-CB 4.14Å; K361-C364 VanDerWaalsContact O-CB 3.22Å; K361-C364 WeakPolarHBondContact O-CB 3.49Å; K361-C364 PolarHBondContact O-N 3.3Å; C364-A366 PolarHBondContact O-N 2.89Å; C364-A366 VanDerWaalsContact O-N 3.13Å; C364-A366 PolarHBondContact SG-N 3.32Å; C364-C367 VanDerWaalsContact CB-SG 3.51Å; C364-C367 PolarHBondContact SG-N 3.25Å; C364-S368 WeakPolarHBondContact O-CB 3.39Å; C364-S368 PolarHBondContact O-N 3.21Å; C364-S368 VanDerWaalsContact O-N 3.14Å; C364-Q372 PolarHBondContact O-NE2 2.88Å
365	P	92.3	Very high	93.3	Very high	22 Å²	22	70.6 Å²	70.6	14%	0.143	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-14.7	-179.5	29.2	-38.3	0	0	0	114.1	E222 Q372 L395 V455	E222-P365 HydrophobicContact CG-CG 4.24Å; P365-Q372 HydrophobicContact CB-CG 4.12Å; P365-L395 HydrophobicContact CB-CD2 3.72Å; P365-L395 HydrophobicContact CG-CD2 3.87Å; P365-V455 HydrophobicContact CB-CG1 4.23Å; P365-V455 WeakPolarHBondContact O-CG1 3.41Å
366	A	94.4	Very high	93.2	Very high	8 Å²	8	68.2 Å²	68.2	7%	0.066	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-57	178.6	0	0	0	0	0	112.5	I180 E222 C364	I180-A366 HydrophobicContact CD1-CB 3.74Å; I180-A366 WeakPolarHBondContact CG2-O 3.18Å; E222-A366 HydrophobicContact CB-CB 3.87Å; E222-A366 HydrophobicContact CG-CB 3.83Å; C364-A366 PolarHBondContact O-N 2.89Å; C364-A366 VanDerWaalsContact O-N 3.13Å; C364-A366 PolarHBondContact SG-N 3.32Å
367	C	94.8	Very high	93.1	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-1	-171.2	71	0	0	0	0	114.8	I180 C220 C223 R360 C364	I180-C367 HydrophobicContact CD1-CB 3.8Å; I180-C367 HydrophobicContact CG1-CB 4.37Å; C220-C367 HydrophobicContact CB-CB 4.19Å; C220-C367 VanDerWaalsContact SG-SG 3.61Å; C223-C367 VanDerWaalsContact SG-SG 3.63Å; R360-C367 PolarHBondContact NH2-O 2.81Å; C364-C367 VanDerWaalsContact CB-SG 3.51Å; C364-C367 PolarHBondContact SG-N 3.25Å
368	S	91.4	Very high	93	Very high	22 Å²	22	62.9 Å²	62.9	15%	0.154	32%	0.317	C	S	.	.			trans	-78.4	141.2	170	-168.3	0	0	0	0	109.5	E362 C364 L370	E362-S368 VanDerWaalsContact O-CB 3.28Å; E362-S368 WeakPolarHBondContact O-CB 3.42Å; E362-S368 PolarHBondContact O-OG 2.95Å; C364-S368 WeakPolarHBondContact O-CB 3.39Å; C364-S368 PolarHBondContact O-N 3.21Å; C364-S368 VanDerWaalsContact O-N 3.14Å; S368-L370 PolarHBondContact OG-N 3.35Å
369	Q	85.2	Confident	92.9	Very high	111 Å²	111	66.3 Å²	66.3	52%	0.519	34%	0.34	S	S	.	.	S	Bend	trans	-81.4	-7.3	173.1	-65	-59.5	-65.4	0	0	112.2	Y185	Y185-Q369 HydrophobicContact CD1-CG 4.25Å; Y185-Q369 HydrophobicContact CE1-CG 3.79Å; Y185-Q369 HydrophobicContact CE2-CG 4.23Å; Y185-Q369 VanDerWaalsContact CZ-CD 3.43Å; Y185-Q369 VanDerWaalsContact CZ-NE2 3.32Å; Y185-Q369 PolarHBondContact OH-NE2 3.34Å
370	L	82.7	Confident	93	Very high	129 Å²	129	58.3 Å²	58.3	68%	0.675	30%	0.304	S	S	*	.	S	Bend	trans	-96.1	137.9	-177.5	-59.2	179.6	0	0	0	111	S368	S368-L370 PolarHBondContact OG-N 3.35Å
371	P	85.3	Confident	93	Very high	37 Å²	37	58.8 Å²	58.8	24%	0.24	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-55.7	144.6	169.3	-24.2	33.3	0	0	0	111.9	L456 K458	P371-L456 CarbonylContact C-O 3.59Å; P371-L456 WeakPolarHBondContact CA-O 3.45Å; P371-L456 HydrophobicContact CB-CB 4.1Å; P371-L456 HydrophobicContact CG-CB 4.3Å; P371-K458 HydrophobicContact CB-CB 4.28Å
372	Q	90.8	Very high	93.1	Very high	28 Å²	28	55.9 Å²	55.9	13%	0.131	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	122.7	179.5	-65.8	-62.1	-56.5	0	0	110.7	N363 C364 P365 I374 V455 L456 F457 K458	N363-Q372 VanDerWaalsContact O-CD 3.26Å; N363-Q372 PolarHBondContact O-NE2 3.48Å; N363-Q372 PolarHBondContact O-OE1 2.88Å; C364-Q372 PolarHBondContact O-NE2 2.88Å; P365-Q372 HydrophobicContact CB-CG 4.12Å; Q372-I374 PolarHBondContact O-N 3.24Å; Q372-V455 HydrophobicContact CG-CG1 4.34Å; Q372-L456 PolarHBondContact N-O 3.2Å; Q372-F457 HydrophobicContact CB-CD1 3.36Å; Q372-F457 HydrophobicContact CB-CE1 3.54Å; Q372-F457 HydrophobicContact CB-CG 4.11Å; Q372-F457 HydrophobicContact CB-CZ 4.39Å; Q372-F457 HydrophobicContact CG-CD1 4.32Å; Q372-F457 HydrophobicContact CG-CE1 4.08Å; Q372-F457 CarbonylContact O-C 3.52Å; Q372-F457 WeakPolarHBondContact O-CA 3.31Å; Q372-K458 PolarHBondContact O-N 3.31Å
373	N	92.6	Very high	93.3	Very high	100 Å²	100	50.5 Å²	50.5	54%	0.535	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	127.9	178.6	-66	-53.4	0	0	0	110.8	K458 H460	N373-K458 WeakPolarHBondContact CA-O 3.11Å; N373-H460 PolarHBondContact OD1-CD2 3.47Å; N373-H460 PolarHBondContact OD1-NE2 3.29Å
374	I	94.2	Very high	93.6	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.015	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	143.9	172.4	56.5	174.2	0	0	0	110.2	Q372 F376 V385 Y388 L444 F457 K458 L459 H460	Q372-I374 PolarHBondContact O-N 3.24Å; I374-F376 HydrophobicContact CB-CD2 4.22Å; I374-F376 HydrophobicContact CB-CE2 4Å; I374-F376 HydrophobicContact CD1-CD2 4.3Å; I374-F376 HydrophobicContact CD1-CE2 4.22Å; I374-F376 HydrophobicContact CG1-CD2 4.41Å; I374-F376 HydrophobicContact CG1-CE2 4.48Å; I374-V385 HydrophobicContact CD1-CG1 4.27Å; I374-Y388 HydrophobicContact CG2-CD1 4.24Å; I374-Y388 HydrophobicContact CG2-CE1 3.57Å; I374-L444 HydrophobicContact CD1-CD1 3.72Å; I374-F457 HydrophobicContact CD1-CB 4.1Å; I374-F457 HydrophobicContact CG1-CB 4.36Å; I374-F457 HydrophobicContact CG2-CD1 3.56Å; I374-F457 HydrophobicContact CG2-CE1 4.23Å; I374-F457 HydrophobicContact CG2-CG 4.42Å; I374-K458 PolarHBondContact N-O 3.43Å; I374-L459 HydrophobicContact CD1-CD1 4.08Å; I374-L459 HydrophobicContact CG1-CB 4.43Å; I374-L459 HydrophobicContact CG1-CD1 4.09Å; I374-H460 PolarHBondContact O-N 3.42Å
375	Q	95.6	Very high	93.7	Very high	142 Å²	142	49.8 Å²	49.8	66%	0.664	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.3	117.6	-175.1	-68.7	178.9	6	0	0	109.4	H460 T462	Q375-H460 WeakPolarHBondContact CA-O 3.22Å; Q375-H460 HydrophobicContact CG-CB 4.38Å; Q375-T462 HydrophobicContact CB-CG2 3.84Å; Q375-T462 HydrophobicContact CG-CG2 4.36Å
376	F	96.8	Very high	93.9	Very high	25 Å²	25	49.1 Å²	49.1	11%	0.11	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	151.8	177.5	-74.5	-83.9	0	0	0	109.6	I374 A380 E384 V385 Y388 L433 L459 H460 F461 T462	I374-F376 HydrophobicContact CB-CD2 4.22Å; I374-F376 HydrophobicContact CB-CE2 4Å; I374-F376 HydrophobicContact CD1-CD2 4.3Å; I374-F376 HydrophobicContact CD1-CE2 4.22Å; I374-F376 HydrophobicContact CG1-CD2 4.41Å; I374-F376 HydrophobicContact CG1-CE2 4.48Å; F376-A380 HydrophobicContact CB-CB 4.04Å; F376-A380 HydrophobicContact CD1-CB 4.01Å; F376-A380 HydrophobicContact CG-CB 4.46Å; F376-E384 HydrophobicContact CE1-CB 4.15Å; F376-V385 HydrophobicContact CD1-CG2 4.18Å; F376-V385 HydrophobicContact CD2-CG2 3.91Å; F376-V385 HydrophobicContact CE1-CG2 4.13Å; F376-V385 HydrophobicContact CE2-CB 4.33Å; F376-V385 HydrophobicContact CE2-CG1 4.27Å; F376-V385 HydrophobicContact CE2-CG2 3.85Å; F376-V385 HydrophobicContact CG-CG2 4.08Å; F376-V385 HydrophobicContact CZ-CB 4.27Å; F376-V385 HydrophobicContact CZ-CG2 3.98Å; F376-Y388 HydrophobicContact CE2-CD1 4.44Å; F376-Y388 HydrophobicContact CZ-CD1 4.32Å; F376-Y388 AromaticContact CZ-CG 3.99Å; F376-Y388 HydrophobicContact CZ-CG 3.99Å; F376-L433 HydrophobicContact CB-CD1 3.65Å; F376-L433 HydrophobicContact CG-CD1 4.28Å; F376-L459 HydrophobicContact CB-CD1 4.25Å; F376-L459 HydrophobicContact CD2-CD1 4.21Å; F376-H460 PolarHBondContact N-O 2.96Å; F376-H460 VanDerWaalsContact N-O 3.15Å; F376-F461 CarbonylContact O-C 3.56Å; F376-F461 VanDerWaalsContact O-CA 3.27Å; F376-F461 WeakPolarHBondContact O-CA 3.39Å; F376-T462 VanDerWaalsContact C-OG1 3.26Å; F376-T462 PolarHBondContact O-N 3.24Å; F376-T462 PolarHBondContact O-OG1 2.87Å
377	S	95.8	Very high	94	Very high	35 Å²	35	52 Å²	52	25%	0.245	27%	0.273	C	S	.	.			trans	-70	148.9	168.7	176.6	0	0	0	0	109.4	S379 A380 T462	S377-S379 PolarHBondContact O-N 2.86Å; S377-S379 VanDerWaalsContact O-N 3.09Å; S377-S379 PolarHBondContact OG-N 2.94Å; S377-S379 PolarHBondContact OG-OG 3.48Å; S377-S379 VanDerWaalsContact OG-OG 3.06Å; S377-A380 WeakPolarHBondContact O-CB 3.14Å; S377-A380 PolarHBondContact O-N 2.94Å; S377-T462 PolarHBondContact N-OG1 3.08Å
378	P	95	Very high	94.1	Very high	37 Å²	37	56.1 Å²	56.1	24%	0.24	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-21.8	174.1	23.6	-35	0	0	0	113.4	K434 F461 T462	P378-K434 HydrophobicContact CB-CB 4.41Å; P378-K434 WeakPolarHBondContact O-CB 3.47Å; P378-K434 PolarHBondContact O-N 2.72Å; P378-K434 VanDerWaalsContact O-N 3.12Å; P378-F461 HydrophobicContact CB-CD1 4.21Å; P378-F461 HydrophobicContact CB-CD2 4.07Å; P378-F461 HydrophobicContact CB-CE1 4.29Å; P378-F461 HydrophobicContact CB-CE2 4.17Å; P378-F461 HydrophobicContact CB-CG 4.12Å; P378-F461 HydrophobicContact CB-CZ 4.29Å; P378-T462 WeakPolarHBondContact CD-O 3.35Å
379	S	96.4	Very high	94.3	Very high	83 Å²	83	55.1 Å²	55.1	58%	0.58	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-2.8	174.3	58.4	0	0	0	0	114.4	S377 T432	S377-S379 PolarHBondContact O-N 2.86Å; S377-S379 VanDerWaalsContact O-N 3.09Å; S377-S379 PolarHBondContact OG-N 2.94Å; S377-S379 PolarHBondContact OG-OG 3.48Å; S377-S379 VanDerWaalsContact OG-OG 3.06Å; S379-T432 VanDerWaalsContact O-CG2 3.24Å; S379-T432 WeakPolarHBondContact O-CG2 3.43Å
380	A	97.1	Very high	94.7	Very high	5 Å²	5	52.1 Å²	52.1	4%	0.041	27%	0.271	C	S	.	.			trans	-62.5	147.2	173.6	0	0	0	0	0	109.9	F376 S377 E384 T432 L433	F376-A380 HydrophobicContact CB-CB 4.04Å; F376-A380 HydrophobicContact CD1-CB 4.01Å; F376-A380 HydrophobicContact CG-CB 4.46Å; S377-A380 WeakPolarHBondContact O-CB 3.14Å; S377-A380 PolarHBondContact O-N 2.94Å; A380-E384 WeakPolarHBondContact CA-OE1 3.35Å; A380-T432 CarbonylContact O-C 3.59Å; A380-T432 WeakPolarHBondContact O-CA 3.36Å; A380-L433 HydrophobicContact CB-CD1 4.32Å; A380-L433 HydrophobicContact CB-CG 4.4Å; A380-L433 WeakPolarHBondContact O-CG 3.41Å; A380-L433 PolarHBondContact O-N 2.98Å
381	K	97.7	Very high	95.2	Very high	101 Å²	101	51.8 Å²	51.8	44%	0.439	27%	0.27	S	S	.	.	B	Isolated β-bridge	trans	-84.1	153.8	175.4	-65.3	-179.3	-179	179.1	0	110.9	Q383 E384 K431	K381-Q383 PolarHBondContact O-N 3.17Å; K381-E384 HydrophobicContact CB-CG 4.44Å; K381-E384 PolarHBondContact N-OE1 2.9Å; K381-E384 WeakPolarHBondContact O-CB 3.39Å; K381-E384 PolarHBondContact O-N 2.57Å; K381-K431 WeakPolarHBondContact CA-O 3.36Å
382	L	97.8	Very high	95.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.2	-29.8	173.5	-177.5	67.4	0	0	0	112.2	E384 V385 L386 I402 L413 N428 L429 K431 L436	L382-E384 VanDerWaalsContact C-N 3.26Å; L382-E384 PolarHBondContact O-N 2.85Å; L382-V385 PolarHBondContact O-N 3.08Å; L382-L386 PolarHBondContact O-N 3.27Å; L382-I402 HydrophobicContact CD1-CD1 3.93Å; L382-L413 HydrophobicContact CD1-CB 4.41Å; L382-L413 HydrophobicContact CD1-CD1 4.31Å; L382-L413 HydrophobicContact CD2-CB 3.79Å; L382-N428 HydrophobicContact CD2-CB 4.07Å; L382-L429 HydrophobicContact CD2-CD2 4.28Å; L382-L429 HydrophobicContact CG-CD2 4.31Å; L382-K431 PolarHBondContact N-O 3.26Å; L382-K431 VanDerWaalsContact N-O 3.11Å; L382-L436 HydrophobicContact CB-CD1 3.78Å; L382-L436 HydrophobicContact CD1-CD1 4.36Å; L382-L436 HydrophobicContact CD2-CD1 3.92Å; L382-L436 HydrophobicContact CG-CD1 4.24Å
383	Q	97.6	Very high	95.4	Very high	65 Å²	65	52.7 Å²	52.7	30%	0.304	28%	0.284	S	S	.	.	H	α-helix	trans	-56.6	-39	171.9	-172.8	64	54.5	0	0	112.5	K381 V385 L386 D387 L429	K381-Q383 PolarHBondContact O-N 3.17Å; Q383-V385 VanDerWaalsContact C-N 3.31Å; Q383-V385 PolarHBondContact O-N 2.68Å; Q383-L386 WeakPolarHBondContact O-CB 3.15Å; Q383-L386 PolarHBondContact O-N 3.18Å; Q383-D387 PolarHBondContact NE2-OD1 3.15Å; Q383-D387 WeakPolarHBondContact O-CB 3.38Å; Q383-D387 PolarHBondContact O-N 3.18Å; Q383-L429 HydrophobicContact CB-CB 4.4Å; Q383-L429 WeakPolarHBondContact CB-O 3.22Å; Q383-L429 PolarHBondContact N-O 3.27Å; Q383-L429 VanDerWaalsContact N-O 3.16Å
384	E	97.2	Very high	95.2	Very high	91 Å²	91	50 Å²	50	43%	0.425	27%	0.273	S	S	.	.	H	α-helix	trans	-66.7	-36.2	-180	-62.7	173	-113.6	0	0	111.3	F376 A380 K381 L382 Y388	F376-E384 HydrophobicContact CE1-CB 4.15Å; A380-E384 WeakPolarHBondContact CA-OE1 3.35Å; K381-E384 HydrophobicContact CB-CG 4.44Å; K381-E384 PolarHBondContact N-OE1 2.9Å; K381-E384 WeakPolarHBondContact O-CB 3.39Å; K381-E384 PolarHBondContact O-N 2.57Å; L382-E384 VanDerWaalsContact C-N 3.26Å; L382-E384 PolarHBondContact O-N 2.85Å; E384-Y388 WeakPolarHBondContact O-CB 3.43Å; E384-Y388 PolarHBondContact O-N 2.87Å
385	V	96.9	Very high	95	Very high	1 Å²	1	50 Å²	50	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-66.3	-44	172.7	-175.8	0	0	0	0	110.6	I374 F376 L382 Q383 D387 Y388 L389 I402 L433 L444	I374-V385 HydrophobicContact CD1-CG1 4.27Å; F376-V385 HydrophobicContact CD1-CG2 4.18Å; F376-V385 HydrophobicContact CD2-CG2 3.91Å; F376-V385 HydrophobicContact CE1-CG2 4.13Å; F376-V385 HydrophobicContact CE2-CB 4.33Å; F376-V385 HydrophobicContact CE2-CG1 4.27Å; F376-V385 HydrophobicContact CE2-CG2 3.85Å; F376-V385 HydrophobicContact CG-CG2 4.08Å; F376-V385 HydrophobicContact CZ-CB 4.27Å; F376-V385 HydrophobicContact CZ-CG2 3.98Å; L382-V385 PolarHBondContact O-N 3.08Å; Q383-V385 VanDerWaalsContact C-N 3.31Å; Q383-V385 PolarHBondContact O-N 2.68Å; V385-D387 VanDerWaalsContact C-N 3.34Å; V385-D387 PolarHBondContact O-N 3.45Å; V385-Y388 WeakPolarHBondContact O-CB 3.31Å; V385-Y388 PolarHBondContact O-N 2.93Å; V385-L389 HydrophobicContact CG1-CD1 4.33Å; V385-L389 WeakPolarHBondContact O-CG 3.32Å; V385-L389 PolarHBondContact O-N 3.27Å; V385-I402 HydrophobicContact CG1-CD1 4.23Å; V385-L433 HydrophobicContact CG2-CD1 4.15Å; V385-L433 HydrophobicContact CG2-CD2 3.85Å; V385-L444 HydrophobicContact CG1-CD1 4.48Å
386	L	96.7	Very high	94.7	Very high	9 Å²	9	47.2 Å²	47.2	5%	0.047	26%	0.26	C	S	.	.	H	α-helix	trans	-61.3	-42.9	177.7	-166.4	75.5	0	0	0	111.9	L382 Q383 Y388 L389 T390 P400 I402 Y414 L429	L382-L386 PolarHBondContact O-N 3.27Å; Q383-L386 WeakPolarHBondContact O-CB 3.15Å; Q383-L386 PolarHBondContact O-N 3.18Å; L386-Y388 VanDerWaalsContact C-N 3.34Å; L386-L389 PolarHBondContact O-N 3.45Å; L386-T390 WeakPolarHBondContact O-CB 3.26Å; L386-T390 PolarHBondContact O-N 2.93Å; L386-T390 PolarHBondContact O-OG1 3.01Å; L386-P400 HydrophobicContact CD1-CB 4.46Å; L386-P400 HydrophobicContact CD1-CG 3.78Å; L386-I402 HydrophobicContact CD1-CD1 3.97Å; L386-I402 HydrophobicContact CD1-CG1 4.45Å; L386-Y414 HydrophobicContact CD1-CD1 3.79Å; L386-Y414 HydrophobicContact CD1-CE1 4.24Å; L386-Y414 HydrophobicContact CD2-CD1 3.78Å; L386-Y414 HydrophobicContact CD2-CE1 3.55Å; L386-Y414 HydrophobicContact CG-CD1 4.46Å; L386-L429 HydrophobicContact CD2-CD2 3.97Å
387	D	96.3	Very high	94.6	Very high	69 Å²	69	46.5 Å²	46.5	37%	0.369	26%	0.257	S	S	.	.	H	α-helix	trans	-64.9	-38.9	177.6	-66.4	-18.1	0	0	0	111	Q383 V385 T390 N391	Q383-D387 PolarHBondContact NE2-OD1 3.15Å; Q383-D387 WeakPolarHBondContact O-CB 3.38Å; Q383-D387 PolarHBondContact O-N 3.18Å; V385-D387 VanDerWaalsContact C-N 3.34Å; V385-D387 PolarHBondContact O-N 3.45Å; D387-T390 PolarHBondContact O-N 3.48Å; D387-N391 WeakPolarHBondContact O-CB 3.32Å; D387-N391 VanDerWaalsContact O-CG 3.31Å; D387-N391 PolarHBondContact O-N 2.86Å; D387-N391 PolarHBondContact O-ND2 3.41Å
388	Y	96.5	Very high	94.3	Very high	86 Å²	86	51 Å²	51	34%	0.337	27%	0.272	S	S	.	.	H	α-helix	trans	-62.1	-48.9	173.7	169.5	-98.4	0	0	0	112.2	I374 F376 E384 V385 L386 T390 N391 S392 L395	I374-Y388 HydrophobicContact CG2-CD1 4.24Å; I374-Y388 HydrophobicContact CG2-CE1 3.57Å; F376-Y388 HydrophobicContact CE2-CD1 4.44Å; F376-Y388 HydrophobicContact CZ-CD1 4.32Å; F376-Y388 AromaticContact CZ-CG 3.99Å; F376-Y388 HydrophobicContact CZ-CG 3.99Å; E384-Y388 WeakPolarHBondContact O-CB 3.43Å; E384-Y388 PolarHBondContact O-N 2.87Å; V385-Y388 WeakPolarHBondContact O-CB 3.31Å; V385-Y388 PolarHBondContact O-N 2.93Å; L386-Y388 VanDerWaalsContact C-N 3.34Å; Y388-T390 PolarHBondContact O-N 3.24Å; Y388-N391 PolarHBondContact O-N 3.35Å; Y388-S392 WeakPolarHBondContact O-CB 3.4Å; Y388-S392 PolarHBondContact O-N 3.43Å; Y388-L395 HydrophobicContact CD1-CD1 4.27Å; Y388-L395 HydrophobicContact CE1-CD1 3.67Å
389	L	95.9	Very high	94.2	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-60.6	-35.6	179.6	-66	173.2	0	0	0	112.1	V385 L386 L395 M397 P400 I402 V446 F457	V385-L389 HydrophobicContact CG1-CD1 4.33Å; V385-L389 WeakPolarHBondContact O-CG 3.32Å; V385-L389 PolarHBondContact O-N 3.27Å; L386-L389 PolarHBondContact O-N 3.45Å; L389-L395 HydrophobicContact CD2-CD1 3.78Å; L389-M397 HydrophobicContact CB-SD 4.11Å; L389-M397 HydrophobicContact CD2-SD 4.28Å; L389-M397 WeakPolarHBondContact O-CB 3.48Å; L389-M397 PolarHBondContact O-N 3.49Å; L389-M397 VanDerWaalsContact O-N 3.11Å; L389-P400 HydrophobicContact CB-CB 4.33Å; L389-P400 HydrophobicContact CB-CG 3.99Å; L389-P400 HydrophobicContact CD1-CB 4.21Å; L389-P400 HydrophobicContact CD1-CG 4.49Å; L389-I402 HydrophobicContact CD1-CD1 3.84Å; L389-I402 HydrophobicContact CD1-CG1 3.99Å; L389-V446 HydrophobicContact CD1-CG1 4Å; L389-V446 HydrophobicContact CD1-CG2 4.01Å; L389-F457 HydrophobicContact CD2-CD1 4.35Å; L389-F457 HydrophobicContact CD2-CD2 4.38Å; L389-F457 HydrophobicContact CD2-CE1 3.8Å; L389-F457 HydrophobicContact CD2-CE2 3.82Å; L389-F457 HydrophobicContact CD2-CZ 3.5Å; L389-F457 VanDerWaalsContact CD2-CZ 3.5Å
390	T	94.1	Very high	94.1	Very high	47 Å²	47	47.6 Å²	47.6	29%	0.288	25%	0.25	S	C	.	.	H	α-helix	trans	-79.8	-43.6	-178.1	-52.1	0	0	0	0	112.3	L386 D387 Y388	L386-T390 WeakPolarHBondContact O-CB 3.26Å; L386-T390 PolarHBondContact O-N 2.93Å; L386-T390 PolarHBondContact O-OG1 3.01Å; D387-T390 PolarHBondContact O-N 3.48Å; Y388-T390 PolarHBondContact O-N 3.24Å
391	N	92.7	Very high	94.1	Very high	122 Å²	122	47.8 Å²	47.8	65%	0.652	25%	0.251	S	S	*	.	H	α-helix	trans	-98.7	-16	-169.4	-59.7	-48.8	0	0	0	114.1	D387 Y388 A393	D387-N391 WeakPolarHBondContact O-CB 3.32Å; D387-N391 VanDerWaalsContact O-CG 3.31Å; D387-N391 PolarHBondContact O-N 2.86Å; D387-N391 PolarHBondContact O-ND2 3.41Å; Y388-N391 PolarHBondContact O-N 3.35Å; N391-A393 PolarHBondContact O-N 2.86Å
392	S	91.5	Very high	94.1	Very high	25 Å²	25	43 Å²	43	18%	0.175	23%	0.23	C	C	.	.			trans	-61.6	126.7	177.5	179.4	0	0	0	0	110.5	Y388 S394 L395 Q396	Y388-S392 WeakPolarHBondContact O-CB 3.4Å; Y388-S392 PolarHBondContact O-N 3.43Å; S392-S394 PolarHBondContact O-N 3.15Å; S392-S394 VanDerWaalsContact O-N 3.15Å; S392-S394 PolarHBondContact OG-OG 3.01Å; S392-L395 PolarHBondContact O-N 2.98Å; S392-Q396 WeakPolarHBondContact O-CG 3.4Å; S392-Q396 PolarHBondContact O-N 2.88Å
393	A	88.6	Confident	94.1	Very high	59 Å²	59	45.1 Å²	45.1	49%	0.488	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.8	179.7	0	0	0	0	0	113	N391 Q396	N391-A393 PolarHBondContact O-N 2.86Å; A393-Q396 WeakPolarHBondContact O-CG 3.23Å; A393-Q396 PolarHBondContact O-NE2 3.01Å
394	S	88.3	Confident	94	Very high	44 Å²	44	42.2 Å²	42.2	31%	0.308	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-16.3	178.1	60.9	0	0	0	0	114.2	S392	S392-S394 PolarHBondContact O-N 3.15Å; S392-S394 VanDerWaalsContact O-N 3.15Å; S392-S394 PolarHBondContact OG-OG 3.01Å
395	L	91	Very high	93.9	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.016	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.5	-53.2	-173.4	-58.3	178.1	0	0	0	112.2	R173 P365 Y388 L389 S392 M397 F457	R173-L395 PolarHBondContact NH1-O 3.31Å; R173-L395 PolarHBondContact NH2-O 3.39Å; P365-L395 HydrophobicContact CB-CD2 3.72Å; P365-L395 HydrophobicContact CG-CD2 3.87Å; Y388-L395 HydrophobicContact CD1-CD1 4.27Å; Y388-L395 HydrophobicContact CE1-CD1 3.67Å; L389-L395 HydrophobicContact CD2-CD1 3.78Å; S392-L395 PolarHBondContact O-N 2.98Å; L395-M397 HydrophobicContact CB-CG 4.46Å; L395-M397 PolarHBondContact O-N 3.06Å; L395-M397 VanDerWaalsContact O-N 3.14Å; L395-F457 HydrophobicContact CD1-CE1 3.9Å; L395-F457 HydrophobicContact CD1-CZ 3.97Å; L395-F457 HydrophobicContact CD2-CE1 4.26Å; L395-F457 HydrophobicContact CD2-CZ 4.09Å
396	Q	89.5	Confident	93.7	Very high	84 Å²	84	42.3 Å²	42.3	39%	0.393	24%	0.237	S	C	.	.			trans	44.1	46	-179.9	-53.9	-179.8	40.2	0	0	112.9	R173 L225 S392 A393	R173-Q396 PolarHBondContact NH1-O 3.4Å; L225-Q396 HydrophobicContact CD2-CB 4.24Å; L225-Q396 HydrophobicContact CD2-CG 4.31Å; S392-Q396 WeakPolarHBondContact O-CG 3.4Å; S392-Q396 PolarHBondContact O-N 2.88Å; A393-Q396 WeakPolarHBondContact O-CG 3.23Å; A393-Q396 PolarHBondContact O-NE2 3.01Å
397	M	93.1	Very high	93.4	Very high	9 Å²	9	51.3 Å²	51.3	4%	0.044	28%	0.278	C	S	.	.			trans	-68.3	148	179.4	-68.5	-178.7	170.1	0	0	110.4	L389 L395 P400 V446 D448 V455 F457	L389-M397 HydrophobicContact CB-SD 4.11Å; L389-M397 HydrophobicContact CD2-SD 4.28Å; L389-M397 WeakPolarHBondContact O-CB 3.48Å; L389-M397 PolarHBondContact O-N 3.49Å; L389-M397 VanDerWaalsContact O-N 3.11Å; L395-M397 HydrophobicContact CB-CG 4.46Å; L395-M397 PolarHBondContact O-N 3.06Å; L395-M397 VanDerWaalsContact O-N 3.14Å; M397-P400 HydrophobicContact CB-CB 4.08Å; M397-P400 HydrophobicContact CB-CG 4.01Å; M397-P400 HydrophobicContact SD-CB 3.88Å; M397-V446 HydrophobicContact CE-CG1 4.04Å; M397-V446 HydrophobicContact SD-CG1 3.64Å; M397-D448 WeakPolarHBondContact CA-OD2 3.48Å; M397-D448 HydrophobicContact CB-CB 4.28Å; M397-D448 HydrophobicContact CG-CB 4.23Å; M397-D448 HydrophobicContact SD-CB 4.28Å; M397-V455 HydrophobicContact CE-CB 4.32Å; M397-V455 HydrophobicContact CE-CG2 4.22Å; M397-F457 HydrophobicContact CE-CE2 4.01Å; M397-F457 HydrophobicContact CE-CZ 4.01Å
398	K	90.8	Very high	93	Very high	129 Å²	129	51.5 Å²	51.5	56%	0.561	30%	0.297	S	S	*	.	S	Bend	trans	-89.1	-46.9	-172	-174.7	65.1	178.1	179.9	0	112.9	D448 V449 T450	K398-D448 PolarHBondContact N-OD1 3.09Å; K398-D448 PolarHBondContact N-OD2 2.69Å; K398-V449 HydrophobicContact CB-CG1 3.66Å; K398-V449 HydrophobicContact CG-CG1 4.04Å; K398-T450 HydrophobicContact CB-CG2 4.06Å
399	S	92	Very high	92.8	Very high	49 Å²	49	55 Å²	55	34%	0.343	31%	0.314	S	S	.	.	S	Bend	trans	-150	63.8	-178.3	-66.2	0	0	0	0	109.8	Q416 D448	S399-Q416 PolarHBondContact OG-OE1 3.01Å; S399-D448 WeakPolarHBondContact CA-OD1 3.38Å; S399-D448 PolarHBondContact N-OD1 3.17Å
400	P	95.9	Very high	92.7	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	35%	0.349	C	S	.	.			trans	-63.4	141.1	-170.9	22.1	-30.4	0	0	0	112.5	L386 L389 M397 V446	L386-P400 HydrophobicContact CD1-CB 4.46Å; L386-P400 HydrophobicContact CD1-CG 3.78Å; L389-P400 HydrophobicContact CB-CB 4.33Å; L389-P400 HydrophobicContact CB-CG 3.99Å; L389-P400 HydrophobicContact CD1-CB 4.21Å; L389-P400 HydrophobicContact CD1-CG 4.49Å; M397-P400 HydrophobicContact CB-CB 4.08Å; M397-P400 HydrophobicContact CB-CG 4.01Å; M397-P400 HydrophobicContact SD-CB 3.88Å; P400-V446 HydrophobicContact CB-CG1 3.92Å
401	A	96.7	Very high	92.7	Very high	9 Å²	9	66.2 Å²	66.2	7%	0.074	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124.6	175.1	0	0	0	0	0	109.5	Y414 L415 V446 A447	A401-Y414 CarbonylContact C-O 3.48Å; A401-Y414 WeakPolarHBondContact CA-O 3.42Å; A401-L415 HydrophobicContact CB-CD1 3.3Å; A401-L415 HydrophobicContact CB-CG 4.49Å; A401-V446 VanDerWaalsContact O-CA 3.24Å; A401-V446 WeakPolarHBondContact O-CA 3.42Å; A401-A447 HydrophobicContact CB-CB 4.47Å; A401-A447 WeakPolarHBondContact CB-O 3.2Å; A401-A447 PolarHBondContact N-O 2.88Å; A401-A447 PolarHBondContact O-N 3.41Å
402	I	97.5	Very high	92.9	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	125.6	-173.2	-49.6	173.7	0	0	0	109.3	L382 V385 L386 L389 L413 Y414 L444 V446	L382-I402 HydrophobicContact CD1-CD1 3.93Å; V385-I402 HydrophobicContact CG1-CD1 4.23Å; L386-I402 HydrophobicContact CD1-CD1 3.97Å; L386-I402 HydrophobicContact CD1-CG1 4.45Å; L389-I402 HydrophobicContact CD1-CD1 3.84Å; L389-I402 HydrophobicContact CD1-CG1 3.99Å; I402-L413 HydrophobicContact CB-CB 4.42Å; I402-L413 HydrophobicContact CG2-CB 4.42Å; I402-L413 HydrophobicContact CG2-CD1 3.96Å; I402-L413 WeakPolarHBondContact O-CA 3.42Å; I402-L413 WeakPolarHBondContact O-CB 3.24Å; I402-L413 PolarHBondContact O-N 3.42Å; I402-Y414 PolarHBondContact N-O 3.39Å; I402-Y414 PolarHBondContact O-N 3.47Å; I402-L444 HydrophobicContact CG2-CB 4.38Å; I402-L444 HydrophobicContact CG2-CD1 4.36Å; I402-V446 HydrophobicContact CG1-CG2 4.43Å; I402-V446 HydrophobicContact CG2-CG2 4.49Å
403	T	97.2	Very high	93.2	Very high	46 Å²	46	62 Å²	62	28%	0.282	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	153.9	175.3	66.5	0	0	0	0	110.4	R411 T412 L444 A445	T403-R411 WeakPolarHBondContact CA-O 3.3Å; T403-T412 HydrophobicContact CG2-CG2 4.39Å; T403-L444 WeakPolarHBondContact O-CA 3.35Å; T403-A445 PolarHBondContact N-O 2.91Å; T403-A445 PolarHBondContact O-N 2.86Å; T403-A445 VanDerWaalsContact OG1-CB 3.29Å; T403-A445 WeakPolarHBondContact OG1-CB 3.43Å; T403-A445 PolarHBondContact OG1-O 3.31Å
404	A	96.4	Very high	93.6	Very high	3 Å²	3	60 Å²	60	3%	0.025	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	156.2	176.1	0	0	0	0	0	110.8	R411 L413 L438 L444	A404-R411 PolarHBondContact N-O 3.29Å; A404-R411 PolarHBondContact O-N 3.46Å; A404-L413 HydrophobicContact CB-CD1 4.09Å; A404-L413 HydrophobicContact CB-CG 4.46Å; A404-L438 HydrophobicContact CB-CD2 3.93Å; A404-L444 HydrophobicContact CB-CD2 3.83Å
405	T	94.4	Very high	93.9	Very high	76 Å²	76	59.5 Å²	59.5	47%	0.466	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	111.8	172.6	-51.6	0	0	0	0	110	K409 N410 Q442	T405-K409 CarbonylContact C-O 3.6Å; T405-K409 WeakPolarHBondContact CA-O 3.49Å; T405-N410 PolarHBondContact OG1-OD1 3.26Å; T405-Q442 PolarHBondContact O-NE2 3.15Å
406	L	91.9	Very high	93.8	Very high	19 Å²	19	62.5 Å²	62.5	10%	0.099	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.8	179.3	-68.3	169.4	0	0	0	109.1	G408 K409 R411 L413 L436 G437 L438	L406-G408 PolarHBondContact O-N 3.03Å; L406-K409 PolarHBondContact N-O 3.04Å; L406-K409 PolarHBondContact O-N 3.46Å; L406-K409 VanDerWaalsContact O-O 3.05Å; L406-R411 HydrophobicContact CB-CB 4.46Å; L406-R411 HydrophobicContact CD1-CB 4.12Å; L406-R411 HydrophobicContact CD1-CG 4.41Å; L406-L413 HydrophobicContact CD1-CD2 3.94Å; L406-L436 WeakPolarHBondContact CD1-O 3.37Å; L406-G437 VanDerWaalsContact CD2-O 3.23Å; L406-G437 WeakPolarHBondContact CD2-O 3.44Å; L406-L438 HydrophobicContact CD2-CD2 4.26Å
407	E	90	Very high	93.8	Very high	197 Å²	197	63.2 Å²	63.2	92%	0.921	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	40	-178.2	-58.4	179.1	175.9	0	0	113.1	K409	E407-K409 VanDerWaalsContact C-N 3.26Å; E407-K409 PolarHBondContact O-N 2.99Å
408	G	89	Confident	93.7	Very high	73 Å²	73	65.8 Å²	65.8	75%	0.753	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	5.9	-179.6	0	0	0	0	0	115.3	L406	L406-G408 PolarHBondContact O-N 3.03Å
409	K	92.5	Very high	93.7	Very high	161 Å²	161	64.8 Å²	64.8	70%	0.7	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	139.2	178.1	-66.6	178	180	173.7	0	111.1	T405 L406 E407 R411	T405-K409 CarbonylContact C-O 3.6Å; T405-K409 WeakPolarHBondContact CA-O 3.49Å; L406-K409 PolarHBondContact N-O 3.04Å; L406-K409 PolarHBondContact O-N 3.46Å; L406-K409 VanDerWaalsContact O-O 3.05Å; E407-K409 VanDerWaalsContact C-N 3.26Å; E407-K409 PolarHBondContact O-N 2.99Å; K409-R411 PolarHBondContact O-N 2.96Å
410	N	93.5	Very high	93.8	Very high	137 Å²	137	65.1 Å²	65.1	73%	0.733	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.5	125.8	171.5	-71.2	-28	0	0	0	109.9	T405	T405-N410 PolarHBondContact OG1-OD1 3.26Å
411	R	94.7	Very high	93.8	Very high	146 Å²	146	67.2 Å²	67.2	55%	0.551	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.1	128.3	-176.9	-165.2	172	-172.6	173.1	0.3	109.7	T403 A404 L406 K409 L413	T403-R411 WeakPolarHBondContact CA-O 3.3Å; A404-R411 PolarHBondContact N-O 3.29Å; A404-R411 PolarHBondContact O-N 3.46Å; L406-R411 HydrophobicContact CB-CB 4.46Å; L406-R411 HydrophobicContact CD1-CB 4.12Å; L406-R411 HydrophobicContact CD1-CG 4.41Å; K409-R411 PolarHBondContact O-N 2.96Å; R411-L413 PolarHBondContact O-N 3.44Å
412	T	96.6	Very high	93.7	Very high	56 Å²	56	67.6 Å²	67.6	34%	0.344	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	117.8	171.6	-49.8	0	0	0	0	109.5	T403 L415 I421 T425	T403-T412 HydrophobicContact CG2-CG2 4.39Å; T412-L415 HydrophobicContact CG2-CB 3.76Å; T412-I421 HydrophobicContact CG2-CG2 4.18Å; T412-T425 HydrophobicContact CG2-CG2 4.16Å
413	L	96.9	Very high	93.6	Very high	2 Å²	2	74 Å²	74	1%	0.01	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-45.6	176.6	-54.6	-175.8	0	0	0	110.2	L382 I402 A404 L406 R411 T425 N428 L438 L444	L382-L413 HydrophobicContact CD1-CB 4.41Å; L382-L413 HydrophobicContact CD1-CD1 4.31Å; L382-L413 HydrophobicContact CD2-CB 3.79Å; I402-L413 HydrophobicContact CB-CB 4.42Å; I402-L413 HydrophobicContact CG2-CB 4.42Å; I402-L413 HydrophobicContact CG2-CD1 3.96Å; I402-L413 WeakPolarHBondContact O-CA 3.42Å; I402-L413 WeakPolarHBondContact O-CB 3.24Å; I402-L413 PolarHBondContact O-N 3.42Å; A404-L413 HydrophobicContact CB-CD1 4.09Å; A404-L413 HydrophobicContact CB-CG 4.46Å; L406-L413 HydrophobicContact CD1-CD2 3.94Å; R411-L413 PolarHBondContact O-N 3.44Å; L413-T425 WeakPolarHBondContact O-CB 3.34Å; L413-N428 WeakPolarHBondContact O-CB 3.4Å; L413-N428 PolarHBondContact O-ND2 3.27Å; L413-L438 HydrophobicContact CD1-CD1 4.17Å; L413-L438 HydrophobicContact CD1-CD2 4.08Å; L413-L444 HydrophobicContact CD1-CD2 4.39Å
414	Y	97.3	Very high	93.5	Very high	18 Å²	18	80 Å²	80	7%	0.071	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	140.2	173.8	-171.8	-120.1	0	0	0	112.1	L386 A401 I402 Q416 E422 R426 L429	L386-Y414 HydrophobicContact CD1-CD1 3.79Å; L386-Y414 HydrophobicContact CD1-CE1 4.24Å; L386-Y414 HydrophobicContact CD2-CD1 3.78Å; L386-Y414 HydrophobicContact CD2-CE1 3.55Å; L386-Y414 HydrophobicContact CG-CD1 4.46Å; A401-Y414 CarbonylContact C-O 3.48Å; A401-Y414 WeakPolarHBondContact CA-O 3.42Å; I402-Y414 PolarHBondContact N-O 3.39Å; I402-Y414 PolarHBondContact O-N 3.47Å; Y414-Q416 HydrophobicContact CD1-CG 4.19Å; Y414-Q416 HydrophobicContact CE1-CG 3.34Å; Y414-E422 HydrophobicContact CE2-CG 4.16Å; Y414-E422 PolarHBondContact OH-OE1 3.35Å; Y414-R426 HydrophobicContact CE2-CB 4.39Å; Y414-L429 HydrophobicContact CD1-CD2 3.89Å; Y414-L429 HydrophobicContact CD2-CD1 4Å; Y414-L429 HydrophobicContact CD2-CD2 3.94Å; Y414-L429 HydrophobicContact CD2-CG 3.9Å; Y414-L429 HydrophobicContact CE1-CD1 4.19Å; Y414-L429 HydrophobicContact CE1-CD2 4.21Å; Y414-L429 HydrophobicContact CE2-CD1 3.6Å; Y414-L429 HydrophobicContact CE2-CD2 4.33Å; Y414-L429 HydrophobicContact CE2-CG 4.05Å; Y414-L429 HydrophobicContact CG-CD1 4.5Å; Y414-L429 HydrophobicContact CG-CD2 3.72Å; Y414-L429 HydrophobicContact CG-CG 4.22Å
415	L	94.8	Very high	93.6	Very high	32 Å²	32	80.3 Å²	80.3	17%	0.168	42%	0.424	C	S	.	.			trans	-148.5	122.9	177.9	176.7	70	0	0	0	110.5	A401 T412 S417 V418 I421 E422 T425	A401-L415 HydrophobicContact CB-CD1 3.3Å; A401-L415 HydrophobicContact CB-CG 4.49Å; T412-L415 HydrophobicContact CG2-CB 3.76Å; L415-S417 WeakPolarHBondContact CD1-OG 3.49Å; L415-V418 HydrophobicContact CD2-CB 4.49Å; L415-V418 HydrophobicContact CD2-CG2 4.45Å; L415-I421 HydrophobicContact CB-CG2 3.93Å; L415-I421 HydrophobicContact CD2-CB 4.01Å; L415-I421 HydrophobicContact CD2-CD1 3.66Å; L415-I421 HydrophobicContact CD2-CG1 4.42Å; L415-I421 HydrophobicContact CD2-CG2 3.82Å; L415-I421 HydrophobicContact CG-CG2 4.41Å; L415-E422 WeakPolarHBondContact O-CA 3.35Å; L415-E422 WeakPolarHBondContact O-CB 3.34Å; L415-E422 PolarHBondContact O-N 3.01Å; L415-T425 PolarHBondContact N-OG1 2.98Å
416	Q	90.1	Very high	93.7	Very high	66 Å²	66	83.4 Å²	83.4	31%	0.308	43%	0.427	S	S	.	.	S	Bend	trans	-91.5	-24.2	-176.7	-63.9	-179.9	38.5	0	0	114.5	S399 Y414 V418	S399-Q416 PolarHBondContact OG-OE1 3.01Å; Y414-Q416 HydrophobicContact CD1-CG 4.19Å; Y414-Q416 HydrophobicContact CE1-CG 3.34Å; Q416-V418 VanDerWaalsContact C-N 3.32Å; Q416-V418 PolarHBondContact O-N 2.84Å
417	S	87.6	Confident	93.9	Very high	100 Å²	100	85.9 Å²	85.9	70%	0.699	44%	0.444	S	S	*	.	S	Bend	trans	-72.7	-21.1	-167.8	57.9	0	0	0	0	114.6	L415	L415-S417 WeakPolarHBondContact CD1-OG 3.49Å
418	V	91.7	Very high	94.3	Very high	62 Å²	62	77.3 Å²	77.3	38%	0.376	41%	0.405	S	S	.	.	S	Bend	trans	-122.8	108.7	179.5	-178.2	0	0	0	0	108.3	L415 Q416 S420 I421 E422	L415-V418 HydrophobicContact CD2-CB 4.49Å; L415-V418 HydrophobicContact CD2-CG2 4.45Å; Q416-V418 VanDerWaalsContact C-N 3.32Å; Q416-V418 PolarHBondContact O-N 2.84Å; V418-S420 VanDerWaalsContact C-N 3.26Å; V418-S420 PolarHBondContact O-N 2.82Å; V418-S420 VanDerWaalsContact O-N 3.15Å; V418-I421 HydrophobicContact CB-CB 4.31Å; V418-I421 HydrophobicContact CB-CD1 4Å; V418-I421 HydrophobicContact CB-CG1 4.18Å; V418-I421 HydrophobicContact CG1-CD1 4.05Å; V418-I421 HydrophobicContact CG1-CG1 4.03Å; V418-I421 HydrophobicContact CG2-CD1 4.36Å; V418-I421 PolarHBondContact O-N 3.15Å; V418-E422 PolarHBondContact O-N 3.15Å
419	T	92	Very high	94.7	Very high	108 Å²	108	74.7 Å²	74.7	66%	0.663	37%	0.373	S	S	*	.	H	α-helix	trans	-50.5	-43	-174.6	51.4	0	0	0	0	113.1	I421 E422 E423	T419-I421 VanDerWaalsContact C-N 3.31Å; T419-I421 PolarHBondContact O-N 3.16Å; T419-E422 WeakPolarHBondContact O-CB 3.4Å; T419-E422 PolarHBondContact O-N 3.41Å; T419-E423 WeakPolarHBondContact O-CG 3.33Å; T419-E423 PolarHBondContact O-N 2.7Å
420	S	94.2	Very high	94.9	Very high	57 Å²	57	70.7 Å²	70.7	40%	0.399	37%	0.366	S	S	.	.	H	α-helix	trans	-65.7	-28.5	178.8	70.4	0	0	0	0	114.2	V418 R424	V418-S420 VanDerWaalsContact C-N 3.26Å; V418-S420 PolarHBondContact O-N 2.82Å; V418-S420 VanDerWaalsContact O-N 3.15Å; S420-R424 WeakPolarHBondContact O-CG 3.16Å; S420-R424 PolarHBondContact O-NE 2.96Å
421	I	94.6	Very high	95.1	Very high	43 Å²	43	68 Å²	68	22%	0.221	35%	0.347	C	S	.	.	H	α-helix	trans	-85.1	-38.4	174.9	-58.3	171.8	0	0	0	109.6	T412 L415 V418 T419 E423 R424 T425	T412-I421 HydrophobicContact CG2-CG2 4.18Å; L415-I421 HydrophobicContact CB-CG2 3.93Å; L415-I421 HydrophobicContact CD2-CB 4.01Å; L415-I421 HydrophobicContact CD2-CD1 3.66Å; L415-I421 HydrophobicContact CD2-CG1 4.42Å; L415-I421 HydrophobicContact CD2-CG2 3.82Å; L415-I421 HydrophobicContact CG-CG2 4.41Å; V418-I421 HydrophobicContact CB-CB 4.31Å; V418-I421 HydrophobicContact CB-CD1 4Å; V418-I421 HydrophobicContact CB-CG1 4.18Å; V418-I421 HydrophobicContact CG1-CD1 4.05Å; V418-I421 HydrophobicContact CG1-CG1 4.03Å; V418-I421 HydrophobicContact CG2-CD1 4.36Å; V418-I421 PolarHBondContact O-N 3.15Å; T419-I421 VanDerWaalsContact C-N 3.31Å; T419-I421 PolarHBondContact O-N 3.16Å; I421-E423 PolarHBondContact O-N 3.32Å; I421-R424 VanDerWaalsContact CG1-NH2 3.31Å; I421-R424 PolarHBondContact O-N 3.44Å; I421-T425 HydrophobicContact CG2-CG2 4.02Å; I421-T425 WeakPolarHBondContact O-CB 3.41Å; I421-T425 WeakPolarHBondContact O-CG2 3.34Å; I421-T425 PolarHBondContact O-N 3.47Å; I421-T425 PolarHBondContact O-OG1 3.08Å
422	E	95.4	Very high	95.2	Very high	18 Å²	18	62.3 Å²	62.3	8%	0.084	33%	0.329	C	S	.	.	H	α-helix	trans	-54.5	-52.6	175.3	-165.9	-73.1	148.6	0	0	110.4	Y414 L415 V418 T419 R424 T425 R426	Y414-E422 HydrophobicContact CE2-CG 4.16Å; Y414-E422 PolarHBondContact OH-OE1 3.35Å; L415-E422 WeakPolarHBondContact O-CA 3.35Å; L415-E422 WeakPolarHBondContact O-CB 3.34Å; L415-E422 PolarHBondContact O-N 3.01Å; V418-E422 PolarHBondContact O-N 3.15Å; T419-E422 WeakPolarHBondContact O-CB 3.4Å; T419-E422 PolarHBondContact O-N 3.41Å; E422-R424 VanDerWaalsContact C-N 3.3Å; E422-R424 PolarHBondContact O-N 3.14Å; E422-T425 CarbonylContact O-C 3.48Å; E422-T425 PolarHBondContact O-N 3.08Å; E422-T425 VanDerWaalsContact O-N 3.09Å; E422-T425 PolarHBondContact O-OG1 3.09Å; E422-R426 VanDerWaalsContact O-CB 3.29Å; E422-R426 WeakPolarHBondContact O-CB 3.47Å; E422-R426 PolarHBondContact O-N 3.31Å; E422-R426 IonicContact OE1-CZ 3.23Å; E422-R426 IonicContact OE1-NE 3.88Å; E422-R426 PolarHBondContact OE1-NE 3.09Å; E422-R426 IonicContact OE1-NH2 3.78Å; E422-R426 PolarHBondContact OE1-NH2 2.97Å; E422-R426 IonicContact OE2-CZ 3.16Å; E422-R426 IonicContact OE2-NE 2.87Å; E422-R426 PolarHBondContact OE2-NE 3.12Å; E422-R426 IonicContact OE2-NH2 3.03Å; E422-R426 PolarHBondContact OE2-NH2 2.93Å
423	E	95.1	Very high	95.2	Very high	133 Å²	133	59.7 Å²	59.7	62%	0.621	31%	0.313	S	S	*	.	H	α-helix	trans	-59.2	-40	179.6	-72.6	173	179.8	0	0	112.4	T419 I421 T425 P427	T419-E423 WeakPolarHBondContact O-CG 3.33Å; T419-E423 PolarHBondContact O-N 2.7Å; I421-E423 PolarHBondContact O-N 3.32Å; E423-T425 VanDerWaalsContact C-N 3.34Å; E423-P427 WeakPolarHBondContact O-CD 3.24Å
424	R	95.8	Very high	95.1	Very high	172 Å²	172	67.1 Å²	67.1	65%	0.649	35%	0.345	S	S	*	.	H	α-helix	trans	-72.3	-26.5	179.1	-74.6	-177.4	-70.3	172.3	-5	113.4	S420 I421 E422	S420-R424 WeakPolarHBondContact O-CG 3.16Å; S420-R424 PolarHBondContact O-NE 2.96Å; I421-R424 VanDerWaalsContact CG1-NH2 3.31Å; I421-R424 PolarHBondContact O-N 3.44Å; E422-R424 VanDerWaalsContact C-N 3.3Å; E422-R424 PolarHBondContact O-N 3.14Å
425	T	96.9	Very high	95.1	Very high	10 Å²	10	72.6 Å²	72.6	6%	0.061	37%	0.371	C	S	.	.	H	α-helix	trans	-103.4	-19.8	-175.5	56.4	0	0	0	0	113	T412 L413 L415 I421 E422 E423 P427 N428	T412-T425 HydrophobicContact CG2-CG2 4.16Å; L413-T425 WeakPolarHBondContact O-CB 3.34Å; L415-T425 PolarHBondContact N-OG1 2.98Å; I421-T425 HydrophobicContact CG2-CG2 4.02Å; I421-T425 WeakPolarHBondContact O-CB 3.41Å; I421-T425 WeakPolarHBondContact O-CG2 3.34Å; I421-T425 PolarHBondContact O-N 3.47Å; I421-T425 PolarHBondContact O-OG1 3.08Å; E422-T425 CarbonylContact O-C 3.48Å; E422-T425 PolarHBondContact O-N 3.08Å; E422-T425 VanDerWaalsContact O-N 3.09Å; E422-T425 PolarHBondContact O-OG1 3.09Å; E423-T425 VanDerWaalsContact C-N 3.34Å; T425-P427 VanDerWaalsContact C-N 3.31Å; T425-N428 WeakPolarHBondContact O-CB 3.46Å; T425-N428 PolarHBondContact O-N 3.04Å
426	R	96.8	Very high	95.2	Very high	142 Å²	142	71.8 Å²	71.8	54%	0.536	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-49.5	-40.7	175.1	-175.5	-173.1	-64.5	-131	8.6	113.7	Y414 E422 N428 L429	Y414-R426 HydrophobicContact CE2-CB 4.39Å; E422-R426 VanDerWaalsContact O-CB 3.29Å; E422-R426 WeakPolarHBondContact O-CB 3.47Å; E422-R426 PolarHBondContact O-N 3.31Å; E422-R426 IonicContact OE1-CZ 3.23Å; E422-R426 IonicContact OE1-NE 3.88Å; E422-R426 PolarHBondContact OE1-NE 3.09Å; E422-R426 IonicContact OE1-NH2 3.78Å; E422-R426 PolarHBondContact OE1-NH2 2.97Å; E422-R426 IonicContact OE2-CZ 3.16Å; E422-R426 IonicContact OE2-NE 2.87Å; E422-R426 PolarHBondContact OE2-NE 3.12Å; E422-R426 IonicContact OE2-NH2 3.03Å; E422-R426 PolarHBondContact OE2-NH2 2.93Å; R426-N428 PolarHBondContact O-N 3.48Å; R426-N428 VanDerWaalsContact O-N 3.13Å; R426-L429 HydrophobicContact CG-CD1 4.3Å; R426-L429 WeakPolarHBondContact O-CB 3.23Å; R426-L429 WeakPolarHBondContact O-CG 3.42Å; R426-L429 PolarHBondContact O-N 3.39Å
427	P	97.5	Very high	95.4	Very high	70 Å²	70	70.6 Å²	70.6	46%	0.455	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-57.7	-28.1	175.6	-26.8	36.4	0	0	0	114	E423 T425 L429 S430	E423-P427 WeakPolarHBondContact O-CD 3.24Å; T425-P427 VanDerWaalsContact C-N 3.31Å; P427-L429 VanDerWaalsContact C-N 3.25Å; P427-L429 PolarHBondContact O-N 3.15Å; P427-S430 PolarHBondContact O-N 3.45Å; P427-S430 PolarHBondContact O-OG 2.95Å
428	N	97.7	Very high	95.8	Very high	18 Å²	18	66.1 Å²	66.1	10%	0.096	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-67.5	-24	178.5	-62	-28.7	0	0	0	113	L382 L413 T425 R426 S430 K431 L436	L382-N428 HydrophobicContact CD2-CB 4.07Å; L413-N428 WeakPolarHBondContact O-CB 3.4Å; L413-N428 PolarHBondContact O-ND2 3.27Å; T425-N428 WeakPolarHBondContact O-CB 3.46Å; T425-N428 PolarHBondContact O-N 3.04Å; R426-N428 PolarHBondContact O-N 3.48Å; R426-N428 VanDerWaalsContact O-N 3.13Å; N428-S430 PolarHBondContact O-N 3.09Å; N428-K431 WeakPolarHBondContact O-CB 3.34Å; N428-K431 PolarHBondContact O-N 2.94Å; N428-K431 PolarHBondContact OD1-NZ 3.4Å; N428-L436 HydrophobicContact CB-CD2 3.78Å
429	L	97.3	Very high	95.9	Very high	17 Å²	17	67.4 Å²	67.4	9%	0.089	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-59.9	-30.8	177.4	-66.1	174.6	0	0	0	112.5	L382 Q383 L386 Y414 R426 P427	L382-L429 HydrophobicContact CD2-CD2 4.28Å; L382-L429 HydrophobicContact CG-CD2 4.31Å; Q383-L429 HydrophobicContact CB-CB 4.4Å; Q383-L429 WeakPolarHBondContact CB-O 3.22Å; Q383-L429 PolarHBondContact N-O 3.27Å; Q383-L429 VanDerWaalsContact N-O 3.16Å; L386-L429 HydrophobicContact CD2-CD2 3.97Å; Y414-L429 HydrophobicContact CD1-CD2 3.89Å; Y414-L429 HydrophobicContact CD2-CD1 4Å; Y414-L429 HydrophobicContact CD2-CD2 3.94Å; Y414-L429 HydrophobicContact CD2-CG 3.9Å; Y414-L429 HydrophobicContact CE1-CD1 4.19Å; Y414-L429 HydrophobicContact CE1-CD2 4.21Å; Y414-L429 HydrophobicContact CE2-CD1 3.6Å; Y414-L429 HydrophobicContact CE2-CD2 4.33Å; Y414-L429 HydrophobicContact CE2-CG 4.05Å; Y414-L429 HydrophobicContact CG-CD1 4.5Å; Y414-L429 HydrophobicContact CG-CD2 3.72Å; Y414-L429 HydrophobicContact CG-CG 4.22Å; R426-L429 HydrophobicContact CG-CD1 4.3Å; R426-L429 WeakPolarHBondContact O-CB 3.23Å; R426-L429 WeakPolarHBondContact O-CG 3.42Å; R426-L429 PolarHBondContact O-N 3.39Å; P427-L429 VanDerWaalsContact C-N 3.25Å; P427-L429 PolarHBondContact O-N 3.15Å
430	S	97.1	Very high	96.1	Very high	78 Å²	78	66.9 Å²	66.9	55%	0.545	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-85.6	-12	178.8	68.4	0	0	0	0	114.3	P427 N428	P427-S430 PolarHBondContact O-N 3.45Å; P427-S430 PolarHBondContact O-OG 2.95Å; N428-S430 PolarHBondContact O-N 3.09Å
431	K	97.5	Very high	96	Very high	79 Å²	79	65.5 Å²	65.5	34%	0.343	34%	0.336	S	S	.	.	S	Bend	trans	-85.1	147.4	178.8	-62.6	178.8	-173.4	164.3	0	110.4	K381 L382 N428 E435 L436	K381-K431 WeakPolarHBondContact CA-O 3.36Å; L382-K431 PolarHBondContact N-O 3.26Å; L382-K431 VanDerWaalsContact N-O 3.11Å; N428-K431 WeakPolarHBondContact O-CB 3.34Å; N428-K431 PolarHBondContact O-N 2.94Å; N428-K431 PolarHBondContact OD1-NZ 3.4Å; K431-E435 HydrophobicContact CB-CB 4.26Å; K431-L436 HydrophobicContact CB-CD2 3.98Å; K431-L436 HydrophobicContact CB-CG 3.98Å; K431-L436 HydrophobicContact CD-CD2 3.74Å; K431-L436 HydrophobicContact CG-CD2 4.49Å
432	T	97.3	Very high	95.9	Very high	28 Å²	28	64.7 Å²	64.7	17%	0.172	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-72.2	158.4	174.1	62.9	0	0	0	0	111.7	S379 A380 K434 E435 L436	S379-T432 VanDerWaalsContact O-CG2 3.24Å; S379-T432 WeakPolarHBondContact O-CG2 3.43Å; A380-T432 CarbonylContact O-C 3.59Å; A380-T432 WeakPolarHBondContact O-CA 3.36Å; T432-K434 PolarHBondContact O-N 3.42Å; T432-E435 WeakPolarHBondContact CB-OE2 2.91Å; T432-E435 WeakPolarHBondContact CG2-OE2 3.44Å; T432-E435 PolarHBondContact N-OE2 3.48Å; T432-E435 PolarHBondContact O-N 3.49Å; T432-E435 VanDerWaalsContact O-N 3.12Å; T432-E435 WeakPolarHBondContact OG1-CB 3.34Å; T432-E435 VanDerWaalsContact OG1-CD 3.29Å; T432-E435 WeakPolarHBondContact OG1-CG 3.37Å; T432-E435 PolarHBondContact OG1-N 3.01Å; T432-E435 PolarHBondContact OG1-OE2 3.37Å; T432-L436 WeakPolarHBondContact O-CG 3.48Å; T432-L436 PolarHBondContact O-N 2.92Å
433	L	96.6	Very high	95.9	Very high	1 Å²	1	68.4 Å²	68.4	1%	0.005	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-40.6	177.2	-55.8	-170.8	0	0	0	110.9	F376 A380 V385 L436 G437 L438 L459 F461	F376-L433 HydrophobicContact CB-CD1 3.65Å; F376-L433 HydrophobicContact CG-CD1 4.28Å; A380-L433 HydrophobicContact CB-CD1 4.32Å; A380-L433 HydrophobicContact CB-CG 4.4Å; A380-L433 WeakPolarHBondContact O-CG 3.41Å; A380-L433 PolarHBondContact O-N 2.98Å; V385-L433 HydrophobicContact CG2-CD1 4.15Å; V385-L433 HydrophobicContact CG2-CD2 3.85Å; L433-L436 PolarHBondContact O-N 3.17Å; L433-G437 PolarHBondContact O-N 3.14Å; L433-L438 HydrophobicContact CB-CB 4.41Å; L433-L438 HydrophobicContact CB-CD1 4.07Å; L433-L438 HydrophobicContact CD2-CD1 3.89Å; L433-L438 HydrophobicContact CG-CD1 4.46Å; L433-L438 WeakPolarHBondContact O-CB 3.34Å; L433-L438 PolarHBondContact O-N 2.78Å; L433-L459 HydrophobicContact CD1-CD1 3.91Å; L433-L459 HydrophobicContact CD1-CD2 4.18Å; L433-F461 HydrophobicContact CB-CE1 3.78Å; L433-F461 HydrophobicContact CB-CZ 3.98Å; L433-F461 HydrophobicContact CD1-CE1 3.81Å; L433-F461 HydrophobicContact CG-CE1 4.43Å
434	K	94.9	Very high	96	Very high	157 Å²	157	62.1 Å²	62.1	68%	0.683	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-41.3	175.1	-171.4	174.1	-176.3	175	0	113.3	P378 T432 L436 G437	P378-K434 HydrophobicContact CB-CB 4.41Å; P378-K434 WeakPolarHBondContact O-CB 3.47Å; P378-K434 PolarHBondContact O-N 2.72Å; P378-K434 VanDerWaalsContact O-N 3.12Å; T432-K434 PolarHBondContact O-N 3.42Å; K434-L436 VanDerWaalsContact C-N 3.27Å; K434-L436 PolarHBondContact O-N 3.04Å; K434-G437 PolarHBondContact O-N 2.89Å
435	E	96.3	Very high	96	Very high	133 Å²	133	55.1 Å²	55.1	62%	0.621	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-27.5	176.7	-75.8	168.1	135.6	0	0	113.1	K431 T432 G437	K431-E435 HydrophobicContact CB-CB 4.26Å; T432-E435 WeakPolarHBondContact CB-OE2 2.91Å; T432-E435 WeakPolarHBondContact CG2-OE2 3.44Å; T432-E435 PolarHBondContact N-OE2 3.48Å; T432-E435 PolarHBondContact O-N 3.49Å; T432-E435 VanDerWaalsContact O-N 3.12Å; T432-E435 WeakPolarHBondContact OG1-CB 3.34Å; T432-E435 VanDerWaalsContact OG1-CD 3.29Å; T432-E435 WeakPolarHBondContact OG1-CG 3.37Å; T432-E435 PolarHBondContact OG1-N 3.01Å; T432-E435 PolarHBondContact OG1-OE2 3.37Å; E435-G437 PolarHBondContact O-N 2.8Å
436	L	96.1	Very high	96	Very high	16 Å²	16	54.7 Å²	54.7	8%	0.084	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-5.3	172.9	-67.7	173.5	0	0	0	113.1	L382 L406 N428 K431 T432 L433 K434 L438	L382-L436 HydrophobicContact CB-CD1 3.78Å; L382-L436 HydrophobicContact CD1-CD1 4.36Å; L382-L436 HydrophobicContact CD2-CD1 3.92Å; L382-L436 HydrophobicContact CG-CD1 4.24Å; L406-L436 WeakPolarHBondContact CD1-O 3.37Å; N428-L436 HydrophobicContact CB-CD2 3.78Å; K431-L436 HydrophobicContact CB-CD2 3.98Å; K431-L436 HydrophobicContact CB-CG 3.98Å; K431-L436 HydrophobicContact CD-CD2 3.74Å; K431-L436 HydrophobicContact CG-CD2 4.49Å; T432-L436 WeakPolarHBondContact O-CG 3.48Å; T432-L436 PolarHBondContact O-N 2.92Å; L433-L436 PolarHBondContact O-N 3.17Å; K434-L436 VanDerWaalsContact C-N 3.27Å; K434-L436 PolarHBondContact O-N 3.04Å; L436-L438 VanDerWaalsContact C-N 3.35Å; L436-L438 HydrophobicContact CB-CG 4.32Å
437	G	95.2	Very high	95.9	Very high	40 Å²	40	50 Å²	50	41%	0.412	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	17.6	-177.8	0	0	0	0	0	113.5	L406 L433 K434 E435	L406-G437 VanDerWaalsContact CD2-O 3.23Å; L406-G437 WeakPolarHBondContact CD2-O 3.44Å; L433-G437 PolarHBondContact O-N 3.14Å; K434-G437 PolarHBondContact O-N 2.89Å; E435-G437 PolarHBondContact O-N 2.8Å
438	L	95.9	Very high	95.7	Very high	6 Å²	6	47.2 Å²	47.2	3%	0.031	27%	0.268	C	S	.	.			trans	-72.6	141.6	175.8	-61.7	172.3	0	0	0	110.6	A404 L406 L413 L433 L436 Q442 L444 L459 F461	A404-L438 HydrophobicContact CB-CD2 3.93Å; L406-L438 HydrophobicContact CD2-CD2 4.26Å; L413-L438 HydrophobicContact CD1-CD1 4.17Å; L413-L438 HydrophobicContact CD1-CD2 4.08Å; L433-L438 HydrophobicContact CB-CB 4.41Å; L433-L438 HydrophobicContact CB-CD1 4.07Å; L433-L438 HydrophobicContact CD2-CD1 3.89Å; L433-L438 HydrophobicContact CG-CD1 4.46Å; L433-L438 WeakPolarHBondContact O-CB 3.34Å; L433-L438 PolarHBondContact O-N 2.78Å; L436-L438 VanDerWaalsContact C-N 3.35Å; L436-L438 HydrophobicContact CB-CG 4.32Å; L438-Q442 VanDerWaalsContact CD2-OE1 3.29Å; L438-L444 HydrophobicContact CD1-CD2 4.36Å; L438-L444 HydrophobicContact CD2-CD2 3.85Å; L438-L459 HydrophobicContact CB-CD2 3.98Å; L438-L459 HydrophobicContact CD1-CD2 4.16Å; L438-F461 HydrophobicContact CB-CZ 4.3Å; L438-F461 WeakPolarHBondContact O-CE2 3.33Å; L438-F461 WeakPolarHBondContact O-CZ 3.47Å
439	V	94.1	Very high	95.5	Very high	89 Å²	89	50.4 Å²	50.4	54%	0.539	29%	0.289	S	S	.	.			trans	-116.8	157.3	-179.9	-61	0	0	0	0	111.2	Q442	V439-Q442 HydrophobicContact CG2-CB 3.93Å; V439-Q442 HydrophobicContact CG2-CG 4.48Å; V439-Q442 WeakPolarHBondContact O-CB 3.48Å; V439-Q442 PolarHBondContact O-N 3.11Å
440	D	95.2	Very high	95.2	Very high	98 Å²	98	49.7 Å²	49.7	52%	0.524	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	138.6	175.5	-169.6	31.9	0	0	0	111.1	Q442 H460 F461	D440-Q442 VanDerWaalsContact C-N 3.28Å; D440-Q442 PolarHBondContact O-N 3.46Å; D440-H460 VanDerWaalsContact OD1-CA 3.26Å; D440-H460 WeakPolarHBondContact OD1-CA 3.23Å; D440-F461 HydrophobicContact CB-CB 4.25Å; D440-F461 HydrophobicContact CB-CD2 3.85Å; D440-F461 HydrophobicContact CB-CG 4.33Å; D440-F461 PolarHBondContact OD1-N 3.11Å
441	G	92.6	Very high	94.9	Very high	28 Å²	28	46.7 Å²	46.7	29%	0.289	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	1.8	-175.3	0	0	0	0	0	115.6	K458 L459	G441-K458 WeakPolarHBondContact O-CE 3.45Å; G441-L459 VanDerWaalsContact CA-O 3.22Å; G441-L459 WeakPolarHBondContact CA-O 3.43Å; G441-L459 PolarHBondContact N-O 3.08Å
442	Q	93.3	Very high	94.6	Very high	25 Å²	25	45.3 Å²	45.3	12%	0.117	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-71.1	144.1	-178.8	-172.2	170.4	14.8	0	0	112.6	T405 L438 V439 D440 L459	T405-Q442 PolarHBondContact O-NE2 3.15Å; L438-Q442 VanDerWaalsContact CD2-OE1 3.29Å; V439-Q442 HydrophobicContact CG2-CB 3.93Å; V439-Q442 HydrophobicContact CG2-CG 4.48Å; V439-Q442 WeakPolarHBondContact O-CB 3.48Å; V439-Q442 PolarHBondContact O-N 3.11Å; D440-Q442 VanDerWaalsContact C-N 3.28Å; D440-Q442 PolarHBondContact O-N 3.46Å; Q442-L459 WeakPolarHBondContact O-CB 3.42Å; Q442-L459 PolarHBondContact O-N 2.63Å
443	E	94.8	Very high	94.2	Very high	96 Å²	96	45.7 Å²	45.7	45%	0.449	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	131.5	173.7	-65.6	-174.7	174.1	0	0	111.9	F457	E443-F457 CarbonylContact C-O 3.43Å; E443-F457 VanDerWaalsContact CA-O 3.29Å; E443-F457 WeakPolarHBondContact CA-O 3.23Å
444	L	96.2	Very high	94	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	125	169	-51.9	-176.7	0	0	0	108.3	I374 V385 I402 T403 A404 L413 L438 F457	I374-L444 HydrophobicContact CD1-CD1 3.72Å; V385-L444 HydrophobicContact CG1-CD1 4.48Å; I402-L444 HydrophobicContact CG2-CB 4.38Å; I402-L444 HydrophobicContact CG2-CD1 4.36Å; T403-L444 WeakPolarHBondContact O-CA 3.35Å; A404-L444 HydrophobicContact CB-CD2 3.83Å; L413-L444 HydrophobicContact CD1-CD2 4.39Å; L438-L444 HydrophobicContact CD1-CD2 4.36Å; L438-L444 HydrophobicContact CD2-CD2 3.85Å; L444-F457 HydrophobicContact CB-CB 4.33Å; L444-F457 PolarHBondContact N-O 2.87Å; L444-F457 PolarHBondContact O-N 2.62Å
445	A	96.6	Very high	94	Very high	24 Å²	24	42.5 Å²	42.5	20%	0.198	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	114.7	173.5	0	0	0	0	0	109	T403 T454 L456	T403-A445 PolarHBondContact N-O 2.91Å; T403-A445 PolarHBondContact O-N 2.86Å; T403-A445 VanDerWaalsContact OG1-CB 3.29Å; T403-A445 WeakPolarHBondContact OG1-CB 3.43Å; T403-A445 PolarHBondContact OG1-O 3.31Å; A445-T454 HydrophobicContact CB-CG2 3.64Å; A445-L456 HydrophobicContact CB-CD2 4.08Å
446	V	96.5	Very high	93.9	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	120.3	-176.6	-177.6	0	0	0	0	110.3	L389 M397 P400 A401 I402 T454 V455 F457	L389-V446 HydrophobicContact CD1-CG1 4Å; L389-V446 HydrophobicContact CD1-CG2 4.01Å; M397-V446 HydrophobicContact CE-CG1 4.04Å; M397-V446 HydrophobicContact SD-CG1 3.64Å; P400-V446 HydrophobicContact CB-CG1 3.92Å; A401-V446 VanDerWaalsContact O-CA 3.24Å; A401-V446 WeakPolarHBondContact O-CA 3.42Å; I402-V446 HydrophobicContact CG1-CG2 4.43Å; I402-V446 HydrophobicContact CG2-CG2 4.49Å; V446-T454 CarbonylContact O-C 3.55Å; V446-T454 WeakPolarHBondContact O-CA 3.28Å; V446-V455 PolarHBondContact N-O 3.47Å; V446-V455 PolarHBondContact O-N 2.94Å; V446-F457 HydrophobicContact CB-CD2 3.94Å; V446-F457 HydrophobicContact CB-CE2 3.81Å; V446-F457 HydrophobicContact CG1-CE2 4.37Å; V446-F457 HydrophobicContact CG2-CD2 3.5Å; V446-F457 VanDerWaalsContact CG2-CD2 3.5Å; V446-F457 HydrophobicContact CG2-CE2 3.79Å
447	A	95	Very high	93.8	Very high	43 Å²	43	38.9 Å²	38.9	36%	0.355	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	145.7	171.4	0	0	0	0	0	109.7	A401	A401-A447 HydrophobicContact CB-CB 4.47Å; A401-A447 WeakPolarHBondContact CB-O 3.2Å; A401-A447 PolarHBondContact N-O 2.88Å; A401-A447 PolarHBondContact O-N 3.41Å
448	D	94.2	Very high	93.8	Very high	12 Å²	12	40.8 Å²	40.8	6%	0.064	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	154.9	178.9	-174.4	53.4	0	0	0	110.9	M397 K398 S399 T450 T451	M397-D448 WeakPolarHBondContact CA-OD2 3.48Å; M397-D448 HydrophobicContact CB-CB 4.28Å; M397-D448 HydrophobicContact CG-CB 4.23Å; M397-D448 HydrophobicContact SD-CB 4.28Å; K398-D448 PolarHBondContact N-OD1 3.09Å; K398-D448 PolarHBondContact N-OD2 2.69Å; S399-D448 WeakPolarHBondContact CA-OD1 3.38Å; S399-D448 PolarHBondContact N-OD1 3.17Å; D448-T450 PolarHBondContact O-N 2.88Å; D448-T450 VanDerWaalsContact O-N 3.12Å; D448-T450 WeakPolarHBondContact OD2-CB 3.33Å; D448-T450 WeakPolarHBondContact OD2-CG2 3.49Å; D448-T450 PolarHBondContact OD2-N 3.42Å; D448-T450 VanDerWaalsContact OD2-N 3.15Å; D448-T450 PolarHBondContact OD2-OG1 2.86Å; D448-T451 PolarHBondContact O-N 3.46Å
449	V	92.6	Very high	93.8	Very high	86 Å²	86	40.5 Å²	40.5	52%	0.521	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-17	177.7	65.2	0	0	0	0	113.1	K398 T451	K398-V449 HydrophobicContact CB-CG1 3.66Å; K398-V449 HydrophobicContact CG-CG1 4.04Å; V449-T451 VanDerWaalsContact C-N 3.32Å; V449-T451 PolarHBondContact O-N 3.05Å
450	T	90.8	Very high	93.9	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.012	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-17.8	178.9	58.6	0	0	0	0	114.3	R173 W174 K398 D448	R173-T450 CarbonylContact C-O 3.58Å; R173-T450 VanDerWaalsContact CB-O 3.26Å; R173-T450 WeakPolarHBondContact CB-O 3.37Å; W174-T450 WeakPolarHBondContact CA-O 3.28Å; W174-T450 PolarHBondContact N-O 2.96Å; W174-T450 VanDerWaalsContact N-O 3.09Å; K398-T450 HydrophobicContact CB-CG2 4.06Å; D448-T450 PolarHBondContact O-N 2.88Å; D448-T450 VanDerWaalsContact O-N 3.12Å; D448-T450 WeakPolarHBondContact OD2-CB 3.33Å; D448-T450 WeakPolarHBondContact OD2-CG2 3.49Å; D448-T450 PolarHBondContact OD2-N 3.42Å; D448-T450 VanDerWaalsContact OD2-N 3.15Å; D448-T450 PolarHBondContact OD2-OG1 2.86Å
451	T	91.8	Very high	93.9	Very high	14 Å²	14	36.8 Å²	36.8	9%	0.086	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	141.2	-179.2	176.5	0	0	0	0	111	D448 V449 Q453 V455	D448-T451 PolarHBondContact O-N 3.46Å; V449-T451 VanDerWaalsContact C-N 3.32Å; V449-T451 PolarHBondContact O-N 3.05Å; T451-Q453 WeakPolarHBondContact CG2-O 3.24Å; T451-Q453 PolarHBondContact O-N 2.89Å; T451-Q453 PolarHBondContact OG1-N 3.47Å; T451-V455 HydrophobicContact CG2-CG2 4.34Å
452	P	89.6	Confident	93.8	Very high	50 Å²	50	38.2 Å²	38.2	33%	0.325	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	-13.9	172.3	29.3	-34.6	0	0	0	113	W174 M178	W174-P452 HydrophobicContact CD2-CG 4.33Å; W174-P452 HydrophobicContact CZ2-CB 3.94Å; W174-P452 HydrophobicContact CZ2-CG 4.29Å; W174-P452 WeakPolarHBondContact O-CD 3.31Å; M178-P452 HydrophobicContact CB-CG 3.92Å; M178-P452 HydrophobicContact CE-CB 4.33Å; M178-P452 HydrophobicContact CE-CG 4.34Å; M178-P452 VanDerWaalsContact N-CG 3.26Å
453	Q	90.7	Very high	92.9	Very high	37 Å²	37	45.5 Å²	45.5	17%	0.173	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	148.2	-179.6	-64.3	-172.2	-4.6	0	0	112.8	G177 I180 T451	G177-Q453 WeakPolarHBondContact O-CG 3.43Å; G177-Q453 PolarHBondContact O-NE2 3.35Å; I180-Q453 VanDerWaalsContact CB-NE2 3.29Å; I180-Q453 VanDerWaalsContact CG2-NE2 3.27Å; T451-Q453 WeakPolarHBondContact CG2-O 3.24Å; T451-Q453 PolarHBondContact O-N 2.89Å; T451-Q453 PolarHBondContact OG1-N 3.47Å
454	T	92.7	Very high	92.8	Very high	80 Å²	80	43 Å²	43	49%	0.491	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	121.4	162.5	-60	0	0	0	0	108.9	A445 V446 L456	A445-T454 HydrophobicContact CB-CG2 3.64Å; V446-T454 CarbonylContact O-C 3.55Å; V446-T454 WeakPolarHBondContact O-CA 3.28Å; T454-L456 HydrophobicContact CG2-CD2 4.48Å
455	V	93.4	Very high	92.7	Very high	11 Å²	11	45.2 Å²	45.2	7%	0.067	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	130	175.1	-176.8	0	0	0	0	108.7	P365 Q372 M397 V446 T451 F457	P365-V455 HydrophobicContact CB-CG1 4.23Å; P365-V455 WeakPolarHBondContact O-CG1 3.41Å; Q372-V455 HydrophobicContact CG-CG1 4.34Å; M397-V455 HydrophobicContact CE-CB 4.32Å; M397-V455 HydrophobicContact CE-CG2 4.22Å; V446-V455 PolarHBondContact N-O 3.47Å; V446-V455 PolarHBondContact O-N 2.94Å; T451-V455 HydrophobicContact CG2-CG2 4.34Å; V455-F457 HydrophobicContact CB-CE2 3.88Å; V455-F457 HydrophobicContact CG1-CD2 4.12Å; V455-F457 HydrophobicContact CG1-CE2 3.49Å; V455-F457 VanDerWaalsContact CG1-CE2 3.49Å; V455-F457 HydrophobicContact CG1-CZ 3.85Å
456	L	94	Very high	92.4	Very high	72 Å²	72	46.3 Å²	46.3	38%	0.377	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	131.1	178.3	-60.2	178.7	0	0	0	110.4	P371 Q372 A445 T454	P371-L456 CarbonylContact C-O 3.59Å; P371-L456 WeakPolarHBondContact CA-O 3.45Å; P371-L456 HydrophobicContact CB-CB 4.1Å; P371-L456 HydrophobicContact CG-CB 4.3Å; Q372-L456 PolarHBondContact N-O 3.2Å; A445-L456 HydrophobicContact CB-CD2 4.08Å; T454-L456 HydrophobicContact CG2-CD2 4.48Å
457	F	95.4	Very high	92.2	Very high	1 Å²	1	49 Å²	49	0%	0.004	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	133.3	174.7	-68.6	-94.5	0	0	0	110.3	Q372 I374 L389 L395 M397 E443 L444 V446 V455	Q372-F457 HydrophobicContact CB-CD1 3.36Å; Q372-F457 HydrophobicContact CB-CE1 3.54Å; Q372-F457 HydrophobicContact CB-CG 4.11Å; Q372-F457 HydrophobicContact CB-CZ 4.39Å; Q372-F457 HydrophobicContact CG-CD1 4.32Å; Q372-F457 HydrophobicContact CG-CE1 4.08Å; Q372-F457 CarbonylContact O-C 3.52Å; Q372-F457 WeakPolarHBondContact O-CA 3.31Å; I374-F457 HydrophobicContact CD1-CB 4.1Å; I374-F457 HydrophobicContact CG1-CB 4.36Å; I374-F457 HydrophobicContact CG2-CD1 3.56Å; I374-F457 HydrophobicContact CG2-CE1 4.23Å; I374-F457 HydrophobicContact CG2-CG 4.42Å; L389-F457 HydrophobicContact CD2-CD1 4.35Å; L389-F457 HydrophobicContact CD2-CD2 4.38Å; L389-F457 HydrophobicContact CD2-CE1 3.8Å; L389-F457 HydrophobicContact CD2-CE2 3.82Å; L389-F457 HydrophobicContact CD2-CZ 3.5Å; L389-F457 VanDerWaalsContact CD2-CZ 3.5Å; L395-F457 HydrophobicContact CD1-CE1 3.9Å; L395-F457 HydrophobicContact CD1-CZ 3.97Å; L395-F457 HydrophobicContact CD2-CE1 4.26Å; L395-F457 HydrophobicContact CD2-CZ 4.09Å; M397-F457 HydrophobicContact CE-CE2 4.01Å; M397-F457 HydrophobicContact CE-CZ 4.01Å; E443-F457 CarbonylContact C-O 3.43Å; E443-F457 VanDerWaalsContact CA-O 3.29Å; E443-F457 WeakPolarHBondContact CA-O 3.23Å; L444-F457 HydrophobicContact CB-CB 4.33Å; L444-F457 PolarHBondContact N-O 2.87Å; L444-F457 PolarHBondContact O-N 2.62Å; V446-F457 HydrophobicContact CB-CD2 3.94Å; V446-F457 HydrophobicContact CB-CE2 3.81Å; V446-F457 HydrophobicContact CG1-CE2 4.37Å; V446-F457 HydrophobicContact CG2-CD2 3.5Å; V446-F457 VanDerWaalsContact CG2-CD2 3.5Å; V446-F457 HydrophobicContact CG2-CE2 3.79Å; V455-F457 HydrophobicContact CB-CE2 3.88Å; V455-F457 HydrophobicContact CG1-CD2 4.12Å; V455-F457 HydrophobicContact CG1-CE2 3.49Å; V455-F457 VanDerWaalsContact CG1-CE2 3.49Å; V455-F457 HydrophobicContact CG1-CZ 3.85Å
458	K	95.4	Very high	92	Very high	80 Å²	80	49.4 Å²	49.4	35%	0.348	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	116.2	174.1	-167.8	168.7	-172.4	167.4	0	110	P371 Q372 N373 I374 G441 H460	P371-K458 HydrophobicContact CB-CB 4.28Å; Q372-K458 PolarHBondContact O-N 3.31Å; N373-K458 WeakPolarHBondContact CA-O 3.11Å; I374-K458 PolarHBondContact N-O 3.43Å; G441-K458 WeakPolarHBondContact O-CE 3.45Å; K458-H460 PolarHBondContact O-CD2 3.47Å
459	L	95.9	Very high	91.9	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	123.1	-179.8	-179.8	62.5	0	0	0	110.7	I374 F376 L433 L438 G441 Q442 F461	I374-L459 HydrophobicContact CD1-CD1 4.08Å; I374-L459 HydrophobicContact CG1-CB 4.43Å; I374-L459 HydrophobicContact CG1-CD1 4.09Å; F376-L459 HydrophobicContact CB-CD1 4.25Å; F376-L459 HydrophobicContact CD2-CD1 4.21Å; L433-L459 HydrophobicContact CD1-CD1 3.91Å; L433-L459 HydrophobicContact CD1-CD2 4.18Å; L438-L459 HydrophobicContact CB-CD2 3.98Å; L438-L459 HydrophobicContact CD1-CD2 4.16Å; G441-L459 VanDerWaalsContact CA-O 3.22Å; G441-L459 WeakPolarHBondContact CA-O 3.43Å; G441-L459 PolarHBondContact N-O 3.08Å; Q442-L459 WeakPolarHBondContact O-CB 3.42Å; Q442-L459 PolarHBondContact O-N 2.63Å; L459-F461 HydrophobicContact CD1-CD1 4.4Å; L459-F461 HydrophobicContact CD1-CE1 4.26Å; L459-F461 HydrophobicContact CD2-CD1 4.31Å; L459-F461 HydrophobicContact CD2-CE1 3.57Å; L459-F461 HydrophobicContact CD2-CZ 3.91Å; L459-F461 HydrophobicContact CG-CD1 4.2Å; L459-F461 HydrophobicContact CG-CE1 3.95Å
460	H	95.8	Very high	91.8	Very high	59 Å²	59	49.4 Å²	49.4	27%	0.273	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	121.1	171.1	-65	-79.7	0	0	0	109.7	N373 I374 Q375 F376 D440 K458 T462	N373-H460 PolarHBondContact OD1-CD2 3.47Å; N373-H460 PolarHBondContact OD1-NE2 3.29Å; I374-H460 PolarHBondContact O-N 3.42Å; Q375-H460 WeakPolarHBondContact CA-O 3.22Å; Q375-H460 HydrophobicContact CG-CB 4.38Å; F376-H460 PolarHBondContact N-O 2.96Å; F376-H460 VanDerWaalsContact N-O 3.15Å; D440-H460 VanDerWaalsContact OD1-CA 3.26Å; D440-H460 WeakPolarHBondContact OD1-CA 3.23Å; K458-H460 PolarHBondContact O-CD2 3.47Å; H460-T462 PolarHBondContact O-N 2.96Å
461	F	95.3	Very high	91.9	Very high	49 Å²	49	53.1 Å²	53.1	22%	0.215	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	115.8	175.6	-75.1	-27.1	0	0	0	111	F376 P378 L433 L438 D440 L459	F376-F461 CarbonylContact O-C 3.56Å; F376-F461 VanDerWaalsContact O-CA 3.27Å; F376-F461 WeakPolarHBondContact O-CA 3.39Å; P378-F461 HydrophobicContact CB-CD1 4.21Å; P378-F461 HydrophobicContact CB-CD2 4.07Å; P378-F461 HydrophobicContact CB-CE1 4.29Å; P378-F461 HydrophobicContact CB-CE2 4.17Å; P378-F461 HydrophobicContact CB-CG 4.12Å; P378-F461 HydrophobicContact CB-CZ 4.29Å; L433-F461 HydrophobicContact CB-CE1 3.78Å; L433-F461 HydrophobicContact CB-CZ 3.98Å; L433-F461 HydrophobicContact CD1-CE1 3.81Å; L433-F461 HydrophobicContact CG-CE1 4.43Å; L438-F461 HydrophobicContact CB-CZ 4.3Å; L438-F461 WeakPolarHBondContact O-CE2 3.33Å; L438-F461 WeakPolarHBondContact O-CZ 3.47Å; D440-F461 HydrophobicContact CB-CB 4.25Å; D440-F461 HydrophobicContact CB-CD2 3.85Å; D440-F461 HydrophobicContact CB-CG 4.33Å; D440-F461 PolarHBondContact OD1-N 3.11Å; L459-F461 HydrophobicContact CD1-CD1 4.4Å; L459-F461 HydrophobicContact CD1-CE1 4.26Å; L459-F461 HydrophobicContact CD2-CD1 4.31Å; L459-F461 HydrophobicContact CD2-CE1 3.57Å; L459-F461 HydrophobicContact CD2-CZ 3.91Å; L459-F461 HydrophobicContact CG-CD1 4.2Å; L459-F461 HydrophobicContact CG-CE1 3.95Å
462	T	90.4	Very high	91.9	Very high	59 Å²	59	56.3 Å²	56.3	36%	0.362	32%	0.323	S	S	.	.			trans	-79.2	148.7	167.7	54.9	0	0	0	0	109.6	Q375 F376 S377 P378 H460	Q375-T462 HydrophobicContact CB-CG2 3.84Å; Q375-T462 HydrophobicContact CG-CG2 4.36Å; F376-T462 VanDerWaalsContact C-OG1 3.26Å; F376-T462 PolarHBondContact O-N 3.24Å; F376-T462 PolarHBondContact O-OG1 2.87Å; S377-T462 PolarHBondContact N-OG1 3.08Å; P378-T462 WeakPolarHBondContact CD-O 3.35Å; H460-T462 PolarHBondContact O-N 2.96Å
463	S	74.6	Confident	92.1	Very high	178 Å²	178	56.9 Å²	56.9	100%	1.245	32%	0.323	S	S	*	.			trans	-57.8	0	-173.3	-56.7	0	0	0	0	114

Retrieved 463 of 463 residues in 89.9 ms (Link to these results)

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