A0A087XF49_POEFO Loading...

Nuclear cap binding protein subunit 1

AlphaFold DB , UniProt , Accession A0A087XF49, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 799 aa.

						>A0A087XF49_POEFO|A0A087XF49
MSRRRHSDENDGGQAHKRRRTSEPIEIEDRLESLICRVGEKSTSSLESNLEGLAGVLEADLPNYKNKILRILCAVARLLPEKLTVYTTLVGLLNARNYNFGGEFVEAMIRQLKETLKNNLYNEAVYLVRFLSDLVNCHVIAAPSMVVMFENFVSVTQEEDVPQVRSDWFVYVVLSCLPWVGKELYEKKDVEMDRLLSQIEGYLKRRVKTHVPMLQVWTAEKPHPQEEYLDCLWAQIQKLKKDRWQERHILRPYIAFDSVLCEALQHNLPPFTPPGHMPDAQYPIPRVIFRMFDYTDAPEGPVMPGSHSAERFVIEENLHCIIKTHWRERKTCAAQLLSYPGKNKIPLNYHIVEVIFGELFQLPLPPHIDVMYTTLLIELCKLQPGSLPQVLAQATEMLYMRLDTMNTTCIDRFINWFSHHLSNFQFRWSWDDWADCLTLDLEKPKPKFVKEVLEKSMRLSYHQRIVDLVPPTFSALIPAEPIFSFKYGDESGTSLPGYPVSITVSNAIKNRASNEEILAILKEVPNPNQEDDDDEGESFNPLKIDVFLQTLLHLAAKSFSHSFSALGKFHEILKNLTESDDGKLHILKVVYEVWRNHPQMIAVLVDKMIRTQIVDCAAVANWLFSQDMAHEFTRLFIWEILHSTIRKMNKHVQKIQNELEEAKDKLEKQQHKRVAPRDSGDDEDMEKNSEEDEEGQLEEQIERLQEKVESAQSEQKNLFLVIFQRFIMLLTEHLVRCETGSVDISTPWYKNCIERLQQIFLMHHGTIQQYMGTLENLLFTAELDHHILAVYQQFCALQL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.1	Very low	30	Very low	246 Å²	246	184.5 Å²	184.5	100%	1.212	88%	0.877	S	S	*	*				0	126.4	0	-75	-179.6	-160.8	0	0	108.6
2	S	33	Very low	29.9	Very low	113 Å²	113	174.2 Å²	174.2	79%	0.79	86%	0.857	S	S	*	*			trans	30	109.9	167.7	-152	0	0	0	0	120.7
3	R	29.9	Very low	29.9	Very low	249 Å²	249	167.2 Å²	167.2	94%	0.94	86%	0.857	S	S	*	*				-159.4	111	115.4	-105.4	172.3	-177.9	-179.9	0.6	109.7
4	R	31.5	Very low	30	Very low	244 Å²	244	168.7 Å²	168.7	92%	0.921	86%	0.859	S	S	*	*			trans	-74.3	137.6	177.8	-84.3	176.9	169.2	167.6	-4.5	110.3
5	R	33.4	Very low	30.1	Very low	248 Å²	248	163.4 Å²	163.4	94%	0.936	85%	0.851	S	S	*	*			trans	-67.1	141.6	160.2	-75.6	175.1	169.8	170.9	-4.7	109.5
6	H	27.8	Very low	30.6	Very low	193 Å²	193	165.1 Å²	165.1	89%	0.894	85%	0.852	S	S	*	*			trans	-129.6	126.6	166.6	-140.1	36.6	0	0	0	108.2
7	S	28.1	Very low	30.9	Very low	92 Å²	92	167.4 Å²	167.4	64%	0.643	86%	0.855	S	S	*	*			trans	-98.4	140.8	169.7	57.6	0	0	0	0	109.3
8	D	29.9	Very low	31.4	Very low	148 Å²	148	171.3 Å²	171.3	79%	0.791	86%	0.857	S	S	*	*			trans	45.4	119.1	145.1	-55.4	-25.1	0	0	0	120.2
9	E	27.3	Very low	32	Very low	189 Å²	189	175 Å²	175	88%	0.883	86%	0.86	S	S	*	*				-175.7	143.5	99.8	-97.1	178.4	179.8	0	0	112.5
10	N	27.3	Very low	32.6	Very low	150 Å²	150	178.6 Å²	178.6	80%	0.802	86%	0.864	S	S	*	*			trans	99.1	102	150.4	-114.8	16.3	0	0	0	122.3
11	D	29	Very low	33.3	Very low	157 Å²	157	173.7 Å²	173.7	84%	0.84	85%	0.845	S	S	*	*				97	133.1	118.6	-142.9	6.2	0	0	0	120.4
12	G	28.9	Very low	34.4	Very low	61 Å²	61	164.9 Å²	164.9	63%	0.629	81%	0.807	S	S	*	*			trans	121.1	57.7	171.3	0	0	0	0	0	116.4	Q14	G12-Q14 PolarHBondContact O-N 3.22Å
13	G	29.5	Very low	35.7	Very low	84 Å²	84	166.9 Å²	166.9	87%	0.866	80%	0.804	S	S	*	*			trans	-59.6	99.3	165.4	0	0	0	0	0	111.8	A15	G13-A15 PolarHBondContact O-N 3.33Å; G13-A15 VanDerWaalsContact O-N 3.16Å
14	Q	31.7	Very low	37.4	Very low	188 Å²	188	158.1 Å²	158.1	88%	0.879	78%	0.779	S	S	*	*			trans	-77	97.6	165.8	-85.7	-175.5	-1.5	0	0	109.1	G12 H16	G12-Q14 PolarHBondContact O-N 3.22Å; Q14-H16 PolarHBondContact O-N 3.48Å
15	A	31.7	Very low	39.4	Very low	89 Å²	89	150.2 Å²	150.2	74%	0.736	75%	0.754	S	S	*	*			trans	-54.9	112.1	162.7	0	0	0	0	0	108.9	G13 K17	G13-A15 PolarHBondContact O-N 3.33Å; G13-A15 VanDerWaalsContact O-N 3.16Å; A15-K17 VanDerWaalsContact C-N 3.33Å; A15-K17 PolarHBondContact O-N 3.26Å
16	H	37.5	Very low	41.6	Very low	190 Å²	190	143.1 Å²	143.1	88%	0.88	73%	0.732	S	S	*	*			trans	-55.8	101.3	161.6	-87	-56.5	0	0	0	107.9	Q14 R18	Q14-H16 PolarHBondContact O-N 3.48Å; H16-R18 PolarHBondContact O-N 2.8Å
17	K	35.4	Very low	44.3	Very low	204 Å²	204	136.6 Å²	136.6	89%	0.887	70%	0.703	S	S	*	*			trans	-59.4	94	161.9	-85.5	-178.3	175.3	176.1	0	106.9	A15 R19	A15-K17 VanDerWaalsContact C-N 3.33Å; A15-K17 PolarHBondContact O-N 3.26Å; K17-R19 PolarHBondContact O-N 2.92Å
18	R	40.8	Very low	47.1	Very low	238 Å²	238	135.1 Å²	135.1	90%	0.898	69%	0.686	S	S	*	*			trans	-52.9	109.3	154.6	-83.9	-179	170.8	174.9	-3.7	105.5	H16 R20	H16-R18 PolarHBondContact O-N 2.8Å; R18-R20 PolarHBondContact O-N 3.06Å
19	R	43.2	Very low	49.9	Very low	242 Å²	242	132.4 Å²	132.4	91%	0.913	67%	0.672	S	S	*	*			trans	-51.3	115.6	163	-94.6	178.4	167.1	171.8	-4.4	105.6	K17 T21	K17-R19 PolarHBondContact O-N 2.92Å; R19-T21 PolarHBondContact O-N 2.87Å
20	R	43.4	Very low	53	Low	247 Å²	247	130.6 Å²	130.6	93%	0.932	66%	0.657	S	S	*	*			trans	-58.5	104.7	164.4	-93.8	177.7	163.8	173.6	-6.5	106.1	R18 S22	R18-R20 PolarHBondContact O-N 3.06Å; R20-S22 PolarHBondContact O-N 3.11Å
21	T	47.8	Very low	56.1	Low	76 Å²	76	123.6 Å²	123.6	47%	0.466	62%	0.619	S	S	.	*			trans	-53.3	132.1	153	16.5	0	0	0	0	106.7	R19 E26	R19-T21 PolarHBondContact O-N 2.87Å; T21-E26 WeakPolarHBondContact CB-OE1 3.28Å; T21-E26 PolarHBondContact OG1-OE1 3.31Å
22	S	54.4	Low	59.1	Low	60 Å²	60	120.2 Å²	120.2	42%	0.42	60%	0.598	S	S	.	*			trans	-69.4	139.6	177	50	0	0	0	0	108.8	R20 P24 I25 E26	R20-S22 PolarHBondContact O-N 3.11Å; S22-P24 WeakPolarHBondContact O-CD 3.16Å; S22-I25 PolarHBondContact O-N 3.39Å; S22-I25 VanDerWaalsContact OG-CD1 3.27Å; S22-I25 WeakPolarHBondContact OG-CD1 3.25Å; S22-I25 WeakPolarHBondContact OG-CG1 3.32Å; S22-E26 PolarHBondContact O-N 3.16Å
23	E	61.2	Low	62.2	Low	155 Å²	155	120.2 Å²	120.2	72%	0.724	59%	0.588	S	S	*	*	H	α-helix	trans	-46.3	-35.5	179.8	-69	178.1	164.9	0	0	114.9	I25 E26 I27	E23-I25 PolarHBondContact O-N 2.8Å; E23-E26 PolarHBondContact O-N 3.19Å; E23-I27 WeakPolarHBondContact O-CG1 3.46Å; E23-I27 PolarHBondContact O-N 3.19Å
24	P	66.1	Low	65.3	Low	66 Å²	66	119.2 Å²	119.2	43%	0.429	56%	0.563	S	S	.	*	H	α-helix	trans	-63.3	-36	176.2	-23.2	34.7	0	0	0	114.1	S22 I27 E28	S22-P24 WeakPolarHBondContact O-CD 3.16Å; P24-I27 PolarHBondContact O-N 3Å; P24-E28 WeakPolarHBondContact O-CG 3.38Å; P24-E28 PolarHBondContact O-N 3.21Å; P24-E28 VanDerWaalsContact O-N 3.15Å
25	I	72.9	Confident	68.3	Low	77 Å²	77	110.3 Å²	110.3	40%	0.395	52%	0.521	S	S	.	.	H	α-helix	trans	-69.9	-38.2	-180	-63.3	174.7	0	0	0	110	S22 E23 I27 E28 D29	S22-I25 PolarHBondContact O-N 3.39Å; S22-I25 VanDerWaalsContact OG-CD1 3.27Å; S22-I25 WeakPolarHBondContact OG-CD1 3.25Å; S22-I25 WeakPolarHBondContact OG-CG1 3.32Å; E23-I25 PolarHBondContact O-N 2.8Å; I25-I27 VanDerWaalsContact C-N 3.31Å; I25-I27 PolarHBondContact O-N 3.22Å; I25-E28 PolarHBondContact O-N 3.48Å; I25-D29 PolarHBondContact O-N 3.19Å
26	E	80.2	Confident	71.2	Confident	100 Å²	100	108 Å²	108	47%	0.467	50%	0.5	S	S	.	.	H	α-helix	trans	-66	-33.7	178.7	-61.7	-175.3	171.5	0	0	112.3	T21 S22 E23 R30	T21-E26 WeakPolarHBondContact CB-OE1 3.28Å; T21-E26 PolarHBondContact OG1-OE1 3.31Å; S22-E26 PolarHBondContact O-N 3.16Å; E23-E26 PolarHBondContact O-N 3.19Å; E26-R30 VanDerWaalsContact O-CB 3.28Å; E26-R30 WeakPolarHBondContact O-CB 3.41Å; E26-R30 PolarHBondContact O-N 2.88Å; E26-R30 VanDerWaalsContact O-N 3.07Å
27	I	83.8	Confident	73.8	Confident	56 Å²	56	106.3 Å²	106.3	29%	0.287	49%	0.485	S	S	.	.	H	α-helix	trans	-72.2	-42.2	175.3	-64.7	168.1	0	0	0	110.8	E23 P24 I25 R30 L31 Y64	E23-I27 WeakPolarHBondContact O-CG1 3.46Å; E23-I27 PolarHBondContact O-N 3.19Å; P24-I27 PolarHBondContact O-N 3Å; I25-I27 VanDerWaalsContact C-N 3.31Å; I25-I27 PolarHBondContact O-N 3.22Å; I27-R30 WeakPolarHBondContact O-CB 3.29Å; I27-R30 PolarHBondContact O-N 3.08Å; I27-L31 HydrophobicContact CG2-CD1 4.3Å; I27-L31 HydrophobicContact CG2-CG 4.48Å; I27-L31 WeakPolarHBondContact O-CG 3.48Å; I27-L31 PolarHBondContact O-N 2.92Å; I27-Y64 WeakPolarHBondContact CD1-OH 3.21Å; I27-Y64 HydrophobicContact CG2-CD2 4.25Å; I27-Y64 HydrophobicContact CG2-CE1 4.27Å; I27-Y64 HydrophobicContact CG2-CE2 3.71Å
28	E	86.8	Confident	76.6	Confident	61 Å²	61	97.1 Å²	97.1	29%	0.285	45%	0.446	S	S	.	.	H	α-helix	trans	-60.7	-46.1	175.9	-72.6	-169.2	-167.5	0	0	112.5	P24 I25 R30 L31 E32 Y64 K67	P24-E28 WeakPolarHBondContact O-CG 3.38Å; P24-E28 PolarHBondContact O-N 3.21Å; P24-E28 VanDerWaalsContact O-N 3.15Å; I25-E28 PolarHBondContact O-N 3.48Å; E28-R30 VanDerWaalsContact C-N 3.28Å; E28-R30 PolarHBondContact O-N 3.31Å; E28-L31 PolarHBondContact O-N 3.3Å; E28-E32 PolarHBondContact O-N 3.31Å; E28-Y64 HydrophobicContact CG-CD1 4.2Å; E28-Y64 HydrophobicContact CG-CE1 4.2Å; E28-K67 HydrophobicContact CB-CG 4.44Å; E28-K67 HydrophobicContact CG-CD 4.34Å; E28-K67 HydrophobicContact CG-CG 4.06Å; E28-K67 WeakPolarHBondContact OE2-CE 3.34Å; E28-K67 IonicContact OE2-NZ 2.71Å; E28-K67 PolarHBondContact OE2-NZ 2.97Å
29	D	88.6	Confident	78.9	Confident	91 Å²	91	87.6 Å²	87.6	49%	0.487	42%	0.422	S	S	.	.	H	α-helix	trans	-64.5	-35.9	177.7	-70.2	-13.7	0	0	0	111.2	I25 S33	I25-D29 PolarHBondContact O-N 3.19Å; D29-S33 VanDerWaalsContact O-CB 3.31Å; D29-S33 WeakPolarHBondContact O-CB 3.31Å; D29-S33 PolarHBondContact O-N 3.41Å
30	R	92.4	Very high	81.1	Confident	151 Å²	151	80.4 Å²	80.4	57%	0.57	40%	0.399	S	S	*	.	H	α-helix	trans	-64.2	-45.3	173.6	178.9	-175.6	171.7	-156.9	-5.8	111.6	E26 I27 E28 E32 S33 L34	E26-R30 VanDerWaalsContact O-CB 3.28Å; E26-R30 WeakPolarHBondContact O-CB 3.41Å; E26-R30 PolarHBondContact O-N 2.88Å; E26-R30 VanDerWaalsContact O-N 3.07Å; I27-R30 WeakPolarHBondContact O-CB 3.29Å; I27-R30 PolarHBondContact O-N 3.08Å; E28-R30 VanDerWaalsContact C-N 3.28Å; E28-R30 PolarHBondContact O-N 3.31Å; R30-E32 VanDerWaalsContact C-N 3.34Å; R30-S33 PolarHBondContact O-N 3.19Å; R30-L34 HydrophobicContact CG-CD1 4.1Å; R30-L34 HydrophobicContact CG-CG 4.43Å; R30-L34 VanDerWaalsContact O-CG 3.31Å; R30-L34 WeakPolarHBondContact O-CG 3.34Å; R30-L34 PolarHBondContact O-N 3.21Å
31	L	92.2	Very high	83	Confident	2 Å²	2	78 Å²	78	1%	0.01	40%	0.395	C	S	.	.	H	α-helix	trans	-60.6	-45.4	178.3	-73.1	171.7	0	0	0	111.2	I27 E28 L34 I35 L57 D60 Y64 I68 I71	I27-L31 HydrophobicContact CG2-CD1 4.3Å; I27-L31 HydrophobicContact CG2-CG 4.48Å; I27-L31 WeakPolarHBondContact O-CG 3.48Å; I27-L31 PolarHBondContact O-N 2.92Å; E28-L31 PolarHBondContact O-N 3.3Å; L31-L34 PolarHBondContact O-N 3.15Å; L31-I35 WeakPolarHBondContact O-CG1 3.45Å; L31-I35 PolarHBondContact O-N 3.32Å; L31-L57 HydrophobicContact CD2-CD2 3.66Å; L31-D60 HydrophobicContact CD2-CB 4.38Å; L31-Y64 HydrophobicContact CD1-CD2 4.46Å; L31-Y64 HydrophobicContact CD1-CG 4.05Å; L31-I68 HydrophobicContact CD1-CD1 4.44Å; L31-I68 HydrophobicContact CD1-CG1 4.17Å; L31-I71 HydrophobicContact CB-CD1 4.34Å
32	E	93.4	Very high	85	Confident	87 Å²	87	77.4 Å²	77.4	41%	0.407	39%	0.394	S	S	.	.	H	α-helix	trans	-61.4	-46.2	176.3	-171.7	168.3	170.4	0	0	111.5	E28 R30 L34 I35 C36 I71	E28-E32 PolarHBondContact O-N 3.31Å; R30-E32 VanDerWaalsContact C-N 3.34Å; E32-L34 PolarHBondContact O-N 2.86Å; E32-I35 PolarHBondContact O-N 3.43Å; E32-C36 WeakPolarHBondContact O-CB 3.37Å; E32-C36 PolarHBondContact O-N 3.13Å; E32-C36 PolarHBondContact O-SG 3.3Å; E32-I71 HydrophobicContact CB-CD1 3.93Å; E32-I71 HydrophobicContact CB-CG1 4.44Å; E32-I71 HydrophobicContact CG-CG2 4.43Å
33	S	93.1	Very high	86.7	Confident	60 Å²	60	81.7 Å²	81.7	42%	0.42	42%	0.418	S	S	.	.	H	α-helix	trans	-59.1	-44.3	176.2	-172.7	0	0	0	0	112.7	D29 R30 C36 R37	D29-S33 VanDerWaalsContact O-CB 3.31Å; D29-S33 WeakPolarHBondContact O-CB 3.31Å; D29-S33 PolarHBondContact O-N 3.41Å; R30-S33 PolarHBondContact O-N 3.19Å; S33-C36 PolarHBondContact O-N 3.41Å; S33-R37 WeakPolarHBondContact O-CB 3.48Å; S33-R37 WeakPolarHBondContact O-CG 3.43Å; S33-R37 PolarHBondContact O-N 2.98Å
34	L	94.4	Very high	88.2	Confident	64 Å²	64	77 Å²	77	34%	0.335	40%	0.402	S	S	.	.	H	α-helix	trans	-63.6	-45	178.9	-72.8	172.7	0	0	0	112	R30 L31 E32 R37 V38 L53 V56	R30-L34 HydrophobicContact CG-CD1 4.1Å; R30-L34 HydrophobicContact CG-CG 4.43Å; R30-L34 VanDerWaalsContact O-CG 3.31Å; R30-L34 WeakPolarHBondContact O-CG 3.34Å; R30-L34 PolarHBondContact O-N 3.21Å; L31-L34 PolarHBondContact O-N 3.15Å; E32-L34 PolarHBondContact O-N 2.86Å; L34-R37 PolarHBondContact O-N 3.12Å; L34-V38 PolarHBondContact O-N 3.07Å; L34-L53 HydrophobicContact CB-CD1 3.85Å; L34-V56 HydrophobicContact CD1-CG1 4.25Å
35	I	95.1	Very high	89.5	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-67.2	-41.5	178.3	-65.2	166.8	0	0	0	110.8	L31 E32 R37 V38 L57 I71 L72 V75 Y86	L31-I35 WeakPolarHBondContact O-CG1 3.45Å; L31-I35 PolarHBondContact O-N 3.32Å; E32-I35 PolarHBondContact O-N 3.43Å; I35-R37 VanDerWaalsContact C-N 3.3Å; I35-R37 PolarHBondContact O-N 3.23Å; I35-V38 WeakPolarHBondContact O-CG1 3.44Å; I35-L57 HydrophobicContact CD1-CD1 4.2Å; I35-L57 HydrophobicContact CD1-CD2 3.99Å; I35-L57 HydrophobicContact CG1-CD1 4.13Å; I35-L57 HydrophobicContact CG1-CD2 4.22Å; I35-I71 HydrophobicContact CB-CG2 4Å; I35-I71 HydrophobicContact CD1-CB 4.04Å; I35-I71 HydrophobicContact CD1-CD1 4.35Å; I35-I71 HydrophobicContact CD1-CG2 3.62Å; I35-I71 HydrophobicContact CG1-CG2 4.41Å; I35-I71 HydrophobicContact CG2-CG2 3.88Å; I35-L72 HydrophobicContact CD1-CD2 4.36Å; I35-L72 HydrophobicContact CG2-CD2 4.06Å; I35-V75 HydrophobicContact CG2-CG1 4.13Å; I35-V75 HydrophobicContact CG2-CG2 4.19Å; I35-Y86 HydrophobicContact CG2-CD1 4.47Å; I35-Y86 HydrophobicContact CG2-CE1 3.87Å; I35-Y86 VanDerWaalsContact O-CE1 3.26Å; I35-Y86 WeakPolarHBondContact O-CE1 3.31Å; I35-Y86 PolarHBondContact O-OH 3.46Å
36	C	93.2	Very high	90.6	Very high	42 Å²	42	75.6 Å²	75.6	28%	0.284	40%	0.396	S	S	.	.	H	α-helix	trans	-66.2	-33.4	179	-72.9	0	0	0	0	112.3	E32 S33 K82	E32-C36 WeakPolarHBondContact O-CB 3.37Å; E32-C36 PolarHBondContact O-N 3.13Å; E32-C36 PolarHBondContact O-SG 3.3Å; S33-C36 PolarHBondContact O-N 3.41Å; C36-K82 PolarHBondContact O-NZ 3.49Å
37	R	92.3	Very high	91.3	Very high	153 Å²	153	74.4 Å²	74.4	58%	0.577	39%	0.391	S	S	*	.	H	α-helix	trans	-88.8	-14.5	-175.1	-66.9	-179.2	68.9	-163.6	-2.8	115.4	S33 L34 I35 G39 E40	S33-R37 WeakPolarHBondContact O-CB 3.48Å; S33-R37 WeakPolarHBondContact O-CG 3.43Å; S33-R37 PolarHBondContact O-N 2.98Å; L34-R37 PolarHBondContact O-N 3.12Å; I35-R37 VanDerWaalsContact C-N 3.3Å; I35-R37 PolarHBondContact O-N 3.23Å; R37-G39 PolarHBondContact O-N 2.84Å; R37-E40 IonicContact NE-OE2 3.92Å; R37-E40 VanDerWaalsContact O-CB 3.27Å; R37-E40 WeakPolarHBondContact O-CB 3.39Å; R37-E40 WeakPolarHBondContact O-CG 3.25Å; R37-E40 PolarHBondContact O-N 3.34Å
38	V	93.4	Very high	91.9	Very high	11 Å²	11	75 Å²	75	7%	0.067	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	131.3	177.9	73.9	0	0	0	0	110.4	L34 I35 N49 L50 L53 K82 V85 Y86	L34-V38 PolarHBondContact O-N 3.07Å; I35-V38 WeakPolarHBondContact O-CG1 3.44Å; V38-N49 HydrophobicContact CG2-CB 4.43Å; V38-L50 HydrophobicContact CG2-CD2 3.93Å; V38-L50 HydrophobicContact CG2-CG 4.31Å; V38-L53 HydrophobicContact CB-CD2 3.75Å; V38-L53 HydrophobicContact CG1-CD2 3.94Å; V38-L53 HydrophobicContact CG2-CD2 3.99Å; V38-K82 WeakPolarHBondContact O-CE 3.44Å; V38-K82 PolarHBondContact O-NZ 3.27Å; V38-V85 HydrophobicContact CG1-CG1 4Å; V38-V85 HydrophobicContact CG2-CG1 4.43Å; V38-Y86 HydrophobicContact CG1-CD1 4.41Å; V38-Y86 HydrophobicContact CG1-CE1 3.8Å
39	G	88.6	Confident	92.4	Very high	38 Å²	38	74.1 Å²	74.1	39%	0.392	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.4	-5.9	-173.4	0	0	0	0	0	115.3	R37	R37-G39 PolarHBondContact O-N 2.84Å
40	E	88.9	Confident	92.8	Very high	91 Å²	91	69.8 Å²	69.8	43%	0.425	37%	0.374	S	S	.	.	S	Bend	trans	-74.3	171.8	166.3	-64.7	179.3	175.5	0	0	111.8	R37 S42	R37-E40 IonicContact NE-OE2 3.92Å; R37-E40 VanDerWaalsContact O-CB 3.27Å; R37-E40 WeakPolarHBondContact O-CB 3.39Å; R37-E40 WeakPolarHBondContact O-CG 3.25Å; R37-E40 PolarHBondContact O-N 3.34Å; E40-S42 PolarHBondContact O-N 3.19Å; E40-S42 VanDerWaalsContact O-N 3.14Å
41	K	84.9	Confident	93	Very high	197 Å²	197	65.8 Å²	65.8	86%	0.857	36%	0.362	S	S	*	.	S	Bend	trans	-54.8	120.1	175.3	-69.2	178.5	177.9	173.4	0	110.4
42	S	89.4	Confident	93.2	Very high	63 Å²	63	67.7 Å²	67.7	44%	0.441	38%	0.382	S	S	.	.			trans	-136.1	157.2	-179.2	-177.7	0	0	0	0	110.5	E40 S44 N49	E40-S42 PolarHBondContact O-N 3.19Å; E40-S42 VanDerWaalsContact O-N 3.14Å; S42-S44 VanDerWaalsContact C-N 3.28Å; S42-S44 PolarHBondContact OG-N 3.41Å; S42-N49 VanDerWaalsContact CB-ND2 3.35Å; S42-N49 WeakPolarHBondContact CB-ND2 3.35Å; S42-N49 PolarHBondContact OG-ND2 3.17Å
43	T	88.9	Confident	93.4	Very high	151 Å²	151	64.2 Å²	64.2	93%	0.926	37%	0.366	S	S	*	.	S	Bend	trans	-74.6	-22	171.2	51.6	0	0	0	0	112.4
44	S	92.9	Very high	93.6	Very high	56 Å²	56	61.3 Å²	61.3	39%	0.392	35%	0.346	S	S	.	.	S	Bend	trans	-98.4	155.6	178	-58.6	0	0	0	0	110.9	S42 N49	S42-S44 VanDerWaalsContact C-N 3.28Å; S42-S44 PolarHBondContact OG-N 3.41Å; S44-N49 WeakPolarHBondContact CB-OD1 3.12Å; S44-N49 PolarHBondContact O-ND2 3.16Å; S44-N49 VanDerWaalsContact O-ND2 3.15Å
45	S	94.4	Very high	93.7	Very high	59 Å²	59	59.4 Å²	59.4	41%	0.413	34%	0.342	S	S	.	.			trans	-62.8	156.9	176.5	91.6	0	0	0	0	111.6	E47 S48 N49	S45-E47 WeakPolarHBondContact CB-OE2 3.32Å; S45-E47 PolarHBondContact O-N 3.12Å; S45-E47 PolarHBondContact OG-N 3.36Å; S45-E47 PolarHBondContact OG-OE2 3.34Å; S45-S48 PolarHBondContact O-N 3.24Å; S45-S48 PolarHBondContact OG-N 2.92Å; S45-N49 VanDerWaalsContact O-CG 3.31Å; S45-N49 PolarHBondContact O-N 3.3Å; S45-N49 PolarHBondContact O-ND2 3.13Å
46	L	94.8	Very high	93.8	Very high	54 Å²	54	61.8 Å²	61.8	28%	0.283	36%	0.356	S	S	.	.	H	α-helix	trans	-59.7	-39.6	178.3	178.7	56.6	0	0	0	111.2	N49 L50 V85 P252	L46-N49 PolarHBondContact O-N 3.12Å; L46-L50 HydrophobicContact CD1-CD1 4.11Å; L46-L50 HydrophobicContact CD1-CG 4.15Å; L46-L50 HydrophobicContact CG-CD1 3.9Å; L46-L50 HydrophobicContact CG-CG 4.42Å; L46-L50 WeakPolarHBondContact O-CB 3.06Å; L46-L50 WeakPolarHBondContact O-CG 3.45Å; L46-L50 PolarHBondContact O-N 3.09Å; L46-V85 HydrophobicContact CD1-CG1 4.24Å; L46-V85 HydrophobicContact CD2-CG2 4.31Å; L46-P252 HydrophobicContact CD2-CB 4.17Å; L46-P252 HydrophobicContact CD2-CG 3.8Å
47	E	96.3	Very high	94	Very high	76 Å²	76	59.8 Å²	59.8	36%	0.355	34%	0.342	S	S	.	.	H	α-helix	trans	-60.4	-49.4	177.5	-55.1	76.2	-168.5	0	0	110.6	S45 N49 L50 E51 A255 F256	S45-E47 WeakPolarHBondContact CB-OE2 3.32Å; S45-E47 PolarHBondContact O-N 3.12Å; S45-E47 PolarHBondContact OG-N 3.36Å; S45-E47 PolarHBondContact OG-OE2 3.34Å; E47-N49 VanDerWaalsContact C-N 3.3Å; E47-N49 PolarHBondContact O-N 3.38Å; E47-L50 PolarHBondContact O-N 2.96Å; E47-E51 WeakPolarHBondContact O-CB 3.38Å; E47-E51 PolarHBondContact O-N 3.24Å; E47-A255 HydrophobicContact CG-CB 3.75Å; E47-F256 HydrophobicContact CB-CE2 4.02Å; E47-F256 HydrophobicContact CB-CZ 3.68Å; E47-F256 HydrophobicContact CG-CE2 4.12Å; E47-F256 HydrophobicContact CG-CZ 4.28Å; E47-F256 WeakPolarHBondContact O-CZ 3.49Å
48	S	96.3	Very high	94.2	Very high	67 Å²	67	55.8 Å²	55.8	47%	0.469	33%	0.33	S	S	.	.	H	α-helix	trans	-61.5	-38.5	177.6	177.8	0	0	0	0	112.5	S45 G52	S45-S48 PolarHBondContact O-N 3.24Å; S45-S48 PolarHBondContact OG-N 2.92Å; S48-G52 PolarHBondContact O-N 3.15Å
49	N	96.9	Very high	94.3	Very high	43 Å²	43	58.7 Å²	58.7	23%	0.23	36%	0.356	C	S	.	.	H	α-helix	trans	-69.2	-39.5	178.1	-65.3	-41.2	0	0	0	111.8	V38 S42 S44 S45 L46 E47 L53	V38-N49 HydrophobicContact CG2-CB 4.43Å; S42-N49 VanDerWaalsContact CB-ND2 3.35Å; S42-N49 WeakPolarHBondContact CB-ND2 3.35Å; S42-N49 PolarHBondContact OG-ND2 3.17Å; S44-N49 WeakPolarHBondContact CB-OD1 3.12Å; S44-N49 PolarHBondContact O-ND2 3.16Å; S44-N49 VanDerWaalsContact O-ND2 3.15Å; S45-N49 VanDerWaalsContact O-CG 3.31Å; S45-N49 PolarHBondContact O-N 3.3Å; S45-N49 PolarHBondContact O-ND2 3.13Å; L46-N49 PolarHBondContact O-N 3.12Å; E47-N49 VanDerWaalsContact C-N 3.3Å; E47-N49 PolarHBondContact O-N 3.38Å; N49-L53 VanDerWaalsContact O-CB 3.26Å; N49-L53 WeakPolarHBondContact O-CB 3.43Å; N49-L53 PolarHBondContact O-N 2.87Å
50	L	97.8	Very high	94.6	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-65.9	-47.2	177	-78.2	168.6	0	0	0	111.7	V38 L46 E47 L53 A54 V85 T88 L89 L92 P252 F256	V38-L50 HydrophobicContact CG2-CD2 3.93Å; V38-L50 HydrophobicContact CG2-CG 4.31Å; L46-L50 HydrophobicContact CD1-CD1 4.11Å; L46-L50 HydrophobicContact CD1-CG 4.15Å; L46-L50 HydrophobicContact CG-CD1 3.9Å; L46-L50 HydrophobicContact CG-CG 4.42Å; L46-L50 WeakPolarHBondContact O-CB 3.06Å; L46-L50 WeakPolarHBondContact O-CG 3.45Å; L46-L50 PolarHBondContact O-N 3.09Å; E47-L50 PolarHBondContact O-N 2.96Å; L50-L53 PolarHBondContact O-N 3.28Å; L50-A54 WeakPolarHBondContact O-CB 3.34Å; L50-A54 PolarHBondContact O-N 2.77Å; L50-V85 HydrophobicContact CD2-CG1 3.95Å; L50-V85 WeakPolarHBondContact CD2-O 3.46Å; L50-T88 HydrophobicContact CD1-CG2 3.89Å; L50-L89 HydrophobicContact CD2-CB 3.87Å; L50-L89 HydrophobicContact CD2-CD1 4.42Å; L50-L92 HydrophobicContact CB-CD1 4.09Å; L50-P252 HydrophobicContact CD1-CB 3.96Å; L50-F256 HydrophobicContact CB-CZ 4.32Å; L50-F256 HydrophobicContact CD1-CE2 4.36Å
51	E	96.5	Very high	94.8	Very high	68 Å²	68	55 Å²	55	32%	0.318	33%	0.33	S	S	.	.	H	α-helix	trans	-61	-46.2	177.9	-172.7	61.7	-153.8	0	0	111.3	E47 A54 G55 R96 F256	E47-E51 WeakPolarHBondContact O-CB 3.38Å; E47-E51 PolarHBondContact O-N 3.24Å; E51-A54 PolarHBondContact O-N 2.99Å; E51-G55 PolarHBondContact O-N 3.13Å; E51-G55 VanDerWaalsContact O-N 3.16Å; E51-R96 IonicContact OE1-CZ 3.83Å; E51-R96 IonicContact OE1-NH2 2.77Å; E51-R96 PolarHBondContact OE1-NH2 2.96Å; E51-F256 HydrophobicContact CB-CE1 4.27Å; E51-F256 WeakPolarHBondContact OE2-CE1 3.49Å
52	G	96.6	Very high	95.3	Very high	42 Å²	42	50.8 Å²	50.8	43%	0.433	32%	0.323	S	S	.	.	H	α-helix	trans	-62.9	-43.1	176.8	0	0	0	0	0	112.6	S48 G55 V56	S48-G52 PolarHBondContact O-N 3.15Å; G52-G55 PolarHBondContact O-N 3.25Å; G52-V56 WeakPolarHBondContact O-CG2 3.08Å; G52-V56 PolarHBondContact O-N 3.19Å; G52-V56 VanDerWaalsContact O-N 3.09Å
53	L	97.3	Very high	95.5	Very high	13 Å²	13	54.1 Å²	54.1	7%	0.068	34%	0.335	C	S	.	.	H	α-helix	trans	-66.6	-41	178	-178	58.1	0	0	0	111.9	L34 V38 N49 L50 G55 V56 L57 L89	L34-L53 HydrophobicContact CB-CD1 3.85Å; V38-L53 HydrophobicContact CB-CD2 3.75Å; V38-L53 HydrophobicContact CG1-CD2 3.94Å; V38-L53 HydrophobicContact CG2-CD2 3.99Å; N49-L53 VanDerWaalsContact O-CB 3.26Å; N49-L53 WeakPolarHBondContact O-CB 3.43Å; N49-L53 PolarHBondContact O-N 2.87Å; L50-L53 PolarHBondContact O-N 3.28Å; L53-G55 VanDerWaalsContact C-N 3.29Å; L53-G55 PolarHBondContact O-N 2.7Å; L53-V56 PolarHBondContact O-N 2.73Å; L53-L57 HydrophobicContact CD1-CD1 4.22Å; L53-L57 HydrophobicContact CD1-CD2 4.3Å; L53-L57 HydrophobicContact CD1-CG 3.95Å; L53-L57 HydrophobicContact CG-CD1 4.02Å; L53-L57 HydrophobicContact CG-CG 4.2Å; L53-L57 WeakPolarHBondContact O-CG 3.46Å; L53-L57 PolarHBondContact O-N 2.6Å; L53-L89 HydrophobicContact CB-CD1 4.2Å; L53-L89 HydrophobicContact CD2-CD1 4.14Å; L53-L89 HydrophobicContact CD2-CD2 3.69Å; L53-L89 HydrophobicContact CG-CD1 4.01Å; L53-L89 HydrophobicContact CG-CD2 4.28Å
54	A	97.4	Very high	95.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-57.6	-43.5	175.6	0	0	0	0	0	111.4	L50 E51 L57 E58 L89 L92 L93	L50-A54 WeakPolarHBondContact O-CB 3.34Å; L50-A54 PolarHBondContact O-N 2.77Å; E51-A54 PolarHBondContact O-N 2.99Å; A54-L57 PolarHBondContact O-N 3.22Å; A54-E58 WeakPolarHBondContact O-CB 3.12Å; A54-E58 PolarHBondContact O-N 3Å; A54-L89 HydrophobicContact CB-CD1 4.13Å; A54-L92 HydrophobicContact CB-CB 3.8Å; A54-L92 HydrophobicContact CB-CD1 4.35Å; A54-L93 HydrophobicContact CB-CD2 4.45Å; A54-L93 WeakPolarHBondContact O-CD2 3.36Å
55	G	96.7	Very high	95.9	Very high	24 Å²	24	49.3 Å²	49.3	25%	0.247	29%	0.294	C	S	.	.	H	α-helix	trans	-64.6	-38.8	175.6	0	0	0	0	0	114	E51 G52 L53 A59	E51-G55 PolarHBondContact O-N 3.13Å; E51-G55 VanDerWaalsContact O-N 3.16Å; G52-G55 PolarHBondContact O-N 3.25Å; L53-G55 VanDerWaalsContact C-N 3.29Å; L53-G55 PolarHBondContact O-N 2.7Å; G55-A59 PolarHBondContact O-N 3.47Å
56	V	96.3	Very high	95.9	Very high	49 Å²	49	52.7 Å²	52.7	30%	0.297	31%	0.307	S	S	.	.	H	α-helix	trans	-64.4	-48.6	175.1	171.2	0	0	0	0	110.8	L34 G52 L53 E58 A59 D60	L34-V56 HydrophobicContact CD1-CG1 4.25Å; G52-V56 WeakPolarHBondContact O-CG2 3.08Å; G52-V56 PolarHBondContact O-N 3.19Å; G52-V56 VanDerWaalsContact O-N 3.09Å; L53-V56 PolarHBondContact O-N 2.73Å; V56-E58 VanDerWaalsContact C-N 3.35Å; V56-E58 PolarHBondContact O-N 3.1Å; V56-A59 PolarHBondContact O-N 3.49Å; V56-D60 PolarHBondContact O-N 3.27Å
57	L	96.7	Very high	95.8	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-64.6	-40	-178.8	-66.7	-179.1	0	0	0	111.8	L31 I35 L53 A54 A59 D60 L61 I68 L89 L93	L31-L57 HydrophobicContact CD2-CD2 3.66Å; I35-L57 HydrophobicContact CD1-CD1 4.2Å; I35-L57 HydrophobicContact CD1-CD2 3.99Å; I35-L57 HydrophobicContact CG1-CD1 4.13Å; I35-L57 HydrophobicContact CG1-CD2 4.22Å; L53-L57 HydrophobicContact CD1-CD1 4.22Å; L53-L57 HydrophobicContact CD1-CD2 4.3Å; L53-L57 HydrophobicContact CD1-CG 3.95Å; L53-L57 HydrophobicContact CG-CD1 4.02Å; L53-L57 HydrophobicContact CG-CG 4.2Å; L53-L57 WeakPolarHBondContact O-CG 3.46Å; L53-L57 PolarHBondContact O-N 2.6Å; A54-L57 PolarHBondContact O-N 3.22Å; L57-A59 PolarHBondContact O-N 3.24Å; L57-D60 PolarHBondContact O-N 3.04Å; L57-L61 WeakPolarHBondContact O-CG 3.48Å; L57-L61 PolarHBondContact O-N 3.1Å; L57-I68 HydrophobicContact CB-CD1 4.5Å; L57-I68 HydrophobicContact CD2-CD1 4.18Å; L57-I68 HydrophobicContact CD2-CG1 4.25Å; L57-I68 HydrophobicContact CD2-CG2 4.39Å; L57-L89 HydrophobicContact CD1-CD1 4.35Å; L57-L89 HydrophobicContact CD1-CD2 4.09Å; L57-L89 HydrophobicContact CD1-CG 4.45Å; L57-L93 HydrophobicContact CB-CD1 4.4Å; L57-L93 HydrophobicContact CB-CD2 3.91Å; L57-L93 HydrophobicContact CD1-CD1 3.93Å
58	E	96.7	Very high	95.9	Very high	69 Å²	69	48.6 Å²	48.6	32%	0.322	29%	0.286	S	S	.	.	H	α-helix	trans	-57.3	-46.8	174.4	-177.9	-175.3	-169.8	0	0	111.9	A54 V56 D60 L61 R96	A54-E58 WeakPolarHBondContact O-CB 3.12Å; A54-E58 PolarHBondContact O-N 3Å; V56-E58 VanDerWaalsContact C-N 3.35Å; V56-E58 PolarHBondContact O-N 3.1Å; E58-D60 PolarHBondContact O-N 2.91Å; E58-L61 WeakPolarHBondContact O-CB 3.43Å; E58-L61 PolarHBondContact O-N 3.29Å; E58-R96 HydrophobicContact CG-CB 4.47Å; E58-R96 VanDerWaalsContact OE2-CD 3.3Å; E58-R96 WeakPolarHBondContact OE2-CD 2.94Å; E58-R96 IonicContact OE2-CZ 3.74Å; E58-R96 IonicContact OE2-NE 3.73Å; E58-R96 IonicContact OE2-NH1 3.69Å; E58-R96 PolarHBondContact OE2-NH1 3.41Å
59	A	95.9	Very high	95.9	Very high	73 Å²	73	46.1 Å²	46.1	60%	0.603	27%	0.268	S	S	*	.	H	α-helix	trans	-62.6	-30.8	179.4	0	0	0	0	0	112.7	G55 V56 L57 P62	G55-A59 PolarHBondContact O-N 3.47Å; V56-A59 PolarHBondContact O-N 3.49Å; L57-A59 PolarHBondContact O-N 3.24Å; A59-P62 WeakPolarHBondContact O-CD 3.48Å
60	D	94.8	Very high	95.8	Very high	38 Å²	38	53.2 Å²	53.2	20%	0.203	29%	0.291	C	S	.	.	H	α-helix	trans	-91	-8.3	-179.3	-73.8	-32.2	0	0	0	113.7	L31 V56 L57 E58 N63 Y64 I68	L31-D60 HydrophobicContact CD2-CB 4.38Å; V56-D60 PolarHBondContact O-N 3.27Å; L57-D60 PolarHBondContact O-N 3.04Å; E58-D60 PolarHBondContact O-N 2.91Å; D60-N63 PolarHBondContact O-N 3.1Å; D60-Y64 HydrophobicContact CB-CD2 4.13Å; D60-Y64 WeakPolarHBondContact O-CB 3.42Å; D60-Y64 PolarHBondContact O-N 3.4Å; D60-I68 HydrophobicContact CB-CD1 4.23Å
61	L	94.1	Very high	95.8	Very high	14 Å²	14	53.7 Å²	53.7	7%	0.073	29%	0.294	C	S	.	.	H	α-helix	trans	-52.3	-42.9	177.3	-72.8	179.8	0	0	0	114.2	L57 E58 N63 Y64 K65 I68 N97 F100	L57-L61 WeakPolarHBondContact O-CG 3.48Å; L57-L61 PolarHBondContact O-N 3.1Å; E58-L61 WeakPolarHBondContact O-CB 3.43Å; E58-L61 PolarHBondContact O-N 3.29Å; L61-N63 PolarHBondContact O-N 2.99Å; L61-N63 VanDerWaalsContact O-N 3.1Å; L61-Y64 PolarHBondContact O-N 3.17Å; L61-K65 HydrophobicContact CD2-CB 4.3Å; L61-K65 HydrophobicContact CD2-CG 4.31Å; L61-K65 VanDerWaalsContact O-CB 3.23Å; L61-K65 WeakPolarHBondContact O-CB 3.19Å; L61-K65 PolarHBondContact O-N 3.44Å; L61-I68 HydrophobicContact CD2-CD1 4.06Å; L61-N97 HydrophobicContact CD1-CB 4.26Å; L61-F100 HydrophobicContact CD1-CB 4.22Å; L61-F100 HydrophobicContact CD1-CD2 4.22Å; L61-F100 HydrophobicContact CD1-CG 4.21Å; L61-F100 HydrophobicContact CD2-CD2 3.46Å; L61-F100 VanDerWaalsContact CD2-CD2 3.46Å; L61-F100 HydrophobicContact CD2-CE2 3.53Å; L61-F100 HydrophobicContact CD2-CG 4.2Å; L61-F100 HydrophobicContact CD2-CZ 4.35Å
62	P	93.9	Very high	95.8	Very high	108 Å²	108	50.5 Å²	50.5	70%	0.701	28%	0.278	S	S	*	.	H	α-helix	trans	-56.1	-32.6	-176.5	-27.3	36.3	0	0	0	114.1	A59	A59-P62 WeakPolarHBondContact O-CD 3.48Å
63	N	93.7	Very high	95.8	Very high	133 Å²	133	48.8 Å²	48.8	71%	0.711	26%	0.26	S	S	*	.	H	α-helix	trans	-108.5	-25.8	-176.2	-62.5	-40.7	0	0	0	113.1	D60 L61	D60-N63 PolarHBondContact O-N 3.1Å; L61-N63 PolarHBondContact O-N 2.99Å; L61-N63 VanDerWaalsContact O-N 3.1Å
64	Y	94.8	Very high	95.8	Very high	36 Å²	36	49.7 Å²	49.7	14%	0.141	27%	0.269	C	S	.	.	H	α-helix	trans	-126.3	11.7	-168.4	-59.6	-76.9	0	0	0	114.7	I27 E28 L31 D60 L61 N66 K67 I68	I27-Y64 WeakPolarHBondContact CD1-OH 3.21Å; I27-Y64 HydrophobicContact CG2-CD2 4.25Å; I27-Y64 HydrophobicContact CG2-CE1 4.27Å; I27-Y64 HydrophobicContact CG2-CE2 3.71Å; E28-Y64 HydrophobicContact CG-CD1 4.2Å; E28-Y64 HydrophobicContact CG-CE1 4.2Å; L31-Y64 HydrophobicContact CD1-CD2 4.46Å; L31-Y64 HydrophobicContact CD1-CG 4.05Å; D60-Y64 HydrophobicContact CB-CD2 4.13Å; D60-Y64 WeakPolarHBondContact O-CB 3.42Å; D60-Y64 PolarHBondContact O-N 3.4Å; L61-Y64 PolarHBondContact O-N 3.17Å; Y64-N66 VanDerWaalsContact C-N 3.31Å; Y64-N66 PolarHBondContact O-N 3.47Å; Y64-N66 VanDerWaalsContact O-N 3.16Å; Y64-K67 PolarHBondContact O-N 3.17Å; Y64-I68 WeakPolarHBondContact O-CG1 3.38Å; Y64-I68 PolarHBondContact O-N 3.4Å
65	K	95.5	Very high	95.7	Very high	69 Å²	69	50 Å²	50	30%	0.3	27%	0.271	S	S	.	.	H	α-helix	trans	-45.4	-50	-179.5	-179	173	66.7	162.9	0	113.8	L61 K67 I68 L69 F100 E103	L61-K65 HydrophobicContact CD2-CB 4.3Å; L61-K65 HydrophobicContact CD2-CG 4.31Å; L61-K65 VanDerWaalsContact O-CB 3.23Å; L61-K65 WeakPolarHBondContact O-CB 3.19Å; L61-K65 PolarHBondContact O-N 3.44Å; K65-K67 VanDerWaalsContact C-N 3.34Å; K65-K67 PolarHBondContact O-N 3.42Å; K65-I68 PolarHBondContact O-N 3.4Å; K65-L69 HydrophobicContact CG-CD1 4.11Å; K65-L69 HydrophobicContact CG-CG 4.39Å; K65-L69 WeakPolarHBondContact O-CB 3.37Å; K65-L69 WeakPolarHBondContact O-CG 3.44Å; K65-L69 PolarHBondContact O-N 3.17Å; K65-F100 HydrophobicContact CD-CD2 4.45Å; K65-F100 HydrophobicContact CG-CD2 4.12Å; K65-F100 HydrophobicContact CG-CE2 4.42Å; K65-E103 VanDerWaalsContact CD-OE2 3.32Å; K65-E103 WeakPolarHBondContact CD-OE2 3.5Å; K65-E103 WeakPolarHBondContact CE-OE2 3.46Å; K65-E103 IonicContact NZ-OE1 2.82Å; K65-E103 PolarHBondContact NZ-OE1 3.36Å; K65-E103 IonicContact NZ-OE2 2.71Å; K65-E103 PolarHBondContact NZ-OE2 2.73Å
66	N	94.4	Very high	95.7	Very high	130 Å²	130	49 Å²	49	70%	0.695	26%	0.26	S	S	*	.	H	α-helix	trans	-62.7	-38.8	-178.3	-70.2	-21.2	0	0	0	112.8	Y64 R70	Y64-N66 VanDerWaalsContact C-N 3.31Å; Y64-N66 PolarHBondContact O-N 3.47Å; Y64-N66 VanDerWaalsContact O-N 3.16Å; N66-R70 WeakPolarHBondContact O-CB 3.5Å; N66-R70 PolarHBondContact O-N 2.91Å; N66-R70 VanDerWaalsContact O-N 3.08Å
67	K	94.1	Very high	95.6	Very high	45 Å²	45	49.1 Å²	49.1	20%	0.196	26%	0.255	C	S	.	.	H	α-helix	trans	-69	-44.7	177	-178.7	70.2	178.3	-138.3	0	110.6	E28 Y64 K65 R70 I71	E28-K67 HydrophobicContact CB-CG 4.44Å; E28-K67 HydrophobicContact CG-CD 4.34Å; E28-K67 HydrophobicContact CG-CG 4.06Å; E28-K67 WeakPolarHBondContact OE2-CE 3.34Å; E28-K67 IonicContact OE2-NZ 2.71Å; E28-K67 PolarHBondContact OE2-NZ 2.97Å; Y64-K67 PolarHBondContact O-N 3.17Å; K65-K67 VanDerWaalsContact C-N 3.34Å; K65-K67 PolarHBondContact O-N 3.42Å; K67-R70 PolarHBondContact O-N 3.46Å; K67-I71 HydrophobicContact CD-CD1 4.23Å; K67-I71 HydrophobicContact CD-CG1 4.44Å; K67-I71 HydrophobicContact CG-CD1 3.83Å; K67-I71 HydrophobicContact CG-CG1 4.43Å; K67-I71 VanDerWaalsContact O-CG1 3.3Å; K67-I71 WeakPolarHBondContact O-CG1 3.22Å; K67-I71 PolarHBondContact O-N 3.36Å
68	I	96.6	Very high	95.4	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.2	-47.3	177.6	-65.8	168.6	0	0	0	110.4	L31 L57 D60 L61 Y64 K65 R70 I71 L72 F100	L31-I68 HydrophobicContact CD1-CD1 4.44Å; L31-I68 HydrophobicContact CD1-CG1 4.17Å; L57-I68 HydrophobicContact CB-CD1 4.5Å; L57-I68 HydrophobicContact CD2-CD1 4.18Å; L57-I68 HydrophobicContact CD2-CG1 4.25Å; L57-I68 HydrophobicContact CD2-CG2 4.39Å; D60-I68 HydrophobicContact CB-CD1 4.23Å; L61-I68 HydrophobicContact CD2-CD1 4.06Å; Y64-I68 WeakPolarHBondContact O-CG1 3.38Å; Y64-I68 PolarHBondContact O-N 3.4Å; K65-I68 PolarHBondContact O-N 3.4Å; I68-R70 VanDerWaalsContact C-N 3.32Å; I68-R70 PolarHBondContact O-N 3.47Å; I68-I71 PolarHBondContact O-N 3.3Å; I68-L72 HydrophobicContact CG2-CD1 3.85Å; I68-L72 HydrophobicContact CG2-CG 4.39Å; I68-L72 WeakPolarHBondContact O-CB 3.23Å; I68-L72 WeakPolarHBondContact O-CG 3.23Å; I68-L72 PolarHBondContact O-N 2.64Å; I68-F100 HydrophobicContact CG2-CE2 4.2Å; I68-F100 HydrophobicContact CG2-CZ 4.03Å
69	L	96.5	Very high	95.3	Very high	15 Å²	15	51.2 Å²	51.2	8%	0.079	27%	0.268	C	S	.	.	H	α-helix	trans	-54.9	-47.6	174.2	-75.8	175.5	0	0	0	111.6	K65 L72 C73 F100 E103 F104	K65-L69 HydrophobicContact CG-CD1 4.11Å; K65-L69 HydrophobicContact CG-CG 4.39Å; K65-L69 WeakPolarHBondContact O-CB 3.37Å; K65-L69 WeakPolarHBondContact O-CG 3.44Å; K65-L69 PolarHBondContact O-N 3.17Å; L69-L72 PolarHBondContact O-N 2.81Å; L69-C73 WeakPolarHBondContact O-CB 3.3Å; L69-C73 PolarHBondContact O-N 2.86Å; L69-C73 PolarHBondContact O-SG 3.2Å; L69-F100 HydrophobicContact CD2-CD2 4.13Å; L69-F100 HydrophobicContact CD2-CE2 3.52Å; L69-F100 HydrophobicContact CD2-CZ 3.87Å; L69-F100 HydrophobicContact CG-CD2 4.47Å; L69-F100 HydrophobicContact CG-CE2 3.82Å; L69-E103 HydrophobicContact CD1-CB 4.24Å; L69-F104 HydrophobicContact CD2-CB 3.63Å; L69-F104 HydrophobicContact CD2-CD2 3.9Å; L69-F104 HydrophobicContact CD2-CG 4.28Å
70	R	95.7	Very high	95.1	Very high	192 Å²	192	48.3 Å²	48.3	73%	0.725	24%	0.243	S	C	*	.	H	α-helix	trans	-62.9	-43.9	179.7	-174.7	178.7	177.5	-178.7	-0.1	112.3	N66 K67 I68 A74	N66-R70 WeakPolarHBondContact O-CB 3.5Å; N66-R70 PolarHBondContact O-N 2.91Å; N66-R70 VanDerWaalsContact O-N 3.08Å; K67-R70 PolarHBondContact O-N 3.46Å; I68-R70 VanDerWaalsContact C-N 3.32Å; I68-R70 PolarHBondContact O-N 3.47Å; R70-A74 WeakPolarHBondContact O-CB 3.42Å; R70-A74 PolarHBondContact O-N 3.11Å
71	I	96.5	Very high	94.9	Very high	10 Å²	10	48.3 Å²	48.3	5%	0.051	24%	0.242	C	C	.	.	H	α-helix	trans	-64.8	-45.8	178.4	-63.2	161.4	0	0	0	110.1	L31 E32 I35 K67 I68 C73 A74 V75	L31-I71 HydrophobicContact CB-CD1 4.34Å; E32-I71 HydrophobicContact CB-CD1 3.93Å; E32-I71 HydrophobicContact CB-CG1 4.44Å; E32-I71 HydrophobicContact CG-CG2 4.43Å; I35-I71 HydrophobicContact CB-CG2 4Å; I35-I71 HydrophobicContact CD1-CB 4.04Å; I35-I71 HydrophobicContact CD1-CD1 4.35Å; I35-I71 HydrophobicContact CD1-CG2 3.62Å; I35-I71 HydrophobicContact CG1-CG2 4.41Å; I35-I71 HydrophobicContact CG2-CG2 3.88Å; K67-I71 HydrophobicContact CD-CD1 4.23Å; K67-I71 HydrophobicContact CD-CG1 4.44Å; K67-I71 HydrophobicContact CG-CD1 3.83Å; K67-I71 HydrophobicContact CG-CG1 4.43Å; K67-I71 VanDerWaalsContact O-CG1 3.3Å; K67-I71 WeakPolarHBondContact O-CG1 3.22Å; K67-I71 PolarHBondContact O-N 3.36Å; I68-I71 PolarHBondContact O-N 3.3Å; I71-C73 PolarHBondContact O-N 2.82Å; I71-A74 WeakPolarHBondContact O-CB 3.26Å; I71-A74 PolarHBondContact O-N 3.29Å; I71-A74 VanDerWaalsContact O-N 3.11Å; I71-V75 HydrophobicContact CG2-CG1 4.48Å; I71-V75 PolarHBondContact O-N 3.14Å
72	L	97.6	Very high	94.9	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.7	-40.7	179.4	-69.7	172.7	0	0	0	112.3	I35 I68 L69 A74 V75 A76 L89 V90 L93 F100 F104	I35-L72 HydrophobicContact CD1-CD2 4.36Å; I35-L72 HydrophobicContact CG2-CD2 4.06Å; I68-L72 HydrophobicContact CG2-CD1 3.85Å; I68-L72 HydrophobicContact CG2-CG 4.39Å; I68-L72 WeakPolarHBondContact O-CB 3.23Å; I68-L72 WeakPolarHBondContact O-CG 3.23Å; I68-L72 PolarHBondContact O-N 2.64Å; L69-L72 PolarHBondContact O-N 2.81Å; L72-A74 VanDerWaalsContact C-N 3.31Å; L72-A74 PolarHBondContact O-N 3.23Å; L72-V75 VanDerWaalsContact O-CG2 3.3Å; L72-V75 WeakPolarHBondContact O-CG2 2.93Å; L72-A76 WeakPolarHBondContact O-CB 3.44Å; L72-A76 PolarHBondContact O-N 3.4Å; L72-L89 HydrophobicContact CD2-CD2 4.03Å; L72-V90 HydrophobicContact CD1-CG2 4.37Å; L72-L93 HydrophobicContact CD1-CD1 4.04Å; L72-F100 HydrophobicContact CD1-CE1 4.32Å; L72-F100 HydrophobicContact CD1-CZ 3.83Å; L72-F104 HydrophobicContact CB-CD2 4.17Å; L72-F104 HydrophobicContact CB-CE2 3.52Å; L72-F104 HydrophobicContact CB-CZ 4.36Å
73	C	96.8	Very high	95.1	Very high	6 Å²	6	44.5 Å²	44.5	4%	0.041	21%	0.214	C	C	.	.	H	α-helix	trans	-63.9	-37	172.6	-67	0	0	0	0	111.8	L69 I71 R77 M108	L69-C73 WeakPolarHBondContact O-CB 3.3Å; L69-C73 PolarHBondContact O-N 2.86Å; L69-C73 PolarHBondContact O-SG 3.2Å; I71-C73 PolarHBondContact O-N 2.82Å; C73-R77 PolarHBondContact O-N 3.48Å; C73-M108 HydrophobicContact CB-SD 4.27Å
74	A	96	Very high	95.3	Very high	32 Å²	32	38.9 Å²	38.9	26%	0.264	19%	0.185	S	C	.	.	H	α-helix	trans	-66.8	-47.1	177.6	0	0	0	0	0	111.8	R70 I71 L72 A76 R77 L78	R70-A74 WeakPolarHBondContact O-CB 3.42Å; R70-A74 PolarHBondContact O-N 3.11Å; I71-A74 WeakPolarHBondContact O-CB 3.26Å; I71-A74 PolarHBondContact O-N 3.29Å; I71-A74 VanDerWaalsContact O-N 3.11Å; L72-A74 VanDerWaalsContact C-N 3.31Å; L72-A74 PolarHBondContact O-N 3.23Å; A74-A76 VanDerWaalsContact C-N 3.32Å; A74-A76 PolarHBondContact O-N 3.34Å; A74-R77 PolarHBondContact O-N 3.44Å; A74-R77 VanDerWaalsContact O-N 3.12Å; A74-L78 VanDerWaalsContact O-CB 3.28Å; A74-L78 WeakPolarHBondContact O-CB 3.37Å; A74-L78 VanDerWaalsContact O-CG 3.31Å; A74-L78 WeakPolarHBondContact O-CG 3.1Å; A74-L78 PolarHBondContact O-N 2.91Å
75	V	96.3	Very high	95.5	Very high	7 Å²	7	37.9 Å²	37.9	4%	0.042	18%	0.182	C	C	.	.	H	α-helix	trans	-68.3	-31.2	178.3	-58.9	0	0	0	0	112.3	I35 I71 L72 R77 L78 L79 Y86	I35-V75 HydrophobicContact CG2-CG1 4.13Å; I35-V75 HydrophobicContact CG2-CG2 4.19Å; I71-V75 HydrophobicContact CG2-CG1 4.48Å; I71-V75 PolarHBondContact O-N 3.14Å; L72-V75 VanDerWaalsContact O-CG2 3.3Å; L72-V75 WeakPolarHBondContact O-CG2 2.93Å; V75-R77 PolarHBondContact O-N 3.34Å; V75-L78 PolarHBondContact O-N 3.28Å; V75-L79 HydrophobicContact CB-CD1 4.11Å; V75-L79 HydrophobicContact CG1-CD1 3.91Å; V75-L79 PolarHBondContact O-N 2.92Å; V75-Y86 HydrophobicContact CB-CD2 4.17Å; V75-Y86 HydrophobicContact CB-CE1 4.25Å; V75-Y86 HydrophobicContact CB-CE2 3.83Å; V75-Y86 HydrophobicContact CG2-CD1 3.77Å; V75-Y86 HydrophobicContact CG2-CD2 3.99Å; V75-Y86 HydrophobicContact CG2-CE1 3.85Å; V75-Y86 HydrophobicContact CG2-CE2 4.05Å; V75-Y86 HydrophobicContact CG2-CG 3.87Å
76	A	95.8	Very high	95.6	Very high	2 Å²	2	34.6 Å²	34.6	2%	0.017	17%	0.168	C	C	.	.	H	α-helix	trans	-61.2	-30.3	171.9	0	0	0	0	0	112.9	L72 A74 M108 L127 F130	L72-A76 WeakPolarHBondContact O-CB 3.44Å; L72-A76 PolarHBondContact O-N 3.4Å; A74-A76 VanDerWaalsContact C-N 3.32Å; A74-A76 PolarHBondContact O-N 3.34Å; A76-M108 HydrophobicContact CB-CE 3.78Å; A76-M108 HydrophobicContact CB-SD 3.93Å; A76-L127 HydrophobicContact CB-CD2 4.34Å; A76-F130 HydrophobicContact CB-CB 4.36Å; A76-F130 HydrophobicContact CB-CD1 4.25Å; A76-F130 HydrophobicContact CB-CD2 3.31Å; A76-F130 HydrophobicContact CB-CE1 4.41Å; A76-F130 HydrophobicContact CB-CE2 3.49Å; A76-F130 VanDerWaalsContact CB-CE2 3.49Å; A76-F130 HydrophobicContact CB-CG 3.73Å; A76-F130 HydrophobicContact CB-CZ 4.07Å
77	R	94.7	Very high	95.8	Very high	53 Å²	53	28.4 Å²	28.4	20%	0.2	14%	0.135	C	C	.	.	H	α-helix	trans	-90.9	-34.4	178.8	-168.5	173.9	57.6	80.8	3.9	113.3	C73 A74 V75 E123 Y126 L127	C73-R77 PolarHBondContact O-N 3.48Å; A74-R77 PolarHBondContact O-N 3.44Å; A74-R77 VanDerWaalsContact O-N 3.12Å; V75-R77 PolarHBondContact O-N 3.34Å; R77-E123 VanDerWaalsContact CD-OE2 3.26Å; R77-E123 WeakPolarHBondContact CD-OE2 3.3Å; R77-E123 HydrophobicContact CG-CB 3.81Å; R77-E123 HydrophobicContact CG-CG 4.38Å; R77-E123 IonicContact CZ-OE2 3.61Å; R77-E123 IonicContact NE-OE2 3.35Å; R77-E123 VanDerWaalsContact NH1-CD 3.29Å; R77-E123 IonicContact NH1-OE1 2.63Å; R77-E123 PolarHBondContact NH1-OE1 3.26Å; R77-E123 IonicContact NH1-OE2 2.79Å; R77-E123 PolarHBondContact NH1-OE2 3.31Å; R77-Y126 VanDerWaalsContact O-CD2 3.32Å; R77-Y126 WeakPolarHBondContact O-CD2 3.43Å; R77-L127 HydrophobicContact CB-CD2 3.98Å; R77-L127 HydrophobicContact CG-CD2 4.48Å
78	L	93.5	Very high	96	Very high	83 Å²	83	26.3 Å²	26.3	44%	0.435	13%	0.126	S	C	.	.	H	α-helix	trans	-105.1	-20.3	-167.1	-63.8	177.1	0	0	0	114.4	A74 V75 P80	A74-L78 VanDerWaalsContact O-CB 3.28Å; A74-L78 WeakPolarHBondContact O-CB 3.37Å; A74-L78 VanDerWaalsContact O-CG 3.31Å; A74-L78 WeakPolarHBondContact O-CG 3.1Å; A74-L78 PolarHBondContact O-N 2.91Å; V75-L78 PolarHBondContact O-N 3.28Å; L78-P80 WeakPolarHBondContact O-CD 3.32Å
79	L	93.6	Very high	96.1	Very high	30 Å²	30	26.3 Å²	26.3	16%	0.157	13%	0.126	C	C	.	.			trans	-125.4	55.6	-177.1	-58.7	177	0	0	0	111.9	V75 E81 K82 Y86 T324	V75-L79 HydrophobicContact CB-CD1 4.11Å; V75-L79 HydrophobicContact CG1-CD1 3.91Å; V75-L79 PolarHBondContact O-N 2.92Å; L79-E81 VanDerWaalsContact C-OE2 3.29Å; L79-E81 WeakPolarHBondContact CA-OE2 3.42Å; L79-E81 PolarHBondContact O-N 3.47Å; L79-K82 PolarHBondContact O-N 3.37Å; L79-Y86 HydrophobicContact CB-CE2 3.9Å; L79-Y86 HydrophobicContact CD1-CE2 4.06Å; L79-Y86 WeakPolarHBondContact CD1-OH 3.44Å; L79-T324 HydrophobicContact CD2-CG2 3.78Å
80	P	92.3	Very high	96.2	Very high	11 Å²	11	25.6 Å²	25.6	7%	0.071	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-62.6	-23.2	-177.8	29	-37.7	0	0	0	113.7	L78 K82 L83 Y126 C320	L78-P80 WeakPolarHBondContact O-CD 3.32Å; P80-K82 PolarHBondContact O-N 3.03Å; P80-L83 VanDerWaalsContact O-CB 3.23Å; P80-L83 WeakPolarHBondContact O-CB 3.4Å; P80-L83 PolarHBondContact O-N 2.91Å; P80-L83 VanDerWaalsContact O-N 3.1Å; P80-Y126 HydrophobicContact CB-CD1 3.57Å; P80-Y126 HydrophobicContact CB-CD2 4.18Å; P80-Y126 HydrophobicContact CB-CE1 4.01Å; P80-Y126 HydrophobicContact CB-CG 3.67Å; P80-Y126 HydrophobicContact CG-CD1 3.9Å; P80-Y126 HydrophobicContact CG-CD2 3.94Å; P80-Y126 HydrophobicContact CG-CE1 3.9Å; P80-Y126 HydrophobicContact CG-CE2 3.92Å; P80-Y126 HydrophobicContact CG-CG 3.93Å; P80-C320 HydrophobicContact CG-CB 3.86Å; P80-C320 VanDerWaalsContact CG-SG 3.52Å
81	E	90.6	Very high	96.4	Very high	38 Å²	38	16.4 Å²	16.4	18%	0.178	9%	0.087	C	C	.	.	G	3₁₀ helix	trans	-65.3	-16.4	174.6	71.2	-76.1	-178.3	0	0	113.2	L79 C320 I321	L79-E81 VanDerWaalsContact C-OE2 3.29Å; L79-E81 WeakPolarHBondContact CA-OE2 3.42Å; L79-E81 PolarHBondContact O-N 3.47Å; E81-C320 HydrophobicContact CB-CB 4.23Å; E81-I321 HydrophobicContact CB-CG1 3.97Å; E81-I321 HydrophobicContact CG-CG1 3.88Å
82	K	94.9	Very high	96.5	Very high	33 Å²	33	16 Å²	16	14%	0.143	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	-109.6	18.2	175.3	-67.3	173.8	69.7	-171.2	0	112.8	C36 V38 L79 P80 T84 V85 Y86	C36-K82 PolarHBondContact O-NZ 3.49Å; V38-K82 WeakPolarHBondContact O-CE 3.44Å; V38-K82 PolarHBondContact O-NZ 3.27Å; L79-K82 PolarHBondContact O-N 3.37Å; P80-K82 PolarHBondContact O-N 3.03Å; K82-T84 PolarHBondContact O-N 2.97Å; K82-V85 WeakPolarHBondContact O-CB 3.27Å; K82-V85 PolarHBondContact O-N 2.91Å; K82-Y86 HydrophobicContact CB-CD2 3.87Å; K82-Y86 HydrophobicContact CB-CE2 3.53Å; K82-Y86 HydrophobicContact CD-CE2 4.24Å; K82-Y86 PolarHBondContact NZ-OH 3.23Å; K82-Y86 WeakPolarHBondContact O-CD2 3.33Å; K82-Y86 PolarHBondContact O-N 2.87Å
83	L	97.1	Very high	96.5	Very high	9 Å²	9	16.1 Å²	16.1	5%	0.047	9%	0.086	C	C	.	.	H	α-helix	trans	-41.1	-59	-175.9	-179.4	65	0	0	0	113.6	P80 V85 Y86 T87 R129 F130 D133 W179	P80-L83 VanDerWaalsContact O-CB 3.23Å; P80-L83 WeakPolarHBondContact O-CB 3.4Å; P80-L83 PolarHBondContact O-N 2.91Å; P80-L83 VanDerWaalsContact O-N 3.1Å; L83-V85 VanDerWaalsContact C-N 3.26Å; L83-V85 PolarHBondContact O-N 3.26Å; L83-Y86 PolarHBondContact O-N 3.42Å; L83-Y86 VanDerWaalsContact O-N 3.12Å; L83-T87 HydrophobicContact CD1-CG2 4.28Å; L83-T87 PolarHBondContact O-N 3.34Å; L83-T87 PolarHBondContact O-OG1 3.46Å; L83-R129 HydrophobicContact CD2-CB 4.1Å; L83-F130 HydrophobicContact CD1-CB 3.81Å; L83-F130 HydrophobicContact CD1-CD2 3.55Å; L83-F130 HydrophobicContact CD1-CE2 4.46Å; L83-F130 HydrophobicContact CD1-CG 3.99Å; L83-D133 HydrophobicContact CD2-CB 4.5Å; L83-W179 HydrophobicContact CD2-CD2 4.33Å; L83-W179 HydrophobicContact CD2-CG 4.25Å
84	T	98.1	Very high	96.5	Very high	16 Å²	16	16 Å²	16	10%	0.098	8%	0.084	C	C	.	.	H	α-helix	trans	-71.7	-20	-171.8	60.6	0	0	0	0	113.4	K82 T87 T88 I249 L250 Y253	K82-T84 PolarHBondContact O-N 2.97Å; T84-T87 VanDerWaalsContact CA-OG1 3.3Å; T84-T87 WeakPolarHBondContact CA-OG1 3.4Å; T84-T87 PolarHBondContact O-OG1 3.3Å; T84-T88 WeakPolarHBondContact O-CB 3.28Å; T84-T88 PolarHBondContact O-N 3.24Å; T84-T88 PolarHBondContact O-OG1 2.89Å; T84-I249 HydrophobicContact CG2-CG2 3.97Å; T84-L250 WeakPolarHBondContact CB-O 3.21Å; T84-L250 WeakPolarHBondContact CG2-O 3.32Å; T84-L250 PolarHBondContact OG1-O 3.06Å; T84-Y253 HydrophobicContact CG2-CE1 4.43Å
85	V	98.1	Very high	96.6	Very high	14 Å²	14	16.3 Å²	16.3	9%	0.085	9%	0.087	C	C	.	.	H	α-helix	trans	-69.2	-47	171.3	-179.7	0	0	0	0	109.4	V38 L46 L50 K82 L83 T88 L89	V38-V85 HydrophobicContact CG1-CG1 4Å; V38-V85 HydrophobicContact CG2-CG1 4.43Å; L46-V85 HydrophobicContact CD1-CG1 4.24Å; L46-V85 HydrophobicContact CD2-CG2 4.31Å; L50-V85 HydrophobicContact CD2-CG1 3.95Å; L50-V85 WeakPolarHBondContact CD2-O 3.46Å; K82-V85 WeakPolarHBondContact O-CB 3.27Å; K82-V85 PolarHBondContact O-N 2.91Å; L83-V85 VanDerWaalsContact C-N 3.26Å; L83-V85 PolarHBondContact O-N 3.26Å; V85-T88 PolarHBondContact O-N 3.39Å; V85-L89 PolarHBondContact O-N 3.46Å
86	Y	98.6	Very high	96.6	Very high	1 Å²	1	20.4 Å²	20.4	0%	0.004	10%	0.102	C	C	.	.	H	α-helix	trans	-74.4	-37.5	-177.4	-68.4	-53.4	0	0	0	113.1	I35 V38 V75 L79 K82 L83 T88 L89 V90	I35-Y86 HydrophobicContact CG2-CD1 4.47Å; I35-Y86 HydrophobicContact CG2-CE1 3.87Å; I35-Y86 VanDerWaalsContact O-CE1 3.26Å; I35-Y86 WeakPolarHBondContact O-CE1 3.31Å; I35-Y86 PolarHBondContact O-OH 3.46Å; V38-Y86 HydrophobicContact CG1-CD1 4.41Å; V38-Y86 HydrophobicContact CG1-CE1 3.8Å; V75-Y86 HydrophobicContact CB-CD2 4.17Å; V75-Y86 HydrophobicContact CB-CE1 4.25Å; V75-Y86 HydrophobicContact CB-CE2 3.83Å; V75-Y86 HydrophobicContact CG2-CD1 3.77Å; V75-Y86 HydrophobicContact CG2-CD2 3.99Å; V75-Y86 HydrophobicContact CG2-CE1 3.85Å; V75-Y86 HydrophobicContact CG2-CE2 4.05Å; V75-Y86 HydrophobicContact CG2-CG 3.87Å; L79-Y86 HydrophobicContact CB-CE2 3.9Å; L79-Y86 HydrophobicContact CD1-CE2 4.06Å; L79-Y86 WeakPolarHBondContact CD1-OH 3.44Å; K82-Y86 HydrophobicContact CB-CD2 3.87Å; K82-Y86 HydrophobicContact CB-CE2 3.53Å; K82-Y86 HydrophobicContact CD-CE2 4.24Å; K82-Y86 PolarHBondContact NZ-OH 3.23Å; K82-Y86 WeakPolarHBondContact O-CD2 3.33Å; K82-Y86 PolarHBondContact O-N 2.87Å; L83-Y86 PolarHBondContact O-N 3.42Å; L83-Y86 VanDerWaalsContact O-N 3.12Å; Y86-T88 VanDerWaalsContact C-N 3.31Å; Y86-T88 PolarHBondContact O-N 3.4Å; Y86-L89 PolarHBondContact O-N 2.86Å; Y86-V90 WeakPolarHBondContact O-CG2 3.33Å; Y86-V90 PolarHBondContact O-N 3.21Å
87	T	98.7	Very high	96.7	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64.5	-37.3	173.2	55.4	0	0	0	0	111.5	L83 T84 V90 G91 F130 D133 L134 C137	L83-T87 HydrophobicContact CD1-CG2 4.28Å; L83-T87 PolarHBondContact O-N 3.34Å; L83-T87 PolarHBondContact O-OG1 3.46Å; T84-T87 VanDerWaalsContact CA-OG1 3.3Å; T84-T87 WeakPolarHBondContact CA-OG1 3.4Å; T84-T87 PolarHBondContact O-OG1 3.3Å; T87-V90 PolarHBondContact O-N 3.48Å; T87-G91 PolarHBondContact O-N 3.41Å; T87-F130 HydrophobicContact CG2-CD1 3.88Å; T87-F130 HydrophobicContact CG2-CD2 4.01Å; T87-F130 HydrophobicContact CG2-CE1 3.82Å; T87-F130 HydrophobicContact CG2-CE2 3.97Å; T87-F130 HydrophobicContact CG2-CG 3.97Å; T87-F130 HydrophobicContact CG2-CZ 3.86Å; T87-D133 WeakPolarHBondContact CB-OD2 3.23Å; T87-D133 HydrophobicContact CG2-CB 4.08Å; T87-D133 PolarHBondContact OG1-OD2 3.18Å; T87-L134 HydrophobicContact CG2-CD2 4.13Å; T87-L134 HydrophobicContact CG2-CG 4.12Å; T87-C137 PolarHBondContact O-SG 3.44Å; T87-C137 VanDerWaalsContact O-SG 3.33Å
88	T	98.8	Very high	96.9	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.8	-45.5	173.4	-55.5	0	0	0	0	111.1	L50 T84 V85 Y86 V90 G91 L92 P252 Y253 F256	L50-T88 HydrophobicContact CD1-CG2 3.89Å; T84-T88 WeakPolarHBondContact O-CB 3.28Å; T84-T88 PolarHBondContact O-N 3.24Å; T84-T88 PolarHBondContact O-OG1 2.89Å; V85-T88 PolarHBondContact O-N 3.39Å; Y86-T88 VanDerWaalsContact C-N 3.31Å; Y86-T88 PolarHBondContact O-N 3.4Å; T88-V90 VanDerWaalsContact C-N 3.33Å; T88-V90 PolarHBondContact O-N 2.68Å; T88-G91 WeakPolarHBondContact O-CA 3.47Å; T88-G91 PolarHBondContact O-N 3.17Å; T88-G91 VanDerWaalsContact O-N 3.12Å; T88-L92 HydrophobicContact CG2-CD1 4.5Å; T88-L92 WeakPolarHBondContact O-CG 3.2Å; T88-L92 PolarHBondContact O-N 3.24Å; T88-P252 HydrophobicContact CG2-CB 4.21Å; T88-Y253 WeakPolarHBondContact OG1-CD1 3.27Å; T88-Y253 PolarHBondContact OG1-N 3.39Å; T88-F256 HydrophobicContact CG2-CD2 3.86Å; T88-F256 HydrophobicContact CG2-CE2 4.04Å
89	L	98.6	Very high	97.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-58.3	-44.3	176.9	-179.9	61.8	0	0	0	112	L50 L53 A54 L57 L72 V85 Y86 G91 L92 L93	L50-L89 HydrophobicContact CD2-CB 3.87Å; L50-L89 HydrophobicContact CD2-CD1 4.42Å; L53-L89 HydrophobicContact CB-CD1 4.2Å; L53-L89 HydrophobicContact CD2-CD1 4.14Å; L53-L89 HydrophobicContact CD2-CD2 3.69Å; L53-L89 HydrophobicContact CG-CD1 4.01Å; L53-L89 HydrophobicContact CG-CD2 4.28Å; A54-L89 HydrophobicContact CB-CD1 4.13Å; L57-L89 HydrophobicContact CD1-CD1 4.35Å; L57-L89 HydrophobicContact CD1-CD2 4.09Å; L57-L89 HydrophobicContact CD1-CG 4.45Å; L72-L89 HydrophobicContact CD2-CD2 4.03Å; V85-L89 PolarHBondContact O-N 3.46Å; Y86-L89 PolarHBondContact O-N 2.86Å; L89-G91 VanDerWaalsContact C-N 3.34Å; L89-L92 PolarHBondContact O-N 3.21Å; L89-L93 HydrophobicContact CG-CD1 4.41Å; L89-L93 WeakPolarHBondContact O-CG 3.2Å; L89-L93 PolarHBondContact O-N 3.49Å
90	V	98.6	Very high	97.3	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-65.1	-38.5	175.8	172.8	0	0	0	0	111.2	L72 Y86 T87 T88 L93 N94 F104 F130 L134 V139	L72-V90 HydrophobicContact CD1-CG2 4.37Å; Y86-V90 WeakPolarHBondContact O-CG2 3.33Å; Y86-V90 PolarHBondContact O-N 3.21Å; T87-V90 PolarHBondContact O-N 3.48Å; T88-V90 VanDerWaalsContact C-N 3.33Å; T88-V90 PolarHBondContact O-N 2.68Å; V90-L93 PolarHBondContact O-N 3.3Å; V90-N94 WeakPolarHBondContact O-CB 3.33Å; V90-N94 PolarHBondContact O-N 2.97Å; V90-F104 HydrophobicContact CB-CE1 4.41Å; V90-F104 HydrophobicContact CG1-CD1 3.59Å; V90-F104 HydrophobicContact CG1-CE1 3.71Å; V90-F104 HydrophobicContact CG1-CG 4.33Å; V90-F104 HydrophobicContact CG2-CD1 4.36Å; V90-F104 HydrophobicContact CG2-CE1 3.89Å; V90-F104 HydrophobicContact CG2-CE2 4.39Å; V90-F104 HydrophobicContact CG2-CZ 3.9Å; V90-F130 HydrophobicContact CG2-CE1 4.23Å; V90-F130 HydrophobicContact CG2-CZ 4.09Å; V90-L134 HydrophobicContact CB-CD2 3.9Å; V90-L134 HydrophobicContact CG1-CD2 3.68Å; V90-V139 HydrophobicContact CG1-CG1 4.49Å; V90-V139 HydrophobicContact CG1-CG2 4.46Å
91	G	98.5	Very high	97.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-56.4	-48.7	173.1	0	0	0	0	0	112.9	T87 T88 L89 L93 N94 A95 V139 L260	T87-G91 PolarHBondContact O-N 3.41Å; T88-G91 WeakPolarHBondContact O-CA 3.47Å; T88-G91 PolarHBondContact O-N 3.17Å; T88-G91 VanDerWaalsContact O-N 3.12Å; L89-G91 VanDerWaalsContact C-N 3.34Å; G91-L93 VanDerWaalsContact C-N 3.34Å; G91-L93 PolarHBondContact O-N 3.28Å; G91-N94 PolarHBondContact O-N 3.24Å; G91-A95 PolarHBondContact O-N 3.39Å; G91-V139 VanDerWaalsContact CA-CG2 3.5Å; G91-L260 VanDerWaalsContact C-CD2 3.44Å
92	L	98.4	Very high	97.9	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-63.6	-39.2	177.1	-64.3	174.3	0	0	0	112.1	L50 A54 T88 L89 A95 R96 F256 V259 L260	L50-L92 HydrophobicContact CB-CD1 4.09Å; A54-L92 HydrophobicContact CB-CB 3.8Å; A54-L92 HydrophobicContact CB-CD1 4.35Å; T88-L92 HydrophobicContact CG2-CD1 4.5Å; T88-L92 WeakPolarHBondContact O-CG 3.2Å; T88-L92 PolarHBondContact O-N 3.24Å; L89-L92 PolarHBondContact O-N 3.21Å; L92-A95 PolarHBondContact O-N 3.21Å; L92-R96 WeakPolarHBondContact O-CD 3.43Å; L92-R96 WeakPolarHBondContact O-CG 3.25Å; L92-R96 PolarHBondContact O-N 3.27Å; L92-F256 HydrophobicContact CD1-CD1 4.34Å; L92-F256 HydrophobicContact CD1-CE1 4.06Å; L92-F256 HydrophobicContact CD1-CE2 4.46Å; L92-F256 HydrophobicContact CD1-CZ 4.1Å; L92-F256 HydrophobicContact CD2-CB 4.12Å; L92-F256 HydrophobicContact CD2-CD1 3.67Å; L92-F256 HydrophobicContact CD2-CE1 4.17Å; L92-F256 HydrophobicContact CD2-CG 3.92Å; L92-V259 HydrophobicContact CD2-CG1 4.28Å; L92-L260 HydrophobicContact CD2-CD2 4.26Å
93	L	98	Very high	98	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-66.9	-38.2	175.2	-73.9	170.7	0	0	0	112.6	A54 L57 L72 L89 V90 G91 R96 N97 F100	A54-L93 HydrophobicContact CB-CD2 4.45Å; A54-L93 WeakPolarHBondContact O-CD2 3.36Å; L57-L93 HydrophobicContact CB-CD1 4.4Å; L57-L93 HydrophobicContact CB-CD2 3.91Å; L57-L93 HydrophobicContact CD1-CD1 3.93Å; L72-L93 HydrophobicContact CD1-CD1 4.04Å; L89-L93 HydrophobicContact CG-CD1 4.41Å; L89-L93 WeakPolarHBondContact O-CG 3.2Å; L89-L93 PolarHBondContact O-N 3.49Å; V90-L93 PolarHBondContact O-N 3.3Å; G91-L93 VanDerWaalsContact C-N 3.34Å; G91-L93 PolarHBondContact O-N 3.28Å; L93-R96 PolarHBondContact O-N 3.26Å; L93-N97 PolarHBondContact O-N 3.34Å; L93-F100 HydrophobicContact CB-CD1 3.91Å; L93-F100 HydrophobicContact CB-CE1 3.8Å; L93-F100 HydrophobicContact CD1-CE1 3.74Å; L93-F100 HydrophobicContact CD1-CZ 4.19Å; L93-F100 HydrophobicContact CG-CE1 4.33Å
94	N	98.3	Very high	98.1	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.016	12%	0.124	C	C	.	.	H	α-helix	trans	-64.6	-42.5	174.9	179.1	59.6	0	0	0	111.6	V90 G91 R96 N97 Y98 V139 L264 H266	V90-N94 WeakPolarHBondContact O-CB 3.33Å; V90-N94 PolarHBondContact O-N 2.97Å; G91-N94 PolarHBondContact O-N 3.24Å; N94-R96 PolarHBondContact O-N 2.84Å; N94-N97 CarbonylContact O-C 3.6Å; N94-N97 VanDerWaalsContact O-C 3.22Å; N94-N97 PolarHBondContact O-N 3.12Å; N94-Y98 PolarHBondContact O-N 3.38Å; N94-V139 HydrophobicContact CB-CG1 4.36Å; N94-V139 HydrophobicContact CB-CG2 3.96Å; N94-L264 PolarHBondContact ND2-O 3.36Å; N94-H266 PolarHBondContact OD1-CD2 3.13Å; N94-H266 PolarHBondContact OD1-NE2 3.21Å
95	A	97.5	Very high	98.1	Very high	39 Å²	39	23.8 Å²	23.8	32%	0.322	12%	0.121	S	C	.	.	H	α-helix	trans	-60.7	-35.9	176.9	0	0	0	0	0	112.2	G91 L92 V259 A263	G91-A95 PolarHBondContact O-N 3.39Å; L92-A95 PolarHBondContact O-N 3.21Å; A95-V259 HydrophobicContact CB-CG1 3.9Å; A95-A263 HydrophobicContact CB-CB 3.92Å
96	R	96.9	Very high	98.1	Very high	94 Å²	94	27.8 Å²	27.8	36%	0.355	14%	0.138	S	C	.	.	H	α-helix	trans	-78.2	-38.8	176.3	-70.3	163	176	-88.4	-2	112.8	E51 E58 L92 L93 N94	E51-R96 IonicContact OE1-CZ 3.83Å; E51-R96 IonicContact OE1-NH2 2.77Å; E51-R96 PolarHBondContact OE1-NH2 2.96Å; E58-R96 HydrophobicContact CG-CB 4.47Å; E58-R96 VanDerWaalsContact OE2-CD 3.3Å; E58-R96 WeakPolarHBondContact OE2-CD 2.94Å; E58-R96 IonicContact OE2-CZ 3.74Å; E58-R96 IonicContact OE2-NE 3.73Å; E58-R96 IonicContact OE2-NH1 3.69Å; E58-R96 PolarHBondContact OE2-NH1 3.41Å; L92-R96 WeakPolarHBondContact O-CD 3.43Å; L92-R96 WeakPolarHBondContact O-CG 3.25Å; L92-R96 PolarHBondContact O-N 3.27Å; L93-R96 PolarHBondContact O-N 3.26Å; N94-R96 PolarHBondContact O-N 2.84Å
97	N	97.6	Very high	98	Very high	55 Å²	55	28.5 Å²	28.5	29%	0.294	14%	0.144	S	C	.	.			trans	-143.9	96.1	-177.2	-170	-36.2	0	0	0	111.4	L61 L93 N94 N99 F100 G101	L61-N97 HydrophobicContact CD1-CB 4.26Å; L93-N97 PolarHBondContact O-N 3.34Å; N94-N97 CarbonylContact O-C 3.6Å; N94-N97 VanDerWaalsContact O-C 3.22Å; N94-N97 PolarHBondContact O-N 3.12Å; N97-N99 VanDerWaalsContact C-N 3.31Å; N97-N99 PolarHBondContact O-N 2.81Å; N97-N99 PolarHBondContact OD1-N 3.01Å; N97-F100 HydrophobicContact CB-CB 4.01Å; N97-F100 WeakPolarHBondContact O-CB 3.36Å; N97-F100 PolarHBondContact O-N 3.05Å; N97-F100 PolarHBondContact OD1-N 3Å; N97-G101 PolarHBondContact O-N 2.76Å
98	Y	97.6	Very high	98	Very high	98 Å²	98	28.5 Å²	28.5	38%	0.384	14%	0.144	S	C	.	.	H	α-helix	trans	-57.6	-40.4	-179.9	178.2	-100.9	0	0	0	113.2	N94 F100 G101 G102 L264 H266	N94-Y98 PolarHBondContact O-N 3.38Å; Y98-F100 VanDerWaalsContact C-N 3.32Å; Y98-F100 PolarHBondContact O-N 2.7Å; Y98-G101 PolarHBondContact O-N 2.85Å; Y98-G101 VanDerWaalsContact O-N 3.15Å; Y98-G102 PolarHBondContact O-N 3.08Å; Y98-G102 VanDerWaalsContact O-N 3.07Å; Y98-L264 HydrophobicContact CD2-CB 3.49Å; Y98-L264 VanDerWaalsContact CD2-CB 3.49Å; Y98-L264 HydrophobicContact CD2-CD1 4.39Å; Y98-L264 HydrophobicContact CE2-CB 3.39Å; Y98-L264 HydrophobicContact CE2-CD1 4.47Å; Y98-L264 HydrophobicContact CG-CB 4.48Å; Y98-H266 AromaticContact CD1-CE1 3.85Å; Y98-H266 AromaticContact CD2-CE1 3.43Å; Y98-H266 VanDerWaalsContact CD2-CE1 3.43Å; Y98-H266 WeakPolarHBondContact CD2-CE1 3.48Å; Y98-H266 AromaticContact CD2-NE2 3.32Å; Y98-H266 VanDerWaalsContact CD2-NE2 3.32Å; Y98-H266 WeakPolarHBondContact CD2-NE2 3.48Å; Y98-H266 AromaticContact CE1-CE1 3.55Å; Y98-H266 AromaticContact CE2-CD2 3.9Å; Y98-H266 AromaticContact CE2-CE1 3.12Å; Y98-H266 WeakPolarHBondContact CE2-CE1 3.44Å; Y98-H266 AromaticContact CE2-ND1 3.7Å; Y98-H266 AromaticContact CE2-NE2 3.27Å; Y98-H266 VanDerWaalsContact CE2-NE2 3.27Å; Y98-H266 WeakPolarHBondContact CE2-NE2 3.44Å; Y98-H266 AromaticContact CG-CE1 3.81Å; Y98-H266 AromaticContact CG-NE2 3.99Å; Y98-H266 AromaticContact CZ-CE1 3.19Å; Y98-H266 AromaticContact CZ-ND1 3.52Å; Y98-H266 AromaticContact CZ-NE2 3.85Å; Y98-H266 PolarHBondContact O-CE1 3.27Å; Y98-H266 PolarHBondContact O-NE2 2.9Å; Y98-H266 VanDerWaalsContact O-NE2 3.15Å
99	N	97.3	Very high	98	Very high	114 Å²	114	28.8 Å²	28.8	61%	0.61	15%	0.146	S	C	*	.	H	α-helix	trans	-63.7	-39.7	-179.4	-67.6	-26.9	0	0	0	111.5	N97 G101 G102 E103	N97-N99 VanDerWaalsContact C-N 3.31Å; N97-N99 PolarHBondContact O-N 2.81Å; N97-N99 PolarHBondContact OD1-N 3.01Å; N99-G101 VanDerWaalsContact C-N 3.34Å; N99-G102 PolarHBondContact O-N 3.01Å; N99-E103 WeakPolarHBondContact O-CG 3.46Å; N99-E103 PolarHBondContact O-N 2.94Å
100	F	97.8	Very high	97.9	Very high	1 Å²	1	34.8 Å²	34.8	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-43.5	174	173.9	-94.6	0	0	0	111.8	L61 K65 I68 L69 L72 L93 N97 Y98 G102 E103 F104	L61-F100 HydrophobicContact CD1-CB 4.22Å; L61-F100 HydrophobicContact CD1-CD2 4.22Å; L61-F100 HydrophobicContact CD1-CG 4.21Å; L61-F100 HydrophobicContact CD2-CD2 3.46Å; L61-F100 VanDerWaalsContact CD2-CD2 3.46Å; L61-F100 HydrophobicContact CD2-CE2 3.53Å; L61-F100 HydrophobicContact CD2-CG 4.2Å; L61-F100 HydrophobicContact CD2-CZ 4.35Å; K65-F100 HydrophobicContact CD-CD2 4.45Å; K65-F100 HydrophobicContact CG-CD2 4.12Å; K65-F100 HydrophobicContact CG-CE2 4.42Å; I68-F100 HydrophobicContact CG2-CE2 4.2Å; I68-F100 HydrophobicContact CG2-CZ 4.03Å; L69-F100 HydrophobicContact CD2-CD2 4.13Å; L69-F100 HydrophobicContact CD2-CE2 3.52Å; L69-F100 HydrophobicContact CD2-CZ 3.87Å; L69-F100 HydrophobicContact CG-CD2 4.47Å; L69-F100 HydrophobicContact CG-CE2 3.82Å; L72-F100 HydrophobicContact CD1-CE1 4.32Å; L72-F100 HydrophobicContact CD1-CZ 3.83Å; L93-F100 HydrophobicContact CB-CD1 3.91Å; L93-F100 HydrophobicContact CB-CE1 3.8Å; L93-F100 HydrophobicContact CD1-CE1 3.74Å; L93-F100 HydrophobicContact CD1-CZ 4.19Å; L93-F100 HydrophobicContact CG-CE1 4.33Å; N97-F100 HydrophobicContact CB-CB 4.01Å; N97-F100 WeakPolarHBondContact O-CB 3.36Å; N97-F100 PolarHBondContact O-N 3.05Å; N97-F100 PolarHBondContact OD1-N 3Å; Y98-F100 VanDerWaalsContact C-N 3.32Å; Y98-F100 PolarHBondContact O-N 2.7Å; F100-G102 VanDerWaalsContact C-N 3.3Å; F100-G102 PolarHBondContact O-N 3.38Å; F100-E103 PolarHBondContact O-N 3.14Å; F100-F104 WeakPolarHBondContact O-CB 3.15Å; F100-F104 PolarHBondContact O-N 3.46Å
101	G	97.9	Very high	97.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-56.7	-43.5	175.5	0	0	0	0	0	112.5	N97 Y98 N99 F104 V105	N97-G101 PolarHBondContact O-N 2.76Å; Y98-G101 PolarHBondContact O-N 2.85Å; Y98-G101 VanDerWaalsContact O-N 3.15Å; N99-G101 VanDerWaalsContact C-N 3.34Å; G101-F104 PolarHBondContact O-N 3.36Å; G101-V105 WeakPolarHBondContact O-CG2 3.43Å; G101-V105 PolarHBondContact O-N 2.88Å
102	G	97.9	Very high	97.8	Very high	14 Å²	14	37.2 Å²	37.2	14%	0.144	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-49.1	176.5	0	0	0	0	0	112.7	Y98 N99 F100 F104 V105 E106 H266	Y98-G102 PolarHBondContact O-N 3.08Å; Y98-G102 VanDerWaalsContact O-N 3.07Å; N99-G102 PolarHBondContact O-N 3.01Å; F100-G102 VanDerWaalsContact C-N 3.3Å; F100-G102 PolarHBondContact O-N 3.38Å; G102-F104 VanDerWaalsContact C-N 3.26Å; G102-F104 PolarHBondContact O-N 2.9Å; G102-V105 PolarHBondContact O-N 3.33Å; G102-E106 WeakPolarHBondContact O-CG 2.87Å; G102-E106 PolarHBondContact O-N 2.98Å; G102-H266 WeakPolarHBondContact CA-CE1 3.35Å; G102-H266 WeakPolarHBondContact CA-ND1 3.08Å; G102-H266 PolarHBondContact N-CE1 3.37Å; G102-H266 PolarHBondContact N-NE2 3.44Å
103	E	98	Very high	97.7	Very high	60 Å²	60	41.8 Å²	41.8	28%	0.28	20%	0.2	S	C	.	.	H	α-helix	trans	-60.6	-35.5	176.8	-72	-179.8	-142.5	0	0	112.4	K65 L69 N99 F100 A107	K65-E103 VanDerWaalsContact CD-OE2 3.32Å; K65-E103 WeakPolarHBondContact CD-OE2 3.5Å; K65-E103 WeakPolarHBondContact CE-OE2 3.46Å; K65-E103 IonicContact NZ-OE1 2.82Å; K65-E103 PolarHBondContact NZ-OE1 3.36Å; K65-E103 IonicContact NZ-OE2 2.71Å; K65-E103 PolarHBondContact NZ-OE2 2.73Å; L69-E103 HydrophobicContact CD1-CB 4.24Å; N99-E103 WeakPolarHBondContact O-CG 3.46Å; N99-E103 PolarHBondContact O-N 2.94Å; F100-E103 PolarHBondContact O-N 3.14Å; E103-A107 VanDerWaalsContact O-CB 3.32Å; E103-A107 WeakPolarHBondContact O-CB 3.36Å; E103-A107 PolarHBondContact O-N 3.43Å
104	F	98.4	Very high	97.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-66.7	-47.1	175.2	178.5	-97.5	0	0	0	112.2	L69 L72 V90 F100 G101 G102 E106 A107 M108 F130 L134	L69-F104 HydrophobicContact CD2-CB 3.63Å; L69-F104 HydrophobicContact CD2-CD2 3.9Å; L69-F104 HydrophobicContact CD2-CG 4.28Å; L72-F104 HydrophobicContact CB-CD2 4.17Å; L72-F104 HydrophobicContact CB-CE2 3.52Å; L72-F104 HydrophobicContact CB-CZ 4.36Å; V90-F104 HydrophobicContact CB-CE1 4.41Å; V90-F104 HydrophobicContact CG1-CD1 3.59Å; V90-F104 HydrophobicContact CG1-CE1 3.71Å; V90-F104 HydrophobicContact CG1-CG 4.33Å; V90-F104 HydrophobicContact CG2-CD1 4.36Å; V90-F104 HydrophobicContact CG2-CE1 3.89Å; V90-F104 HydrophobicContact CG2-CE2 4.39Å; V90-F104 HydrophobicContact CG2-CZ 3.9Å; F100-F104 WeakPolarHBondContact O-CB 3.15Å; F100-F104 PolarHBondContact O-N 3.46Å; G101-F104 PolarHBondContact O-N 3.36Å; G102-F104 VanDerWaalsContact C-N 3.26Å; G102-F104 PolarHBondContact O-N 2.9Å; F104-E106 VanDerWaalsContact C-N 3.32Å; F104-E106 PolarHBondContact O-N 3.27Å; F104-A107 PolarHBondContact O-N 3.41Å; F104-M108 HydrophobicContact CD1-CG 4.17Å; F104-M108 HydrophobicContact CE1-CG 3.61Å; F104-M108 HydrophobicContact CE1-SD 4.38Å; F104-M108 HydrophobicContact CE2-CG 4.05Å; F104-M108 HydrophobicContact CE2-SD 4.28Å; F104-M108 HydrophobicContact CZ-CG 3.56Å; F104-M108 HydrophobicContact CZ-SD 3.8Å; F104-M108 WeakPolarHBondContact O-CG 3.45Å; F104-M108 PolarHBondContact O-N 3.5Å; F104-F130 HydrophobicContact CE1-CD1 4.39Å; F104-F130 AromaticContact CE1-CE1 3.73Å; F104-F130 HydrophobicContact CE1-CE1 3.73Å; F104-F130 HydrophobicContact CZ-CD1 4.45Å; F104-F130 AromaticContact CZ-CE1 3.7Å; F104-F130 HydrophobicContact CZ-CE1 3.7Å; F104-F130 HydrophobicContact CZ-CZ 4.19Å; F104-L134 HydrophobicContact CE1-CD1 4.01Å
105	V	98.4	Very high	97.5	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.018	22%	0.222	C	C	.	.	H	α-helix	trans	-60.2	-43	176.9	170	0	0	0	0	110.9	G101 G102 M108 I109 V139 I140 L268	G101-V105 WeakPolarHBondContact O-CG2 3.43Å; G101-V105 PolarHBondContact O-N 2.88Å; G102-V105 PolarHBondContact O-N 3.33Å; V105-M108 PolarHBondContact O-N 2.99Å; V105-I109 WeakPolarHBondContact O-CG1 3.36Å; V105-I109 PolarHBondContact O-N 3.16Å; V105-I109 VanDerWaalsContact O-N 3.08Å; V105-V139 HydrophobicContact CG2-CG1 4.07Å; V105-I140 HydrophobicContact CG1-CD1 4.48Å; V105-I140 HydrophobicContact CG2-CD1 4.19Å; V105-I140 HydrophobicContact CG2-CG1 3.97Å; V105-L268 HydrophobicContact CG1-CD2 3.49Å; V105-L268 VanDerWaalsContact CG1-CD2 3.49Å
106	E	97.8	Very high	97.4	Very high	98 Å²	98	44.9 Å²	44.9	46%	0.458	21%	0.208	S	C	.	.	H	α-helix	trans	-62.9	-42	174.6	-70.7	-175.9	-177.4	0	0	112.8	G102 F104 M108 I109 R110	G102-E106 WeakPolarHBondContact O-CG 2.87Å; G102-E106 PolarHBondContact O-N 2.98Å; F104-E106 VanDerWaalsContact C-N 3.32Å; F104-E106 PolarHBondContact O-N 3.27Å; E106-M108 VanDerWaalsContact C-N 3.32Å; E106-M108 PolarHBondContact O-N 2.94Å; E106-I109 PolarHBondContact O-N 2.75Å; E106-R110 WeakPolarHBondContact O-CG 3.32Å; E106-R110 PolarHBondContact O-N 3.23Å; E106-R110 IonicContact OE2-NH1 3.9Å; E106-R110 PolarHBondContact OE2-NH1 3.12Å
107	A	97.7	Very high	97.3	Very high	16 Å²	16	48.5 Å²	48.5	13%	0.132	23%	0.226	C	C	.	.	H	α-helix	trans	-62.2	-40.6	176.9	0	0	0	0	0	111.6	E103 F104 R110 Q111	E103-A107 VanDerWaalsContact O-CB 3.32Å; E103-A107 WeakPolarHBondContact O-CB 3.36Å; E103-A107 PolarHBondContact O-N 3.43Å; F104-A107 PolarHBondContact O-N 3.41Å; A107-R110 PolarHBondContact O-N 2.92Å; A107-Q111 WeakPolarHBondContact O-CB 3.31Å; A107-Q111 PolarHBondContact O-N 2.66Å
108	M	98.3	Very high	97.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.1	-40.4	175.6	-75	-67.9	-67.4	0	0	112.5	C73 A76 F104 V105 E106 Q111 L112 L127 F130 L131	C73-M108 HydrophobicContact CB-SD 4.27Å; A76-M108 HydrophobicContact CB-CE 3.78Å; A76-M108 HydrophobicContact CB-SD 3.93Å; F104-M108 HydrophobicContact CD1-CG 4.17Å; F104-M108 HydrophobicContact CE1-CG 3.61Å; F104-M108 HydrophobicContact CE1-SD 4.38Å; F104-M108 HydrophobicContact CE2-CG 4.05Å; F104-M108 HydrophobicContact CE2-SD 4.28Å; F104-M108 HydrophobicContact CZ-CG 3.56Å; F104-M108 HydrophobicContact CZ-SD 3.8Å; F104-M108 WeakPolarHBondContact O-CG 3.45Å; F104-M108 PolarHBondContact O-N 3.5Å; V105-M108 PolarHBondContact O-N 2.99Å; E106-M108 VanDerWaalsContact C-N 3.32Å; E106-M108 PolarHBondContact O-N 2.94Å; M108-Q111 PolarHBondContact O-N 3.4Å; M108-L112 WeakPolarHBondContact O-CB 3.1Å; M108-L112 PolarHBondContact O-N 3.4Å; M108-L127 HydrophobicContact CE-CB 4.25Å; M108-L127 HydrophobicContact CE-CD2 3.51Å; M108-L127 HydrophobicContact CE-CG 4.5Å; M108-L127 HydrophobicContact SD-CD2 4.04Å; M108-F130 HydrophobicContact CE-CB 3.92Å; M108-F130 HydrophobicContact CE-CD1 3.87Å; M108-F130 HydrophobicContact CE-CG 3.99Å; M108-L131 HydrophobicContact CB-CD2 3.87Å; M108-L131 HydrophobicContact CE-CG 4.5Å
109	I	98	Very high	97.1	Very high	7 Å²	7	48.4 Å²	48.4	4%	0.036	23%	0.232	C	C	.	.	H	α-helix	trans	-68.5	-39.7	176	-67.6	-66.2	0	0	0	111.7	V105 E106 L112 K113 L131 M148 L268 F271	V105-I109 WeakPolarHBondContact O-CG1 3.36Å; V105-I109 PolarHBondContact O-N 3.16Å; V105-I109 VanDerWaalsContact O-N 3.08Å; E106-I109 PolarHBondContact O-N 2.75Å; I109-L112 PolarHBondContact O-N 2.93Å; I109-K113 WeakPolarHBondContact O-CG 3.41Å; I109-K113 PolarHBondContact O-N 3.4Å; I109-L131 HydrophobicContact CD1-CD1 3.75Å; I109-M148 HydrophobicContact CD1-CE 4.21Å; I109-L268 HydrophobicContact CD1-CD2 4.13Å; I109-L268 HydrophobicContact CG1-CD2 4.23Å; I109-F271 HydrophobicContact CD1-CD2 4.49Å; I109-F271 HydrophobicContact CG2-CD2 4.32Å
110	R	96.8	Very high	97	Very high	125 Å²	125	46.4 Å²	46.4	47%	0.472	22%	0.221	S	C	.	.	H	α-helix	trans	-60.5	-48	171.8	-73.3	-172.4	-66.3	-92.8	-0.8	110.9	E106 A107 L112 K113 E114	E106-R110 WeakPolarHBondContact O-CG 3.32Å; E106-R110 PolarHBondContact O-N 3.23Å; E106-R110 IonicContact OE2-NH1 3.9Å; E106-R110 PolarHBondContact OE2-NH1 3.12Å; A107-R110 PolarHBondContact O-N 2.92Å; R110-L112 VanDerWaalsContact C-N 3.31Å; R110-L112 PolarHBondContact O-N 3.38Å; R110-K113 PolarHBondContact O-N 3.06Å; R110-E114 WeakPolarHBondContact O-CG 3.34Å; R110-E114 PolarHBondContact O-N 3.29Å
111	Q	97.4	Very high	97	Very high	51 Å²	51	47.1 Å²	47.1	24%	0.238	22%	0.224	C	C	.	.	H	α-helix	trans	-59.5	-41.2	177.5	-173.5	63.4	75.2	0	0	111.5	A107 M108 E114 T115 L127	A107-Q111 WeakPolarHBondContact O-CB 3.31Å; A107-Q111 PolarHBondContact O-N 2.66Å; M108-Q111 PolarHBondContact O-N 3.4Å; Q111-E114 PolarHBondContact O-N 3Å; Q111-T115 PolarHBondContact NE2-OG1 3.41Å; Q111-T115 VanDerWaalsContact O-CB 3.26Å; Q111-T115 WeakPolarHBondContact O-CB 3.26Å; Q111-T115 PolarHBondContact O-N 3.41Å; Q111-T115 PolarHBondContact O-OG1 3.02Å; Q111-L127 HydrophobicContact CB-CD1 4.45Å; Q111-L127 HydrophobicContact CG-CD1 3.9Å; Q111-L127 HydrophobicContact CG-CD2 4.3Å
112	L	98	Very high	96.8	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.3	-46.5	176.1	176.6	60.8	0	0	0	111.6	M108 I109 R110 E114 T115 L116 A124 L127 V128 M148 F271	M108-L112 WeakPolarHBondContact O-CB 3.1Å; M108-L112 PolarHBondContact O-N 3.4Å; I109-L112 PolarHBondContact O-N 2.93Å; R110-L112 VanDerWaalsContact C-N 3.31Å; R110-L112 PolarHBondContact O-N 3.38Å; L112-E114 PolarHBondContact O-N 3.33Å; L112-T115 PolarHBondContact O-N 2.94Å; L112-L116 HydrophobicContact CD1-CD1 4.14Å; L112-L116 HydrophobicContact CD1-CG 4.22Å; L112-L116 HydrophobicContact CG-CD1 4.2Å; L112-L116 WeakPolarHBondContact O-CG 3.42Å; L112-L116 PolarHBondContact O-N 3.17Å; L112-A124 HydrophobicContact CD1-CB 3.71Å; L112-L127 HydrophobicContact CB-CD1 4.28Å; L112-L127 HydrophobicContact CD1-CB 4.35Å; L112-L127 HydrophobicContact CD1-CD1 4.42Å; L112-V128 HydrophobicContact CD1-CG2 3.88Å; L112-V128 HydrophobicContact CD2-CG2 3.82Å; L112-M148 HydrophobicContact CD2-CE 3.34Å; L112-F271 HydrophobicContact CD2-CD2 4.2Å; L112-F271 HydrophobicContact CD2-CE2 3.63Å; L112-F271 HydrophobicContact CD2-CZ 4.01Å; L112-F271 HydrophobicContact CG-CE2 3.94Å; L112-F271 HydrophobicContact CG-CZ 4.25Å
113	K	96.2	Very high	96.7	Very high	98 Å²	98	52.3 Å²	52.3	43%	0.426	25%	0.247	S	C	.	.	H	α-helix	trans	-60.7	-44.5	177.3	-71.4	179	179.7	-177.7	0	111.9	I109 R110 L116 K117 F271	I109-K113 WeakPolarHBondContact O-CG 3.41Å; I109-K113 PolarHBondContact O-N 3.4Å; R110-K113 PolarHBondContact O-N 3.06Å; K113-L116 PolarHBondContact O-N 3.25Å; K113-K117 WeakPolarHBondContact O-CB 3.45Å; K113-K117 PolarHBondContact O-N 3.45Å; K113-F271 HydrophobicContact CG-CD2 4.45Å; K113-F271 HydrophobicContact CG-CE2 3.82Å
114	E	95.8	Very high	96.7	Very high	102 Å²	102	49.4 Å²	49.4	48%	0.477	23%	0.234	S	C	.	.	H	α-helix	trans	-63.4	-42.2	176.2	-71.5	172.6	-169.8	0	0	112	R110 Q111 L112 L116 K117 N118	R110-E114 WeakPolarHBondContact O-CG 3.34Å; R110-E114 PolarHBondContact O-N 3.29Å; Q111-E114 PolarHBondContact O-N 3Å; L112-E114 PolarHBondContact O-N 3.33Å; E114-L116 PolarHBondContact O-N 3.13Å; E114-K117 PolarHBondContact O-N 2.94Å; E114-N118 WeakPolarHBondContact O-CB 3.35Å; E114-N118 VanDerWaalsContact O-CG 3.24Å; E114-N118 PolarHBondContact O-N 3.41Å; E114-N118 PolarHBondContact O-ND2 3.49Å
115	T	96.7	Very high	96.7	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-63.4	-42.1	179.5	-55.3	0	0	0	0	111	Q111 L112 N118 N119 L120 E123 A124 L127	Q111-T115 PolarHBondContact NE2-OG1 3.41Å; Q111-T115 VanDerWaalsContact O-CB 3.26Å; Q111-T115 WeakPolarHBondContact O-CB 3.26Å; Q111-T115 PolarHBondContact O-N 3.41Å; Q111-T115 PolarHBondContact O-OG1 3.02Å; L112-T115 PolarHBondContact O-N 2.94Å; T115-N118 PolarHBondContact O-N 2.87Å; T115-N119 PolarHBondContact O-N 3.39Å; T115-L120 HydrophobicContact CG2-CB 3.53Å; T115-L120 VanDerWaalsContact CG2-O 3.27Å; T115-L120 WeakPolarHBondContact CG2-O 3.42Å; T115-L120 WeakPolarHBondContact O-CB 3.37Å; T115-L120 PolarHBondContact O-N 2.93Å; T115-E123 HydrophobicContact CG2-CB 3.91Å; T115-A124 HydrophobicContact CG2-CB 3.87Å; T115-L127 HydrophobicContact CG2-CD1 4.37Å
116	L	95.9	Very high	96.7	Very high	6 Å²	6	50.4 Å²	50.4	3%	0.031	24%	0.238	C	C	.	.	H	α-helix	trans	-67.5	-42.6	175	-67.6	172.2	0	0	0	112.6	L112 K113 E114 N118 N119 Y121 A124 W168 F271 P274	L112-L116 HydrophobicContact CD1-CD1 4.14Å; L112-L116 HydrophobicContact CD1-CG 4.22Å; L112-L116 HydrophobicContact CG-CD1 4.2Å; L112-L116 WeakPolarHBondContact O-CG 3.42Å; L112-L116 PolarHBondContact O-N 3.17Å; K113-L116 PolarHBondContact O-N 3.25Å; E114-L116 PolarHBondContact O-N 3.13Å; L116-N118 PolarHBondContact O-N 2.82Å; L116-N119 PolarHBondContact O-N 3.21Å; L116-Y121 HydrophobicContact CD2-CD1 3.69Å; L116-Y121 HydrophobicContact CD2-CE1 3.76Å; L116-A124 HydrophobicContact CD2-CB 3.73Å; L116-A124 HydrophobicContact CG-CB 4.22Å; L116-W168 HydrophobicContact CD2-CH2 3.36Å; L116-W168 HydrophobicContact CD2-CZ2 4.03Å; L116-W168 HydrophobicContact CD2-CZ3 3.65Å; L116-F271 HydrophobicContact CD1-CZ 3.69Å; L116-P274 HydrophobicContact CB-CG 4.09Å; L116-P274 HydrophobicContact CD1-CG 4.13Å
117	K	93.3	Very high	96.7	Very high	170 Å²	170	45.7 Å²	45.7	74%	0.739	22%	0.216	S	C	*	.	H	α-helix	trans	-58.3	-34.9	176.1	-175.7	-178.1	177.2	-174.9	0	111.9	K113 E114 N119	K113-K117 WeakPolarHBondContact O-CB 3.45Å; K113-K117 PolarHBondContact O-N 3.45Å; E114-K117 PolarHBondContact O-N 2.94Å; K117-N119 VanDerWaalsContact C-N 3.29Å; K117-N119 PolarHBondContact O-N 2.7Å
118	N	94.9	Very high	96.8	Very high	102 Å²	102	45 Å²	45	55%	0.545	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	13.8	180	-63.1	-25.1	0	0	0	113.5	E114 T115 L116 L120	E114-N118 WeakPolarHBondContact O-CB 3.35Å; E114-N118 VanDerWaalsContact O-CG 3.24Å; E114-N118 PolarHBondContact O-N 3.41Å; E114-N118 PolarHBondContact O-ND2 3.49Å; T115-N118 PolarHBondContact O-N 2.87Å; L116-N118 PolarHBondContact O-N 2.82Å; N118-L120 HydrophobicContact CB-CD1 4.24Å; N118-L120 HydrophobicContact CB-CG 4.17Å; N118-L120 PolarHBondContact O-N 3.29Å; N118-L120 VanDerWaalsContact O-N 3.14Å
119	N	95.9	Very high	96.8	Very high	48 Å²	48	45.3 Å²	45.3	26%	0.257	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	22.8	-177.6	-63.9	-47.6	0	0	0	114.8	T115 L116 K117 Y121 D279 A280 Q281	T115-N119 PolarHBondContact O-N 3.39Å; L116-N119 PolarHBondContact O-N 3.21Å; K117-N119 VanDerWaalsContact C-N 3.29Å; K117-N119 PolarHBondContact O-N 2.7Å; N119-Y121 HydrophobicContact CB-CD2 4.3Å; N119-Y121 HydrophobicContact CB-CE2 3.91Å; N119-Y121 WeakPolarHBondContact O-CD2 3.31Å; N119-Y121 PolarHBondContact O-N 2.77Å; N119-Y121 WeakPolarHBondContact OD1-CE2 3.27Å; N119-Y121 PolarHBondContact OD1-OH 3.08Å; N119-D279 PolarHBondContact ND2-O 3.09Å; N119-A280 WeakPolarHBondContact OD1-CA 3.43Å; N119-Q281 HydrophobicContact CB-CB 4.38Å; N119-Q281 PolarHBondContact OD1-N 3.38Å
120	L	96.4	Very high	96.8	Very high	72 Å²	72	45.1 Å²	45.1	38%	0.377	21%	0.21	S	C	.	.			trans	-86.3	49.2	179.4	-62.6	176.3	0	0	0	111.5	T115 N118 N122 E123 A124	T115-L120 HydrophobicContact CG2-CB 3.53Å; T115-L120 VanDerWaalsContact CG2-O 3.27Å; T115-L120 WeakPolarHBondContact CG2-O 3.42Å; T115-L120 WeakPolarHBondContact O-CB 3.37Å; T115-L120 PolarHBondContact O-N 2.93Å; N118-L120 HydrophobicContact CB-CD1 4.24Å; N118-L120 HydrophobicContact CB-CG 4.17Å; N118-L120 PolarHBondContact O-N 3.29Å; N118-L120 VanDerWaalsContact O-N 3.14Å; L120-N122 VanDerWaalsContact C-N 3.29Å; L120-N122 PolarHBondContact O-N 2.83Å; L120-E123 HydrophobicContact CB-CB 4.39Å; L120-E123 WeakPolarHBondContact O-CB 3.3Å; L120-E123 PolarHBondContact O-N 3.28Å; L120-A124 PolarHBondContact O-N 3.03Å
121	Y	97.1	Very high	96.9	Very high	16 Å²	16	39.1 Å²	39.1	6%	0.063	19%	0.187	C	C	.	.	H	α-helix	trans	-56.3	-36	-172	-70.5	-75.9	0	0	0	114.3	L116 N119 E123 A124 V125 W168 Q281 Y282 P283	L116-Y121 HydrophobicContact CD2-CD1 3.69Å; L116-Y121 HydrophobicContact CD2-CE1 3.76Å; N119-Y121 HydrophobicContact CB-CD2 4.3Å; N119-Y121 HydrophobicContact CB-CE2 3.91Å; N119-Y121 WeakPolarHBondContact O-CD2 3.31Å; N119-Y121 PolarHBondContact O-N 2.77Å; N119-Y121 WeakPolarHBondContact OD1-CE2 3.27Å; N119-Y121 PolarHBondContact OD1-OH 3.08Å; Y121-E123 VanDerWaalsContact C-N 3.31Å; Y121-E123 PolarHBondContact O-N 3.19Å; Y121-A124 PolarHBondContact O-N 2.94Å; Y121-V125 WeakPolarHBondContact O-CG2 3.4Å; Y121-V125 PolarHBondContact O-N 3.36Å; Y121-W168 AromaticContact CD1-CD2 3.7Å; Y121-W168 HydrophobicContact CD1-CD2 3.7Å; Y121-W168 AromaticContact CD1-CE2 3.75Å; Y121-W168 AromaticContact CD1-CE3 3.92Å; Y121-W168 HydrophobicContact CD1-CE3 3.92Å; Y121-W168 HydrophobicContact CD1-CG 4.23Å; Y121-W168 HydrophobicContact CD1-CH2 4.32Å; Y121-W168 HydrophobicContact CD1-CZ2 4.06Å; Y121-W168 HydrophobicContact CD1-CZ3 4.21Å; Y121-W168 HydrophobicContact CE1-CE3 4.38Å; Y121-W168 HydrophobicContact CG-CD2 4.43Å; Y121-W168 VanDerWaalsContact O-CZ2 3.27Å; Y121-W168 WeakPolarHBondContact O-CZ2 3.33Å; Y121-W168 PolarHBondContact O-NE1 3.41Å; Y121-W168 VanDerWaalsContact O-NE1 3.15Å; Y121-Q281 WeakPolarHBondContact CD2-O 3.42Å; Y121-Q281 WeakPolarHBondContact CE2-O 3.35Å; Y121-Y282 HydrophobicContact CD1-CD1 4.36Å; Y121-Y282 HydrophobicContact CD2-CD1 4.45Å; Y121-Y282 AromaticContact CE1-CD1 3.75Å; Y121-Y282 HydrophobicContact CE1-CD1 3.75Å; Y121-Y282 AromaticContact CE1-CE1 3.75Å; Y121-Y282 HydrophobicContact CE1-CE1 3.75Å; Y121-Y282 AromaticContact CE2-CD1 3.86Å; Y121-Y282 HydrophobicContact CE2-CD1 3.86Å; Y121-Y282 HydrophobicContact CE2-CE1 4.19Å; Y121-Y282 AromaticContact CZ-CD1 3.49Å; Y121-Y282 VanDerWaalsContact CZ-CD1 3.49Å; Y121-Y282 AromaticContact CZ-CE1 3.43Å; Y121-Y282 VanDerWaalsContact CZ-CE1 3.43Å; Y121-Y282 WeakPolarHBondContact OH-CE1 3.33Å; Y121-P283 HydrophobicContact CG-CG 4.34Å
122	N	93.9	Very high	97	Very high	89 Å²	89	36.7 Å²	36.7	48%	0.476	18%	0.176	S	C	.	.	H	α-helix	trans	-64.9	-35.7	176.5	-68.6	-36	0	0	0	112.4	L120 Y126	L120-N122 VanDerWaalsContact C-N 3.29Å; L120-N122 PolarHBondContact O-N 2.83Å; N122-Y126 WeakPolarHBondContact O-CE2 3.45Å
123	E	96.1	Very high	97	Very high	34 Å²	34	36.7 Å²	36.7	16%	0.159	18%	0.176	C	C	.	.	H	α-helix	trans	-77.5	-33.8	177.7	-61.2	-174.7	175.1	0	0	111.7	R77 T115 L120 Y121 V125 Y126 L127	R77-E123 VanDerWaalsContact CD-OE2 3.26Å; R77-E123 WeakPolarHBondContact CD-OE2 3.3Å; R77-E123 HydrophobicContact CG-CB 3.81Å; R77-E123 HydrophobicContact CG-CG 4.38Å; R77-E123 IonicContact CZ-OE2 3.61Å; R77-E123 IonicContact NE-OE2 3.35Å; R77-E123 VanDerWaalsContact NH1-CD 3.29Å; R77-E123 IonicContact NH1-OE1 2.63Å; R77-E123 PolarHBondContact NH1-OE1 3.26Å; R77-E123 IonicContact NH1-OE2 2.79Å; R77-E123 PolarHBondContact NH1-OE2 3.31Å; T115-E123 HydrophobicContact CG2-CB 3.91Å; L120-E123 HydrophobicContact CB-CB 4.39Å; L120-E123 WeakPolarHBondContact O-CB 3.3Å; L120-E123 PolarHBondContact O-N 3.28Å; Y121-E123 VanDerWaalsContact C-N 3.31Å; Y121-E123 PolarHBondContact O-N 3.19Å; E123-V125 PolarHBondContact O-N 3.35Å; E123-Y126 WeakPolarHBondContact O-CB 3.26Å; E123-Y126 PolarHBondContact O-N 3.49Å; E123-Y126 VanDerWaalsContact O-N 3.08Å; E123-L127 PolarHBondContact O-N 3.27Å
124	A	98.1	Very high	97.2	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.7	-33.5	174.9	0	0	0	0	0	112.2	L112 T115 L116 L120 Y121 Y126 L127 V128 W168	L112-A124 HydrophobicContact CD1-CB 3.71Å; T115-A124 HydrophobicContact CG2-CB 3.87Å; L116-A124 HydrophobicContact CD2-CB 3.73Å; L116-A124 HydrophobicContact CG-CB 4.22Å; L120-A124 PolarHBondContact O-N 3.03Å; Y121-A124 PolarHBondContact O-N 2.94Å; A124-Y126 VanDerWaalsContact C-N 3.29Å; A124-Y126 PolarHBondContact O-N 3.1Å; A124-L127 PolarHBondContact O-N 2.93Å; A124-V128 WeakPolarHBondContact O-CG2 3.44Å; A124-V128 PolarHBondContact O-N 3.25Å; A124-W168 HydrophobicContact CB-CH2 3.91Å; A124-W168 HydrophobicContact CB-CZ2 3.67Å
125	V	98.3	Very high	97.3	Very high	3 Å²	3	27.3 Å²	27.3	2%	0.018	13%	0.134	C	C	.	.	H	α-helix	trans	-56.2	-44.8	172.7	175.5	0	0	0	0	111	Y121 E123 L127 V128 R129 W168 Y171 V172	Y121-V125 WeakPolarHBondContact O-CG2 3.4Å; Y121-V125 PolarHBondContact O-N 3.36Å; E123-V125 PolarHBondContact O-N 3.35Å; V125-L127 PolarHBondContact O-N 3.48Å; V125-V128 PolarHBondContact O-N 3.45Å; V125-R129 HydrophobicContact CG1-CG 4.48Å; V125-R129 WeakPolarHBondContact O-CG 3.45Å; V125-R129 PolarHBondContact O-N 3.19Å; V125-W168 HydrophobicContact CG2-CZ2 4.05Å; V125-Y171 HydrophobicContact CG1-CE1 4.2Å; V125-Y171 HydrophobicContact CG2-CD1 4.24Å; V125-Y171 HydrophobicContact CG2-CE1 4.09Å; V125-V172 HydrophobicContact CB-CG2 4.47Å; V125-V172 HydrophobicContact CG2-CG2 3.67Å
126	Y	98.1	Very high	97.4	Very high	20 Å²	20	28.4 Å²	28.4	8%	0.078	14%	0.139	C	C	.	.	H	α-helix	trans	-66	-40	-178.9	-50.6	-38.9	0	0	0	112	R77 P80 N122 E123 A124 V128 R129 F130	R77-Y126 VanDerWaalsContact O-CD2 3.32Å; R77-Y126 WeakPolarHBondContact O-CD2 3.43Å; P80-Y126 HydrophobicContact CB-CD1 3.57Å; P80-Y126 HydrophobicContact CB-CD2 4.18Å; P80-Y126 HydrophobicContact CB-CE1 4.01Å; P80-Y126 HydrophobicContact CB-CG 3.67Å; P80-Y126 HydrophobicContact CG-CD1 3.9Å; P80-Y126 HydrophobicContact CG-CD2 3.94Å; P80-Y126 HydrophobicContact CG-CE1 3.9Å; P80-Y126 HydrophobicContact CG-CE2 3.92Å; P80-Y126 HydrophobicContact CG-CG 3.93Å; N122-Y126 WeakPolarHBondContact O-CE2 3.45Å; E123-Y126 WeakPolarHBondContact O-CB 3.26Å; E123-Y126 PolarHBondContact O-N 3.49Å; E123-Y126 VanDerWaalsContact O-N 3.08Å; A124-Y126 VanDerWaalsContact C-N 3.29Å; A124-Y126 PolarHBondContact O-N 3.1Å; Y126-V128 VanDerWaalsContact C-N 3.34Å; Y126-V128 PolarHBondContact O-N 3.2Å; Y126-R129 PolarHBondContact O-N 3.07Å; Y126-F130 WeakPolarHBondContact O-CB 3.36Å; Y126-F130 PolarHBondContact O-N 2.87Å
127	L	98.6	Very high	97.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61	-42.5	175.1	-64.1	174	0	0	0	111.6	A76 R77 M108 Q111 L112 T115 E123 A124 V125 F130 L131	A76-L127 HydrophobicContact CB-CD2 4.34Å; R77-L127 HydrophobicContact CB-CD2 3.98Å; R77-L127 HydrophobicContact CG-CD2 4.48Å; M108-L127 HydrophobicContact CE-CB 4.25Å; M108-L127 HydrophobicContact CE-CD2 3.51Å; M108-L127 HydrophobicContact CE-CG 4.5Å; M108-L127 HydrophobicContact SD-CD2 4.04Å; Q111-L127 HydrophobicContact CB-CD1 4.45Å; Q111-L127 HydrophobicContact CG-CD1 3.9Å; Q111-L127 HydrophobicContact CG-CD2 4.3Å; L112-L127 HydrophobicContact CB-CD1 4.28Å; L112-L127 HydrophobicContact CD1-CB 4.35Å; L112-L127 HydrophobicContact CD1-CD1 4.42Å; T115-L127 HydrophobicContact CG2-CD1 4.37Å; E123-L127 PolarHBondContact O-N 3.27Å; A124-L127 PolarHBondContact O-N 2.93Å; V125-L127 PolarHBondContact O-N 3.48Å; L127-F130 WeakPolarHBondContact O-CB 3.49Å; L127-F130 PolarHBondContact O-N 3.46Å; L127-L131 WeakPolarHBondContact O-CG 3.47Å; L127-L131 PolarHBondContact O-N 3.16Å
128	V	98.7	Very high	97.7	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-70.5	-38.1	178.4	-178.5	0	0	0	0	111.5	L112 A124 V125 Y126 F130 L131 S132 M148 F149 F152 V172	L112-V128 HydrophobicContact CD1-CG2 3.88Å; L112-V128 HydrophobicContact CD2-CG2 3.82Å; A124-V128 WeakPolarHBondContact O-CG2 3.44Å; A124-V128 PolarHBondContact O-N 3.25Å; V125-V128 PolarHBondContact O-N 3.45Å; Y126-V128 VanDerWaalsContact C-N 3.34Å; Y126-V128 PolarHBondContact O-N 3.2Å; V128-F130 VanDerWaalsContact C-N 3.29Å; V128-F130 PolarHBondContact O-N 3.21Å; V128-L131 PolarHBondContact O-N 3.2Å; V128-S132 WeakPolarHBondContact O-CB 3.39Å; V128-S132 PolarHBondContact O-N 3.38Å; V128-S132 PolarHBondContact O-OG 2.9Å; V128-M148 HydrophobicContact CG2-CE 4.44Å; V128-F149 HydrophobicContact CG1-CE1 3.96Å; V128-F152 HydrophobicContact CG1-CE2 4.04Å; V128-F152 HydrophobicContact CG2-CE2 3.94Å; V128-F152 HydrophobicContact CG2-CZ 4.07Å; V128-V172 HydrophobicContact CB-CG1 3.65Å; V128-V172 HydrophobicContact CG1-CG1 3.51Å; V128-V172 HydrophobicContact CG2-CG1 3.97Å
129	R	98.7	Very high	97.9	Very high	8 Å²	8	17.1 Å²	17.1	3%	0.03	9%	0.086	C	C	.	.	H	α-helix	trans	-62.1	-37.3	170.9	-72.5	-177.1	-157.6	151.3	2	111.9	L83 V125 Y126 S132 D133 S175 C176 E316	L83-R129 HydrophobicContact CD2-CB 4.1Å; V125-R129 HydrophobicContact CG1-CG 4.48Å; V125-R129 WeakPolarHBondContact O-CG 3.45Å; V125-R129 PolarHBondContact O-N 3.19Å; Y126-R129 PolarHBondContact O-N 3.07Å; R129-S132 WeakPolarHBondContact O-CB 3.42Å; R129-S132 PolarHBondContact O-N 2.91Å; R129-D133 PolarHBondContact O-N 3.38Å; R129-S175 PolarHBondContact NE-OG 3.37Å; R129-C176 HydrophobicContact CG-CB 4.47Å; R129-C176 WeakPolarHBondContact CG-SG 3.4Å; R129-E316 IonicContact CZ-OE1 3.3Å; R129-E316 VanDerWaalsContact CZ-OE1 3.24Å; R129-E316 IonicContact NH1-OE1 3.78Å; R129-E316 PolarHBondContact NH1-OE1 2.86Å; R129-E316 IonicContact NH2-OE1 2.85Å; R129-E316 PolarHBondContact NH2-OE1 3.39Å
130	F	98.8	Very high	98	Very high	2 Å²	2	14.9 Å²	14.9	1%	0.009	7%	0.074	C	C	.	.	H	α-helix	trans	-63.2	-50.3	175.4	-160.5	-75.8	0	0	0	111.4	A76 L83 T87 V90 F104 M108 Y126 L127 V128 S132 D133 L134	A76-F130 HydrophobicContact CB-CB 4.36Å; A76-F130 HydrophobicContact CB-CD1 4.25Å; A76-F130 HydrophobicContact CB-CD2 3.31Å; A76-F130 HydrophobicContact CB-CE1 4.41Å; A76-F130 HydrophobicContact CB-CE2 3.49Å; A76-F130 VanDerWaalsContact CB-CE2 3.49Å; A76-F130 HydrophobicContact CB-CG 3.73Å; A76-F130 HydrophobicContact CB-CZ 4.07Å; L83-F130 HydrophobicContact CD1-CB 3.81Å; L83-F130 HydrophobicContact CD1-CD2 3.55Å; L83-F130 HydrophobicContact CD1-CE2 4.46Å; L83-F130 HydrophobicContact CD1-CG 3.99Å; T87-F130 HydrophobicContact CG2-CD1 3.88Å; T87-F130 HydrophobicContact CG2-CD2 4.01Å; T87-F130 HydrophobicContact CG2-CE1 3.82Å; T87-F130 HydrophobicContact CG2-CE2 3.97Å; T87-F130 HydrophobicContact CG2-CG 3.97Å; T87-F130 HydrophobicContact CG2-CZ 3.86Å; V90-F130 HydrophobicContact CG2-CE1 4.23Å; V90-F130 HydrophobicContact CG2-CZ 4.09Å; F104-F130 HydrophobicContact CE1-CD1 4.39Å; F104-F130 AromaticContact CE1-CE1 3.73Å; F104-F130 HydrophobicContact CE1-CE1 3.73Å; F104-F130 HydrophobicContact CZ-CD1 4.45Å; F104-F130 AromaticContact CZ-CE1 3.7Å; F104-F130 HydrophobicContact CZ-CE1 3.7Å; F104-F130 HydrophobicContact CZ-CZ 4.19Å; M108-F130 HydrophobicContact CE-CB 3.92Å; M108-F130 HydrophobicContact CE-CD1 3.87Å; M108-F130 HydrophobicContact CE-CG 3.99Å; Y126-F130 WeakPolarHBondContact O-CB 3.36Å; Y126-F130 PolarHBondContact O-N 2.87Å; L127-F130 WeakPolarHBondContact O-CB 3.49Å; L127-F130 PolarHBondContact O-N 3.46Å; V128-F130 VanDerWaalsContact C-N 3.29Å; V128-F130 PolarHBondContact O-N 3.21Å; F130-S132 PolarHBondContact O-N 2.93Å; F130-D133 PolarHBondContact O-N 3.45Å; F130-L134 HydrophobicContact CD1-CD1 3.79Å; F130-L134 HydrophobicContact CD1-CG 3.94Å; F130-L134 HydrophobicContact CE1-CD1 3.87Å; F130-L134 HydrophobicContact CE1-CD2 4.08Å; F130-L134 HydrophobicContact CE1-CG 3.96Å; F130-L134 VanDerWaalsContact O-CG 3.32Å; F130-L134 WeakPolarHBondContact O-CG 3.48Å; F130-L134 PolarHBondContact O-N 3.1Å
131	L	98.8	Very high	98.1	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-58.8	-37.4	174.2	-68	171.1	0	0	0	111.9	M108 I109 L127 V128 L134 I140 M145 M148 L268	M108-L131 HydrophobicContact CB-CD2 3.87Å; M108-L131 HydrophobicContact CE-CG 4.5Å; I109-L131 HydrophobicContact CD1-CD1 3.75Å; L127-L131 WeakPolarHBondContact O-CG 3.47Å; L127-L131 PolarHBondContact O-N 3.16Å; V128-L131 PolarHBondContact O-N 3.2Å; L131-L134 HydrophobicContact CD2-CD1 4.44Å; L131-I140 HydrophobicContact CB-CD1 4.18Å; L131-I140 HydrophobicContact CD2-CD1 3.64Å; L131-I140 WeakPolarHBondContact O-CD1 3.35Å; L131-M145 HydrophobicContact CB-CE 4.41Å; L131-M145 HydrophobicContact CB-SD 4.07Å; L131-M148 HydrophobicContact CD1-CE 4.38Å; L131-L268 HydrophobicContact CD2-CD2 4.28Å
132	S	98.8	Very high	98.2	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-64.2	-51.1	176.8	-59.7	0	0	0	0	112	V128 R129 F130 L134 V135 M145 F149 C176 V180	V128-S132 WeakPolarHBondContact O-CB 3.39Å; V128-S132 PolarHBondContact O-N 3.38Å; V128-S132 PolarHBondContact O-OG 2.9Å; R129-S132 WeakPolarHBondContact O-CB 3.42Å; R129-S132 PolarHBondContact O-N 2.91Å; F130-S132 PolarHBondContact O-N 2.93Å; S132-L134 VanDerWaalsContact C-N 3.28Å; S132-L134 PolarHBondContact O-N 2.8Å; S132-V135 VanDerWaalsContact O-CB 3.31Å; S132-V135 WeakPolarHBondContact O-CB 3.1Å; S132-V135 WeakPolarHBondContact O-CG2 3.46Å; S132-V135 PolarHBondContact O-N 2.88Å; S132-V135 VanDerWaalsContact O-N 3.13Å; S132-M145 WeakPolarHBondContact OG-CE 3.38Å; S132-F149 WeakPolarHBondContact OG-CZ 3.41Å; S132-C176 WeakPolarHBondContact OG-CB 3.47Å; S132-V180 WeakPolarHBondContact O-CG2 3.23Å
133	D	98.8	Very high	98.4	Very high	0 Å²	0	10 Å²	10	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-72.7	-20.5	-178.3	-171.8	64.5	0	0	0	113	L83 T87 R129 F130 V135 N136 C137 W179 Y253	L83-D133 HydrophobicContact CD2-CB 4.5Å; T87-D133 WeakPolarHBondContact CB-OD2 3.23Å; T87-D133 HydrophobicContact CG2-CB 4.08Å; T87-D133 PolarHBondContact OG1-OD2 3.18Å; R129-D133 PolarHBondContact O-N 3.38Å; F130-D133 PolarHBondContact O-N 3.45Å; D133-V135 PolarHBondContact O-N 3.33Å; D133-N136 WeakPolarHBondContact O-CB 3.3Å; D133-N136 PolarHBondContact O-N 3.15Å; D133-N136 PolarHBondContact OD1-ND2 2.89Å; D133-C137 PolarHBondContact O-N 3.41Å; D133-W179 HydrophobicContact CB-CB 4.27Å; D133-Y253 WeakPolarHBondContact OD1-CE1 3.37Å; D133-Y253 PolarHBondContact OD1-OH 2.88Å; D133-Y253 WeakPolarHBondContact OD2-CE1 3.49Å
134	L	98.8	Very high	98.5	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-62.3	-19.1	168.3	-79.4	178.9	0	0	0	114.3	T87 V90 F104 F130 L131 S132 C137 H138 V139 I140	T87-L134 HydrophobicContact CG2-CD2 4.13Å; T87-L134 HydrophobicContact CG2-CG 4.12Å; V90-L134 HydrophobicContact CB-CD2 3.9Å; V90-L134 HydrophobicContact CG1-CD2 3.68Å; F104-L134 HydrophobicContact CE1-CD1 4.01Å; F130-L134 HydrophobicContact CD1-CD1 3.79Å; F130-L134 HydrophobicContact CD1-CG 3.94Å; F130-L134 HydrophobicContact CE1-CD1 3.87Å; F130-L134 HydrophobicContact CE1-CD2 4.08Å; F130-L134 HydrophobicContact CE1-CG 3.96Å; F130-L134 VanDerWaalsContact O-CG 3.32Å; F130-L134 WeakPolarHBondContact O-CG 3.48Å; F130-L134 PolarHBondContact O-N 3.1Å; L131-L134 HydrophobicContact CD2-CD1 4.44Å; S132-L134 VanDerWaalsContact C-N 3.28Å; S132-L134 PolarHBondContact O-N 2.8Å; L134-C137 PolarHBondContact O-N 3.13Å; L134-H138 PolarHBondContact O-N 3.38Å; L134-V139 HydrophobicContact CB-CB 4.22Å; L134-V139 HydrophobicContact CD2-CB 4.06Å; L134-V139 HydrophobicContact CD2-CG1 4.41Å; L134-V139 HydrophobicContact CD2-CG2 3.95Å; L134-V139 PolarHBondContact O-N 3.43Å; L134-I140 HydrophobicContact CB-CD1 3.87Å; L134-I140 HydrophobicContact CB-CG1 4.19Å; L134-I140 HydrophobicContact CD1-CD1 3.91Å; L134-I140 PolarHBondContact O-N 3.42Å
135	V	98.8	Very high	98.5	Very high	3 Å²	3	9 Å²	9	2%	0.018	5%	0.052	C	C	.	.	H	α-helix	trans	-65	-44	169.5	-178.4	0	0	0	0	110.3	S132 D133 C137 H138 I140 A142 M145 V180 E183 L184	S132-V135 VanDerWaalsContact O-CB 3.31Å; S132-V135 WeakPolarHBondContact O-CB 3.1Å; S132-V135 WeakPolarHBondContact O-CG2 3.46Å; S132-V135 PolarHBondContact O-N 2.88Å; S132-V135 VanDerWaalsContact O-N 3.13Å; D133-V135 PolarHBondContact O-N 3.33Å; V135-C137 PolarHBondContact O-N 3.14Å; V135-H138 PolarHBondContact O-N 3.46Å; V135-I140 WeakPolarHBondContact CA-O 3.24Å; V135-I140 HydrophobicContact CG2-CB 4.13Å; V135-I140 HydrophobicContact CG2-CG2 4.09Å; V135-A142 HydrophobicContact CG1-CB 3.79Å; V135-M145 HydrophobicContact CG2-CB 4.11Å; V135-M145 HydrophobicContact CG2-CG 3.27Å; V135-V180 HydrophobicContact CB-CG2 3.78Å; V135-V180 HydrophobicContact CG1-CG2 4.24Å; V135-V180 HydrophobicContact CG2-CG2 4.09Å; V135-E183 HydrophobicContact CG1-CG 3.75Å; V135-L184 HydrophobicContact CG1-CD2 4.41Å
136	N	98.4	Very high	98.5	Very high	24 Å²	24	9.1 Å²	9.1	13%	0.128	5%	0.052	C	C	.	.	H	α-helix	trans	-65.8	-23.1	177.2	-57.8	-49.4	0	0	0	112.2	D133 H138 W179 Y253	D133-N136 WeakPolarHBondContact O-CB 3.3Å; D133-N136 PolarHBondContact O-N 3.15Å; D133-N136 PolarHBondContact OD1-ND2 2.89Å; N136-H138 VanDerWaalsContact C-N 3.31Å; N136-W179 PolarHBondContact ND2-O 3.3Å; N136-Y253 HydrophobicContact CB-CD2 4.31Å; N136-Y253 HydrophobicContact CB-CE1 4.29Å; N136-Y253 HydrophobicContact CB-CE2 3.61Å; N136-Y253 PolarHBondContact ND2-OH 3.36Å
137	C	98.4	Very high	98.5	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	7.6	174.5	-61.2	0	0	0	0	113.8	T87 D133 L134 V135 V139 Y253	T87-C137 PolarHBondContact O-SG 3.44Å; T87-C137 VanDerWaalsContact O-SG 3.33Å; D133-C137 PolarHBondContact O-N 3.41Å; L134-C137 PolarHBondContact O-N 3.13Å; V135-C137 PolarHBondContact O-N 3.14Å; C137-V139 HydrophobicContact CB-CG2 4.14Å; C137-V139 PolarHBondContact O-N 3.35Å; C137-Y253 WeakPolarHBondContact SG-CD1 3.46Å
138	H	98.1	Very high	98.5	Very high	41 Å²	41	11.7 Å²	11.7	19%	0.19	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	56	29	-176.2	-61	-96.7	0	0	0	114.3	L134 V135 N136 L260 Q265	L134-H138 PolarHBondContact O-N 3.38Å; V135-H138 PolarHBondContact O-N 3.46Å; N136-H138 VanDerWaalsContact C-N 3.31Å; H138-L260 VanDerWaalsContact CB-O 3.23Å; H138-L260 WeakPolarHBondContact CB-O 3.48Å; H138-Q265 HydrophobicContact CB-CG 4.46Å; H138-Q265 WeakPolarHBondContact O-CG 3.42Å
139	V	98.6	Very high	98.5	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.07	C	C	.	.	S	Bend	trans	-91.8	-40.7	173.6	-178.3	0	0	0	0	110.8	V90 G91 N94 V105 L134 C137 H266	V90-V139 HydrophobicContact CG1-CG1 4.49Å; V90-V139 HydrophobicContact CG1-CG2 4.46Å; G91-V139 VanDerWaalsContact CA-CG2 3.5Å; N94-V139 HydrophobicContact CB-CG1 4.36Å; N94-V139 HydrophobicContact CB-CG2 3.96Å; V105-V139 HydrophobicContact CG2-CG1 4.07Å; L134-V139 HydrophobicContact CB-CB 4.22Å; L134-V139 HydrophobicContact CD2-CB 4.06Å; L134-V139 HydrophobicContact CD2-CG1 4.41Å; L134-V139 HydrophobicContact CD2-CG2 3.95Å; L134-V139 PolarHBondContact O-N 3.43Å; C137-V139 HydrophobicContact CB-CG2 4.14Å; C137-V139 PolarHBondContact O-N 3.35Å; V139-H266 PolarHBondContact O-CD2 3.48Å; V139-H266 PolarHBondContact O-N 3.24Å
140	I	98.7	Very high	98.5	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	8%	0.077	C	C	.	.	B	Isolated β-bridge	trans	-112.4	135.8	-179.4	-66.6	171	0	0	0	109.9	V105 L131 L134 V135 A142 S144 M145 H266 L268	V105-I140 HydrophobicContact CG1-CD1 4.48Å; V105-I140 HydrophobicContact CG2-CD1 4.19Å; V105-I140 HydrophobicContact CG2-CG1 3.97Å; L131-I140 HydrophobicContact CB-CD1 4.18Å; L131-I140 HydrophobicContact CD2-CD1 3.64Å; L131-I140 WeakPolarHBondContact O-CD1 3.35Å; L134-I140 HydrophobicContact CB-CD1 3.87Å; L134-I140 HydrophobicContact CB-CG1 4.19Å; L134-I140 HydrophobicContact CD1-CD1 3.91Å; L134-I140 PolarHBondContact O-N 3.42Å; V135-I140 WeakPolarHBondContact CA-O 3.24Å; V135-I140 HydrophobicContact CG2-CB 4.13Å; V135-I140 HydrophobicContact CG2-CG2 4.09Å; I140-A142 PolarHBondContact O-N 2.84Å; I140-S144 WeakPolarHBondContact CG2-OG 3.33Å; I140-M145 HydrophobicContact CG2-CG 3.82Å; I140-M145 HydrophobicContact CG2-SD 4.26Å; I140-H266 WeakPolarHBondContact CA-O 3.47Å; I140-L268 HydrophobicContact CD1-CD2 3.82Å; I140-L268 HydrophobicContact CD1-CG 4.49Å; I140-L268 HydrophobicContact CG1-CD2 4.34Å; I140-L268 HydrophobicContact CG2-CD1 4.48Å; I140-L268 HydrophobicContact CG2-CD2 4.33Å; I140-L268 HydrophobicContact CG2-CG 3.93Å
141	A	98.3	Very high	98.5	Very high	10 Å²	10	15.4 Å²	15.4	8%	0.083	9%	0.089	C	C	.	.			trans	-71.8	126.6	175.2	0	0	0	0	0	111.1	P143 S144 Q265 H266	A141-P143 VanDerWaalsContact C-N 3.33Å; A141-S144 PolarHBondContact O-N 3.46Å; A141-S144 PolarHBondContact O-OG 2.84Å; A141-Q265 HydrophobicContact CB-CB 4.21Å; A141-H266 PolarHBondContact N-O 3.49Å
142	A	98.3	Very high	98.5	Very high	5 Å²	5	15.4 Å²	15.4	4%	0.041	9%	0.089	C	C	.	.	H	α-helix	trans	-48.7	-42	-179.3	0	0	0	0	0	114.6	V135 I140 S144 M145 V146 L184 K187	V135-A142 HydrophobicContact CG1-CB 3.79Å; I140-A142 PolarHBondContact O-N 2.84Å; A142-S144 VanDerWaalsContact C-N 3.25Å; A142-S144 PolarHBondContact O-N 3.15Å; A142-M145 PolarHBondContact O-N 3.06Å; A142-M145 VanDerWaalsContact O-N 3.16Å; A142-V146 PolarHBondContact O-N 2.88Å; A142-V146 VanDerWaalsContact O-N 3.1Å; A142-L184 HydrophobicContact CB-CD2 3.88Å; A142-K187 HydrophobicContact CB-CB 4.2Å; A142-K187 HydrophobicContact CB-CG 4.11Å
143	P	98.3	Very high	98.5	Very high	61 Å²	61	15.4 Å²	15.4	40%	0.396	9%	0.089	S	C	.	.	H	α-helix	trans	-57.7	-35.7	177.5	-26.3	36.2	0	0	0	113.8	A141 V146 V147	A141-P143 VanDerWaalsContact C-N 3.33Å; P143-V146 PolarHBondContact O-N 2.93Å; P143-V147 WeakPolarHBondContact O-CG2 3.39Å; P143-V147 PolarHBondContact O-N 2.94Å; P143-V147 VanDerWaalsContact O-N 3.09Å
144	S	97.9	Very high	98.4	Very high	13 Å²	13	18.1 Å²	18.1	9%	0.091	11%	0.108	C	C	.	.	H	α-helix	trans	-71.8	-31.2	-179.3	71.9	0	0	0	0	112.7	I140 A141 A142 M148 L268	I140-S144 WeakPolarHBondContact CG2-OG 3.33Å; A141-S144 PolarHBondContact O-N 3.46Å; A141-S144 PolarHBondContact O-OG 2.84Å; A142-S144 VanDerWaalsContact C-N 3.25Å; A142-S144 PolarHBondContact O-N 3.15Å; S144-M148 PolarHBondContact O-N 3.24Å; S144-M148 VanDerWaalsContact O-N 3.15Å; S144-L268 PolarHBondContact OG-N 2.89Å
145	M	98.6	Very high	98.4	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-70.2	-40.1	170.5	-77.9	-54	-55.2	0	0	112.6	L131 S132 V135 I140 A142 V147 M148 F149 L184 L268	L131-M145 HydrophobicContact CB-CE 4.41Å; L131-M145 HydrophobicContact CB-SD 4.07Å; S132-M145 WeakPolarHBondContact OG-CE 3.38Å; V135-M145 HydrophobicContact CG2-CB 4.11Å; V135-M145 HydrophobicContact CG2-CG 3.27Å; I140-M145 HydrophobicContact CG2-CG 3.82Å; I140-M145 HydrophobicContact CG2-SD 4.26Å; A142-M145 PolarHBondContact O-N 3.06Å; A142-M145 VanDerWaalsContact O-N 3.16Å; M145-V147 VanDerWaalsContact C-N 3.34Å; M145-V147 PolarHBondContact O-N 3.49Å; M145-M148 HydrophobicContact CE-SD 4.28Å; M145-M148 WeakPolarHBondContact O-CB 3.31Å; M145-M148 PolarHBondContact O-N 2.75Å; M145-M148 HydrophobicContact SD-SD 4.43Å; M145-F149 HydrophobicContact CE-CD1 4.42Å; M145-F149 HydrophobicContact CE-CE1 3.77Å; M145-F149 HydrophobicContact CE-CZ 3.88Å; M145-F149 PolarHBondContact O-N 3.41Å; M145-L184 HydrophobicContact CB-CD2 4.11Å; M145-L268 HydrophobicContact CG-CD1 4.4Å; M145-L268 HydrophobicContact SD-CD1 3.35Å; M145-L268 WeakPolarHBondContact SD-CD1 3.36Å; M145-L268 HydrophobicContact SD-CG 4.37Å
146	V	98.6	Very high	98.3	Very high	4 Å²	4	18.4 Å²	18.4	2%	0.024	11%	0.109	C	C	.	.	H	α-helix	trans	-60.2	-46.1	176	175.4	0	0	0	0	110.4	A142 P143 M148 F149 E150 L184 K188 E191 M192	A142-V146 PolarHBondContact O-N 2.88Å; A142-V146 VanDerWaalsContact O-N 3.1Å; P143-V146 PolarHBondContact O-N 2.93Å; V146-M148 VanDerWaalsContact C-N 3.31Å; V146-M148 PolarHBondContact O-N 2.88Å; V146-F149 PolarHBondContact O-N 3.28Å; V146-F149 VanDerWaalsContact O-N 3.13Å; V146-E150 HydrophobicContact CG1-CG 4.4Å; V146-E150 WeakPolarHBondContact O-CG 3.48Å; V146-E150 PolarHBondContact O-N 2.92Å; V146-L184 HydrophobicContact CG2-CB 4.28Å; V146-L184 HydrophobicContact CG2-CD1 4.32Å; V146-L184 HydrophobicContact CG2-CD2 4.15Å; V146-L184 HydrophobicContact CG2-CG 4.47Å; V146-K188 HydrophobicContact CG2-CB 3.95Å; V146-K188 HydrophobicContact CG2-CG 4.13Å; V146-E191 HydrophobicContact CG1-CB 3.84Å; V146-M192 HydrophobicContact CG2-SD 4.11Å
147	V	98.4	Very high	98.3	Very high	71 Å²	71	22.6 Å²	22.6	43%	0.43	13%	0.128	S	C	.	.	H	α-helix	trans	-59.5	-41.1	175.8	171.5	0	0	0	0	111.7	P143 M145 E150 N151	P143-V147 WeakPolarHBondContact O-CG2 3.39Å; P143-V147 PolarHBondContact O-N 2.94Å; P143-V147 VanDerWaalsContact O-N 3.09Å; M145-V147 VanDerWaalsContact C-N 3.34Å; M145-V147 PolarHBondContact O-N 3.49Å; V147-E150 PolarHBondContact O-N 2.76Å; V147-N151 VanDerWaalsContact O-CG 3.31Å; V147-N151 PolarHBondContact O-N 3.32Å
148	M	98.5	Very high	98.2	Very high	4 Å²	4	25.9 Å²	25.9	2%	0.02	14%	0.144	C	C	.	.	H	α-helix	trans	-61.8	-43.6	175.3	-171.7	-177.7	-168.9	0	0	111.8	I109 L112 V128 L131 S144 M145 V146 N151 F152 L268 F271	I109-M148 HydrophobicContact CD1-CE 4.21Å; L112-M148 HydrophobicContact CD2-CE 3.34Å; V128-M148 HydrophobicContact CG2-CE 4.44Å; L131-M148 HydrophobicContact CD1-CE 4.38Å; S144-M148 PolarHBondContact O-N 3.24Å; S144-M148 VanDerWaalsContact O-N 3.15Å; M145-M148 HydrophobicContact CE-SD 4.28Å; M145-M148 WeakPolarHBondContact O-CB 3.31Å; M145-M148 PolarHBondContact O-N 2.75Å; M145-M148 HydrophobicContact SD-SD 4.43Å; V146-M148 VanDerWaalsContact C-N 3.31Å; V146-M148 PolarHBondContact O-N 2.88Å; M148-N151 PolarHBondContact O-N 3.35Å; M148-F152 HydrophobicContact CE-CE1 3.82Å; M148-F152 HydrophobicContact CE-CZ 3.53Å; M148-F152 HydrophobicContact CG-CD1 4.35Å; M148-F152 HydrophobicContact CG-CE1 3.87Å; M148-F152 HydrophobicContact CG-CZ 4.25Å; M148-F152 WeakPolarHBondContact O-CD1 3.48Å; M148-F152 PolarHBondContact O-N 3.06Å; M148-L268 HydrophobicContact CB-CD1 4.29Å; M148-L268 HydrophobicContact SD-CD1 3.71Å; M148-F271 HydrophobicContact CE-CB 4.35Å; M148-F271 HydrophobicContact CE-CD1 4.26Å; M148-F271 HydrophobicContact CE-CD2 4.06Å; M148-F271 HydrophobicContact CE-CE2 4.45Å; M148-F271 HydrophobicContact CE-CG 3.95Å; M148-F271 HydrophobicContact CG-CB 4.34Å
149	F	98.8	Very high	98	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-67.2	-35.6	176.3	-69.6	-16.8	0	0	0	112.9	V128 S132 M145 V146 N151 F152 V153 V173 C176 L177 V180 L184 L195	V128-F149 HydrophobicContact CG1-CE1 3.96Å; S132-F149 WeakPolarHBondContact OG-CZ 3.41Å; M145-F149 HydrophobicContact CE-CD1 4.42Å; M145-F149 HydrophobicContact CE-CE1 3.77Å; M145-F149 HydrophobicContact CE-CZ 3.88Å; M145-F149 PolarHBondContact O-N 3.41Å; V146-F149 PolarHBondContact O-N 3.28Å; V146-F149 VanDerWaalsContact O-N 3.13Å; F149-N151 VanDerWaalsContact C-N 3.33Å; F149-N151 PolarHBondContact O-N 2.97Å; F149-F152 WeakPolarHBondContact O-CB 3.46Å; F149-F152 PolarHBondContact O-N 2.92Å; F149-F152 VanDerWaalsContact O-N 3.14Å; F149-V153 WeakPolarHBondContact O-CG2 3.21Å; F149-V153 PolarHBondContact O-N 3.26Å; F149-V173 HydrophobicContact CB-CG1 4.13Å; F149-V173 HydrophobicContact CB-CG2 4.1Å; F149-V173 HydrophobicContact CD1-CB 4.48Å; F149-V173 HydrophobicContact CD1-CG1 4.37Å; F149-V173 HydrophobicContact CD1-CG2 3.82Å; F149-V173 HydrophobicContact CD2-CG1 4.09Å; F149-V173 HydrophobicContact CE1-CG2 4.45Å; F149-V173 HydrophobicContact CG-CG1 3.98Å; F149-V173 HydrophobicContact CG-CG2 4.07Å; F149-C176 HydrophobicContact CE1-CB 4.41Å; F149-C176 HydrophobicContact CZ-CB 3.7Å; F149-L177 HydrophobicContact CE2-CD2 4.43Å; F149-V180 HydrophobicContact CE2-CG1 4.18Å; F149-V180 HydrophobicContact CZ-CG1 4.43Å; F149-L184 HydrophobicContact CD2-CD1 3.76Å; F149-L184 HydrophobicContact CE2-CD1 3.48Å; F149-L184 VanDerWaalsContact CE2-CD1 3.48Å; F149-L195 HydrophobicContact CB-CD1 3.56Å
150	E	98.4	Very high	97.7	Very high	38 Å²	38	40 Å²	40	18%	0.178	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-43.7	172.2	-72.1	179	160	0	0	111.2	V146 V147 F152 V153 S154 R194 L195	V146-E150 HydrophobicContact CG1-CG 4.4Å; V146-E150 WeakPolarHBondContact O-CG 3.48Å; V146-E150 PolarHBondContact O-N 2.92Å; V147-E150 PolarHBondContact O-N 2.76Å; E150-F152 VanDerWaalsContact C-N 3.26Å; E150-F152 PolarHBondContact O-N 3.05Å; E150-V153 PolarHBondContact O-N 2.97Å; E150-S154 PolarHBondContact O-N 3.1Å; E150-R194 VanDerWaalsContact CD-NH2 3.29Å; E150-R194 IonicContact OE1-CZ 2.77Å; E150-R194 IonicContact OE1-NE 2.63Å; E150-R194 IonicContact OE1-NH2 3.02Å; E150-R194 PolarHBondContact OE1-NH2 3.5Å; E150-R194 IonicContact OE2-NH2 3.78Å; E150-R194 PolarHBondContact OE2-NH2 3.37Å; E150-L195 HydrophobicContact CG-CD1 4.11Å
151	N	98.1	Very high	97.6	Very high	49 Å²	49	41.6 Å²	41.6	26%	0.262	23%	0.225	S	C	.	.	H	α-helix	trans	-65.7	-28	174.8	-66.5	-15.5	0	0	0	112.7	V147 M148 F149 S154 F271 P273	V147-N151 VanDerWaalsContact O-CG 3.31Å; V147-N151 PolarHBondContact O-N 3.32Å; M148-N151 PolarHBondContact O-N 3.35Å; F149-N151 VanDerWaalsContact C-N 3.33Å; F149-N151 PolarHBondContact O-N 2.97Å; N151-S154 PolarHBondContact O-OG 3.28Å; N151-F271 PolarHBondContact ND2-O 3.45Å; N151-P273 VanDerWaalsContact O-CG 3.26Å; N151-P273 WeakPolarHBondContact O-CG 3.33Å
152	F	98.6	Very high	97.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-74.1	-45.5	174.9	-78.8	22.9	0	0	0	110.6	V128 M148 F149 E150 S154 V155 F169 V172 V173 F271 P273	V128-F152 HydrophobicContact CG1-CE2 4.04Å; V128-F152 HydrophobicContact CG2-CE2 3.94Å; V128-F152 HydrophobicContact CG2-CZ 4.07Å; M148-F152 HydrophobicContact CE-CE1 3.82Å; M148-F152 HydrophobicContact CE-CZ 3.53Å; M148-F152 HydrophobicContact CG-CD1 4.35Å; M148-F152 HydrophobicContact CG-CE1 3.87Å; M148-F152 HydrophobicContact CG-CZ 4.25Å; M148-F152 WeakPolarHBondContact O-CD1 3.48Å; M148-F152 PolarHBondContact O-N 3.06Å; F149-F152 WeakPolarHBondContact O-CB 3.46Å; F149-F152 PolarHBondContact O-N 2.92Å; F149-F152 VanDerWaalsContact O-N 3.14Å; E150-F152 VanDerWaalsContact C-N 3.26Å; E150-F152 PolarHBondContact O-N 3.05Å; F152-S154 VanDerWaalsContact C-N 3.27Å; F152-S154 PolarHBondContact O-N 2.85Å; F152-V155 VanDerWaalsContact O-CB 3.31Å; F152-V155 WeakPolarHBondContact O-CB 3.44Å; F152-V155 WeakPolarHBondContact O-CG2 3.45Å; F152-V155 PolarHBondContact O-N 3.33Å; F152-F169 HydrophobicContact CB-CB 4.3Å; F152-F169 HydrophobicContact CB-CD1 3.87Å; F152-F169 AromaticContact CD1-CD1 3.96Å; F152-F169 HydrophobicContact CD1-CD1 3.96Å; F152-F169 HydrophobicContact CD1-CE1 4.1Å; F152-F169 AromaticContact CD2-CD1 3.77Å; F152-F169 HydrophobicContact CD2-CD1 3.77Å; F152-F169 HydrophobicContact CD2-CE1 4.42Å; F152-F169 HydrophobicContact CE1-CD1 4.43Å; F152-F169 HydrophobicContact CE1-CE1 4.24Å; F152-F169 HydrophobicContact CE2-CD1 4.24Å; F152-F169 AromaticContact CG-CD1 3.6Å; F152-F169 HydrophobicContact CG-CD1 3.6Å; F152-F169 HydrophobicContact CG-CE1 4.2Å; F152-F169 HydrophobicContact CZ-CE1 4.42Å; F152-F169 WeakPolarHBondContact O-CB 3.35Å; F152-V172 HydrophobicContact CD2-CB 4.4Å; F152-V172 HydrophobicContact CD2-CG1 4.08Å; F152-V172 HydrophobicContact CE2-CB 4.42Å; F152-V172 HydrophobicContact CE2-CG1 3.75Å; F152-V173 HydrophobicContact CB-CG2 3.69Å; F152-V173 HydrophobicContact CD2-CG2 3.98Å; F152-V173 HydrophobicContact CG-CG2 4.3Å; F152-F271 HydrophobicContact CD1-CD1 4.36Å; F152-F271 HydrophobicContact CD1-CE1 4.36Å; F152-F271 AromaticContact CE1-CD1 3.53Å; F152-F271 HydrophobicContact CE1-CD1 3.53Å; F152-F271 AromaticContact CE1-CE1 3.42Å; F152-F271 HydrophobicContact CE1-CE1 3.42Å; F152-F271 VanDerWaalsContact CE1-CE1 3.42Å; F152-F271 HydrophobicContact CE1-CG 4.49Å; F152-F271 HydrophobicContact CE1-CZ 4.32Å; F152-F271 HydrophobicContact CZ-CD1 4.41Å; F152-F271 HydrophobicContact CZ-CE1 4.07Å; F152-P273 HydrophobicContact CD1-CG 4.4Å
153	V	98.3	Very high	97.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-69.3	-27.3	179.6	175.8	0	0	0	0	111.5	F149 E150 V155 T156 V173 L195 Q198 I199	F149-V153 WeakPolarHBondContact O-CG2 3.21Å; F149-V153 PolarHBondContact O-N 3.26Å; E150-V153 PolarHBondContact O-N 2.97Å; V153-V155 PolarHBondContact O-N 3.07Å; V153-T156 WeakPolarHBondContact O-CB 3.08Å; V153-T156 WeakPolarHBondContact O-CG2 3.37Å; V153-T156 PolarHBondContact O-N 3.27Å; V153-T156 PolarHBondContact O-OG1 2.91Å; V153-V173 HydrophobicContact CG2-CG2 4.22Å; V153-L195 HydrophobicContact CG2-CD1 4.14Å; V153-L195 HydrophobicContact CG2-CD2 4.29Å; V153-L195 HydrophobicContact CG2-CG 3.97Å; V153-Q198 HydrophobicContact CG1-CB 3.73Å; V153-I199 HydrophobicContact CG1-CG1 4.01Å; V153-I199 HydrophobicContact CG2-CD1 3.83Å; V153-I199 HydrophobicContact CG2-CG1 3.74Å
154	S	97.7	Very high	97.5	Very high	58 Å²	58	40.9 Å²	40.9	41%	0.406	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-61.8	-22.4	174.5	67.5	0	0	0	0	113.5	E150 N151 F152 T156 Q157	E150-S154 PolarHBondContact O-N 3.1Å; N151-S154 PolarHBondContact O-OG 3.28Å; F152-S154 VanDerWaalsContact C-N 3.27Å; F152-S154 PolarHBondContact O-N 2.85Å; S154-T156 PolarHBondContact O-N 3.08Å; S154-Q157 PolarHBondContact O-N 3.05Å
155	V	98	Very high	97.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-58.1	-28.9	173.6	179.1	0	0	0	0	111.5	F152 V153 Q157 E158 R165 S166 F169 P273	F152-V155 VanDerWaalsContact O-CB 3.31Å; F152-V155 WeakPolarHBondContact O-CB 3.44Å; F152-V155 WeakPolarHBondContact O-CG2 3.45Å; F152-V155 PolarHBondContact O-N 3.33Å; V153-V155 PolarHBondContact O-N 3.07Å; V155-Q157 PolarHBondContact O-N 3.04Å; V155-E158 WeakPolarHBondContact O-CB 3.21Å; V155-E158 PolarHBondContact O-N 3.14Å; V155-R165 HydrophobicContact CG1-CG 4.01Å; V155-S166 PolarHBondContact O-OG 3.17Å; V155-F169 HydrophobicContact CB-CB 4.41Å; V155-F169 HydrophobicContact CB-CD2 3.98Å; V155-F169 HydrophobicContact CB-CG 4.24Å; V155-F169 HydrophobicContact CG1-CD2 3.71Å; V155-F169 HydrophobicContact CG1-CE2 4.15Å; V155-F169 HydrophobicContact CG1-CG 4.44Å; V155-F169 HydrophobicContact CG2-CD1 4.31Å; V155-F169 HydrophobicContact CG2-CD2 3.8Å; V155-F169 HydrophobicContact CG2-CE1 4.49Å; V155-F169 HydrophobicContact CG2-CE2 4.01Å; V155-F169 HydrophobicContact CG2-CG 3.96Å; V155-F169 HydrophobicContact CG2-CZ 4.37Å; V155-P273 HydrophobicContact CG2-CB 3.81Å; V155-P273 HydrophobicContact CG2-CG 3.67Å
156	T	97.9	Very high	97.5	Very high	8 Å²	8	40.8 Å²	40.8	5%	0.049	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-63.2	-14.3	176	66.9	0	0	0	0	113.8	V153 S154 V170 Y202 R205	V153-T156 WeakPolarHBondContact O-CB 3.08Å; V153-T156 WeakPolarHBondContact O-CG2 3.37Å; V153-T156 PolarHBondContact O-N 3.27Å; V153-T156 PolarHBondContact O-OG1 2.91Å; S154-T156 PolarHBondContact O-N 3.08Å; T156-V170 HydrophobicContact CG2-CG2 3.51Å; T156-Y202 HydrophobicContact CG2-CD1 3.96Å; T156-Y202 HydrophobicContact CG2-CD2 3.78Å; T156-Y202 HydrophobicContact CG2-CE1 4.39Å; T156-Y202 HydrophobicContact CG2-CE2 4.25Å; T156-Y202 HydrophobicContact CG2-CG 3.63Å; T156-R205 PolarHBondContact O-NH2 3.44Å
157	Q	96.9	Very high	97.5	Very high	112 Å²	112	40.6 Å²	40.6	52%	0.523	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-104.9	1.2	178	-48.3	-57.9	-48.7	0	0	112.6	S154 V155 R205	S154-Q157 PolarHBondContact O-N 3.05Å; V155-Q157 PolarHBondContact O-N 3.04Å; Q157-R205 VanDerWaalsContact NE2-NH2 3.1Å
158	E	96.4	Very high	97.5	Very high	69 Å²	69	37.5 Å²	37.5	32%	0.322	19%	0.194	S	C	.	.			trans	-64.6	134.7	170.6	-70.8	176	-170.5	0	0	109.3	V155 V161 R165	V155-E158 WeakPolarHBondContact O-CB 3.21Å; V155-E158 PolarHBondContact O-N 3.14Å; E158-V161 HydrophobicContact CB-CG1 3.95Å; E158-V161 HydrophobicContact CB-CG2 3.79Å; E158-R165 IonicContact OE1-NH2 2.72Å; E158-R165 PolarHBondContact OE1-NH2 3.17Å; E158-R165 IonicContact OE2-CZ 3.68Å; E158-R165 VanDerWaalsContact OE2-CZ 3.28Å; E158-R165 IonicContact OE2-NE 2.6Å; E158-R165 PolarHBondContact OE2-NE 3.47Å; E158-R165 IonicContact OE2-NH2 3.25Å; E158-R165 PolarHBondContact OE2-NH2 2.89Å
159	E	94.4	Very high	97.5	Very high	172 Å²	172	37.5 Å²	37.5	80%	0.804	19%	0.194	S	C	*	.	S	Bend	trans	-84.9	152	174.7	-64.3	-179	175.2	0	0	109.9	V161	E159-V161 VanDerWaalsContact C-N 3.26Å; E159-V161 PolarHBondContact O-N 3.13Å
160	D	93	Very high	97.5	Very high	165 Å²	165	37.5 Å²	37.5	88%	0.882	19%	0.194	S	C	*	.	S	Bend	trans	55.2	33.6	175.3	-56.4	-38.5	0	0	0	115.5
161	V	96.1	Very high	97.5	Very high	34 Å²	34	36.5 Å²	36.5	21%	0.206	19%	0.188	C	C	.	.			trans	-112.9	150.5	173.3	-61.4	0	0	0	0	112.5	E158 E159 H276	E158-V161 HydrophobicContact CB-CG1 3.95Å; E158-V161 HydrophobicContact CB-CG2 3.79Å; E159-V161 VanDerWaalsContact C-N 3.26Å; E159-V161 PolarHBondContact O-N 3.13Å; V161-H276 HydrophobicContact CG1-CB 3.88Å
162	P	96.7	Very high	97.6	Very high	22 Å²	22	34.1 Å²	34.1	14%	0.143	18%	0.176	C	C	.	.			trans	-60.5	145.5	176.9	-24.5	34.3	0	0	0	113.3	V164 R165 L799	P162-V164 HydrophobicContact CB-CG2 3.7Å; P162-V164 PolarHBondContact O-N 3.3Å; P162-R165 WeakPolarHBondContact O-CB 3.43Å; P162-R165 PolarHBondContact O-N 2.98Å; P162-R165 VanDerWaalsContact O-N 3.09Å; P162-L799 WeakPolarHBondContact CA-OXT 3.45Å
163	Q	98.1	Very high	97.6	Very high	37 Å²	37	34.1 Å²	34.1	17%	0.173	18%	0.176	C	C	.	.	H	α-helix	trans	-57.6	-40.8	175.2	-173.4	177.8	-89.8	0	0	110.8	R165 S166 D167 Y202 V207 L799	Q163-R165 PolarHBondContact O-N 3.5Å; Q163-R165 VanDerWaalsContact O-N 3.15Å; Q163-S166 PolarHBondContact O-N 2.91Å; Q163-S166 VanDerWaalsContact O-N 3.1Å; Q163-D167 VanDerWaalsContact O-CB 3.28Å; Q163-D167 WeakPolarHBondContact O-CB 3.47Å; Q163-D167 PolarHBondContact O-N 3.37Å; Q163-Y202 WeakPolarHBondContact CG-OH 3.49Å; Q163-Y202 PolarHBondContact O-OH 2.96Å; Q163-V207 PolarHBondContact NE2-O 2.93Å; Q163-L799 WeakPolarHBondContact CB-O 3.49Å; Q163-L799 PolarHBondContact N-O 2.85Å; Q163-L799 PolarHBondContact N-OXT 3.28Å
164	V	98	Very high	97.6	Very high	3 Å²	3	34.1 Å²	34.1	2%	0.018	18%	0.176	C	C	.	.	H	α-helix	trans	-57.9	-26.3	178.1	-67	0	0	0	0	114.4	P162 W168 Y282 Q798	P162-V164 HydrophobicContact CB-CG2 3.7Å; P162-V164 PolarHBondContact O-N 3.3Å; V164-W168 PolarHBondContact O-N 2.85Å; V164-W168 VanDerWaalsContact O-N 3.16Å; V164-Y282 HydrophobicContact CG2-CD2 3.92Å; V164-Y282 HydrophobicContact CG2-CG 4.19Å; V164-Q798 VanDerWaalsContact CG2-O 3.28Å; V164-Q798 WeakPolarHBondContact CG2-O 3.36Å
165	R	97.9	Very high	97.7	Very high	3 Å²	3	31.4 Å²	31.4	1%	0.011	16%	0.157	C	C	.	.	H	α-helix	trans	-68.8	-55.2	172.6	177.8	-176.4	168.4	75.2	2.9	110.6	V155 E158 P162 Q163 D167 W168 F169 P274 Y282	V155-R165 HydrophobicContact CG1-CG 4.01Å; E158-R165 IonicContact OE1-NH2 2.72Å; E158-R165 PolarHBondContact OE1-NH2 3.17Å; E158-R165 IonicContact OE2-CZ 3.68Å; E158-R165 VanDerWaalsContact OE2-CZ 3.28Å; E158-R165 IonicContact OE2-NE 2.6Å; E158-R165 PolarHBondContact OE2-NE 3.47Å; E158-R165 IonicContact OE2-NH2 3.25Å; E158-R165 PolarHBondContact OE2-NH2 2.89Å; P162-R165 WeakPolarHBondContact O-CB 3.43Å; P162-R165 PolarHBondContact O-N 2.98Å; P162-R165 VanDerWaalsContact O-N 3.09Å; Q163-R165 PolarHBondContact O-N 3.5Å; Q163-R165 VanDerWaalsContact O-N 3.15Å; R165-D167 VanDerWaalsContact C-N 3.29Å; R165-D167 PolarHBondContact O-N 3.45Å; R165-W168 PolarHBondContact O-N 2.66Å; R165-F169 HydrophobicContact CG-CD2 4.43Å; R165-F169 HydrophobicContact CG-CE2 4.32Å; R165-F169 WeakPolarHBondContact O-CD2 3.45Å; R165-F169 PolarHBondContact O-N 3.14Å; R165-P274 VanDerWaalsContact CZ-O 3.31Å; R165-P274 PolarHBondContact NH1-O 3.25Å; R165-P274 PolarHBondContact NH2-O 3.37Å; R165-Y282 HydrophobicContact CB-CD1 4.12Å; R165-Y282 HydrophobicContact CB-CD2 3.94Å; R165-Y282 HydrophobicContact CB-CE1 3.89Å; R165-Y282 HydrophobicContact CB-CE2 3.68Å; R165-Y282 HydrophobicContact CB-CG 4.17Å; R165-Y282 HydrophobicContact CG-CD1 4.36Å; R165-Y282 HydrophobicContact CG-CE1 3.72Å; R165-Y282 HydrophobicContact CG-CE2 4.15Å; R165-Y282 PolarHBondContact NH1-OH 3.03Å
166	S	98.4	Very high	97.7	Very high	7 Å²	7	31.4 Å²	31.4	5%	0.049	16%	0.157	C	C	.	.	H	α-helix	trans	-60.5	-42.1	179.7	-71.9	0	0	0	0	111.2	V155 Q163 W168 F169 V170 Y202	V155-S166 PolarHBondContact O-OG 3.17Å; Q163-S166 PolarHBondContact O-N 2.91Å; Q163-S166 VanDerWaalsContact O-N 3.1Å; S166-W168 VanDerWaalsContact C-N 3.33Å; S166-W168 PolarHBondContact O-N 3.15Å; S166-F169 PolarHBondContact O-N 3.34Å; S166-V170 WeakPolarHBondContact O-CG2 3.43Å; S166-V170 PolarHBondContact O-N 3.28Å; S166-Y202 VanDerWaalsContact CB-CZ 3.48Å; S166-Y202 WeakPolarHBondContact CB-OH 3.39Å
167	D	98.7	Very high	97.7	Very high	1 Å²	1	31 Å²	31	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-57.5	-41.8	175.8	-83.8	2.4	0	0	0	112.6	Q163 R165 Y171 Y202 R206 Y228 L229	Q163-D167 VanDerWaalsContact O-CB 3.28Å; Q163-D167 WeakPolarHBondContact O-CB 3.47Å; Q163-D167 PolarHBondContact O-N 3.37Å; R165-D167 VanDerWaalsContact C-N 3.29Å; R165-D167 PolarHBondContact O-N 3.45Å; D167-Y171 WeakPolarHBondContact O-CB 3.38Å; D167-Y171 PolarHBondContact O-N 2.88Å; D167-Y202 PolarHBondContact N-OH 3.29Å; D167-Y202 VanDerWaalsContact OD1-CE1 3.31Å; D167-Y202 WeakPolarHBondContact OD1-CE1 3.39Å; D167-Y202 VanDerWaalsContact OD1-CZ 3.31Å; D167-Y202 PolarHBondContact OD1-OH 3.5Å; D167-R206 WeakPolarHBondContact OD1-CD 3.32Å; D167-R206 IonicContact OD1-CZ 3.63Å; D167-R206 IonicContact OD1-NE 3.78Å; D167-R206 PolarHBondContact OD1-NE 3.49Å; D167-R206 IonicContact OD1-NH2 3.77Å; D167-R206 IonicContact OD2-CZ 3.79Å; D167-R206 IonicContact OD2-NE 3.51Å; D167-R206 PolarHBondContact OD2-NE 3.11Å; D167-R206 IonicContact OD2-NH2 3.69Å; D167-R206 PolarHBondContact OD2-NH2 3.35Å; D167-Y228 WeakPolarHBondContact CB-OH 3.23Å; D167-L229 HydrophobicContact CB-CD1 3.8Å; D167-L229 WeakPolarHBondContact OD1-CD1 3.46Å
168	W	98.6	Very high	97.8	Very high	6 Å²	6	25.9 Å²	25.9	2%	0.023	13%	0.131	C	C	.	.	H	α-helix	trans	-64.9	-46	178.1	-177.5	78.6	0	0	0	112.1	L116 Y121 A124 V125 V164 R165 S166 V170 Y171 V172	L116-W168 HydrophobicContact CD2-CH2 3.36Å; L116-W168 HydrophobicContact CD2-CZ2 4.03Å; L116-W168 HydrophobicContact CD2-CZ3 3.65Å; Y121-W168 AromaticContact CD1-CD2 3.7Å; Y121-W168 HydrophobicContact CD1-CD2 3.7Å; Y121-W168 AromaticContact CD1-CE2 3.75Å; Y121-W168 AromaticContact CD1-CE3 3.92Å; Y121-W168 HydrophobicContact CD1-CE3 3.92Å; Y121-W168 HydrophobicContact CD1-CG 4.23Å; Y121-W168 HydrophobicContact CD1-CH2 4.32Å; Y121-W168 HydrophobicContact CD1-CZ2 4.06Å; Y121-W168 HydrophobicContact CD1-CZ3 4.21Å; Y121-W168 HydrophobicContact CE1-CE3 4.38Å; Y121-W168 HydrophobicContact CG-CD2 4.43Å; Y121-W168 VanDerWaalsContact O-CZ2 3.27Å; Y121-W168 WeakPolarHBondContact O-CZ2 3.33Å; Y121-W168 PolarHBondContact O-NE1 3.41Å; Y121-W168 VanDerWaalsContact O-NE1 3.15Å; A124-W168 HydrophobicContact CB-CH2 3.91Å; A124-W168 HydrophobicContact CB-CZ2 3.67Å; V125-W168 HydrophobicContact CG2-CZ2 4.05Å; V164-W168 PolarHBondContact O-N 2.85Å; V164-W168 VanDerWaalsContact O-N 3.16Å; R165-W168 PolarHBondContact O-N 2.66Å; S166-W168 VanDerWaalsContact C-N 3.33Å; S166-W168 PolarHBondContact O-N 3.15Å; W168-V170 PolarHBondContact O-N 3.14Å; W168-Y171 WeakPolarHBondContact O-CB 3.18Å; W168-Y171 PolarHBondContact O-N 3.21Å; W168-V172 HydrophobicContact CD2-CG2 3.86Å; W168-V172 VanDerWaalsContact CE2-CG2 3.45Å; W168-V172 HydrophobicContact CE3-CG2 4.15Å; W168-V172 HydrophobicContact CH2-CG2 3.64Å; W168-V172 HydrophobicContact CZ2-CG2 3.36Å; W168-V172 HydrophobicContact CZ3-CG2 4.05Å; W168-V172 WeakPolarHBondContact O-CG2 3.28Å; W168-V172 PolarHBondContact O-N 2.99Å
169	F	98.7	Very high	97.9	Very high	3 Å²	3	23.1 Å²	23.1	1%	0.013	12%	0.117	C	C	.	.	H	α-helix	trans	-64.7	-41.1	178.7	-79.2	-78.2	0	0	0	112.3	F152 V155 R165 S166 V172 V173 P273	F152-F169 HydrophobicContact CB-CB 4.3Å; F152-F169 HydrophobicContact CB-CD1 3.87Å; F152-F169 AromaticContact CD1-CD1 3.96Å; F152-F169 HydrophobicContact CD1-CD1 3.96Å; F152-F169 HydrophobicContact CD1-CE1 4.1Å; F152-F169 AromaticContact CD2-CD1 3.77Å; F152-F169 HydrophobicContact CD2-CD1 3.77Å; F152-F169 HydrophobicContact CD2-CE1 4.42Å; F152-F169 HydrophobicContact CE1-CD1 4.43Å; F152-F169 HydrophobicContact CE1-CE1 4.24Å; F152-F169 HydrophobicContact CE2-CD1 4.24Å; F152-F169 AromaticContact CG-CD1 3.6Å; F152-F169 HydrophobicContact CG-CD1 3.6Å; F152-F169 HydrophobicContact CG-CE1 4.2Å; F152-F169 HydrophobicContact CZ-CE1 4.42Å; F152-F169 WeakPolarHBondContact O-CB 3.35Å; V155-F169 HydrophobicContact CB-CB 4.41Å; V155-F169 HydrophobicContact CB-CD2 3.98Å; V155-F169 HydrophobicContact CB-CG 4.24Å; V155-F169 HydrophobicContact CG1-CD2 3.71Å; V155-F169 HydrophobicContact CG1-CE2 4.15Å; V155-F169 HydrophobicContact CG1-CG 4.44Å; V155-F169 HydrophobicContact CG2-CD1 4.31Å; V155-F169 HydrophobicContact CG2-CD2 3.8Å; V155-F169 HydrophobicContact CG2-CE1 4.49Å; V155-F169 HydrophobicContact CG2-CE2 4.01Å; V155-F169 HydrophobicContact CG2-CG 3.96Å; V155-F169 HydrophobicContact CG2-CZ 4.37Å; R165-F169 HydrophobicContact CG-CD2 4.43Å; R165-F169 HydrophobicContact CG-CE2 4.32Å; R165-F169 WeakPolarHBondContact O-CD2 3.45Å; R165-F169 PolarHBondContact O-N 3.14Å; S166-F169 PolarHBondContact O-N 3.34Å; F169-V172 PolarHBondContact O-N 3.31Å; F169-V173 WeakPolarHBondContact O-CG2 3.4Å; F169-V173 PolarHBondContact O-N 3.22Å; F169-V173 VanDerWaalsContact O-N 3.16Å; F169-P273 HydrophobicContact CE1-CB 3.9Å; F169-P273 HydrophobicContact CE1-CG 4.06Å; F169-P273 HydrophobicContact CE2-CB 4.39Å; F169-P273 HydrophobicContact CZ-CB 3.66Å; F169-P273 HydrophobicContact CZ-CG 4.32Å
170	V	98.9	Very high	98.1	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.1	-44.1	174.1	171.8	0	0	0	0	111	T156 S166 W168 V172 V173 L174 I199 Y202 L203 L229	T156-V170 HydrophobicContact CG2-CG2 3.51Å; S166-V170 WeakPolarHBondContact O-CG2 3.43Å; S166-V170 PolarHBondContact O-N 3.28Å; W168-V170 PolarHBondContact O-N 3.14Å; V170-V172 VanDerWaalsContact C-N 3.35Å; V170-V172 PolarHBondContact O-N 3.45Å; V170-V173 PolarHBondContact O-N 3.41Å; V170-L174 HydrophobicContact CG1-CD1 3.82Å; V170-L174 HydrophobicContact CG1-CG 4.27Å; V170-L174 WeakPolarHBondContact O-CG 3.22Å; V170-L174 PolarHBondContact O-N 2.97Å; V170-I199 HydrophobicContact CG1-CG1 4.45Å; V170-I199 HydrophobicContact CG1-CG2 3.76Å; V170-Y202 HydrophobicContact CG2-CD1 3.77Å; V170-Y202 HydrophobicContact CG2-CE1 3.96Å; V170-L203 HydrophobicContact CG1-CD2 4.33Å; V170-L229 HydrophobicContact CG1-CD2 4.06Å
171	Y	98.9	Very high	98.4	Very high	17 Å²	17	7.1 Å²	7.1	7%	0.067	4%	0.037	C	C	.	.	H	α-helix	trans	-59.1	-44.7	176.5	174.1	-102.5	0	0	0	112.1	V125 D167 W168 V173 L174 S175 Y228 L229 L232 F312	V125-Y171 HydrophobicContact CG1-CE1 4.2Å; V125-Y171 HydrophobicContact CG2-CD1 4.24Å; V125-Y171 HydrophobicContact CG2-CE1 4.09Å; D167-Y171 WeakPolarHBondContact O-CB 3.38Å; D167-Y171 PolarHBondContact O-N 2.88Å; W168-Y171 WeakPolarHBondContact O-CB 3.18Å; W168-Y171 PolarHBondContact O-N 3.21Å; Y171-V173 PolarHBondContact O-N 2.88Å; Y171-L174 PolarHBondContact O-N 2.91Å; Y171-S175 WeakPolarHBondContact O-CB 3.39Å; Y171-S175 PolarHBondContact O-N 3.25Å; Y171-S175 PolarHBondContact O-OG 2.96Å; Y171-Y228 AromaticContact CD2-CD2 3.67Å; Y171-Y228 HydrophobicContact CD2-CD2 3.67Å; Y171-Y228 AromaticContact CD2-CE2 3.49Å; Y171-Y228 HydrophobicContact CD2-CE2 3.49Å; Y171-Y228 VanDerWaalsContact CD2-CE2 3.49Å; Y171-Y228 AromaticContact CE2-CD2 4Å; Y171-Y228 HydrophobicContact CE2-CD2 4Å; Y171-Y228 HydrophobicContact CE2-CE2 4.19Å; Y171-Y228 HydrophobicContact CG-CD2 4.46Å; Y171-Y228 AromaticContact CG-CE2 3.85Å; Y171-Y228 HydrophobicContact CG-CE2 3.85Å; Y171-L229 HydrophobicContact CD2-CD2 4.36Å; Y171-L232 HydrophobicContact CD2-CD2 3.63Å; Y171-L232 HydrophobicContact CE2-CD2 3.84Å; Y171-F312 HydrophobicContact CE2-CE2 4.43Å
172	V	98.7	Very high	98.5	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-58.9	-49.6	178.7	173.4	0	0	0	0	110.1	V125 V128 F152 W168 F169 V170 S175 C176	V125-V172 HydrophobicContact CB-CG2 4.47Å; V125-V172 HydrophobicContact CG2-CG2 3.67Å; V128-V172 HydrophobicContact CB-CG1 3.65Å; V128-V172 HydrophobicContact CG1-CG1 3.51Å; V128-V172 HydrophobicContact CG2-CG1 3.97Å; F152-V172 HydrophobicContact CD2-CB 4.4Å; F152-V172 HydrophobicContact CD2-CG1 4.08Å; F152-V172 HydrophobicContact CE2-CB 4.42Å; F152-V172 HydrophobicContact CE2-CG1 3.75Å; W168-V172 HydrophobicContact CD2-CG2 3.86Å; W168-V172 VanDerWaalsContact CE2-CG2 3.45Å; W168-V172 HydrophobicContact CE3-CG2 4.15Å; W168-V172 HydrophobicContact CH2-CG2 3.64Å; W168-V172 HydrophobicContact CZ2-CG2 3.36Å; W168-V172 HydrophobicContact CZ3-CG2 4.05Å; W168-V172 WeakPolarHBondContact O-CG2 3.28Å; W168-V172 PolarHBondContact O-N 2.99Å; F169-V172 PolarHBondContact O-N 3.31Å; V170-V172 VanDerWaalsContact C-N 3.35Å; V170-V172 PolarHBondContact O-N 3.45Å; V172-S175 PolarHBondContact O-N 2.98Å; V172-S175 PolarHBondContact O-OG 3.24Å; V172-C176 PolarHBondContact O-N 3.27Å; V172-C176 PolarHBondContact O-SG 3.46Å
173	V	98.9	Very high	98.6	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-60.1	-54.2	179.7	175.8	0	0	0	0	110.9	F149 F152 V153 F169 V170 Y171 S175 C176 L177 L195 I199	F149-V173 HydrophobicContact CB-CG1 4.13Å; F149-V173 HydrophobicContact CB-CG2 4.1Å; F149-V173 HydrophobicContact CD1-CB 4.48Å; F149-V173 HydrophobicContact CD1-CG1 4.37Å; F149-V173 HydrophobicContact CD1-CG2 3.82Å; F149-V173 HydrophobicContact CD2-CG1 4.09Å; F149-V173 HydrophobicContact CE1-CG2 4.45Å; F149-V173 HydrophobicContact CG-CG1 3.98Å; F149-V173 HydrophobicContact CG-CG2 4.07Å; F152-V173 HydrophobicContact CB-CG2 3.69Å; F152-V173 HydrophobicContact CD2-CG2 3.98Å; F152-V173 HydrophobicContact CG-CG2 4.3Å; V153-V173 HydrophobicContact CG2-CG2 4.22Å; F169-V173 WeakPolarHBondContact O-CG2 3.4Å; F169-V173 PolarHBondContact O-N 3.22Å; F169-V173 VanDerWaalsContact O-N 3.16Å; V170-V173 PolarHBondContact O-N 3.41Å; Y171-V173 PolarHBondContact O-N 2.88Å; V173-S175 VanDerWaalsContact C-N 3.34Å; V173-S175 PolarHBondContact O-N 3.35Å; V173-C176 PolarHBondContact O-N 3.42Å; V173-L177 WeakPolarHBondContact O-CG 3.29Å; V173-L195 HydrophobicContact CG1-CD2 3.95Å; V173-I199 HydrophobicContact CG1-CD1 4.11Å
174	L	98.9	Very high	98.6	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-60.3	-42.5	-178.4	-68.8	177.5	0	0	0	112.2	V170 Y171 C176 L177 I199 L229 L232 W233 I236	V170-L174 HydrophobicContact CG1-CD1 3.82Å; V170-L174 HydrophobicContact CG1-CG 4.27Å; V170-L174 WeakPolarHBondContact O-CG 3.22Å; V170-L174 PolarHBondContact O-N 2.97Å; Y171-L174 PolarHBondContact O-N 2.91Å; L174-C176 PolarHBondContact O-N 3.24Å; L174-L177 HydrophobicContact CD2-CD1 4.13Å; L174-L177 WeakPolarHBondContact O-CB 3.47Å; L174-L177 PolarHBondContact O-N 3.17Å; L174-I199 HydrophobicContact CD1-CG2 4.17Å; L174-I199 HydrophobicContact CD2-CD1 4Å; L174-I199 HydrophobicContact CD2-CG2 4.26Å; L174-I199 HydrophobicContact CG-CD1 4.32Å; L174-I199 HydrophobicContact CG-CG2 4.45Å; L174-L229 HydrophobicContact CD1-CD2 4.2Å; L174-L232 HydrophobicContact CB-CD2 3.59Å; L174-L232 HydrophobicContact CB-CG 3.91Å; L174-L232 HydrophobicContact CD1-CD2 4.45Å; L174-L232 HydrophobicContact CD1-CG 4.48Å; L174-W233 HydrophobicContact CD1-CE3 4.37Å; L174-W233 HydrophobicContact CD2-CE3 3.89Å; L174-W233 HydrophobicContact CD2-CZ3 4.1Å; L174-I236 HydrophobicContact CB-CG1 4.26Å; L174-I236 HydrophobicContact CD2-CB 4.41Å; L174-I236 HydrophobicContact CD2-CG1 4.13Å; L174-I236 HydrophobicContact CD2-CG2 4.25Å; L174-I236 WeakPolarHBondContact O-CD1 3.36Å
175	S	98.7	Very high	98.7	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-70.6	-14.6	-178.7	70.4	0	0	0	0	113.9	R129 Y171 V172 V173 P178 W179	R129-S175 PolarHBondContact NE-OG 3.37Å; Y171-S175 WeakPolarHBondContact O-CB 3.39Å; Y171-S175 PolarHBondContact O-N 3.25Å; Y171-S175 PolarHBondContact O-OG 2.96Å; V172-S175 PolarHBondContact O-N 2.98Å; V172-S175 PolarHBondContact O-OG 3.24Å; V173-S175 VanDerWaalsContact C-N 3.34Å; V173-S175 PolarHBondContact O-N 3.35Å; S175-P178 WeakPolarHBondContact O-CD 2.99Å; S175-W179 WeakPolarHBondContact O-CZ3 3.26Å
176	C	98.8	Very high	98.7	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-83.5	-23	173.6	-67	0	0	0	0	113	R129 S132 F149 V172 V173 L174 P178 W179 V180	R129-C176 HydrophobicContact CG-CB 4.47Å; R129-C176 WeakPolarHBondContact CG-SG 3.4Å; S132-C176 WeakPolarHBondContact OG-CB 3.47Å; F149-C176 HydrophobicContact CE1-CB 4.41Å; F149-C176 HydrophobicContact CZ-CB 3.7Å; V172-C176 PolarHBondContact O-N 3.27Å; V172-C176 PolarHBondContact O-SG 3.46Å; V173-C176 PolarHBondContact O-N 3.42Å; L174-C176 PolarHBondContact O-N 3.24Å; C176-P178 VanDerWaalsContact C-CD 3.43Å; C176-W179 PolarHBondContact O-N 2.92Å; C176-V180 PolarHBondContact O-N 3.41Å; C176-V180 VanDerWaalsContact O-N 3.15Å
177	L	98.8	Very high	98.6	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-64.5	-28.9	-173	-61.1	178.1	0	0	0	115.8	F149 V173 L174 W179 G181 M192 L196 I236 W244	F149-L177 HydrophobicContact CE2-CD2 4.43Å; V173-L177 WeakPolarHBondContact O-CG 3.29Å; L174-L177 HydrophobicContact CD2-CD1 4.13Å; L174-L177 WeakPolarHBondContact O-CB 3.47Å; L174-L177 PolarHBondContact O-N 3.17Å; L177-W179 PolarHBondContact O-N 3.48Å; L177-G181 VanDerWaalsContact O-CA 3.26Å; L177-G181 WeakPolarHBondContact O-CA 3.25Å; L177-G181 PolarHBondContact O-N 2.96Å; L177-M192 HydrophobicContact CD2-CE 3.77Å; L177-L196 HydrophobicContact CD1-CD2 4.13Å; L177-I236 HydrophobicContact CB-CD1 3.94Å; L177-I236 HydrophobicContact CD1-CD1 4.5Å; L177-I236 HydrophobicContact CD1-CG1 4.34Å; L177-I236 HydrophobicContact CD1-CG2 3.59Å; L177-W244 HydrophobicContact CB-CZ3 3.98Å; L177-W244 HydrophobicContact CD1-CH2 4.2Å; L177-W244 HydrophobicContact CD1-CZ3 4.18Å; L177-W244 HydrophobicContact CG-CZ3 4.47Å
178	P	98.8	Very high	98.6	Very high	4 Å²	4	25.1 Å²	25.1	3%	0.026	11%	0.11	C	C	.	.	H	α-helix	trans	-58	-29.7	170.8	-25.5	35.6	0	0	0	113	S175 C176 I236 L239 I249 R251 A309 F312 V313	S175-P178 WeakPolarHBondContact O-CD 2.99Å; C176-P178 VanDerWaalsContact C-CD 3.43Å; P178-I236 HydrophobicContact CG-CD1 4.17Å; P178-L239 HydrophobicContact CB-CD2 4.5Å; P178-I249 HydrophobicContact CB-CD1 4Å; P178-I249 VanDerWaalsContact O-CD1 3.25Å; P178-I249 WeakPolarHBondContact O-CD1 3.37Å; P178-R251 PolarHBondContact O-NH2 3.36Å; P178-A309 HydrophobicContact CG-CB 4.41Å; P178-F312 HydrophobicContact CG-CD1 4.3Å; P178-F312 HydrophobicContact CG-CE1 4.49Å; P178-V313 HydrophobicContact CB-CG2 3.84Å; P178-V313 HydrophobicContact CG-CG2 4.32Å
179	W	98.7	Very high	98.5	Very high	11 Å²	11	28.7 Å²	28.7	4%	0.042	13%	0.13	C	C	.	.	H	α-helix	trans	-87.5	-50.1	178.6	-71.8	-95.5	0	0	0	112.4	L83 D133 N136 S175 C176 L177 I249 R251 F312 V313	L83-W179 HydrophobicContact CD2-CD2 4.33Å; L83-W179 HydrophobicContact CD2-CG 4.25Å; D133-W179 HydrophobicContact CB-CB 4.27Å; N136-W179 PolarHBondContact ND2-O 3.3Å; S175-W179 WeakPolarHBondContact O-CZ3 3.26Å; C176-W179 PolarHBondContact O-N 2.92Å; L177-W179 PolarHBondContact O-N 3.48Å; W179-I249 HydrophobicContact CD2-CD1 3.98Å; W179-I249 HydrophobicContact CG-CD1 4.09Å; W179-I249 HydrophobicContact CZ2-CD1 4.47Å; W179-R251 PolarHBondContact O-NH1 2.9Å; W179-F312 HydrophobicContact CZ3-CE1 4.25Å; W179-V313 HydrophobicContact CH2-CB 4.43Å; W179-V313 HydrophobicContact CH2-CG1 4.17Å; W179-V313 HydrophobicContact CH2-CG2 3.75Å; W179-V313 HydrophobicContact CZ2-CG1 3.97Å; W179-V313 HydrophobicContact CZ2-CG2 4.22Å; W179-V313 HydrophobicContact CZ3-CG2 4.09Å
180	V	98.8	Very high	98.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-111.3	-11.3	-168.1	78.1	0	0	0	0	114.6	S132 V135 F149 C176 K182 E183 L184	S132-V180 WeakPolarHBondContact O-CG2 3.23Å; V135-V180 HydrophobicContact CB-CG2 3.78Å; V135-V180 HydrophobicContact CG1-CG2 4.24Å; V135-V180 HydrophobicContact CG2-CG2 4.09Å; F149-V180 HydrophobicContact CE2-CG1 4.18Å; F149-V180 HydrophobicContact CZ-CG1 4.43Å; C176-V180 PolarHBondContact O-N 3.41Å; C176-V180 VanDerWaalsContact O-N 3.15Å; V180-K182 PolarHBondContact O-N 2.7Å; V180-K182 VanDerWaalsContact O-N 3.11Å; V180-E183 PolarHBondContact O-N 3.47Å; V180-E183 VanDerWaalsContact O-N 3.08Å; V180-L184 HydrophobicContact CB-CG 4.43Å; V180-L184 HydrophobicContact CG1-CD1 3.69Å; V180-L184 HydrophobicContact CG1-CG 3.97Å; V180-L184 HydrophobicContact CG2-CD1 4.36Å; V180-L184 HydrophobicContact CG2-CD2 3.95Å; V180-L184 HydrophobicContact CG2-CG 3.84Å; V180-L184 PolarHBondContact O-N 3.01Å; V180-L184 VanDerWaalsContact O-N 3.08Å
181	G	98.6	Very high	98.5	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-57.1	-36.3	-167.8	0	0	0	0	0	113.8	L177 Y185	L177-G181 VanDerWaalsContact O-CA 3.26Å; L177-G181 WeakPolarHBondContact O-CA 3.25Å; L177-G181 PolarHBondContact O-N 2.96Å; G181-Y185 VanDerWaalsContact O-CB 3.24Å; G181-Y185 WeakPolarHBondContact O-CB 3.3Å; G181-Y185 PolarHBondContact O-N 2.72Å
182	K	98.6	Very high	98.5	Very high	84 Å²	84	35.2 Å²	35.2	37%	0.365	17%	0.167	S	C	.	.	H	α-helix	trans	-59.7	-55.2	174.9	-173.4	-173.3	174.9	-173.9	0	112	V180 L184 Y185 E186 W244	V180-K182 PolarHBondContact O-N 2.7Å; V180-K182 VanDerWaalsContact O-N 3.11Å; K182-L184 PolarHBondContact O-N 3.23Å; K182-Y185 PolarHBondContact O-N 3.05Å; K182-E186 WeakPolarHBondContact CE-OE1 3.49Å; K182-E186 HydrophobicContact CG-CG 4.49Å; K182-E186 IonicContact NZ-OE1 2.74Å; K182-E186 WeakPolarHBondContact O-CB 3.34Å; K182-E186 WeakPolarHBondContact O-CG 3.26Å; K182-E186 PolarHBondContact O-N 2.93Å; K182-W244 HydrophobicContact CB-CB 3.63Å; K182-W244 HydrophobicContact CB-CG 4.47Å; K182-W244 HydrophobicContact CG-CB 4.1Å
183	E	98.4	Very high	98.5	Very high	35 Å²	35	37.5 Å²	37.5	16%	0.164	18%	0.18	C	C	.	.	H	α-helix	trans	-64.9	-41.1	-175.8	-174.6	59.4	-151.2	0	0	111.3	V135 V180 E186 K187	V135-E183 HydrophobicContact CG1-CG 3.75Å; V180-E183 PolarHBondContact O-N 3.47Å; V180-E183 VanDerWaalsContact O-N 3.08Å; E183-E186 PolarHBondContact O-N 3.33Å; E183-K187 VanDerWaalsContact O-CG 3.31Å; E183-K187 WeakPolarHBondContact O-CG 3.48Å; E183-K187 PolarHBondContact O-N 3.27Å; E183-K187 WeakPolarHBondContact OE1-CE 3.45Å; E183-K187 IonicContact OE1-NZ 3.86Å
184	L	98.7	Very high	98.4	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.1	-43.8	176.1	-58.5	-170.3	0	0	0	111.7	V135 A142 M145 V146 F149 V180 K182 K187 K188 M192	V135-L184 HydrophobicContact CG1-CD2 4.41Å; A142-L184 HydrophobicContact CB-CD2 3.88Å; M145-L184 HydrophobicContact CB-CD2 4.11Å; V146-L184 HydrophobicContact CG2-CB 4.28Å; V146-L184 HydrophobicContact CG2-CD1 4.32Å; V146-L184 HydrophobicContact CG2-CD2 4.15Å; V146-L184 HydrophobicContact CG2-CG 4.47Å; F149-L184 HydrophobicContact CD2-CD1 3.76Å; F149-L184 HydrophobicContact CE2-CD1 3.48Å; F149-L184 VanDerWaalsContact CE2-CD1 3.48Å; V180-L184 HydrophobicContact CB-CG 4.43Å; V180-L184 HydrophobicContact CG1-CD1 3.69Å; V180-L184 HydrophobicContact CG1-CG 3.97Å; V180-L184 HydrophobicContact CG2-CD1 4.36Å; V180-L184 HydrophobicContact CG2-CD2 3.95Å; V180-L184 HydrophobicContact CG2-CG 3.84Å; V180-L184 PolarHBondContact O-N 3.01Å; V180-L184 VanDerWaalsContact O-N 3.08Å; K182-L184 PolarHBondContact O-N 3.23Å; L184-K187 PolarHBondContact O-N 3.05Å; L184-K188 CarbonylContact O-C 3.22Å; L184-K188 WeakPolarHBondContact O-CA 3.41Å; L184-K188 WeakPolarHBondContact O-CB 3.47Å; L184-K188 PolarHBondContact O-N 3.36Å; L184-M192 HydrophobicContact CB-CE 4.24Å; L184-M192 HydrophobicContact CB-CG 4.11Å; L184-M192 HydrophobicContact CB-SD 3.85Å; L184-M192 HydrophobicContact CD1-CE 4.38Å; L184-M192 HydrophobicContact CD1-SD 4.09Å
185	Y	98.4	Very high	98.4	Very high	58 Å²	58	43.9 Å²	43.9	23%	0.227	20%	0.204	C	C	.	.	H	α-helix	trans	-69.3	-35.5	-179.6	-159.3	-98.8	0	0	0	112.2	G181 K182 K187 D189 M192 D193 W244	G181-Y185 VanDerWaalsContact O-CB 3.24Å; G181-Y185 WeakPolarHBondContact O-CB 3.3Å; G181-Y185 PolarHBondContact O-N 2.72Å; K182-Y185 PolarHBondContact O-N 3.05Å; Y185-K187 VanDerWaalsContact C-N 3.32Å; Y185-K187 PolarHBondContact O-N 3.35Å; Y185-D189 HydrophobicContact CD1-CB 4.33Å; Y185-D189 HydrophobicContact CE1-CB 4.15Å; Y185-D189 HydrophobicContact CE2-CB 4.3Å; Y185-D189 WeakPolarHBondContact O-CA 3.34Å; Y185-D189 VanDerWaalsContact O-CB 3.32Å; Y185-D189 WeakPolarHBondContact O-CB 3.37Å; Y185-D189 PolarHBondContact O-N 3.34Å; Y185-M192 HydrophobicContact CD2-CB 3.74Å; Y185-M192 HydrophobicContact CD2-CG 4.45Å; Y185-M192 HydrophobicContact CE2-CB 4.26Å; Y185-D193 WeakPolarHBondContact CE2-OD1 3.3Å; Y185-D193 PolarHBondContact OH-OD1 3.47Å; Y185-D193 PolarHBondContact OH-OD2 2.91Å; Y185-W244 VanDerWaalsContact CB-NE1 3.35Å; Y185-W244 AromaticContact CD1-CD1 3.95Å; Y185-W244 AromaticContact CD1-NE1 3.33Å; Y185-W244 VanDerWaalsContact CD1-NE1 3.33Å; Y185-W244 AromaticContact CD2-CZ2 3.82Å; Y185-W244 HydrophobicContact CD2-CZ2 3.82Å; Y185-W244 AromaticContact CD2-NE1 3.69Å; Y185-W244 HydrophobicContact CE2-CZ2 4.46Å; Y185-W244 AromaticContact CG-CE2 3.82Å; Y185-W244 HydrophobicContact CG-CZ2 4.1Å; Y185-W244 AromaticContact CG-NE1 3.14Å
186	E	98	Very high	98.4	Very high	122 Å²	122	44.1 Å²	44.1	57%	0.57	21%	0.205	S	C	*	.	H	α-helix	trans	-67.4	-30.8	176.2	-75.7	-179.6	179.2	0	0	112.9	K182 E183	K182-E186 WeakPolarHBondContact CE-OE1 3.49Å; K182-E186 HydrophobicContact CG-CG 4.49Å; K182-E186 IonicContact NZ-OE1 2.74Å; K182-E186 WeakPolarHBondContact O-CB 3.34Å; K182-E186 WeakPolarHBondContact O-CG 3.26Å; K182-E186 PolarHBondContact O-N 2.93Å; E183-E186 PolarHBondContact O-N 3.33Å
187	K	97.6	Very high	98.4	Very high	129 Å²	129	47.6 Å²	47.6	56%	0.561	23%	0.23	S	C	*	.	H	α-helix	trans	-92.7	-28.9	179.9	-60.6	-64.5	-179.5	-176.1	0	114	A142 E183 L184 Y185	A142-K187 HydrophobicContact CB-CB 4.2Å; A142-K187 HydrophobicContact CB-CG 4.11Å; E183-K187 VanDerWaalsContact O-CG 3.31Å; E183-K187 WeakPolarHBondContact O-CG 3.48Å; E183-K187 PolarHBondContact O-N 3.27Å; E183-K187 WeakPolarHBondContact OE1-CE 3.45Å; E183-K187 IonicContact OE1-NZ 3.86Å; L184-K187 PolarHBondContact O-N 3.05Å; Y185-K187 VanDerWaalsContact C-N 3.32Å; Y185-K187 PolarHBondContact O-N 3.35Å
188	K	98.1	Very high	98.4	Very high	58 Å²	58	51.3 Å²	51.3	25%	0.252	25%	0.247	S	C	.	.	H	α-helix	trans	-147.3	48.8	-164.3	-68.1	-63	-170.6	172.2	0	112	V146 L184 V190 E191 M192	V146-K188 HydrophobicContact CG2-CB 3.95Å; V146-K188 HydrophobicContact CG2-CG 4.13Å; L184-K188 CarbonylContact O-C 3.22Å; L184-K188 WeakPolarHBondContact O-CA 3.41Å; L184-K188 WeakPolarHBondContact O-CB 3.47Å; L184-K188 PolarHBondContact O-N 3.36Å; K188-V190 PolarHBondContact O-N 3.49Å; K188-E191 HydrophobicContact CB-CB 4.49Å; K188-E191 WeakPolarHBondContact CD-OE1 3.46Å; K188-E191 WeakPolarHBondContact CD-OE2 3.21Å; K188-E191 IonicContact NZ-OE1 3.47Å; K188-E191 PolarHBondContact NZ-OE1 2.77Å; K188-E191 PolarHBondContact O-N 3.21Å; K188-M192 WeakPolarHBondContact O-CB 3.28Å; K188-M192 WeakPolarHBondContact O-CG 3.31Å; K188-M192 PolarHBondContact O-N 2.96Å
189	D	97.6	Very high	98.4	Very high	80 Å²	80	51.1 Å²	51.1	43%	0.428	25%	0.246	S	C	.	.	H	α-helix	trans	-56.3	-46.6	-177.7	62.8	-30.1	0	0	0	113.3	Y185 M192 D193	Y185-D189 HydrophobicContact CD1-CB 4.33Å; Y185-D189 HydrophobicContact CE1-CB 4.15Å; Y185-D189 HydrophobicContact CE2-CB 4.3Å; Y185-D189 WeakPolarHBondContact O-CA 3.34Å; Y185-D189 VanDerWaalsContact O-CB 3.32Å; Y185-D189 WeakPolarHBondContact O-CB 3.37Å; Y185-D189 PolarHBondContact O-N 3.34Å; D189-M192 PolarHBondContact O-N 3.26Å; D189-D193 WeakPolarHBondContact O-CB 3.17Å; D189-D193 PolarHBondContact O-N 3.36Å
190	V	98.3	Very high	98.4	Very high	102 Å²	102	53.7 Å²	53.7	62%	0.618	26%	0.258	S	S	*	.	H	α-helix	trans	-61.9	-48	-179.2	178.1	0	0	0	0	111.5	K188 D193 R194	K188-V190 PolarHBondContact O-N 3.49Å; V190-D193 PolarHBondContact O-N 2.8Å; V190-R194 PolarHBondContact O-N 2.85Å; V190-R194 VanDerWaalsContact O-N 3.09Å
191	E	98.3	Very high	98.4	Very high	55 Å²	55	55.6 Å²	55.6	26%	0.257	28%	0.278	S	S	.	.	H	α-helix	trans	-65.9	-40.1	178.2	-63.9	95	144.5	0	0	111.5	V146 K188 R194 L195	V146-E191 HydrophobicContact CG1-CB 3.84Å; K188-E191 HydrophobicContact CB-CB 4.49Å; K188-E191 WeakPolarHBondContact CD-OE1 3.46Å; K188-E191 WeakPolarHBondContact CD-OE2 3.21Å; K188-E191 IonicContact NZ-OE1 3.47Å; K188-E191 PolarHBondContact NZ-OE1 2.77Å; K188-E191 PolarHBondContact O-N 3.21Å; E191-R194 WeakPolarHBondContact O-CB 3.5Å; E191-R194 PolarHBondContact O-N 2.87Å; E191-L195 WeakPolarHBondContact O-CB 3.36Å; E191-L195 PolarHBondContact O-N 3.14Å
192	M	98.4	Very high	98.4	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-65.5	-39.9	175.9	-73.1	-61.6	-63	0	0	112.7	V146 L177 L184 Y185 K188 D189 L195 L196	V146-M192 HydrophobicContact CG2-SD 4.11Å; L177-M192 HydrophobicContact CD2-CE 3.77Å; L184-M192 HydrophobicContact CB-CE 4.24Å; L184-M192 HydrophobicContact CB-CG 4.11Å; L184-M192 HydrophobicContact CB-SD 3.85Å; L184-M192 HydrophobicContact CD1-CE 4.38Å; L184-M192 HydrophobicContact CD1-SD 4.09Å; Y185-M192 HydrophobicContact CD2-CB 3.74Å; Y185-M192 HydrophobicContact CD2-CG 4.45Å; Y185-M192 HydrophobicContact CE2-CB 4.26Å; K188-M192 WeakPolarHBondContact O-CB 3.28Å; K188-M192 WeakPolarHBondContact O-CG 3.31Å; K188-M192 PolarHBondContact O-N 2.96Å; D189-M192 PolarHBondContact O-N 3.26Å; M192-L195 PolarHBondContact O-N 3.23Å; M192-L196 WeakPolarHBondContact O-CB 3.28Å; M192-L196 VanDerWaalsContact O-CG 3.29Å; M192-L196 WeakPolarHBondContact O-CG 3.44Å; M192-L196 PolarHBondContact O-N 3.22Å
193	D	98.5	Very high	98.4	Very high	49 Å²	49	52.7 Å²	52.7	26%	0.262	27%	0.265	S	S	.	.	H	α-helix	trans	-65.8	-38.6	175.8	-84	-29.6	0	0	0	112	Y185 D189 V190 S197 K240	Y185-D193 WeakPolarHBondContact CE2-OD1 3.3Å; Y185-D193 PolarHBondContact OH-OD1 3.47Å; Y185-D193 PolarHBondContact OH-OD2 2.91Å; D189-D193 WeakPolarHBondContact O-CB 3.17Å; D189-D193 PolarHBondContact O-N 3.36Å; V190-D193 PolarHBondContact O-N 2.8Å; D193-S197 WeakPolarHBondContact O-CB 3.44Å; D193-S197 PolarHBondContact O-N 3.24Å; D193-S197 PolarHBondContact O-OG 2.94Å; D193-K240 WeakPolarHBondContact OD1-CE 3.26Å; D193-K240 IonicContact OD1-NZ 2.64Å; D193-K240 PolarHBondContact OD1-NZ 2.98Å
194	R	98.4	Very high	98.4	Very high	133 Å²	133	58.4 Å²	58.4	50%	0.502	29%	0.29	S	S	.	.	H	α-helix	trans	-60.8	-47.3	171.7	-179.9	177.6	68.4	164.3	-0.2	111.2	E150 V190 E191 S197 Q198	E150-R194 VanDerWaalsContact CD-NH2 3.29Å; E150-R194 IonicContact OE1-CZ 2.77Å; E150-R194 IonicContact OE1-NE 2.63Å; E150-R194 IonicContact OE1-NH2 3.02Å; E150-R194 PolarHBondContact OE1-NH2 3.5Å; E150-R194 IonicContact OE2-NH2 3.78Å; E150-R194 PolarHBondContact OE2-NH2 3.37Å; V190-R194 PolarHBondContact O-N 2.85Å; V190-R194 VanDerWaalsContact O-N 3.09Å; E191-R194 WeakPolarHBondContact O-CB 3.5Å; E191-R194 PolarHBondContact O-N 2.87Å; R194-S197 PolarHBondContact O-N 3.45Å; R194-Q198 WeakPolarHBondContact O-CG 3.22Å; R194-Q198 PolarHBondContact O-N 3.43Å
195	L	98.3	Very high	98.3	Very high	1 Å²	1	64.7 Å²	64.7	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-60.6	-47.9	179.1	-179.5	144.9	0	0	0	111.8	F149 E150 V153 V173 E191 M192 S197 Q198 I199	F149-L195 HydrophobicContact CB-CD1 3.56Å; E150-L195 HydrophobicContact CG-CD1 4.11Å; V153-L195 HydrophobicContact CG2-CD1 4.14Å; V153-L195 HydrophobicContact CG2-CD2 4.29Å; V153-L195 HydrophobicContact CG2-CG 3.97Å; V173-L195 HydrophobicContact CG1-CD2 3.95Å; E191-L195 WeakPolarHBondContact O-CB 3.36Å; E191-L195 PolarHBondContact O-N 3.14Å; M192-L195 PolarHBondContact O-N 3.23Å; L195-S197 VanDerWaalsContact C-N 3.29Å; L195-S197 PolarHBondContact O-N 3.33Å; L195-Q198 WeakPolarHBondContact O-CB 3.48Å; L195-Q198 PolarHBondContact O-N 3.5Å; L195-I199 HydrophobicContact CD2-CD1 3.64Å; L195-I199 HydrophobicContact CD2-CG1 4.49Å; L195-I199 WeakPolarHBondContact O-CG1 3.45Å; L195-I199 PolarHBondContact O-N 3.13Å
196	L	98.7	Very high	98.2	Very high	4 Å²	4	62.6 Å²	62.6	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-64	-35.3	178.1	-69.3	173	0	0	0	111.9	L177 M192 I199 E200 W233 I236 K240 W244	L177-L196 HydrophobicContact CD1-CD2 4.13Å; M192-L196 WeakPolarHBondContact O-CB 3.28Å; M192-L196 VanDerWaalsContact O-CG 3.29Å; M192-L196 WeakPolarHBondContact O-CG 3.44Å; M192-L196 PolarHBondContact O-N 3.22Å; L196-I199 PolarHBondContact O-N 2.93Å; L196-E200 PolarHBondContact O-N 3.42Å; L196-W233 HydrophobicContact CB-CH2 4.25Å; L196-W233 HydrophobicContact CD2-CH2 4.4Å; L196-W233 HydrophobicContact CD2-CZ3 3.92Å; L196-W233 WeakPolarHBondContact O-CH2 3.38Å; L196-I236 HydrophobicContact CD2-CG2 4.46Å; L196-K240 HydrophobicContact CD1-CD 3.96Å; L196-W244 HydrophobicContact CD1-CH2 4.2Å; L196-W244 HydrophobicContact CD1-CZ2 4.24Å
197	S	98.6	Very high	98.2	Very high	74 Å²	74	60.7 Å²	60.7	52%	0.517	30%	0.302	S	S	.	.	H	α-helix	trans	-66.5	-38.3	175.5	-58.2	0	0	0	0	112.3	D193 R194 L195 E200 G201	D193-S197 WeakPolarHBondContact O-CB 3.44Å; D193-S197 PolarHBondContact O-N 3.24Å; D193-S197 PolarHBondContact O-OG 2.94Å; R194-S197 PolarHBondContact O-N 3.45Å; L195-S197 VanDerWaalsContact C-N 3.29Å; L195-S197 PolarHBondContact O-N 3.33Å; S197-E200 PolarHBondContact O-N 2.88Å; S197-G201 PolarHBondContact O-N 3.08Å
198	Q	98.5	Very high	98.2	Very high	78 Å²	78	57.8 Å²	57.8	36%	0.364	29%	0.289	S	S	.	.	H	α-helix	trans	-64.9	-43.5	173.9	-72.3	176.9	-8.4	0	0	111.6	V153 R194 L195 G201 Y202	V153-Q198 HydrophobicContact CG1-CB 3.73Å; R194-Q198 WeakPolarHBondContact O-CG 3.22Å; R194-Q198 PolarHBondContact O-N 3.43Å; L195-Q198 WeakPolarHBondContact O-CB 3.48Å; L195-Q198 PolarHBondContact O-N 3.5Å; Q198-G201 PolarHBondContact O-N 3.11Å; Q198-Y202 PolarHBondContact O-N 3.41Å
199	I	98.8	Very high	98.2	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.2	-48.6	174	-68.7	173.6	0	0	0	110.3	V153 V170 V173 L174 L195 L196 G201 Y202 L203 W233	V153-I199 HydrophobicContact CG1-CG1 4.01Å; V153-I199 HydrophobicContact CG2-CD1 3.83Å; V153-I199 HydrophobicContact CG2-CG1 3.74Å; V170-I199 HydrophobicContact CG1-CG1 4.45Å; V170-I199 HydrophobicContact CG1-CG2 3.76Å; V173-I199 HydrophobicContact CG1-CD1 4.11Å; L174-I199 HydrophobicContact CD1-CG2 4.17Å; L174-I199 HydrophobicContact CD2-CD1 4Å; L174-I199 HydrophobicContact CD2-CG2 4.26Å; L174-I199 HydrophobicContact CG-CD1 4.32Å; L174-I199 HydrophobicContact CG-CG2 4.45Å; L195-I199 HydrophobicContact CD2-CD1 3.64Å; L195-I199 HydrophobicContact CD2-CG1 4.49Å; L195-I199 WeakPolarHBondContact O-CG1 3.45Å; L195-I199 PolarHBondContact O-N 3.13Å; L196-I199 PolarHBondContact O-N 2.93Å; I199-G201 VanDerWaalsContact C-N 3.3Å; I199-G201 PolarHBondContact O-N 3.48Å; I199-Y202 WeakPolarHBondContact O-CB 3.26Å; I199-Y202 PolarHBondContact O-N 2.98Å; I199-Y202 VanDerWaalsContact O-N 3.12Å; I199-L203 HydrophobicContact CG2-CD1 3.77Å; I199-L203 HydrophobicContact CG2-CG 4.02Å; I199-L203 VanDerWaalsContact O-CG 3.32Å; I199-L203 WeakPolarHBondContact O-CG 3.3Å; I199-L203 PolarHBondContact O-N 3.27Å; I199-W233 HydrophobicContact CB-CZ3 4.46Å; I199-W233 HydrophobicContact CG2-CE3 4.08Å; I199-W233 HydrophobicContact CG2-CZ3 3.98Å
200	E	98.7	Very high	98.3	Very high	66 Å²	66	53.8 Å²	53.8	31%	0.308	27%	0.272	S	S	.	.	H	α-helix	trans	-59.2	-42.1	178.8	-168.9	-174.6	177.9	0	0	111.9	L196 S197 Y202 L203 K204 W233	L196-E200 PolarHBondContact O-N 3.42Å; S197-E200 PolarHBondContact O-N 2.88Å; E200-Y202 VanDerWaalsContact C-N 3.34Å; E200-Y202 PolarHBondContact O-N 2.85Å; E200-L203 PolarHBondContact O-N 3.25Å; E200-K204 VanDerWaalsContact CD-NZ 3.35Å; E200-K204 HydrophobicContact CG-CD 4.46Å; E200-K204 WeakPolarHBondContact O-CG 3.31Å; E200-K204 PolarHBondContact O-N 3.34Å; E200-K204 VanDerWaalsContact O-N 3.13Å; E200-K204 VanDerWaalsContact OE1-CE 3.25Å; E200-K204 WeakPolarHBondContact OE1-CE 3.48Å; E200-K204 IonicContact OE1-NZ 2.97Å; E200-K204 PolarHBondContact OE1-NZ 3.24Å; E200-W233 HydrophobicContact CB-CH2 4.06Å; E200-W233 HydrophobicContact CB-CZ2 3.71Å; E200-W233 HydrophobicContact CG-CZ2 3.86Å
201	G	98.4	Very high	98.3	Very high	40 Å²	40	50 Å²	50	41%	0.412	25%	0.249	S	C	.	.	H	α-helix	trans	-60	-42.2	175	0	0	0	0	0	112.7	S197 Q198 I199	S197-G201 PolarHBondContact O-N 3.08Å; Q198-G201 PolarHBondContact O-N 3.11Å; I199-G201 VanDerWaalsContact C-N 3.3Å; I199-G201 PolarHBondContact O-N 3.48Å
202	Y	98.6	Very high	98.3	Very high	11 Å²	11	50.2 Å²	50.2	4%	0.043	26%	0.256	C	S	.	.	H	α-helix	trans	-65.2	-48.9	173.9	172.2	-104.9	0	0	0	112.3	T156 Q163 S166 D167 V170 Q198 I199 E200 K204 R205 R206	T156-Y202 HydrophobicContact CG2-CD1 3.96Å; T156-Y202 HydrophobicContact CG2-CD2 3.78Å; T156-Y202 HydrophobicContact CG2-CE1 4.39Å; T156-Y202 HydrophobicContact CG2-CE2 4.25Å; T156-Y202 HydrophobicContact CG2-CG 3.63Å; Q163-Y202 WeakPolarHBondContact CG-OH 3.49Å; Q163-Y202 PolarHBondContact O-OH 2.96Å; S166-Y202 VanDerWaalsContact CB-CZ 3.48Å; S166-Y202 WeakPolarHBondContact CB-OH 3.39Å; D167-Y202 PolarHBondContact N-OH 3.29Å; D167-Y202 VanDerWaalsContact OD1-CE1 3.31Å; D167-Y202 WeakPolarHBondContact OD1-CE1 3.39Å; D167-Y202 VanDerWaalsContact OD1-CZ 3.31Å; D167-Y202 PolarHBondContact OD1-OH 3.5Å; V170-Y202 HydrophobicContact CG2-CD1 3.77Å; V170-Y202 HydrophobicContact CG2-CE1 3.96Å; Q198-Y202 PolarHBondContact O-N 3.41Å; I199-Y202 WeakPolarHBondContact O-CB 3.26Å; I199-Y202 PolarHBondContact O-N 2.98Å; I199-Y202 VanDerWaalsContact O-N 3.12Å; E200-Y202 VanDerWaalsContact C-N 3.34Å; E200-Y202 PolarHBondContact O-N 2.85Å; Y202-K204 VanDerWaalsContact C-N 3.26Å; Y202-K204 PolarHBondContact O-N 3.11Å; Y202-R205 WeakPolarHBondContact O-CG 3.43Å; Y202-R205 PolarHBondContact O-N 2.88Å; Y202-R206 HydrophobicContact CD1-CG 4.22Å; Y202-R206 HydrophobicContact CE1-CG 3.74Å; Y202-R206 HydrophobicContact CE2-CG 4.27Å; Y202-R206 PolarHBondContact O-N 3.21Å
203	L	98.5	Very high	98.3	Very high	11 Å²	11	50.2 Å²	50.2	6%	0.058	26%	0.256	C	S	.	.	H	α-helix	trans	-59.6	-35.9	-177.2	-68.2	177.9	0	0	0	112.6	V170 I199 E200 R205 R206 L229 W233	V170-L203 HydrophobicContact CG1-CD2 4.33Å; I199-L203 HydrophobicContact CG2-CD1 3.77Å; I199-L203 HydrophobicContact CG2-CG 4.02Å; I199-L203 VanDerWaalsContact O-CG 3.32Å; I199-L203 WeakPolarHBondContact O-CG 3.3Å; I199-L203 PolarHBondContact O-N 3.27Å; E200-L203 PolarHBondContact O-N 3.25Å; L203-R205 VanDerWaalsContact C-N 3.3Å; L203-R205 PolarHBondContact O-N 3.42Å; L203-R206 PolarHBondContact O-N 3.26Å; L203-L229 HydrophobicContact CD2-CB 3.96Å; L203-L229 HydrophobicContact CD2-CD1 4.25Å; L203-W233 HydrophobicContact CD1-CB 3.61Å; L203-W233 HydrophobicContact CD1-CD2 3.7Å; L203-W233 HydrophobicContact CD1-CE3 3.99Å; L203-W233 HydrophobicContact CD1-CG 3.52Å
204	K	98	Very high	98.3	Very high	156 Å²	156	48.1 Å²	48.1	68%	0.678	24%	0.244	S	C	*	.	H	α-helix	trans	-66.1	-25.7	177.3	-76	173.7	-177.6	164.1	0	114.3	E200 Y202	E200-K204 VanDerWaalsContact CD-NZ 3.35Å; E200-K204 HydrophobicContact CG-CD 4.46Å; E200-K204 WeakPolarHBondContact O-CG 3.31Å; E200-K204 PolarHBondContact O-N 3.34Å; E200-K204 VanDerWaalsContact O-N 3.13Å; E200-K204 VanDerWaalsContact OE1-CE 3.25Å; E200-K204 WeakPolarHBondContact OE1-CE 3.48Å; E200-K204 IonicContact OE1-NZ 2.97Å; E200-K204 PolarHBondContact OE1-NZ 3.24Å; Y202-K204 VanDerWaalsContact C-N 3.26Å; Y202-K204 PolarHBondContact O-N 3.11Å
205	R	97	Very high	98.3	Very high	131 Å²	131	42.8 Å²	42.8	49%	0.494	23%	0.225	S	C	.	.	H	α-helix	trans	-98.3	-5.2	-179.6	63.4	175.8	-178.5	-148.3	2.5	114	T156 Q157 Y202 L203	T156-R205 PolarHBondContact O-NH2 3.44Å; Q157-R205 VanDerWaalsContact NE2-NH2 3.1Å; Y202-R205 WeakPolarHBondContact O-CG 3.43Å; Y202-R205 PolarHBondContact O-N 2.88Å; L203-R205 VanDerWaalsContact C-N 3.3Å; L203-R205 PolarHBondContact O-N 3.42Å
206	R	97.8	Very high	98.4	Very high	14 Å²	14	43.1 Å²	43.1	5%	0.053	23%	0.227	C	C	.	.			trans	-62.9	138.6	178.3	-73.9	175.3	70.1	-126.5	-1.8	111.4	D167 Y202 L203 K208 E227 D230	D167-R206 WeakPolarHBondContact OD1-CD 3.32Å; D167-R206 IonicContact OD1-CZ 3.63Å; D167-R206 IonicContact OD1-NE 3.78Å; D167-R206 PolarHBondContact OD1-NE 3.49Å; D167-R206 IonicContact OD1-NH2 3.77Å; D167-R206 IonicContact OD2-CZ 3.79Å; D167-R206 IonicContact OD2-NE 3.51Å; D167-R206 PolarHBondContact OD2-NE 3.11Å; D167-R206 IonicContact OD2-NH2 3.69Å; D167-R206 PolarHBondContact OD2-NH2 3.35Å; Y202-R206 HydrophobicContact CD1-CG 4.22Å; Y202-R206 HydrophobicContact CE1-CG 3.74Å; Y202-R206 HydrophobicContact CE2-CG 4.27Å; Y202-R206 PolarHBondContact O-N 3.21Å; L203-R206 PolarHBondContact O-N 3.26Å; R206-K208 VanDerWaalsContact NH1-CE 3.33Å; R206-E227 IonicContact CZ-OE1 3.5Å; R206-E227 IonicContact CZ-OE2 3.64Å; R206-E227 VanDerWaalsContact NH1-CD 3.34Å; R206-E227 IonicContact NH1-OE1 2.84Å; R206-E227 IonicContact NH1-OE2 3.9Å; R206-E227 PolarHBondContact NH1-OE2 3.28Å; R206-E227 VanDerWaalsContact NH2-CD 3.34Å; R206-E227 IonicContact NH2-OE1 3.86Å; R206-E227 PolarHBondContact NH2-OE1 3.47Å; R206-E227 IonicContact NH2-OE2 2.64Å; R206-E227 PolarHBondContact NH2-OE2 2.69Å; R206-D230 IonicContact NH1-OD1 2.77Å
207	V	97.1	Very high	98.4	Very high	83 Å²	83	43.3 Å²	43.3	50%	0.503	23%	0.228	S	C	.	.			trans	-83	138.7	172.4	-177.5	0	0	0	0	109	Q163 T209	Q163-V207 PolarHBondContact NE2-O 2.93Å; V207-T209 WeakPolarHBondContact CG1-OG1 3.44Å
208	K	97.9	Very high	98.4	Very high	67 Å²	67	43.3 Å²	43.3	29%	0.291	22%	0.224	S	C	.	.			trans	-114.8	23.7	-173.7	-54.6	-61.5	174.3	70.6	0	113.2	R206 H210 V211 E227 D230	R206-K208 VanDerWaalsContact NH1-CE 3.33Å; K208-H210 PolarHBondContact O-N 2.78Å; K208-V211 HydrophobicContact CB-CG2 4.03Å; K208-V211 PolarHBondContact O-N 3.38Å; K208-V211 VanDerWaalsContact O-N 3.12Å; K208-E227 HydrophobicContact CD-CG 4.18Å; K208-D230 IonicContact NZ-OD1 3.14Å; K208-D230 PolarHBondContact NZ-OD1 2.93Å; K208-D230 IonicContact NZ-OD2 3.28Å; K208-D230 PolarHBondContact NZ-OD2 2.88Å
209	T	98.4	Very high	98.3	Very high	53 Å²	53	41 Å²	41	33%	0.325	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-29.8	-177.4	-53.4	0	0	0	0	112.3	V207 V211 P212 Q792 Q793 A796	V207-T209 WeakPolarHBondContact CG1-OG1 3.44Å; T209-V211 VanDerWaalsContact C-N 3.33Å; T209-V211 PolarHBondContact O-N 2.64Å; T209-P212 WeakPolarHBondContact O-CD 3.44Å; T209-Q792 HydrophobicContact CG2-CB 4.15Å; T209-Q793 HydrophobicContact CG2-CG 4.4Å; T209-Q793 WeakPolarHBondContact O-CG 3.42Å; T209-A796 HydrophobicContact CG2-CB 4.19Å
210	H	98.6	Very high	98.2	Very high	1 Å²	1	47 Å²	47	1%	0.005	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-22	178.3	56.8	-77.4	0	0	0	114.7	K208 M213 L214 E227 P285 A796 L797	K208-H210 PolarHBondContact O-N 2.78Å; H210-M213 PolarHBondContact O-N 3.4Å; H210-M213 VanDerWaalsContact O-N 3.15Å; H210-L214 HydrophobicContact CB-CD1 4.23Å; H210-L214 WeakPolarHBondContact O-CG 3.14Å; H210-L214 PolarHBondContact O-N 2.89Å; H210-E227 IonicContact CE1-OE1 3.58Å; H210-E227 WeakPolarHBondContact NE2-CG 3.31Å; H210-E227 IonicContact NE2-OE1 2.76Å; H210-E227 PolarHBondContact NE2-OE1 3.39Å; H210-P285 HydrophobicContact CB-CG 3.94Å; H210-P285 WeakPolarHBondContact CD2-CB 3.46Å; H210-P285 WeakPolarHBondContact CD2-CG 3.39Å; H210-P285 WeakPolarHBondContact NE2-CB 3.31Å; H210-A796 HydrophobicContact CB-CB 4.12Å; H210-L797 HydrophobicContact CB-CD2 4.26Å
211	V	98.7	Very high	98.1	Very high	22 Å²	22	52.4 Å²	52.4	13%	0.133	27%	0.269	C	S	.	.	H	α-helix	trans	-59.8	-51.8	-167.9	173.6	0	0	0	0	113	K208 T209 M213 L214 Q215 E227 V287	K208-V211 HydrophobicContact CB-CG2 4.03Å; K208-V211 PolarHBondContact O-N 3.38Å; K208-V211 VanDerWaalsContact O-N 3.12Å; T209-V211 VanDerWaalsContact C-N 3.33Å; T209-V211 PolarHBondContact O-N 2.64Å; V211-M213 PolarHBondContact O-N 2.9Å; V211-L214 PolarHBondContact O-N 2.94Å; V211-Q215 HydrophobicContact CG1-CG 3.88Å; V211-Q215 WeakPolarHBondContact O-CG 3.36Å; V211-Q215 PolarHBondContact O-N 3.39Å; V211-Q215 VanDerWaalsContact O-N 3.09Å; V211-E227 HydrophobicContact CG2-CB 3.98Å; V211-E227 HydrophobicContact CG2-CG 3.68Å; V211-V287 HydrophobicContact CG1-CG2 4.41Å
212	P	98.6	Very high	98.1	Very high	60 Å²	60	54.1 Å²	54.1	39%	0.39	27%	0.274	S	S	.	.	H	α-helix	trans	-60.8	-21.3	-178.9	-23.5	35.4	0	0	0	113.9	T209	T209-P212 WeakPolarHBondContact O-CD 3.44Å
213	M	98.6	Very high	98.1	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-84.5	-18.4	178	177.4	170.1	-160.5	0	0	114.6	H210 V211 L362 Q757 F760 L761 Q793 F794 L797	H210-M213 PolarHBondContact O-N 3.4Å; H210-M213 VanDerWaalsContact O-N 3.15Å; V211-M213 PolarHBondContact O-N 2.9Å; M213-L362 WeakPolarHBondContact O-CD1 3.44Å; M213-Q757 HydrophobicContact CE-CG 3.98Å; M213-Q757 HydrophobicContact CG-CG 3.85Å; M213-Q757 HydrophobicContact SD-CG 4.43Å; M213-F760 HydrophobicContact CE-CB 3.54Å; M213-L761 HydrophobicContact CE-CD2 3.54Å; M213-L761 HydrophobicContact CE-CG 3.63Å; M213-L761 HydrophobicContact CG-CD2 3.73Å; M213-L761 HydrophobicContact CG-CG 4.31Å; M213-L761 HydrophobicContact SD-CD2 4.29Å; M213-Q793 HydrophobicContact CB-CB 3.72Å; M213-Q793 HydrophobicContact CB-CG 4.13Å; M213-Q793 HydrophobicContact CG-CB 4.28Å; M213-Q793 HydrophobicContact SD-CB 3.58Å; M213-Q793 VanDerWaalsContact SD-CB 3.58Å; M213-F794 HydrophobicContact CE-CB 4.07Å; M213-F794 HydrophobicContact SD-CB 4.25Å; M213-F794 PolarHBondContact SD-N 3.21Å; M213-F794 VanDerWaalsContact SD-N 3.42Å; M213-L797 HydrophobicContact CE-CD1 4.23Å; M213-L797 HydrophobicContact SD-CD1 4.23Å; M213-L797 HydrophobicContact SD-CG 4.45Å
214	L	98.8	Very high	98	Very high	5 Å²	5	56 Å²	56	3%	0.026	29%	0.286	C	S	.	.	H	α-helix	trans	-112.6	-8.2	-175.4	-60.1	-179.9	0	0	0	113.2	H210 V211 I284 P285 V287 L362 P363 L761 L797	H210-L214 HydrophobicContact CB-CD1 4.23Å; H210-L214 WeakPolarHBondContact O-CG 3.14Å; H210-L214 PolarHBondContact O-N 2.89Å; V211-L214 PolarHBondContact O-N 2.94Å; L214-I284 HydrophobicContact CD1-CG2 4.45Å; L214-P285 HydrophobicContact CD1-CG 4.21Å; L214-P285 WeakPolarHBondContact CD1-O 3.47Å; L214-V287 HydrophobicContact CB-CB 4.25Å; L214-V287 HydrophobicContact CB-CG2 3.67Å; L214-L362 HydrophobicContact CD2-CB 3.98Å; L214-P363 HydrophobicContact CD2-CG 4.4Å; L214-L761 HydrophobicContact CD2-CD2 4.15Å; L214-L797 HydrophobicContact CD1-CD2 3.93Å; L214-L797 HydrophobicContact CD2-CD2 3.92Å; L214-L797 HydrophobicContact CG-CD2 4.1Å
215	Q	98.8	Very high	98.1	Very high	22 Å²	22	48.7 Å²	48.7	10%	0.103	25%	0.254	C	S	.	.			trans	-70.5	128.9	175.5	-77.7	-178.1	-37.3	0	0	112	V211 Q225 V287	V211-Q215 HydrophobicContact CG1-CG 3.88Å; V211-Q215 WeakPolarHBondContact O-CG 3.36Å; V211-Q215 PolarHBondContact O-N 3.39Å; V211-Q215 VanDerWaalsContact O-N 3.09Å; Q215-Q225 HydrophobicContact CB-CB 4.35Å; Q215-Q225 HydrophobicContact CG-CB 3.89Å; Q215-Q225 PolarHBondContact NE2-O 3.16Å; Q215-V287 HydrophobicContact CG-CG1 3.94Å; Q215-V287 HydrophobicContact CG-CG2 4.31Å
216	V	98.9	Very high	98.2	Very high	8 Å²	8	44.5 Å²	44.5	5%	0.048	24%	0.24	C	C	.	.	S	Bend	trans	-68.6	-39.6	169.2	177.7	0	0	0	0	110.7	F289 F360 M405 N406 C409	V216-F289 HydrophobicContact CB-CD2 4.27Å; V216-F289 HydrophobicContact CG1-CD2 4.41Å; V216-F289 HydrophobicContact CG1-CE2 4.17Å; V216-F289 HydrophobicContact CG2-CD2 3.93Å; V216-F289 HydrophobicContact CG2-CE2 4.45Å; V216-F360 HydrophobicContact CG1-CB 4.13Å; V216-F360 HydrophobicContact CG2-CB 3.81Å; V216-F360 WeakPolarHBondContact CG2-O 3.4Å; V216-M405 HydrophobicContact CG1-CG 4.22Å; V216-M405 CarbonylContact O-C 3.55Å; V216-M405 VanDerWaalsContact O-CA 3.23Å; V216-M405 WeakPolarHBondContact O-CA 3.49Å; V216-N406 PolarHBondContact O-N 2.95Å; V216-C409 HydrophobicContact CG1-CB 4.08Å
217	W	98.8	Very high	98.2	Very high	8 Å²	8	44.1 Å²	44.1	3%	0.03	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-127.6	134.7	173.1	-64.2	-78.9	0	0	0	110.7	A219 Q225 F289 M291 L398 R401 T404 M405	W217-A219 VanDerWaalsContact C-N 3.34Å; W217-Q225 HydrophobicContact CB-CG 4.18Å; W217-Q225 HydrophobicContact CE3-CG 4.25Å; W217-Q225 WeakPolarHBondContact O-CG 3.3Å; W217-F289 HydrophobicContact CE3-CE2 4.33Å; W217-F289 HydrophobicContact CH2-CD2 4.49Å; W217-F289 AromaticContact CH2-CE2 3.45Å; W217-F289 HydrophobicContact CH2-CE2 3.45Å; W217-F289 VanDerWaalsContact CH2-CE2 3.45Å; W217-F289 AromaticContact CH2-CZ 3.74Å; W217-F289 HydrophobicContact CH2-CZ 3.74Å; W217-F289 AromaticContact CZ3-CD2 3.91Å; W217-F289 HydrophobicContact CZ3-CD2 3.91Å; W217-F289 AromaticContact CZ3-CE2 3.27Å; W217-F289 HydrophobicContact CZ3-CE2 3.27Å; W217-F289 AromaticContact CZ3-CZ 3.86Å; W217-F289 HydrophobicContact CZ3-CZ 3.86Å; W217-M291 HydrophobicContact CH2-CB 4.17Å; W217-M291 HydrophobicContact CZ3-CB 4.31Å; W217-L398 HydrophobicContact CH2-CD2 3.59Å; W217-L398 HydrophobicContact CZ2-CD2 3.52Å; W217-R401 HydrophobicContact CZ2-CB 4.3Å; W217-R401 PolarHBondContact NE1-O 3.34Å; W217-T404 WeakPolarHBondContact CA-O 3.3Å; W217-M405 HydrophobicContact CH2-CE 4.49Å; W217-M405 HydrophobicContact CZ2-CE 3.39Å
218	T	98.2	Very high	98.3	Very high	73 Å²	73	40.6 Å²	40.6	45%	0.448	22%	0.217	S	C	.	.			trans	-83.4	-10.8	173.5	57.6	0	0	0	0	113.3	T404	T218-T404 PolarHBondContact N-O 3.13Å; T218-T404 WeakPolarHBondContact OG1-CB 3.28Å
219	A	97.9	Very high	98.3	Very high	30 Å²	30	37.4 Å²	37.4	25%	0.248	20%	0.203	C	C	.	.			trans	-74.3	134.1	175.9	0	0	0	0	0	111.7	W217 K221 T404	W217-A219 VanDerWaalsContact C-N 3.34Å; A219-K221 PolarHBondContact O-N 3.39Å; A219-T404 HydrophobicContact CB-CG2 3.94Å; A219-T404 VanDerWaalsContact CB-OG1 3.3Å; A219-T404 WeakPolarHBondContact CB-OG1 3.31Å
220	E	96.6	Very high	98.4	Very high	126 Å²	126	37.6 Å²	37.6	59%	0.589	20%	0.202	S	C	*	.			trans	-72.8	-16.6	174.2	-64.7	-61.2	144.5	0	0	113.5	H223 P224	E220-H223 CarbonylContact O-C 3.39Å; E220-P224 WeakPolarHBondContact O-CD 3.17Å; E220-P224 WeakPolarHBondContact OE2-CB 3.43Å
221	K	96.5	Very high	98.4	Very high	179 Å²	179	37.6 Å²	37.6	78%	0.778	20%	0.202	S	C	*	.	S	Bend	trans	-121.3	145.5	-177.6	-68.6	-177.3	-177.5	177	0	110.9	A219	A219-K221 PolarHBondContact O-N 3.39Å
222	P	97.4	Very high	98.4	Very high	77 Å²	77	36.7 Å²	36.7	50%	0.5	20%	0.197	S	C	.	.	S	Bend	cis	-77.4	-16.7	-1.6	29.6	-33	0	0	0	113.9
223	H	98.3	Very high	98.4	Very high	16 Å²	16	35.5 Å²	35.5	7%	0.074	18%	0.184	C	C	.	.	S	Bend	trans	-130.9	124.9	177.8	-47.5	-64.9	0	0	0	111	E220 Q225 R290 M291 D293 R401	E220-H223 CarbonylContact O-C 3.39Å; H223-Q225 PolarHBondContact O-NE2 3.34Å; H223-Q225 VanDerWaalsContact O-NE2 3.13Å; H223-R290 HydrophobicContact CB-CB 4.11Å; H223-R290 HydrophobicContact CB-CG 3.75Å; H223-M291 PolarHBondContact CD2-O 2.88Å; H223-M291 VanDerWaalsContact CD2-O 3.28Å; H223-M291 PolarHBondContact NE2-O 3.05Å; H223-M291 VanDerWaalsContact NE2-O 3.08Å; H223-D293 IonicContact CE1-OD2 2.73Å; H223-D293 PolarHBondContact CE1-OD2 3.02Å; H223-R401 PolarHBondContact CD2-NH1 3.44Å
224	P	98.3	Very high	98.4	Very high	44 Å²	44	36.9 Å²	36.9	29%	0.286	20%	0.195	S	C	.	.			trans	-65.8	141.6	171.9	29.2	-35.1	0	0	0	110.2	E220 E226	E220-P224 WeakPolarHBondContact O-CD 3.17Å; E220-P224 WeakPolarHBondContact OE2-CB 3.43Å; P224-E226 HydrophobicContact CB-CG 4.19Å; P224-E226 HydrophobicContact CG-CG 4.1Å; P224-E226 PolarHBondContact O-N 3.34Å
225	Q	98.7	Very high	98.4	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.019	20%	0.195	C	C	.	.			trans	-90.9	92.4	172	-56.7	-53.5	-74	0	0	107.7	Q215 W217 H223 V287 I288 R290	Q215-Q225 HydrophobicContact CB-CB 4.35Å; Q215-Q225 HydrophobicContact CG-CB 3.89Å; Q215-Q225 PolarHBondContact NE2-O 3.16Å; W217-Q225 HydrophobicContact CB-CG 4.18Å; W217-Q225 HydrophobicContact CE3-CG 4.25Å; W217-Q225 WeakPolarHBondContact O-CG 3.3Å; H223-Q225 PolarHBondContact O-NE2 3.34Å; H223-Q225 VanDerWaalsContact O-NE2 3.13Å; Q225-V287 HydrophobicContact CB-CG1 3.59Å; Q225-V287 WeakPolarHBondContact O-CG1 3.44Å; Q225-I288 PolarHBondContact OE1-O 3.06Å; Q225-R290 PolarHBondContact NE2-O 3.33Å; Q225-R290 VanDerWaalsContact OE1-N 3.13Å
226	E	98.8	Very high	98.4	Very high	43 Å²	43	35.9 Å²	35.9	20%	0.201	19%	0.191	C	C	.	.			trans	-82.3	146.6	-168.2	-65.6	178.5	-129.9	0	0	113.1	P224 C231 V287 I288 H307	P224-E226 HydrophobicContact CB-CG 4.19Å; P224-E226 HydrophobicContact CG-CG 4.1Å; P224-E226 PolarHBondContact O-N 3.34Å; E226-C231 HydrophobicContact CB-CB 3.93Å; E226-V287 CarbonylContact O-C 3.58Å; E226-V287 WeakPolarHBondContact O-CA 3.28Å; E226-I288 PolarHBondContact O-N 3.33Å; E226-H307 IonicContact OE1-CD2 2.64Å; E226-H307 IonicContact OE1-CE1 2.56Å; E226-H307 IonicContact OE1-NE2 2.63Å; E226-H307 PolarHBondContact OE1-NE2 3.21Å; E226-H307 IonicContact OE2-CD2 3.88Å; E226-H307 IonicContact OE2-CE1 3.38Å; E226-H307 IonicContact OE2-NE2 3.44Å; E226-H307 PolarHBondContact OE2-NE2 3.11Å
227	E	98.8	Very high	98.4	Very high	5 Å²	5	38.8 Å²	38.8	2%	0.023	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-64	135.6	171.4	-156.4	-78	161.1	0	0	110.4	R206 K208 H210 V211 L229 D230 C231	R206-E227 IonicContact CZ-OE1 3.5Å; R206-E227 IonicContact CZ-OE2 3.64Å; R206-E227 VanDerWaalsContact NH1-CD 3.34Å; R206-E227 IonicContact NH1-OE1 2.84Å; R206-E227 IonicContact NH1-OE2 3.9Å; R206-E227 PolarHBondContact NH1-OE2 3.28Å; R206-E227 VanDerWaalsContact NH2-CD 3.34Å; R206-E227 IonicContact NH2-OE1 3.86Å; R206-E227 PolarHBondContact NH2-OE1 3.47Å; R206-E227 IonicContact NH2-OE2 2.64Å; R206-E227 PolarHBondContact NH2-OE2 2.69Å; K208-E227 HydrophobicContact CD-CG 4.18Å; H210-E227 IonicContact CE1-OE1 3.58Å; H210-E227 WeakPolarHBondContact NE2-CG 3.31Å; H210-E227 IonicContact NE2-OE1 2.76Å; H210-E227 PolarHBondContact NE2-OE1 3.39Å; V211-E227 HydrophobicContact CG2-CB 3.98Å; V211-E227 HydrophobicContact CG2-CG 3.68Å; E227-L229 VanDerWaalsContact C-N 3.33Å; E227-L229 PolarHBondContact O-N 3.38Å; E227-L229 WeakPolarHBondContact OE2-CB 3.3Å; E227-L229 PolarHBondContact OE2-N 3.31Å; E227-D230 HydrophobicContact CB-CB 4.42Å; E227-D230 PolarHBondContact O-N 3.08Å; E227-D230 VanDerWaalsContact O-N 3.15Å; E227-D230 PolarHBondContact OE2-N 2.78Å; E227-C231 WeakPolarHBondContact O-CB 3.17Å; E227-C231 PolarHBondContact O-N 3.31Å
228	Y	98.8	Very high	98.4	Very high	10 Å²	10	42.4 Å²	42.4	4%	0.039	22%	0.22	C	C	.	.	H	α-helix	trans	-61.7	-33.5	-165.3	80	-68.5	0	0	0	115.1	D167 Y171 L232 P285 R286	D167-Y228 WeakPolarHBondContact CB-OH 3.23Å; Y171-Y228 AromaticContact CD2-CD2 3.67Å; Y171-Y228 HydrophobicContact CD2-CD2 3.67Å; Y171-Y228 AromaticContact CD2-CE2 3.49Å; Y171-Y228 HydrophobicContact CD2-CE2 3.49Å; Y171-Y228 VanDerWaalsContact CD2-CE2 3.49Å; Y171-Y228 AromaticContact CE2-CD2 4Å; Y171-Y228 HydrophobicContact CE2-CD2 4Å; Y171-Y228 HydrophobicContact CE2-CE2 4.19Å; Y171-Y228 HydrophobicContact CG-CD2 4.46Å; Y171-Y228 AromaticContact CG-CE2 3.85Å; Y171-Y228 HydrophobicContact CG-CE2 3.85Å; Y228-L232 WeakPolarHBondContact O-CB 3.31Å; Y228-L232 PolarHBondContact O-N 3.3Å; Y228-P285 HydrophobicContact CD1-CB 4.44Å; Y228-P285 HydrophobicContact CE1-CB 3.91Å; Y228-R286 WeakPolarHBondContact CB-O 3.31Å; Y228-R286 HydrophobicContact CD1-CB 4.26Å; Y228-R286 VanDerWaalsContact CD1-N 3.29Å; Y228-R286 VanDerWaalsContact CD1-O 3.28Å; Y228-R286 WeakPolarHBondContact CD1-O 3.31Å; Y228-R286 HydrophobicContact CG-CB 4.11Å; Y228-R286 PolarHBondContact N-O 2.9Å
229	L	98.9	Very high	98.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-79.3	-34.6	177.8	-82.7	175.6	0	0	0	111.8	D167 V170 Y171 L174 L203 E227 W233	D167-L229 HydrophobicContact CB-CD1 3.8Å; D167-L229 WeakPolarHBondContact OD1-CD1 3.46Å; V170-L229 HydrophobicContact CG1-CD2 4.06Å; Y171-L229 HydrophobicContact CD2-CD2 4.36Å; L174-L229 HydrophobicContact CD1-CD2 4.2Å; L203-L229 HydrophobicContact CD2-CB 3.96Å; L203-L229 HydrophobicContact CD2-CD1 4.25Å; E227-L229 VanDerWaalsContact C-N 3.33Å; E227-L229 PolarHBondContact O-N 3.38Å; E227-L229 WeakPolarHBondContact OE2-CB 3.3Å; E227-L229 PolarHBondContact OE2-N 3.31Å; L229-W233 WeakPolarHBondContact O-CB 3.26Å; L229-W233 PolarHBondContact O-N 3.37Å
230	D	98.8	Very high	98.5	Very high	56 Å²	56	40.4 Å²	40.4	30%	0.299	20%	0.2	S	C	.	.	H	α-helix	trans	-64.6	-45.2	173.8	-63.5	-24.3	0	0	0	110.7	R206 K208 E227 W233 A234	R206-D230 IonicContact NH1-OD1 2.77Å; K208-D230 IonicContact NZ-OD1 3.14Å; K208-D230 PolarHBondContact NZ-OD1 2.93Å; K208-D230 IonicContact NZ-OD2 3.28Å; K208-D230 PolarHBondContact NZ-OD2 2.88Å; E227-D230 HydrophobicContact CB-CB 4.42Å; E227-D230 PolarHBondContact O-N 3.08Å; E227-D230 VanDerWaalsContact O-N 3.15Å; E227-D230 PolarHBondContact OE2-N 2.78Å; D230-W233 PolarHBondContact O-N 2.83Å; D230-A234 PolarHBondContact O-N 2.57Å
231	C	98.9	Very high	98.6	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.014	21%	0.208	C	C	.	.	H	α-helix	trans	-63.2	-47.3	177.4	-175.3	0	0	0	0	111.2	E226 E227 W233 A234 Q235 I288	E226-C231 HydrophobicContact CB-CB 3.93Å; E227-C231 WeakPolarHBondContact O-CB 3.17Å; E227-C231 PolarHBondContact O-N 3.31Å; C231-W233 VanDerWaalsContact C-N 3.33Å; C231-W233 PolarHBondContact O-N 2.82Å; C231-A234 PolarHBondContact O-N 3.35Å; C231-Q235 VanDerWaalsContact O-CG 3.27Å; C231-Q235 WeakPolarHBondContact O-CG 3.43Å; C231-Q235 PolarHBondContact O-N 2.6Å; C231-I288 HydrophobicContact CB-CG1 3.9Å
232	L	98.9	Very high	98.6	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.016	19%	0.188	C	C	.	.	H	α-helix	trans	-63.4	-39.4	177.1	-177.9	60	0	0	0	111.8	Y171 L174 Y228 Q235 I236 F312	Y171-L232 HydrophobicContact CD2-CD2 3.63Å; Y171-L232 HydrophobicContact CE2-CD2 3.84Å; L174-L232 HydrophobicContact CB-CD2 3.59Å; L174-L232 HydrophobicContact CB-CG 3.91Å; L174-L232 HydrophobicContact CD1-CD2 4.45Å; L174-L232 HydrophobicContact CD1-CG 4.48Å; Y228-L232 WeakPolarHBondContact O-CB 3.31Å; Y228-L232 PolarHBondContact O-N 3.3Å; L232-Q235 WeakPolarHBondContact O-CB 3.33Å; L232-Q235 PolarHBondContact O-N 3.48Å; L232-I236 HydrophobicContact CD1-CD1 4.44Å; L232-I236 HydrophobicContact CD1-CG1 4.33Å; L232-I236 HydrophobicContact CG-CG1 4.49Å; L232-I236 WeakPolarHBondContact O-CG1 3.25Å; L232-I236 PolarHBondContact O-N 2.75Å; L232-F312 HydrophobicContact CD1-CD1 4.23Å; L232-F312 HydrophobicContact CD1-CD2 4.08Å; L232-F312 HydrophobicContact CD1-CE1 4.29Å; L232-F312 HydrophobicContact CD1-CE2 4.14Å; L232-F312 HydrophobicContact CD1-CG 4.15Å; L232-F312 HydrophobicContact CD1-CZ 4.26Å
233	W	98.9	Very high	98.7	Very high	35 Å²	35	43.6 Å²	43.6	13%	0.133	20%	0.201	C	C	.	.	H	α-helix	trans	-60.4	-46.6	174.5	177	-115.1	0	0	0	111.8	L174 L196 I199 E200 L203 L229 D230 C231 Q235 I236 Q237	L174-W233 HydrophobicContact CD1-CE3 4.37Å; L174-W233 HydrophobicContact CD2-CE3 3.89Å; L174-W233 HydrophobicContact CD2-CZ3 4.1Å; L196-W233 HydrophobicContact CB-CH2 4.25Å; L196-W233 HydrophobicContact CD2-CH2 4.4Å; L196-W233 HydrophobicContact CD2-CZ3 3.92Å; L196-W233 WeakPolarHBondContact O-CH2 3.38Å; I199-W233 HydrophobicContact CB-CZ3 4.46Å; I199-W233 HydrophobicContact CG2-CE3 4.08Å; I199-W233 HydrophobicContact CG2-CZ3 3.98Å; E200-W233 HydrophobicContact CB-CH2 4.06Å; E200-W233 HydrophobicContact CB-CZ2 3.71Å; E200-W233 HydrophobicContact CG-CZ2 3.86Å; L203-W233 HydrophobicContact CD1-CB 3.61Å; L203-W233 HydrophobicContact CD1-CD2 3.7Å; L203-W233 HydrophobicContact CD1-CE3 3.99Å; L203-W233 HydrophobicContact CD1-CG 3.52Å; L229-W233 WeakPolarHBondContact O-CB 3.26Å; L229-W233 PolarHBondContact O-N 3.37Å; D230-W233 PolarHBondContact O-N 2.83Å; C231-W233 VanDerWaalsContact C-N 3.33Å; C231-W233 PolarHBondContact O-N 2.82Å; W233-Q235 VanDerWaalsContact C-N 3.27Å; W233-Q235 PolarHBondContact O-N 3.32Å; W233-I236 PolarHBondContact O-N 2.94Å; W233-Q237 HydrophobicContact CD2-CG 3.9Å; W233-Q237 HydrophobicContact CE3-CG 4.44Å; W233-Q237 HydrophobicContact CG-CG 4.33Å; W233-Q237 HydrophobicContact CH2-CG 4.32Å; W233-Q237 HydrophobicContact CZ2-CG 3.75Å; W233-Q237 WeakPolarHBondContact O-CB 3.22Å; W233-Q237 VanDerWaalsContact O-CG 3.24Å; W233-Q237 WeakPolarHBondContact O-CG 3.05Å; W233-Q237 PolarHBondContact O-N 3.37Å
234	A	98.9	Very high	98.7	Very high	28 Å²	28	43.7 Å²	43.7	23%	0.231	20%	0.201	C	C	.	.	H	α-helix	trans	-58.8	-39.9	175.5	0	0	0	0	0	112	D230 C231 Q237 K238 H307	D230-A234 PolarHBondContact O-N 2.57Å; C231-A234 PolarHBondContact O-N 3.35Å; A234-Q237 PolarHBondContact O-N 2.89Å; A234-K238 PolarHBondContact O-N 2.98Å; A234-H307 HydrophobicContact CB-CB 4.27Å
235	Q	98.9	Very high	98.7	Very high	5 Å²	5	46.3 Å²	46.3	2%	0.023	21%	0.209	C	C	.	.	H	α-helix	trans	-63.2	-44.9	175.4	-67.5	163.4	-11.2	0	0	112.6	C231 L232 W233 K238 L239 S306 H307 F312	C231-Q235 VanDerWaalsContact O-CG 3.27Å; C231-Q235 WeakPolarHBondContact O-CG 3.43Å; C231-Q235 PolarHBondContact O-N 2.6Å; L232-Q235 WeakPolarHBondContact O-CB 3.33Å; L232-Q235 PolarHBondContact O-N 3.48Å; W233-Q235 VanDerWaalsContact C-N 3.27Å; W233-Q235 PolarHBondContact O-N 3.32Å; Q235-K238 PolarHBondContact O-N 3.26Å; Q235-L239 WeakPolarHBondContact O-CB 3.22Å; Q235-L239 PolarHBondContact O-N 3.39Å; Q235-S306 PolarHBondContact NE2-O 2.84Å; Q235-H307 WeakPolarHBondContact CA-O 3.5Å; Q235-H307 VanDerWaalsContact CG-C 3.48Å; Q235-F312 VanDerWaalsContact OE1-CB 3.3Å
236	I	98.9	Very high	98.6	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-67.4	-39.7	177	-65.2	-44.2	0	0	0	111.5	L174 L177 P178 L196 L232 W233 K238 L239 K240 W244	L174-I236 HydrophobicContact CB-CG1 4.26Å; L174-I236 HydrophobicContact CD2-CB 4.41Å; L174-I236 HydrophobicContact CD2-CG1 4.13Å; L174-I236 HydrophobicContact CD2-CG2 4.25Å; L174-I236 WeakPolarHBondContact O-CD1 3.36Å; L177-I236 HydrophobicContact CB-CD1 3.94Å; L177-I236 HydrophobicContact CD1-CD1 4.5Å; L177-I236 HydrophobicContact CD1-CG1 4.34Å; L177-I236 HydrophobicContact CD1-CG2 3.59Å; P178-I236 HydrophobicContact CG-CD1 4.17Å; L196-I236 HydrophobicContact CD2-CG2 4.46Å; L232-I236 HydrophobicContact CD1-CD1 4.44Å; L232-I236 HydrophobicContact CD1-CG1 4.33Å; L232-I236 HydrophobicContact CG-CG1 4.49Å; L232-I236 WeakPolarHBondContact O-CG1 3.25Å; L232-I236 PolarHBondContact O-N 2.75Å; W233-I236 PolarHBondContact O-N 2.94Å; I236-K238 VanDerWaalsContact C-N 3.33Å; I236-K238 PolarHBondContact O-N 2.92Å; I236-L239 HydrophobicContact CD1-CD2 4.35Å; I236-L239 WeakPolarHBondContact O-CB 3.47Å; I236-L239 PolarHBondContact O-N 3.48Å; I236-K240 WeakPolarHBondContact O-CB 3.23Å; I236-K240 PolarHBondContact O-N 2.84Å; I236-W244 HydrophobicContact CG2-CH2 4.4Å; I236-W244 HydrophobicContact CG2-CZ3 4.32Å
237	Q	98.8	Very high	98.4	Very high	69 Å²	69	52.8 Å²	52.8	32%	0.322	23%	0.232	S	C	.	.	H	α-helix	trans	-63.6	-39.8	176.1	-70.6	-68.9	86.5	0	0	111.5	W233 A234 K241	W233-Q237 HydrophobicContact CD2-CG 3.9Å; W233-Q237 HydrophobicContact CE3-CG 4.44Å; W233-Q237 HydrophobicContact CG-CG 4.33Å; W233-Q237 HydrophobicContact CH2-CG 4.32Å; W233-Q237 HydrophobicContact CZ2-CG 3.75Å; W233-Q237 WeakPolarHBondContact O-CB 3.22Å; W233-Q237 VanDerWaalsContact O-CG 3.24Å; W233-Q237 WeakPolarHBondContact O-CG 3.05Å; W233-Q237 PolarHBondContact O-N 3.37Å; A234-Q237 PolarHBondContact O-N 2.89Å; Q237-K241 WeakPolarHBondContact O-CB 3.43Å; Q237-K241 PolarHBondContact O-N 2.63Å
238	K	98.7	Very high	98.3	Very high	84 Å²	84	52.8 Å²	52.8	37%	0.365	23%	0.232	S	C	.	.	H	α-helix	trans	-63.1	-46.8	171.1	175.6	167.2	166.3	46.5	0	111.5	A234 Q235 I236 K240 K241 D242 H307	A234-K238 PolarHBondContact O-N 2.98Å; Q235-K238 PolarHBondContact O-N 3.26Å; I236-K238 VanDerWaalsContact C-N 3.33Å; I236-K238 PolarHBondContact O-N 2.92Å; K238-K240 VanDerWaalsContact C-N 3.34Å; K238-K240 PolarHBondContact O-N 3.16Å; K238-K241 WeakPolarHBondContact O-CB 3.26Å; K238-K241 PolarHBondContact O-N 3.21Å; K238-D242 IonicContact NZ-OD1 2.88Å; K238-D242 IonicContact NZ-OD2 3.56Å; K238-D242 PolarHBondContact NZ-OD2 2.75Å; K238-D242 WeakPolarHBondContact O-CB 3.33Å; K238-D242 VanDerWaalsContact O-CG 3.31Å; K238-D242 PolarHBondContact O-N 3.33Å; K238-H307 WeakPolarHBondContact CD-O 3.28Å
239	L	98.8	Very high	98.2	Very high	7 Å²	7	52.8 Å²	52.8	4%	0.037	23%	0.233	C	C	.	.	H	α-helix	trans	-58.4	-44.7	178	179.6	61.6	0	0	0	111.7	P178 Q235 I236 D242 R243 W244 E246 A309	P178-L239 HydrophobicContact CB-CD2 4.5Å; Q235-L239 WeakPolarHBondContact O-CB 3.22Å; Q235-L239 PolarHBondContact O-N 3.39Å; I236-L239 HydrophobicContact CD1-CD2 4.35Å; I236-L239 WeakPolarHBondContact O-CB 3.47Å; I236-L239 PolarHBondContact O-N 3.48Å; L239-D242 CarbonylContact O-C 3.57Å; L239-D242 PolarHBondContact O-N 3.4Å; L239-R243 PolarHBondContact O-N 3.27Å; L239-W244 HydrophobicContact CD2-CE3 3.95Å; L239-W244 HydrophobicContact CD2-CZ3 4.34Å; L239-W244 HydrophobicContact CG-CE3 3.95Å; L239-W244 VanDerWaalsContact O-CA 3.32Å; L239-W244 WeakPolarHBondContact O-CA 3.04Å; L239-W244 PolarHBondContact O-N 3.46Å; L239-E246 HydrophobicContact CD1-CB 4.01Å; L239-A309 HydrophobicContact CB-CB 4.3Å; L239-A309 HydrophobicContact CD1-CB 4.44Å; L239-A309 HydrophobicContact CD2-CB 4.16Å
240	K	98.6	Very high	98.1	Very high	55 Å²	55	56.1 Å²	56.1	24%	0.239	25%	0.25	C	S	.	.	H	α-helix	trans	-60.4	-46.5	174.6	-178.3	179.8	-177.7	177.5	0	111.6	D193 L196 I236 K238 D242 R243 W244	D193-K240 WeakPolarHBondContact OD1-CE 3.26Å; D193-K240 IonicContact OD1-NZ 2.64Å; D193-K240 PolarHBondContact OD1-NZ 2.98Å; L196-K240 HydrophobicContact CD1-CD 3.96Å; I236-K240 WeakPolarHBondContact O-CB 3.23Å; I236-K240 PolarHBondContact O-N 2.84Å; K238-K240 VanDerWaalsContact C-N 3.34Å; K238-K240 PolarHBondContact O-N 3.16Å; K240-D242 PolarHBondContact O-N 2.9Å; K240-R243 WeakPolarHBondContact O-CA 3.49Å; K240-R243 PolarHBondContact O-N 3.41Å; K240-W244 HydrophobicContact CB-CH2 4.26Å; K240-W244 HydrophobicContact CB-CZ2 4.01Å; K240-W244 HydrophobicContact CD-CZ2 4.26Å; K240-W244 HydrophobicContact CG-CZ2 3.9Å
241	K	98.5	Very high	98	Very high	175 Å²	175	55.7 Å²	55.7	76%	0.761	25%	0.245	S	C	*	.	H	α-helix	trans	-58.4	-36.6	175.9	-177.9	-178.2	178.2	-179.3	0	111.9	Q237 K238 R243	Q237-K241 WeakPolarHBondContact O-CB 3.43Å; Q237-K241 PolarHBondContact O-N 2.63Å; K238-K241 WeakPolarHBondContact O-CB 3.26Å; K238-K241 PolarHBondContact O-N 3.21Å; K241-R243 PolarHBondContact O-N 3.08Å
242	D	98.4	Very high	98	Very high	67 Å²	67	56.2 Å²	56.2	36%	0.358	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	20.1	176.5	-62.8	-16.4	0	0	0	112.5	K238 L239 K240 W244 Q245	K238-D242 IonicContact NZ-OD1 2.88Å; K238-D242 IonicContact NZ-OD2 3.56Å; K238-D242 PolarHBondContact NZ-OD2 2.75Å; K238-D242 WeakPolarHBondContact O-CB 3.33Å; K238-D242 VanDerWaalsContact O-CG 3.31Å; K238-D242 PolarHBondContact O-N 3.33Å; L239-D242 CarbonylContact O-C 3.57Å; L239-D242 PolarHBondContact O-N 3.4Å; K240-D242 PolarHBondContact O-N 2.9Å; D242-W244 VanDerWaalsContact C-N 3.3Å; D242-W244 PolarHBondContact O-N 3.43Å; D242-Q245 WeakPolarHBondContact O-CB 3.36Å; D242-Q245 PolarHBondContact O-N 2.91Å
243	R	98.3	Very high	97.9	Very high	207 Å²	207	56.8 Å²	56.8	78%	0.781	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.6	41.7	178.3	-54.5	-179.9	-179	-178.6	-1	113	L239 K240 K241 Q245	L239-R243 PolarHBondContact O-N 3.27Å; K240-R243 WeakPolarHBondContact O-CA 3.49Å; K240-R243 PolarHBondContact O-N 3.41Å; K241-R243 PolarHBondContact O-N 3.08Å; R243-Q245 PolarHBondContact O-N 3.22Å; R243-Q245 VanDerWaalsContact O-N 3.12Å; R243-Q245 PolarHBondContact O-NE2 3.01Å
244	W	98.4	Very high	97.8	Very high	17 Å²	17	60.3 Å²	60.3	6%	0.064	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	26.1	180	-52.6	98.2	0	0	0	113.7	L177 K182 Y185 L196 I236 L239 K240 D242	L177-W244 HydrophobicContact CB-CZ3 3.98Å; L177-W244 HydrophobicContact CD1-CH2 4.2Å; L177-W244 HydrophobicContact CD1-CZ3 4.18Å; L177-W244 HydrophobicContact CG-CZ3 4.47Å; K182-W244 HydrophobicContact CB-CB 3.63Å; K182-W244 HydrophobicContact CB-CG 4.47Å; K182-W244 HydrophobicContact CG-CB 4.1Å; Y185-W244 VanDerWaalsContact CB-NE1 3.35Å; Y185-W244 AromaticContact CD1-CD1 3.95Å; Y185-W244 AromaticContact CD1-NE1 3.33Å; Y185-W244 VanDerWaalsContact CD1-NE1 3.33Å; Y185-W244 AromaticContact CD2-CZ2 3.82Å; Y185-W244 HydrophobicContact CD2-CZ2 3.82Å; Y185-W244 AromaticContact CD2-NE1 3.69Å; Y185-W244 HydrophobicContact CE2-CZ2 4.46Å; Y185-W244 AromaticContact CG-CE2 3.82Å; Y185-W244 HydrophobicContact CG-CZ2 4.1Å; Y185-W244 AromaticContact CG-NE1 3.14Å; L196-W244 HydrophobicContact CD1-CH2 4.2Å; L196-W244 HydrophobicContact CD1-CZ2 4.24Å; I236-W244 HydrophobicContact CG2-CH2 4.4Å; I236-W244 HydrophobicContact CG2-CZ3 4.32Å; L239-W244 HydrophobicContact CD2-CE3 3.95Å; L239-W244 HydrophobicContact CD2-CZ3 4.34Å; L239-W244 HydrophobicContact CG-CE3 3.95Å; L239-W244 VanDerWaalsContact O-CA 3.32Å; L239-W244 WeakPolarHBondContact O-CA 3.04Å; L239-W244 PolarHBondContact O-N 3.46Å; K240-W244 HydrophobicContact CB-CH2 4.26Å; K240-W244 HydrophobicContact CB-CZ2 4.01Å; K240-W244 HydrophobicContact CD-CZ2 4.26Å; K240-W244 HydrophobicContact CG-CZ2 3.9Å; D242-W244 VanDerWaalsContact C-N 3.3Å; D242-W244 PolarHBondContact O-N 3.43Å
245	Q	97.6	Very high	97.7	Very high	100 Å²	100	62 Å²	62	47%	0.467	28%	0.284	S	S	.	.			trans	-95.1	123.5	174.8	-60.2	-53.4	-53.2	0	0	110.2	D242 R243	D242-Q245 WeakPolarHBondContact O-CB 3.36Å; D242-Q245 PolarHBondContact O-N 2.91Å; R243-Q245 PolarHBondContact O-N 3.22Å; R243-Q245 VanDerWaalsContact O-N 3.12Å; R243-Q245 PolarHBondContact O-NE2 3.01Å
246	E	96.6	Very high	97.6	Very high	13 Å²	13	62.6 Å²	62.6	6%	0.061	29%	0.287	C	S	.	.			trans	-120.7	162.3	171	58.4	71.1	-140.6	0	0	110.6	L239 H248 I249 R251 E310	L239-E246 HydrophobicContact CD1-CB 4.01Å; E246-H248 PolarHBondContact OE2-N 3.3Å; E246-I249 HydrophobicContact CG-CD1 4.16Å; E246-I249 PolarHBondContact OE2-N 2.87Å; E246-R251 IonicContact OE1-CZ 3.68Å; E246-R251 IonicContact OE1-NE 3.27Å; E246-R251 PolarHBondContact OE1-NE 2.87Å; E246-R251 IonicContact OE1-NH2 2.77Å; E246-R251 PolarHBondContact OE1-NH2 3.46Å; E246-E310 WeakPolarHBondContact CA-OE1 3.41Å
247	R	94.8	Very high	97.3	Very high	170 Å²	170	67 Å²	67	64%	0.642	31%	0.311	S	S	*	.	S	Bend	trans	-115	9.7	-168	-66.3	-174.8	68.3	173.4	1.7	114.5	E310 N343	R247-E310 HydrophobicContact CB-CG 4.38Å; R247-E310 PolarHBondContact N-OE1 2.96Å; R247-N343 PolarHBondContact O-ND2 3Å
248	H	96.4	Very high	97	Very high	5 Å²	5	68.1 Å²	68.1	2%	0.023	33%	0.325	C	S	.	.	S	Bend	trans	-123.9	-44.2	-167.8	-170.8	59.6	0	0	0	115.3	E246 L250 E310 I314 Y339 K342	E246-H248 PolarHBondContact OE2-N 3.3Å; H248-L250 PolarHBondContact O-N 3.31Å; H248-E310 HydrophobicContact CB-CB 3.94Å; H248-E310 HydrophobicContact CB-CG 3.65Å; H248-I314 VanDerWaalsContact CD2-CG1 3.49Å; H248-I314 WeakPolarHBondContact CD2-CG1 3.47Å; H248-I314 VanDerWaalsContact NE2-CG1 3.3Å; H248-I314 WeakPolarHBondContact NE2-CG1 3.35Å; H248-Y339 AromaticContact CE1-CE1 3.67Å; H248-Y339 AromaticContact NE2-CE1 3.36Å; H248-Y339 WeakPolarHBondContact NE2-CE1 3.47Å; H248-Y339 AromaticContact NE2-CZ 3.38Å; H248-Y339 PolarHBondContact NE2-OH 3.45Å; H248-K342 VanDerWaalsContact O-CB 3.29Å; H248-K342 WeakPolarHBondContact O-CB 3.44Å; H248-K342 PolarHBondContact O-N 3.33Å
249	I	97.3	Very high	96.8	Very high	9 Å²	9	66.8 Å²	66.8	5%	0.046	33%	0.325	C	S	.	.			trans	-61.5	128.4	-173.5	-61.8	165.8	0	0	0	110.1	T84 P178 W179 E246 R251 V313	T84-I249 HydrophobicContact CG2-CG2 3.97Å; P178-I249 HydrophobicContact CB-CD1 4Å; P178-I249 VanDerWaalsContact O-CD1 3.25Å; P178-I249 WeakPolarHBondContact O-CD1 3.37Å; W179-I249 HydrophobicContact CD2-CD1 3.98Å; W179-I249 HydrophobicContact CG-CD1 4.09Å; W179-I249 HydrophobicContact CZ2-CD1 4.47Å; E246-I249 HydrophobicContact CG-CD1 4.16Å; E246-I249 PolarHBondContact OE2-N 2.87Å; I249-R251 HydrophobicContact CG2-CG 3.88Å; I249-V313 HydrophobicContact CD1-CG2 4.18Å; I249-V313 HydrophobicContact CG1-CG1 3.85Å; I249-V313 HydrophobicContact CG1-CG2 4.32Å
250	L	96.4	Very high	96.6	Very high	70 Å²	70	66.6 Å²	66.6	37%	0.366	32%	0.323	S	S	.	.			trans	-81.7	129.1	169.3	-67.7	175.5	0	0	0	109.4	T84 H248 P252 P340 K342	T84-L250 WeakPolarHBondContact CB-O 3.21Å; T84-L250 WeakPolarHBondContact CG2-O 3.32Å; T84-L250 PolarHBondContact OG1-O 3.06Å; H248-L250 PolarHBondContact O-N 3.31Å; L250-P252 WeakPolarHBondContact O-CD 3.3Å; L250-P340 HydrophobicContact CD1-CB 3.66Å; L250-P340 HydrophobicContact CD1-CG 4.02Å; L250-K342 HydrophobicContact CD2-CB 4.04Å
251	R	97.6	Very high	96.3	Very high	48 Å²	48	67.3 Å²	67.3	18%	0.181	34%	0.335	C	S	.	.			trans	-126.4	78.8	-172.3	-62.7	-179.5	-171.6	-95.5	3.9	110.1	P178 W179 E246 I249 Y253 I254	P178-R251 PolarHBondContact O-NH2 3.36Å; W179-R251 PolarHBondContact O-NH1 2.9Å; E246-R251 IonicContact OE1-CZ 3.68Å; E246-R251 IonicContact OE1-NE 3.27Å; E246-R251 PolarHBondContact OE1-NE 2.87Å; E246-R251 IonicContact OE1-NH2 2.77Å; E246-R251 PolarHBondContact OE1-NH2 3.46Å; I249-R251 HydrophobicContact CG2-CG 3.88Å; R251-Y253 HydrophobicContact CB-CD2 4.29Å; R251-Y253 HydrophobicContact CB-CE1 4.05Å; R251-Y253 HydrophobicContact CB-CE2 3.69Å; R251-Y253 WeakPolarHBondContact CD-OH 3.42Å; R251-Y253 HydrophobicContact CG-CE1 4.36Å; R251-Y253 HydrophobicContact CG-CE2 4.16Å; R251-Y253 WeakPolarHBondContact CG-OH 3.44Å; R251-Y253 PolarHBondContact NH1-OH 3.18Å; R251-Y253 PolarHBondContact O-N 2.85Å; R251-I254 HydrophobicContact CB-CD1 3.65Å; R251-I254 HydrophobicContact CB-CG1 3.91Å; R251-I254 HydrophobicContact CG-CD1 4.45Å; R251-I254 PolarHBondContact O-N 3.43Å; R251-I254 VanDerWaalsContact O-N 3.15Å
252	P	97.7	Very high	96	Very high	13 Å²	13	67 Å²	67	8%	0.084	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-58.8	-32.8	-173.4	-23.1	33.8	0	0	0	113.3	L46 L50 T88 L250 I254 A255 F256	L46-P252 HydrophobicContact CD2-CB 4.17Å; L46-P252 HydrophobicContact CD2-CG 3.8Å; L50-P252 HydrophobicContact CD1-CB 3.96Å; T88-P252 HydrophobicContact CG2-CB 4.21Å; L250-P252 WeakPolarHBondContact O-CD 3.3Å; P252-I254 PolarHBondContact O-N 2.84Å; P252-I254 VanDerWaalsContact O-N 3.09Å; P252-A255 WeakPolarHBondContact O-CB 3.37Å; P252-A255 PolarHBondContact O-N 3.01Å; P252-F256 WeakPolarHBondContact O-CD2 3.36Å
253	Y	97.9	Very high	95.7	Very high	14 Å²	14	64.5 Å²	64.5	6%	0.055	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-55.1	-24.3	176.7	48.3	-103.6	0	0	0	114.8	T84 T88 D133 N136 C137 R251 A255 F256	T84-Y253 HydrophobicContact CG2-CE1 4.43Å; T88-Y253 WeakPolarHBondContact OG1-CD1 3.27Å; T88-Y253 PolarHBondContact OG1-N 3.39Å; D133-Y253 WeakPolarHBondContact OD1-CE1 3.37Å; D133-Y253 PolarHBondContact OD1-OH 2.88Å; D133-Y253 WeakPolarHBondContact OD2-CE1 3.49Å; N136-Y253 HydrophobicContact CB-CD2 4.31Å; N136-Y253 HydrophobicContact CB-CE1 4.29Å; N136-Y253 HydrophobicContact CB-CE2 3.61Å; N136-Y253 PolarHBondContact ND2-OH 3.36Å; C137-Y253 WeakPolarHBondContact SG-CD1 3.46Å; R251-Y253 HydrophobicContact CB-CD2 4.29Å; R251-Y253 HydrophobicContact CB-CE1 4.05Å; R251-Y253 HydrophobicContact CB-CE2 3.69Å; R251-Y253 WeakPolarHBondContact CD-OH 3.42Å; R251-Y253 HydrophobicContact CG-CE1 4.36Å; R251-Y253 HydrophobicContact CG-CE2 4.16Å; R251-Y253 WeakPolarHBondContact CG-OH 3.44Å; R251-Y253 PolarHBondContact NH1-OH 3.18Å; R251-Y253 PolarHBondContact O-N 2.85Å; Y253-A255 PolarHBondContact O-N 3.46Å; Y253-F256 PolarHBondContact O-N 3.12Å
254	I	96.6	Very high	95.6	Very high	109 Å²	109	60.3 Å²	60.3	56%	0.559	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-60.9	-31.4	175.8	-63.3	178.6	0	0	0	111.4	R251 P252 F256	R251-I254 HydrophobicContact CB-CD1 3.65Å; R251-I254 HydrophobicContact CB-CG1 3.91Å; R251-I254 HydrophobicContact CG-CD1 4.45Å; R251-I254 PolarHBondContact O-N 3.43Å; R251-I254 VanDerWaalsContact O-N 3.15Å; P252-I254 PolarHBondContact O-N 2.84Å; P252-I254 VanDerWaalsContact O-N 3.09Å; I254-F256 PolarHBondContact O-N 3.04Å
255	A	96.8	Very high	95.6	Very high	63 Å²	63	63.2 Å²	63.2	52%	0.521	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-72.9	-11.9	177.6	0	0	0	0	0	113.4	E47 P252 Y253	E47-A255 HydrophobicContact CG-CB 3.75Å; P252-A255 WeakPolarHBondContact O-CB 3.37Å; P252-A255 PolarHBondContact O-N 3.01Å; Y253-A255 PolarHBondContact O-N 3.46Å
256	F	97	Very high	95.7	Very high	18 Å²	18	59.3 Å²	59.3	8%	0.079	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-114.1	18.9	-176.6	-62.3	-84.9	0	0	0	112.8	E47 L50 E51 T88 L92 P252 Y253 I254 S258 V259 L260	E47-F256 HydrophobicContact CB-CE2 4.02Å; E47-F256 HydrophobicContact CB-CZ 3.68Å; E47-F256 HydrophobicContact CG-CE2 4.12Å; E47-F256 HydrophobicContact CG-CZ 4.28Å; E47-F256 WeakPolarHBondContact O-CZ 3.49Å; L50-F256 HydrophobicContact CB-CZ 4.32Å; L50-F256 HydrophobicContact CD1-CE2 4.36Å; E51-F256 HydrophobicContact CB-CE1 4.27Å; E51-F256 WeakPolarHBondContact OE2-CE1 3.49Å; T88-F256 HydrophobicContact CG2-CD2 3.86Å; T88-F256 HydrophobicContact CG2-CE2 4.04Å; L92-F256 HydrophobicContact CD1-CD1 4.34Å; L92-F256 HydrophobicContact CD1-CE1 4.06Å; L92-F256 HydrophobicContact CD1-CE2 4.46Å; L92-F256 HydrophobicContact CD1-CZ 4.1Å; L92-F256 HydrophobicContact CD2-CB 4.12Å; L92-F256 HydrophobicContact CD2-CD1 3.67Å; L92-F256 HydrophobicContact CD2-CE1 4.17Å; L92-F256 HydrophobicContact CD2-CG 3.92Å; P252-F256 WeakPolarHBondContact O-CD2 3.36Å; Y253-F256 PolarHBondContact O-N 3.12Å; I254-F256 PolarHBondContact O-N 3.04Å; F256-S258 PolarHBondContact O-N 3.41Å; F256-S258 VanDerWaalsContact O-N 3.15Å; F256-V259 PolarHBondContact O-N 3.37Å; F256-L260 HydrophobicContact CB-CD1 4.04Å; F256-L260 HydrophobicContact CB-CG 4.07Å; F256-L260 PolarHBondContact O-N 3.03Å
257	D	92	Very high	95.7	Very high	95 Å²	95	64.4 Å²	64.4	51%	0.508	34%	0.341	S	S	.	.	H	α-helix	trans	-51.2	-41.4	-175.1	-170	55	0	0	0	113.1	V259 L260 C261	D257-V259 VanDerWaalsContact C-N 3.26Å; D257-V259 PolarHBondContact O-N 3.05Å; D257-L260 PolarHBondContact O-N 3.33Å; D257-C261 VanDerWaalsContact O-CB 3.24Å; D257-C261 WeakPolarHBondContact O-CB 3.25Å; D257-C261 PolarHBondContact O-N 2.99Å; D257-C261 PolarHBondContact O-SG 3.13Å; D257-C261 VanDerWaalsContact O-SG 3.39Å; D257-C261 PolarHBondContact OD1-SG 3.5Å; D257-C261 VanDerWaalsContact OD1-SG 3.32Å
258	S	92.7	Very high	95.8	Very high	91 Å²	91	57.2 Å²	57.2	64%	0.636	32%	0.315	S	S	*	.	H	α-helix	trans	-63.1	-29	177.9	60.3	0	0	0	0	114	F256	F256-S258 PolarHBondContact O-N 3.41Å; F256-S258 VanDerWaalsContact O-N 3.15Å
259	V	94.4	Very high	95.7	Very high	57 Å²	57	59.2 Å²	59.2	35%	0.345	33%	0.328	S	S	.	.	H	α-helix	trans	-87.4	-45.3	178.9	-180	0	0	0	0	110.2	L92 A95 F256 D257 E262	L92-V259 HydrophobicContact CD2-CG1 4.28Å; A95-V259 HydrophobicContact CB-CG1 3.9Å; F256-V259 PolarHBondContact O-N 3.37Å; D257-V259 VanDerWaalsContact C-N 3.26Å; D257-V259 PolarHBondContact O-N 3.05Å; V259-E262 PolarHBondContact O-N 3.28Å
260	L	95.4	Very high	95.4	Very high	2 Å²	2	64.3 Å²	64.3	1%	0.01	36%	0.362	C	S	.	.	H	α-helix	trans	-74.3	-32.1	-172.9	-60.9	178.8	0	0	0	112.5	G91 L92 H138 F256 D257 E262 A263	G91-L260 VanDerWaalsContact C-CD2 3.44Å; L92-L260 HydrophobicContact CD2-CD2 4.26Å; H138-L260 VanDerWaalsContact CB-O 3.23Å; H138-L260 WeakPolarHBondContact CB-O 3.48Å; F256-L260 HydrophobicContact CB-CD1 4.04Å; F256-L260 HydrophobicContact CB-CG 4.07Å; F256-L260 PolarHBondContact O-N 3.03Å; D257-L260 PolarHBondContact O-N 3.33Å; L260-E262 VanDerWaalsContact C-N 3.25Å; L260-E262 PolarHBondContact O-N 2.94Å; L260-A263 WeakPolarHBondContact O-CB 3.41Å; L260-A263 PolarHBondContact O-N 2.9Å; L260-A263 VanDerWaalsContact O-N 3.15Å
261	C	91.5	Very high	95.3	Very high	71 Å²	71	61.2 Å²	61.2	48%	0.48	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-27.4	176.1	-80.5	0	0	0	0	113.6	D257 A263	D257-C261 VanDerWaalsContact O-CB 3.24Å; D257-C261 WeakPolarHBondContact O-CB 3.25Å; D257-C261 PolarHBondContact O-N 2.99Å; D257-C261 PolarHBondContact O-SG 3.13Å; D257-C261 VanDerWaalsContact O-SG 3.39Å; D257-C261 PolarHBondContact OD1-SG 3.5Å; D257-C261 VanDerWaalsContact OD1-SG 3.32Å; C261-A263 VanDerWaalsContact C-N 3.34Å
262	E	91.6	Very high	95.1	Very high	168 Å²	168	64.2 Å²	64.2	79%	0.785	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-13.2	177.3	-64	-174.7	174.7	0	0	112.5	V259 L260	V259-E262 PolarHBondContact O-N 3.28Å; L260-E262 VanDerWaalsContact C-N 3.25Å; L260-E262 PolarHBondContact O-N 2.94Å
263	A	93.3	Very high	95	Very high	15 Å²	15	64.3 Å²	64.3	12%	0.124	37%	0.37	C	S	.	.	S	Bend	trans	-72.3	139.8	-179.7	0	0	0	0	0	111.6	A95 L260 C261	A95-A263 HydrophobicContact CB-CB 3.92Å; L260-A263 WeakPolarHBondContact O-CB 3.41Å; L260-A263 PolarHBondContact O-N 2.9Å; L260-A263 VanDerWaalsContact O-N 3.15Å; C261-A263 VanDerWaalsContact C-N 3.34Å
264	L	96.3	Very high	94.8	Very high	119 Å²	119	66.1 Å²	66.1	62%	0.623	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-75.3	137.2	173	-65.1	175.2	0	0	0	110.3	N94 Y98	N94-L264 PolarHBondContact ND2-O 3.36Å; Y98-L264 HydrophobicContact CD2-CB 3.49Å; Y98-L264 VanDerWaalsContact CD2-CB 3.49Å; Y98-L264 HydrophobicContact CD2-CD1 4.39Å; Y98-L264 HydrophobicContact CE2-CB 3.39Å; Y98-L264 HydrophobicContact CE2-CD1 4.47Å; Y98-L264 HydrophobicContact CG-CB 4.48Å
265	Q	98.1	Very high	94.6	Very high	78 Å²	78	63.5 Å²	63.5	36%	0.364	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-88.1	151.1	178.3	-68.6	177.4	-15.3	0	0	111.9	H138 A141	H138-Q265 HydrophobicContact CB-CG 4.46Å; H138-Q265 WeakPolarHBondContact O-CG 3.42Å; A141-Q265 HydrophobicContact CB-CB 4.21Å
266	H	98.5	Very high	94.5	Very high	17 Å²	17	63.6 Å²	63.6	8%	0.079	37%	0.373	C	S	.	.	B	Isolated β-bridge	trans	-102.5	147.7	172.6	-61.8	-87.7	0	0	0	110.9	N94 Y98 G102 V139 I140 A141	N94-H266 PolarHBondContact OD1-CD2 3.13Å; N94-H266 PolarHBondContact OD1-NE2 3.21Å; Y98-H266 AromaticContact CD1-CE1 3.85Å; Y98-H266 AromaticContact CD2-CE1 3.43Å; Y98-H266 VanDerWaalsContact CD2-CE1 3.43Å; Y98-H266 WeakPolarHBondContact CD2-CE1 3.48Å; Y98-H266 AromaticContact CD2-NE2 3.32Å; Y98-H266 VanDerWaalsContact CD2-NE2 3.32Å; Y98-H266 WeakPolarHBondContact CD2-NE2 3.48Å; Y98-H266 AromaticContact CE1-CE1 3.55Å; Y98-H266 AromaticContact CE2-CD2 3.9Å; Y98-H266 AromaticContact CE2-CE1 3.12Å; Y98-H266 WeakPolarHBondContact CE2-CE1 3.44Å; Y98-H266 AromaticContact CE2-ND1 3.7Å; Y98-H266 AromaticContact CE2-NE2 3.27Å; Y98-H266 VanDerWaalsContact CE2-NE2 3.27Å; Y98-H266 WeakPolarHBondContact CE2-NE2 3.44Å; Y98-H266 AromaticContact CG-CE1 3.81Å; Y98-H266 AromaticContact CG-NE2 3.99Å; Y98-H266 AromaticContact CZ-CE1 3.19Å; Y98-H266 AromaticContact CZ-ND1 3.52Å; Y98-H266 AromaticContact CZ-NE2 3.85Å; Y98-H266 PolarHBondContact O-CE1 3.27Å; Y98-H266 PolarHBondContact O-NE2 2.9Å; Y98-H266 VanDerWaalsContact O-NE2 3.15Å; G102-H266 WeakPolarHBondContact CA-CE1 3.35Å; G102-H266 WeakPolarHBondContact CA-ND1 3.08Å; G102-H266 PolarHBondContact N-CE1 3.37Å; G102-H266 PolarHBondContact N-NE2 3.44Å; V139-H266 PolarHBondContact O-CD2 3.48Å; V139-H266 PolarHBondContact O-N 3.24Å; I140-H266 WeakPolarHBondContact CA-O 3.47Å; A141-H266 PolarHBondContact N-O 3.49Å
267	N	98.1	Very high	94.3	Very high	121 Å²	121	68 Å²	68	65%	0.647	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-89.7	137.2	166.7	-72.8	-53.4	0	0	0	109.6
268	L	97.1	Very high	94	Very high	18 Å²	18	69.4 Å²	69.4	9%	0.094	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-61.6	138.5	169.1	-71.1	-176.1	0	0	0	111.3	V105 I109 L131 I140 S144 M145 M148	V105-L268 HydrophobicContact CG1-CD2 3.49Å; V105-L268 VanDerWaalsContact CG1-CD2 3.49Å; I109-L268 HydrophobicContact CD1-CD2 4.13Å; I109-L268 HydrophobicContact CG1-CD2 4.23Å; L131-L268 HydrophobicContact CD2-CD2 4.28Å; I140-L268 HydrophobicContact CD1-CD2 3.82Å; I140-L268 HydrophobicContact CD1-CG 4.49Å; I140-L268 HydrophobicContact CG1-CD2 4.34Å; I140-L268 HydrophobicContact CG2-CD1 4.48Å; I140-L268 HydrophobicContact CG2-CD2 4.33Å; I140-L268 HydrophobicContact CG2-CG 3.93Å; S144-L268 PolarHBondContact OG-N 2.89Å; M145-L268 HydrophobicContact CG-CD1 4.4Å; M145-L268 HydrophobicContact SD-CD1 3.35Å; M145-L268 WeakPolarHBondContact SD-CD1 3.36Å; M145-L268 HydrophobicContact SD-CG 4.37Å; M148-L268 HydrophobicContact CB-CD1 4.29Å; M148-L268 HydrophobicContact SD-CD1 3.71Å
269	P	94	Very high	93.7	Very high	47 Å²	47	70.5 Å²	70.5	31%	0.305	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-55.3	146.1	162.9	-22.4	32.2	0	0	0	110.7	F271	P269-F271 PolarHBondContact O-N 2.83Å
270	P	89.6	Confident	93.5	Very high	117 Å²	117	68.6 Å²	68.6	76%	0.76	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-52.5	125.5	173.6	-26.1	34.3	0	0	0	111.2
271	F	94.1	Very high	93.4	Very high	5 Å²	5	75 Å²	75	2%	0.022	43%	0.429	C	S	.	.			trans	-112.6	119.4	178.8	-175	-80.1	0	0	0	109.8	I109 L112 K113 L116 M148 N151 F152 P269 P273	I109-F271 HydrophobicContact CD1-CD2 4.49Å; I109-F271 HydrophobicContact CG2-CD2 4.32Å; L112-F271 HydrophobicContact CD2-CD2 4.2Å; L112-F271 HydrophobicContact CD2-CE2 3.63Å; L112-F271 HydrophobicContact CD2-CZ 4.01Å; L112-F271 HydrophobicContact CG-CE2 3.94Å; L112-F271 HydrophobicContact CG-CZ 4.25Å; K113-F271 HydrophobicContact CG-CD2 4.45Å; K113-F271 HydrophobicContact CG-CE2 3.82Å; L116-F271 HydrophobicContact CD1-CZ 3.69Å; M148-F271 HydrophobicContact CE-CB 4.35Å; M148-F271 HydrophobicContact CE-CD1 4.26Å; M148-F271 HydrophobicContact CE-CD2 4.06Å; M148-F271 HydrophobicContact CE-CE2 4.45Å; M148-F271 HydrophobicContact CE-CG 3.95Å; M148-F271 HydrophobicContact CG-CB 4.34Å; N151-F271 PolarHBondContact ND2-O 3.45Å; F152-F271 HydrophobicContact CD1-CD1 4.36Å; F152-F271 HydrophobicContact CD1-CE1 4.36Å; F152-F271 AromaticContact CE1-CD1 3.53Å; F152-F271 HydrophobicContact CE1-CD1 3.53Å; F152-F271 AromaticContact CE1-CE1 3.42Å; F152-F271 HydrophobicContact CE1-CE1 3.42Å; F152-F271 VanDerWaalsContact CE1-CE1 3.42Å; F152-F271 HydrophobicContact CE1-CG 4.49Å; F152-F271 HydrophobicContact CE1-CZ 4.32Å; F152-F271 HydrophobicContact CZ-CD1 4.41Å; F152-F271 HydrophobicContact CZ-CE1 4.07Å; P269-F271 PolarHBondContact O-N 2.83Å; F271-P273 HydrophobicContact CE1-CG 4.46Å
272	T	94.8	Very high	93.6	Very high	111 Å²	111	72 Å²	72	68%	0.681	41%	0.407	S	S	*	.			trans	-105.1	125.5	169.7	-51.6	0	0	0	0	108.1
273	P	95.1	Very high	93.9	Very high	14 Å²	14	65.2 Å²	65.2	9%	0.091	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-48.6	133.5	169.7	-29.2	36.6	0	0	0	111.4	N151 F152 V155 F169 F271 G275	N151-P273 VanDerWaalsContact O-CG 3.26Å; N151-P273 WeakPolarHBondContact O-CG 3.33Å; F152-P273 HydrophobicContact CD1-CG 4.4Å; V155-P273 HydrophobicContact CG2-CB 3.81Å; V155-P273 HydrophobicContact CG2-CG 3.67Å; F169-P273 HydrophobicContact CE1-CB 3.9Å; F169-P273 HydrophobicContact CE1-CG 4.06Å; F169-P273 HydrophobicContact CE2-CB 4.39Å; F169-P273 HydrophobicContact CZ-CB 3.66Å; F169-P273 HydrophobicContact CZ-CG 4.32Å; F271-P273 HydrophobicContact CE1-CG 4.46Å; P273-G275 PolarHBondContact O-N 2.85Å
274	P	94.1	Very high	94	Very high	52 Å²	52	66 Å²	66	34%	0.338	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-56.7	134.7	171.2	-23	33.5	0	0	0	110.1	L116 R165	L116-P274 HydrophobicContact CB-CG 4.09Å; L116-P274 HydrophobicContact CD1-CG 4.13Å; R165-P274 VanDerWaalsContact CZ-O 3.31Å; R165-P274 PolarHBondContact NH1-O 3.25Å; R165-P274 PolarHBondContact NH2-O 3.37Å
275	G	92.9	Very high	94.1	Very high	54 Å²	54	60.5 Å²	60.5	56%	0.557	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-56.8	154	176.2	0	0	0	0	0	111.9	P273	P273-G275 PolarHBondContact O-N 2.85Å
276	H	94.3	Very high	94.2	Very high	65 Å²	65	59.9 Å²	59.9	30%	0.301	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-64.2	136.6	174.4	177.9	54.1	0	0	0	110.5	V161 Y282	V161-H276 HydrophobicContact CG1-CB 3.88Å; H276-Y282 AromaticContact CE1-CE2 3.82Å; H276-Y282 AromaticContact ND1-CE2 3.46Å; H276-Y282 WeakPolarHBondContact ND1-CE2 3.25Å; H276-Y282 AromaticContact ND1-CZ 3.69Å; H276-Y282 PolarHBondContact ND1-OH 3.47Å
277	M	91.4	Very high	94.2	Very high	110 Å²	110	60.3 Å²	60.3	54%	0.542	35%	0.348	S	S	.	.			trans	-125	146.8	174.5	-60	-65	-65	0	0	108.7	D279 A280	M277-D279 WeakPolarHBondContact CB-OD1 3.23Å; M277-D279 PolarHBondContact O-N 3.43Å; M277-D279 VanDerWaalsContact O-N 3.12Å; M277-A280 WeakPolarHBondContact O-CB 3.25Å; M277-A280 PolarHBondContact O-N 2.97Å
278	P	86.6	Confident	94.2	Very high	126 Å²	126	56.5 Å²	56.5	82%	0.818	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-23.4	-178.8	-26.1	35.2	0	0	0	115
279	D	86.1	Confident	94.3	Very high	113 Å²	113	56.6 Å²	56.6	60%	0.604	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	0.8	176.8	65.9	-34.3	0	0	0	113.5	N119 M277 Q281	N119-D279 PolarHBondContact ND2-O 3.09Å; M277-D279 WeakPolarHBondContact CB-OD1 3.23Å; M277-D279 PolarHBondContact O-N 3.43Å; M277-D279 VanDerWaalsContact O-N 3.12Å; D279-Q281 PolarHBondContact O-N 2.56Å
280	A	91.3	Very high	94.5	Very high	17 Å²	17	54.6 Å²	54.6	14%	0.14	31%	0.314	C	S	.	.			trans	-69.7	127.9	178.1	0	0	0	0	0	111.1	N119 M277 Y282	N119-A280 WeakPolarHBondContact OD1-CA 3.43Å; M277-A280 WeakPolarHBondContact O-CB 3.25Å; M277-A280 PolarHBondContact O-N 2.97Å; A280-Y282 HydrophobicContact CB-CE1 4.39Å; A280-Y282 HydrophobicContact CB-CE2 3.83Å; A280-Y282 WeakPolarHBondContact CB-OH 3.4Å
281	Q	92.4	Very high	95	Very high	138 Å²	138	49 Å²	49	65%	0.645	28%	0.278	S	S	*	.			trans	-112.4	94.2	-179.6	-66.6	-177.4	10.1	0	0	110.6	N119 Y121 D279	N119-Q281 HydrophobicContact CB-CB 4.38Å; N119-Q281 PolarHBondContact OD1-N 3.38Å; Y121-Q281 WeakPolarHBondContact CD2-O 3.42Å; Y121-Q281 WeakPolarHBondContact CE2-O 3.35Å; D279-Q281 PolarHBondContact O-N 2.56Å
282	Y	96.3	Very high	95.2	Very high	8 Å²	8	48.8 Å²	48.8	3%	0.031	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-79.5	150.4	179.1	-55.4	-72.5	0	0	0	111.5	Y121 V164 R165 H276 A280 I284 Q798	Y121-Y282 HydrophobicContact CD1-CD1 4.36Å; Y121-Y282 HydrophobicContact CD2-CD1 4.45Å; Y121-Y282 AromaticContact CE1-CD1 3.75Å; Y121-Y282 HydrophobicContact CE1-CD1 3.75Å; Y121-Y282 AromaticContact CE1-CE1 3.75Å; Y121-Y282 HydrophobicContact CE1-CE1 3.75Å; Y121-Y282 AromaticContact CE2-CD1 3.86Å; Y121-Y282 HydrophobicContact CE2-CD1 3.86Å; Y121-Y282 HydrophobicContact CE2-CE1 4.19Å; Y121-Y282 AromaticContact CZ-CD1 3.49Å; Y121-Y282 VanDerWaalsContact CZ-CD1 3.49Å; Y121-Y282 AromaticContact CZ-CE1 3.43Å; Y121-Y282 VanDerWaalsContact CZ-CE1 3.43Å; Y121-Y282 WeakPolarHBondContact OH-CE1 3.33Å; V164-Y282 HydrophobicContact CG2-CD2 3.92Å; V164-Y282 HydrophobicContact CG2-CG 4.19Å; R165-Y282 HydrophobicContact CB-CD1 4.12Å; R165-Y282 HydrophobicContact CB-CD2 3.94Å; R165-Y282 HydrophobicContact CB-CE1 3.89Å; R165-Y282 HydrophobicContact CB-CE2 3.68Å; R165-Y282 HydrophobicContact CB-CG 4.17Å; R165-Y282 HydrophobicContact CG-CD1 4.36Å; R165-Y282 HydrophobicContact CG-CE1 3.72Å; R165-Y282 HydrophobicContact CG-CE2 4.15Å; R165-Y282 PolarHBondContact NH1-OH 3.03Å; H276-Y282 AromaticContact CE1-CE2 3.82Å; H276-Y282 AromaticContact ND1-CE2 3.46Å; H276-Y282 WeakPolarHBondContact ND1-CE2 3.25Å; H276-Y282 AromaticContact ND1-CZ 3.69Å; H276-Y282 PolarHBondContact ND1-OH 3.47Å; A280-Y282 HydrophobicContact CB-CE1 4.39Å; A280-Y282 HydrophobicContact CB-CE2 3.83Å; A280-Y282 WeakPolarHBondContact CB-OH 3.4Å; Y282-I284 PolarHBondContact O-N 3.47Å; Y282-Q798 PolarHBondContact O-NE2 2.82Å
283	P	97.1	Very high	95.3	Very high	24 Å²	24	45.6 Å²	45.6	16%	0.156	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-58.3	135.4	176	-25.9	36.9	0	0	0	112.2	Y121	Y121-P283 HydrophobicContact CG-CG 4.34Å
284	I	96.9	Very high	95.4	Very high	33 Å²	33	52 Å²	52	17%	0.169	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-59.3	141.4	173.1	-59.9	174.2	0	0	0	108.9	L214 Y282 P363 L797	L214-I284 HydrophobicContact CD1-CG2 4.45Å; Y282-I284 PolarHBondContact O-N 3.47Å; I284-P363 HydrophobicContact CD1-CG 4.03Å; I284-L797 HydrophobicContact CG2-CB 4.04Å; I284-L797 HydrophobicContact CG2-CD2 3.82Å; I284-L797 HydrophobicContact CG2-CG 4.39Å
285	P	98.3	Very high	95.6	Very high	3 Å²	3	53.2 Å²	53.2	2%	0.019	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-57.8	158.1	172.8	26.3	-36	0	0	0	110.9	H210 L214 Y228	H210-P285 HydrophobicContact CB-CG 3.94Å; H210-P285 WeakPolarHBondContact CD2-CB 3.46Å; H210-P285 WeakPolarHBondContact CD2-CG 3.39Å; H210-P285 WeakPolarHBondContact NE2-CB 3.31Å; L214-P285 HydrophobicContact CD1-CG 4.21Å; L214-P285 WeakPolarHBondContact CD1-O 3.47Å; Y228-P285 HydrophobicContact CD1-CB 4.44Å; Y228-P285 HydrophobicContact CE1-CB 3.91Å
286	R	98.4	Very high	95.7	Very high	65 Å²	65	51.8 Å²	51.8	25%	0.245	27%	0.265	C	S	.	.			trans	-125.4	156.9	-177	-65.5	-178.9	-59.5	-70	3.1	111.3	Y228	Y228-R286 WeakPolarHBondContact CB-O 3.31Å; Y228-R286 HydrophobicContact CD1-CB 4.26Å; Y228-R286 VanDerWaalsContact CD1-N 3.29Å; Y228-R286 VanDerWaalsContact CD1-O 3.28Å; Y228-R286 WeakPolarHBondContact CD1-O 3.31Å; Y228-R286 HydrophobicContact CG-CB 4.11Å; Y228-R286 PolarHBondContact N-O 2.9Å
287	V	98.9	Very high	95.7	Very high	25 Å²	25	49 Å²	49	15%	0.152	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-115.4	131.6	166.8	171.6	0	0	0	0	107.4	V211 L214 Q215 Q225 E226 F289	V211-V287 HydrophobicContact CG1-CG2 4.41Å; L214-V287 HydrophobicContact CB-CB 4.25Å; L214-V287 HydrophobicContact CB-CG2 3.67Å; Q215-V287 HydrophobicContact CG-CG1 3.94Å; Q215-V287 HydrophobicContact CG-CG2 4.31Å; Q225-V287 HydrophobicContact CB-CG1 3.59Å; Q225-V287 WeakPolarHBondContact O-CG1 3.44Å; E226-V287 CarbonylContact O-C 3.58Å; E226-V287 WeakPolarHBondContact O-CA 3.28Å; V287-F289 PolarHBondContact O-N 3.02Å
288	I	98.9	Very high	95.7	Very high	41 Å²	41	48.9 Å²	48.9	21%	0.21	26%	0.261	C	S	.	.			trans	-74	117.9	-177.6	-56.2	-54.9	0	0	0	108.9	Q225 E226 C231 R290	Q225-I288 PolarHBondContact OE1-O 3.06Å; E226-I288 PolarHBondContact O-N 3.33Å; C231-I288 HydrophobicContact CB-CG1 3.9Å; I288-R290 PolarHBondContact O-N 3.38Å
289	F	98.9	Very high	95.8	Very high	20 Å²	20	52.4 Å²	52.4	9%	0.088	27%	0.266	C	S	.	.			trans	-66.8	126.9	170.8	-179.7	-101	0	0	0	109.7	V216 W217 V287 M291 E353 F356 G357 F360	V216-F289 HydrophobicContact CB-CD2 4.27Å; V216-F289 HydrophobicContact CG1-CD2 4.41Å; V216-F289 HydrophobicContact CG1-CE2 4.17Å; V216-F289 HydrophobicContact CG2-CD2 3.93Å; V216-F289 HydrophobicContact CG2-CE2 4.45Å; W217-F289 HydrophobicContact CE3-CE2 4.33Å; W217-F289 HydrophobicContact CH2-CD2 4.49Å; W217-F289 AromaticContact CH2-CE2 3.45Å; W217-F289 HydrophobicContact CH2-CE2 3.45Å; W217-F289 VanDerWaalsContact CH2-CE2 3.45Å; W217-F289 AromaticContact CH2-CZ 3.74Å; W217-F289 HydrophobicContact CH2-CZ 3.74Å; W217-F289 AromaticContact CZ3-CD2 3.91Å; W217-F289 HydrophobicContact CZ3-CD2 3.91Å; W217-F289 AromaticContact CZ3-CE2 3.27Å; W217-F289 HydrophobicContact CZ3-CE2 3.27Å; W217-F289 AromaticContact CZ3-CZ 3.86Å; W217-F289 HydrophobicContact CZ3-CZ 3.86Å; V287-F289 PolarHBondContact O-N 3.02Å; F289-M291 HydrophobicContact CE1-CB 4.15Å; F289-M291 HydrophobicContact CE1-CG 3.77Å; F289-M291 HydrophobicContact CE1-SD 3.71Å; F289-M291 HydrophobicContact CZ-CB 4.09Å; F289-M291 HydrophobicContact CZ-CG 4.04Å; F289-M291 HydrophobicContact CZ-SD 3.67Å; F289-E353 HydrophobicContact CD1-CG 3.91Å; F289-E353 WeakPolarHBondContact CD1-O 3.48Å; F289-E353 HydrophobicContact CE1-CG 3.9Å; F289-F356 HydrophobicContact CE1-CB 3.91Å; F289-F356 HydrophobicContact CZ-CB 3.87Å; F289-G357 VanDerWaalsContact CD1-CA 3.42Å; F289-G357 VanDerWaalsContact CG-CA 3.45Å; F289-F360 HydrophobicContact CE2-CB 4.49Å; F289-F360 AromaticContact CE2-CD2 3.87Å; F289-F360 HydrophobicContact CE2-CD2 3.87Å; F289-F360 HydrophobicContact CZ-CD2 4.13Å
290	R	98.9	Very high	95.9	Very high	6 Å²	6	48.9 Å²	48.9	2%	0.023	26%	0.257	C	S	.	.			trans	-140.5	122.3	177.7	-170.2	60.5	55.7	-134.6	5.1	110.2	H223 Q225 I288 S306 R311 E315 E353	H223-R290 HydrophobicContact CB-CB 4.11Å; H223-R290 HydrophobicContact CB-CG 3.75Å; Q225-R290 PolarHBondContact NE2-O 3.33Å; Q225-R290 VanDerWaalsContact OE1-N 3.13Å; I288-R290 PolarHBondContact O-N 3.38Å; R290-S306 WeakPolarHBondContact CD-OG 3.42Å; R290-R311 VanDerWaalsContact CD-NH2 3.35Å; R290-R311 VanDerWaalsContact NH1-CZ 3.25Å; R290-R311 VanDerWaalsContact NH1-NE 3.16Å; R290-E315 IonicContact CZ-OE1 3.79Å; R290-E315 VanDerWaalsContact CZ-OE1 3.27Å; R290-E315 IonicContact CZ-OE2 2.73Å; R290-E315 IonicContact NH1-OE1 3.21Å; R290-E315 PolarHBondContact NH1-OE1 3.26Å; R290-E315 IonicContact NH1-OE2 3.78Å; R290-E315 VanDerWaalsContact NH2-CD 3.35Å; R290-E315 IonicContact NH2-OE1 3.58Å; R290-E315 PolarHBondContact NH2-OE1 3.03Å; R290-E315 VanDerWaalsContact NH2-OE1 3.07Å; R290-E315 IonicContact NH2-OE2 3.55Å; R290-E315 PolarHBondContact NH2-OE2 2.9Å; R290-E353 WeakPolarHBondContact CD-OE1 3.31Å; R290-E353 IonicContact CZ-OE1 2.81Å; R290-E353 IonicContact NH1-OE1 3.21Å; R290-E353 PolarHBondContact NH1-OE1 3.32Å; R290-E353 IonicContact NH1-OE2 3.42Å; R290-E353 PolarHBondContact NH1-OE2 2.99Å
291	M	98.6	Very high	96	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.265	C	S	.	.			trans	-132.2	-21.3	174.8	72.6	178.8	-69.7	0	0	114.6	W217 H223 F289 E353 F356 A394 M397 L398 R401	W217-M291 HydrophobicContact CH2-CB 4.17Å; W217-M291 HydrophobicContact CZ3-CB 4.31Å; H223-M291 PolarHBondContact CD2-O 2.88Å; H223-M291 VanDerWaalsContact CD2-O 3.28Å; H223-M291 PolarHBondContact NE2-O 3.05Å; H223-M291 VanDerWaalsContact NE2-O 3.08Å; F289-M291 HydrophobicContact CE1-CB 4.15Å; F289-M291 HydrophobicContact CE1-CG 3.77Å; F289-M291 HydrophobicContact CE1-SD 3.71Å; F289-M291 HydrophobicContact CZ-CB 4.09Å; F289-M291 HydrophobicContact CZ-CG 4.04Å; F289-M291 HydrophobicContact CZ-SD 3.67Å; M291-E353 HydrophobicContact CG-CG 4.05Å; M291-E353 PolarHBondContact N-OE1 3.21Å; M291-F356 HydrophobicContact SD-CD2 4.32Å; M291-A394 HydrophobicContact CE-CB 3.82Å; M291-M397 HydrophobicContact CE-CB 4.07Å; M291-M397 HydrophobicContact CE-SD 4.48Å; M291-M397 WeakPolarHBondContact O-CE 3.45Å; M291-L398 HydrophobicContact CE-CD2 4.13Å; M291-L398 HydrophobicContact CE-CG 4.07Å; M291-L398 HydrophobicContact SD-CD2 4.34Å; M291-R401 PolarHBondContact O-NH1 3.47Å; M291-R401 PolarHBondContact O-NH2 2.9Å
292	F	98.6	Very high	96.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.268	C	S	.	.			trans	-112.9	149.7	179.7	-63.8	-55.2	0	0	0	113.8	D296 M303 R311 Y349 V352 E353 V390 A394 M397	F292-D296 VanDerWaalsContact CA-OD2 3.26Å; F292-D296 WeakPolarHBondContact CA-OD2 3.32Å; F292-D296 HydrophobicContact CD1-CB 3.88Å; F292-M303 HydrophobicContact CB-CE 3.74Å; F292-M303 HydrophobicContact CB-SD 3.87Å; F292-M303 HydrophobicContact CG-CE 4.42Å; F292-R311 PolarHBondContact O-NH2 3.45Å; F292-Y349 AromaticContact CD1-CD1 3.95Å; F292-Y349 HydrophobicContact CD1-CD1 3.95Å; F292-Y349 HydrophobicContact CD1-CE1 4.43Å; F292-Y349 HydrophobicContact CD2-CD1 4.04Å; F292-Y349 AromaticContact CE1-CD1 3.85Å; F292-Y349 HydrophobicContact CE1-CD1 3.85Å; F292-Y349 HydrophobicContact CE1-CE1 4.18Å; F292-Y349 AromaticContact CE2-CD1 3.98Å; F292-Y349 HydrophobicContact CE2-CD1 3.98Å; F292-Y349 HydrophobicContact CG-CD1 4.05Å; F292-Y349 AromaticContact CZ-CD1 3.88Å; F292-Y349 HydrophobicContact CZ-CD1 3.88Å; F292-Y349 HydrophobicContact CZ-CE1 4.46Å; F292-V352 HydrophobicContact CE2-CB 4.45Å; F292-V352 HydrophobicContact CE2-CG1 4.26Å; F292-V352 HydrophobicContact CZ-CG1 4.39Å; F292-E353 HydrophobicContact CD2-CB 3.75Å; F292-E353 HydrophobicContact CD2-CG 4.24Å; F292-E353 HydrophobicContact CE2-CB 4.02Å; F292-E353 PolarHBondContact N-OE1 3.02Å; F292-E353 VanDerWaalsContact N-OE1 3.08Å; F292-V390 HydrophobicContact CZ-CG1 4.43Å; F292-A394 HydrophobicContact CZ-CB 3.84Å; F292-M397 HydrophobicContact CD1-CE 3.73Å; F292-M397 HydrophobicContact CD1-SD 3.89Å; F292-M397 HydrophobicContact CE1-CE 4Å; F292-M397 HydrophobicContact CE1-SD 3.53Å; F292-M397 VanDerWaalsContact CE1-SD 3.53Å
293	D	98.1	Very high	96.3	Very high	43 Å²	43	49.3 Å²	49.3	23%	0.23	27%	0.268	C	S	.	.			trans	-130.9	-170.1	160	71.8	33.8	0	0	0	112.5	H223 T295 D296	H223-D293 IonicContact CE1-OD2 2.73Å; H223-D293 PolarHBondContact CE1-OD2 3.02Å; D293-T295 PolarHBondContact O-N 3.23Å; D293-T295 WeakPolarHBondContact OD1-CA 3.3Å; D293-T295 VanDerWaalsContact OD1-CB 3.26Å; D293-T295 WeakPolarHBondContact OD1-CB 3.27Å; D293-T295 WeakPolarHBondContact OD1-CG2 3.5Å; D293-T295 PolarHBondContact OD1-N 3.26Å; D293-T295 PolarHBondContact OD1-OG1 2.97Å; D293-D296 PolarHBondContact N-OD2 3.07Å; D293-D296 PolarHBondContact O-N 2.99Å
294	Y	96.6	Very high	96.3	Very high	148 Å²	148	49.2 Å²	49.2	58%	0.58	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-67.3	-21.1	-177.1	70.4	-83.6	0	0	0	113.8	D296 A297	Y294-D296 VanDerWaalsContact C-N 3.29Å; Y294-A297 PolarHBondContact O-N 3.44Å
295	T	97.4	Very high	96.4	Very high	79 Å²	79	49.7 Å²	49.7	49%	0.485	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-75	-22.3	179.8	70.3	0	0	0	0	112.2	D293 A297	D293-T295 PolarHBondContact O-N 3.23Å; D293-T295 WeakPolarHBondContact OD1-CA 3.3Å; D293-T295 VanDerWaalsContact OD1-CB 3.26Å; D293-T295 WeakPolarHBondContact OD1-CB 3.27Å; D293-T295 WeakPolarHBondContact OD1-CG2 3.5Å; D293-T295 PolarHBondContact OD1-N 3.26Å; D293-T295 PolarHBondContact OD1-OG1 2.97Å; T295-A297 VanDerWaalsContact C-N 3.29Å; T295-A297 PolarHBondContact O-N 3.48Å
296	D	96.8	Very high	96.4	Very high	24 Å²	24	50.8 Å²	50.8	13%	0.128	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-75.4	-18.1	176.9	-62.4	-59.5	0	0	0	113.2	F292 D293 Y294 P298 Y349 Q393 M397	F292-D296 VanDerWaalsContact CA-OD2 3.26Å; F292-D296 WeakPolarHBondContact CA-OD2 3.32Å; F292-D296 HydrophobicContact CD1-CB 3.88Å; D293-D296 PolarHBondContact N-OD2 3.07Å; D293-D296 PolarHBondContact O-N 2.99Å; Y294-D296 VanDerWaalsContact C-N 3.29Å; D296-P298 VanDerWaalsContact C-CD 3.48Å; D296-Y349 HydrophobicContact CB-CE1 4.23Å; D296-Y349 WeakPolarHBondContact O-CE1 3.49Å; D296-Y349 PolarHBondContact O-OH 3.31Å; D296-Y349 VanDerWaalsContact O-OH 3.06Å; D296-Q393 PolarHBondContact O-NE2 2.95Å; D296-Q393 PolarHBondContact O-OE1 3.25Å; D296-M397 WeakPolarHBondContact OD1-CE 3.32Å
297	A	93.4	Very high	96.4	Very high	7 Å²	7	51.4 Å²	51.4	6%	0.058	29%	0.294	C	S	.	.	S	Bend	trans	-128.3	58.8	-178.5	0	0	0	0	0	112.4	Y294 T295 E299 G300 P346 Y349	Y294-A297 PolarHBondContact O-N 3.44Å; T295-A297 VanDerWaalsContact C-N 3.29Å; T295-A297 PolarHBondContact O-N 3.48Å; A297-E299 VanDerWaalsContact C-N 3.35Å; A297-E299 PolarHBondContact O-N 3.18Å; A297-G300 PolarHBondContact O-N 2.93Å; A297-P346 HydrophobicContact CB-CB 4.28Å; A297-Y349 HydrophobicContact CB-CD1 4.38Å; A297-Y349 HydrophobicContact CB-CD2 3.9Å; A297-Y349 HydrophobicContact CB-CE1 4.11Å; A297-Y349 HydrophobicContact CB-CE2 3.59Å; A297-Y349 HydrophobicContact CB-CG 4.29Å
298	P	90.8	Very high	96.4	Very high	107 Å²	107	50.6 Å²	50.6	70%	0.695	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-28.1	-166.5	27.5	-35.2	0	0	0	114.4	D296	D296-P298 VanDerWaalsContact C-CD 3.48Å
299	E	88.8	Confident	96.3	Very high	199 Å²	199	48.8 Å²	48.8	93%	0.93	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-5.2	-177.4	-60.9	-175	172	0	0	113.4	A297	A297-E299 VanDerWaalsContact C-N 3.35Å; A297-E299 PolarHBondContact O-N 3.18Å
300	G	89	Confident	96.3	Very high	40 Å²	40	49.3 Å²	49.3	41%	0.412	28%	0.283	S	S	.	.	S	Bend	trans	-100.9	-175.6	-175.4	0	0	0	0	0	114.5	A297	A297-G300 PolarHBondContact O-N 2.93Å
301	P	93.9	Very high	96.3	Very high	48 Å²	48	49 Å²	49	31%	0.312	28%	0.282	S	S	.	.	S	Bend	trans	-55.9	140.2	164.8	-18.7	31.2	0	0	0	110.4	M303 K344 P346	P301-M303 PolarHBondContact O-N 2.96Å; P301-K344 HydrophobicContact CB-CB 4.01Å; P301-K344 WeakPolarHBondContact CB-O 3.29Å; P301-K344 HydrophobicContact CG-CB 3.82Å; P301-P346 WeakPolarHBondContact O-CD 3.49Å
302	V	96.1	Very high	96.3	Very high	116 Å²	116	49.9 Å²	49.9	70%	0.703	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-60.9	127.7	-179.4	-179.2	0	0	0	0	110.1
303	M	97.8	Very high	96.3	Very high	7 Å²	7	50 Å²	50	3%	0.034	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-67.8	131.4	175.6	-169.6	177.1	-73.2	0	0	110.8	F292 P301 G305 R311 P346 Y349	F292-M303 HydrophobicContact CB-CE 3.74Å; F292-M303 HydrophobicContact CB-SD 3.87Å; F292-M303 HydrophobicContact CG-CE 4.42Å; P301-M303 PolarHBondContact O-N 2.96Å; M303-G305 PolarHBondContact O-N 3.18Å; M303-R311 PolarHBondContact SD-NH1 2.82Å; M303-R311 VanDerWaalsContact SD-NH1 3.45Å; M303-P346 HydrophobicContact CB-CG 3.78Å; M303-P346 HydrophobicContact CE-CG 3.99Å; M303-P346 HydrophobicContact CG-CG 4.07Å; M303-Y349 HydrophobicContact CE-CD1 4.35Å; M303-Y349 HydrophobicContact CE-CG 4.1Å
304	P	97.9	Very high	96.3	Very high	23 Å²	23	48 Å²	48	15%	0.149	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-58.8	130	169.1	-23.8	35	0	0	0	111.4	S308 E310 R311 I314 I345	P304-S308 WeakPolarHBondContact CB-OG 3.43Å; P304-E310 HydrophobicContact CB-CB 3.98Å; P304-E310 HydrophobicContact CG-CB 4.12Å; P304-R311 HydrophobicContact CB-CB 4.29Å; P304-R311 PolarHBondContact O-NH1 3.46Å; P304-I314 HydrophobicContact CG-CD1 3.84Å; P304-I345 HydrophobicContact CG-CG2 4.45Å
305	G	97.8	Very high	96.4	Very high	42 Å²	42	41.9 Å²	41.9	43%	0.433	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-65.1	159	-178.1	0	0	0	0	0	113.2	M303 H307 S308 R311	M303-G305 PolarHBondContact O-N 3.18Å; G305-H307 PolarHBondContact O-N 3.25Å; G305-H307 VanDerWaalsContact O-N 3.14Å; G305-S308 WeakPolarHBondContact O-CB 3.34Å; G305-S308 PolarHBondContact O-N 3.43Å; G305-R311 WeakPolarHBondContact O-CB 3.24Å
306	S	98.1	Very high	96.4	Very high	27 Å²	27	39.5 Å²	39.5	19%	0.189	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-36.9	-174.7	-53.3	0	0	0	0	114.2	Q235 R290	Q235-S306 PolarHBondContact NE2-O 2.84Å; R290-S306 WeakPolarHBondContact CD-OG 3.42Å
307	H	98.6	Very high	96.5	Very high	78 Å²	78	39.2 Å²	39.2	36%	0.361	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	22.5	178.4	-60.4	154.1	0	0	0	113.9	E226 A234 Q235 K238 G305	E226-H307 IonicContact OE1-CD2 2.64Å; E226-H307 IonicContact OE1-CE1 2.56Å; E226-H307 IonicContact OE1-NE2 2.63Å; E226-H307 PolarHBondContact OE1-NE2 3.21Å; E226-H307 IonicContact OE2-CD2 3.88Å; E226-H307 IonicContact OE2-CE1 3.38Å; E226-H307 IonicContact OE2-NE2 3.44Å; E226-H307 PolarHBondContact OE2-NE2 3.11Å; A234-H307 HydrophobicContact CB-CB 4.27Å; Q235-H307 WeakPolarHBondContact CA-O 3.5Å; Q235-H307 VanDerWaalsContact CG-C 3.48Å; K238-H307 WeakPolarHBondContact CD-O 3.28Å; G305-H307 PolarHBondContact O-N 3.25Å; G305-H307 VanDerWaalsContact O-N 3.14Å
308	S	98.5	Very high	96.7	Very high	7 Å²	7	38.9 Å²	38.9	5%	0.049	23%	0.232	C	C	.	.	S	Bend	trans	-96.7	142.9	172.5	111.4	0	0	0	0	111.1	P304 G305 E310 R311	P304-S308 WeakPolarHBondContact CB-OG 3.43Å; G305-S308 WeakPolarHBondContact O-CB 3.34Å; G305-S308 PolarHBondContact O-N 3.43Å; S308-E310 VanDerWaalsContact CB-OE2 3.24Å; S308-E310 WeakPolarHBondContact CB-OE2 3.44Å; S308-E310 PolarHBondContact O-N 3.26Å; S308-E310 PolarHBondContact OG-N 3.47Å; S308-E310 PolarHBondContact OG-OE2 3.19Å; S308-R311 PolarHBondContact O-N 3.34Å; S308-R311 PolarHBondContact OG-N 3.34Å
309	A	98.1	Very high	97.1	Very high	3 Å²	3	36.3 Å²	36.3	3%	0.025	21%	0.21	C	C	.	.	H	α-helix	trans	-63	-29.6	176.1	0	0	0	0	0	111.8	P178 L239 R311 F312 V313	P178-A309 HydrophobicContact CG-CB 4.41Å; L239-A309 HydrophobicContact CB-CB 4.3Å; L239-A309 HydrophobicContact CD1-CB 4.44Å; L239-A309 HydrophobicContact CD2-CB 4.16Å; A309-R311 PolarHBondContact O-N 3.2Å; A309-F312 PolarHBondContact O-N 2.86Å; A309-V313 VanDerWaalsContact O-CG2 3.27Å; A309-V313 WeakPolarHBondContact O-CG2 3.47Å; A309-V313 PolarHBondContact O-N 3.49Å
310	E	98.5	Very high	97.5	Very high	31 Å²	31	27 Å²	27	15%	0.145	17%	0.167	C	C	.	.	H	α-helix	trans	-61.6	-42.1	174.3	-59.7	81.8	177.9	0	0	111.9	E246 R247 H248 P304 S308 F312 V313 I314	E246-E310 WeakPolarHBondContact CA-OE1 3.41Å; R247-E310 HydrophobicContact CB-CG 4.38Å; R247-E310 PolarHBondContact N-OE1 2.96Å; H248-E310 HydrophobicContact CB-CB 3.94Å; H248-E310 HydrophobicContact CB-CG 3.65Å; P304-E310 HydrophobicContact CB-CB 3.98Å; P304-E310 HydrophobicContact CG-CB 4.12Å; S308-E310 VanDerWaalsContact CB-OE2 3.24Å; S308-E310 WeakPolarHBondContact CB-OE2 3.44Å; S308-E310 PolarHBondContact O-N 3.26Å; S308-E310 PolarHBondContact OG-N 3.47Å; S308-E310 PolarHBondContact OG-OE2 3.19Å; E310-F312 VanDerWaalsContact C-N 3.32Å; E310-F312 PolarHBondContact O-N 3.41Å; E310-V313 PolarHBondContact O-N 3.37Å; E310-I314 HydrophobicContact CB-CD1 4.44Å; E310-I314 WeakPolarHBondContact O-CB 3.43Å; E310-I314 WeakPolarHBondContact O-CD1 3.32Å; E310-I314 WeakPolarHBondContact O-CG1 3.23Å; E310-I314 PolarHBondContact O-N 2.91Å
311	R	98.7	Very high	97.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-59.1	-46.1	178.3	-172.4	60.8	165.7	-87.1	2.3	110.9	R290 F292 M303 P304 G305 S308 A309 I314 E315 E353	R290-R311 VanDerWaalsContact CD-NH2 3.35Å; R290-R311 VanDerWaalsContact NH1-CZ 3.25Å; R290-R311 VanDerWaalsContact NH1-NE 3.16Å; F292-R311 PolarHBondContact O-NH2 3.45Å; M303-R311 PolarHBondContact SD-NH1 2.82Å; M303-R311 VanDerWaalsContact SD-NH1 3.45Å; P304-R311 HydrophobicContact CB-CB 4.29Å; P304-R311 PolarHBondContact O-NH1 3.46Å; G305-R311 WeakPolarHBondContact O-CB 3.24Å; S308-R311 PolarHBondContact O-N 3.34Å; S308-R311 PolarHBondContact OG-N 3.34Å; A309-R311 PolarHBondContact O-N 3.2Å; R311-I314 PolarHBondContact O-N 3.06Å; R311-E315 VanDerWaalsContact CD-OE1 3.31Å; R311-E315 WeakPolarHBondContact CD-OE1 3.38Å; R311-E315 IonicContact CZ-OE1 2.96Å; R311-E315 IonicContact NE-OE1 2.73Å; R311-E315 PolarHBondContact NE-OE1 3.3Å; R311-E315 WeakPolarHBondContact O-CG 3.2Å; R311-E315 PolarHBondContact O-N 3.13Å; R311-E315 VanDerWaalsContact O-N 3.12Å; R311-E353 IonicContact CZ-OE2 3.96Å; R311-E353 IonicContact NE-OE2 2.78Å; R311-E353 VanDerWaalsContact NH2-CD 3.26Å; R311-E353 IonicContact NH2-OE1 3.41Å; R311-E353 PolarHBondContact NH2-OE1 3.31Å; R311-E353 VanDerWaalsContact NH2-OE1 3.12Å; R311-E353 IonicContact NH2-OE2 3.12Å; R311-E353 PolarHBondContact NH2-OE2 2.97Å
312	F	98.8	Very high	98.2	Very high	18 Å²	18	23.3 Å²	23.3	8%	0.079	14%	0.135	C	C	.	.	H	α-helix	trans	-58.3	-51.6	174.4	171.1	-103.8	0	0	0	112.6	Y171 P178 W179 L232 Q235 A309 E310 I314 E315 E316	Y171-F312 HydrophobicContact CE2-CE2 4.43Å; P178-F312 HydrophobicContact CG-CD1 4.3Å; P178-F312 HydrophobicContact CG-CE1 4.49Å; W179-F312 HydrophobicContact CZ3-CE1 4.25Å; L232-F312 HydrophobicContact CD1-CD1 4.23Å; L232-F312 HydrophobicContact CD1-CD2 4.08Å; L232-F312 HydrophobicContact CD1-CE1 4.29Å; L232-F312 HydrophobicContact CD1-CE2 4.14Å; L232-F312 HydrophobicContact CD1-CG 4.15Å; L232-F312 HydrophobicContact CD1-CZ 4.26Å; Q235-F312 VanDerWaalsContact OE1-CB 3.3Å; A309-F312 PolarHBondContact O-N 2.86Å; E310-F312 VanDerWaalsContact C-N 3.32Å; E310-F312 PolarHBondContact O-N 3.41Å; F312-I314 VanDerWaalsContact C-N 3.34Å; F312-I314 PolarHBondContact O-N 2.91Å; F312-E315 PolarHBondContact O-N 3.02Å; F312-E316 VanDerWaalsContact O-CB 3.26Å; F312-E316 WeakPolarHBondContact O-CB 3.24Å; F312-E316 PolarHBondContact O-N 3.4Å
313	V	98.4	Very high	98.2	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.018	12%	0.119	C	C	.	.	H	α-helix	trans	-64.3	-38.7	-177.4	173.4	0	0	0	0	111.8	P178 W179 I249 A309 E310 N317	P178-V313 HydrophobicContact CB-CG2 3.84Å; P178-V313 HydrophobicContact CG-CG2 4.32Å; W179-V313 HydrophobicContact CH2-CB 4.43Å; W179-V313 HydrophobicContact CH2-CG1 4.17Å; W179-V313 HydrophobicContact CH2-CG2 3.75Å; W179-V313 HydrophobicContact CZ2-CG1 3.97Å; W179-V313 HydrophobicContact CZ2-CG2 4.22Å; W179-V313 HydrophobicContact CZ3-CG2 4.09Å; I249-V313 HydrophobicContact CD1-CG2 4.18Å; I249-V313 HydrophobicContact CG1-CG1 3.85Å; I249-V313 HydrophobicContact CG1-CG2 4.32Å; A309-V313 VanDerWaalsContact O-CG2 3.27Å; A309-V313 WeakPolarHBondContact O-CG2 3.47Å; A309-V313 PolarHBondContact O-N 3.49Å; E310-V313 PolarHBondContact O-N 3.37Å; V313-N317 WeakPolarHBondContact CG1-ND2 3.23Å; V313-N317 WeakPolarHBondContact O-CB 3.37Å; V313-N317 VanDerWaalsContact O-CG 3.26Å; V313-N317 PolarHBondContact O-N 3.17Å; V313-N317 VanDerWaalsContact O-N 3.15Å; V313-N317 PolarHBondContact O-ND2 2.85Å
314	I	98.7	Very high	98	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.7	-52.9	177.1	-69.9	160.7	0	0	0	109.6	H248 P304 E310 R311 F312 N317 L318 Y339 I345 H350	H248-I314 VanDerWaalsContact CD2-CG1 3.49Å; H248-I314 WeakPolarHBondContact CD2-CG1 3.47Å; H248-I314 VanDerWaalsContact NE2-CG1 3.3Å; H248-I314 WeakPolarHBondContact NE2-CG1 3.35Å; P304-I314 HydrophobicContact CG-CD1 3.84Å; E310-I314 HydrophobicContact CB-CD1 4.44Å; E310-I314 WeakPolarHBondContact O-CB 3.43Å; E310-I314 WeakPolarHBondContact O-CD1 3.32Å; E310-I314 WeakPolarHBondContact O-CG1 3.23Å; E310-I314 PolarHBondContact O-N 2.91Å; R311-I314 PolarHBondContact O-N 3.06Å; F312-I314 VanDerWaalsContact C-N 3.34Å; F312-I314 PolarHBondContact O-N 2.91Å; I314-N317 PolarHBondContact O-N 3.33Å; I314-L318 HydrophobicContact CG2-CD1 3.87Å; I314-L318 HydrophobicContact CG2-CG 4.46Å; I314-L318 VanDerWaalsContact O-CG 3.29Å; I314-L318 WeakPolarHBondContact O-CG 3.48Å; I314-L318 PolarHBondContact O-N 3Å; I314-Y339 HydrophobicContact CG1-CE1 4.35Å; I314-Y339 HydrophobicContact CG2-CE1 4.26Å; I314-I345 HydrophobicContact CD1-CD1 3.85Å; I314-I345 HydrophobicContact CD1-CG2 3.98Å; I314-I345 HydrophobicContact CG1-CD1 4.03Å; I314-I345 HydrophobicContact CG2-CD1 4.06Å; I314-H350 HydrophobicContact CG2-CB 3.95Å
315	E	98.7	Very high	98	Very high	21 Å²	21	25 Å²	25	10%	0.098	14%	0.135	C	C	.	.	H	α-helix	trans	-64.3	-46.4	-176.4	-70	173.8	176.8	0	0	111.7	R290 R311 F312 N317 L318 H319 V354	R290-E315 IonicContact CZ-OE1 3.79Å; R290-E315 VanDerWaalsContact CZ-OE1 3.27Å; R290-E315 IonicContact CZ-OE2 2.73Å; R290-E315 IonicContact NH1-OE1 3.21Å; R290-E315 PolarHBondContact NH1-OE1 3.26Å; R290-E315 IonicContact NH1-OE2 3.78Å; R290-E315 VanDerWaalsContact NH2-CD 3.35Å; R290-E315 IonicContact NH2-OE1 3.58Å; R290-E315 PolarHBondContact NH2-OE1 3.03Å; R290-E315 VanDerWaalsContact NH2-OE1 3.07Å; R290-E315 IonicContact NH2-OE2 3.55Å; R290-E315 PolarHBondContact NH2-OE2 2.9Å; R311-E315 VanDerWaalsContact CD-OE1 3.31Å; R311-E315 WeakPolarHBondContact CD-OE1 3.38Å; R311-E315 IonicContact CZ-OE1 2.96Å; R311-E315 IonicContact NE-OE1 2.73Å; R311-E315 PolarHBondContact NE-OE1 3.3Å; R311-E315 WeakPolarHBondContact O-CG 3.2Å; R311-E315 PolarHBondContact O-N 3.13Å; R311-E315 VanDerWaalsContact O-N 3.12Å; F312-E315 PolarHBondContact O-N 3.02Å; E315-N317 VanDerWaalsContact C-N 3.3Å; E315-N317 PolarHBondContact O-N 3.04Å; E315-L318 PolarHBondContact O-N 3.38Å; E315-H319 PolarHBondContact O-CD2 2.87Å; E315-H319 PolarHBondContact O-N 3.44Å; E315-V354 HydrophobicContact CB-CG2 4.1Å; E315-V354 HydrophobicContact CG-CG2 3.86Å
316	E	97.6	Very high	98	Very high	29 Å²	29	27 Å²	27	14%	0.136	13%	0.13	C	C	.	.	H	α-helix	trans	-56.5	-43.8	177.7	-178.7	70.7	178.5	0	0	111.8	R129 F312 C320	R129-E316 IonicContact CZ-OE1 3.3Å; R129-E316 VanDerWaalsContact CZ-OE1 3.24Å; R129-E316 IonicContact NH1-OE1 3.78Å; R129-E316 PolarHBondContact NH1-OE1 2.86Å; R129-E316 IonicContact NH2-OE1 2.85Å; R129-E316 PolarHBondContact NH2-OE1 3.39Å; F312-E316 VanDerWaalsContact O-CB 3.26Å; F312-E316 WeakPolarHBondContact O-CB 3.24Å; F312-E316 PolarHBondContact O-N 3.4Å; E316-C320 PolarHBondContact O-N 3.35Å; E316-C320 PolarHBondContact O-SG 2.99Å
317	N	97.9	Very high	97.9	Very high	18 Å²	18	35.1 Å²	35.1	10%	0.096	16%	0.156	C	C	.	.	H	α-helix	trans	-69.5	-39.5	178.7	-74	-43.6	0	0	0	112.4	V313 I314 E315 C320 I321 Y339	V313-N317 WeakPolarHBondContact CG1-ND2 3.23Å; V313-N317 WeakPolarHBondContact O-CB 3.37Å; V313-N317 VanDerWaalsContact O-CG 3.26Å; V313-N317 PolarHBondContact O-N 3.17Å; V313-N317 VanDerWaalsContact O-N 3.15Å; V313-N317 PolarHBondContact O-ND2 2.85Å; I314-N317 PolarHBondContact O-N 3.33Å; E315-N317 VanDerWaalsContact C-N 3.3Å; E315-N317 PolarHBondContact O-N 3.04Å; N317-C320 WeakPolarHBondContact O-CB 3.44Å; N317-C320 PolarHBondContact O-N 3.39Å; N317-I321 VanDerWaalsContact O-CG1 3.32Å; N317-I321 WeakPolarHBondContact O-CG1 3.4Å; N317-I321 PolarHBondContact O-N 3.44Å; N317-Y339 HydrophobicContact CB-CE2 3.55Å; N317-Y339 PolarHBondContact ND2-OH 3.45Å
318	L	98.8	Very high	97.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66	-40.1	177.1	-66.6	175.2	0	0	0	111.2	I314 E315 C320 I321 I322 L336 Y339 L347 H350 I351 V354	I314-L318 HydrophobicContact CG2-CD1 3.87Å; I314-L318 HydrophobicContact CG2-CG 4.46Å; I314-L318 VanDerWaalsContact O-CG 3.29Å; I314-L318 WeakPolarHBondContact O-CG 3.48Å; I314-L318 PolarHBondContact O-N 3Å; E315-L318 PolarHBondContact O-N 3.38Å; L318-C320 VanDerWaalsContact C-N 3.34Å; L318-C320 PolarHBondContact O-N 3.13Å; L318-I321 HydrophobicContact CD2-CD1 4.37Å; L318-I321 PolarHBondContact O-N 2.92Å; L318-I322 WeakPolarHBondContact O-CG1 3.42Å; L318-I322 PolarHBondContact O-N 3.27Å; L318-L336 HydrophobicContact CB-CD2 4.15Å; L318-L336 HydrophobicContact CD2-CD2 3.65Å; L318-L336 HydrophobicContact CG-CD2 4.47Å; L318-Y339 HydrophobicContact CD2-CD1 4.12Å; L318-Y339 HydrophobicContact CD2-CD2 4.33Å; L318-Y339 HydrophobicContact CD2-CG 3.88Å; L318-L347 HydrophobicContact CD2-CD1 4.32Å; L318-H350 HydrophobicContact CD1-CB 3.79Å; L318-I351 HydrophobicContact CD1-CG1 4.37Å; L318-I351 HydrophobicContact CD2-CG1 4.36Å; L318-V354 HydrophobicContact CB-CB 4.38Å; L318-V354 HydrophobicContact CB-CG1 3.99Å; L318-V354 HydrophobicContact CB-CG2 4.04Å; L318-V354 HydrophobicContact CD1-CG2 4.01Å
319	H	98.6	Very high	97.9	Very high	53 Å²	53	42.3 Å²	42.3	25%	0.245	19%	0.185	C	C	.	.	H	α-helix	trans	-58.8	-43.9	170	-76.7	-61	0	0	0	111.8	E315 I321 I322 K323 E358	E315-H319 PolarHBondContact O-CD2 2.87Å; E315-H319 PolarHBondContact O-N 3.44Å; H319-I321 PolarHBondContact O-N 2.92Å; H319-I322 PolarHBondContact O-N 2.77Å; H319-K323 WeakPolarHBondContact O-CB 3.46Å; H319-K323 PolarHBondContact O-N 2.85Å; H319-E358 WeakPolarHBondContact CE1-CG 3.49Å; H319-E358 IonicContact CE1-OE1 3.56Å; H319-E358 IonicContact CG-OE1 3.01Å; H319-E358 VanDerWaalsContact ND1-CG 3.25Å; H319-E358 WeakPolarHBondContact ND1-CG 3.45Å; H319-E358 IonicContact ND1-OE1 3.46Å; H319-E358 PolarHBondContact ND1-OE1 3.47Å
320	C	97.5	Very high	97.9	Very high	4 Å²	4	48.8 Å²	48.8	3%	0.027	21%	0.212	C	C	.	.	H	α-helix	trans	-62.7	-42.2	176.5	-68.2	0	0	0	0	112.2	P80 E81 E316 N317 L318 I322 K323 T324	P80-C320 HydrophobicContact CG-CB 3.86Å; P80-C320 VanDerWaalsContact CG-SG 3.52Å; E81-C320 HydrophobicContact CB-CB 4.23Å; E316-C320 PolarHBondContact O-N 3.35Å; E316-C320 PolarHBondContact O-SG 2.99Å; N317-C320 WeakPolarHBondContact O-CB 3.44Å; N317-C320 PolarHBondContact O-N 3.39Å; L318-C320 VanDerWaalsContact C-N 3.34Å; L318-C320 PolarHBondContact O-N 3.13Å; C320-I322 VanDerWaalsContact C-N 3.33Å; C320-I322 PolarHBondContact O-N 3.4Å; C320-K323 WeakPolarHBondContact O-CB 3.31Å; C320-K323 PolarHBondContact O-N 3.45Å; C320-T324 PolarHBondContact O-N 2.9Å; C320-T324 PolarHBondContact O-OG1 3.24Å; C320-T324 VanDerWaalsContact O-OG1 3.05Å
321	I	97.8	Very high	97.8	Very high	9 Å²	9	50.1 Å²	50.1	5%	0.046	22%	0.223	C	C	.	.	H	α-helix	trans	-59.3	-44.5	175.6	-71.7	165.8	0	0	0	111	E81 N317 L318 H319 T324 H325 Q335 L336 Y339	E81-I321 HydrophobicContact CB-CG1 3.97Å; E81-I321 HydrophobicContact CG-CG1 3.88Å; N317-I321 VanDerWaalsContact O-CG1 3.32Å; N317-I321 WeakPolarHBondContact O-CG1 3.4Å; N317-I321 PolarHBondContact O-N 3.44Å; L318-I321 HydrophobicContact CD2-CD1 4.37Å; L318-I321 PolarHBondContact O-N 2.92Å; H319-I321 PolarHBondContact O-N 2.92Å; I321-T324 PolarHBondContact O-N 3.19Å; I321-H325 PolarHBondContact O-CD2 3.35Å; I321-H325 VanDerWaalsContact O-CD2 3.3Å; I321-H325 PolarHBondContact O-N 3.14Å; I321-H325 VanDerWaalsContact O-N 3.08Å; I321-Q335 HydrophobicContact CG2-CB 3.65Å; I321-L336 HydrophobicContact CB-CD2 4.17Å; I321-L336 HydrophobicContact CG2-CD2 3.81Å; I321-L336 HydrophobicContact CG2-CG 3.88Å; I321-Y339 HydrophobicContact CD1-CD2 3.8Å
322	I	98.6	Very high	97.8	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.9	-49.5	175.9	-65.8	169.6	0	0	0	109.7	L318 H319 C320 T324 H325 W326 L336 V354 I355 M371 L375	L318-I322 WeakPolarHBondContact O-CG1 3.42Å; L318-I322 PolarHBondContact O-N 3.27Å; H319-I322 PolarHBondContact O-N 2.77Å; C320-I322 VanDerWaalsContact C-N 3.33Å; C320-I322 PolarHBondContact O-N 3.4Å; I322-T324 VanDerWaalsContact C-N 3.25Å; I322-T324 PolarHBondContact O-N 3.24Å; I322-H325 CarbonylContact O-C 3.51Å; I322-H325 PolarHBondContact O-N 3.49Å; I322-H325 VanDerWaalsContact O-N 3.07Å; I322-W326 HydrophobicContact CG2-CB 4.5Å; I322-W326 WeakPolarHBondContact O-CA 3.33Å; I322-W326 VanDerWaalsContact O-CB 3.31Å; I322-W326 WeakPolarHBondContact O-CB 3.5Å; I322-W326 PolarHBondContact O-N 3.06Å; I322-L336 HydrophobicContact CG1-CD1 4.1Å; I322-L336 HydrophobicContact CG1-CD2 4.09Å; I322-V354 HydrophobicContact CD1-CG1 3.84Å; I322-I355 HydrophobicContact CD1-CG1 4.13Å; I322-M371 HydrophobicContact CG2-CE 3.83Å; I322-L375 HydrophobicContact CG1-CD2 4.45Å
323	K	96.6	Very high	97.8	Very high	86 Å²	86	49.3 Å²	49.3	37%	0.374	22%	0.219	S	C	.	.	H	α-helix	trans	-54.9	-39.7	178.4	-175.6	-175.8	177.4	-171.8	0	112.8	H319 C320	H319-K323 WeakPolarHBondContact O-CB 3.46Å; H319-K323 PolarHBondContact O-N 2.85Å; C320-K323 WeakPolarHBondContact O-CB 3.31Å; C320-K323 PolarHBondContact O-N 3.45Å
324	T	95	Very high	97.8	Very high	52 Å²	52	51.3 Å²	51.3	32%	0.319	24%	0.236	S	C	.	.	H	α-helix	trans	-72.7	-34.9	179.1	-58.7	0	0	0	0	112.1	L79 C320 I321 I322	L79-T324 HydrophobicContact CD2-CG2 3.78Å; C320-T324 PolarHBondContact O-N 2.9Å; C320-T324 PolarHBondContact O-OG1 3.24Å; C320-T324 VanDerWaalsContact O-OG1 3.05Å; I321-T324 PolarHBondContact O-N 3.19Å; I322-T324 VanDerWaalsContact C-N 3.25Å; I322-T324 PolarHBondContact O-N 3.24Å
325	H	96.4	Very high	97.7	Very high	43 Å²	43	54.7 Å²	54.7	20%	0.199	25%	0.252	C	S	.	.	H	α-helix	trans	-118.9	6.3	-167.5	-59.5	-60.6	0	0	0	116.1	I321 I322 R327 E328 C332	I321-H325 PolarHBondContact O-CD2 3.35Å; I321-H325 VanDerWaalsContact O-CD2 3.3Å; I321-H325 PolarHBondContact O-N 3.14Å; I321-H325 VanDerWaalsContact O-N 3.08Å; I322-H325 CarbonylContact O-C 3.51Å; I322-H325 PolarHBondContact O-N 3.49Å; I322-H325 VanDerWaalsContact O-N 3.07Å; H325-R327 PolarHBondContact O-N 3.07Å; H325-E328 CarbonylContact O-C 3.41Å; H325-E328 PolarHBondContact O-N 3.45Å; H325-C332 HydrophobicContact CB-CB 3.75Å
326	W	97.5	Very high	97.7	Very high	85 Å²	85	53.8 Å²	53.8	32%	0.322	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-28	-171.7	72.6	-89.5	0	0	0	115	I322 E328 H367 M371	I322-W326 HydrophobicContact CG2-CB 4.5Å; I322-W326 WeakPolarHBondContact O-CA 3.33Å; I322-W326 VanDerWaalsContact O-CB 3.31Å; I322-W326 WeakPolarHBondContact O-CB 3.5Å; I322-W326 PolarHBondContact O-N 3.06Å; W326-E328 VanDerWaalsContact C-N 3.31Å; W326-H367 AromaticContact CD1-CE1 3.43Å; W326-H367 VanDerWaalsContact CD1-CE1 3.43Å; W326-H367 AromaticContact CD1-ND1 3.75Å; W326-H367 AromaticContact CD1-NE2 3.93Å; W326-H367 AromaticContact CD2-ND1 3.85Å; W326-H367 AromaticContact CG-CE1 3.7Å; W326-H367 AromaticContact CG-CG 3.95Å; W326-H367 AromaticContact CG-ND1 3.67Å; W326-H367 AromaticContact CG-NE2 3.98Å; W326-H367 AromaticContact NE1-CE1 3.86Å; W326-H367 AromaticContact NE1-ND1 3.95Å; W326-M371 HydrophobicContact CB-CE 4.09Å; W326-M371 HydrophobicContact CB-CG 4.49Å; W326-M371 HydrophobicContact CB-SD 4.47Å; W326-M371 HydrophobicContact CE3-CG 4.49Å
327	R	97.8	Very high	97.7	Very high	198 Å²	198	54.2 Å²	54.2	75%	0.747	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-24.8	177.7	-62.7	-173.9	179.3	-177.1	1.2	112.9	H325	H325-R327 PolarHBondContact O-N 3.07Å
328	E	97.8	Very high	97.6	Very high	125 Å²	125	55.4 Å²	55.4	58%	0.584	26%	0.26	S	S	*	.			trans	-117.1	75.2	-173.7	-68.6	-64.2	165.1	0	0	110.4	H325 W326 K330 T331 C332	H325-E328 CarbonylContact O-C 3.41Å; H325-E328 PolarHBondContact O-N 3.45Å; W326-E328 VanDerWaalsContact C-N 3.31Å; E328-K330 PolarHBondContact O-N 2.95Å; E328-T331 WeakPolarHBondContact O-CA 3.48Å; E328-T331 WeakPolarHBondContact O-CB 3.45Å; E328-T331 PolarHBondContact O-N 3.08Å; E328-C332 PolarHBondContact O-N 2.87Å
329	R	97.4	Very high	97.4	Very high	111 Å²	111	56.6 Å²	56.6	42%	0.419	27%	0.265	S	S	.	.	H	α-helix	trans	-50	-34.6	-170.7	65.5	173.7	-167.2	-137.4	-3.2	115.7	A333 E378	R329-A333 WeakPolarHBondContact O-CB 3.38Å; R329-A333 PolarHBondContact O-N 2.96Å; R329-E378 HydrophobicContact CB-CG 4.3Å; R329-E378 HydrophobicContact CG-CG 3.84Å; R329-E378 IonicContact CZ-OE1 2.62Å; R329-E378 IonicContact NE-OE1 3.57Å; R329-E378 PolarHBondContact NE-OE1 2.88Å; R329-E378 IonicContact NH2-OE1 3.53Å; R329-E378 PolarHBondContact NH2-OE1 3.46Å
330	K	98.4	Very high	97	Very high	139 Å²	139	58 Å²	58	60%	0.604	28%	0.278	S	S	*	.	H	α-helix	trans	-70.7	-44.2	177.6	-71.1	-175.3	178.4	-179.2	0	111.6	E328 A334	E328-K330 PolarHBondContact O-N 2.95Å; K330-A334 WeakPolarHBondContact O-CB 3.48Å; K330-A334 PolarHBondContact O-N 3.38Å
331	T	97.3	Very high	96.4	Very high	59 Å²	59	59.2 Å²	59.2	36%	0.362	29%	0.292	S	S	.	.	H	α-helix	trans	-64.7	-46.2	175.4	-55.3	0	0	0	0	109.8	E328 A333 A334 Q335	E328-T331 WeakPolarHBondContact O-CA 3.48Å; E328-T331 WeakPolarHBondContact O-CB 3.45Å; E328-T331 PolarHBondContact O-N 3.08Å; T331-A333 PolarHBondContact O-N 3.12Å; T331-A334 PolarHBondContact O-N 3.44Å; T331-Q335 HydrophobicContact CG2-CG 4.18Å; T331-Q335 WeakPolarHBondContact O-CB 3.44Å; T331-Q335 VanDerWaalsContact O-CG 3.25Å; T331-Q335 WeakPolarHBondContact O-CG 3.38Å; T331-Q335 PolarHBondContact O-N 3.17Å
332	C	98.5	Very high	95.8	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-55.6	-50.4	176.1	-167	0	0	0	0	111.8	H325 E328 A334 Q335 L336 L375	H325-C332 HydrophobicContact CB-CB 3.75Å; E328-C332 PolarHBondContact O-N 2.87Å; C332-A334 PolarHBondContact O-N 3.12Å; C332-Q335 PolarHBondContact O-N 3.39Å; C332-L336 VanDerWaalsContact O-CG 3.3Å; C332-L336 WeakPolarHBondContact O-CG 3.33Å; C332-L336 PolarHBondContact O-N 2.8Å; C332-L375 HydrophobicContact CB-CD1 3.9Å
333	A	98.8	Very high	95.4	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-61	-42.9	177.5	0	0	0	0	0	112.3	R329 T331 L337 L375 E378 L379 L382	R329-A333 WeakPolarHBondContact O-CB 3.38Å; R329-A333 PolarHBondContact O-N 2.96Å; T331-A333 PolarHBondContact O-N 3.12Å; A333-L337 WeakPolarHBondContact O-CB 3.32Å; A333-L337 VanDerWaalsContact O-CG 3.3Å; A333-L337 WeakPolarHBondContact O-CG 3.18Å; A333-L337 PolarHBondContact O-N 3.17Å; A333-L337 VanDerWaalsContact O-N 3.09Å; A333-L375 HydrophobicContact CB-CD1 3.97Å; A333-E378 HydrophobicContact CB-CB 3.98Å; A333-L379 HydrophobicContact CB-CD2 3.81Å; A333-L379 HydrophobicContact CB-CG 3.94Å; A333-L382 HydrophobicContact CB-CD1 3.75Å
334	A	97.9	Very high	95.2	Very high	45 Å²	45	72.4 Å²	72.4	37%	0.372	35%	0.353	S	S	.	.	H	α-helix	trans	-64.3	-41.9	178	0	0	0	0	0	112.4	K330 T331 C332 L337 S338	K330-A334 WeakPolarHBondContact O-CB 3.48Å; K330-A334 PolarHBondContact O-N 3.38Å; T331-A334 PolarHBondContact O-N 3.44Å; C332-A334 PolarHBondContact O-N 3.12Å; A334-L337 PolarHBondContact O-N 3.45Å; A334-S338 WeakPolarHBondContact O-CB 3.42Å; A334-S338 PolarHBondContact O-N 3.31Å; A334-S338 PolarHBondContact O-OG 2.89Å
335	Q	96.9	Very high	95.3	Very high	72 Å²	72	71.3 Å²	71.3	34%	0.336	35%	0.345	S	S	.	.	H	α-helix	trans	-67.1	-43	179.5	-69.5	-65.7	-16	0	0	111.8	I321 T331 C332 L337 S338 Y339	I321-Q335 HydrophobicContact CG2-CB 3.65Å; T331-Q335 HydrophobicContact CG2-CG 4.18Å; T331-Q335 WeakPolarHBondContact O-CB 3.44Å; T331-Q335 VanDerWaalsContact O-CG 3.25Å; T331-Q335 WeakPolarHBondContact O-CG 3.38Å; T331-Q335 PolarHBondContact O-N 3.17Å; C332-Q335 PolarHBondContact O-N 3.39Å; Q335-L337 VanDerWaalsContact C-N 3.35Å; Q335-L337 PolarHBondContact O-N 2.78Å; Q335-S338 WeakPolarHBondContact CA-OG 3.35Å; Q335-S338 CarbonylContact O-C 3.5Å; Q335-S338 PolarHBondContact O-N 3.43Å; Q335-S338 PolarHBondContact O-OG 3.24Å; Q335-Y339 PolarHBondContact O-N 3.46Å; Q335-Y339 VanDerWaalsContact O-N 3.16Å
336	L	98.3	Very high	95.4	Very high	1 Å²	1	69.7 Å²	69.7	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-57.8	-46.7	173.5	-72.7	169.1	0	0	0	111.6	L318 I321 I322 C332 S338 Y339 I351 L375 L379	L318-L336 HydrophobicContact CB-CD2 4.15Å; L318-L336 HydrophobicContact CD2-CD2 3.65Å; L318-L336 HydrophobicContact CG-CD2 4.47Å; I321-L336 HydrophobicContact CB-CD2 4.17Å; I321-L336 HydrophobicContact CG2-CD2 3.81Å; I321-L336 HydrophobicContact CG2-CG 3.88Å; I322-L336 HydrophobicContact CG1-CD1 4.1Å; I322-L336 HydrophobicContact CG1-CD2 4.09Å; C332-L336 VanDerWaalsContact O-CG 3.3Å; C332-L336 WeakPolarHBondContact O-CG 3.33Å; C332-L336 PolarHBondContact O-N 2.8Å; L336-S338 VanDerWaalsContact C-N 3.28Å; L336-S338 PolarHBondContact O-N 3.44Å; L336-Y339 VanDerWaalsContact O-CB 3.24Å; L336-Y339 WeakPolarHBondContact O-CB 3.46Å; L336-Y339 PolarHBondContact O-N 3.44Å; L336-I351 HydrophobicContact CB-CD1 3.93Å; L336-I351 HydrophobicContact CB-CG1 4.21Å; L336-I351 HydrophobicContact CD1-CG2 4.24Å; L336-L375 HydrophobicContact CD1-CD1 4.3Å; L336-L375 HydrophobicContact CD1-CD2 4.09Å; L336-L379 HydrophobicContact CB-CD2 4.46Å
337	L	97.7	Very high	95.4	Very high	38 Å²	38	67.1 Å²	67.1	20%	0.199	33%	0.33	C	S	.	.	H	α-helix	trans	-71.8	-20.8	179.7	-69.4	173.1	0	0	0	113.8	A333 A334 Q335 I351 L379 L382 Q383	A333-L337 WeakPolarHBondContact O-CB 3.32Å; A333-L337 VanDerWaalsContact O-CG 3.3Å; A333-L337 WeakPolarHBondContact O-CG 3.18Å; A333-L337 PolarHBondContact O-N 3.17Å; A333-L337 VanDerWaalsContact O-N 3.09Å; A334-L337 PolarHBondContact O-N 3.45Å; Q335-L337 VanDerWaalsContact C-N 3.35Å; Q335-L337 PolarHBondContact O-N 2.78Å; L337-I351 HydrophobicContact CD2-CD1 3.92Å; L337-L379 HydrophobicContact CD1-CD2 3.99Å; L337-L379 HydrophobicContact CD2-CD2 4.15Å; L337-L379 HydrophobicContact CG-CD2 3.76Å; L337-L382 HydrophobicContact CD1-CB 3.4Å; L337-L382 VanDerWaalsContact CD1-CB 3.4Å; L337-L382 HydrophobicContact CD1-CD1 3.8Å; L337-L382 HydrophobicContact CD1-CG 4.25Å; L337-Q383 HydrophobicContact CD1-CG 3.75Å; L337-Q383 HydrophobicContact CD2-CG 3.52Å; L337-Q383 HydrophobicContact CG-CG 4.29Å
338	S	95.6	Very high	95.4	Very high	44 Å²	44	58.9 Å²	58.9	31%	0.308	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	9.9	173.7	63.3	0	0	0	0	113.8	A334 Q335 L336 P340	A334-S338 WeakPolarHBondContact O-CB 3.42Å; A334-S338 PolarHBondContact O-N 3.31Å; A334-S338 PolarHBondContact O-OG 2.89Å; Q335-S338 WeakPolarHBondContact CA-OG 3.35Å; Q335-S338 CarbonylContact O-C 3.5Å; Q335-S338 PolarHBondContact O-N 3.43Å; Q335-S338 PolarHBondContact O-OG 3.24Å; L336-S338 VanDerWaalsContact C-N 3.28Å; L336-S338 PolarHBondContact O-N 3.44Å; S338-P340 VanDerWaalsContact O-CD 3.3Å; S338-P340 WeakPolarHBondContact O-CD 2.94Å; S338-P340 VanDerWaalsContact O-N 3.12Å
339	Y	95.8	Very high	95.5	Very high	25 Å²	25	54.7 Å²	54.7	10%	0.098	28%	0.28	C	S	.	.			trans	-54.8	116.5	-179.6	177.3	-117.8	0	0	0	111	H248 I314 N317 L318 I321 Q335 L336 I345 L347	H248-Y339 AromaticContact CE1-CE1 3.67Å; H248-Y339 AromaticContact NE2-CE1 3.36Å; H248-Y339 WeakPolarHBondContact NE2-CE1 3.47Å; H248-Y339 AromaticContact NE2-CZ 3.38Å; H248-Y339 PolarHBondContact NE2-OH 3.45Å; I314-Y339 HydrophobicContact CG1-CE1 4.35Å; I314-Y339 HydrophobicContact CG2-CE1 4.26Å; N317-Y339 HydrophobicContact CB-CE2 3.55Å; N317-Y339 PolarHBondContact ND2-OH 3.45Å; L318-Y339 HydrophobicContact CD2-CD1 4.12Å; L318-Y339 HydrophobicContact CD2-CD2 4.33Å; L318-Y339 HydrophobicContact CD2-CG 3.88Å; I321-Y339 HydrophobicContact CD1-CD2 3.8Å; Q335-Y339 PolarHBondContact O-N 3.46Å; Q335-Y339 VanDerWaalsContact O-N 3.16Å; L336-Y339 VanDerWaalsContact O-CB 3.24Å; L336-Y339 WeakPolarHBondContact O-CB 3.46Å; L336-Y339 PolarHBondContact O-N 3.44Å; Y339-I345 HydrophobicContact CD1-CD1 4.24Å; Y339-I345 HydrophobicContact CE1-CD1 4.13Å; Y339-L347 HydrophobicContact CD1-CD1 3.92Å; Y339-L347 HydrophobicContact CG-CD1 4.47Å
340	P	90.3	Very high	95.5	Very high	81 Å²	81	49.4 Å²	49.4	53%	0.526	26%	0.26	S	S	.	.			trans	-86.3	147.9	-176.2	37.2	-36.4	0	0	0	110.4	L250 S338	L250-P340 HydrophobicContact CD1-CB 3.66Å; L250-P340 HydrophobicContact CD1-CG 4.02Å; S338-P340 VanDerWaalsContact O-CD 3.3Å; S338-P340 WeakPolarHBondContact O-CD 2.94Å; S338-P340 VanDerWaalsContact O-N 3.12Å
341	G	84.6	Confident	95.6	Very high	31 Å²	31	42.8 Å²	42.8	32%	0.32	23%	0.231	S	C	.	.			trans	-150.8	153.5	176.5	0	0	0	0	0	111.1	N343	G341-N343 VanDerWaalsContact C-N 3.3Å; G341-N343 PolarHBondContact O-N 3.41Å
342	K	84.2	Confident	95.6	Very high	118 Å²	118	40 Å²	40	51%	0.513	21%	0.214	S	C	.	.	S	Bend	trans	-63.8	-36.2	179.9	-175.9	177.8	-178	178.5	0	112.5	H248 L250	H248-K342 VanDerWaalsContact O-CB 3.29Å; H248-K342 WeakPolarHBondContact O-CB 3.44Å; H248-K342 PolarHBondContact O-N 3.33Å; L250-K342 HydrophobicContact CD2-CB 4.04Å
343	N	90.4	Very high	95.7	Very high	70 Å²	70	40.1 Å²	40.1	37%	0.374	22%	0.215	S	C	.	.	S	Bend	trans	-121.6	158.6	177.2	-75.9	-58.7	0	0	0	110.8	R247 G341	R247-N343 PolarHBondContact O-ND2 3Å; G341-N343 VanDerWaalsContact C-N 3.3Å; G341-N343 PolarHBondContact O-N 3.41Å
344	K	93.1	Very high	95.7	Very high	184 Å²	184	40.2 Å²	40.2	80%	0.8	22%	0.216	S	C	*	.			trans	-66.4	136.4	173.7	-66.8	-174.2	176.7	-177.7	0	110.2	P301	P301-K344 HydrophobicContact CB-CB 4.01Å; P301-K344 WeakPolarHBondContact CB-O 3.29Å; P301-K344 HydrophobicContact CG-CB 3.82Å
345	I	96.9	Very high	95.7	Very high	29 Å²	29	38.1 Å²	38.1	15%	0.149	20%	0.198	C	C	.	.			trans	-130.7	157.7	176.8	59.1	172.7	0	0	0	109.5	P304 I314 Y339 L347	P304-I345 HydrophobicContact CG-CG2 4.45Å; I314-I345 HydrophobicContact CD1-CD1 3.85Å; I314-I345 HydrophobicContact CD1-CG2 3.98Å; I314-I345 HydrophobicContact CG1-CD1 4.03Å; I314-I345 HydrophobicContact CG2-CD1 4.06Å; Y339-I345 HydrophobicContact CD1-CD1 4.24Å; Y339-I345 HydrophobicContact CE1-CD1 4.13Å; I345-L347 HydrophobicContact CD1-CD1 4.27Å; I345-L347 HydrophobicContact CG1-CB 4.33Å; I345-L347 PolarHBondContact O-N 2.82Å
346	P	97.5	Very high	95.8	Very high	9 Å²	9	34.7 Å²	34.7	6%	0.058	18%	0.182	C	C	.	.			trans	-74.6	69.8	172.9	31.4	-32.8	0	0	0	110.3	A297 P301 M303 N348 Y349 H350	A297-P346 HydrophobicContact CB-CB 4.28Å; P301-P346 WeakPolarHBondContact O-CD 3.49Å; M303-P346 HydrophobicContact CB-CG 3.78Å; M303-P346 HydrophobicContact CE-CG 3.99Å; M303-P346 HydrophobicContact CG-CG 4.07Å; P346-N348 VanDerWaalsContact C-N 3.32Å; P346-N348 PolarHBondContact O-N 3.3Å; P346-Y349 HydrophobicContact CB-CD2 4.04Å; P346-Y349 WeakPolarHBondContact O-CB 3.33Å; P346-Y349 PolarHBondContact O-N 3.48Å; P346-H350 PolarHBondContact O-N 2.96Å
347	L	98.1	Very high	95.8	Very high	31 Å²	31	35.1 Å²	35.1	16%	0.162	19%	0.187	C	C	.	.	H	α-helix	trans	-55.6	-40.3	-168.4	180	59	0	0	0	113.6	L318 Y339 I345 Y349 H350 I351	L318-L347 HydrophobicContact CD2-CD1 4.32Å; Y339-L347 HydrophobicContact CD1-CD1 3.92Å; Y339-L347 HydrophobicContact CG-CD1 4.47Å; I345-L347 HydrophobicContact CD1-CD1 4.27Å; I345-L347 HydrophobicContact CG1-CB 4.33Å; I345-L347 PolarHBondContact O-N 2.82Å; L347-Y349 VanDerWaalsContact C-N 3.27Å; L347-Y349 PolarHBondContact O-N 2.88Å; L347-H350 PolarHBondContact O-N 3.5Å; L347-I351 HydrophobicContact CD1-CD1 3.99Å; L347-I351 HydrophobicContact CD1-CG1 4Å; L347-I351 HydrophobicContact CD2-CD1 4.33Å; L347-I351 HydrophobicContact CG-CD1 3.73Å; L347-I351 HydrophobicContact CG-CG1 4.22Å; L347-I351 WeakPolarHBondContact O-CG1 3.4Å; L347-I351 PolarHBondContact O-N 3.32Å
348	N	98.4	Very high	95.9	Very high	25 Å²	25	33.5 Å²	33.5	13%	0.134	18%	0.178	C	C	.	.	H	α-helix	trans	-58.3	-39	177.9	-76	-3	0	0	0	112.5	P346 V352 S386 L387 V390	P346-N348 VanDerWaalsContact C-N 3.32Å; P346-N348 PolarHBondContact O-N 3.3Å; N348-V352 VanDerWaalsContact O-CG2 3.31Å; N348-V352 WeakPolarHBondContact O-CG2 3.49Å; N348-V352 PolarHBondContact O-N 3.06Å; N348-S386 WeakPolarHBondContact ND2-CB 3.05Å; N348-S386 PolarHBondContact ND2-OG 2.8Å; N348-L387 HydrophobicContact CB-CD1 3.99Å; N348-V390 HydrophobicContact CB-CG2 4.15Å
349	Y	98.8	Very high	96.1	Very high	37 Å²	37	31.5 Å²	31.5	15%	0.145	16%	0.164	C	C	.	.	H	α-helix	trans	-68.2	-44.8	177.4	-73.3	-99.5	0	0	0	111	F292 D296 A297 M303 P346 L347 I351 V352 E353 V390 Q393	F292-Y349 AromaticContact CD1-CD1 3.95Å; F292-Y349 HydrophobicContact CD1-CD1 3.95Å; F292-Y349 HydrophobicContact CD1-CE1 4.43Å; F292-Y349 HydrophobicContact CD2-CD1 4.04Å; F292-Y349 AromaticContact CE1-CD1 3.85Å; F292-Y349 HydrophobicContact CE1-CD1 3.85Å; F292-Y349 HydrophobicContact CE1-CE1 4.18Å; F292-Y349 AromaticContact CE2-CD1 3.98Å; F292-Y349 HydrophobicContact CE2-CD1 3.98Å; F292-Y349 HydrophobicContact CG-CD1 4.05Å; F292-Y349 AromaticContact CZ-CD1 3.88Å; F292-Y349 HydrophobicContact CZ-CD1 3.88Å; F292-Y349 HydrophobicContact CZ-CE1 4.46Å; D296-Y349 HydrophobicContact CB-CE1 4.23Å; D296-Y349 WeakPolarHBondContact O-CE1 3.49Å; D296-Y349 PolarHBondContact O-OH 3.31Å; D296-Y349 VanDerWaalsContact O-OH 3.06Å; A297-Y349 HydrophobicContact CB-CD1 4.38Å; A297-Y349 HydrophobicContact CB-CD2 3.9Å; A297-Y349 HydrophobicContact CB-CE1 4.11Å; A297-Y349 HydrophobicContact CB-CE2 3.59Å; A297-Y349 HydrophobicContact CB-CG 4.29Å; M303-Y349 HydrophobicContact CE-CD1 4.35Å; M303-Y349 HydrophobicContact CE-CG 4.1Å; P346-Y349 HydrophobicContact CB-CD2 4.04Å; P346-Y349 WeakPolarHBondContact O-CB 3.33Å; P346-Y349 PolarHBondContact O-N 3.48Å; L347-Y349 VanDerWaalsContact C-N 3.27Å; L347-Y349 PolarHBondContact O-N 2.88Å; Y349-I351 PolarHBondContact O-N 3.37Å; Y349-V352 PolarHBondContact O-N 3.3Å; Y349-E353 WeakPolarHBondContact O-CB 3.49Å; Y349-E353 PolarHBondContact O-N 2.89Å; Y349-V390 HydrophobicContact CD1-CG1 3.81Å; Y349-V390 HydrophobicContact CD2-CG1 4.12Å; Y349-V390 HydrophobicContact CD2-CG2 3.97Å; Y349-V390 HydrophobicContact CE1-CG1 3.97Å; Y349-V390 HydrophobicContact CE1-CG2 4.37Å; Y349-V390 HydrophobicContact CE2-CG1 4.26Å; Y349-V390 HydrophobicContact CE2-CG2 3.53Å; Y349-V390 HydrophobicContact CG-CG1 3.88Å; Y349-Q393 PolarHBondContact OH-OE1 3.45Å
350	H	98.8	Very high	96.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.5	-43.2	175.5	-70.8	-62.4	0	0	0	112.4	I314 L318 P346 L347 E353 V354	I314-H350 HydrophobicContact CG2-CB 3.95Å; L318-H350 HydrophobicContact CD1-CB 3.79Å; P346-H350 PolarHBondContact O-N 2.96Å; L347-H350 PolarHBondContact O-N 3.5Å; H350-E353 PolarHBondContact O-N 2.73Å; H350-V354 VanDerWaalsContact O-CB 3.3Å; H350-V354 WeakPolarHBondContact O-CB 3.41Å; H350-V354 WeakPolarHBondContact O-CG2 3.46Å; H350-V354 PolarHBondContact O-N 3.21Å
351	I	98.9	Very high	96.6	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.5	-47.9	177.3	-69.3	168.4	0	0	0	110.8	L318 L336 L337 L347 Y349 V354 I355 L379	L318-I351 HydrophobicContact CD1-CG1 4.37Å; L318-I351 HydrophobicContact CD2-CG1 4.36Å; L336-I351 HydrophobicContact CB-CD1 3.93Å; L336-I351 HydrophobicContact CB-CG1 4.21Å; L336-I351 HydrophobicContact CD1-CG2 4.24Å; L337-I351 HydrophobicContact CD2-CD1 3.92Å; L347-I351 HydrophobicContact CD1-CD1 3.99Å; L347-I351 HydrophobicContact CD1-CG1 4Å; L347-I351 HydrophobicContact CD2-CD1 4.33Å; L347-I351 HydrophobicContact CG-CD1 3.73Å; L347-I351 HydrophobicContact CG-CG1 4.22Å; L347-I351 WeakPolarHBondContact O-CG1 3.4Å; L347-I351 PolarHBondContact O-N 3.32Å; Y349-I351 PolarHBondContact O-N 3.37Å; I351-V354 PolarHBondContact O-N 3.07Å; I351-I355 HydrophobicContact CG2-CD1 3.76Å; I351-I355 WeakPolarHBondContact O-CB 3.41Å; I351-I355 VanDerWaalsContact O-CG1 3.28Å; I351-I355 WeakPolarHBondContact O-CG1 3.43Å; I351-I355 PolarHBondContact O-N 2.95Å; I351-L379 HydrophobicContact CG2-CD1 3.54Å; I351-L379 HydrophobicContact CG2-CD2 4.27Å
352	V	98.9	Very high	97.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.8	-43.5	-179.5	169.7	0	0	0	0	111	F292 N348 Y349 I355 F356 L376 L387 V390 L391 A394	F292-V352 HydrophobicContact CE2-CB 4.45Å; F292-V352 HydrophobicContact CE2-CG1 4.26Å; F292-V352 HydrophobicContact CZ-CG1 4.39Å; N348-V352 VanDerWaalsContact O-CG2 3.31Å; N348-V352 WeakPolarHBondContact O-CG2 3.49Å; N348-V352 PolarHBondContact O-N 3.06Å; Y349-V352 PolarHBondContact O-N 3.3Å; V352-I355 PolarHBondContact O-N 2.81Å; V352-F356 HydrophobicContact CG1-CD2 3.69Å; V352-F356 HydrophobicContact CG1-CE2 3.65Å; V352-F356 WeakPolarHBondContact O-CD2 3.44Å; V352-F356 PolarHBondContact O-N 3.03Å; V352-L376 HydrophobicContact CG2-CD2 4.38Å; V352-L387 HydrophobicContact CG2-CD1 4.21Å; V352-V390 HydrophobicContact CB-CG1 4.25Å; V352-V390 HydrophobicContact CG2-CG1 4.01Å; V352-L391 HydrophobicContact CG1-CD1 4.22Å; V352-A394 HydrophobicContact CG1-CB 3.72Å
353	E	98.9	Very high	97.9	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.009	12%	0.115	C	C	.	.	H	α-helix	trans	-66.1	-41.6	178.3	-171.5	169.5	-148.4	0	0	112.9	F289 R290 M291 F292 R311 Y349 H350 F356 G357	F289-E353 HydrophobicContact CD1-CG 3.91Å; F289-E353 WeakPolarHBondContact CD1-O 3.48Å; F289-E353 HydrophobicContact CE1-CG 3.9Å; R290-E353 WeakPolarHBondContact CD-OE1 3.31Å; R290-E353 IonicContact CZ-OE1 2.81Å; R290-E353 IonicContact NH1-OE1 3.21Å; R290-E353 PolarHBondContact NH1-OE1 3.32Å; R290-E353 IonicContact NH1-OE2 3.42Å; R290-E353 PolarHBondContact NH1-OE2 2.99Å; M291-E353 HydrophobicContact CG-CG 4.05Å; M291-E353 PolarHBondContact N-OE1 3.21Å; F292-E353 HydrophobicContact CD2-CB 3.75Å; F292-E353 HydrophobicContact CD2-CG 4.24Å; F292-E353 HydrophobicContact CE2-CB 4.02Å; F292-E353 PolarHBondContact N-OE1 3.02Å; F292-E353 VanDerWaalsContact N-OE1 3.08Å; R311-E353 IonicContact CZ-OE2 3.96Å; R311-E353 IonicContact NE-OE2 2.78Å; R311-E353 VanDerWaalsContact NH2-CD 3.26Å; R311-E353 IonicContact NH2-OE1 3.41Å; R311-E353 PolarHBondContact NH2-OE1 3.31Å; R311-E353 VanDerWaalsContact NH2-OE1 3.12Å; R311-E353 IonicContact NH2-OE2 3.12Å; R311-E353 PolarHBondContact NH2-OE2 2.97Å; Y349-E353 WeakPolarHBondContact O-CB 3.49Å; Y349-E353 PolarHBondContact O-N 2.89Å; H350-E353 PolarHBondContact O-N 2.73Å; E353-F356 PolarHBondContact O-N 3.18Å; E353-G357 PolarHBondContact O-N 3.02Å
354	V	98.9	Very high	98.3	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.018	12%	0.115	C	C	.	.	H	α-helix	trans	-62.7	-43.5	175.4	164.4	0	0	0	0	110.8	E315 L318 I322 H350 I351 G357 E358	E315-V354 HydrophobicContact CB-CG2 4.1Å; E315-V354 HydrophobicContact CG-CG2 3.86Å; L318-V354 HydrophobicContact CB-CB 4.38Å; L318-V354 HydrophobicContact CB-CG1 3.99Å; L318-V354 HydrophobicContact CB-CG2 4.04Å; L318-V354 HydrophobicContact CD1-CG2 4.01Å; I322-V354 HydrophobicContact CD1-CG1 3.84Å; H350-V354 VanDerWaalsContact O-CB 3.3Å; H350-V354 WeakPolarHBondContact O-CB 3.41Å; H350-V354 WeakPolarHBondContact O-CG2 3.46Å; H350-V354 PolarHBondContact O-N 3.21Å; I351-V354 PolarHBondContact O-N 3.07Å; V354-G357 PolarHBondContact O-N 3.26Å; V354-E358 PolarHBondContact O-N 3.4Å
355	I	98.9	Very high	98.5	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-63.2	-44.6	178.2	-72.7	169.9	0	0	0	111.4	I322 I351 V352 E358 L359 Y372 L375 L376 L379	I322-I355 HydrophobicContact CD1-CG1 4.13Å; I351-I355 HydrophobicContact CG2-CD1 3.76Å; I351-I355 WeakPolarHBondContact O-CB 3.41Å; I351-I355 VanDerWaalsContact O-CG1 3.28Å; I351-I355 WeakPolarHBondContact O-CG1 3.43Å; I351-I355 PolarHBondContact O-N 2.95Å; V352-I355 PolarHBondContact O-N 2.81Å; I355-E358 PolarHBondContact O-N 3.47Å; I355-L359 WeakPolarHBondContact O-CB 3.46Å; I355-L359 PolarHBondContact O-N 3.4Å; I355-Y372 HydrophobicContact CG2-CD1 4Å; I355-Y372 HydrophobicContact CG2-CG 4.41Å; I355-L375 HydrophobicContact CD1-CD2 3.78Å; I355-L375 HydrophobicContact CD1-CG 4.05Å; I355-L375 HydrophobicContact CG1-CD2 4.1Å; I355-L376 HydrophobicContact CD1-CD2 3.78Å; I355-L376 HydrophobicContact CD1-CG 4.15Å; I355-L376 HydrophobicContact CG2-CD1 3.81Å; I355-L376 HydrophobicContact CG2-CD2 4.2Å; I355-L376 HydrophobicContact CG2-CG 3.91Å; I355-L379 HydrophobicContact CD1-CD1 3.45Å; I355-L379 VanDerWaalsContact CD1-CD1 3.45Å
356	F	98.9	Very high	98.6	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-70.1	-34.3	175.6	-77.6	-55.5	0	0	0	112.5	F289 M291 V352 E353 E358 L359 F360 L376 L391 A394 L398 W416	F289-F356 HydrophobicContact CE1-CB 3.91Å; F289-F356 HydrophobicContact CZ-CB 3.87Å; M291-F356 HydrophobicContact SD-CD2 4.32Å; V352-F356 HydrophobicContact CG1-CD2 3.69Å; V352-F356 HydrophobicContact CG1-CE2 3.65Å; V352-F356 WeakPolarHBondContact O-CD2 3.44Å; V352-F356 PolarHBondContact O-N 3.03Å; E353-F356 PolarHBondContact O-N 3.18Å; F356-E358 VanDerWaalsContact C-N 3.33Å; F356-E358 PolarHBondContact O-N 2.96Å; F356-L359 HydrophobicContact CD1-CD2 4.16Å; F356-L359 HydrophobicContact CE1-CD2 4.38Å; F356-L359 PolarHBondContact O-N 2.73Å; F356-F360 HydrophobicContact CB-CD2 3.99Å; F356-F360 HydrophobicContact CB-CE2 3.91Å; F356-F360 HydrophobicContact CD1-CD2 4.28Å; F356-F360 AromaticContact CD1-CE2 3.46Å; F356-F360 HydrophobicContact CD1-CE2 3.46Å; F356-F360 VanDerWaalsContact CD1-CE2 3.46Å; F356-F360 AromaticContact CD1-CZ 3.83Å; F356-F360 HydrophobicContact CD1-CZ 3.83Å; F356-F360 HydrophobicContact CE1-CE2 4.27Å; F356-F360 HydrophobicContact CE1-CZ 4.29Å; F356-F360 AromaticContact CG-CE2 3.96Å; F356-F360 HydrophobicContact CG-CE2 3.96Å; F356-F360 WeakPolarHBondContact O-CB 3.2Å; F356-F360 WeakPolarHBondContact O-CD2 3.48Å; F356-F360 WeakPolarHBondContact O-CG 3.35Å; F356-F360 PolarHBondContact O-N 3.1Å; F356-L376 HydrophobicContact CZ-CD1 4.47Å; F356-L391 HydrophobicContact CE2-CD1 3.74Å; F356-L391 HydrophobicContact CZ-CD1 3.82Å; F356-A394 HydrophobicContact CD2-CB 4.39Å; F356-A394 HydrophobicContact CE2-CB 3.85Å; F356-L398 HydrophobicContact CD1-CD1 4.04Å; F356-L398 HydrophobicContact CD2-CD1 4.29Å; F356-L398 HydrophobicContact CE1-CD1 3.82Å; F356-L398 HydrophobicContact CE2-CD1 4.07Å; F356-L398 HydrophobicContact CG-CD1 4.28Å; F356-L398 HydrophobicContact CZ-CD1 3.83Å; F356-W416 AromaticContact CE1-CD2 3.92Å; F356-W416 HydrophobicContact CE1-CD2 3.92Å; F356-W416 AromaticContact CE1-CE2 3.87Å; F356-W416 HydrophobicContact CE1-CE3 4.08Å; F356-W416 HydrophobicContact CE1-CH2 4.22Å; F356-W416 HydrophobicContact CE1-CZ2 4.04Å; F356-W416 HydrophobicContact CE1-CZ3 4.24Å; F356-W416 HydrophobicContact CZ-CD2 4.32Å; F356-W416 AromaticContact CZ-CE2 3.92Å; F356-W416 HydrophobicContact CZ-CE3 4.35Å; F356-W416 AromaticContact CZ-CH2 3.68Å; F356-W416 HydrophobicContact CZ-CH2 3.68Å; F356-W416 AromaticContact CZ-CZ2 3.6Å; F356-W416 HydrophobicContact CZ-CZ2 3.6Å; F356-W416 HydrophobicContact CZ-CZ3 4.07Å
357	G	98.9	Very high	98.6	Very high	10 Å²	10	18 Å²	18	10%	0.103	10%	0.097	C	C	.	.	H	α-helix	trans	-59.9	-42.5	173.1	0	0	0	0	0	112.1	F289 E353 V354 Q361	F289-G357 VanDerWaalsContact CD1-CA 3.42Å; F289-G357 VanDerWaalsContact CG-CA 3.45Å; E353-G357 PolarHBondContact O-N 3.02Å; V354-G357 PolarHBondContact O-N 3.26Å; G357-Q361 WeakPolarHBondContact O-CB 3.36Å; G357-Q361 PolarHBondContact O-N 3.04Å
358	E	98.9	Very high	98.6	Very high	3 Å²	3	21.7 Å²	21.7	1%	0.014	12%	0.116	C	C	.	.	H	α-helix	trans	-67.3	-48.3	171.9	-71.6	-160.4	-167.7	0	0	112.4	H319 V354 I355 F356 F360 Q361 P365 P366 H367 Y372	H319-E358 WeakPolarHBondContact CE1-CG 3.49Å; H319-E358 IonicContact CE1-OE1 3.56Å; H319-E358 IonicContact CG-OE1 3.01Å; H319-E358 VanDerWaalsContact ND1-CG 3.25Å; H319-E358 WeakPolarHBondContact ND1-CG 3.45Å; H319-E358 IonicContact ND1-OE1 3.46Å; H319-E358 PolarHBondContact ND1-OE1 3.47Å; V354-E358 PolarHBondContact O-N 3.4Å; I355-E358 PolarHBondContact O-N 3.47Å; F356-E358 VanDerWaalsContact C-N 3.33Å; F356-E358 PolarHBondContact O-N 2.96Å; E358-F360 VanDerWaalsContact C-N 3.27Å; E358-F360 PolarHBondContact O-N 2.77Å; E358-Q361 VanDerWaalsContact O-CB 3.27Å; E358-Q361 WeakPolarHBondContact O-CB 3.38Å; E358-Q361 PolarHBondContact O-N 3.48Å; E358-Q361 VanDerWaalsContact O-N 3.17Å; E358-P365 WeakPolarHBondContact O-CA 3.35Å; E358-P365 VanDerWaalsContact O-CB 3.24Å; E358-P365 WeakPolarHBondContact O-CB 3.34Å; E358-P366 HydrophobicContact CB-CG 4.44Å; E358-P366 HydrophobicContact CG-CG 4.11Å; E358-H367 IonicContact OE2-CD2 2.8Å; E358-Y372 HydrophobicContact CB-CD1 4.48Å; E358-Y372 HydrophobicContact CB-CE1 3.57Å; E358-Y372 WeakPolarHBondContact CB-OH 3.39Å; E358-Y372 HydrophobicContact CG-CE1 4.32Å; E358-Y372 WeakPolarHBondContact OE2-CE1 3.3Å; E358-Y372 VanDerWaalsContact OE2-CZ 3.28Å; E358-Y372 PolarHBondContact OE2-OH 3.16Å
359	L	98.9	Very high	98.6	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-59.9	-38.6	-178.6	179.5	63.6	0	0	0	111.8	I355 F356 P365 D369 Y372 R412 W416	I355-L359 WeakPolarHBondContact O-CB 3.46Å; I355-L359 PolarHBondContact O-N 3.4Å; F356-L359 HydrophobicContact CD1-CD2 4.16Å; F356-L359 HydrophobicContact CE1-CD2 4.38Å; F356-L359 PolarHBondContact O-N 2.73Å; L359-P365 WeakPolarHBondContact O-CG 3.49Å; L359-D369 HydrophobicContact CD1-CB 4.16Å; L359-Y372 HydrophobicContact CB-CD2 4.23Å; L359-Y372 HydrophobicContact CB-CG 4.38Å; L359-Y372 HydrophobicContact CD1-CD2 3.86Å; L359-R412 HydrophobicContact CD1-CB 4.26Å; L359-R412 HydrophobicContact CG-CB 4.31Å; L359-R412 WeakPolarHBondContact O-CD 3.46Å; L359-R412 PolarHBondContact O-NH1 2.88Å; L359-W416 HydrophobicContact CD2-CB 3.9Å; L359-W416 HydrophobicContact CD2-CG 4.03Å
360	F	98.9	Very high	98.6	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	3.1	-179.4	-57.6	-44.7	0	0	0	113.7	V216 F289 F356 E358 L362 L398 C409 R412 F413	V216-F360 HydrophobicContact CG1-CB 4.13Å; V216-F360 HydrophobicContact CG2-CB 3.81Å; V216-F360 WeakPolarHBondContact CG2-O 3.4Å; F289-F360 HydrophobicContact CE2-CB 4.49Å; F289-F360 AromaticContact CE2-CD2 3.87Å; F289-F360 HydrophobicContact CE2-CD2 3.87Å; F289-F360 HydrophobicContact CZ-CD2 4.13Å; F356-F360 HydrophobicContact CB-CD2 3.99Å; F356-F360 HydrophobicContact CB-CE2 3.91Å; F356-F360 HydrophobicContact CD1-CD2 4.28Å; F356-F360 AromaticContact CD1-CE2 3.46Å; F356-F360 HydrophobicContact CD1-CE2 3.46Å; F356-F360 VanDerWaalsContact CD1-CE2 3.46Å; F356-F360 AromaticContact CD1-CZ 3.83Å; F356-F360 HydrophobicContact CD1-CZ 3.83Å; F356-F360 HydrophobicContact CE1-CE2 4.27Å; F356-F360 HydrophobicContact CE1-CZ 4.29Å; F356-F360 AromaticContact CG-CE2 3.96Å; F356-F360 HydrophobicContact CG-CE2 3.96Å; F356-F360 WeakPolarHBondContact O-CB 3.2Å; F356-F360 WeakPolarHBondContact O-CD2 3.48Å; F356-F360 WeakPolarHBondContact O-CG 3.35Å; F356-F360 PolarHBondContact O-N 3.1Å; E358-F360 VanDerWaalsContact C-N 3.27Å; E358-F360 PolarHBondContact O-N 2.77Å; F360-L362 PolarHBondContact O-N 3.13Å; F360-L398 HydrophobicContact CE2-CD1 3.88Å; F360-L398 HydrophobicContact CE2-CD2 3.78Å; F360-L398 HydrophobicContact CE2-CG 4.5Å; F360-L398 HydrophobicContact CZ-CD1 4.15Å; F360-C409 HydrophobicContact CB-CB 4.23Å; F360-C409 HydrophobicContact CD1-CB 3.87Å; F360-C409 WeakPolarHBondContact CE1-O 3.46Å; F360-C409 HydrophobicContact CG-CB 4.25Å; F360-C409 PolarHBondContact O-SG 2.89Å; F360-C409 VanDerWaalsContact O-SG 3.38Å; F360-R412 HydrophobicContact CD1-CB 4.21Å; F360-R412 HydrophobicContact CE1-CB 4.12Å; F360-F413 HydrophobicContact CE1-CB 3.8Å; F360-F413 HydrophobicContact CZ-CB 3.85Å; F360-F413 HydrophobicContact CZ-CD2 4.14Å; F360-F413 HydrophobicContact CZ-CG 4.2Å
361	Q	98.8	Very high	98.6	Very high	65 Å²	65	25.4 Å²	25.4	30%	0.304	14%	0.141	S	C	.	.			trans	-57.6	126.5	177.7	-169.8	179.8	-82.8	0	0	111.1	G357 E358 L364 R412	G357-Q361 WeakPolarHBondContact O-CB 3.36Å; G357-Q361 PolarHBondContact O-N 3.04Å; E358-Q361 VanDerWaalsContact O-CB 3.27Å; E358-Q361 WeakPolarHBondContact O-CB 3.38Å; E358-Q361 PolarHBondContact O-N 3.48Å; E358-Q361 VanDerWaalsContact O-N 3.17Å; Q361-L364 PolarHBondContact NE2-O 3.32Å; Q361-L364 CarbonylContact O-C 3.32Å; Q361-L364 PolarHBondContact O-N 3.23Å; Q361-R412 PolarHBondContact O-NH1 3.09Å
362	L	98.7	Very high	98.6	Very high	10 Å²	10	25.4 Å²	25.4	5%	0.052	14%	0.141	C	C	.	.	S	Bend	trans	-98.7	138.1	170.6	-59	-178.1	0	0	0	108.8	M213 L214 F360 N406 T408 L761	M213-L362 WeakPolarHBondContact O-CD1 3.44Å; L214-L362 HydrophobicContact CD2-CB 3.98Å; F360-L362 PolarHBondContact O-N 3.13Å; L362-N406 HydrophobicContact CD1-CB 4.33Å; L362-T408 HydrophobicContact CD2-CG2 3.8Å; L362-L761 HydrophobicContact CB-CD1 4.48Å; L362-L761 HydrophobicContact CB-CD2 4.47Å; L362-L761 HydrophobicContact CD1-CD1 4.22Å; L362-L761 HydrophobicContact CD2-CD1 4.19Å
363	P	98.1	Very high	98.6	Very high	12 Å²	12	25.7 Å²	25.7	8%	0.078	14%	0.142	C	C	.	.	S	Bend	cis	-75.4	-37.7	6.2	-16.7	31.4	0	0	0	115.5	L214 I284 R412 L761 L797	L214-P363 HydrophobicContact CD2-CG 4.4Å; I284-P363 HydrophobicContact CD1-CG 4.03Å; P363-R412 PolarHBondContact O-NH2 3.26Å; P363-L761 HydrophobicContact CB-CB 3.95Å; P363-L761 HydrophobicContact CB-CD2 3.73Å; P363-L761 HydrophobicContact CB-CG 4.46Å; P363-L761 WeakPolarHBondContact CB-O 3.46Å; P363-L761 HydrophobicContact CG-CD2 3.93Å; P363-L797 HydrophobicContact CG-CD1 4.47Å
364	L	97.5	Very high	98.6	Very high	71 Å²	71	27.1 Å²	27.1	37%	0.372	15%	0.151	S	C	.	.			trans	-136.2	149.6	-176	-64.6	170.9	0	0	0	110.9	Q361 M762	Q361-L364 PolarHBondContact NE2-O 3.32Å; Q361-L364 CarbonylContact O-C 3.32Å; Q361-L364 PolarHBondContact O-N 3.23Å; L364-M762 HydrophobicContact CD2-CG 4.43Å
365	P	98.4	Very high	98.6	Very high	17 Å²	17	27 Å²	27	11%	0.11	15%	0.15	C	C	.	.			trans	-62.2	150.3	169.1	-21.4	36	0	0	0	110.6	E358 L359 H367 Y372	E358-P365 WeakPolarHBondContact O-CA 3.35Å; E358-P365 VanDerWaalsContact O-CB 3.24Å; E358-P365 WeakPolarHBondContact O-CB 3.34Å; L359-P365 WeakPolarHBondContact O-CG 3.49Å; P365-H367 WeakPolarHBondContact CB-O 3.48Å; P365-H367 PolarHBondContact O-N 3.32Å; P365-Y372 HydrophobicContact CB-CE2 3.85Å
366	P	97.4	Very high	98.6	Very high	62 Å²	62	26.9 Å²	26.9	40%	0.403	15%	0.15	S	C	.	.	S	Bend	trans	-59	-28.2	174.9	-25.5	34.8	0	0	0	114.2	E358	E358-P366 HydrophobicContact CB-CG 4.44Å; E358-P366 HydrophobicContact CG-CG 4.11Å
367	H	98.4	Very high	98.6	Very high	27 Å²	27	27.7 Å²	27.7	13%	0.125	15%	0.154	C	C	.	.	S	Bend	trans	-133.1	166.9	-178.2	-55.7	-53.1	0	0	0	111.8	W326 E358 P365 D369 M371 Y372	W326-H367 AromaticContact CD1-CE1 3.43Å; W326-H367 VanDerWaalsContact CD1-CE1 3.43Å; W326-H367 AromaticContact CD1-ND1 3.75Å; W326-H367 AromaticContact CD1-NE2 3.93Å; W326-H367 AromaticContact CD2-ND1 3.85Å; W326-H367 AromaticContact CG-CE1 3.7Å; W326-H367 AromaticContact CG-CG 3.95Å; W326-H367 AromaticContact CG-ND1 3.67Å; W326-H367 AromaticContact CG-NE2 3.98Å; W326-H367 AromaticContact NE1-CE1 3.86Å; W326-H367 AromaticContact NE1-ND1 3.95Å; E358-H367 IonicContact OE2-CD2 2.8Å; P365-H367 WeakPolarHBondContact CB-O 3.48Å; P365-H367 PolarHBondContact O-N 3.32Å; H367-D369 PolarHBondContact O-N 3.39Å; H367-M371 HydrophobicContact CB-CE 3.68Å; H367-Y372 HydrophobicContact CB-CE2 4.43Å; H367-Y372 PolarHBondContact N-OH 3.01Å; H367-Y372 WeakPolarHBondContact O-CE2 3.11Å
368	I	98.4	Very high	98.6	Very high	108 Å²	108	27.8 Å²	27.8	55%	0.554	15%	0.152	S	C	*	.			trans	-59.2	131.5	-179.9	-169.2	173.3	0	0	0	112.1	V370 M371	I368-V370 HydrophobicContact CD1-CG1 4.19Å; I368-V370 HydrophobicContact CG1-CG1 4.17Å; I368-V370 HydrophobicContact CG2-CG1 4.14Å; I368-V370 PolarHBondContact O-N 3.23Å; I368-M371 HydrophobicContact CG2-CB 4.07Å; I368-M371 WeakPolarHBondContact O-CB 3.45Å; I368-M371 PolarHBondContact O-N 3.42Å
369	D	98.6	Very high	98.6	Very high	62 Å²	62	27.6 Å²	27.6	33%	0.332	15%	0.151	S	C	.	.	H	α-helix	trans	-48.9	-40.2	-171.8	-58.3	25.2	0	0	0	114	L359 H367 M371 Y372	L359-D369 HydrophobicContact CD1-CB 4.16Å; H367-D369 PolarHBondContact O-N 3.39Å; D369-M371 PolarHBondContact O-N 3.45Å; D369-Y372 WeakPolarHBondContact O-CD2 3.46Å; D369-Y372 PolarHBondContact O-N 3.03Å
370	V	98.6	Very high	98.5	Very high	68 Å²	68	28.1 Å²	28.1	41%	0.412	16%	0.155	S	C	.	.	H	α-helix	trans	-64.1	-25.6	-178.1	70.7	0	0	0	0	112.9	I368 Y372 T373 T374	I368-V370 HydrophobicContact CD1-CG1 4.19Å; I368-V370 HydrophobicContact CG1-CG1 4.17Å; I368-V370 HydrophobicContact CG2-CG1 4.14Å; I368-V370 PolarHBondContact O-N 3.23Å; V370-Y372 VanDerWaalsContact C-N 3.34Å; V370-Y372 PolarHBondContact O-N 3.3Å; V370-T373 PolarHBondContact O-N 3Å; V370-T374 PolarHBondContact O-N 3.48Å
371	M	98.7	Very high	98.5	Very high	11 Å²	11	33.9 Å²	33.9	5%	0.054	18%	0.18	C	C	.	.	H	α-helix	trans	-57.8	-49.1	178.1	-175.4	-79.4	-70.8	0	0	110	I322 W326 H367 I368 D369 T373 T374 L375	I322-M371 HydrophobicContact CG2-CE 3.83Å; W326-M371 HydrophobicContact CB-CE 4.09Å; W326-M371 HydrophobicContact CB-CG 4.49Å; W326-M371 HydrophobicContact CB-SD 4.47Å; W326-M371 HydrophobicContact CE3-CG 4.49Å; H367-M371 HydrophobicContact CB-CE 3.68Å; I368-M371 HydrophobicContact CG2-CB 4.07Å; I368-M371 WeakPolarHBondContact O-CB 3.45Å; I368-M371 PolarHBondContact O-N 3.42Å; D369-M371 PolarHBondContact O-N 3.45Å; M371-T373 VanDerWaalsContact C-N 3.32Å; M371-T373 PolarHBondContact O-N 2.81Å; M371-T374 PolarHBondContact O-N 2.92Å; M371-T374 VanDerWaalsContact O-N 3.09Å; M371-T374 PolarHBondContact O-OG1 3.14Å; M371-L375 WeakPolarHBondContact O-CB 3.11Å; M371-L375 PolarHBondContact O-N 2.76Å; M371-L375 HydrophobicContact SD-CB 4.11Å; M371-L375 HydrophobicContact SD-CD2 4.05Å
372	Y	98.9	Very high	98.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-59.8	-38.8	-179	-57.3	-68.3	0	0	0	113	I355 E358 L359 P365 H367 D369 V370 T374 L375 L376	I355-Y372 HydrophobicContact CG2-CD1 4Å; I355-Y372 HydrophobicContact CG2-CG 4.41Å; E358-Y372 HydrophobicContact CB-CD1 4.48Å; E358-Y372 HydrophobicContact CB-CE1 3.57Å; E358-Y372 WeakPolarHBondContact CB-OH 3.39Å; E358-Y372 HydrophobicContact CG-CE1 4.32Å; E358-Y372 WeakPolarHBondContact OE2-CE1 3.3Å; E358-Y372 VanDerWaalsContact OE2-CZ 3.28Å; E358-Y372 PolarHBondContact OE2-OH 3.16Å; L359-Y372 HydrophobicContact CB-CD2 4.23Å; L359-Y372 HydrophobicContact CB-CG 4.38Å; L359-Y372 HydrophobicContact CD1-CD2 3.86Å; P365-Y372 HydrophobicContact CB-CE2 3.85Å; H367-Y372 HydrophobicContact CB-CE2 4.43Å; H367-Y372 PolarHBondContact N-OH 3.01Å; H367-Y372 WeakPolarHBondContact O-CE2 3.11Å; D369-Y372 WeakPolarHBondContact O-CD2 3.46Å; D369-Y372 PolarHBondContact O-N 3.03Å; V370-Y372 VanDerWaalsContact C-N 3.34Å; V370-Y372 PolarHBondContact O-N 3.3Å; Y372-T374 PolarHBondContact O-N 3.13Å; Y372-L375 PolarHBondContact O-N 3.19Å; Y372-L376 WeakPolarHBondContact O-CG 3.4Å; Y372-L376 PolarHBondContact O-N 3.07Å
373	T	98.8	Very high	98.4	Very high	5 Å²	5	37.7 Å²	37.7	3%	0.031	20%	0.199	C	C	.	.	H	α-helix	trans	-60.2	-48.3	175.5	-53.9	0	0	0	0	110.5	V370 M371 I377 H419	V370-T373 PolarHBondContact O-N 3Å; M371-T373 VanDerWaalsContact C-N 3.32Å; M371-T373 PolarHBondContact O-N 2.81Å; T373-I377 HydrophobicContact CG2-CD1 4.32Å; T373-I377 WeakPolarHBondContact O-CG1 3.49Å; T373-I377 PolarHBondContact O-N 2.87Å; T373-H419 HydrophobicContact CG2-CB 4.29Å; T373-H419 WeakPolarHBondContact CG2-ND1 3.4Å
374	T	98.7	Very high	98.4	Very high	32 Å²	32	41.5 Å²	41.5	20%	0.196	22%	0.224	C	C	.	.	H	α-helix	trans	-72.9	-30.5	-178.8	67.2	0	0	0	0	113.1	V370 M371 Y372 I377 E378	V370-T374 PolarHBondContact O-N 3.48Å; M371-T374 PolarHBondContact O-N 2.92Å; M371-T374 VanDerWaalsContact O-N 3.09Å; M371-T374 PolarHBondContact O-OG1 3.14Å; Y372-T374 PolarHBondContact O-N 3.13Å; T374-I377 PolarHBondContact O-N 3.43Å; T374-E378 WeakPolarHBondContact O-CG 3.46Å; T374-E378 PolarHBondContact O-N 3.02Å
375	L	98.9	Very high	98.3	Very high	0 Å²	0	41 Å²	41	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.6	-47	175.2	179.3	59.9	0	0	0	111	I322 C332 A333 L336 I355 M371 Y372 I377 E378 L379	I322-L375 HydrophobicContact CG1-CD2 4.45Å; C332-L375 HydrophobicContact CB-CD1 3.9Å; A333-L375 HydrophobicContact CB-CD1 3.97Å; L336-L375 HydrophobicContact CD1-CD1 4.3Å; L336-L375 HydrophobicContact CD1-CD2 4.09Å; I355-L375 HydrophobicContact CD1-CD2 3.78Å; I355-L375 HydrophobicContact CD1-CG 4.05Å; I355-L375 HydrophobicContact CG1-CD2 4.1Å; M371-L375 WeakPolarHBondContact O-CB 3.11Å; M371-L375 PolarHBondContact O-N 2.76Å; M371-L375 HydrophobicContact SD-CB 4.11Å; M371-L375 HydrophobicContact SD-CD2 4.05Å; Y372-L375 PolarHBondContact O-N 3.19Å; L375-I377 VanDerWaalsContact C-N 3.28Å; L375-I377 PolarHBondContact O-N 2.88Å; L375-E378 PolarHBondContact O-N 3.37Å; L375-E378 VanDerWaalsContact O-N 3.14Å; L375-L379 HydrophobicContact CD1-CD1 4.48Å; L375-L379 HydrophobicContact CD1-CG 4.5Å; L375-L379 HydrophobicContact CG-CD1 4.12Å; L375-L379 WeakPolarHBondContact O-CG 3.4Å; L375-L379 PolarHBondContact O-N 3.01Å
376	L	98.9	Very high	98.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61	-36.8	175.3	-74.7	166.3	0	0	0	112.4	V352 I355 F356 Y372 L379 C380 L391 W416	V352-L376 HydrophobicContact CG2-CD2 4.38Å; I355-L376 HydrophobicContact CD1-CD2 3.78Å; I355-L376 HydrophobicContact CD1-CG 4.15Å; I355-L376 HydrophobicContact CG2-CD1 3.81Å; I355-L376 HydrophobicContact CG2-CD2 4.2Å; I355-L376 HydrophobicContact CG2-CG 3.91Å; F356-L376 HydrophobicContact CZ-CD1 4.47Å; Y372-L376 WeakPolarHBondContact O-CG 3.4Å; Y372-L376 PolarHBondContact O-N 3.07Å; L376-L379 HydrophobicContact CD2-CD1 4.31Å; L376-L379 PolarHBondContact O-N 3.16Å; L376-C380 PolarHBondContact O-N 3.27Å; L376-C380 PolarHBondContact O-SG 3.37Å; L376-L391 HydrophobicContact CB-CD2 4.35Å; L376-L391 HydrophobicContact CD1-CD1 4.16Å; L376-L391 HydrophobicContact CD2-CD1 4.09Å; L376-L391 HydrophobicContact CD2-CD2 4.49Å; L376-W416 HydrophobicContact CD1-CZ2 4.09Å; L376-W416 VanDerWaalsContact CD1-NE1 3.28Å
377	I	98.7	Very high	98.2	Very high	16 Å²	16	39.1 Å²	39.1	8%	0.082	23%	0.225	C	C	.	.	H	α-helix	trans	-63	-45.9	173.2	-69.7	166.1	0	0	0	111.1	T373 T374 L375 C380 K381 N423 F424	T373-I377 HydrophobicContact CG2-CD1 4.32Å; T373-I377 WeakPolarHBondContact O-CG1 3.49Å; T373-I377 PolarHBondContact O-N 2.87Å; T374-I377 PolarHBondContact O-N 3.43Å; L375-I377 VanDerWaalsContact C-N 3.28Å; L375-I377 PolarHBondContact O-N 2.88Å; I377-C380 PolarHBondContact O-N 3.14Å; I377-K381 WeakPolarHBondContact O-CG 3.38Å; I377-K381 PolarHBondContact O-N 3.49Å; I377-K381 VanDerWaalsContact O-N 3.13Å; I377-N423 HydrophobicContact CD1-CB 3.79Å; I377-F424 HydrophobicContact CG1-CE2 4.02Å; I377-F424 HydrophobicContact CG1-CZ 4.33Å
378	E	98.8	Very high	98.2	Very high	12 Å²	12	40.2 Å²	40.2	6%	0.056	23%	0.234	C	C	.	.	H	α-helix	trans	-65.5	-38.6	177.4	-66.6	-58.7	152.4	0	0	112	R329 A333 T374 L375 C380 K381 L382	R329-E378 HydrophobicContact CB-CG 4.3Å; R329-E378 HydrophobicContact CG-CG 3.84Å; R329-E378 IonicContact CZ-OE1 2.62Å; R329-E378 IonicContact NE-OE1 3.57Å; R329-E378 PolarHBondContact NE-OE1 2.88Å; R329-E378 IonicContact NH2-OE1 3.53Å; R329-E378 PolarHBondContact NH2-OE1 3.46Å; A333-E378 HydrophobicContact CB-CB 3.98Å; T374-E378 WeakPolarHBondContact O-CG 3.46Å; T374-E378 PolarHBondContact O-N 3.02Å; L375-E378 PolarHBondContact O-N 3.37Å; L375-E378 VanDerWaalsContact O-N 3.14Å; E378-C380 VanDerWaalsContact C-N 3.35Å; E378-C380 PolarHBondContact O-N 2.88Å; E378-K381 WeakPolarHBondContact O-CB 3.48Å; E378-K381 PolarHBondContact O-N 3.31Å; E378-K381 IonicContact OE1-NZ 3.53Å; E378-K381 PolarHBondContact OE1-NZ 3.33Å; E378-K381 IonicContact OE2-NZ 3.54Å; E378-L382 WeakPolarHBondContact O-CG 3.39Å; E378-L382 PolarHBondContact O-N 3.38Å
379	L	98.8	Very high	98.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.3	-42.8	173.4	-70.1	163.9	0	0	0	111.1	A333 L336 L337 I351 I355 L375 L376 K381 L382 Q383 L387	A333-L379 HydrophobicContact CB-CD2 3.81Å; A333-L379 HydrophobicContact CB-CG 3.94Å; L336-L379 HydrophobicContact CB-CD2 4.46Å; L337-L379 HydrophobicContact CD1-CD2 3.99Å; L337-L379 HydrophobicContact CD2-CD2 4.15Å; L337-L379 HydrophobicContact CG-CD2 3.76Å; I351-L379 HydrophobicContact CG2-CD1 3.54Å; I351-L379 HydrophobicContact CG2-CD2 4.27Å; I355-L379 HydrophobicContact CD1-CD1 3.45Å; I355-L379 VanDerWaalsContact CD1-CD1 3.45Å; L375-L379 HydrophobicContact CD1-CD1 4.48Å; L375-L379 HydrophobicContact CD1-CG 4.5Å; L375-L379 HydrophobicContact CG-CD1 4.12Å; L375-L379 WeakPolarHBondContact O-CG 3.4Å; L375-L379 PolarHBondContact O-N 3.01Å; L376-L379 HydrophobicContact CD2-CD1 4.31Å; L376-L379 PolarHBondContact O-N 3.16Å; L379-K381 VanDerWaalsContact C-N 3.26Å; L379-K381 PolarHBondContact O-N 3.13Å; L379-L382 PolarHBondContact O-N 3.18Å; L379-L382 VanDerWaalsContact O-N 3.13Å; L379-Q383 PolarHBondContact O-N 2.94Å; L379-L387 HydrophobicContact CB-CD1 4.49Å; L379-L387 HydrophobicContact CB-CD2 3.26Å; L379-L387 HydrophobicContact CB-CG 4.49Å
380	C	98.4	Very high	98.1	Very high	13 Å²	13	37.7 Å²	37.7	9%	0.088	22%	0.219	C	C	.	.	H	α-helix	trans	-60.5	-36	176.1	-71.3	0	0	0	0	112	L376 I377 E378 Q383 P384 L387 P388	L376-C380 PolarHBondContact O-N 3.27Å; L376-C380 PolarHBondContact O-SG 3.37Å; I377-C380 PolarHBondContact O-N 3.14Å; E378-C380 VanDerWaalsContact C-N 3.35Å; E378-C380 PolarHBondContact O-N 2.88Å; C380-Q383 CarbonylContact O-C 3.52Å; C380-P384 VanDerWaalsContact O-CA 3.24Å; C380-P384 WeakPolarHBondContact O-CA 3.37Å; C380-L387 HydrophobicContact CB-CD2 4.44Å; C380-L387 VanDerWaalsContact N-CD2 3.33Å; C380-P388 HydrophobicContact CB-CG 4.33Å
381	K	98	Very high	98.1	Very high	121 Å²	121	34.6 Å²	34.6	53%	0.526	20%	0.2	S	C	.	.	H	α-helix	trans	-68.1	-37.9	175.5	-66.8	171	-169	168.5	0	112.2	I377 E378 L379	I377-K381 WeakPolarHBondContact O-CG 3.38Å; I377-K381 PolarHBondContact O-N 3.49Å; I377-K381 VanDerWaalsContact O-N 3.13Å; E378-K381 WeakPolarHBondContact O-CB 3.48Å; E378-K381 PolarHBondContact O-N 3.31Å; E378-K381 IonicContact OE1-NZ 3.53Å; E378-K381 PolarHBondContact OE1-NZ 3.33Å; E378-K381 IonicContact OE2-NZ 3.54Å; L379-K381 VanDerWaalsContact C-N 3.26Å; L379-K381 PolarHBondContact O-N 3.13Å
382	L	98.3	Very high	98.1	Very high	80 Å²	80	36 Å²	36	42%	0.419	21%	0.213	S	C	.	.	H	α-helix	trans	-80	-25	-179.1	-68.5	177.2	0	0	0	113.1	A333 L337 E378 L379	A333-L382 HydrophobicContact CB-CD1 3.75Å; L337-L382 HydrophobicContact CD1-CB 3.4Å; L337-L382 VanDerWaalsContact CD1-CB 3.4Å; L337-L382 HydrophobicContact CD1-CD1 3.8Å; L337-L382 HydrophobicContact CD1-CG 4.25Å; E378-L382 WeakPolarHBondContact O-CG 3.39Å; E378-L382 PolarHBondContact O-N 3.38Å; L379-L382 PolarHBondContact O-N 3.18Å; L379-L382 VanDerWaalsContact O-N 3.13Å
383	Q	97.5	Very high	98.1	Very high	74 Å²	74	38.9 Å²	38.9	35%	0.346	23%	0.227	S	C	.	.	S	Bend	trans	-131.2	61.3	178.2	-68.7	-62.7	-66.5	0	0	112.4	L337 L379 C380 G385 S386 L387 P388	L337-Q383 HydrophobicContact CD1-CG 3.75Å; L337-Q383 HydrophobicContact CD2-CG 3.52Å; L337-Q383 HydrophobicContact CG-CG 4.29Å; L379-Q383 PolarHBondContact O-N 2.94Å; C380-Q383 CarbonylContact O-C 3.52Å; Q383-G385 PolarHBondContact O-N 3.11Å; Q383-S386 PolarHBondContact O-N 2.83Å; Q383-L387 HydrophobicContact CB-CB 3.83Å; Q383-L387 WeakPolarHBondContact O-CB 3.43Å; Q383-L387 PolarHBondContact O-N 2.84Å; Q383-L387 VanDerWaalsContact O-N 3.07Å; Q383-P388 VanDerWaalsContact O-CD 3.31Å; Q383-P388 WeakPolarHBondContact O-CD 3.24Å
384	P	96.9	Very high	98.1	Very high	92 Å²	92	38.7 Å²	38.7	60%	0.597	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-21.3	-171.8	27.5	-35.8	0	0	0	114.1	C380	C380-P384 VanDerWaalsContact O-CA 3.24Å; C380-P384 WeakPolarHBondContact O-CA 3.37Å
385	G	95.7	Very high	98.1	Very high	60 Å²	60	37.3 Å²	37.3	62%	0.619	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-11	-177.4	0	0	0	0	0	115.3	Q383 Q389	Q383-G385 PolarHBondContact O-N 3.11Å; G385-Q389 PolarHBondContact O-NE2 3.03Å; G385-Q389 PolarHBondContact O-OE1 3.15Å
386	S	95.6	Very high	98.1	Very high	41 Å²	41	39.9 Å²	39.9	29%	0.287	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140.6	-40.2	-170.7	56.1	0	0	0	0	114.4	N348 Q383 Q389 V390	N348-S386 WeakPolarHBondContact ND2-CB 3.05Å; N348-S386 PolarHBondContact ND2-OG 2.8Å; Q383-S386 PolarHBondContact O-N 2.83Å; S386-Q389 PolarHBondContact O-N 3.05Å; S386-Q389 PolarHBondContact O-OE1 3.34Å; S386-Q389 VanDerWaalsContact O-OE1 3.05Å; S386-V390 WeakPolarHBondContact O-CG2 3.33Å; S386-V390 PolarHBondContact O-N 3.42Å
387	L	97.8	Very high	98.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-70.8	-39.6	-174.7	-164.8	100.4	0	0	0	113.7	N348 V352 L379 C380 Q383 Q389 V390 L391	N348-L387 HydrophobicContact CB-CD1 3.99Å; V352-L387 HydrophobicContact CG2-CD1 4.21Å; L379-L387 HydrophobicContact CB-CD1 4.49Å; L379-L387 HydrophobicContact CB-CD2 3.26Å; L379-L387 HydrophobicContact CB-CG 4.49Å; C380-L387 HydrophobicContact CB-CD2 4.44Å; C380-L387 VanDerWaalsContact N-CD2 3.33Å; Q383-L387 HydrophobicContact CB-CB 3.83Å; Q383-L387 WeakPolarHBondContact O-CB 3.43Å; Q383-L387 PolarHBondContact O-N 2.84Å; Q383-L387 VanDerWaalsContact O-N 3.07Å; L387-Q389 PolarHBondContact O-N 3.09Å; L387-V390 PolarHBondContact O-N 3.09Å; L387-L391 WeakPolarHBondContact O-CB 3.43Å; L387-L391 PolarHBondContact O-N 3.36Å
388	P	98.3	Very high	98.1	Very high	50 Å²	50	40.1 Å²	40.1	33%	0.325	23%	0.23	S	C	.	.	H	α-helix	trans	-56.4	-36.6	175.5	-27.7	36.6	0	0	0	113.4	C380 Q383 L391 A392	C380-P388 HydrophobicContact CB-CG 4.33Å; Q383-P388 VanDerWaalsContact O-CD 3.31Å; Q383-P388 WeakPolarHBondContact O-CD 3.24Å; P388-L391 PolarHBondContact O-N 3.48Å; P388-A392 WeakPolarHBondContact O-CB 3.31Å; P388-A392 PolarHBondContact O-N 3.14Å
389	Q	97.8	Very high	98.1	Very high	109 Å²	109	39.6 Å²	39.6	51%	0.509	23%	0.228	S	C	.	.	H	α-helix	trans	-68.1	-45.2	177.7	-61.3	92.1	-28.9	0	0	111.7	G385 S386 L387 L391 A392 Q393	G385-Q389 PolarHBondContact O-NE2 3.03Å; G385-Q389 PolarHBondContact O-OE1 3.15Å; S386-Q389 PolarHBondContact O-N 3.05Å; S386-Q389 PolarHBondContact O-OE1 3.34Å; S386-Q389 VanDerWaalsContact O-OE1 3.05Å; L387-Q389 PolarHBondContact O-N 3.09Å; Q389-L391 VanDerWaalsContact C-N 3.28Å; Q389-L391 PolarHBondContact O-N 2.98Å; Q389-A392 PolarHBondContact O-N 3.41Å; Q389-Q393 WeakPolarHBondContact O-CB 3.36Å; Q389-Q393 PolarHBondContact O-N 2.81Å
390	V	98.6	Very high	98.1	Very high	7 Å²	7	43.1 Å²	43.1	4%	0.042	25%	0.245	C	C	.	.	H	α-helix	trans	-61.1	-40.2	175.3	179.2	0	0	0	0	110.8	F292 N348 Y349 V352 S386 L387 Q393 A394	F292-V390 HydrophobicContact CZ-CG1 4.43Å; N348-V390 HydrophobicContact CB-CG2 4.15Å; Y349-V390 HydrophobicContact CD1-CG1 3.81Å; Y349-V390 HydrophobicContact CD2-CG1 4.12Å; Y349-V390 HydrophobicContact CD2-CG2 3.97Å; Y349-V390 HydrophobicContact CE1-CG1 3.97Å; Y349-V390 HydrophobicContact CE1-CG2 4.37Å; Y349-V390 HydrophobicContact CE2-CG1 4.26Å; Y349-V390 HydrophobicContact CE2-CG2 3.53Å; Y349-V390 HydrophobicContact CG-CG1 3.88Å; V352-V390 HydrophobicContact CB-CG1 4.25Å; V352-V390 HydrophobicContact CG2-CG1 4.01Å; S386-V390 WeakPolarHBondContact O-CG2 3.33Å; S386-V390 PolarHBondContact O-N 3.42Å; L387-V390 PolarHBondContact O-N 3.09Å; V390-Q393 PolarHBondContact O-N 3.33Å; V390-A394 WeakPolarHBondContact O-CB 3.39Å; V390-A394 PolarHBondContact O-N 3.45Å
391	L	98.7	Very high	98.1	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-68.6	-39.3	178.3	-171.9	58.4	0	0	0	112.4	V352 F356 L376 L387 P388 Q389 A394 T395 W416	V352-L391 HydrophobicContact CG1-CD1 4.22Å; F356-L391 HydrophobicContact CE2-CD1 3.74Å; F356-L391 HydrophobicContact CZ-CD1 3.82Å; L376-L391 HydrophobicContact CB-CD2 4.35Å; L376-L391 HydrophobicContact CD1-CD1 4.16Å; L376-L391 HydrophobicContact CD2-CD1 4.09Å; L376-L391 HydrophobicContact CD2-CD2 4.49Å; L387-L391 WeakPolarHBondContact O-CB 3.43Å; L387-L391 PolarHBondContact O-N 3.36Å; P388-L391 PolarHBondContact O-N 3.48Å; Q389-L391 VanDerWaalsContact C-N 3.28Å; Q389-L391 PolarHBondContact O-N 2.98Å; L391-A394 PolarHBondContact O-N 2.89Å; L391-T395 WeakPolarHBondContact O-CB 3.37Å; L391-T395 PolarHBondContact O-N 3.37Å; L391-T395 PolarHBondContact O-OG1 2.83Å; L391-W416 HydrophobicContact CD1-CH2 4.2Å; L391-W416 HydrophobicContact CD1-CZ2 3.82Å; L391-W416 HydrophobicContact CD2-CZ2 4.29Å; L391-W416 HydrophobicContact CG-CZ2 4.26Å
392	A	98.6	Very high	98.2	Very high	41 Å²	41	38.8 Å²	38.8	34%	0.339	22%	0.223	S	C	.	.	H	α-helix	trans	-64.6	-44.7	174.2	0	0	0	0	0	111.4	P388 Q389 A394 T395 E396	P388-A392 WeakPolarHBondContact O-CB 3.31Å; P388-A392 PolarHBondContact O-N 3.14Å; Q389-A392 PolarHBondContact O-N 3.41Å; A392-A394 VanDerWaalsContact C-N 3.35Å; A392-A394 PolarHBondContact O-N 3.46Å; A392-T395 WeakPolarHBondContact O-CB 3.4Å; A392-T395 PolarHBondContact O-N 2.64Å; A392-E396 PolarHBondContact O-N 2.77Å
393	Q	98.6	Very high	98.2	Very high	60 Å²	60	38.8 Å²	38.8	28%	0.28	22%	0.224	S	C	.	.	H	α-helix	trans	-58.9	-45.1	173.1	-177	-177.3	3.1	0	0	111.5	D296 Y349 Q389 V390 T395 E396 M397	D296-Q393 PolarHBondContact O-NE2 2.95Å; D296-Q393 PolarHBondContact O-OE1 3.25Å; Y349-Q393 PolarHBondContact OH-OE1 3.45Å; Q389-Q393 WeakPolarHBondContact O-CB 3.36Å; Q389-Q393 PolarHBondContact O-N 2.81Å; V390-Q393 PolarHBondContact O-N 3.33Å; Q393-T395 VanDerWaalsContact C-N 3.34Å; Q393-T395 PolarHBondContact O-N 2.92Å; Q393-E396 WeakPolarHBondContact O-CB 3.46Å; Q393-E396 PolarHBondContact O-N 3.39Å; Q393-M397 HydrophobicContact CG-SD 3.98Å; Q393-M397 VanDerWaalsContact O-CG 3.26Å; Q393-M397 WeakPolarHBondContact O-CG 3.47Å; Q393-M397 PolarHBondContact O-N 3.16Å
394	A	98.8	Very high	98.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.7	-45.7	176.4	0	0	0	0	0	111.5	M291 F292 V352 F356 V390 L391 A392 E396 M397 L398	M291-A394 HydrophobicContact CE-CB 3.82Å; F292-A394 HydrophobicContact CZ-CB 3.84Å; V352-A394 HydrophobicContact CG1-CB 3.72Å; F356-A394 HydrophobicContact CD2-CB 4.39Å; F356-A394 HydrophobicContact CE2-CB 3.85Å; V390-A394 WeakPolarHBondContact O-CB 3.39Å; V390-A394 PolarHBondContact O-N 3.45Å; L391-A394 PolarHBondContact O-N 2.89Å; A392-A394 VanDerWaalsContact C-N 3.35Å; A392-A394 PolarHBondContact O-N 3.46Å; A394-E396 VanDerWaalsContact C-N 3.31Å; A394-E396 PolarHBondContact O-N 3.07Å; A394-M397 PolarHBondContact O-N 2.63Å; A394-L398 VanDerWaalsContact O-CG 3.27Å; A394-L398 WeakPolarHBondContact O-CG 3.21Å; A394-L398 PolarHBondContact O-N 2.82Å
395	T	98.9	Very high	98.3	Very high	4 Å²	4	32.9 Å²	32.9	3%	0.025	19%	0.191	C	C	.	.	H	α-helix	trans	-59.8	-43	178.8	-54.7	0	0	0	0	111.5	L391 A392 Q393 L398 Y399 F413 W416 F417 W428 W433	L391-T395 WeakPolarHBondContact O-CB 3.37Å; L391-T395 PolarHBondContact O-N 3.37Å; L391-T395 PolarHBondContact O-OG1 2.83Å; A392-T395 WeakPolarHBondContact O-CB 3.4Å; A392-T395 PolarHBondContact O-N 2.64Å; Q393-T395 VanDerWaalsContact C-N 3.34Å; Q393-T395 PolarHBondContact O-N 2.92Å; T395-L398 PolarHBondContact O-N 3.25Å; T395-Y399 PolarHBondContact O-N 3.45Å; T395-F413 HydrophobicContact CG2-CE2 4.29Å; T395-F413 HydrophobicContact CG2-CZ 4.18Å; T395-W416 HydrophobicContact CG2-CH2 4.48Å; T395-W416 HydrophobicContact CG2-CZ3 4.25Å; T395-W416 WeakPolarHBondContact OG1-CH2 3.49Å; T395-F417 HydrophobicContact CG2-CD2 3.82Å; T395-F417 HydrophobicContact CG2-CE2 3.58Å; T395-F417 HydrophobicContact CG2-CZ 4.18Å; T395-W428 HydrophobicContact CG2-CH2 3.7Å; T395-W428 HydrophobicContact CG2-CZ2 4.07Å; T395-W428 HydrophobicContact CG2-CZ3 4.26Å; T395-W433 HydrophobicContact CG2-CH2 4.36Å; T395-W433 HydrophobicContact CG2-CZ2 4.19Å
396	E	98.8	Very high	98.4	Very high	54 Å²	54	30.3 Å²	30.3	25%	0.252	16%	0.164	S	C	.	.	H	α-helix	trans	-61.8	-45.5	175.9	-178.4	56.6	-154.5	0	0	111.8	A392 Q393 A394 L398 Y399 M400 W433	A392-E396 PolarHBondContact O-N 2.77Å; Q393-E396 WeakPolarHBondContact O-CB 3.46Å; Q393-E396 PolarHBondContact O-N 3.39Å; A394-E396 VanDerWaalsContact C-N 3.31Å; A394-E396 PolarHBondContact O-N 3.07Å; E396-L398 PolarHBondContact O-N 3.27Å; E396-Y399 PolarHBondContact O-N 2.75Å; E396-M400 WeakPolarHBondContact O-CB 3.42Å; E396-M400 WeakPolarHBondContact O-CG 3.24Å; E396-M400 PolarHBondContact O-N 3.24Å; E396-M400 WeakPolarHBondContact OE1-CE 3.41Å; E396-M400 WeakPolarHBondContact OE1-CG 3.36Å; E396-W433 PolarHBondContact OE2-NE1 2.99Å
397	M	98.8	Very high	98.6	Very high	21 Å²	21	28.8 Å²	28.8	10%	0.103	15%	0.152	C	C	.	.	H	α-helix	trans	-64.5	-39.4	177.1	-66.6	165.2	75.7	0	0	112.4	M291 F292 D296 Q393 A394 M400 R401	M291-M397 HydrophobicContact CE-CB 4.07Å; M291-M397 HydrophobicContact CE-SD 4.48Å; M291-M397 WeakPolarHBondContact O-CE 3.45Å; F292-M397 HydrophobicContact CD1-CE 3.73Å; F292-M397 HydrophobicContact CD1-SD 3.89Å; F292-M397 HydrophobicContact CE1-CE 4Å; F292-M397 HydrophobicContact CE1-SD 3.53Å; F292-M397 VanDerWaalsContact CE1-SD 3.53Å; D296-M397 WeakPolarHBondContact OD1-CE 3.32Å; Q393-M397 HydrophobicContact CG-SD 3.98Å; Q393-M397 VanDerWaalsContact O-CG 3.26Å; Q393-M397 WeakPolarHBondContact O-CG 3.47Å; Q393-M397 PolarHBondContact O-N 3.16Å; A394-M397 PolarHBondContact O-N 2.63Å; M397-M400 PolarHBondContact O-N 2.89Å; M397-R401 WeakPolarHBondContact O-CB 3.31Å; M397-R401 WeakPolarHBondContact O-CD 3.42Å; M397-R401 WeakPolarHBondContact O-CG 3.42Å; M397-R401 PolarHBondContact O-N 3.44Å
398	L	98.9	Very high	98.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.2	-45.8	175.2	-69.2	173.5	0	0	0	110.8	W217 M291 F356 F360 A394 T395 E396 R401 L402 M405 F413	W217-L398 HydrophobicContact CH2-CD2 3.59Å; W217-L398 HydrophobicContact CZ2-CD2 3.52Å; M291-L398 HydrophobicContact CE-CD2 4.13Å; M291-L398 HydrophobicContact CE-CG 4.07Å; M291-L398 HydrophobicContact SD-CD2 4.34Å; F356-L398 HydrophobicContact CD1-CD1 4.04Å; F356-L398 HydrophobicContact CD2-CD1 4.29Å; F356-L398 HydrophobicContact CE1-CD1 3.82Å; F356-L398 HydrophobicContact CE2-CD1 4.07Å; F356-L398 HydrophobicContact CG-CD1 4.28Å; F356-L398 HydrophobicContact CZ-CD1 3.83Å; F360-L398 HydrophobicContact CE2-CD1 3.88Å; F360-L398 HydrophobicContact CE2-CD2 3.78Å; F360-L398 HydrophobicContact CE2-CG 4.5Å; F360-L398 HydrophobicContact CZ-CD1 4.15Å; A394-L398 VanDerWaalsContact O-CG 3.27Å; A394-L398 WeakPolarHBondContact O-CG 3.21Å; A394-L398 PolarHBondContact O-N 2.82Å; T395-L398 PolarHBondContact O-N 3.25Å; E396-L398 PolarHBondContact O-N 3.27Å; L398-R401 CarbonylContact O-C 3.48Å; L398-R401 PolarHBondContact O-N 3.23Å; L398-L402 PolarHBondContact O-N 3.28Å; L398-M405 HydrophobicContact CB-CE 4.39Å; L398-M405 HydrophobicContact CD2-CE 3.99Å; L398-F413 HydrophobicContact CB-CD1 4.37Å; L398-F413 HydrophobicContact CB-CE1 3.69Å; L398-F413 HydrophobicContact CB-CE2 3.92Å; L398-F413 HydrophobicContact CB-CZ 3.46Å; L398-F413 VanDerWaalsContact CB-CZ 3.46Å; L398-F413 HydrophobicContact CD1-CD2 3.97Å; L398-F413 HydrophobicContact CD1-CE2 3.59Å; L398-F413 HydrophobicContact CD1-CZ 4.06Å; L398-F413 HydrophobicContact CG-CE2 4.41Å; L398-F413 HydrophobicContact CG-CZ 4.41Å
399	Y	98.9	Very high	98.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.8	-49	176.1	173.4	-94.3	0	0	0	112	T395 E396 R401 L402 W433 D435 C436 K445 F448 V449	T395-Y399 PolarHBondContact O-N 3.45Å; E396-Y399 PolarHBondContact O-N 2.75Å; Y399-R401 PolarHBondContact O-N 2.9Å; Y399-R401 VanDerWaalsContact O-N 3.13Å; Y399-L402 HydrophobicContact CD2-CD1 3.71Å; Y399-L402 HydrophobicContact CE2-CD1 4.22Å; Y399-L402 HydrophobicContact CG-CD1 4.35Å; Y399-L402 WeakPolarHBondContact O-CB 3.44Å; Y399-L402 WeakPolarHBondContact O-CD1 3.36Å; Y399-L402 VanDerWaalsContact O-CG 3.29Å; Y399-L402 WeakPolarHBondContact O-CG 3.44Å; Y399-L402 PolarHBondContact O-N 2.75Å; Y399-L402 VanDerWaalsContact O-N 3.15Å; Y399-W433 AromaticContact CD1-CD1 3.43Å; Y399-W433 VanDerWaalsContact CD1-CD1 3.43Å; Y399-W433 HydrophobicContact CD1-CD2 4.13Å; Y399-W433 AromaticContact CD1-CE2 3.85Å; Y399-W433 AromaticContact CD1-CG 3.89Å; Y399-W433 HydrophobicContact CD1-CG 3.89Å; Y399-W433 AromaticContact CD1-NE1 3.43Å; Y399-W433 AromaticContact CD2-CD2 3.64Å; Y399-W433 HydrophobicContact CD2-CD2 3.64Å; Y399-W433 AromaticContact CD2-CE2 3.67Å; Y399-W433 AromaticContact CD2-CE3 3.91Å; Y399-W433 HydrophobicContact CD2-CE3 3.91Å; Y399-W433 HydrophobicContact CD2-CG 4.1Å; Y399-W433 HydrophobicContact CD2-CH2 4.2Å; Y399-W433 AromaticContact CD2-CZ2 3.96Å; Y399-W433 HydrophobicContact CD2-CZ2 3.96Å; Y399-W433 HydrophobicContact CD2-CZ3 4.18Å; Y399-W433 HydrophobicContact CE1-CB 3.97Å; Y399-W433 AromaticContact CE1-CD1 3.44Å; Y399-W433 VanDerWaalsContact CE1-CD1 3.44Å; Y399-W433 HydrophobicContact CE1-CD2 4.19Å; Y399-W433 AromaticContact CE1-CG 3.61Å; Y399-W433 HydrophobicContact CE1-CG 3.61Å; Y399-W433 AromaticContact CE1-NE1 3.95Å; Y399-W433 HydrophobicContact CE2-CB 4.12Å; Y399-W433 AromaticContact CE2-CD2 3.68Å; Y399-W433 HydrophobicContact CE2-CD2 3.68Å; Y399-W433 AromaticContact CE2-CE3 3.89Å; Y399-W433 HydrophobicContact CE2-CE3 3.89Å; Y399-W433 AromaticContact CE2-CG 3.8Å; Y399-W433 HydrophobicContact CE2-CG 3.8Å; Y399-W433 AromaticContact CG-CD1 3.92Å; Y399-W433 AromaticContact CG-CD2 3.86Å; Y399-W433 HydrophobicContact CG-CD2 3.86Å; Y399-W433 AromaticContact CG-CE2 3.47Å; Y399-W433 VanDerWaalsContact CG-CE2 3.47Å; Y399-W433 HydrophobicContact CG-CG 4.13Å; Y399-W433 AromaticContact CG-CZ2 3.84Å; Y399-W433 HydrophobicContact CG-CZ2 3.84Å; Y399-W433 AromaticContact CG-NE1 3.55Å; Y399-W433 AromaticContact CZ-CD1 3.89Å; Y399-W433 AromaticContact CZ-CD2 3.95Å; Y399-W433 AromaticContact CZ-CG 3.54Å; Y399-W433 WeakPolarHBondContact OH-CB 3.27Å; Y399-W433 PolarHBondContact OH-O 2.88Å; Y399-D435 PolarHBondContact OH-OD1 2.85Å; Y399-C436 VanDerWaalsContact OH-CB 3.32Å; Y399-C436 WeakPolarHBondContact OH-CB 3.28Å; Y399-K445 HydrophobicContact CE1-CD 3.99Å; Y399-K445 HydrophobicContact CE1-CG 4.36Å; Y399-K445 HydrophobicContact CE2-CB 4.11Å; Y399-K445 HydrophobicContact CE2-CG 4.16Å; Y399-F448 AromaticContact CD2-CD1 3.98Å; Y399-F448 HydrophobicContact CD2-CD1 3.98Å; Y399-F448 HydrophobicContact CD2-CE1 4.21Å; Y399-F448 HydrophobicContact CE2-CD1 4.37Å; Y399-V449 HydrophobicContact CE2-CG2 4.1Å
400	M	98.6	Very high	98.7	Very high	75 Å²	75	22.2 Å²	22.2	37%	0.369	12%	0.118	S	C	.	.	H	α-helix	trans	-65.3	-18.1	-178.9	-72.3	-62.1	168.9	0	0	113.5	E396 M397 K445	E396-M400 WeakPolarHBondContact O-CB 3.42Å; E396-M400 WeakPolarHBondContact O-CG 3.24Å; E396-M400 PolarHBondContact O-N 3.24Å; E396-M400 WeakPolarHBondContact OE1-CE 3.41Å; E396-M400 WeakPolarHBondContact OE1-CG 3.36Å; M397-M400 PolarHBondContact O-N 2.89Å; M400-K445 PolarHBondContact SD-NZ 3.32Å; M400-K445 VanDerWaalsContact SD-NZ 3.4Å
401	R	98.7	Very high	98.8	Very high	42 Å²	42	22.7 Å²	22.7	16%	0.158	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	14.5	179.3	-60.9	171	-170.9	178.2	2	113	W217 H223 M291 M397 L398 Y399 D403	W217-R401 HydrophobicContact CZ2-CB 4.3Å; W217-R401 PolarHBondContact NE1-O 3.34Å; H223-R401 PolarHBondContact CD2-NH1 3.44Å; M291-R401 PolarHBondContact O-NH1 3.47Å; M291-R401 PolarHBondContact O-NH2 2.9Å; M397-R401 WeakPolarHBondContact O-CB 3.31Å; M397-R401 WeakPolarHBondContact O-CD 3.42Å; M397-R401 WeakPolarHBondContact O-CG 3.42Å; M397-R401 PolarHBondContact O-N 3.44Å; L398-R401 CarbonylContact O-C 3.48Å; L398-R401 PolarHBondContact O-N 3.23Å; Y399-R401 PolarHBondContact O-N 2.9Å; Y399-R401 VanDerWaalsContact O-N 3.13Å; R401-D403 VanDerWaalsContact C-N 3.26Å; R401-D403 PolarHBondContact O-N 3.17Å
402	L	98.8	Very high	98.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-61.3	-28.8	-178.8	-82.7	170.4	0	0	0	114.3	L398 Y399 T404 M405 I410 F413 P444 K445 F448	L398-L402 PolarHBondContact O-N 3.28Å; Y399-L402 HydrophobicContact CD2-CD1 3.71Å; Y399-L402 HydrophobicContact CE2-CD1 4.22Å; Y399-L402 HydrophobicContact CG-CD1 4.35Å; Y399-L402 WeakPolarHBondContact O-CB 3.44Å; Y399-L402 WeakPolarHBondContact O-CD1 3.36Å; Y399-L402 VanDerWaalsContact O-CG 3.29Å; Y399-L402 WeakPolarHBondContact O-CG 3.44Å; Y399-L402 PolarHBondContact O-N 2.75Å; Y399-L402 VanDerWaalsContact O-N 3.15Å; L402-T404 VanDerWaalsContact C-N 3.25Å; L402-T404 PolarHBondContact O-N 3.04Å; L402-T404 VanDerWaalsContact O-N 3.17Å; L402-M405 HydrophobicContact CD2-SD 4.12Å; L402-M405 PolarHBondContact O-N 2.9Å; L402-M405 VanDerWaalsContact O-N 3.08Å; L402-I410 HydrophobicContact CD2-CD1 4.26Å; L402-I410 HydrophobicContact CD2-CG1 3.93Å; L402-I410 HydrophobicContact CD2-CG2 4.44Å; L402-F413 HydrophobicContact CD2-CD1 4.04Å; L402-F413 HydrophobicContact CD2-CE1 4.29Å; L402-P444 HydrophobicContact CB-CB 3.99Å; L402-K445 HydrophobicContact CB-CG 4.31Å; L402-K445 HydrophobicContact CD1-CG 4.21Å; L402-F448 HydrophobicContact CD1-CB 3.59Å; L402-F448 HydrophobicContact CD1-CD1 3.83Å; L402-F448 HydrophobicContact CD1-CD2 4.18Å; L402-F448 HydrophobicContact CD1-CG 3.6Å; L402-F448 HydrophobicContact CD2-CD2 4.16Å; L402-F448 HydrophobicContact CD2-CG 4.37Å
403	D	98.2	Very high	98.8	Very high	81 Å²	81	21.3 Å²	21.3	43%	0.433	11%	0.106	S	C	.	.	G	3₁₀ helix	trans	-57.4	-37.3	-170.2	-68.6	-42.6	0	0	0	113.6	R401	R401-D403 VanDerWaalsContact C-N 3.26Å; R401-D403 PolarHBondContact O-N 3.17Å
404	T	98.6	Very high	98.8	Very high	41 Å²	41	18.7 Å²	18.7	25%	0.252	9%	0.094	S	C	.	.	G	3₁₀ helix	trans	-110.6	8.1	178.9	60.4	0	0	0	0	113.1	W217 T218 A219 L402	W217-T404 WeakPolarHBondContact CA-O 3.3Å; T218-T404 PolarHBondContact N-O 3.13Å; T218-T404 WeakPolarHBondContact OG1-CB 3.28Å; A219-T404 HydrophobicContact CB-CG2 3.94Å; A219-T404 VanDerWaalsContact CB-OG1 3.3Å; A219-T404 WeakPolarHBondContact CB-OG1 3.31Å; L402-T404 VanDerWaalsContact C-N 3.25Å; L402-T404 PolarHBondContact O-N 3.04Å; L402-T404 VanDerWaalsContact O-N 3.17Å
405	M	98.9	Very high	98.8	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.108	C	C	.	.	B	Isolated β-bridge	trans	-70.1	138.8	177.5	-168.7	-177.9	-77.7	0	0	109.5	V216 W217 L398 L402 C409 I410 K750	V216-M405 HydrophobicContact CG1-CG 4.22Å; V216-M405 CarbonylContact O-C 3.55Å; V216-M405 VanDerWaalsContact O-CA 3.23Å; V216-M405 WeakPolarHBondContact O-CA 3.49Å; W217-M405 HydrophobicContact CH2-CE 4.49Å; W217-M405 HydrophobicContact CZ2-CE 3.39Å; L398-M405 HydrophobicContact CB-CE 4.39Å; L398-M405 HydrophobicContact CD2-CE 3.99Å; L402-M405 HydrophobicContact CD2-SD 4.12Å; L402-M405 PolarHBondContact O-N 2.9Å; L402-M405 VanDerWaalsContact O-N 3.08Å; M405-C409 HydrophobicContact CG-CB 3.96Å; M405-C409 HydrophobicContact SD-CB 4.15Å; M405-I410 HydrophobicContact CB-CD1 4.07Å; M405-I410 HydrophobicContact CB-CG1 3.8Å; M405-I410 HydrophobicContact CG-CG1 3.76Å; M405-I410 HydrophobicContact SD-CG1 3.67Å; M405-K750 PolarHBondContact O-NZ 3.18Å
406	N	98.8	Very high	98.8	Very high	7 Å²	7	21.3 Å²	21.3	4%	0.037	11%	0.108	C	C	.	.			trans	-64.4	136.3	175.1	-174.3	-82.1	0	0	0	110.5	V216 L362 T408 C409 I410 Q757	V216-N406 PolarHBondContact O-N 2.95Å; L362-N406 HydrophobicContact CD1-CB 4.33Å; N406-T408 PolarHBondContact O-N 3.45Å; N406-T408 VanDerWaalsContact O-N 3.16Å; N406-T408 VanDerWaalsContact OD1-CB 3.24Å; N406-T408 WeakPolarHBondContact OD1-CB 3.48Å; N406-T408 PolarHBondContact OD1-N 3.06Å; N406-T408 PolarHBondContact OD1-OG1 2.86Å; N406-C409 WeakPolarHBondContact O-CA 3.48Å; N406-C409 WeakPolarHBondContact O-CB 3.1Å; N406-C409 PolarHBondContact O-N 3.37Å; N406-I410 PolarHBondContact O-N 3Å; N406-Q757 PolarHBondContact ND2-OE1 3.11Å
407	T	98.8	Very high	98.8	Very high	9 Å²	9	18.8 Å²	18.8	6%	0.055	10%	0.096	C	C	.	.	H	α-helix	trans	-53.8	-36.9	-178.6	-66.6	0	0	0	0	112.8	C409 I410 D411 E754 R755	T407-C409 VanDerWaalsContact C-N 3.31Å; T407-C409 PolarHBondContact O-N 3.29Å; T407-I410 PolarHBondContact O-N 2.63Å; T407-D411 PolarHBondContact O-N 3.08Å; T407-E754 WeakPolarHBondContact CB-OE2 3.47Å; T407-E754 PolarHBondContact N-OE2 3.28Å; T407-E754 PolarHBondContact OG1-OE2 3.26Å; T407-R755 HydrophobicContact CG2-CG 4.46Å
408	T	98.9	Very high	98.8	Very high	2 Å²	2	18 Å²	18	1%	0.012	9%	0.092	C	C	.	.	H	α-helix	trans	-62.5	-39	176.5	-56.3	0	0	0	0	111.8	L362 N406 R412 Q758	L362-T408 HydrophobicContact CD2-CG2 3.8Å; N406-T408 PolarHBondContact O-N 3.45Å; N406-T408 VanDerWaalsContact O-N 3.16Å; N406-T408 VanDerWaalsContact OD1-CB 3.24Å; N406-T408 WeakPolarHBondContact OD1-CB 3.48Å; N406-T408 PolarHBondContact OD1-N 3.06Å; N406-T408 PolarHBondContact OD1-OG1 2.86Å; T408-R412 WeakPolarHBondContact O-CG 3.3Å; T408-R412 PolarHBondContact O-N 2.83Å; T408-Q758 HydrophobicContact CG2-CG 4.3Å; T408-Q758 WeakPolarHBondContact OG1-CG 3.38Å
409	C	98.9	Very high	98.8	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-73	-38.4	177	-55.3	0	0	0	0	111	V216 F360 M405 N406 T407 D411 R412 F413	V216-C409 HydrophobicContact CG1-CB 4.08Å; F360-C409 HydrophobicContact CB-CB 4.23Å; F360-C409 HydrophobicContact CD1-CB 3.87Å; F360-C409 WeakPolarHBondContact CE1-O 3.46Å; F360-C409 HydrophobicContact CG-CB 4.25Å; F360-C409 PolarHBondContact O-SG 2.89Å; F360-C409 VanDerWaalsContact O-SG 3.38Å; M405-C409 HydrophobicContact CG-CB 3.96Å; M405-C409 HydrophobicContact SD-CB 4.15Å; N406-C409 WeakPolarHBondContact O-CA 3.48Å; N406-C409 WeakPolarHBondContact O-CB 3.1Å; N406-C409 PolarHBondContact O-N 3.37Å; T407-C409 VanDerWaalsContact C-N 3.31Å; T407-C409 PolarHBondContact O-N 3.29Å; C409-D411 VanDerWaalsContact C-N 3.33Å; C409-D411 PolarHBondContact O-N 3.18Å; C409-R412 PolarHBondContact O-N 2.89Å; C409-F413 WeakPolarHBondContact O-CB 3.15Å; C409-F413 PolarHBondContact O-N 3.22Å
410	I	98.9	Very high	98.8	Very high	19 Å²	19	21.8 Å²	21.8	10%	0.097	11%	0.11	C	C	.	.	H	α-helix	trans	-58.4	-44.4	174.5	-64.8	175.6	0	0	0	110.6	L402 M405 N406 T407 R412 F413 I414 F448	L402-I410 HydrophobicContact CD2-CD1 4.26Å; L402-I410 HydrophobicContact CD2-CG1 3.93Å; L402-I410 HydrophobicContact CD2-CG2 4.44Å; M405-I410 HydrophobicContact CB-CD1 4.07Å; M405-I410 HydrophobicContact CB-CG1 3.8Å; M405-I410 HydrophobicContact CG-CG1 3.76Å; M405-I410 HydrophobicContact SD-CG1 3.67Å; N406-I410 PolarHBondContact O-N 3Å; T407-I410 PolarHBondContact O-N 2.63Å; I410-R412 VanDerWaalsContact C-N 3.31Å; I410-R412 PolarHBondContact O-N 3.34Å; I410-F413 WeakPolarHBondContact O-CB 3.48Å; I410-F413 PolarHBondContact O-N 3.4Å; I410-F413 VanDerWaalsContact O-N 3.12Å; I410-I414 HydrophobicContact CG2-CD1 3.72Å; I410-I414 HydrophobicContact CG2-CG1 4.25Å; I410-I414 VanDerWaalsContact O-CG1 3.3Å; I410-I414 WeakPolarHBondContact O-CG1 3.3Å; I410-I414 PolarHBondContact O-N 3.46Å; I410-F448 HydrophobicContact CG2-CD2 4.37Å
411	D	98.9	Very high	98.8	Very high	17 Å²	17	18.4 Å²	18.4	9%	0.091	9%	0.093	C	C	.	.	H	α-helix	trans	-56.3	-45.5	176	-71.5	-1.5	0	0	0	112.1	T407 C409 F413 I414 N415 L635 R755 Q758	T407-D411 PolarHBondContact O-N 3.08Å; C409-D411 VanDerWaalsContact C-N 3.33Å; C409-D411 PolarHBondContact O-N 3.18Å; D411-F413 VanDerWaalsContact C-N 3.31Å; D411-I414 PolarHBondContact O-N 3.41Å; D411-N415 WeakPolarHBondContact O-CB 3.24Å; D411-N415 PolarHBondContact O-N 3.38Å; D411-N415 PolarHBondContact O-ND2 3.02Å; D411-L635 HydrophobicContact CB-CD1 3.99Å; D411-L635 WeakPolarHBondContact OD1-CD1 3.3Å; D411-R755 IonicContact OD1-CZ 2.62Å; D411-R755 IonicContact OD1-NH1 3.47Å; D411-R755 IonicContact OD1-NH2 2.7Å; D411-R755 PolarHBondContact OD1-NH2 3.27Å; D411-R755 IonicContact OD2-CZ 3.87Å; D411-R755 IonicContact OD2-NH1 3.89Å; D411-R755 PolarHBondContact OD2-NH1 3.45Å; D411-R755 IonicContact OD2-NH2 3.7Å; D411-R755 PolarHBondContact OD2-NH2 3.37Å; D411-Q758 PolarHBondContact OD2-NE2 3.49Å; D411-Q758 VanDerWaalsContact OD2-NE2 3.12Å
412	R	98.9	Very high	98.8	Very high	15 Å²	15	18 Å²	18	6%	0.057	10%	0.097	C	C	.	.	H	α-helix	trans	-67.1	-36.8	178.7	-64	179.8	-163.5	161.5	4.6	110.8	L359 F360 Q361 P363 T408 C409 I410 N415 W416	L359-R412 HydrophobicContact CD1-CB 4.26Å; L359-R412 HydrophobicContact CG-CB 4.31Å; L359-R412 WeakPolarHBondContact O-CD 3.46Å; L359-R412 PolarHBondContact O-NH1 2.88Å; F360-R412 HydrophobicContact CD1-CB 4.21Å; F360-R412 HydrophobicContact CE1-CB 4.12Å; Q361-R412 PolarHBondContact O-NH1 3.09Å; P363-R412 PolarHBondContact O-NH2 3.26Å; T408-R412 WeakPolarHBondContact O-CG 3.3Å; T408-R412 PolarHBondContact O-N 2.83Å; C409-R412 PolarHBondContact O-N 2.89Å; I410-R412 VanDerWaalsContact C-N 3.31Å; I410-R412 PolarHBondContact O-N 3.34Å; R412-N415 PolarHBondContact O-N 3.09Å; R412-W416 VanDerWaalsContact O-CB 3.25Å; R412-W416 WeakPolarHBondContact O-CB 3.36Å; R412-W416 PolarHBondContact O-N 2.9Å
413	F	98.9	Very high	98.8	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-66	-44.8	176.7	-174.2	-147.8	0	0	0	111.5	F360 T395 L398 L402 C409 I410 D411 N415 W416 F417 F448	F360-F413 HydrophobicContact CE1-CB 3.8Å; F360-F413 HydrophobicContact CZ-CB 3.85Å; F360-F413 HydrophobicContact CZ-CD2 4.14Å; F360-F413 HydrophobicContact CZ-CG 4.2Å; T395-F413 HydrophobicContact CG2-CE2 4.29Å; T395-F413 HydrophobicContact CG2-CZ 4.18Å; L398-F413 HydrophobicContact CB-CD1 4.37Å; L398-F413 HydrophobicContact CB-CE1 3.69Å; L398-F413 HydrophobicContact CB-CE2 3.92Å; L398-F413 HydrophobicContact CB-CZ 3.46Å; L398-F413 VanDerWaalsContact CB-CZ 3.46Å; L398-F413 HydrophobicContact CD1-CD2 3.97Å; L398-F413 HydrophobicContact CD1-CE2 3.59Å; L398-F413 HydrophobicContact CD1-CZ 4.06Å; L398-F413 HydrophobicContact CG-CE2 4.41Å; L398-F413 HydrophobicContact CG-CZ 4.41Å; L402-F413 HydrophobicContact CD2-CD1 4.04Å; L402-F413 HydrophobicContact CD2-CE1 4.29Å; C409-F413 WeakPolarHBondContact O-CB 3.15Å; C409-F413 PolarHBondContact O-N 3.22Å; I410-F413 WeakPolarHBondContact O-CB 3.48Å; I410-F413 PolarHBondContact O-N 3.4Å; I410-F413 VanDerWaalsContact O-N 3.12Å; D411-F413 VanDerWaalsContact C-N 3.31Å; F413-N415 PolarHBondContact O-N 2.85Å; F413-W416 AromaticContact CD2-CE3 3.63Å; F413-W416 HydrophobicContact CD2-CE3 3.63Å; F413-W416 AromaticContact CD2-CZ3 3.95Å; F413-W416 HydrophobicContact CD2-CZ3 3.95Å; F413-W416 AromaticContact CE2-CE3 3.74Å; F413-W416 HydrophobicContact CE2-CE3 3.74Å; F413-W416 AromaticContact CE2-CZ3 3.54Å; F413-W416 HydrophobicContact CE2-CZ3 3.54Å; F413-W416 PolarHBondContact O-N 3.44Å; F413-F417 HydrophobicContact CD2-CB 4.47Å; F413-F417 HydrophobicContact CE2-CB 4.39Å; F413-F417 WeakPolarHBondContact O-CB 3.12Å; F413-F417 PolarHBondContact O-N 3.2Å; F413-F448 HydrophobicContact CB-CE2 4.17Å; F413-F448 AromaticContact CD1-CD2 3.92Å; F413-F448 HydrophobicContact CD1-CD2 3.92Å; F413-F448 HydrophobicContact CD1-CE1 4.49Å; F413-F448 AromaticContact CD1-CE2 3.14Å; F413-F448 HydrophobicContact CD1-CE2 3.14Å; F413-F448 AromaticContact CD1-CZ 3.49Å; F413-F448 HydrophobicContact CD1-CZ 3.49Å; F413-F448 VanDerWaalsContact CD1-CZ 3.49Å; F413-F448 HydrophobicContact CD2-CE2 4.41Å; F413-F448 HydrophobicContact CD2-CZ 4.39Å; F413-F448 HydrophobicContact CE1-CD2 4.27Å; F413-F448 AromaticContact CE1-CE1 3.98Å; F413-F448 HydrophobicContact CE1-CE1 3.98Å; F413-F448 AromaticContact CE1-CE2 3.46Å; F413-F448 HydrophobicContact CE1-CE2 3.46Å; F413-F448 VanDerWaalsContact CE1-CE2 3.46Å; F413-F448 AromaticContact CE1-CZ 3.27Å; F413-F448 HydrophobicContact CE1-CZ 3.27Å; F413-F448 HydrophobicContact CE2-CZ 4.24Å; F413-F448 AromaticContact CG-CE2 3.65Å; F413-F448 HydrophobicContact CG-CE2 3.65Å; F413-F448 HydrophobicContact CG-CZ 4.04Å; F413-F448 HydrophobicContact CZ-CE1 4.38Å; F413-F448 HydrophobicContact CZ-CE2 4.21Å; F413-F448 AromaticContact CZ-CZ 3.66Å; F413-F448 HydrophobicContact CZ-CZ 3.66Å
414	I	98.9	Very high	98.8	Very high	5 Å²	5	21 Å²	21	3%	0.026	11%	0.109	C	C	.	.	H	α-helix	trans	-57.1	-50.3	174.1	-69.5	162	0	0	0	110.4	I410 D411 S418 F448 E451 V452 K455 L635	I410-I414 HydrophobicContact CG2-CD1 3.72Å; I410-I414 HydrophobicContact CG2-CG1 4.25Å; I410-I414 VanDerWaalsContact O-CG1 3.3Å; I410-I414 WeakPolarHBondContact O-CG1 3.3Å; I410-I414 PolarHBondContact O-N 3.46Å; D411-I414 PolarHBondContact O-N 3.41Å; I414-S418 VanDerWaalsContact O-CB 3.31Å; I414-S418 WeakPolarHBondContact O-CB 3.2Å; I414-S418 PolarHBondContact O-N 2.98Å; I414-S418 PolarHBondContact O-OG 2.6Å; I414-F448 HydrophobicContact CB-CE2 4.46Å; I414-F448 HydrophobicContact CD1-CD2 4.28Å; I414-F448 HydrophobicContact CG1-CD2 3.45Å; I414-F448 VanDerWaalsContact CG1-CD2 3.45Å; I414-F448 HydrophobicContact CG1-CE2 3.67Å; I414-F448 HydrophobicContact CG1-CG 4.46Å; I414-E451 HydrophobicContact CD1-CB 3.69Å; I414-E451 HydrophobicContact CD1-CG 4.23Å; I414-E451 HydrophobicContact CG1-CB 4.24Å; I414-E451 HydrophobicContact CG2-CB 4.01Å; I414-V452 HydrophobicContact CB-CG2 4.34Å; I414-V452 HydrophobicContact CG1-CG2 4.22Å; I414-V452 HydrophobicContact CG2-CG2 4.17Å; I414-K455 HydrophobicContact CG2-CG 3.83Å; I414-L635 HydrophobicContact CD1-CD2 4.45Å; I414-L635 HydrophobicContact CG2-CD2 3.94Å
415	N	98.9	Very high	98.7	Very high	56 Å²	56	23.8 Å²	23.8	30%	0.299	12%	0.12	S	C	.	.	H	α-helix	trans	-65.7	-44.1	-178.1	-76.1	-56.6	0	0	0	112.2	D411 R412 F413 S418 H419 K455	D411-N415 WeakPolarHBondContact O-CB 3.24Å; D411-N415 PolarHBondContact O-N 3.38Å; D411-N415 PolarHBondContact O-ND2 3.02Å; R412-N415 PolarHBondContact O-N 3.09Å; F413-N415 PolarHBondContact O-N 2.85Å; N415-S418 PolarHBondContact O-OG 2.77Å; N415-H419 VanDerWaalsContact O-CB 3.23Å; N415-H419 WeakPolarHBondContact O-CB 3.33Å; N415-H419 PolarHBondContact O-N 2.92Å; N415-K455 WeakPolarHBondContact OD1-CE 3.25Å; N415-K455 PolarHBondContact OD1-NZ 3.44Å
416	W	98.9	Very high	98.7	Very high	4 Å²	4	24.2 Å²	24.2	2%	0.015	12%	0.121	C	C	.	.	H	α-helix	trans	-62.2	-50.5	175.6	166.5	82.5	0	0	0	111.5	F356 L359 L376 L391 T395 R412 F413 H419 H420	F356-W416 AromaticContact CE1-CD2 3.92Å; F356-W416 HydrophobicContact CE1-CD2 3.92Å; F356-W416 AromaticContact CE1-CE2 3.87Å; F356-W416 HydrophobicContact CE1-CE3 4.08Å; F356-W416 HydrophobicContact CE1-CH2 4.22Å; F356-W416 HydrophobicContact CE1-CZ2 4.04Å; F356-W416 HydrophobicContact CE1-CZ3 4.24Å; F356-W416 HydrophobicContact CZ-CD2 4.32Å; F356-W416 AromaticContact CZ-CE2 3.92Å; F356-W416 HydrophobicContact CZ-CE3 4.35Å; F356-W416 AromaticContact CZ-CH2 3.68Å; F356-W416 HydrophobicContact CZ-CH2 3.68Å; F356-W416 AromaticContact CZ-CZ2 3.6Å; F356-W416 HydrophobicContact CZ-CZ2 3.6Å; F356-W416 HydrophobicContact CZ-CZ3 4.07Å; L359-W416 HydrophobicContact CD2-CB 3.9Å; L359-W416 HydrophobicContact CD2-CG 4.03Å; L376-W416 HydrophobicContact CD1-CZ2 4.09Å; L376-W416 VanDerWaalsContact CD1-NE1 3.28Å; L391-W416 HydrophobicContact CD1-CH2 4.2Å; L391-W416 HydrophobicContact CD1-CZ2 3.82Å; L391-W416 HydrophobicContact CD2-CZ2 4.29Å; L391-W416 HydrophobicContact CG-CZ2 4.26Å; T395-W416 HydrophobicContact CG2-CH2 4.48Å; T395-W416 HydrophobicContact CG2-CZ3 4.25Å; T395-W416 WeakPolarHBondContact OG1-CH2 3.49Å; R412-W416 VanDerWaalsContact O-CB 3.25Å; R412-W416 WeakPolarHBondContact O-CB 3.36Å; R412-W416 PolarHBondContact O-N 2.9Å; F413-W416 AromaticContact CD2-CE3 3.63Å; F413-W416 HydrophobicContact CD2-CE3 3.63Å; F413-W416 AromaticContact CD2-CZ3 3.95Å; F413-W416 HydrophobicContact CD2-CZ3 3.95Å; F413-W416 AromaticContact CE2-CE3 3.74Å; F413-W416 HydrophobicContact CE2-CE3 3.74Å; F413-W416 AromaticContact CE2-CZ3 3.54Å; F413-W416 HydrophobicContact CE2-CZ3 3.54Å; F413-W416 PolarHBondContact O-N 3.44Å; W416-H419 PolarHBondContact O-N 3.42Å; W416-H420 HydrophobicContact CZ2-CB 4.38Å; W416-H420 VanDerWaalsContact O-CB 3.27Å; W416-H420 WeakPolarHBondContact O-CB 3.35Å; W416-H420 PolarHBondContact O-N 3.38Å
417	F	98.9	Very high	98.6	Very high	1 Å²	1	32.9 Å²	32.9	0%	0.004	15%	0.154	C	C	.	.	H	α-helix	trans	-68.1	-46.8	-171.7	-175.2	-126	0	0	0	111.2	T395 F413 H419 H420 L421 W428 W430 W433 F448 V452	T395-F417 HydrophobicContact CG2-CD2 3.82Å; T395-F417 HydrophobicContact CG2-CE2 3.58Å; T395-F417 HydrophobicContact CG2-CZ 4.18Å; F413-F417 HydrophobicContact CD2-CB 4.47Å; F413-F417 HydrophobicContact CE2-CB 4.39Å; F413-F417 WeakPolarHBondContact O-CB 3.12Å; F413-F417 PolarHBondContact O-N 3.2Å; F417-H419 VanDerWaalsContact C-N 3.32Å; F417-H419 PolarHBondContact O-N 2.99Å; F417-H420 WeakPolarHBondContact O-CB 3.49Å; F417-H420 PolarHBondContact O-N 2.91Å; F417-L421 HydrophobicContact CD1-CD1 4.03Å; F417-L421 HydrophobicContact CD2-CG 4.25Å; F417-L421 HydrophobicContact CE1-CD1 3.6Å; F417-L421 HydrophobicContact CE1-CG 4.22Å; F417-L421 HydrophobicContact CE2-CD1 4.22Å; F417-L421 HydrophobicContact CE2-CD2 3.93Å; F417-L421 HydrophobicContact CE2-CG 3.94Å; F417-L421 HydrophobicContact CZ-CD1 3.72Å; F417-L421 HydrophobicContact CZ-CD2 3.93Å; F417-L421 HydrophobicContact CZ-CG 3.93Å; F417-L421 WeakPolarHBondContact O-CB 3.41Å; F417-L421 VanDerWaalsContact O-CG 3.3Å; F417-L421 WeakPolarHBondContact O-CG 3.45Å; F417-L421 PolarHBondContact O-N 3Å; F417-W428 HydrophobicContact CE2-CD2 4.18Å; F417-W428 AromaticContact CE2-CE3 3.98Å; F417-W428 HydrophobicContact CE2-CE3 3.98Å; F417-W428 HydrophobicContact CE2-CZ3 4.19Å; F417-W428 AromaticContact CZ-CD2 3.61Å; F417-W428 HydrophobicContact CZ-CD2 3.61Å; F417-W428 AromaticContact CZ-CE2 3.88Å; F417-W428 AromaticContact CZ-CE3 3.89Å; F417-W428 HydrophobicContact CZ-CE3 3.89Å; F417-W428 AromaticContact CZ-CG 3.88Å; F417-W428 HydrophobicContact CZ-CG 3.88Å; F417-W428 HydrophobicContact CZ-CZ2 4.41Å; F417-W428 HydrophobicContact CZ-CZ3 4.4Å; F417-W430 HydrophobicContact CE1-CH2 4.39Å; F417-W433 HydrophobicContact CD1-CH2 4.15Å; F417-W433 HydrophobicContact CD1-CZ3 4.44Å; F417-W433 AromaticContact CE1-CH2 3.38Å; F417-W433 HydrophobicContact CE1-CH2 3.38Å; F417-W433 AromaticContact CE1-CZ3 3.59Å; F417-W433 HydrophobicContact CE1-CZ3 3.59Å; F417-W433 HydrophobicContact CE2-CH2 4.48Å; F417-W433 AromaticContact CZ-CH2 3.57Å; F417-W433 HydrophobicContact CZ-CH2 3.57Å; F417-W433 HydrophobicContact CZ-CZ2 4.48Å; F417-W433 HydrophobicContact CZ-CZ3 4.09Å; F417-F448 HydrophobicContact CB-CZ 4.42Å; F417-F448 HydrophobicContact CD1-CE1 4.25Å; F417-F448 HydrophobicContact CD1-CZ 4Å; F417-F448 HydrophobicContact CG-CZ 4.5Å; F417-V452 HydrophobicContact CD1-CB 4.49Å; F417-V452 HydrophobicContact CD1-CG1 3.69Å; F417-V452 HydrophobicContact CD1-CG2 3.97Å; F417-V452 HydrophobicContact CE1-CG1 4.05Å
418	S	98.9	Very high	98.5	Very high	3 Å²	3	35 Å²	35	2%	0.021	16%	0.161	C	C	.	.	H	α-helix	trans	-60.2	-39.5	176.7	58.4	0	0	0	0	112.9	I414 N415 S422 K455	I414-S418 VanDerWaalsContact O-CB 3.31Å; I414-S418 WeakPolarHBondContact O-CB 3.2Å; I414-S418 PolarHBondContact O-N 2.98Å; I414-S418 PolarHBondContact O-OG 2.6Å; N415-S418 PolarHBondContact O-OG 2.77Å; S418-S422 PolarHBondContact O-N 3.43Å; S418-S422 VanDerWaalsContact O-N 3.14Å; S418-K455 VanDerWaalsContact CB-CB 3.45Å; S418-K455 VanDerWaalsContact OG-CB 3.28Å; S418-K455 WeakPolarHBondContact OG-CB 3.47Å
419	H	98.9	Very high	98.5	Very high	54 Å²	54	37.7 Å²	37.7	25%	0.25	18%	0.18	C	C	.	.	H	α-helix	trans	-73.7	-36	175.8	-175.5	-156.8	0	0	0	112.5	T373 N415 W416 F417 S422 N423 L459	T373-H419 HydrophobicContact CG2-CB 4.29Å; T373-H419 WeakPolarHBondContact CG2-ND1 3.4Å; N415-H419 VanDerWaalsContact O-CB 3.23Å; N415-H419 WeakPolarHBondContact O-CB 3.33Å; N415-H419 PolarHBondContact O-N 2.92Å; W416-H419 PolarHBondContact O-N 3.42Å; F417-H419 VanDerWaalsContact C-N 3.32Å; F417-H419 PolarHBondContact O-N 2.99Å; H419-S422 PolarHBondContact O-N 3.12Å; H419-S422 PolarHBondContact O-OG 3.19Å; H419-N423 PolarHBondContact CD2-ND2 3.36Å; H419-N423 PolarHBondContact O-N 3.41Å; H419-N423 PolarHBondContact O-ND2 3.02Å; H419-L459 HydrophobicContact CB-CD1 4.43Å
420	H	98.8	Very high	98.4	Very high	27 Å²	27	38.2 Å²	38.2	13%	0.125	18%	0.182	C	C	.	.	H	α-helix	trans	-59.6	-51.9	171.4	-179.1	85.2	0	0	0	110.1	W416 F417 S422 N423 F424	W416-H420 HydrophobicContact CZ2-CB 4.38Å; W416-H420 VanDerWaalsContact O-CB 3.27Å; W416-H420 WeakPolarHBondContact O-CB 3.35Å; W416-H420 PolarHBondContact O-N 3.38Å; F417-H420 WeakPolarHBondContact O-CB 3.49Å; F417-H420 PolarHBondContact O-N 2.91Å; H420-S422 VanDerWaalsContact C-N 3.3Å; H420-S422 PolarHBondContact O-N 3.06Å; H420-N423 WeakPolarHBondContact O-CB 3.4Å; H420-N423 PolarHBondContact O-N 3.48Å; H420-F424 AromaticContact CD2-CD2 3.97Å; H420-F424 AromaticContact CE1-CD2 3.73Å; H420-F424 AromaticContact CE1-CE2 3.3Å; H420-F424 WeakPolarHBondContact CE1-CE2 3.48Å; H420-F424 AromaticContact ND1-CE2 3.77Å; H420-F424 AromaticContact NE2-CD2 3.57Å; H420-F424 AromaticContact NE2-CE2 3.63Å; H420-F424 VanDerWaalsContact O-CD2 3.32Å; H420-F424 WeakPolarHBondContact O-CD2 3.4Å; H420-F424 PolarHBondContact O-N 2.98Å
421	L	98.7	Very high	98.3	Very high	3 Å²	3	42.2 Å²	42.2	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-54.3	-42.8	177.4	-73.8	-178.2	0	0	0	112.5	F417 N423 F424 Q425 F426 R427 W428 W430 V452	F417-L421 HydrophobicContact CD1-CD1 4.03Å; F417-L421 HydrophobicContact CD2-CG 4.25Å; F417-L421 HydrophobicContact CE1-CD1 3.6Å; F417-L421 HydrophobicContact CE1-CG 4.22Å; F417-L421 HydrophobicContact CE2-CD1 4.22Å; F417-L421 HydrophobicContact CE2-CD2 3.93Å; F417-L421 HydrophobicContact CE2-CG 3.94Å; F417-L421 HydrophobicContact CZ-CD1 3.72Å; F417-L421 HydrophobicContact CZ-CD2 3.93Å; F417-L421 HydrophobicContact CZ-CG 3.93Å; F417-L421 WeakPolarHBondContact O-CB 3.41Å; F417-L421 VanDerWaalsContact O-CG 3.3Å; F417-L421 WeakPolarHBondContact O-CG 3.45Å; F417-L421 PolarHBondContact O-N 3Å; L421-N423 PolarHBondContact O-N 2.94Å; L421-N423 VanDerWaalsContact O-N 3.13Å; L421-F424 CarbonylContact O-C 3.49Å; L421-F424 PolarHBondContact O-N 3.15Å; L421-Q425 PolarHBondContact O-N 3.23Å; L421-F426 HydrophobicContact CB-CD1 3.99Å; L421-F426 WeakPolarHBondContact O-CA 3.3Å; L421-F426 PolarHBondContact O-N 3.02Å; L421-R427 WeakPolarHBondContact CD2-O 3.28Å; L421-W428 HydrophobicContact CD2-CB 3.94Å; L421-W430 HydrophobicContact CD1-CH2 3.95Å; L421-W430 HydrophobicContact CD1-CZ2 3.97Å; L421-V452 HydrophobicContact CD1-CG1 4.26Å
422	S	98.6	Very high	98.2	Very high	35 Å²	35	46 Å²	46	25%	0.245	22%	0.224	C	C	.	.	H	α-helix	trans	-61.6	-24.2	179.3	74.7	0	0	0	0	113.6	S418 H419 H420 F426	S418-S422 PolarHBondContact O-N 3.43Å; S418-S422 VanDerWaalsContact O-N 3.14Å; H419-S422 PolarHBondContact O-N 3.12Å; H419-S422 PolarHBondContact O-OG 3.19Å; H420-S422 VanDerWaalsContact C-N 3.3Å; H420-S422 PolarHBondContact O-N 3.06Å; S422-F426 VanDerWaalsContact CA-CE1 3.48Å; S422-F426 VanDerWaalsContact CB-CE1 3.49Å; S422-F426 VanDerWaalsContact CB-CZ 3.45Å
423	N	98.5	Very high	98.2	Very high	72 Å²	72	45.3 Å²	45.3	39%	0.385	22%	0.221	S	C	.	.	H	α-helix	trans	-83.8	-12.6	176.2	-75.3	-92.5	0	0	0	113.3	I377 H419 H420 L421	I377-N423 HydrophobicContact CD1-CB 3.79Å; H419-N423 PolarHBondContact CD2-ND2 3.36Å; H419-N423 PolarHBondContact O-N 3.41Å; H419-N423 PolarHBondContact O-ND2 3.02Å; H420-N423 WeakPolarHBondContact O-CB 3.4Å; H420-N423 PolarHBondContact O-N 3.48Å; L421-N423 PolarHBondContact O-N 2.94Å; L421-N423 VanDerWaalsContact O-N 3.13Å
424	F	97.5	Very high	98.2	Very high	71 Å²	71	47.2 Å²	47.2	31%	0.311	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.6	38.7	179.8	-62.6	-78.6	0	0	0	112.3	I377 H420 L421 F426 R427	I377-F424 HydrophobicContact CG1-CE2 4.02Å; I377-F424 HydrophobicContact CG1-CZ 4.33Å; H420-F424 AromaticContact CD2-CD2 3.97Å; H420-F424 AromaticContact CE1-CD2 3.73Å; H420-F424 AromaticContact CE1-CE2 3.3Å; H420-F424 WeakPolarHBondContact CE1-CE2 3.48Å; H420-F424 AromaticContact ND1-CE2 3.77Å; H420-F424 AromaticContact NE2-CD2 3.57Å; H420-F424 AromaticContact NE2-CE2 3.63Å; H420-F424 VanDerWaalsContact O-CD2 3.32Å; H420-F424 WeakPolarHBondContact O-CD2 3.4Å; H420-F424 PolarHBondContact O-N 2.98Å; L421-F424 CarbonylContact O-C 3.49Å; L421-F424 PolarHBondContact O-N 3.15Å; F424-F426 PolarHBondContact O-N 2.96Å; F424-F426 VanDerWaalsContact O-N 3.1Å; F424-R427 PolarHBondContact O-N 3.13Å
425	Q	97.5	Very high	98.1	Very high	100 Å²	100	49.6 Å²	49.6	47%	0.467	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	25.1	176.5	-59.2	76.8	43.5	0	0	114.2	L421 R427	L421-Q425 PolarHBondContact O-N 3.23Å; Q425-R427 HydrophobicContact CB-CG 4.49Å; Q425-R427 PolarHBondContact O-N 3.39Å
426	F	97.6	Very high	98	Very high	8 Å²	8	47 Å²	47	4%	0.035	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	29.2	-177.2	-54.6	-83.5	0	0	0	114.4	L421 S422 F424 W428 L459 L468	L421-F426 HydrophobicContact CB-CD1 3.99Å; L421-F426 WeakPolarHBondContact O-CA 3.3Å; L421-F426 PolarHBondContact O-N 3.02Å; S422-F426 VanDerWaalsContact CA-CE1 3.48Å; S422-F426 VanDerWaalsContact CB-CE1 3.49Å; S422-F426 VanDerWaalsContact CB-CZ 3.45Å; F424-F426 PolarHBondContact O-N 2.96Å; F424-F426 VanDerWaalsContact O-N 3.1Å; F426-W428 PolarHBondContact O-N 3.11Å; F426-L459 HydrophobicContact CZ-CB 4.35Å; F426-L468 HydrophobicContact CB-CD1 3.41Å; F426-L468 VanDerWaalsContact CB-CD1 3.41Å; F426-L468 HydrophobicContact CB-CD2 4.09Å; F426-L468 HydrophobicContact CB-CG 4.35Å; F426-L468 HydrophobicContact CD2-CD1 4Å; F426-L468 HydrophobicContact CG-CD1 3.86Å
427	R	96.9	Very high	97.9	Very high	189 Å²	189	49.9 Å²	49.9	71%	0.713	25%	0.251	S	S	*	.			trans	-78.2	122	176.9	-68.8	179.4	177	164.1	-0.9	110.7	L421 F424 Q425	L421-R427 WeakPolarHBondContact CD2-O 3.28Å; F424-R427 PolarHBondContact O-N 3.13Å; Q425-R427 HydrophobicContact CB-CG 4.49Å; Q425-R427 PolarHBondContact O-N 3.39Å
428	W	98.1	Very high	97.8	Very high	53 Å²	53	55.8 Å²	55.8	20%	0.201	29%	0.288	C	S	.	.			trans	-151.2	149.8	171.3	-173.1	-111.2	0	0	0	109.6	T395 F417 L421 F426 W430 W433	T395-W428 HydrophobicContact CG2-CH2 3.7Å; T395-W428 HydrophobicContact CG2-CZ2 4.07Å; T395-W428 HydrophobicContact CG2-CZ3 4.26Å; F417-W428 HydrophobicContact CE2-CD2 4.18Å; F417-W428 AromaticContact CE2-CE3 3.98Å; F417-W428 HydrophobicContact CE2-CE3 3.98Å; F417-W428 HydrophobicContact CE2-CZ3 4.19Å; F417-W428 AromaticContact CZ-CD2 3.61Å; F417-W428 HydrophobicContact CZ-CD2 3.61Å; F417-W428 AromaticContact CZ-CE2 3.88Å; F417-W428 AromaticContact CZ-CE3 3.89Å; F417-W428 HydrophobicContact CZ-CE3 3.89Å; F417-W428 AromaticContact CZ-CG 3.88Å; F417-W428 HydrophobicContact CZ-CG 3.88Å; F417-W428 HydrophobicContact CZ-CZ2 4.41Å; F417-W428 HydrophobicContact CZ-CZ3 4.4Å; L421-W428 HydrophobicContact CD2-CB 3.94Å; F426-W428 PolarHBondContact O-N 3.11Å; W428-W430 VanDerWaalsContact C-N 3.28Å; W428-W430 HydrophobicContact CB-CD2 4.29Å; W428-W430 HydrophobicContact CB-CZ2 4.17Å; W428-W430 AromaticContact CD1-CD2 3.79Å; W428-W430 AromaticContact CD1-CE3 3.79Å; W428-W430 HydrophobicContact CG-CD2 4.45Å; W428-W430 PolarHBondContact O-N 3.34Å; W428-W430 VanDerWaalsContact O-N 3.1Å; W428-W433 AromaticContact CE2-CE2 3.88Å; W428-W433 AromaticContact CE2-CH2 3.78Å; W428-W433 AromaticContact CE2-CZ2 3.53Å; W428-W433 HydrophobicContact CH2-CZ2 4.39Å; W428-W433 AromaticContact CZ2-CE2 3.77Å; W428-W433 AromaticContact CZ2-CH2 3.96Å; W428-W433 HydrophobicContact CZ2-CH2 3.96Å; W428-W433 AromaticContact CZ2-CZ2 3.32Å; W428-W433 HydrophobicContact CZ2-CZ2 3.32Å; W428-W433 AromaticContact NE1-CD2 3.58Å; W428-W433 AromaticContact NE1-CE2 3.43Å; W428-W433 AromaticContact NE1-CE3 3.64Å; W428-W433 AromaticContact NE1-CH2 3.49Å; W428-W433 AromaticContact NE1-CZ2 3.41Å; W428-W433 AromaticContact NE1-CZ3 3.6Å
429	S	97.4	Very high	97.7	Very high	59 Å²	59	59.1 Å²	59.1	41%	0.413	31%	0.305	S	S	.	.			trans	-82.5	71.2	173.6	44.4	0	0	0	0	110.5	D431 D432	S429-D431 PolarHBondContact O-N 3.32Å; S429-D431 VanDerWaalsContact O-N 3.1Å; S429-D432 WeakPolarHBondContact CB-OD2 3.34Å; S429-D432 WeakPolarHBondContact O-CB 3.37Å; S429-D432 PolarHBondContact O-N 2.63Å; S429-D432 PolarHBondContact OG-OD2 2.92Å
430	W	97.6	Very high	97.5	Very high	11 Å²	11	61.4 Å²	61.4	4%	0.042	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-55	-30.9	-176.6	-61.4	104.2	0	0	0	114.3	F417 L421 W428 D432 W433 V449 V452 L453 V469 P470 F473	F417-W430 HydrophobicContact CE1-CH2 4.39Å; L421-W430 HydrophobicContact CD1-CH2 3.95Å; L421-W430 HydrophobicContact CD1-CZ2 3.97Å; W428-W430 VanDerWaalsContact C-N 3.28Å; W428-W430 HydrophobicContact CB-CD2 4.29Å; W428-W430 HydrophobicContact CB-CZ2 4.17Å; W428-W430 AromaticContact CD1-CD2 3.79Å; W428-W430 AromaticContact CD1-CE3 3.79Å; W428-W430 HydrophobicContact CG-CD2 4.45Å; W428-W430 PolarHBondContact O-N 3.34Å; W428-W430 VanDerWaalsContact O-N 3.1Å; W430-D432 PolarHBondContact O-N 2.94Å; W430-W433 HydrophobicContact CE3-CE3 4.18Å; W430-W433 HydrophobicContact CE3-CZ3 4.41Å; W430-W433 HydrophobicContact CZ3-CE3 4.19Å; W430-W433 HydrophobicContact CZ3-CZ3 4.02Å; W430-W433 PolarHBondContact O-N 2.94Å; W430-V449 HydrophobicContact CZ3-CG1 4.26Å; W430-V452 HydrophobicContact CH2-CG1 4.07Å; W430-L453 HydrophobicContact CH2-CD2 3.7Å; W430-L453 HydrophobicContact CZ2-CD2 3.89Å; W430-L453 HydrophobicContact CZ3-CD2 4.22Å; W430-V469 HydrophobicContact CD2-CG1 4.23Å; W430-V469 HydrophobicContact CG-CG1 4.37Å; W430-V469 HydrophobicContact CZ2-CG1 4.48Å; W430-P470 HydrophobicContact CB-CG 4Å; W430-F473 HydrophobicContact CB-CE2 4.38Å; W430-F473 HydrophobicContact CB-CZ 4.39Å; W430-F473 WeakPolarHBondContact O-CZ 3.35Å
431	D	96.9	Very high	97.4	Very high	103 Å²	103	64.3 Å²	64.3	55%	0.551	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-61.3	-24.3	177.5	-69.8	-48.6	0	0	0	113.4	S429 W433 A434 P470	S429-D431 PolarHBondContact O-N 3.32Å; S429-D431 VanDerWaalsContact O-N 3.1Å; D431-W433 PolarHBondContact O-N 3.03Å; D431-A434 VanDerWaalsContact O-CB 3.29Å; D431-A434 WeakPolarHBondContact O-CB 3.27Å; D431-A434 PolarHBondContact O-N 2.96Å; D431-P470 WeakPolarHBondContact OD1-CG 3.46Å
432	D	97.6	Very high	97.2	Very high	97 Å²	97	68 Å²	68	52%	0.519	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-64.2	-21.5	174.8	-62.7	-21.9	0	0	0	111.6	S429 W430	S429-D432 WeakPolarHBondContact CB-OD2 3.34Å; S429-D432 WeakPolarHBondContact O-CB 3.37Å; S429-D432 PolarHBondContact O-N 2.63Å; S429-D432 PolarHBondContact OG-OD2 2.92Å; W430-D432 PolarHBondContact O-N 2.94Å
433	W	98.4	Very high	97.1	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-104.9	19.7	-179.9	-64.9	-6.5	0	0	0	113.1	T395 E396 Y399 F417 W428 W430 D431 D435 C436 F448 V449	T395-W433 HydrophobicContact CG2-CH2 4.36Å; T395-W433 HydrophobicContact CG2-CZ2 4.19Å; E396-W433 PolarHBondContact OE2-NE1 2.99Å; Y399-W433 AromaticContact CD1-CD1 3.43Å; Y399-W433 VanDerWaalsContact CD1-CD1 3.43Å; Y399-W433 HydrophobicContact CD1-CD2 4.13Å; Y399-W433 AromaticContact CD1-CE2 3.85Å; Y399-W433 AromaticContact CD1-CG 3.89Å; Y399-W433 HydrophobicContact CD1-CG 3.89Å; Y399-W433 AromaticContact CD1-NE1 3.43Å; Y399-W433 AromaticContact CD2-CD2 3.64Å; Y399-W433 HydrophobicContact CD2-CD2 3.64Å; Y399-W433 AromaticContact CD2-CE2 3.67Å; Y399-W433 AromaticContact CD2-CE3 3.91Å; Y399-W433 HydrophobicContact CD2-CE3 3.91Å; Y399-W433 HydrophobicContact CD2-CG 4.1Å; Y399-W433 HydrophobicContact CD2-CH2 4.2Å; Y399-W433 AromaticContact CD2-CZ2 3.96Å; Y399-W433 HydrophobicContact CD2-CZ2 3.96Å; Y399-W433 HydrophobicContact CD2-CZ3 4.18Å; Y399-W433 HydrophobicContact CE1-CB 3.97Å; Y399-W433 AromaticContact CE1-CD1 3.44Å; Y399-W433 VanDerWaalsContact CE1-CD1 3.44Å; Y399-W433 HydrophobicContact CE1-CD2 4.19Å; Y399-W433 AromaticContact CE1-CG 3.61Å; Y399-W433 HydrophobicContact CE1-CG 3.61Å; Y399-W433 AromaticContact CE1-NE1 3.95Å; Y399-W433 HydrophobicContact CE2-CB 4.12Å; Y399-W433 AromaticContact CE2-CD2 3.68Å; Y399-W433 HydrophobicContact CE2-CD2 3.68Å; Y399-W433 AromaticContact CE2-CE3 3.89Å; Y399-W433 HydrophobicContact CE2-CE3 3.89Å; Y399-W433 AromaticContact CE2-CG 3.8Å; Y399-W433 HydrophobicContact CE2-CG 3.8Å; Y399-W433 AromaticContact CG-CD1 3.92Å; Y399-W433 AromaticContact CG-CD2 3.86Å; Y399-W433 HydrophobicContact CG-CD2 3.86Å; Y399-W433 AromaticContact CG-CE2 3.47Å; Y399-W433 VanDerWaalsContact CG-CE2 3.47Å; Y399-W433 HydrophobicContact CG-CG 4.13Å; Y399-W433 AromaticContact CG-CZ2 3.84Å; Y399-W433 HydrophobicContact CG-CZ2 3.84Å; Y399-W433 AromaticContact CG-NE1 3.55Å; Y399-W433 AromaticContact CZ-CD1 3.89Å; Y399-W433 AromaticContact CZ-CD2 3.95Å; Y399-W433 AromaticContact CZ-CG 3.54Å; Y399-W433 WeakPolarHBondContact OH-CB 3.27Å; Y399-W433 PolarHBondContact OH-O 2.88Å; F417-W433 HydrophobicContact CD1-CH2 4.15Å; F417-W433 HydrophobicContact CD1-CZ3 4.44Å; F417-W433 AromaticContact CE1-CH2 3.38Å; F417-W433 HydrophobicContact CE1-CH2 3.38Å; F417-W433 AromaticContact CE1-CZ3 3.59Å; F417-W433 HydrophobicContact CE1-CZ3 3.59Å; F417-W433 HydrophobicContact CE2-CH2 4.48Å; F417-W433 AromaticContact CZ-CH2 3.57Å; F417-W433 HydrophobicContact CZ-CH2 3.57Å; F417-W433 HydrophobicContact CZ-CZ2 4.48Å; F417-W433 HydrophobicContact CZ-CZ3 4.09Å; W428-W433 AromaticContact CE2-CE2 3.88Å; W428-W433 AromaticContact CE2-CH2 3.78Å; W428-W433 AromaticContact CE2-CZ2 3.53Å; W428-W433 HydrophobicContact CH2-CZ2 4.39Å; W428-W433 AromaticContact CZ2-CE2 3.77Å; W428-W433 AromaticContact CZ2-CH2 3.96Å; W428-W433 HydrophobicContact CZ2-CH2 3.96Å; W428-W433 AromaticContact CZ2-CZ2 3.32Å; W428-W433 HydrophobicContact CZ2-CZ2 3.32Å; W428-W433 AromaticContact NE1-CD2 3.58Å; W428-W433 AromaticContact NE1-CE2 3.43Å; W428-W433 AromaticContact NE1-CE3 3.64Å; W428-W433 AromaticContact NE1-CH2 3.49Å; W428-W433 AromaticContact NE1-CZ2 3.41Å; W428-W433 AromaticContact NE1-CZ3 3.6Å; W430-W433 HydrophobicContact CE3-CE3 4.18Å; W430-W433 HydrophobicContact CE3-CZ3 4.41Å; W430-W433 HydrophobicContact CZ3-CE3 4.19Å; W430-W433 HydrophobicContact CZ3-CZ3 4.02Å; W430-W433 PolarHBondContact O-N 2.94Å; D431-W433 PolarHBondContact O-N 3.03Å; W433-D435 VanDerWaalsContact C-OD1 3.3Å; W433-D435 WeakPolarHBondContact CA-OD1 3.38Å; W433-D435 PolarHBondContact O-N 3.38Å; W433-D435 VanDerWaalsContact O-N 3.13Å; W433-C436 PolarHBondContact O-N 3.2Å; W433-C436 PolarHBondContact O-SG 2.68Å; W433-F448 AromaticContact CH2-CE1 3.88Å; W433-F448 HydrophobicContact CH2-CE1 3.88Å; W433-F448 HydrophobicContact CZ3-CD1 4.45Å; W433-F448 AromaticContact CZ3-CE1 3.84Å; W433-F448 HydrophobicContact CZ3-CE1 3.84Å; W433-V449 HydrophobicContact CE3-CG2 3.97Å; W433-V449 HydrophobicContact CZ3-CG2 4.48Å
434	A	97.6	Very high	97	Very high	41 Å²	41	68.1 Å²	68.1	34%	0.339	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-64	-14.9	-179.9	0	0	0	0	0	113.4	D431 C436 L437	D431-A434 VanDerWaalsContact O-CB 3.29Å; D431-A434 WeakPolarHBondContact O-CB 3.27Å; D431-A434 PolarHBondContact O-N 2.96Å; A434-C436 PolarHBondContact O-N 3.16Å; A434-L437 HydrophobicContact CB-CD1 4.3Å; A434-L437 WeakPolarHBondContact O-CB 3.19Å; A434-L437 PolarHBondContact O-N 3.33Å
435	D	97.4	Very high	97.1	Very high	55 Å²	55	65.7 Å²	65.7	29%	0.294	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-58.6	-34.3	175	66.2	-51.5	0	0	0	112.2	Y399 W433 L437 T438 K445	Y399-D435 PolarHBondContact OH-OD1 2.85Å; W433-D435 VanDerWaalsContact C-OD1 3.3Å; W433-D435 WeakPolarHBondContact CA-OD1 3.38Å; W433-D435 PolarHBondContact O-N 3.38Å; W433-D435 VanDerWaalsContact O-N 3.13Å; D435-L437 PolarHBondContact O-N 3.4Å; D435-T438 PolarHBondContact O-N 3.32Å; D435-T438 PolarHBondContact O-OG1 3.38Å; D435-K445 WeakPolarHBondContact OD2-CD 3.36Å; D435-K445 IonicContact OD2-NZ 2.73Å; D435-K445 PolarHBondContact OD2-NZ 2.88Å
436	C	97.8	Very high	97.1	Very high	1 Å²	1	61 Å²	61	1%	0.007	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-65.5	-22.8	178.8	72.1	0	0	0	0	114.8	Y399 W433 A434 T438 L439 K445 P446	Y399-C436 VanDerWaalsContact OH-CB 3.32Å; Y399-C436 WeakPolarHBondContact OH-CB 3.28Å; W433-C436 PolarHBondContact O-N 3.2Å; W433-C436 PolarHBondContact O-SG 2.68Å; A434-C436 PolarHBondContact O-N 3.16Å; C436-T438 PolarHBondContact O-N 3.27Å; C436-L439 PolarHBondContact O-N 3.43Å; C436-L439 VanDerWaalsContact O-N 3.16Å; C436-K445 HydrophobicContact CB-CB 3.85Å; C436-P446 HydrophobicContact CB-CB 4.1Å; C436-P446 HydrophobicContact CB-CG 4.49Å
437	L	97.1	Very high	97.2	Very high	64 Å²	64	62.2 Å²	62.2	34%	0.335	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-68.9	-17.8	-176.8	-57.9	177.7	0	0	0	112.9	A434 D435 F473 L476	A434-L437 HydrophobicContact CB-CD1 4.3Å; A434-L437 WeakPolarHBondContact O-CB 3.19Å; A434-L437 PolarHBondContact O-N 3.33Å; D435-L437 PolarHBondContact O-N 3.4Å; L437-F473 HydrophobicContact CD1-CD2 4.08Å; L437-F473 HydrophobicContact CD1-CE2 3.84Å; L437-F473 HydrophobicContact CD1-CZ 4.19Å; L437-F473 HydrophobicContact CD2-CD1 3.98Å; L437-F473 HydrophobicContact CD2-CD2 4.34Å; L437-F473 HydrophobicContact CD2-CE1 4.07Å; L437-F473 HydrophobicContact CD2-CE2 4.44Å; L437-F473 HydrophobicContact CD2-CG 4.1Å; L437-F473 HydrophobicContact CD2-CZ 4.29Å; L437-F473 HydrophobicContact CG-CE1 4.49Å; L437-F473 HydrophobicContact CG-CE2 4.39Å; L437-F473 HydrophobicContact CG-CZ 4.27Å; L437-L476 HydrophobicContact CD2-CD1 3.75Å; L437-L476 HydrophobicContact CD2-CG 4.39Å
438	T	96.1	Very high	97.3	Very high	126 Å²	126	53.2 Å²	53.2	77%	0.773	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-98.3	-2.7	178.8	65.7	0	0	0	0	113.2	D435 C436	D435-T438 PolarHBondContact O-N 3.32Å; D435-T438 PolarHBondContact O-OG1 3.38Å; C436-T438 PolarHBondContact O-N 3.27Å
439	L	96.7	Very high	97.3	Very high	73 Å²	73	50.7 Å²	50.7	38%	0.382	28%	0.276	S	S	.	.	S	Bend	trans	-94.8	161.1	-178.7	-57.1	-180	0	0	0	111.2	C436 L441 K443 K445 P446	C436-L439 PolarHBondContact O-N 3.43Å; C436-L439 VanDerWaalsContact O-N 3.16Å; L439-L441 PolarHBondContact O-N 3.18Å; L439-K443 HydrophobicContact CB-CB 4.48Å; L439-K445 HydrophobicContact CD1-CB 4.34Å; L439-K445 HydrophobicContact CD1-CD 4.28Å; L439-P446 HydrophobicContact CB-CG 4.22Å
440	D	95.4	Very high	97.3	Very high	102 Å²	102	51.4 Å²	51.4	55%	0.545	27%	0.272	S	S	.	.			trans	-58.4	133.7	166.4	-177.7	-37.7	0	0	0	110	E442 K443 P446	D440-E442 PolarHBondContact O-N 3.49Å; D440-E442 VanDerWaalsContact O-N 3.15Å; D440-E442 PolarHBondContact OD1-N 3.19Å; D440-K443 HydrophobicContact CB-CG 3.98Å; D440-K443 VanDerWaalsContact O-CB 3.25Å; D440-K443 WeakPolarHBondContact O-CB 3.27Å; D440-K443 PolarHBondContact O-N 3.38Å; D440-P446 WeakPolarHBondContact O-CG 3.24Å
441	L	95.1	Very high	97.4	Very high	87 Å²	87	51.2 Å²	51.2	46%	0.455	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-22.8	-176.7	-65.5	179.5	0	0	0	114	L439 K443 P446 L476	L439-L441 PolarHBondContact O-N 3.18Å; L441-K443 VanDerWaalsContact C-N 3.31Å; L441-P446 HydrophobicContact CD2-CB 4.34Å; L441-L476 HydrophobicContact CD2-CD2 3.57Å
442	E	94.6	Very high	97.5	Very high	80 Å²	80	46.3 Å²	46.3	37%	0.374	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-8.1	175.6	-66.8	-58.8	132.7	0	0	112.9	D440 T633 P747	D440-E442 PolarHBondContact O-N 3.49Å; D440-E442 VanDerWaalsContact O-N 3.15Å; D440-E442 PolarHBondContact OD1-N 3.19Å; E442-T633 PolarHBondContact OE2-OG1 3.48Å; E442-P747 HydrophobicContact CB-CB 4.05Å; E442-P747 HydrophobicContact CB-CG 4.46Å; E442-P747 WeakPolarHBondContact O-CB 3.45Å
443	K	96.6	Very high	97.5	Very high	91 Å²	91	41.9 Å²	41.9	40%	0.396	22%	0.221	S	C	.	.	S	Bend	trans	-69.7	154	174.4	-68.5	-76.8	-178	178.4	0	111.2	L439 D440 L441 K445 P446 K447 P747	L439-K443 HydrophobicContact CB-CB 4.48Å; D440-K443 HydrophobicContact CB-CG 3.98Å; D440-K443 VanDerWaalsContact O-CB 3.25Å; D440-K443 WeakPolarHBondContact O-CB 3.27Å; D440-K443 PolarHBondContact O-N 3.38Å; L441-K443 VanDerWaalsContact C-N 3.31Å; K443-K445 PolarHBondContact O-N 3.01Å; K443-P446 HydrophobicContact CB-CG 4.2Å; K443-P446 VanDerWaalsContact O-CD 3.25Å; K443-P446 WeakPolarHBondContact O-CD 3.41Å; K443-P446 WeakPolarHBondContact O-CG 3.35Å; K443-K447 WeakPolarHBondContact O-CB 3.4Å; K443-K447 PolarHBondContact O-N 2.99Å; K443-K447 VanDerWaalsContact O-N 3.17Å; K443-P747 HydrophobicContact CD-CG 4.2Å
444	P	97.9	Very high	97.6	Very high	20 Å²	20	42.1 Å²	42.1	13%	0.13	22%	0.222	C	C	.	.	H	α-helix	trans	-56.4	-41.8	-171.2	-32.2	41.4	0	0	0	115.2	L402 F448	L402-P444 HydrophobicContact CB-CB 3.99Å; P444-F448 WeakPolarHBondContact O-CB 3.22Å; P444-F448 PolarHBondContact O-N 2.91Å
445	K	98.6	Very high	97.6	Very high	19 Å²	19	41.2 Å²	41.2	8%	0.083	21%	0.211	C	C	.	.	H	α-helix	trans	-64.3	-58.5	-178.6	-70.1	-178.8	170.7	-174	0	114.5	Y399 M400 L402 D435 C436 L439 K443 K447 F448 V449	Y399-K445 HydrophobicContact CE1-CD 3.99Å; Y399-K445 HydrophobicContact CE1-CG 4.36Å; Y399-K445 HydrophobicContact CE2-CB 4.11Å; Y399-K445 HydrophobicContact CE2-CG 4.16Å; M400-K445 PolarHBondContact SD-NZ 3.32Å; M400-K445 VanDerWaalsContact SD-NZ 3.4Å; L402-K445 HydrophobicContact CB-CG 4.31Å; L402-K445 HydrophobicContact CD1-CG 4.21Å; D435-K445 WeakPolarHBondContact OD2-CD 3.36Å; D435-K445 IonicContact OD2-NZ 2.73Å; D435-K445 PolarHBondContact OD2-NZ 2.88Å; C436-K445 HydrophobicContact CB-CB 3.85Å; L439-K445 HydrophobicContact CD1-CB 4.34Å; L439-K445 HydrophobicContact CD1-CD 4.28Å; K443-K445 PolarHBondContact O-N 3.01Å; K445-K447 VanDerWaalsContact C-N 3.29Å; K445-K447 PolarHBondContact O-N 2.96Å; K445-F448 WeakPolarHBondContact O-CB 3.27Å; K445-F448 PolarHBondContact O-N 3.14Å; K445-V449 PolarHBondContact O-N 3.24Å; K445-V449 VanDerWaalsContact O-N 3.12Å
446	P	98.3	Very high	97.7	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.006	20%	0.197	C	C	.	.	H	α-helix	trans	-64	-36.6	178.6	23.1	-32.3	0	0	0	111.9	C436 L439 D440 L441 K443 V449 K450 L476	C436-P446 HydrophobicContact CB-CB 4.1Å; C436-P446 HydrophobicContact CB-CG 4.49Å; L439-P446 HydrophobicContact CB-CG 4.22Å; D440-P446 WeakPolarHBondContact O-CG 3.24Å; L441-P446 HydrophobicContact CD2-CB 4.34Å; K443-P446 HydrophobicContact CB-CG 4.2Å; K443-P446 VanDerWaalsContact O-CD 3.25Å; K443-P446 WeakPolarHBondContact O-CD 3.41Å; K443-P446 WeakPolarHBondContact O-CG 3.35Å; P446-V449 PolarHBondContact O-N 3.45Å; P446-K450 WeakPolarHBondContact O-CB 3.32Å; P446-K450 PolarHBondContact O-N 3.39Å; P446-L476 HydrophobicContact CB-CD2 4.22Å
447	K	98.4	Very high	97.7	Very high	34 Å²	34	39.4 Å²	39.4	15%	0.148	20%	0.201	C	C	.	.	H	α-helix	trans	-60.7	-45.2	174.5	-172.2	176.5	-179.1	68.7	0	112	K443 K445 V449 K450 E451 T633	K443-K447 WeakPolarHBondContact O-CB 3.4Å; K443-K447 PolarHBondContact O-N 2.99Å; K443-K447 VanDerWaalsContact O-N 3.17Å; K445-K447 VanDerWaalsContact C-N 3.29Å; K445-K447 PolarHBondContact O-N 2.96Å; K447-V449 PolarHBondContact O-N 3.49Å; K447-K450 PolarHBondContact O-N 3.28Å; K447-E451 HydrophobicContact CG-CG 4.46Å; K447-E451 VanDerWaalsContact O-CG 3.26Å; K447-E451 WeakPolarHBondContact O-CG 3.49Å; K447-E451 PolarHBondContact O-N 2.88Å; K447-T633 WeakPolarHBondContact CE-O 3.24Å; K447-T633 PolarHBondContact NZ-O 3.45Å; K447-T633 PolarHBondContact NZ-OG1 3.05Å
448	F	98.8	Very high	97.8	Very high	1 Å²	1	38.8 Å²	38.8	0%	0.004	19%	0.194	C	C	.	.	H	α-helix	trans	-57.3	-49.3	175.4	171.8	-96.9	0	0	0	111.5	Y399 L402 I410 F413 I414 F417 W433 P444 K445 K450 E451 V452	Y399-F448 AromaticContact CD2-CD1 3.98Å; Y399-F448 HydrophobicContact CD2-CD1 3.98Å; Y399-F448 HydrophobicContact CD2-CE1 4.21Å; Y399-F448 HydrophobicContact CE2-CD1 4.37Å; L402-F448 HydrophobicContact CD1-CB 3.59Å; L402-F448 HydrophobicContact CD1-CD1 3.83Å; L402-F448 HydrophobicContact CD1-CD2 4.18Å; L402-F448 HydrophobicContact CD1-CG 3.6Å; L402-F448 HydrophobicContact CD2-CD2 4.16Å; L402-F448 HydrophobicContact CD2-CG 4.37Å; I410-F448 HydrophobicContact CG2-CD2 4.37Å; F413-F448 HydrophobicContact CB-CE2 4.17Å; F413-F448 AromaticContact CD1-CD2 3.92Å; F413-F448 HydrophobicContact CD1-CD2 3.92Å; F413-F448 HydrophobicContact CD1-CE1 4.49Å; F413-F448 AromaticContact CD1-CE2 3.14Å; F413-F448 HydrophobicContact CD1-CE2 3.14Å; F413-F448 AromaticContact CD1-CZ 3.49Å; F413-F448 HydrophobicContact CD1-CZ 3.49Å; F413-F448 VanDerWaalsContact CD1-CZ 3.49Å; F413-F448 HydrophobicContact CD2-CE2 4.41Å; F413-F448 HydrophobicContact CD2-CZ 4.39Å; F413-F448 HydrophobicContact CE1-CD2 4.27Å; F413-F448 AromaticContact CE1-CE1 3.98Å; F413-F448 HydrophobicContact CE1-CE1 3.98Å; F413-F448 AromaticContact CE1-CE2 3.46Å; F413-F448 HydrophobicContact CE1-CE2 3.46Å; F413-F448 VanDerWaalsContact CE1-CE2 3.46Å; F413-F448 AromaticContact CE1-CZ 3.27Å; F413-F448 HydrophobicContact CE1-CZ 3.27Å; F413-F448 HydrophobicContact CE2-CZ 4.24Å; F413-F448 AromaticContact CG-CE2 3.65Å; F413-F448 HydrophobicContact CG-CE2 3.65Å; F413-F448 HydrophobicContact CG-CZ 4.04Å; F413-F448 HydrophobicContact CZ-CE1 4.38Å; F413-F448 HydrophobicContact CZ-CE2 4.21Å; F413-F448 AromaticContact CZ-CZ 3.66Å; F413-F448 HydrophobicContact CZ-CZ 3.66Å; I414-F448 HydrophobicContact CB-CE2 4.46Å; I414-F448 HydrophobicContact CD1-CD2 4.28Å; I414-F448 HydrophobicContact CG1-CD2 3.45Å; I414-F448 VanDerWaalsContact CG1-CD2 3.45Å; I414-F448 HydrophobicContact CG1-CE2 3.67Å; I414-F448 HydrophobicContact CG1-CG 4.46Å; F417-F448 HydrophobicContact CB-CZ 4.42Å; F417-F448 HydrophobicContact CD1-CE1 4.25Å; F417-F448 HydrophobicContact CD1-CZ 4Å; F417-F448 HydrophobicContact CG-CZ 4.5Å; W433-F448 AromaticContact CH2-CE1 3.88Å; W433-F448 HydrophobicContact CH2-CE1 3.88Å; W433-F448 HydrophobicContact CZ3-CD1 4.45Å; W433-F448 AromaticContact CZ3-CE1 3.84Å; W433-F448 HydrophobicContact CZ3-CE1 3.84Å; P444-F448 WeakPolarHBondContact O-CB 3.22Å; P444-F448 PolarHBondContact O-N 2.91Å; K445-F448 WeakPolarHBondContact O-CB 3.27Å; K445-F448 PolarHBondContact O-N 3.14Å; F448-K450 PolarHBondContact O-N 2.91Å; F448-E451 PolarHBondContact O-N 3.41Å; F448-V452 HydrophobicContact CD1-CG2 4.22Å; F448-V452 HydrophobicContact CD2-CG2 4.22Å; F448-V452 HydrophobicContact CE1-CG2 3.84Å; F448-V452 HydrophobicContact CE2-CG2 3.81Å; F448-V452 HydrophobicContact CG-CG2 4.41Å; F448-V452 HydrophobicContact CZ-CG2 3.61Å; F448-V452 WeakPolarHBondContact O-CB 3.43Å; F448-V452 VanDerWaalsContact O-CG2 3.27Å; F448-V452 WeakPolarHBondContact O-CG2 3.34Å; F448-V452 PolarHBondContact O-N 2.74Å
449	V	98.8	Very high	97.9	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.4	-46.7	178.9	175.2	0	0	0	0	111	Y399 W430 W433 K445 P446 K447 E451 V452 L453 F473 L476	Y399-V449 HydrophobicContact CE2-CG2 4.1Å; W430-V449 HydrophobicContact CZ3-CG1 4.26Å; W433-V449 HydrophobicContact CE3-CG2 3.97Å; W433-V449 HydrophobicContact CZ3-CG2 4.48Å; K445-V449 PolarHBondContact O-N 3.24Å; K445-V449 VanDerWaalsContact O-N 3.12Å; P446-V449 PolarHBondContact O-N 3.45Å; K447-V449 PolarHBondContact O-N 3.49Å; V449-E451 PolarHBondContact O-N 2.88Å; V449-V452 PolarHBondContact O-N 3.42Å; V449-L453 HydrophobicContact CG1-CD1 3.97Å; V449-L453 HydrophobicContact CG1-CG 4.29Å; V449-L453 VanDerWaalsContact O-CG 3.31Å; V449-L453 WeakPolarHBondContact O-CG 3.33Å; V449-L453 PolarHBondContact O-N 3.12Å; V449-F473 HydrophobicContact CG1-CD1 4.12Å; V449-F473 HydrophobicContact CG1-CE1 4.29Å; V449-L476 HydrophobicContact CB-CD1 4.17Å; V449-L476 HydrophobicContact CG1-CB 4.43Å; V449-L476 HydrophobicContact CG1-CD1 3.84Å
450	K	98.4	Very high	97.9	Very high	74 Å²	74	35.4 Å²	35.4	32%	0.322	17%	0.174	S	C	.	.	H	α-helix	trans	-57.5	-46.5	177.9	-174.5	177	-179.4	-179.9	0	112.1	P446 K447 F448 L453 E454	P446-K450 WeakPolarHBondContact O-CB 3.32Å; P446-K450 PolarHBondContact O-N 3.39Å; K447-K450 PolarHBondContact O-N 3.28Å; F448-K450 PolarHBondContact O-N 2.91Å; K450-L453 PolarHBondContact O-N 3.32Å; K450-E454 PolarHBondContact O-N 3.18Å
451	E	98.8	Very high	98.1	Very high	7 Å²	7	37.1 Å²	37.1	3%	0.033	17%	0.173	C	C	.	.	H	α-helix	trans	-69.1	-37	179.2	-65.9	-73.8	-176.7	0	0	112.3	I414 K447 F448 V449 E454 K455 R634 L635	I414-E451 HydrophobicContact CD1-CB 3.69Å; I414-E451 HydrophobicContact CD1-CG 4.23Å; I414-E451 HydrophobicContact CG1-CB 4.24Å; I414-E451 HydrophobicContact CG2-CB 4.01Å; K447-E451 HydrophobicContact CG-CG 4.46Å; K447-E451 VanDerWaalsContact O-CG 3.26Å; K447-E451 WeakPolarHBondContact O-CG 3.49Å; K447-E451 PolarHBondContact O-N 2.88Å; F448-E451 PolarHBondContact O-N 3.41Å; V449-E451 PolarHBondContact O-N 2.88Å; E451-E454 PolarHBondContact O-N 2.77Å; E451-K455 WeakPolarHBondContact O-CG 3.15Å; E451-K455 PolarHBondContact O-N 3.1Å; E451-R634 VanDerWaalsContact OE1-CA 3.23Å; E451-R634 WeakPolarHBondContact OE1-CA 3.14Å; E451-R634 WeakPolarHBondContact OE1-CB 3.46Å; E451-L635 PolarHBondContact OE1-N 3.08Å; E451-L635 WeakPolarHBondContact OE2-CB 3.3Å
452	V	98.9	Very high	98.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.9	-47.7	173.1	166.9	0	0	0	0	110.7	I414 F417 L421 W430 F448 V449 E454 K455 S456	I414-V452 HydrophobicContact CB-CG2 4.34Å; I414-V452 HydrophobicContact CG1-CG2 4.22Å; I414-V452 HydrophobicContact CG2-CG2 4.17Å; F417-V452 HydrophobicContact CD1-CB 4.49Å; F417-V452 HydrophobicContact CD1-CG1 3.69Å; F417-V452 HydrophobicContact CD1-CG2 3.97Å; F417-V452 HydrophobicContact CE1-CG1 4.05Å; L421-V452 HydrophobicContact CD1-CG1 4.26Å; W430-V452 HydrophobicContact CH2-CG1 4.07Å; F448-V452 HydrophobicContact CD1-CG2 4.22Å; F448-V452 HydrophobicContact CD2-CG2 4.22Å; F448-V452 HydrophobicContact CE1-CG2 3.84Å; F448-V452 HydrophobicContact CE2-CG2 3.81Å; F448-V452 HydrophobicContact CG-CG2 4.41Å; F448-V452 HydrophobicContact CZ-CG2 3.61Å; F448-V452 WeakPolarHBondContact O-CB 3.43Å; F448-V452 VanDerWaalsContact O-CG2 3.27Å; F448-V452 WeakPolarHBondContact O-CG2 3.34Å; F448-V452 PolarHBondContact O-N 2.74Å; V449-V452 PolarHBondContact O-N 3.42Å; V452-E454 VanDerWaalsContact C-N 3.32Å; V452-E454 PolarHBondContact O-N 3.36Å; V452-K455 PolarHBondContact O-N 3.36Å; V452-S456 WeakPolarHBondContact O-CB 3.4Å; V452-S456 PolarHBondContact O-N 3.03Å; V452-S456 PolarHBondContact O-OG 2.77Å; V452-S456 VanDerWaalsContact O-OG 3.13Å
453	L	98.7	Very high	98.4	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-63.9	-37.9	178.6	-67	177.3	0	0	0	111.6	W430 V449 K450 S456 M457 I465 V469 L476	W430-L453 HydrophobicContact CH2-CD2 3.7Å; W430-L453 HydrophobicContact CZ2-CD2 3.89Å; W430-L453 HydrophobicContact CZ3-CD2 4.22Å; V449-L453 HydrophobicContact CG1-CD1 3.97Å; V449-L453 HydrophobicContact CG1-CG 4.29Å; V449-L453 VanDerWaalsContact O-CG 3.31Å; V449-L453 WeakPolarHBondContact O-CG 3.33Å; V449-L453 PolarHBondContact O-N 3.12Å; K450-L453 PolarHBondContact O-N 3.32Å; L453-S456 PolarHBondContact O-N 3.22Å; L453-M457 WeakPolarHBondContact O-CB 3.34Å; L453-M457 PolarHBondContact O-N 3Å; L453-I465 HydrophobicContact CB-CG2 4.17Å; L453-I465 HydrophobicContact CD2-CG2 3.94Å; L453-V469 HydrophobicContact CD1-CG1 4.2Å; L453-V469 HydrophobicContact CD2-CG1 3.59Å; L453-L476 HydrophobicContact CD1-CB 4.33Å
454	E	98.7	Very high	98.4	Very high	6 Å²	6	35.6 Å²	35.6	3%	0.028	16%	0.162	C	C	.	.	H	α-helix	trans	-61.3	-46.3	172.3	-170.5	-179.6	135.8	0	0	112	K450 E451 V452 M457 R458 P478 P598 R634	K450-E454 PolarHBondContact O-N 3.18Å; E451-E454 PolarHBondContact O-N 2.77Å; V452-E454 VanDerWaalsContact C-N 3.32Å; V452-E454 PolarHBondContact O-N 3.36Å; E454-M457 WeakPolarHBondContact O-CB 3.35Å; E454-M457 PolarHBondContact O-N 3.49Å; E454-R458 WeakPolarHBondContact O-CG 3.29Å; E454-R458 PolarHBondContact O-N 2.96Å; E454-R458 VanDerWaalsContact O-N 3.1Å; E454-R458 IonicContact OE1-CZ 2.75Å; E454-R458 IonicContact OE1-NE 3.24Å; E454-R458 IonicContact OE1-NH2 2.8Å; E454-R458 PolarHBondContact OE1-NH2 3.09Å; E454-P478 HydrophobicContact CB-CB 4.15Å; E454-P478 HydrophobicContact CG-CB 4.26Å; E454-P598 WeakPolarHBondContact OE1-CG 3.34Å; E454-R634 IonicContact OE1-NH2 2.7Å; E454-R634 IonicContact OE2-CZ 2.68Å; E454-R634 IonicContact OE2-NE 3.55Å; E454-R634 IonicContact OE2-NH2 3.27Å; E454-R634 PolarHBondContact OE2-NH2 2.91Å
455	K	98.8	Very high	98.4	Very high	22 Å²	22	34.8 Å²	34.8	10%	0.096	16%	0.156	C	C	.	.	H	α-helix	trans	-63.6	-41.5	175.7	-72.7	-66.5	-170.2	162.7	0	112.5	I414 N415 S418 E451 V452 M457 R458 L459 L635 E639	I414-K455 HydrophobicContact CG2-CG 3.83Å; N415-K455 WeakPolarHBondContact OD1-CE 3.25Å; N415-K455 PolarHBondContact OD1-NZ 3.44Å; S418-K455 VanDerWaalsContact CB-CB 3.45Å; S418-K455 VanDerWaalsContact OG-CB 3.28Å; S418-K455 WeakPolarHBondContact OG-CB 3.47Å; E451-K455 WeakPolarHBondContact O-CG 3.15Å; E451-K455 PolarHBondContact O-N 3.1Å; V452-K455 PolarHBondContact O-N 3.36Å; K455-M457 VanDerWaalsContact C-N 3.3Å; K455-M457 PolarHBondContact O-N 3.3Å; K455-R458 PolarHBondContact O-N 2.99Å; K455-L459 PolarHBondContact O-N 3.38Å; K455-L635 VanDerWaalsContact CE-CD2 3.49Å; K455-E639 VanDerWaalsContact NZ-CD 3.31Å; K455-E639 IonicContact NZ-OE1 3.95Å; K455-E639 PolarHBondContact NZ-OE1 2.77Å; K455-E639 IonicContact NZ-OE2 2.93Å; K455-E639 PolarHBondContact NZ-OE2 3.49Å
456	S	98.6	Very high	98.3	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.014	17%	0.166	C	C	.	.	H	α-helix	trans	-62	-38.1	174.6	-66.7	0	0	0	0	111.7	V452 L453 L459 S460	V452-S456 WeakPolarHBondContact O-CB 3.4Å; V452-S456 PolarHBondContact O-N 3.03Å; V452-S456 PolarHBondContact O-OG 2.77Å; V452-S456 VanDerWaalsContact O-OG 3.13Å; L453-S456 PolarHBondContact O-N 3.22Å; S456-L459 CarbonylContact O-C 3.03Å; S456-L459 PolarHBondContact O-N 2.9Å; S456-S460 PolarHBondContact O-N 3.3Å
457	M	98.6	Very high	98.2	Very high	16 Å²	16	41.4 Å²	41.4	8%	0.079	19%	0.194	C	C	.	.	H	α-helix	trans	-61.9	-42.1	173.7	-171.9	179.2	67.7	0	0	111.7	L453 E454 K455 L459 S460 Y461 H462 I465 P478 P481	L453-M457 WeakPolarHBondContact O-CB 3.34Å; L453-M457 PolarHBondContact O-N 3Å; E454-M457 WeakPolarHBondContact O-CB 3.35Å; E454-M457 PolarHBondContact O-N 3.49Å; K455-M457 VanDerWaalsContact C-N 3.3Å; K455-M457 PolarHBondContact O-N 3.3Å; M457-L459 PolarHBondContact O-N 3.03Å; M457-S460 CarbonylContact O-C 3.39Å; M457-S460 WeakPolarHBondContact O-CA 3.37Å; M457-S460 PolarHBondContact O-N 3.42Å; M457-S460 VanDerWaalsContact O-O 3.12Å; M457-Y461 PolarHBondContact O-N 3.45Å; M457-H462 HydrophobicContact SD-CB 3.85Å; M457-I465 HydrophobicContact CB-CG1 3.85Å; M457-I465 HydrophobicContact CG-CG1 4.34Å; M457-P478 HydrophobicContact CB-CG 4.02Å; M457-P478 HydrophobicContact CE-CB 3.9Å; M457-P478 HydrophobicContact CE-CG 4.03Å; M457-P478 HydrophobicContact CG-CG 4.47Å; M457-P478 HydrophobicContact SD-CB 4.19Å; M457-P478 HydrophobicContact SD-CG 3.74Å; M457-P481 HydrophobicContact CE-CB 4.44Å; M457-P481 HydrophobicContact CE-CG 4.22Å; M457-P481 HydrophobicContact SD-CG 4.45Å
458	R	98.4	Very high	98	Very high	51 Å²	51	42.4 Å²	42.4	19%	0.192	20%	0.201	C	C	.	.	H	α-helix	trans	-63.1	-25.7	176.5	-64	179.9	-168.2	-177	8.3	113.1	E454 K455 Q599 E639	E454-R458 WeakPolarHBondContact O-CG 3.29Å; E454-R458 PolarHBondContact O-N 2.96Å; E454-R458 VanDerWaalsContact O-N 3.1Å; E454-R458 IonicContact OE1-CZ 2.75Å; E454-R458 IonicContact OE1-NE 3.24Å; E454-R458 IonicContact OE1-NH2 2.8Å; E454-R458 PolarHBondContact OE1-NH2 3.09Å; K455-R458 PolarHBondContact O-N 2.99Å; R458-Q599 HydrophobicContact CG-CB 4.31Å; R458-E639 IonicContact CZ-OE2 2.76Å; R458-E639 IonicContact NH1-OE2 2.66Å; R458-E639 PolarHBondContact NH1-OE2 3.16Å; R458-E639 IonicContact NH2-OE2 3.69Å
459	L	98.5	Very high	97.8	Very high	94 Å²	94	43 Å²	43	49%	0.492	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	1.6	173.3	-64.4	174	0	0	0	113	H419 F426 K455 S456 M457	H419-L459 HydrophobicContact CB-CD1 4.43Å; F426-L459 HydrophobicContact CZ-CB 4.35Å; K455-L459 PolarHBondContact O-N 3.38Å; S456-L459 CarbonylContact O-C 3.03Å; S456-L459 PolarHBondContact O-N 2.9Å; M457-L459 PolarHBondContact O-N 3.03Å
460	S	98.1	Very high	97.7	Very high	33 Å²	33	44 Å²	44	23%	0.231	21%	0.211	C	C	.	.	S	Bend	trans	-147.1	-125.8	176.8	-161.7	0	0	0	0	111.5	S456 M457 R464	S456-S460 PolarHBondContact O-N 3.3Å; M457-S460 CarbonylContact O-C 3.39Å; M457-S460 WeakPolarHBondContact O-CA 3.37Å; M457-S460 PolarHBondContact O-N 3.42Å; M457-S460 VanDerWaalsContact O-O 3.12Å; S460-R464 WeakPolarHBondContact OG-CD 3.36Å; S460-R464 PolarHBondContact OG-NH1 2.99Å
461	Y	97.8	Very high	97.6	Very high	139 Å²	139	46.1 Å²	46.1	55%	0.545	23%	0.232	S	C	.	.			trans	-153.4	155.1	178.5	55.3	-91.2	0	0	0	109.6	M457 Q463 R464 I465	M457-Y461 PolarHBondContact O-N 3.45Å; Y461-Q463 HydrophobicContact CD2-CB 4.06Å; Y461-Q463 HydrophobicContact CE2-CB 4.08Å; Y461-Q463 PolarHBondContact O-N 3.2Å; Y461-R464 HydrophobicContact CD1-CB 4.32Å; Y461-R464 HydrophobicContact CD2-CB 3.89Å; Y461-R464 HydrophobicContact CE1-CB 4.04Å; Y461-R464 HydrophobicContact CE2-CB 3.58Å; Y461-R464 HydrophobicContact CG-CB 4.24Å; Y461-R464 WeakPolarHBondContact O-CB 3.33Å; Y461-R464 PolarHBondContact O-N 3.42Å; Y461-R464 VanDerWaalsContact O-N 3.11Å; Y461-I465 PolarHBondContact O-N 3.08Å
462	H	98.3	Very high	97.5	Very high	40 Å²	40	50 Å²	50	19%	0.185	26%	0.256	C	S	.	.	H	α-helix	trans	-50	-55.6	-171.1	177.2	-99.5	0	0	0	113.4	M457 R464 I465 V466 P478 E480	M457-H462 HydrophobicContact SD-CB 3.85Å; H462-R464 PolarHBondContact O-N 3.16Å; H462-R464 VanDerWaalsContact O-N 3.17Å; H462-I465 PolarHBondContact O-N 3.39Å; H462-V466 PolarHBondContact O-N 2.79Å; H462-V466 VanDerWaalsContact O-N 3.07Å; H462-P478 PolarHBondContact CD2-O 3.43Å; H462-P478 VanDerWaalsContact CD2-O 3.24Å; H462-P478 PolarHBondContact NE2-O 2.99Å; H462-E480 HydrophobicContact CB-CG 4.26Å
463	Q	98	Very high	97.4	Very high	101 Å²	101	50 Å²	50	47%	0.472	26%	0.256	S	S	.	.	H	α-helix	trans	-56.7	-37.2	-177.8	-171.8	61.1	49.4	0	0	112.9	Y461 I465 V466 D467	Y461-Q463 HydrophobicContact CD2-CB 4.06Å; Y461-Q463 HydrophobicContact CE2-CB 4.08Å; Y461-Q463 PolarHBondContact O-N 3.2Å; Q463-I465 VanDerWaalsContact C-N 3.32Å; Q463-I465 PolarHBondContact O-N 3.3Å; Q463-V466 WeakPolarHBondContact O-CB 3.42Å; Q463-V466 PolarHBondContact O-N 3.07Å; Q463-D467 PolarHBondContact NE2-OD1 3.22Å; Q463-D467 PolarHBondContact O-N 3.23Å
464	R	97.5	Very high	97.2	Very high	85 Å²	85	53.4 Å²	53.4	32%	0.321	28%	0.281	S	S	.	.	H	α-helix	trans	-62.6	-41.9	177.6	-161.3	-173.4	-177.3	164.1	-2.8	111.5	S460 Y461 H462 V466 D467 L468	S460-R464 WeakPolarHBondContact OG-CD 3.36Å; S460-R464 PolarHBondContact OG-NH1 2.99Å; Y461-R464 HydrophobicContact CD1-CB 4.32Å; Y461-R464 HydrophobicContact CD2-CB 3.89Å; Y461-R464 HydrophobicContact CE1-CB 4.04Å; Y461-R464 HydrophobicContact CE2-CB 3.58Å; Y461-R464 HydrophobicContact CG-CB 4.24Å; Y461-R464 WeakPolarHBondContact O-CB 3.33Å; Y461-R464 PolarHBondContact O-N 3.42Å; Y461-R464 VanDerWaalsContact O-N 3.11Å; H462-R464 PolarHBondContact O-N 3.16Å; H462-R464 VanDerWaalsContact O-N 3.17Å; R464-V466 VanDerWaalsContact C-N 3.33Å; R464-D467 PolarHBondContact O-N 3.03Å; R464-L468 HydrophobicContact CG-CD1 3.91Å; R464-L468 HydrophobicContact CG-CG 4.4Å; R464-L468 WeakPolarHBondContact O-CB 3.42Å; R464-L468 VanDerWaalsContact O-CD1 3.26Å; R464-L468 WeakPolarHBondContact O-CD1 3.49Å; R464-L468 WeakPolarHBondContact O-CG 3.25Å; R464-L468 PolarHBondContact O-N 3.33Å; R464-L468 VanDerWaalsContact O-N 3.13Å
465	I	97.5	Very high	97	Very high	2 Å²	2	57 Å²	57	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-66.7	-39.9	179.6	-56.9	-51.5	0	0	0	110.3	L453 M457 Y461 H462 Q463 D467 L468	L453-I465 HydrophobicContact CB-CG2 4.17Å; L453-I465 HydrophobicContact CD2-CG2 3.94Å; M457-I465 HydrophobicContact CB-CG1 3.85Å; M457-I465 HydrophobicContact CG-CG1 4.34Å; Y461-I465 PolarHBondContact O-N 3.08Å; H462-I465 PolarHBondContact O-N 3.39Å; Q463-I465 VanDerWaalsContact C-N 3.32Å; Q463-I465 PolarHBondContact O-N 3.3Å; I465-D467 VanDerWaalsContact C-N 3.29Å; I465-D467 PolarHBondContact O-N 2.98Å; I465-L468 HydrophobicContact CD1-CD1 4.13Å; I465-L468 PolarHBondContact O-N 2.85Å
466	V	97.1	Very high	96.9	Very high	47 Å²	47	56 Å²	56	29%	0.285	31%	0.307	S	S	.	.	H	α-helix	trans	-56.2	-44.7	172.5	177	0	0	0	0	111.6	H462 Q463 R464 L468 I477	H462-V466 PolarHBondContact O-N 2.79Å; H462-V466 VanDerWaalsContact O-N 3.07Å; Q463-V466 WeakPolarHBondContact O-CB 3.42Å; Q463-V466 PolarHBondContact O-N 3.07Å; R464-V466 VanDerWaalsContact C-N 3.33Å; V466-L468 VanDerWaalsContact C-N 3.31Å; V466-L468 PolarHBondContact O-N 2.86Å; V466-I477 HydrophobicContact CB-CD1 4.41Å; V466-I477 HydrophobicContact CG1-CD1 4.46Å; V466-I477 HydrophobicContact CG2-CD1 4.19Å; V466-I477 HydrophobicContact CG2-CG2 3.96Å
467	D	96	Very high	96.8	Very high	113 Å²	113	57.4 Å²	57.4	60%	0.604	31%	0.314	S	S	*	.	H	α-helix	trans	-74.8	-18.2	-177.4	-59.8	-22.3	0	0	0	113.7	Q463 R464 I465	Q463-D467 PolarHBondContact NE2-OD1 3.22Å; Q463-D467 PolarHBondContact O-N 3.23Å; R464-D467 PolarHBondContact O-N 3.03Å; I465-D467 VanDerWaalsContact C-N 3.29Å; I465-D467 PolarHBondContact O-N 2.98Å
468	L	92.8	Very high	96.7	Very high	54 Å²	54	57 Å²	57	28%	0.283	31%	0.313	S	S	.	.	H	α-helix	trans	-88.8	-23.3	-174.3	-78.4	164.7	0	0	0	114.1	F426 R464 I465 V466	F426-L468 HydrophobicContact CB-CD1 3.41Å; F426-L468 VanDerWaalsContact CB-CD1 3.41Å; F426-L468 HydrophobicContact CB-CD2 4.09Å; F426-L468 HydrophobicContact CB-CG 4.35Å; F426-L468 HydrophobicContact CD2-CD1 4Å; F426-L468 HydrophobicContact CG-CD1 3.86Å; R464-L468 HydrophobicContact CG-CD1 3.91Å; R464-L468 HydrophobicContact CG-CG 4.4Å; R464-L468 WeakPolarHBondContact O-CB 3.42Å; R464-L468 VanDerWaalsContact O-CD1 3.26Å; R464-L468 WeakPolarHBondContact O-CD1 3.49Å; R464-L468 WeakPolarHBondContact O-CG 3.25Å; R464-L468 PolarHBondContact O-N 3.33Å; R464-L468 VanDerWaalsContact O-N 3.13Å; I465-L468 HydrophobicContact CD1-CD1 4.13Å; I465-L468 PolarHBondContact O-N 2.85Å; V466-L468 VanDerWaalsContact C-N 3.31Å; V466-L468 PolarHBondContact O-N 2.86Å
469	V	95.3	Very high	96.5	Very high	13 Å²	13	57.2 Å²	57.2	8%	0.079	33%	0.325	C	S	.	.	S	Bend	trans	-103	150.4	-176.4	-60.7	0	0	0	0	111.3	W430 L453 F473 I477	W430-V469 HydrophobicContact CD2-CG1 4.23Å; W430-V469 HydrophobicContact CG-CG1 4.37Å; W430-V469 HydrophobicContact CZ2-CG1 4.48Å; L453-V469 HydrophobicContact CD1-CG1 4.2Å; L453-V469 HydrophobicContact CD2-CG1 3.59Å; V469-F473 HydrophobicContact CB-CB 4.11Å; V469-F473 HydrophobicContact CG2-CB 4.21Å; V469-I477 HydrophobicContact CG2-CD1 3.66Å; V469-I477 HydrophobicContact CG2-CG1 3.83Å
470	P	96.4	Very high	96.5	Very high	23 Å²	23	58.1 Å²	58.1	15%	0.149	33%	0.327	C	S	.	.			trans	-59.1	149.7	173.2	-21.9	32.1	0	0	0	111.8	W430 D431 T472 F473	W430-P470 HydrophobicContact CB-CG 4Å; D431-P470 WeakPolarHBondContact OD1-CG 3.46Å; P470-T472 PolarHBondContact O-N 2.92Å; P470-F473 HydrophobicContact CB-CD2 4.08Å; P470-F473 HydrophobicContact CG-CD2 4.07Å; P470-F473 HydrophobicContact CG-CE2 4.38Å; P470-F473 WeakPolarHBondContact O-CB 3.3Å; P470-F473 PolarHBondContact O-N 2.99Å
471	P	96	Very high	96.4	Very high	117 Å²	117	58.6 Å²	58.6	76%	0.76	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-56.4	-28.3	-179	-27.6	35.3	0	0	0	114.7	F473 S474	P471-F473 PolarHBondContact O-N 2.87Å; P471-S474 VanDerWaalsContact O-CB 3.28Å; P471-S474 WeakPolarHBondContact O-CB 3.42Å; P471-S474 PolarHBondContact O-N 3.06Å; P471-S474 PolarHBondContact O-OG 3.24Å
472	T	97	Very high	96.3	Very high	88 Å²	88	56.3 Å²	56.3	54%	0.54	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-62.7	-24.1	175.7	47.7	0	0	0	0	113.2	P470 S474	P470-T472 PolarHBondContact O-N 2.92Å; T472-S474 VanDerWaalsContact C-N 3.34Å
473	F	97.5	Very high	96.1	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-87.3	1.6	177.9	-77.2	-104.9	0	0	0	113.7	W430 L437 V449 V469 P470 P471 A475 L476	W430-F473 HydrophobicContact CB-CE2 4.38Å; W430-F473 HydrophobicContact CB-CZ 4.39Å; W430-F473 WeakPolarHBondContact O-CZ 3.35Å; L437-F473 HydrophobicContact CD1-CD2 4.08Å; L437-F473 HydrophobicContact CD1-CE2 3.84Å; L437-F473 HydrophobicContact CD1-CZ 4.19Å; L437-F473 HydrophobicContact CD2-CD1 3.98Å; L437-F473 HydrophobicContact CD2-CD2 4.34Å; L437-F473 HydrophobicContact CD2-CE1 4.07Å; L437-F473 HydrophobicContact CD2-CE2 4.44Å; L437-F473 HydrophobicContact CD2-CG 4.1Å; L437-F473 HydrophobicContact CD2-CZ 4.29Å; L437-F473 HydrophobicContact CG-CE1 4.49Å; L437-F473 HydrophobicContact CG-CE2 4.39Å; L437-F473 HydrophobicContact CG-CZ 4.27Å; V449-F473 HydrophobicContact CG1-CD1 4.12Å; V449-F473 HydrophobicContact CG1-CE1 4.29Å; V469-F473 HydrophobicContact CB-CB 4.11Å; V469-F473 HydrophobicContact CG2-CB 4.21Å; P470-F473 HydrophobicContact CB-CD2 4.08Å; P470-F473 HydrophobicContact CG-CD2 4.07Å; P470-F473 HydrophobicContact CG-CE2 4.38Å; P470-F473 WeakPolarHBondContact O-CB 3.3Å; P470-F473 PolarHBondContact O-N 2.99Å; P471-F473 PolarHBondContact O-N 2.87Å; F473-A475 PolarHBondContact O-N 3Å; F473-A475 VanDerWaalsContact O-N 3.08Å; F473-L476 HydrophobicContact CD1-CD1 3.92Å; F473-L476 HydrophobicContact CE1-CD1 4.36Å; F473-L476 WeakPolarHBondContact O-CB 3.45Å; F473-L476 PolarHBondContact O-N 2.71Å
474	S	94.4	Very high	96	Very high	76 Å²	76	53.7 Å²	53.7	53%	0.531	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-51.5	-35.7	-175.6	48.1	0	0	0	0	114.8	P471 T472 L476 I477	P471-S474 VanDerWaalsContact O-CB 3.28Å; P471-S474 WeakPolarHBondContact O-CB 3.42Å; P471-S474 PolarHBondContact O-N 3.06Å; P471-S474 PolarHBondContact O-OG 3.24Å; T472-S474 VanDerWaalsContact C-N 3.34Å; S474-L476 PolarHBondContact O-N 3.13Å; S474-I477 PolarHBondContact O-N 3.39Å
475	A	94.4	Very high	95.8	Very high	80 Å²	80	51.5 Å²	51.5	66%	0.661	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-68.8	-17.4	178.1	0	0	0	0	0	114.3	F473	F473-A475 PolarHBondContact O-N 3Å; F473-A475 VanDerWaalsContact O-N 3.08Å
476	L	97.3	Very high	95.5	Very high	3 Å²	3	55.1 Å²	55.1	2%	0.016	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-96.8	-7.5	179.1	-58.1	-179.3	0	0	0	112.8	L437 L441 P446 V449 L453 F473 S474	L437-L476 HydrophobicContact CD2-CD1 3.75Å; L437-L476 HydrophobicContact CD2-CG 4.39Å; L441-L476 HydrophobicContact CD2-CD2 3.57Å; P446-L476 HydrophobicContact CB-CD2 4.22Å; V449-L476 HydrophobicContact CB-CD1 4.17Å; V449-L476 HydrophobicContact CG1-CB 4.43Å; V449-L476 HydrophobicContact CG1-CD1 3.84Å; L453-L476 HydrophobicContact CD1-CB 4.33Å; F473-L476 HydrophobicContact CD1-CD1 3.92Å; F473-L476 HydrophobicContact CE1-CD1 4.36Å; F473-L476 WeakPolarHBondContact O-CB 3.45Å; F473-L476 PolarHBondContact O-N 2.71Å; S474-L476 PolarHBondContact O-N 3.13Å
477	I	96.6	Very high	95.2	Very high	30 Å²	30	53.3 Å²	53.3	15%	0.154	32%	0.315	C	S	.	.	S	Bend	trans	-68.3	134.3	178.5	-60.2	173.7	0	0	0	109	V466 V469 S474	V466-I477 HydrophobicContact CB-CD1 4.41Å; V466-I477 HydrophobicContact CG1-CD1 4.46Å; V466-I477 HydrophobicContact CG2-CD1 4.19Å; V466-I477 HydrophobicContact CG2-CG2 3.96Å; V469-I477 HydrophobicContact CG2-CD1 3.66Å; V469-I477 HydrophobicContact CG2-CG1 3.83Å; S474-I477 PolarHBondContact O-N 3.39Å
478	P	95	Very high	94.5	Very high	9 Å²	9	50.1 Å²	50.1	6%	0.058	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-60.5	142.4	173.7	28.4	-38.2	0	0	0	110.9	E454 M457 H462	E454-P478 HydrophobicContact CB-CB 4.15Å; E454-P478 HydrophobicContact CG-CB 4.26Å; M457-P478 HydrophobicContact CB-CG 4.02Å; M457-P478 HydrophobicContact CE-CB 3.9Å; M457-P478 HydrophobicContact CE-CG 4.03Å; M457-P478 HydrophobicContact CG-CG 4.47Å; M457-P478 HydrophobicContact SD-CB 4.19Å; M457-P478 HydrophobicContact SD-CG 3.74Å; H462-P478 PolarHBondContact CD2-O 3.43Å; H462-P478 VanDerWaalsContact CD2-O 3.24Å; H462-P478 PolarHBondContact NE2-O 2.99Å
479	A	95.9	Very high	93.6	Very high	55 Å²	55	53 Å²	53	46%	0.455	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-59.1	154.1	174.9	0	0	0	0	0	111.8
480	E	97.3	Very high	91.9	Very high	112 Å²	112	61 Å²	61	52%	0.523	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-61.9	129.7	175.5	-165.6	177	-173.3	0	0	110.4	H462 I482 N596	H462-E480 HydrophobicContact CB-CG 4.26Å; E480-I482 HydrophobicContact CB-CG2 4.32Å; E480-I482 HydrophobicContact CG-CG2 3.91Å; E480-I482 PolarHBondContact O-N 3.3Å; E480-N596 WeakPolarHBondContact O-CB 3.38Å
481	P	96.8	Very high	90.2	Very high	44 Å²	44	64.5 Å²	64.5	29%	0.286	39%	0.386	S	S	.	.			trans	-78.4	68	-173.1	32.2	-36.7	0	0	0	112.3	M457 N596 H597	M457-P481 HydrophobicContact CE-CB 4.44Å; M457-P481 HydrophobicContact CE-CG 4.22Å; M457-P481 HydrophobicContact SD-CG 4.45Å; P481-N596 WeakPolarHBondContact CA-O 3.31Å; P481-H597 HydrophobicContact CB-CB 3.83Å
482	I	94.5	Very high	88.8	Confident	91 Å²	91	59 Å²	59	47%	0.467	35%	0.351	S	S	.	.			trans	-96	151.3	-179.6	61.5	172.8	0	0	0	112.5	E480	E480-I482 HydrophobicContact CB-CG2 4.32Å; E480-I482 HydrophobicContact CG-CG2 3.91Å; E480-I482 PolarHBondContact O-N 3.3Å
483	F	95.7	Very high	87.7	Confident	38 Å²	38	59.3 Å²	59.3	17%	0.167	35%	0.353	C	S	.	.			trans	-77.8	136	172.3	-175.4	-95.7	0	0	0	110.9	F485 L552 H553 A556 V593 W594	F483-F485 HydrophobicContact CD1-CB 3.9Å; F483-F485 HydrophobicContact CE1-CB 3.56Å; F483-F485 AromaticContact CE1-CD2 3.99Å; F483-F485 HydrophobicContact CE1-CD2 3.99Å; F483-F485 HydrophobicContact CE1-CG 4.06Å; F483-L552 HydrophobicContact CE2-CB 3.76Å; F483-L552 HydrophobicContact CZ-CB 4.04Å; F483-H553 HydrophobicContact CD1-CB 4.29Å; F483-H553 AromaticContact CD1-ND1 3.72Å; F483-H553 VanDerWaalsContact CE1-CA 3.47Å; F483-H553 HydrophobicContact CE1-CB 3.46Å; F483-H553 VanDerWaalsContact CE1-CB 3.46Å; F483-H553 AromaticContact CE1-CG 3.95Å; F483-H553 AromaticContact CE1-ND1 3.69Å; F483-H553 VanDerWaalsContact CZ-CA 3.46Å; F483-H553 HydrophobicContact CZ-CB 3.78Å; F483-H553 VanDerWaalsContact CZ-N 3.29Å; F483-A556 HydrophobicContact CB-CB 4.12Å; F483-A556 HydrophobicContact CD2-CB 4.1Å; F483-A556 HydrophobicContact CG-CB 4.05Å; F483-V593 HydrophobicContact CD2-CB 4.21Å; F483-V593 HydrophobicContact CD2-CG2 4.39Å; F483-V593 HydrophobicContact CE2-CB 3.52Å; F483-V593 HydrophobicContact CE2-CG1 4.33Å; F483-V593 HydrophobicContact CE2-CG2 3.59Å; F483-V593 HydrophobicContact CZ-CB 3.7Å; F483-V593 HydrophobicContact CZ-CG1 4.04Å; F483-V593 HydrophobicContact CZ-CG2 4.12Å; F483-W594 HydrophobicContact CB-CE3 4.35Å; F483-W594 HydrophobicContact CB-CH2 3.9Å; F483-W594 HydrophobicContact CB-CZ2 4.46Å; F483-W594 HydrophobicContact CB-CZ3 3.83Å; F483-W594 AromaticContact CD2-CD2 3.78Å; F483-W594 HydrophobicContact CD2-CD2 3.78Å; F483-W594 AromaticContact CD2-CE2 3.42Å; F483-W594 VanDerWaalsContact CD2-CE2 3.42Å; F483-W594 HydrophobicContact CD2-CE3 4.03Å; F483-W594 AromaticContact CD2-CH2 3.7Å; F483-W594 HydrophobicContact CD2-CH2 3.7Å; F483-W594 AromaticContact CD2-CZ2 3.38Å; F483-W594 HydrophobicContact CD2-CZ2 3.38Å; F483-W594 AromaticContact CD2-CZ3 4Å; F483-W594 HydrophobicContact CD2-CZ3 4Å; F483-W594 AromaticContact CD2-NE1 3.94Å; F483-W594 HydrophobicContact CE2-CD2 4.39Å; F483-W594 AromaticContact CE2-CE2 3.82Å; F483-W594 HydrophobicContact CE2-CZ2 4Å; F483-W594 AromaticContact CE2-NE1 3.86Å; F483-W594 HydrophobicContact CG-CH2 4.26Å; F483-W594 HydrophobicContact CG-CZ2 4.34Å; F483-W594 HydrophobicContact CG-CZ3 4.44Å
484	S	94.5	Very high	87	Confident	48 Å²	48	64.2 Å²	64.2	34%	0.336	39%	0.387	S	S	.	.			trans	-106.4	104.4	176.1	-175.6	0	0	0	0	110.4	V593	S484-V593 PolarHBondContact N-O 3.02Å; S484-V593 WeakPolarHBondContact O-CA 3.32Å
485	F	93.7	Very high	86.7	Confident	38 Å²	38	63.5 Å²	63.5	17%	0.167	38%	0.377	C	S	.	.			trans	-95.7	112	179.8	-169.4	-144.2	0	0	0	111.9	F483 Y487 G488 Q549 H553	F483-F485 HydrophobicContact CD1-CB 3.9Å; F483-F485 HydrophobicContact CE1-CB 3.56Å; F483-F485 AromaticContact CE1-CD2 3.99Å; F483-F485 HydrophobicContact CE1-CD2 3.99Å; F483-F485 HydrophobicContact CE1-CG 4.06Å; F485-Y487 AromaticContact CE2-CD2 3.85Å; F485-Y487 HydrophobicContact CE2-CD2 3.85Å; F485-Y487 HydrophobicContact CE2-CG 4.48Å; F485-Y487 HydrophobicContact CZ-CD2 4.2Å; F485-Y487 HydrophobicContact CZ-CG 4.48Å; F485-Y487 PolarHBondContact O-N 3.32Å; F485-G488 VanDerWaalsContact CD1-N 3.32Å; F485-G488 PolarHBondContact O-N 3.48Å; F485-Q549 HydrophobicContact CD2-CB 4.27Å; F485-Q549 HydrophobicContact CE2-CB 4.11Å; F485-H553 HydrophobicContact CD1-CB 4.39Å; F485-H553 AromaticContact CD1-CD2 3.77Å; F485-H553 AromaticContact CD1-CE1 3.93Å; F485-H553 AromaticContact CD1-CG 3.73Å; F485-H553 AromaticContact CD1-ND1 3.84Å; F485-H553 AromaticContact CD1-NE2 3.93Å; F485-H553 HydrophobicContact CD2-CB 3.77Å; F485-H553 AromaticContact CD2-CG 4Å; F485-H553 AromaticContact CE1-CD2 3.78Å; F485-H553 HydrophobicContact CE2-CB 3.97Å; F485-H553 HydrophobicContact CG-CB 4.01Å; F485-H553 AromaticContact CG-CG 3.72Å; F485-H553 AromaticContact CG-ND1 3.77Å; F485-H553 HydrophobicContact CZ-CB 4.38Å
486	K	91.6	Very high	86.4	Confident	79 Å²	79	64 Å²	64	34%	0.343	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-30.9	-179.2	-178.1	175	175.9	175.7	0	113.7	L495 D545	K486-L495 HydrophobicContact CG-CD1 4.08Å; K486-L495 VanDerWaalsContact O-CD1 3.25Å; K486-L495 WeakPolarHBondContact O-CD1 3.25Å; K486-D545 IonicContact NZ-OD2 3.47Å; K486-D545 PolarHBondContact NZ-OD2 2.75Å
487	Y	90.4	Very high	86	Confident	8 Å²	8	64.3 Å²	64.3	3%	0.031	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	17.8	-176.3	-48.1	-73.2	0	0	0	113.3	F485 L495 Y498 S501 V546 Q549	F485-Y487 AromaticContact CE2-CD2 3.85Å; F485-Y487 HydrophobicContact CE2-CD2 3.85Å; F485-Y487 HydrophobicContact CE2-CG 4.48Å; F485-Y487 HydrophobicContact CZ-CD2 4.2Å; F485-Y487 HydrophobicContact CZ-CG 4.48Å; F485-Y487 PolarHBondContact O-N 3.32Å; Y487-L495 HydrophobicContact CD1-CB 4.49Å; Y487-L495 HydrophobicContact CD1-CD1 4.41Å; Y487-L495 HydrophobicContact CE1-CB 4.39Å; Y487-Y498 HydrophobicContact CD1-CD2 4.19Å; Y487-Y498 WeakPolarHBondContact O-CE2 3.47Å; Y487-S501 WeakPolarHBondContact CD2-OG 3.31Å; Y487-V546 HydrophobicContact CE2-CG2 4.36Å; Y487-Q549 HydrophobicContact CD2-CB 4.38Å; Y487-Q549 HydrophobicContact CE2-CB 4.18Å
488	G	81.3	Confident	85.8	Confident	47 Å²	47	64.9 Å²	64.9	49%	0.485	38%	0.378	S	S	.	.			trans	-84.5	-31.9	-175	0	0	0	0	0	115.6	F485	F485-G488 VanDerWaalsContact CD1-N 3.32Å; F485-G488 PolarHBondContact O-N 3.48Å
489	D	73.7	Confident	85.6	Confident	115 Å²	115	68.5 Å²	68.5	62%	0.615	40%	0.401	S	S	*	.	S	Bend	trans	-89.9	151	-173.7	-67.1	-28.1	0	0	0	112.5	S491 G492	D489-S491 PolarHBondContact O-N 2.9Å; D489-G492 WeakPolarHBondContact O-CA 3.42Å; D489-G492 PolarHBondContact O-N 3.19Å
490	E	59.1	Low	85.4	Confident	179 Å²	179	67 Å²	67	84%	0.836	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-62.3	-24.8	177.3	-70	-174.9	165.8	0	0	112.9	G492 T493	E490-G492 PolarHBondContact O-N 3.21Å; E490-T493 PolarHBondContact O-OG1 2.97Å
491	S	61.6	Low	85.2	Confident	97 Å²	97	61.8 Å²	61.8	68%	0.678	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-68	-11.4	170.5	53.1	0	0	0	0	113.6	D489 T493	D489-S491 PolarHBondContact O-N 2.9Å; S491-T493 VanDerWaalsContact C-N 3.31Å; S491-T493 PolarHBondContact O-N 3.23Å
492	G	65.6	Low	85.1	Confident	3 Å²	3	63.1 Å²	63.1	3%	0.031	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-79	-6.1	-179.6	0	0	0	0	0	114.9	D489 E490 S494 L495 Y498	D489-G492 WeakPolarHBondContact O-CA 3.42Å; D489-G492 PolarHBondContact O-N 3.19Å; E490-G492 PolarHBondContact O-N 3.21Å; G492-S494 PolarHBondContact O-N 3.42Å; G492-S494 VanDerWaalsContact O-N 3.11Å; G492-L495 VanDerWaalsContact O-CB 3.31Å; G492-L495 WeakPolarHBondContact O-CB 3.45Å; G492-L495 PolarHBondContact O-N 3.45Å; G492-Y498 WeakPolarHBondContact O-CB 3.44Å; G492-Y498 WeakPolarHBondContact O-CD2 3.45Å; G492-Y498 VanDerWaalsContact O-CG 3.25Å
493	T	75.2	Confident	85.1	Confident	94 Å²	94	62.1 Å²	62.1	58%	0.577	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-59	-24.9	-178.7	49.2	0	0	0	0	113.9	E490 S491 Y498	E490-T493 PolarHBondContact O-OG1 2.97Å; S491-T493 VanDerWaalsContact C-N 3.31Å; S491-T493 PolarHBondContact O-N 3.23Å; T493-Y498 HydrophobicContact CG2-CD1 4.42Å; T493-Y498 HydrophobicContact CG2-CE1 3.78Å
494	S	82.6	Confident	85.1	Confident	103 Å²	103	60.3 Å²	60.3	72%	0.72	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-89.7	-3.4	175.6	62.5	0	0	0	0	114.5	G492	G492-S494 PolarHBondContact O-N 3.42Å; G492-S494 VanDerWaalsContact O-N 3.11Å
495	L	88.1	Confident	85.1	Confident	61 Å²	61	58.7 Å²	58.7	32%	0.319	35%	0.345	S	S	.	.	S	Bend	trans	-74.6	137.8	-179.4	-68.4	171.9	0	0	0	110.9	K486 Y487 G492 G497 Y498	K486-L495 HydrophobicContact CG-CD1 4.08Å; K486-L495 VanDerWaalsContact O-CD1 3.25Å; K486-L495 WeakPolarHBondContact O-CD1 3.25Å; Y487-L495 HydrophobicContact CD1-CB 4.49Å; Y487-L495 HydrophobicContact CD1-CD1 4.41Å; Y487-L495 HydrophobicContact CE1-CB 4.39Å; G492-L495 VanDerWaalsContact O-CB 3.31Å; G492-L495 WeakPolarHBondContact O-CB 3.45Å; G492-L495 PolarHBondContact O-N 3.45Å; L495-G497 PolarHBondContact O-N 2.96Å; L495-Y498 WeakPolarHBondContact O-CB 3.44Å; L495-Y498 PolarHBondContact O-N 3.43Å; L495-Y498 VanDerWaalsContact O-N 3.15Å
496	P	88.6	Confident	85.3	Confident	89 Å²	89	60.7 Å²	60.7	58%	0.578	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	131.9	169.7	-25.3	34.4	0	0	0	110.8	Y498 L542	P496-Y498 VanDerWaalsContact C-N 3.33Å; P496-Y498 PolarHBondContact O-N 3.4Å; P496-L542 HydrophobicContact CB-CD1 4.15Å; P496-L542 HydrophobicContact CB-CD2 4.02Å
497	G	89.1	Confident	85.5	Confident	10 Å²	10	57.5 Å²	57.5	10%	0.103	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	-3	178.7	0	0	0	0	0	116.1	L495 V500 S501	L495-G497 PolarHBondContact O-N 2.96Å; G497-V500 PolarHBondContact O-N 2.82Å; G497-V500 VanDerWaalsContact O-N 3.12Å; G497-S501 PolarHBondContact O-N 3.19Å
498	Y	91.3	Very high	85.8	Confident	43 Å²	43	58.1 Å²	58.1	17%	0.169	35%	0.35	C	S	.	.	H	α-helix	trans	-55.6	-47.9	177.7	179.1	-89.4	0	0	0	113.9	Y487 G492 T493 L495 P496 V500 S501 I502	Y487-Y498 HydrophobicContact CD1-CD2 4.19Å; Y487-Y498 WeakPolarHBondContact O-CE2 3.47Å; G492-Y498 WeakPolarHBondContact O-CB 3.44Å; G492-Y498 WeakPolarHBondContact O-CD2 3.45Å; G492-Y498 VanDerWaalsContact O-CG 3.25Å; T493-Y498 HydrophobicContact CG2-CD1 4.42Å; T493-Y498 HydrophobicContact CG2-CE1 3.78Å; L495-Y498 WeakPolarHBondContact O-CB 3.44Å; L495-Y498 PolarHBondContact O-N 3.43Å; L495-Y498 VanDerWaalsContact O-N 3.15Å; P496-Y498 VanDerWaalsContact C-N 3.33Å; P496-Y498 PolarHBondContact O-N 3.4Å; Y498-V500 VanDerWaalsContact C-N 3.25Å; Y498-V500 PolarHBondContact O-N 3.22Å; Y498-S501 WeakPolarHBondContact O-CB 3.25Å; Y498-S501 PolarHBondContact O-N 3.21Å; Y498-S501 VanDerWaalsContact O-N 3.16Å; Y498-I502 HydrophobicContact CD1-CD1 4.03Å; Y498-I502 HydrophobicContact CE1-CD1 3.37Å; Y498-I502 HydrophobicContact CE1-CG1 4.27Å; Y498-I502 PolarHBondContact O-N 3.35Å
499	P	90.6	Very high	86.4	Confident	84 Å²	84	61.9 Å²	61.9	55%	0.545	35%	0.353	S	S	.	.	H	α-helix	trans	-59.4	-38.7	176.6	-22.9	34.3	0	0	0	112.2	I502 T503	P499-I502 PolarHBondContact O-N 2.92Å; P499-T503 PolarHBondContact O-N 2.85Å; P499-T503 VanDerWaalsContact O-N 3.12Å; P499-T503 PolarHBondContact O-OG1 3.35Å; P499-T503 VanDerWaalsContact O-OG1 3.12Å
500	V	92.7	Very high	87.5	Confident	23 Å²	23	62.8 Å²	62.8	14%	0.139	36%	0.358	C	S	.	.	H	α-helix	trans	-70.3	-35.9	179.6	-173.5	0	0	0	0	110.8	G497 Y498 I502 T503 V504 I520 V524 V546	G497-V500 PolarHBondContact O-N 2.82Å; G497-V500 VanDerWaalsContact O-N 3.12Å; Y498-V500 VanDerWaalsContact C-N 3.25Å; Y498-V500 PolarHBondContact O-N 3.22Å; V500-I502 VanDerWaalsContact C-N 3.32Å; V500-I502 PolarHBondContact O-N 2.78Å; V500-T503 PolarHBondContact O-N 3.01Å; V500-V504 HydrophobicContact CG1-CG2 4.12Å; V500-V504 WeakPolarHBondContact O-CB 3.33Å; V500-V504 VanDerWaalsContact O-CG2 3.3Å; V500-V504 WeakPolarHBondContact O-CG2 3.06Å; V500-V504 PolarHBondContact O-N 3.25Å; V500-I520 HydrophobicContact CG1-CG2 3.95Å; V500-V524 HydrophobicContact CB-CG2 4.2Å; V500-V524 HydrophobicContact CG1-CG2 3.53Å; V500-V524 HydrophobicContact CG2-CG2 4.17Å; V500-V546 HydrophobicContact CB-CG1 4.06Å; V500-V546 HydrophobicContact CG1-CG1 3.95Å
501	S	93.4	Very high	89.1	Confident	3 Å²	3	64.3 Å²	64.3	2%	0.021	36%	0.356	C	S	.	.	H	α-helix	trans	-59.5	-41.7	173.2	178.5	0	0	0	0	112	Y487 G497 Y498 S505 V546 T550	Y487-S501 WeakPolarHBondContact CD2-OG 3.31Å; G497-S501 PolarHBondContact O-N 3.19Å; Y498-S501 WeakPolarHBondContact O-CB 3.25Å; Y498-S501 PolarHBondContact O-N 3.21Å; Y498-S501 VanDerWaalsContact O-N 3.16Å; S501-S505 VanDerWaalsContact O-CB 3.23Å; S501-S505 WeakPolarHBondContact O-CB 3.41Å; S501-S505 PolarHBondContact O-N 2.85Å; S501-V546 VanDerWaalsContact N-CG1 3.34Å; S501-T550 PolarHBondContact OG-OG1 3.44Å
502	I	93.2	Very high	90.7	Very high	73 Å²	73	60.2 Å²	60.2	37%	0.374	33%	0.328	S	S	.	.	H	α-helix	trans	-63.1	-47.5	174.8	-65.2	176.2	0	0	0	110.6	Y498 P499 V500 S505 N506	Y498-I502 HydrophobicContact CD1-CD1 4.03Å; Y498-I502 HydrophobicContact CE1-CD1 3.37Å; Y498-I502 HydrophobicContact CE1-CG1 4.27Å; Y498-I502 PolarHBondContact O-N 3.35Å; P499-I502 PolarHBondContact O-N 2.92Å; V500-I502 VanDerWaalsContact C-N 3.32Å; V500-I502 PolarHBondContact O-N 2.78Å; I502-S505 WeakPolarHBondContact O-CB 3.41Å; I502-S505 PolarHBondContact O-N 3.48Å; I502-N506 PolarHBondContact O-N 2.72Å; I502-N506 PolarHBondContact O-ND2 3.43Å
503	T	95	Very high	92.1	Very high	70 Å²	70	62.6 Å²	62.6	43%	0.429	34%	0.344	S	S	.	.	H	α-helix	trans	-60.5	-46.9	179.5	-55.9	0	0	0	0	111.6	P499 V500 S505 N506 A507 I520	P499-T503 PolarHBondContact O-N 2.85Å; P499-T503 VanDerWaalsContact O-N 3.12Å; P499-T503 PolarHBondContact O-OG1 3.35Å; P499-T503 VanDerWaalsContact O-OG1 3.12Å; V500-T503 PolarHBondContact O-N 3.01Å; T503-S505 PolarHBondContact O-N 3.14Å; T503-N506 PolarHBondContact O-N 3.25Å; T503-A507 WeakPolarHBondContact O-CB 3.43Å; T503-A507 PolarHBondContact O-N 2.76Å; T503-I520 HydrophobicContact CG2-CD1 3.98Å; T503-I520 HydrophobicContact CG2-CG1 4.14Å; T503-I520 HydrophobicContact CG2-CG2 3.8Å
504	V	95.5	Very high	93	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-62.3	-41.8	175.5	171.3	0	0	0	0	111	V500 N506 A507 I508 I520 L521 V546 F547 T550	V500-V504 HydrophobicContact CG1-CG2 4.12Å; V500-V504 WeakPolarHBondContact O-CB 3.33Å; V500-V504 VanDerWaalsContact O-CG2 3.3Å; V500-V504 WeakPolarHBondContact O-CG2 3.06Å; V500-V504 PolarHBondContact O-N 3.25Å; V504-N506 VanDerWaalsContact C-N 3.34Å; V504-N506 PolarHBondContact O-N 3.12Å; V504-A507 PolarHBondContact O-N 3.3Å; V504-I508 HydrophobicContact CG1-CD1 3.75Å; V504-I508 HydrophobicContact CG1-CG1 4.34Å; V504-I508 WeakPolarHBondContact O-CG1 3.44Å; V504-I508 PolarHBondContact O-N 2.75Å; V504-I520 HydrophobicContact CG2-CG2 3.85Å; V504-L521 HydrophobicContact CG2-CD2 4.07Å; V504-V546 HydrophobicContact CG2-CG1 4.47Å; V504-F547 HydrophobicContact CG1-CD2 4.1Å; V504-T550 HydrophobicContact CB-CG2 4.46Å; V504-T550 HydrophobicContact CG1-CG2 4.06Å
505	S	95.8	Very high	93.7	Very high	13 Å²	13	61.8 Å²	61.8	9%	0.091	32%	0.324	C	S	.	.	H	α-helix	trans	-59.7	-45.8	177.8	-170.5	0	0	0	0	111.5	S501 I502 T503 I508 K509	S501-S505 VanDerWaalsContact O-CB 3.23Å; S501-S505 WeakPolarHBondContact O-CB 3.41Å; S501-S505 PolarHBondContact O-N 2.85Å; I502-S505 WeakPolarHBondContact O-CB 3.41Å; I502-S505 PolarHBondContact O-N 3.48Å; T503-S505 PolarHBondContact O-N 3.14Å; S505-I508 PolarHBondContact O-N 3.19Å; S505-K509 WeakPolarHBondContact O-CB 3.37Å; S505-K509 VanDerWaalsContact O-CG 3.27Å; S505-K509 WeakPolarHBondContact O-CG 3.48Å; S505-K509 PolarHBondContact O-N 3.2Å; S505-K509 PolarHBondContact OG-NZ 3.01Å
506	N	96.3	Very high	94	Very high	80 Å²	80	64.2 Å²	64.2	43%	0.428	33%	0.333	S	S	.	.	H	α-helix	trans	-66.2	-42.1	177.4	-70.2	-25.5	0	0	0	111.7	I502 T503 V504 K509 N510	I502-N506 PolarHBondContact O-N 2.72Å; I502-N506 PolarHBondContact O-ND2 3.43Å; T503-N506 PolarHBondContact O-N 3.25Å; V504-N506 VanDerWaalsContact C-N 3.34Å; V504-N506 PolarHBondContact O-N 3.12Å; N506-K509 PolarHBondContact O-N 3.37Å; N506-N510 VanDerWaalsContact O-CB 3.31Å; N506-N510 WeakPolarHBondContact O-CB 3.46Å; N506-N510 VanDerWaalsContact O-CG 3.27Å; N506-N510 PolarHBondContact O-N 3.02Å; N506-N510 PolarHBondContact O-ND2 2.91Å
507	A	96.4	Very high	94.3	Very high	13 Å²	13	60 Å²	60	11%	0.107	31%	0.306	C	S	.	.	H	α-helix	trans	-59	-48.1	175.9	0	0	0	0	0	111.6	T503 V504 K509 N510 R511 A512 I517 I520	T503-A507 WeakPolarHBondContact O-CB 3.43Å; T503-A507 PolarHBondContact O-N 2.76Å; V504-A507 PolarHBondContact O-N 3.3Å; A507-K509 PolarHBondContact O-N 2.9Å; A507-N510 CarbonylContact O-C 3.47Å; A507-N510 PolarHBondContact O-N 3.18Å; A507-R511 PolarHBondContact O-N 2.88Å; A507-R511 VanDerWaalsContact O-N 3.15Å; A507-A512 HydrophobicContact CB-CB 3.82Å; A507-A512 WeakPolarHBondContact O-CB 3.5Å; A507-A512 PolarHBondContact O-N 3.15Å; A507-I517 HydrophobicContact CB-CG1 4.16Å; A507-I520 HydrophobicContact CB-CD1 3.74Å
508	I	96	Very high	94.5	Very high	20 Å²	20	61.2 Å²	61.2	10%	0.103	31%	0.31	C	S	.	.	H	α-helix	trans	-62	-45.5	178.2	-67.5	170	0	0	0	111.1	V504 S505 N510 R511 I517 L551 L554 F569	V504-I508 HydrophobicContact CG1-CD1 3.75Å; V504-I508 HydrophobicContact CG1-CG1 4.34Å; V504-I508 WeakPolarHBondContact O-CG1 3.44Å; V504-I508 PolarHBondContact O-N 2.75Å; S505-I508 PolarHBondContact O-N 3.19Å; I508-N510 VanDerWaalsContact C-N 3.3Å; I508-N510 PolarHBondContact O-N 3.2Å; I508-R511 PolarHBondContact O-N 2.93Å; I508-I517 HydrophobicContact CG1-CD1 3.88Å; I508-L551 HydrophobicContact CD1-CB 4.49Å; I508-L551 HydrophobicContact CD1-CD1 4.11Å; I508-L554 HydrophobicContact CB-CD1 3.78Å; I508-L554 HydrophobicContact CD1-CD1 4.18Å; I508-L554 HydrophobicContact CG2-CD1 3.56Å; I508-F569 HydrophobicContact CB-CZ 4.42Å; I508-F569 HydrophobicContact CG1-CE1 4.45Å; I508-F569 HydrophobicContact CG1-CE2 4.47Å; I508-F569 HydrophobicContact CG1-CZ 3.96Å; I508-F569 HydrophobicContact CG2-CE2 4.17Å; I508-F569 HydrophobicContact CG2-CZ 3.99Å
509	K	94.9	Very high	94.7	Very high	127 Å²	127	61.8 Å²	61.8	55%	0.552	32%	0.323	S	S	*	.	H	α-helix	trans	-61.5	-37.9	177.6	-74	170.2	-175.3	165.8	0	112.3	S505 N506 A507 R511 L554	S505-K509 WeakPolarHBondContact O-CB 3.37Å; S505-K509 VanDerWaalsContact O-CG 3.27Å; S505-K509 WeakPolarHBondContact O-CG 3.48Å; S505-K509 PolarHBondContact O-N 3.2Å; S505-K509 PolarHBondContact OG-NZ 3.01Å; N506-K509 PolarHBondContact O-N 3.37Å; A507-K509 PolarHBondContact O-N 2.9Å; K509-R511 PolarHBondContact O-N 2.9Å; K509-L554 VanDerWaalsContact CE-CD2 3.45Å; K509-L554 HydrophobicContact CG-CD1 4.49Å; K509-L554 HydrophobicContact CG-CD2 4.41Å
510	N	95.9	Very high	94.8	Very high	133 Å²	133	59.3 Å²	59.3	71%	0.711	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	6.8	176.7	-67.5	-25.8	0	0	0	113.6	N506 A507 I508 A512	N506-N510 VanDerWaalsContact O-CB 3.31Å; N506-N510 WeakPolarHBondContact O-CB 3.46Å; N506-N510 VanDerWaalsContact O-CG 3.27Å; N506-N510 PolarHBondContact O-N 3.02Å; N506-N510 PolarHBondContact O-ND2 2.91Å; A507-N510 CarbonylContact O-C 3.47Å; A507-N510 PolarHBondContact O-N 3.18Å; I508-N510 VanDerWaalsContact C-N 3.3Å; I508-N510 PolarHBondContact O-N 3.2Å; N510-A512 VanDerWaalsContact C-N 3.33Å; N510-A512 PolarHBondContact O-N 3.2Å
511	R	93.9	Very high	94.9	Very high	211 Å²	211	58.4 Å²	58.4	80%	0.796	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	36.1	177.5	-50	178.5	177.7	-171.3	-0.6	113.7	A507 I508 K509	A507-R511 PolarHBondContact O-N 2.88Å; A507-R511 VanDerWaalsContact O-N 3.15Å; I508-R511 PolarHBondContact O-N 2.93Å; K509-R511 PolarHBondContact O-N 2.9Å
512	A	94.4	Very high	94.6	Very high	12 Å²	12	65.8 Å²	65.8	10%	0.099	33%	0.331	C	S	.	.			trans	-52	152.3	172.5	0	0	0	0	0	112.5	A507 N510 E516 I517	A507-A512 HydrophobicContact CB-CB 3.82Å; A507-A512 WeakPolarHBondContact O-CB 3.5Å; A507-A512 PolarHBondContact O-N 3.15Å; N510-A512 VanDerWaalsContact C-N 3.33Å; N510-A512 PolarHBondContact O-N 3.2Å; A512-E516 WeakPolarHBondContact CA-OE2 3.43Å; A512-E516 HydrophobicContact CB-CB 4.15Å; A512-E516 WeakPolarHBondContact CB-OE2 3.24Å; A512-I517 HydrophobicContact CB-CD1 4.35Å; A512-I517 HydrophobicContact CB-CG1 4.04Å
513	S	95.4	Very high	94.3	Very high	52 Å²	52	70 Å²	70	36%	0.364	35%	0.349	S	S	.	.			trans	-73.4	166.7	175.1	77.7	0	0	0	0	111.6	E515 E516 I517	S513-E515 VanDerWaalsContact C-N 3.28Å; S513-E515 PolarHBondContact O-N 3.34Å; S513-E515 PolarHBondContact OG-N 2.88Å; S513-E516 PolarHBondContact N-OE2 3.41Å; S513-E516 PolarHBondContact O-N 2.93Å; S513-E516 WeakPolarHBondContact OG-CG 3.44Å; S513-E516 PolarHBondContact OG-N 2.98Å; S513-I517 WeakPolarHBondContact O-CG1 3.18Å; S513-I517 PolarHBondContact O-N 3.3Å
514	N	95	Very high	94	Very high	32 Å²	32	66.9 Å²	66.9	17%	0.171	33%	0.331	C	S	.	.	H	α-helix	trans	-62	-39.2	175.7	-70.1	-19.8	0	0	0	111.6	I517 L518 F569 E571 I572	N514-I517 PolarHBondContact O-N 2.94Å; N514-L518 WeakPolarHBondContact O-CB 3.49Å; N514-L518 VanDerWaalsContact O-CG 3.31Å; N514-L518 WeakPolarHBondContact O-CG 3.43Å; N514-L518 PolarHBondContact O-N 3.46Å; N514-F569 WeakPolarHBondContact OD1-CD1 3.43Å; N514-E571 WeakPolarHBondContact CB-OE2 3.43Å; N514-E571 PolarHBondContact ND2-OE2 3.1Å; N514-I572 HydrophobicContact CB-CD1 4.24Å; N514-I572 HydrophobicContact CB-CG1 3.96Å
515	E	95.3	Very high	93.7	Very high	149 Å²	149	71.1 Å²	71.1	70%	0.696	36%	0.358	S	S	*	.	H	α-helix	trans	-63	-43.8	178.5	-64.2	175.7	-179.6	0	0	112.2	S513 I517 L518 A519	S513-E515 VanDerWaalsContact C-N 3.28Å; S513-E515 PolarHBondContact O-N 3.34Å; S513-E515 PolarHBondContact OG-N 2.88Å; E515-I517 VanDerWaalsContact C-N 3.32Å; E515-I517 PolarHBondContact O-N 2.91Å; E515-L518 PolarHBondContact O-N 2.79Å; E515-A519 WeakPolarHBondContact O-CB 3.32Å; E515-A519 PolarHBondContact O-N 2.77Å
516	E	94.9	Very high	93.3	Very high	112 Å²	112	71.3 Å²	71.3	52%	0.523	36%	0.358	S	S	.	.	H	α-helix	trans	-62.1	-41	177.8	-72.7	171.1	160.2	0	0	111.4	A512 S513 A519 I520	A512-E516 WeakPolarHBondContact CA-OE2 3.43Å; A512-E516 HydrophobicContact CB-CB 4.15Å; A512-E516 WeakPolarHBondContact CB-OE2 3.24Å; S513-E516 PolarHBondContact N-OE2 3.41Å; S513-E516 PolarHBondContact O-N 2.93Å; S513-E516 WeakPolarHBondContact OG-CG 3.44Å; S513-E516 PolarHBondContact OG-N 2.98Å; E516-A519 PolarHBondContact O-N 2.81Å; E516-I520 WeakPolarHBondContact O-CG1 3.31Å; E516-I520 PolarHBondContact O-N 2.8Å
517	I	95.5	Very high	92.8	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-71.8	-40.8	177.8	-62.9	170.9	0	0	0	111	A507 I508 A512 S513 N514 E515 A519 I520 L521 F547 F569 I572	A507-I517 HydrophobicContact CB-CG1 4.16Å; I508-I517 HydrophobicContact CG1-CD1 3.88Å; A512-I517 HydrophobicContact CB-CD1 4.35Å; A512-I517 HydrophobicContact CB-CG1 4.04Å; S513-I517 WeakPolarHBondContact O-CG1 3.18Å; S513-I517 PolarHBondContact O-N 3.3Å; N514-I517 PolarHBondContact O-N 2.94Å; E515-I517 VanDerWaalsContact C-N 3.32Å; E515-I517 PolarHBondContact O-N 2.91Å; I517-A519 VanDerWaalsContact C-N 3.26Å; I517-A519 PolarHBondContact O-N 3.15Å; I517-I520 WeakPolarHBondContact O-CB 3.49Å; I517-I520 PolarHBondContact O-N 2.73Å; I517-I520 VanDerWaalsContact O-N 3.16Å; I517-L521 HydrophobicContact CG2-CD1 4.2Å; I517-L521 HydrophobicContact CG2-CG 4.37Å; I517-L521 WeakPolarHBondContact O-CG 3.49Å; I517-L521 PolarHBondContact O-N 2.82Å; I517-F547 HydrophobicContact CG2-CD2 3.96Å; I517-F547 HydrophobicContact CG2-CE2 3.82Å; I517-F569 HydrophobicContact CD1-CD1 3.88Å; I517-F569 HydrophobicContact CD1-CE1 3.33Å; I517-F569 HydrophobicContact CD1-CZ 4.15Å; I517-I572 HydrophobicContact CB-CD1 3.73Å; I517-I572 HydrophobicContact CD1-CD1 4.27Å; I517-I572 HydrophobicContact CG2-CD1 3.67Å
518	L	94.1	Very high	92	Very high	35 Å²	35	75 Å²	75	18%	0.183	38%	0.38	C	S	.	.	H	α-helix	trans	-59.8	-38.4	174.1	-76.9	167.5	0	0	0	111.5	N514 E515 L521 K522 I572	N514-L518 WeakPolarHBondContact O-CB 3.49Å; N514-L518 VanDerWaalsContact O-CG 3.31Å; N514-L518 WeakPolarHBondContact O-CG 3.43Å; N514-L518 PolarHBondContact O-N 3.46Å; E515-L518 PolarHBondContact O-N 2.79Å; L518-L521 PolarHBondContact O-N 3.29Å; L518-K522 WeakPolarHBondContact O-CG 3.42Å; L518-K522 PolarHBondContact O-N 2.94Å; L518-I572 HydrophobicContact CD1-CG1 4.49Å; L518-I572 HydrophobicContact CD2-CB 4.46Å; L518-I572 HydrophobicContact CD2-CG1 4.4Å; L518-I572 HydrophobicContact CD2-CG2 3.96Å; L518-I572 HydrophobicContact CG-CG1 4.11Å
519	A	93.9	Very high	91	Very high	55 Å²	55	78.8 Å²	78.8	46%	0.455	40%	0.398	S	S	.	.	H	α-helix	trans	-61.4	-43.7	174.6	0	0	0	0	0	111.9	E515 E516 I517 L521 K522	E515-A519 WeakPolarHBondContact O-CB 3.32Å; E515-A519 PolarHBondContact O-N 2.77Å; E516-A519 PolarHBondContact O-N 2.81Å; I517-A519 VanDerWaalsContact C-N 3.26Å; I517-A519 PolarHBondContact O-N 3.15Å; A519-L521 VanDerWaalsContact C-N 3.32Å; A519-L521 PolarHBondContact O-N 3.47Å; A519-K522 PolarHBondContact O-N 2.97Å
520	I	94.1	Very high	89.5	Confident	33 Å²	33	80.1 Å²	80.1	17%	0.169	41%	0.406	C	S	.	.	H	α-helix	trans	-61	-42.9	173.6	-64.1	160.2	0	0	0	110.8	V500 T503 V504 A507 E516 I517 K522 E523	V500-I520 HydrophobicContact CG1-CG2 3.95Å; T503-I520 HydrophobicContact CG2-CD1 3.98Å; T503-I520 HydrophobicContact CG2-CG1 4.14Å; T503-I520 HydrophobicContact CG2-CG2 3.8Å; V504-I520 HydrophobicContact CG2-CG2 3.85Å; A507-I520 HydrophobicContact CB-CD1 3.74Å; E516-I520 WeakPolarHBondContact O-CG1 3.31Å; E516-I520 PolarHBondContact O-N 2.8Å; I517-I520 WeakPolarHBondContact O-CB 3.49Å; I517-I520 PolarHBondContact O-N 2.73Å; I517-I520 VanDerWaalsContact O-N 3.16Å; I520-K522 VanDerWaalsContact C-N 3.28Å; I520-K522 PolarHBondContact O-N 3.13Å; I520-E523 PolarHBondContact O-N 2.89Å
521	L	93.2	Very high	87.7	Confident	4 Å²	4	82.3 Å²	82.3	2%	0.021	42%	0.418	C	S	.	.	H	α-helix	trans	-68.3	-24.7	-178.3	-67.8	175.7	0	0	0	113.1	V504 I517 L518 A519 E523 V524 K543 F547 I572	V504-L521 HydrophobicContact CG2-CD2 4.07Å; I517-L521 HydrophobicContact CG2-CD1 4.2Å; I517-L521 HydrophobicContact CG2-CG 4.37Å; I517-L521 WeakPolarHBondContact O-CG 3.49Å; I517-L521 PolarHBondContact O-N 2.82Å; L518-L521 PolarHBondContact O-N 3.29Å; A519-L521 VanDerWaalsContact C-N 3.32Å; A519-L521 PolarHBondContact O-N 3.47Å; L521-E523 PolarHBondContact O-N 3.41Å; L521-V524 HydrophobicContact CD2-CG2 4.33Å; L521-V524 WeakPolarHBondContact O-CB 3.44Å; L521-V524 WeakPolarHBondContact O-CG2 3.42Å; L521-V524 PolarHBondContact O-N 2.99Å; L521-V524 VanDerWaalsContact O-N 3.17Å; L521-K543 WeakPolarHBondContact O-CE 3.41Å; L521-F547 HydrophobicContact CD1-CB 4Å; L521-F547 HydrophobicContact CD1-CD2 3.98Å; L521-F547 HydrophobicContact CD1-CG 4.01Å; L521-F547 HydrophobicContact CD2-CB 3.97Å; L521-I572 HydrophobicContact CD1-CG2 3.86Å
522	K	88.7	Confident	85.8	Confident	157 Å²	157	79.8 Å²	79.8	68%	0.683	42%	0.42	S	S	*	.	H	α-helix	trans	-61.9	-26.4	175	-75.6	179.1	-178.5	-172.7	0	113	L518 A519 I520 V524	L518-K522 WeakPolarHBondContact O-CG 3.42Å; L518-K522 PolarHBondContact O-N 2.94Å; A519-K522 PolarHBondContact O-N 2.97Å; I520-K522 VanDerWaalsContact C-N 3.28Å; I520-K522 PolarHBondContact O-N 3.13Å; K522-V524 PolarHBondContact O-N 3.34Å
523	E	85.6	Confident	83.9	Confident	161 Å²	161	84.9 Å²	84.9	75%	0.752	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-5	179.3	-57.3	-175.9	169.4	0	0	113.3	I520 L521	I520-E523 PolarHBondContact O-N 2.89Å; L521-E523 PolarHBondContact O-N 3.41Å
524	V	90.2	Very high	81.9	Confident	6 Å²	6	90.1 Å²	90.1	4%	0.036	47%	0.469	C	S	.	.	S	Bend	trans	-76.6	122.8	179.8	180	0	0	0	0	109.9	V500 L521 K522 N540 L542 K543	V500-V524 HydrophobicContact CB-CG2 4.2Å; V500-V524 HydrophobicContact CG1-CG2 3.53Å; V500-V524 HydrophobicContact CG2-CG2 4.17Å; L521-V524 HydrophobicContact CD2-CG2 4.33Å; L521-V524 WeakPolarHBondContact O-CB 3.44Å; L521-V524 WeakPolarHBondContact O-CG2 3.42Å; L521-V524 PolarHBondContact O-N 2.99Å; L521-V524 VanDerWaalsContact O-N 3.17Å; K522-V524 PolarHBondContact O-N 3.34Å; V524-N540 PolarHBondContact O-ND2 3Å; V524-L542 HydrophobicContact CG1-CB 3.89Å; V524-L542 HydrophobicContact CG1-CD2 3.8Å; V524-L542 HydrophobicContact CG1-CG 3.65Å; V524-K543 HydrophobicContact CB-CG 3.66Å; V524-K543 HydrophobicContact CG1-CG 3.91Å; V524-K543 HydrophobicContact CG2-CG 4.2Å
525	P	88.6	Confident	79.8	Confident	88 Å²	88	98.2 Å²	98.2	57%	0.571	51%	0.506	S	S	*	.			trans	-63.2	145.6	179.3	26.8	-34	0	0	0	110.7	P527 N540 L542	P525-P527 WeakPolarHBondContact O-CD 3.22Å; P525-N540 PolarHBondContact O-ND2 2.96Å; P525-L542 HydrophobicContact CG-CD2 4.07Å
526	N	87.9	Confident	77.9	Confident	17 Å²	17	93.8 Å²	93.8	9%	0.091	50%	0.5	C	S	.	.			trans	-92.3	113.4	174.9	-166.6	-11.7	0	0	0	109.9	N528 Q529 S538 F539 N540	N526-N528 PolarHBondContact O-N 3.23Å; N526-N528 WeakPolarHBondContact OD1-CB 3.45Å; N526-N528 PolarHBondContact OD1-N 2.93Å; N526-Q529 HydrophobicContact CB-CB 4.09Å; N526-Q529 HydrophobicContact CB-CG 3.79Å; N526-Q529 PolarHBondContact O-N 3.12Å; N526-S538 PolarHBondContact ND2-O 2.99Å; N526-S538 VanDerWaalsContact ND2-O 3.14Å; N526-S538 PolarHBondContact ND2-OG 3.27Å; N526-F539 PolarHBondContact ND2-O 3.28Å; N526-F539 PolarHBondContact OD1-O 3.26Å; N526-N540 VanDerWaalsContact CA-ND2 3.3Å; N526-N540 WeakPolarHBondContact CA-ND2 3.37Å; N526-N540 HydrophobicContact CB-CB 4.25Å; N526-N540 WeakPolarHBondContact CB-ND2 3.21Å; N526-N540 PolarHBondContact N-ND2 2.9Å
527	P	84.4	Confident	76.2	Confident	84 Å²	84	97.4 Å²	97.4	55%	0.545	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-13	177.4	30.2	-36.6	0	0	0	113.4	P525 P541 L542	P525-P527 WeakPolarHBondContact O-CD 3.22Å; P527-P541 HydrophobicContact CG-CG 3.63Å; P527-L542 HydrophobicContact CG-CB 4.37Å
528	N	80.6	Confident	75	Confident	86 Å²	86	99.9 Å²	99.9	46%	0.46	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-0.4	178.6	-61.8	-19.2	0	0	0	113.3	N526 F539 P541	N526-N528 PolarHBondContact O-N 3.23Å; N526-N528 WeakPolarHBondContact OD1-CB 3.45Å; N526-N528 PolarHBondContact OD1-N 2.93Å; N528-F539 PolarHBondContact ND2-O 3.47Å; N528-F539 VanDerWaalsContact ND2-O 3.08Å; N528-P541 VanDerWaalsContact ND2-CD 3.26Å; N528-P541 WeakPolarHBondContact ND2-CD 3.34Å
529	Q	75.7	Confident	74.6	Confident	101 Å²	101	100.5 Å²	100.5	47%	0.472	54%	0.536	S	S	.	.			trans	-88.4	120.8	173.7	-81.5	176.4	-34.1	0	0	109.1	N526 S538	N526-Q529 HydrophobicContact CB-CB 4.09Å; N526-Q529 HydrophobicContact CB-CG 3.79Å; N526-Q529 PolarHBondContact O-N 3.12Å; Q529-S538 WeakPolarHBondContact CG-OG 3.39Å
530	E	63.2	Low	74.5	Confident	155 Å²	155	98.6 Å²	98.6	72%	0.724	52%	0.518	S	S	*	.			trans	-81.3	152.1	164.4	-64.8	-170.7	173.2	0	0	109.5	D532 D533	E530-D532 PolarHBondContact O-N 2.9Å; E530-D533 PolarHBondContact O-N 3.16Å
531	D	57.8	Low	74.4	Confident	179 Å²	179	97.8 Å²	97.8	96%	0.957	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-10.5	-172.4	-72.6	-39.3	0	0	0	114.5
532	D	54.2	Low	74.5	Confident	158 Å²	158	98.3 Å²	98.3	85%	0.845	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	2.4	-176.2	-80.1	-28.4	0	0	0	114.7	E530 D534	E530-D532 PolarHBondContact O-N 2.9Å; D532-D534 PolarHBondContact O-N 3.18Å
533	D	53.5	Low	74.8	Confident	119 Å²	119	93 Å²	93	64%	0.636	50%	0.495	S	S	*	.			trans	-87.9	86.3	178.7	-86.4	-21.1	0	0	0	112	E530	E530-D533 PolarHBondContact O-N 3.16Å
534	D	53.4	Low	75.3	Confident	161 Å²	161	85.4 Å²	85.4	86%	0.861	46%	0.459	S	S	*	.			trans	-82.2	128	165.3	-95.2	-29.3	0	0	0	110.4	D532	D532-D534 PolarHBondContact O-N 3.18Å
535	E	51.8	Low	75.5	Confident	202 Å²	202	85.9 Å²	85.9	94%	0.944	46%	0.462	S	S	*	.	S	Bend	trans	92.1	63.5	168.7	-54	-173.3	165.2	0	0	118.7
536	G	53.6	Low	75.8	Confident	56 Å²	56	81.7 Å²	81.7	58%	0.577	43%	0.434	S	S	*	.			trans	-176.6	138.6	152.5	0	0	0	0	0	113.6	S538	G536-S538 PolarHBondContact O-N 3.05Å
537	E	59.7	Low	76.3	Confident	189 Å²	189	80.9 Å²	80.9	88%	0.883	43%	0.43	S	S	*	.			trans	-69.6	85.1	165.3	-83.2	-166.6	155.1	0	0	108.7
538	S	71.4	Confident	76.9	Confident	52 Å²	52	77 Å²	77	36%	0.364	40%	0.404	S	S	.	.			trans	-69.7	150.5	176.5	61.1	0	0	0	0	111.5	N526 Q529 G536 N540	N526-S538 PolarHBondContact ND2-O 2.99Å; N526-S538 VanDerWaalsContact ND2-O 3.14Å; N526-S538 PolarHBondContact ND2-OG 3.27Å; Q529-S538 WeakPolarHBondContact CG-OG 3.39Å; G536-S538 PolarHBondContact O-N 3.05Å; S538-N540 PolarHBondContact O-N 2.9Å
539	F	85.6	Confident	77.7	Confident	48 Å²	48	73 Å²	73	21%	0.211	38%	0.383	C	S	.	.			trans	-51.8	122.5	176.5	162.2	-113.5	0	0	0	111.1	N526 N528 P541 I544 D581 G582 H585	N526-F539 PolarHBondContact ND2-O 3.28Å; N526-F539 PolarHBondContact OD1-O 3.26Å; N528-F539 PolarHBondContact ND2-O 3.47Å; N528-F539 VanDerWaalsContact ND2-O 3.08Å; F539-P541 HydrophobicContact CE1-CB 3.97Å; F539-P541 HydrophobicContact CE1-CG 4.23Å; F539-P541 HydrophobicContact CZ-CB 3.72Å; F539-P541 HydrophobicContact CZ-CG 4.41Å; F539-P541 WeakPolarHBondContact O-CD 3.36Å; F539-I544 HydrophobicContact CE2-CD1 3.71Å; F539-D581 HydrophobicContact CB-CB 4.44Å; F539-D581 HydrophobicContact CD1-CB 3.68Å; F539-D581 HydrophobicContact CD2-CB 4.23Å; F539-D581 HydrophobicContact CE1-CB 3.97Å; F539-D581 HydrophobicContact CG-CB 3.84Å; F539-D581 HydrophobicContact CZ-CB 4.38Å; F539-G582 VanDerWaalsContact CE2-CA 3.49Å; F539-H585 HydrophobicContact CE2-CB 4.07Å; F539-H585 HydrophobicContact CZ-CB 3.54Å; F539-H585 AromaticContact CZ-CG 3.72Å
540	N	91	Very high	78.7	Confident	14 Å²	14	68.2 Å²	68.2	8%	0.075	36%	0.361	C	S	.	.			trans	-110.6	100.2	-178.9	-174.9	-30	0	0	0	111	V524 P525 N526 S538 L542 K543	V524-N540 PolarHBondContact O-ND2 3Å; P525-N540 PolarHBondContact O-ND2 2.96Å; N526-N540 VanDerWaalsContact CA-ND2 3.3Å; N526-N540 WeakPolarHBondContact CA-ND2 3.37Å; N526-N540 HydrophobicContact CB-CB 4.25Å; N526-N540 WeakPolarHBondContact CB-ND2 3.21Å; N526-N540 PolarHBondContact N-ND2 2.9Å; S538-N540 PolarHBondContact O-N 2.9Å; N540-L542 VanDerWaalsContact C-N 3.32Å; N540-L542 PolarHBondContact O-N 3.32Å; N540-L542 PolarHBondContact OD1-N 3.35Å; N540-K543 HydrophobicContact CB-CB 4.36Å; N540-K543 HydrophobicContact CB-CD 3.98Å; N540-K543 HydrophobicContact CB-CG 4.17Å; N540-K543 WeakPolarHBondContact ND2-CE 3.35Å; N540-K543 PolarHBondContact O-N 2.62Å; N540-K543 PolarHBondContact OD1-N 2.9Å
541	P	93.3	Very high	80.3	Confident	17 Å²	17	61 Å²	61	11%	0.11	33%	0.327	C	S	.	.	H	α-helix	trans	-66.2	-33.1	-179	24.1	-32.7	0	0	0	112.4	P527 N528 F539 K543 I544 D545 H585	P527-P541 HydrophobicContact CG-CG 3.63Å; N528-P541 VanDerWaalsContact ND2-CD 3.26Å; N528-P541 WeakPolarHBondContact ND2-CD 3.34Å; F539-P541 HydrophobicContact CE1-CB 3.97Å; F539-P541 HydrophobicContact CE1-CG 4.23Å; F539-P541 HydrophobicContact CZ-CB 3.72Å; F539-P541 HydrophobicContact CZ-CG 4.41Å; F539-P541 WeakPolarHBondContact O-CD 3.36Å; P541-K543 VanDerWaalsContact C-N 3.35Å; P541-K543 PolarHBondContact O-N 3.09Å; P541-I544 WeakPolarHBondContact O-CB 3.26Å; P541-I544 PolarHBondContact O-N 3.14Å; P541-I544 VanDerWaalsContact O-N 3.17Å; P541-D545 PolarHBondContact O-N 2.98Å; P541-H585 VanDerWaalsContact CB-CE1 3.41Å; P541-H585 WeakPolarHBondContact CB-CE1 3.13Å; P541-H585 VanDerWaalsContact CB-NE2 3.35Å; P541-H585 WeakPolarHBondContact CB-NE2 3.27Å; P541-H585 PolarHBondContact O-NE2 3.26Å
542	L	94.3	Very high	82.2	Confident	14 Å²	14	52.5 Å²	52.5	7%	0.073	28%	0.282	C	S	.	.	H	α-helix	trans	-67.5	-34.3	-176.8	-171.3	61.5	0	0	0	112.4	P496 V524 P525 P527 N540 I544 D545 V546	P496-L542 HydrophobicContact CB-CD1 4.15Å; P496-L542 HydrophobicContact CB-CD2 4.02Å; V524-L542 HydrophobicContact CG1-CB 3.89Å; V524-L542 HydrophobicContact CG1-CD2 3.8Å; V524-L542 HydrophobicContact CG1-CG 3.65Å; P525-L542 HydrophobicContact CG-CD2 4.07Å; P527-L542 HydrophobicContact CG-CB 4.37Å; N540-L542 VanDerWaalsContact C-N 3.32Å; N540-L542 PolarHBondContact O-N 3.32Å; N540-L542 PolarHBondContact OD1-N 3.35Å; L542-I544 VanDerWaalsContact C-N 3.31Å; L542-I544 PolarHBondContact O-N 3.38Å; L542-D545 HydrophobicContact CD1-CB 4.41Å; L542-D545 PolarHBondContact O-N 3.49Å; L542-V546 HydrophobicContact CD1-CG2 4.17Å; L542-V546 HydrophobicContact CG-CG2 4.35Å; L542-V546 WeakPolarHBondContact O-CB 3.29Å; L542-V546 WeakPolarHBondContact O-CG2 3.44Å; L542-V546 PolarHBondContact O-N 2.98Å
543	K	95.1	Very high	84.3	Confident	47 Å²	47	48.6 Å²	48.6	20%	0.204	26%	0.258	C	S	.	.	H	α-helix	trans	-58.2	-45.2	172.5	-79.2	179.7	-170.4	176.7	0	111.2	L521 V524 N540 P541 F547 L576	L521-K543 WeakPolarHBondContact O-CE 3.41Å; V524-K543 HydrophobicContact CB-CG 3.66Å; V524-K543 HydrophobicContact CG1-CG 3.91Å; V524-K543 HydrophobicContact CG2-CG 4.2Å; N540-K543 HydrophobicContact CB-CB 4.36Å; N540-K543 HydrophobicContact CB-CD 3.98Å; N540-K543 HydrophobicContact CB-CG 4.17Å; N540-K543 WeakPolarHBondContact ND2-CE 3.35Å; N540-K543 PolarHBondContact O-N 2.62Å; N540-K543 PolarHBondContact OD1-N 2.9Å; P541-K543 VanDerWaalsContact C-N 3.35Å; P541-K543 PolarHBondContact O-N 3.09Å; K543-F547 VanDerWaalsContact O-CB 3.24Å; K543-F547 WeakPolarHBondContact O-CB 3.39Å; K543-F547 PolarHBondContact O-N 2.53Å; K543-F547 VanDerWaalsContact O-N 3.08Å; K543-L576 HydrophobicContact CB-CD2 3.94Å
544	I	95.9	Very high	86.3	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-66.4	-49.8	179.1	-61.4	-172.4	0	0	0	110.5	F539 P541 L542 V546 F547 L548 L576 H585 I586 V589	F539-I544 HydrophobicContact CE2-CD1 3.71Å; P541-I544 WeakPolarHBondContact O-CB 3.26Å; P541-I544 PolarHBondContact O-N 3.14Å; P541-I544 VanDerWaalsContact O-N 3.17Å; L542-I544 VanDerWaalsContact C-N 3.31Å; L542-I544 PolarHBondContact O-N 3.38Å; I544-V546 PolarHBondContact O-N 2.96Å; I544-F547 PolarHBondContact O-N 3.38Å; I544-L548 HydrophobicContact CG2-CB 4.47Å; I544-L548 HydrophobicContact CG2-CD2 4.47Å; I544-L548 VanDerWaalsContact O-CB 3.23Å; I544-L548 WeakPolarHBondContact O-CB 3.29Å; I544-L548 PolarHBondContact O-N 2.85Å; I544-L576 HydrophobicContact CD1-CB 4.36Å; I544-L576 WeakPolarHBondContact CD1-O 3.25Å; I544-L576 HydrophobicContact CG1-CB 4.05Å; I544-L576 HydrophobicContact CG1-CD1 4.39Å; I544-L576 HydrophobicContact CG1-CD2 4.12Å; I544-L576 HydrophobicContact CG1-CG 4.41Å; I544-H585 HydrophobicContact CD1-CB 4.31Å; I544-I586 HydrophobicContact CD1-CG1 4.26Å; I544-I586 HydrophobicContact CG2-CD1 4.48Å; I544-I586 HydrophobicContact CG2-CG1 3.56Å; I544-V589 HydrophobicContact CG2-CG2 4.35Å
545	D	95.1	Very high	88.4	Confident	16 Å²	16	38.3 Å²	38.3	9%	0.086	20%	0.204	C	C	.	.	H	α-helix	trans	-49.8	-56	177.5	-104.7	6.3	0	0	0	111.4	K486 P541 L542 Q549 H585 V589	K486-D545 IonicContact NZ-OD2 3.47Å; K486-D545 PolarHBondContact NZ-OD2 2.75Å; P541-D545 PolarHBondContact O-N 2.98Å; L542-D545 HydrophobicContact CD1-CB 4.41Å; L542-D545 PolarHBondContact O-N 3.49Å; D545-Q549 WeakPolarHBondContact O-CB 3.32Å; D545-Q549 WeakPolarHBondContact O-CG 3.5Å; D545-Q549 PolarHBondContact O-N 3.12Å; D545-H585 IonicContact OD1-NE2 2.72Å; D545-H585 PolarHBondContact OD1-NE2 3.39Å; D545-V589 WeakPolarHBondContact OD1-CG2 3.27Å
546	V	95.1	Very high	90.6	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.1	-47.8	-176.3	173.7	0	0	0	0	111	Y487 V500 S501 V504 L542 I544 T550	Y487-V546 HydrophobicContact CE2-CG2 4.36Å; V500-V546 HydrophobicContact CB-CG1 4.06Å; V500-V546 HydrophobicContact CG1-CG1 3.95Å; S501-V546 VanDerWaalsContact N-CG1 3.34Å; V504-V546 HydrophobicContact CG2-CG1 4.47Å; L542-V546 HydrophobicContact CD1-CG2 4.17Å; L542-V546 HydrophobicContact CG-CG2 4.35Å; L542-V546 WeakPolarHBondContact O-CB 3.29Å; L542-V546 WeakPolarHBondContact O-CG2 3.44Å; L542-V546 PolarHBondContact O-N 2.98Å; I544-V546 PolarHBondContact O-N 2.96Å; V546-T550 VanDerWaalsContact O-CB 3.23Å; V546-T550 WeakPolarHBondContact O-CB 3.46Å; V546-T550 PolarHBondContact O-N 3.31Å; V546-T550 PolarHBondContact O-OG1 3.1Å
547	F	97.8	Very high	92.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.4	-55.2	-176.3	178.3	-110.1	0	0	0	112	V504 I517 L521 K543 I544 T550 L551 F569 I572 L573 L576	V504-F547 HydrophobicContact CG1-CD2 4.1Å; I517-F547 HydrophobicContact CG2-CD2 3.96Å; I517-F547 HydrophobicContact CG2-CE2 3.82Å; L521-F547 HydrophobicContact CD1-CB 4Å; L521-F547 HydrophobicContact CD1-CD2 3.98Å; L521-F547 HydrophobicContact CD1-CG 4.01Å; L521-F547 HydrophobicContact CD2-CB 3.97Å; K543-F547 VanDerWaalsContact O-CB 3.24Å; K543-F547 WeakPolarHBondContact O-CB 3.39Å; K543-F547 PolarHBondContact O-N 2.53Å; K543-F547 VanDerWaalsContact O-N 3.08Å; I544-F547 PolarHBondContact O-N 3.38Å; F547-T550 PolarHBondContact O-N 2.83Å; F547-L551 HydrophobicContact CE1-CD2 4.01Å; F547-L551 HydrophobicContact CZ-CD2 3.96Å; F547-L551 VanDerWaalsContact O-CB 3.31Å; F547-L551 WeakPolarHBondContact O-CB 3.44Å; F547-L551 PolarHBondContact O-N 3.15Å; F547-F569 HydrophobicContact CZ-CB 3.76Å; F547-F569 HydrophobicContact CZ-CG 4.16Å; F547-I572 HydrophobicContact CD1-CG2 3.99Å; F547-I572 HydrophobicContact CD2-CG2 4.32Å; F547-I572 HydrophobicContact CE1-CB 4.08Å; F547-I572 HydrophobicContact CE1-CG2 3.68Å; F547-I572 HydrophobicContact CE2-CD1 3.88Å; F547-I572 HydrophobicContact CE2-CG2 4.06Å; F547-I572 HydrophobicContact CG-CG2 4.3Å; F547-I572 HydrophobicContact CZ-CB 3.95Å; F547-I572 HydrophobicContact CZ-CD1 3.88Å; F547-I572 HydrophobicContact CZ-CG1 4.5Å; F547-I572 HydrophobicContact CZ-CG2 3.73Å; F547-L573 HydrophobicContact CD1-CD2 4.22Å; F547-L573 HydrophobicContact CE1-CD2 3.75Å; F547-L573 HydrophobicContact CE1-CG 4.04Å; F547-L576 HydrophobicContact CB-CD1 4.19Å; F547-L576 HydrophobicContact CD1-CD1 3.61Å; F547-L576 HydrophobicContact CE1-CD1 4.38Å; F547-L576 HydrophobicContact CG-CD1 4.14Å
548	L	97.6	Very high	94.5	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-71	-40.2	-170.8	-176.2	59.5	0	0	0	111.9	I544 T550 L551 L552 L573 I586 V589 V590	I544-L548 HydrophobicContact CG2-CB 4.47Å; I544-L548 HydrophobicContact CG2-CD2 4.47Å; I544-L548 VanDerWaalsContact O-CB 3.23Å; I544-L548 WeakPolarHBondContact O-CB 3.29Å; I544-L548 PolarHBondContact O-N 2.85Å; L548-T550 VanDerWaalsContact C-N 3.34Å; L548-T550 PolarHBondContact O-N 3.43Å; L548-L551 PolarHBondContact O-N 3.35Å; L548-L552 HydrophobicContact CD1-CD1 3.86Å; L548-L552 HydrophobicContact CD1-CD2 4.43Å; L548-L552 HydrophobicContact CD1-CG 3.86Å; L548-L552 HydrophobicContact CG-CD1 3.94Å; L548-L552 HydrophobicContact CG-CG 4.31Å; L548-L552 WeakPolarHBondContact O-CB 3.48Å; L548-L552 WeakPolarHBondContact O-CG 3.42Å; L548-L552 PolarHBondContact O-N 3.09Å; L548-L573 HydrophobicContact CD1-CD2 4.1Å; L548-I586 HydrophobicContact CD2-CB 4.07Å; L548-I586 HydrophobicContact CD2-CD1 4.15Å; L548-I586 HydrophobicContact CD2-CG1 3.89Å; L548-I586 HydrophobicContact CD2-CG2 3.84Å; L548-V589 HydrophobicContact CB-CG1 4.09Å; L548-V589 HydrophobicContact CD2-CB 4Å; L548-V589 HydrophobicContact CD2-CG1 3.9Å; L548-V589 HydrophobicContact CG-CG1 4.02Å; L548-V590 HydrophobicContact CD2-CG2 4.09Å
549	Q	96	Very high	95.8	Very high	4 Å²	4	28.9 Å²	28.9	2%	0.019	15%	0.145	C	C	.	.	H	α-helix	trans	-61.5	-44.5	174.6	-70.3	-142.9	27.1	0	0	111.7	F485 Y487 D545 H553 V589 V593	F485-Q549 HydrophobicContact CD2-CB 4.27Å; F485-Q549 HydrophobicContact CE2-CB 4.11Å; Y487-Q549 HydrophobicContact CD2-CB 4.38Å; Y487-Q549 HydrophobicContact CE2-CB 4.18Å; D545-Q549 WeakPolarHBondContact O-CB 3.32Å; D545-Q549 WeakPolarHBondContact O-CG 3.5Å; D545-Q549 PolarHBondContact O-N 3.12Å; Q549-H553 VanDerWaalsContact O-CB 3.22Å; Q549-H553 WeakPolarHBondContact O-CB 3.3Å; Q549-H553 PolarHBondContact O-N 3.3Å; Q549-V589 HydrophobicContact CG-CG1 3.58Å; Q549-V593 HydrophobicContact CB-CG1 4.29Å; Q549-V593 VanDerWaalsContact CD-CG1 3.43Å; Q549-V593 HydrophobicContact CG-CG1 3.57Å
550	T	96.9	Very high	96.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.6	-43.9	178.9	-55.3	0	0	0	0	111	S501 V504 V546 F547 L548 H553 L554	S501-T550 PolarHBondContact OG-OG1 3.44Å; V504-T550 HydrophobicContact CB-CG2 4.46Å; V504-T550 HydrophobicContact CG1-CG2 4.06Å; V546-T550 VanDerWaalsContact O-CB 3.23Å; V546-T550 WeakPolarHBondContact O-CB 3.46Å; V546-T550 PolarHBondContact O-N 3.31Å; V546-T550 PolarHBondContact O-OG1 3.1Å; F547-T550 PolarHBondContact O-N 2.83Å; L548-T550 VanDerWaalsContact C-N 3.34Å; L548-T550 PolarHBondContact O-N 3.43Å; T550-H553 PolarHBondContact O-N 2.79Å; T550-L554 HydrophobicContact CG2-CD1 4.33Å; T550-L554 VanDerWaalsContact O-CG 3.32Å; T550-L554 WeakPolarHBondContact O-CG 3.49Å; T550-L554 PolarHBondContact O-N 3.27Å; T550-L554 VanDerWaalsContact O-N 3.14Å
551	L	97.9	Very high	96.7	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-61.2	-49.8	178.4	-179	63.9	0	0	0	111.8	I508 F547 L548 L554 A555 A565 F569	I508-L551 HydrophobicContact CD1-CB 4.49Å; I508-L551 HydrophobicContact CD1-CD1 4.11Å; F547-L551 HydrophobicContact CE1-CD2 4.01Å; F547-L551 HydrophobicContact CZ-CD2 3.96Å; F547-L551 VanDerWaalsContact O-CB 3.31Å; F547-L551 WeakPolarHBondContact O-CB 3.44Å; F547-L551 PolarHBondContact O-N 3.15Å; L548-L551 PolarHBondContact O-N 3.35Å; L551-L554 PolarHBondContact O-N 3.38Å; L551-A555 WeakPolarHBondContact O-CB 3.3Å; L551-A555 PolarHBondContact O-N 3.37Å; L551-A555 VanDerWaalsContact O-N 3.14Å; L551-A565 HydrophobicContact CD1-CB 3.86Å; L551-A565 HydrophobicContact CG-CB 4.13Å; L551-F569 HydrophobicContact CD1-CD2 3.34Å; L551-F569 HydrophobicContact CD1-CE2 3.53Å; L551-F569 HydrophobicContact CD1-CG 4.3Å; L551-F569 HydrophobicContact CD2-CB 4.39Å; L551-F569 HydrophobicContact CD2-CD2 4.25Å; L551-F569 HydrophobicContact CG-CD2 4.45Å
552	L	97.8	Very high	96.9	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-68.4	-35.1	-179	-67.8	178.6	0	0	0	111.8	F483 L548 A555 A556 V590 V593 L604	F483-L552 HydrophobicContact CE2-CB 3.76Å; F483-L552 HydrophobicContact CZ-CB 4.04Å; L548-L552 HydrophobicContact CD1-CD1 3.86Å; L548-L552 HydrophobicContact CD1-CD2 4.43Å; L548-L552 HydrophobicContact CD1-CG 3.86Å; L548-L552 HydrophobicContact CG-CD1 3.94Å; L548-L552 HydrophobicContact CG-CG 4.31Å; L548-L552 WeakPolarHBondContact O-CB 3.48Å; L548-L552 WeakPolarHBondContact O-CG 3.42Å; L548-L552 PolarHBondContact O-N 3.09Å; L552-A555 CarbonylContact O-C 3.46Å; L552-A555 VanDerWaalsContact O-C 3.32Å; L552-A555 PolarHBondContact O-N 3.45Å; L552-A555 VanDerWaalsContact O-N 3.13Å; L552-A556 WeakPolarHBondContact O-CA 3.06Å; L552-A556 WeakPolarHBondContact O-CB 3.08Å; L552-A556 PolarHBondContact O-N 3.26Å; L552-V590 HydrophobicContact CD1-CG2 4.16Å; L552-V593 HydrophobicContact CD1-CG2 3.8Å; L552-L604 HydrophobicContact CD2-CD1 4.28Å
553	H	97.3	Very high	97.1	Very high	76 Å²	76	35.7 Å²	35.7	35%	0.352	18%	0.183	S	C	.	.	H	α-helix	trans	-58.3	-49.9	173.8	177.4	59.9	0	0	0	111.5	F483 F485 Q549 T550 A555 A556	F483-H553 HydrophobicContact CD1-CB 4.29Å; F483-H553 AromaticContact CD1-ND1 3.72Å; F483-H553 VanDerWaalsContact CE1-CA 3.47Å; F483-H553 HydrophobicContact CE1-CB 3.46Å; F483-H553 VanDerWaalsContact CE1-CB 3.46Å; F483-H553 AromaticContact CE1-CG 3.95Å; F483-H553 AromaticContact CE1-ND1 3.69Å; F483-H553 VanDerWaalsContact CZ-CA 3.46Å; F483-H553 HydrophobicContact CZ-CB 3.78Å; F483-H553 VanDerWaalsContact CZ-N 3.29Å; F485-H553 HydrophobicContact CD1-CB 4.39Å; F485-H553 AromaticContact CD1-CD2 3.77Å; F485-H553 AromaticContact CD1-CE1 3.93Å; F485-H553 AromaticContact CD1-CG 3.73Å; F485-H553 AromaticContact CD1-ND1 3.84Å; F485-H553 AromaticContact CD1-NE2 3.93Å; F485-H553 HydrophobicContact CD2-CB 3.77Å; F485-H553 AromaticContact CD2-CG 4Å; F485-H553 AromaticContact CE1-CD2 3.78Å; F485-H553 HydrophobicContact CE2-CB 3.97Å; F485-H553 HydrophobicContact CG-CB 4.01Å; F485-H553 AromaticContact CG-CG 3.72Å; F485-H553 AromaticContact CG-ND1 3.77Å; F485-H553 HydrophobicContact CZ-CB 4.38Å; Q549-H553 VanDerWaalsContact O-CB 3.22Å; Q549-H553 WeakPolarHBondContact O-CB 3.3Å; Q549-H553 PolarHBondContact O-N 3.3Å; T550-H553 PolarHBondContact O-N 2.79Å; H553-A555 PolarHBondContact O-N 3.12Å; H553-A556 WeakPolarHBondContact O-CB 3.46Å; H553-A556 PolarHBondContact O-N 2.83Å
554	L	96.8	Very high	97.3	Very high	58 Å²	58	37.5 Å²	37.5	30%	0.304	20%	0.202	S	C	.	.	H	α-helix	trans	-66	-21.9	178.4	-64.4	176.3	0	0	0	112.7	I508 K509 T550 L551	I508-L554 HydrophobicContact CB-CD1 3.78Å; I508-L554 HydrophobicContact CD1-CD1 4.18Å; I508-L554 HydrophobicContact CG2-CD1 3.56Å; K509-L554 VanDerWaalsContact CE-CD2 3.45Å; K509-L554 HydrophobicContact CG-CD1 4.49Å; K509-L554 HydrophobicContact CG-CD2 4.41Å; T550-L554 HydrophobicContact CG2-CD1 4.33Å; T550-L554 VanDerWaalsContact O-CG 3.32Å; T550-L554 WeakPolarHBondContact O-CG 3.49Å; T550-L554 PolarHBondContact O-N 3.27Å; T550-L554 VanDerWaalsContact O-N 3.14Å; L551-L554 PolarHBondContact O-N 3.38Å
555	A	97.4	Very high	97.3	Very high	6 Å²	6	38 Å²	38	5%	0.05	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	10.5	-178.5	0	0	0	0	0	114.1	L551 L552 H553 K557 H561 S562 A565	L551-A555 WeakPolarHBondContact O-CB 3.3Å; L551-A555 PolarHBondContact O-N 3.37Å; L551-A555 VanDerWaalsContact O-N 3.14Å; L552-A555 CarbonylContact O-C 3.46Å; L552-A555 VanDerWaalsContact O-C 3.32Å; L552-A555 PolarHBondContact O-N 3.45Å; L552-A555 VanDerWaalsContact O-N 3.13Å; H553-A555 PolarHBondContact O-N 3.12Å; A555-K557 PolarHBondContact O-N 3.48Å; A555-K557 VanDerWaalsContact O-N 3.15Å; A555-H561 HydrophobicContact CB-CB 4.36Å; A555-H561 WeakPolarHBondContact O-CB 3.34Å; A555-S562 PolarHBondContact O-N 2.84Å; A555-S562 PolarHBondContact O-OG 2.89Å; A555-A565 HydrophobicContact CB-CB 3.59Å
556	A	97.4	Very high	97.5	Very high	30 Å²	30	37.3 Å²	37.3	25%	0.248	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-8.6	-171.5	0	0	0	0	0	114.6	F483 L552 H553 S558 W594	F483-A556 HydrophobicContact CB-CB 4.12Å; F483-A556 HydrophobicContact CD2-CB 4.1Å; F483-A556 HydrophobicContact CG-CB 4.05Å; L552-A556 WeakPolarHBondContact O-CA 3.06Å; L552-A556 WeakPolarHBondContact O-CB 3.08Å; L552-A556 PolarHBondContact O-N 3.26Å; H553-A556 WeakPolarHBondContact O-CB 3.46Å; H553-A556 PolarHBondContact O-N 2.83Å; A556-S558 PolarHBondContact O-N 3.19Å; A556-W594 HydrophobicContact CB-CH2 3.72Å; A556-W594 HydrophobicContact CB-CZ2 3.83Å
557	K	97.1	Very high	97.6	Very high	175 Å²	175	39.4 Å²	39.4	76%	0.761	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-36.5	-173.9	-176.3	173.4	177.5	178.5	0	114	A555	A555-K557 PolarHBondContact O-N 3.48Å; A555-K557 VanDerWaalsContact O-N 3.15Å
558	S	97.5	Very high	97.5	Very high	41 Å²	41	44.5 Å²	44.5	29%	0.287	25%	0.246	S	C	.	.			trans	-163.7	165.2	177	75.6	0	0	0	0	111.8	A556 S560 H561 S562	A556-S558 PolarHBondContact O-N 3.19Å; S558-S560 PolarHBondContact O-N 2.97Å; S558-S560 PolarHBondContact OG-N 2.91Å; S558-H561 PolarHBondContact O-N 3.44Å; S558-H561 VanDerWaalsContact O-N 3.08Å; S558-H561 PolarHBondContact OG-N 3.47Å; S558-H561 PolarHBondContact OG-ND1 2.9Å; S558-S562 PolarHBondContact O-N 3.38Å; S558-S562 VanDerWaalsContact O-N 3.11Å; S558-S562 PolarHBondContact O-OG 3.21Å
559	F	98.4	Very high	97.5	Very high	56 Å²	56	44.7 Å²	44.7	25%	0.246	25%	0.247	C	C	.	.	H	α-helix	trans	-52.2	-43.3	174.4	-62.6	-12.6	0	0	0	112.2	H561 S562 F563 H597 Q599 M600 V603	F559-H561 PolarHBondContact O-N 3.28Å; F559-S562 PolarHBondContact O-N 2.87Å; F559-F563 HydrophobicContact CB-CE2 3.98Å; F559-F563 HydrophobicContact CB-CZ 3.95Å; F559-F563 WeakPolarHBondContact O-CD1 3.32Å; F559-F563 WeakPolarHBondContact O-CD2 3.46Å; F559-F563 WeakPolarHBondContact O-CG 3.5Å; F559-F563 PolarHBondContact O-N 3.32Å; F559-H597 AromaticContact CE1-NE2 3.94Å; F559-Q599 HydrophobicContact CE2-CG 4.26Å; F559-Q599 HydrophobicContact CZ-CB 4.46Å; F559-Q599 HydrophobicContact CZ-CG 3.8Å; F559-M600 HydrophobicContact CD1-CE 3.41Å; F559-M600 VanDerWaalsContact CD1-CE 3.41Å; F559-M600 HydrophobicContact CD1-SD 3.52Å; F559-M600 VanDerWaalsContact CD1-SD 3.52Å; F559-M600 HydrophobicContact CE1-CB 4.11Å; F559-M600 HydrophobicContact CE1-CE 3.68Å; F559-M600 HydrophobicContact CE1-SD 3.77Å; F559-V603 HydrophobicContact CD1-CG2 3.98Å; F559-V603 HydrophobicContact CD2-CG2 4.25Å; F559-V603 HydrophobicContact CE1-CG2 4.11Å; F559-V603 HydrophobicContact CE2-CG1 4.4Å; F559-V603 HydrophobicContact CE2-CG2 4.36Å; F559-V603 HydrophobicContact CG-CG2 4.07Å; F559-V603 HydrophobicContact CZ-CG2 4.31Å
560	S	98.2	Very high	97.6	Very high	82 Å²	82	47.7 Å²	47.7	57%	0.573	26%	0.261	S	S	*	.	H	α-helix	trans	-61.7	-41.3	179.1	-52.5	0	0	0	0	112.7	S558 F563 S564	S558-S560 PolarHBondContact O-N 2.97Å; S558-S560 PolarHBondContact OG-N 2.91Å; S560-F563 PolarHBondContact O-N 3.04Å; S560-S564 WeakPolarHBondContact O-CB 3.44Å; S560-S564 PolarHBondContact O-N 3.15Å; S560-S564 PolarHBondContact O-OG 3.15Å; S560-S564 VanDerWaalsContact O-OG 3.11Å
561	H	98.3	Very high	97.6	Very high	89 Å²	89	52 Å²	52	41%	0.412	28%	0.281	S	S	.	.	H	α-helix	trans	-63.6	-45.8	176.6	-69.4	82	0	0	0	110.5	A555 S558 F559 F563 S564 A565	A555-H561 HydrophobicContact CB-CB 4.36Å; A555-H561 WeakPolarHBondContact O-CB 3.34Å; S558-H561 PolarHBondContact O-N 3.44Å; S558-H561 VanDerWaalsContact O-N 3.08Å; S558-H561 PolarHBondContact OG-N 3.47Å; S558-H561 PolarHBondContact OG-ND1 2.9Å; F559-H561 PolarHBondContact O-N 3.28Å; H561-F563 PolarHBondContact O-N 2.82Å; H561-S564 PolarHBondContact O-N 3.5Å; H561-A565 VanDerWaalsContact O-CB 3.31Å; H561-A565 WeakPolarHBondContact O-CB 3.48Å; H561-A565 PolarHBondContact O-N 3.32Å
562	S	98.3	Very high	97.5	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-42.4	177.5	-58.2	0	0	0	0	112.1	A555 S558 F559 A565 L566	A555-S562 PolarHBondContact O-N 2.84Å; A555-S562 PolarHBondContact O-OG 2.89Å; S558-S562 PolarHBondContact O-N 3.38Å; S558-S562 VanDerWaalsContact O-N 3.11Å; S558-S562 PolarHBondContact O-OG 3.21Å; F559-S562 PolarHBondContact O-N 2.87Å; S562-A565 WeakPolarHBondContact O-CB 3.31Å; S562-A565 PolarHBondContact O-N 3.22Å; S562-L566 WeakPolarHBondContact O-CG 3.28Å; S562-L566 PolarHBondContact O-N 3.16Å
563	F	98.3	Very high	97.5	Very high	64 Å²	64	52 Å²	52	28%	0.281	28%	0.281	S	S	.	.	H	α-helix	trans	-66.1	-40.6	176.8	-61	-19.7	0	0	0	112.9	F559 S560 H561 A565 L566 G567 V603 L604 K607	F559-F563 HydrophobicContact CB-CE2 3.98Å; F559-F563 HydrophobicContact CB-CZ 3.95Å; F559-F563 WeakPolarHBondContact O-CD1 3.32Å; F559-F563 WeakPolarHBondContact O-CD2 3.46Å; F559-F563 WeakPolarHBondContact O-CG 3.5Å; F559-F563 PolarHBondContact O-N 3.32Å; S560-F563 PolarHBondContact O-N 3.04Å; H561-F563 PolarHBondContact O-N 2.82Å; F563-A565 VanDerWaalsContact C-N 3.31Å; F563-L566 PolarHBondContact O-N 3.18Å; F563-G567 PolarHBondContact O-N 3.21Å; F563-V603 HydrophobicContact CE1-CB 4.11Å; F563-V603 HydrophobicContact CE1-CG2 3.94Å; F563-V603 HydrophobicContact CZ-CB 3.83Å; F563-V603 HydrophobicContact CZ-CG2 3.87Å; F563-L604 HydrophobicContact CE1-CD2 4.47Å; F563-K607 HydrophobicContact CD1-CB 4.09Å; F563-K607 HydrophobicContact CD1-CD 4.47Å; F563-K607 HydrophobicContact CD1-CG 3.93Å; F563-K607 HydrophobicContact CE1-CB 4.13Å; F563-K607 HydrophobicContact CE1-CG 4.45Å; F563-K607 HydrophobicContact CG-CG 4.46Å
564	S	97.6	Very high	97.5	Very high	85 Å²	85	51.8 Å²	51.8	59%	0.594	28%	0.279	S	S	*	.	H	α-helix	trans	-65.1	-37.4	174.9	-68	0	0	0	0	111.6	S560 H561 G567 K568	S560-S564 WeakPolarHBondContact O-CB 3.44Å; S560-S564 PolarHBondContact O-N 3.15Å; S560-S564 PolarHBondContact O-OG 3.15Å; S560-S564 VanDerWaalsContact O-OG 3.11Å; H561-S564 PolarHBondContact O-N 3.5Å; S564-G567 PolarHBondContact O-N 3.34Å; S564-K568 VanDerWaalsContact O-CB 3.31Å; S564-K568 WeakPolarHBondContact O-CB 3.42Å; S564-K568 PolarHBondContact O-N 3.26Å
565	A	97.6	Very high	97.3	Very high	12 Å²	12	53 Å²	53	10%	0.099	29%	0.286	C	S	.	.	H	α-helix	trans	-63.3	-50.3	175.1	0	0	0	0	0	111.6	L551 A555 H561 S562 F563 G567 K568 F569	L551-A565 HydrophobicContact CD1-CB 3.86Å; L551-A565 HydrophobicContact CG-CB 4.13Å; A555-A565 HydrophobicContact CB-CB 3.59Å; H561-A565 VanDerWaalsContact O-CB 3.31Å; H561-A565 WeakPolarHBondContact O-CB 3.48Å; H561-A565 PolarHBondContact O-N 3.32Å; S562-A565 WeakPolarHBondContact O-CB 3.31Å; S562-A565 PolarHBondContact O-N 3.22Å; F563-A565 VanDerWaalsContact C-N 3.31Å; A565-G567 VanDerWaalsContact C-N 3.27Å; A565-G567 PolarHBondContact O-N 2.81Å; A565-K568 PolarHBondContact O-N 3.21Å; A565-F569 WeakPolarHBondContact O-CD2 3.41Å; A565-F569 PolarHBondContact O-N 2.97Å; A565-F569 VanDerWaalsContact O-N 3.11Å
566	L	97.8	Very high	97.2	Very high	2 Å²	2	54 Å²	54	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-59.1	-38.5	175.2	-66.4	-178.7	0	0	0	112.3	S562 F563 H570 L573 L604 K607 M608	S562-L566 WeakPolarHBondContact O-CG 3.28Å; S562-L566 PolarHBondContact O-N 3.16Å; F563-L566 PolarHBondContact O-N 3.18Å; L566-H570 WeakPolarHBondContact O-CA 3.2Å; L566-H570 WeakPolarHBondContact O-CB 3.16Å; L566-H570 PolarHBondContact O-N 3Å; L566-H570 VanDerWaalsContact O-N 3.17Å; L566-L573 HydrophobicContact CB-CD1 4.36Å; L566-L573 HydrophobicContact CD2-CD1 3.63Å; L566-L604 HydrophobicContact CD1-CD2 3.91Å; L566-K607 HydrophobicContact CD1-CB 4.38Å; L566-K607 HydrophobicContact CD1-CG 4.05Å; L566-M608 HydrophobicContact CD1-CG 4.07Å
567	G	96.8	Very high	97	Very high	44 Å²	44	52.6 Å²	52.6	45%	0.454	28%	0.279	S	S	.	.	H	α-helix	trans	-69.6	-41.7	177.1	0	0	0	0	0	113.3	F563 S564 A565 H570	F563-G567 PolarHBondContact O-N 3.21Å; S564-G567 PolarHBondContact O-N 3.34Å; A565-G567 VanDerWaalsContact C-N 3.27Å; A565-G567 PolarHBondContact O-N 2.81Å; G567-H570 WeakPolarHBondContact O-CB 3.28Å
568	K	97.1	Very high	96.8	Very high	106 Å²	106	52 Å²	52	46%	0.461	28%	0.279	S	S	.	.	H	α-helix	trans	-65.7	-41.8	-178.7	-176.9	179.3	176	-169.1	0	111.9	S564 A565	S564-K568 VanDerWaalsContact O-CB 3.31Å; S564-K568 WeakPolarHBondContact O-CB 3.42Å; S564-K568 PolarHBondContact O-N 3.26Å; A565-K568 PolarHBondContact O-N 3.21Å
569	F	97.8	Very high	96.6	Very high	6 Å²	6	52.3 Å²	52.3	3%	0.026	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	28.7	-177.5	-55.2	-78.9	0	0	0	112.7	I508 N514 I517 F547 L551 A565 E571 I572 L573	I508-F569 HydrophobicContact CB-CZ 4.42Å; I508-F569 HydrophobicContact CG1-CE1 4.45Å; I508-F569 HydrophobicContact CG1-CE2 4.47Å; I508-F569 HydrophobicContact CG1-CZ 3.96Å; I508-F569 HydrophobicContact CG2-CE2 4.17Å; I508-F569 HydrophobicContact CG2-CZ 3.99Å; N514-F569 WeakPolarHBondContact OD1-CD1 3.43Å; I517-F569 HydrophobicContact CD1-CD1 3.88Å; I517-F569 HydrophobicContact CD1-CE1 3.33Å; I517-F569 HydrophobicContact CD1-CZ 4.15Å; F547-F569 HydrophobicContact CZ-CB 3.76Å; F547-F569 HydrophobicContact CZ-CG 4.16Å; L551-F569 HydrophobicContact CD1-CD2 3.34Å; L551-F569 HydrophobicContact CD1-CE2 3.53Å; L551-F569 HydrophobicContact CD1-CG 4.3Å; L551-F569 HydrophobicContact CD2-CB 4.39Å; L551-F569 HydrophobicContact CD2-CD2 4.25Å; L551-F569 HydrophobicContact CG-CD2 4.45Å; A565-F569 WeakPolarHBondContact O-CD2 3.41Å; A565-F569 PolarHBondContact O-N 2.97Å; A565-F569 VanDerWaalsContact O-N 3.11Å; F569-E571 VanDerWaalsContact C-N 3.29Å; F569-E571 PolarHBondContact O-N 2.67Å; F569-I572 HydrophobicContact CB-CD1 4.34Å; F569-I572 HydrophobicContact CD1-CD1 3.9Å; F569-I572 PolarHBondContact O-N 3.25Å; F569-L573 WeakPolarHBondContact O-CG 3.18Å; F569-L573 PolarHBondContact O-N 3.19Å; F569-L573 VanDerWaalsContact O-N 3.11Å
570	H	97.9	Very high	96.3	Very high	67 Å²	67	54.5 Å²	54.5	31%	0.31	30%	0.295	S	S	.	.	H	α-helix	trans	-56.8	-41.5	-178.3	174.1	-103	0	0	0	112.6	L566 G567 I572 L573 K574 T611	L566-H570 WeakPolarHBondContact O-CA 3.2Å; L566-H570 WeakPolarHBondContact O-CB 3.16Å; L566-H570 PolarHBondContact O-N 3Å; L566-H570 VanDerWaalsContact O-N 3.17Å; G567-H570 WeakPolarHBondContact O-CB 3.28Å; H570-I572 PolarHBondContact O-N 3.03Å; H570-L573 WeakPolarHBondContact O-CB 3.47Å; H570-L573 PolarHBondContact O-N 3.41Å; H570-K574 VanDerWaalsContact CE1-CG 3.44Å; H570-K574 WeakPolarHBondContact CE1-CG 3.48Å; H570-K574 WeakPolarHBondContact O-CG 3.32Å; H570-K574 PolarHBondContact O-N 3.2Å; H570-T611 PolarHBondContact NE2-O 3.46Å
571	E	96.8	Very high	96.1	Very high	91 Å²	91	55.2 Å²	55.2	43%	0.425	29%	0.293	S	S	.	.	H	α-helix	trans	-58.6	-47.5	177.7	-174.1	-171.3	166.7	0	0	112.4	N514 F569 L573 K574 N575	N514-E571 WeakPolarHBondContact CB-OE2 3.43Å; N514-E571 PolarHBondContact ND2-OE2 3.1Å; F569-E571 VanDerWaalsContact C-N 3.29Å; F569-E571 PolarHBondContact O-N 2.67Å; E571-L573 VanDerWaalsContact C-N 3.31Å; E571-L573 PolarHBondContact O-N 3.41Å; E571-K574 PolarHBondContact O-N 3.47Å; E571-N575 VanDerWaalsContact O-CG 3.31Å; E571-N575 PolarHBondContact O-N 2.94Å; E571-N575 PolarHBondContact O-OD1 2.81Å
572	I	96.4	Very high	96	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.1	-45	176.9	-52.5	-175.8	0	0	0	109.9	N514 I517 L518 L521 F547 F569 H570 K574 N575 L576	N514-I572 HydrophobicContact CB-CD1 4.24Å; N514-I572 HydrophobicContact CB-CG1 3.96Å; I517-I572 HydrophobicContact CB-CD1 3.73Å; I517-I572 HydrophobicContact CD1-CD1 4.27Å; I517-I572 HydrophobicContact CG2-CD1 3.67Å; L518-I572 HydrophobicContact CD1-CG1 4.49Å; L518-I572 HydrophobicContact CD2-CB 4.46Å; L518-I572 HydrophobicContact CD2-CG1 4.4Å; L518-I572 HydrophobicContact CD2-CG2 3.96Å; L518-I572 HydrophobicContact CG-CG1 4.11Å; L521-I572 HydrophobicContact CD1-CG2 3.86Å; F547-I572 HydrophobicContact CD1-CG2 3.99Å; F547-I572 HydrophobicContact CD2-CG2 4.32Å; F547-I572 HydrophobicContact CE1-CB 4.08Å; F547-I572 HydrophobicContact CE1-CG2 3.68Å; F547-I572 HydrophobicContact CE2-CD1 3.88Å; F547-I572 HydrophobicContact CE2-CG2 4.06Å; F547-I572 HydrophobicContact CG-CG2 4.3Å; F547-I572 HydrophobicContact CZ-CB 3.95Å; F547-I572 HydrophobicContact CZ-CD1 3.88Å; F547-I572 HydrophobicContact CZ-CG1 4.5Å; F547-I572 HydrophobicContact CZ-CG2 3.73Å; F569-I572 HydrophobicContact CB-CD1 4.34Å; F569-I572 HydrophobicContact CD1-CD1 3.9Å; F569-I572 PolarHBondContact O-N 3.25Å; H570-I572 PolarHBondContact O-N 3.03Å; I572-K574 VanDerWaalsContact C-N 3.33Å; I572-K574 PolarHBondContact O-N 3.22Å; I572-N575 PolarHBondContact O-N 3.27Å; I572-L576 HydrophobicContact CG2-CD1 3.95Å; I572-L576 HydrophobicContact CG2-CG 4.38Å; I572-L576 WeakPolarHBondContact O-CB 3.21Å; I572-L576 VanDerWaalsContact O-CG 3.28Å; I572-L576 WeakPolarHBondContact O-CG 3.46Å; I572-L576 PolarHBondContact O-N 3.14Å
573	L	97.3	Very high	96	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-61.7	-42.2	179	-66.9	164.6	0	0	0	111.1	F547 L548 L566 F569 H570 E571 L576 T577 I586 I613	F547-L573 HydrophobicContact CD1-CD2 4.22Å; F547-L573 HydrophobicContact CE1-CD2 3.75Å; F547-L573 HydrophobicContact CE1-CG 4.04Å; L548-L573 HydrophobicContact CD1-CD2 4.1Å; L566-L573 HydrophobicContact CB-CD1 4.36Å; L566-L573 HydrophobicContact CD2-CD1 3.63Å; F569-L573 WeakPolarHBondContact O-CG 3.18Å; F569-L573 PolarHBondContact O-N 3.19Å; F569-L573 VanDerWaalsContact O-N 3.11Å; H570-L573 WeakPolarHBondContact O-CB 3.47Å; H570-L573 PolarHBondContact O-N 3.41Å; E571-L573 VanDerWaalsContact C-N 3.31Å; E571-L573 PolarHBondContact O-N 3.41Å; L573-L576 PolarHBondContact O-N 2.89Å; L573-T577 WeakPolarHBondContact O-CG2 3.16Å; L573-T577 PolarHBondContact O-N 2.93Å; L573-T577 PolarHBondContact O-OG1 2.93Å; L573-I586 HydrophobicContact CD2-CD1 3.76Å; L573-I613 HydrophobicContact CB-CD1 4.21Å; L573-I613 HydrophobicContact CB-CG1 4.19Å; L573-I613 HydrophobicContact CB-CG2 4.22Å; L573-I613 HydrophobicContact CD1-CD1 3.79Å
574	K	96.1	Very high	95.9	Very high	72 Å²	72	52.1 Å²	52.1	31%	0.313	28%	0.28	S	S	.	.	H	α-helix	trans	-62.5	-43.2	176.4	-77.7	-62.1	-60.1	166.6	0	112.7	H570 E571 I572 L576 T577 E578 Q612	H570-K574 VanDerWaalsContact CE1-CG 3.44Å; H570-K574 WeakPolarHBondContact CE1-CG 3.48Å; H570-K574 WeakPolarHBondContact O-CG 3.32Å; H570-K574 PolarHBondContact O-N 3.2Å; E571-K574 PolarHBondContact O-N 3.47Å; I572-K574 VanDerWaalsContact C-N 3.33Å; I572-K574 PolarHBondContact O-N 3.22Å; K574-L576 VanDerWaalsContact C-N 3.3Å; K574-L576 PolarHBondContact O-N 3.21Å; K574-T577 CarbonylContact O-C 3.34Å; K574-T577 PolarHBondContact O-N 3.31Å; K574-T577 PolarHBondContact O-OG1 2.88Å; K574-E578 PolarHBondContact O-N 3.41Å; K574-Q612 WeakPolarHBondContact CD-O 3.48Å; K574-Q612 WeakPolarHBondContact CE-O 3.46Å; K574-Q612 PolarHBondContact NZ-O 3.29Å
575	N	94.1	Very high	95.9	Very high	85 Å²	85	49.7 Å²	49.7	46%	0.455	26%	0.259	S	S	.	.	H	α-helix	trans	-63.6	-38.7	176	-66.7	-9.4	0	0	0	111.3	E571 I572 T577	E571-N575 VanDerWaalsContact O-CG 3.31Å; E571-N575 PolarHBondContact O-N 2.94Å; E571-N575 PolarHBondContact O-OD1 2.81Å; I572-N575 PolarHBondContact O-N 3.27Å; N575-T577 VanDerWaalsContact C-N 3.29Å; N575-T577 PolarHBondContact O-N 3.05Å
576	L	93.8	Very high	95.9	Very high	25 Å²	25	49.1 Å²	49.1	13%	0.131	25%	0.254	C	S	.	.	H	α-helix	trans	-73	-19	177.7	-71.1	176.1	0	0	0	113.8	K543 I544 F547 I572 L573 K574	K543-L576 HydrophobicContact CB-CD2 3.94Å; I544-L576 HydrophobicContact CD1-CB 4.36Å; I544-L576 WeakPolarHBondContact CD1-O 3.25Å; I544-L576 HydrophobicContact CG1-CB 4.05Å; I544-L576 HydrophobicContact CG1-CD1 4.39Å; I544-L576 HydrophobicContact CG1-CD2 4.12Å; I544-L576 HydrophobicContact CG1-CG 4.41Å; F547-L576 HydrophobicContact CB-CD1 4.19Å; F547-L576 HydrophobicContact CD1-CD1 3.61Å; F547-L576 HydrophobicContact CE1-CD1 4.38Å; F547-L576 HydrophobicContact CG-CD1 4.14Å; I572-L576 HydrophobicContact CG2-CD1 3.95Å; I572-L576 HydrophobicContact CG2-CG 4.38Å; I572-L576 WeakPolarHBondContact O-CB 3.21Å; I572-L576 VanDerWaalsContact O-CG 3.28Å; I572-L576 WeakPolarHBondContact O-CG 3.46Å; I572-L576 PolarHBondContact O-N 3.14Å; L573-L576 PolarHBondContact O-N 2.89Å; K574-L576 VanDerWaalsContact C-N 3.3Å; K574-L576 PolarHBondContact O-N 3.21Å
577	T	95	Very high	96	Very high	1 Å²	1	49 Å²	49	1%	0.006	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	29.4	-178	62.5	0	0	0	0	113.1	L573 K574 N575 S579 I586 I613	L573-T577 WeakPolarHBondContact O-CG2 3.16Å; L573-T577 PolarHBondContact O-N 2.93Å; L573-T577 PolarHBondContact O-OG1 2.93Å; K574-T577 CarbonylContact O-C 3.34Å; K574-T577 PolarHBondContact O-N 3.31Å; K574-T577 PolarHBondContact O-OG1 2.88Å; N575-T577 VanDerWaalsContact C-N 3.29Å; N575-T577 PolarHBondContact O-N 3.05Å; T577-S579 VanDerWaalsContact C-N 3.34Å; T577-I586 HydrophobicContact CG2-CB 4.21Å; T577-I586 HydrophobicContact CG2-CD1 3.26Å; T577-I586 HydrophobicContact CG2-CG1 3.64Å; T577-I613 WeakPolarHBondContact CB-O 3.5Å; T577-I613 HydrophobicContact CG2-CG2 4.02Å; T577-I613 PolarHBondContact OG1-O 3.29Å
578	E	91.9	Very high	96	Very high	163 Å²	163	49.6 Å²	49.6	76%	0.762	24%	0.244	S	C	*	.	S	Bend	trans	-66	-40.5	175.2	-171.4	169.8	-170.1	0	0	111	K574	K574-E578 PolarHBondContact O-N 3.41Å
579	S	93.2	Very high	96	Very high	47 Å²	47	44.6 Å²	44.6	33%	0.329	22%	0.222	S	C	.	.	S	Bend	trans	-86.4	155.6	173.4	71.6	0	0	0	0	113	T577 D581 G582 K583	T577-S579 VanDerWaalsContact C-N 3.34Å; S579-D581 VanDerWaalsContact C-N 3.31Å; S579-D581 PolarHBondContact O-N 3.04Å; S579-G582 PolarHBondContact O-N 2.74Å; S579-G582 VanDerWaalsContact O-N 3.14Å; S579-G582 PolarHBondContact OG-N 2.93Å; S579-G582 VanDerWaalsContact OG-N 3.14Å; S579-K583 PolarHBondContact O-N 3.23Å; S579-K583 VanDerWaalsContact O-N 3.13Å
580	D	93.1	Very high	96	Very high	102 Å²	102	44.4 Å²	44.4	55%	0.545	22%	0.222	S	C	.	.	H	α-helix	trans	-64.6	-35.5	175.4	-71.3	-22.1	0	0	0	112.4	G582 K583 L584	D580-G582 VanDerWaalsContact C-N 3.28Å; D580-G582 PolarHBondContact O-N 3.15Å; D580-K583 PolarHBondContact O-N 3.14Å; D580-K583 IonicContact OD1-NZ 3.34Å; D580-K583 PolarHBondContact OD1-NZ 2.68Å; D580-L584 WeakPolarHBondContact O-CG 3.11Å; D580-L584 PolarHBondContact O-N 2.62Å
581	D	94.1	Very high	96	Very high	98 Å²	98	42.1 Å²	42.1	52%	0.524	21%	0.21	S	C	.	.	H	α-helix	trans	-60.9	-38.9	172.3	-67.5	-37.2	0	0	0	111.6	F539 S579 L584 H585	F539-D581 HydrophobicContact CB-CB 4.44Å; F539-D581 HydrophobicContact CD1-CB 3.68Å; F539-D581 HydrophobicContact CD2-CB 4.23Å; F539-D581 HydrophobicContact CE1-CB 3.97Å; F539-D581 HydrophobicContact CG-CB 3.84Å; F539-D581 HydrophobicContact CZ-CB 4.38Å; S579-D581 VanDerWaalsContact C-N 3.31Å; S579-D581 PolarHBondContact O-N 3.04Å; D581-L584 PolarHBondContact O-N 3.34Å; D581-H585 VanDerWaalsContact O-CB 3.26Å; D581-H585 WeakPolarHBondContact O-CB 3.4Å; D581-H585 PolarHBondContact O-N 2.7Å
582	G	95.9	Very high	96	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.6	-44.8	173.8	0	0	0	0	0	112.9	F539 S579 D580 H585 I586	F539-G582 VanDerWaalsContact CE2-CA 3.49Å; S579-G582 PolarHBondContact O-N 2.74Å; S579-G582 VanDerWaalsContact O-N 3.14Å; S579-G582 PolarHBondContact OG-N 2.93Å; S579-G582 VanDerWaalsContact OG-N 3.14Å; D580-G582 VanDerWaalsContact C-N 3.28Å; D580-G582 PolarHBondContact O-N 3.15Å; G582-H585 PolarHBondContact O-N 3.02Å; G582-I586 PolarHBondContact O-N 2.95Å
583	K	97.3	Very high	96	Very high	29 Å²	29	40.9 Å²	40.9	13%	0.126	21%	0.205	C	C	.	.	H	α-helix	trans	-61.6	-46.5	176.2	-63	170.2	-164.5	161.4	0	111.6	S579 D580 H585 I586 L587 V614 D615 A618	S579-K583 PolarHBondContact O-N 3.23Å; S579-K583 VanDerWaalsContact O-N 3.13Å; D580-K583 PolarHBondContact O-N 3.14Å; D580-K583 IonicContact OD1-NZ 3.34Å; D580-K583 PolarHBondContact OD1-NZ 2.68Å; K583-H585 VanDerWaalsContact C-N 3.34Å; K583-I586 PolarHBondContact O-N 2.73Å; K583-L587 WeakPolarHBondContact O-CG 3.44Å; K583-L587 PolarHBondContact O-N 3.43Å; K583-V614 HydrophobicContact CB-CB 4.39Å; K583-V614 HydrophobicContact CB-CG1 4Å; K583-V614 HydrophobicContact CG-CG1 4.39Å; K583-D615 WeakPolarHBondContact CD-OD2 3.33Å; K583-D615 WeakPolarHBondContact CE-OD2 3.33Å; K583-D615 IonicContact NZ-OD2 3.77Å; K583-D615 PolarHBondContact NZ-OD2 3.39Å; K583-A618 HydrophobicContact CB-CB 3.84Å; K583-A618 HydrophobicContact CD-CB 4.21Å
584	L	97.1	Very high	96	Very high	59 Å²	59	41.1 Å²	41.1	31%	0.309	21%	0.206	S	C	.	.	H	α-helix	trans	-63	-41.1	177.7	-71.8	175.3	0	0	0	111.6	D580 D581 L587 K588 A618 N621 W622	D580-L584 WeakPolarHBondContact O-CG 3.11Å; D580-L584 PolarHBondContact O-N 2.62Å; D581-L584 PolarHBondContact O-N 3.34Å; L584-L587 WeakPolarHBondContact O-CB 3.49Å; L584-L587 PolarHBondContact O-N 2.69Å; L584-K588 PolarHBondContact O-N 3.45Å; L584-A618 VanDerWaalsContact CD2-O 3.3Å; L584-A618 WeakPolarHBondContact CD2-O 3.4Å; L584-N621 HydrophobicContact CD2-CB 3.99Å; L584-W622 HydrophobicContact CD2-CB 4.01Å
585	H	97.3	Very high	96	Very high	33 Å²	33	43.7 Å²	43.7	15%	0.153	21%	0.213	C	C	.	.	H	α-helix	trans	-69.8	-36.9	-179.8	-159.8	80.8	0	0	0	112.7	F539 P541 I544 D545 D581 G582 K583 L587 K588 V589	F539-H585 HydrophobicContact CE2-CB 4.07Å; F539-H585 HydrophobicContact CZ-CB 3.54Å; F539-H585 AromaticContact CZ-CG 3.72Å; P541-H585 VanDerWaalsContact CB-CE1 3.41Å; P541-H585 WeakPolarHBondContact CB-CE1 3.13Å; P541-H585 VanDerWaalsContact CB-NE2 3.35Å; P541-H585 WeakPolarHBondContact CB-NE2 3.27Å; P541-H585 PolarHBondContact O-NE2 3.26Å; I544-H585 HydrophobicContact CD1-CB 4.31Å; D545-H585 IonicContact OD1-NE2 2.72Å; D545-H585 PolarHBondContact OD1-NE2 3.39Å; D581-H585 VanDerWaalsContact O-CB 3.26Å; D581-H585 WeakPolarHBondContact O-CB 3.4Å; D581-H585 PolarHBondContact O-N 2.7Å; G582-H585 PolarHBondContact O-N 3.02Å; K583-H585 VanDerWaalsContact C-N 3.34Å; H585-L587 VanDerWaalsContact C-N 3.28Å; H585-L587 PolarHBondContact O-N 2.84Å; H585-K588 WeakPolarHBondContact O-CB 3.42Å; H585-K588 PolarHBondContact O-N 2.83Å; H585-V589 WeakPolarHBondContact O-CG2 3.34Å; H585-V589 PolarHBondContact O-N 2.99Å
586	I	97.8	Very high	96.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-56.9	-43.3	170	-83.2	-152	0	0	0	111.4	I544 L548 L573 T577 G582 K583 V589 V590 M608 I613 V614	I544-I586 HydrophobicContact CD1-CG1 4.26Å; I544-I586 HydrophobicContact CG2-CD1 4.48Å; I544-I586 HydrophobicContact CG2-CG1 3.56Å; L548-I586 HydrophobicContact CD2-CB 4.07Å; L548-I586 HydrophobicContact CD2-CD1 4.15Å; L548-I586 HydrophobicContact CD2-CG1 3.89Å; L548-I586 HydrophobicContact CD2-CG2 3.84Å; L573-I586 HydrophobicContact CD2-CD1 3.76Å; T577-I586 HydrophobicContact CG2-CB 4.21Å; T577-I586 HydrophobicContact CG2-CD1 3.26Å; T577-I586 HydrophobicContact CG2-CG1 3.64Å; G582-I586 PolarHBondContact O-N 2.95Å; K583-I586 PolarHBondContact O-N 2.73Å; I586-V589 PolarHBondContact O-N 3.4Å; I586-V590 HydrophobicContact CG2-CG2 4.47Å; I586-V590 WeakPolarHBondContact O-CG2 3.21Å; I586-V590 PolarHBondContact O-N 2.89Å; I586-M608 HydrophobicContact CG2-CE 4.47Å; I586-M608 HydrophobicContact CG2-SD 3.6Å; I586-I613 HydrophobicContact CD1-CG2 4.16Å; I586-V614 HydrophobicContact CG2-CG1 4.41Å
587	L	98.4	Very high	96.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-66.4	-40	179.2	-67.7	168.5	0	0	0	111.8	K583 L584 H585 V590 Y591 V605 M608 V614 A618 V619 W622	K583-L587 WeakPolarHBondContact O-CG 3.44Å; K583-L587 PolarHBondContact O-N 3.43Å; L584-L587 WeakPolarHBondContact O-CB 3.49Å; L584-L587 PolarHBondContact O-N 2.69Å; H585-L587 VanDerWaalsContact C-N 3.28Å; H585-L587 PolarHBondContact O-N 2.84Å; L587-V590 PolarHBondContact O-N 3.23Å; L587-Y591 PolarHBondContact O-N 3.04Å; L587-V605 HydrophobicContact CD2-CG2 3.86Å; L587-M608 HydrophobicContact CD2-CE 3.85Å; L587-V614 HydrophobicContact CD1-CG1 4.44Å; L587-V614 HydrophobicContact CD2-CG1 4.45Å; L587-V614 HydrophobicContact CD2-CG2 4.4Å; L587-V614 HydrophobicContact CG-CG1 4.22Å; L587-A618 HydrophobicContact CD1-CB 4.4Å; L587-V619 HydrophobicContact CD1-CG2 3.92Å; L587-V619 HydrophobicContact CD2-CG2 4.23Å; L587-W622 HydrophobicContact CB-CB 4.17Å; L587-W622 HydrophobicContact CB-CD2 3.71Å; L587-W622 HydrophobicContact CB-CE3 4.24Å; L587-W622 HydrophobicContact CB-CG 3.63Å; L587-W622 HydrophobicContact CD1-CB 3.72Å; L587-W622 HydrophobicContact CD1-CD2 4.25Å; L587-W622 HydrophobicContact CD1-CE3 4.25Å; L587-W622 HydrophobicContact CD1-CG 4.03Å; L587-W622 HydrophobicContact CD2-CE3 4.22Å; L587-W622 HydrophobicContact CG-CD2 4.39Å; L587-W622 HydrophobicContact CG-CE3 4.48Å; L587-W622 HydrophobicContact CG-CG 4.42Å
588	K	97.8	Very high	96.5	Very high	57 Å²	57	42.7 Å²	42.7	25%	0.248	21%	0.207	C	C	.	.	H	α-helix	trans	-57.4	-50.6	172	-179.6	-178.9	-178.3	131.9	0	111.6	L584 H585 V590 Y591 E592 D627	L584-K588 PolarHBondContact O-N 3.45Å; H585-K588 WeakPolarHBondContact O-CB 3.42Å; H585-K588 PolarHBondContact O-N 2.83Å; K588-V590 VanDerWaalsContact C-N 3.33Å; K588-V590 PolarHBondContact O-N 3.3Å; K588-Y591 WeakPolarHBondContact O-CB 3.49Å; K588-Y591 PolarHBondContact O-N 3.04Å; K588-Y591 VanDerWaalsContact O-N 3.12Å; K588-E592 WeakPolarHBondContact CE-OE1 3.49Å; K588-E592 WeakPolarHBondContact O-CG 3.23Å; K588-E592 PolarHBondContact O-N 3.31Å; K588-D627 WeakPolarHBondContact CD-OD2 3.24Å; K588-D627 WeakPolarHBondContact CE-OD2 3.26Å; K588-D627 IonicContact NZ-OD1 3.46Å; K588-D627 PolarHBondContact NZ-OD1 2.95Å; K588-D627 IonicContact NZ-OD2 3.3Å; K588-D627 PolarHBondContact NZ-OD2 3.23Å
589	V	97.6	Very high	96.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.1	-40.7	178.9	174.4	0	0	0	0	111.5	I544 D545 L548 Q549 H585 I586 Y591 E592 V593	I544-V589 HydrophobicContact CG2-CG2 4.35Å; D545-V589 WeakPolarHBondContact OD1-CG2 3.27Å; L548-V589 HydrophobicContact CB-CG1 4.09Å; L548-V589 HydrophobicContact CD2-CB 4Å; L548-V589 HydrophobicContact CD2-CG1 3.9Å; L548-V589 HydrophobicContact CG-CG1 4.02Å; Q549-V589 HydrophobicContact CG-CG1 3.58Å; H585-V589 WeakPolarHBondContact O-CG2 3.34Å; H585-V589 PolarHBondContact O-N 2.99Å; I586-V589 PolarHBondContact O-N 3.4Å; V589-Y591 VanDerWaalsContact C-N 3.3Å; V589-Y591 PolarHBondContact O-N 3.22Å; V589-E592 PolarHBondContact O-N 3.4Å; V589-V593 HydrophobicContact CG1-CG1 4.44Å; V589-V593 WeakPolarHBondContact O-CG1 3.45Å; V589-V593 WeakPolarHBondContact O-CG2 3.47Å; V589-V593 PolarHBondContact O-N 3.03Å; V589-V593 VanDerWaalsContact O-N 3.1Å
590	V	98.2	Very high	97.1	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.012	17%	0.17	C	C	.	.	H	α-helix	trans	-58.5	-42.4	174.5	167	0	0	0	0	111.2	L548 L552 I586 L587 K588 W594 I601 L604 M608	L548-V590 HydrophobicContact CD2-CG2 4.09Å; L552-V590 HydrophobicContact CD1-CG2 4.16Å; I586-V590 HydrophobicContact CG2-CG2 4.47Å; I586-V590 WeakPolarHBondContact O-CG2 3.21Å; I586-V590 PolarHBondContact O-N 2.89Å; L587-V590 PolarHBondContact O-N 3.23Å; K588-V590 VanDerWaalsContact C-N 3.33Å; K588-V590 PolarHBondContact O-N 3.3Å; V590-W594 WeakPolarHBondContact O-CB 3.42Å; V590-W594 PolarHBondContact O-N 2.9Å; V590-I601 HydrophobicContact CG1-CG2 4.46Å; V590-L604 HydrophobicContact CG1-CB 4.29Å; V590-L604 HydrophobicContact CG1-CD1 4.08Å; V590-M608 HydrophobicContact CB-CE 4.5Å; V590-M608 HydrophobicContact CG1-CE 4.4Å; V590-M608 HydrophobicContact CG2-CE 3.81Å; V590-M608 HydrophobicContact CG2-SD 4.23Å
591	Y	97.9	Very high	97.3	Very high	19 Å²	19	30.9 Å²	30.9	8%	0.075	14%	0.144	C	C	.	.	H	α-helix	trans	-64.2	-50.8	174.6	176.1	-104.3	0	0	0	111.8	L587 K588 V589 V593 W594 R595 I601 M628 H630 E631	L587-Y591 PolarHBondContact O-N 3.04Å; K588-Y591 WeakPolarHBondContact O-CB 3.49Å; K588-Y591 PolarHBondContact O-N 3.04Å; K588-Y591 VanDerWaalsContact O-N 3.12Å; V589-Y591 VanDerWaalsContact C-N 3.3Å; V589-Y591 PolarHBondContact O-N 3.22Å; Y591-V593 VanDerWaalsContact C-N 3.27Å; Y591-V593 PolarHBondContact O-N 2.65Å; Y591-W594 CarbonylContact O-C 3.46Å; Y591-W594 PolarHBondContact O-N 3.18Å; Y591-W594 VanDerWaalsContact O-N 3.16Å; Y591-R595 HydrophobicContact CD2-CB 4.43Å; Y591-R595 HydrophobicContact CE1-CB 4.29Å; Y591-R595 HydrophobicContact CE2-CB 3.93Å; Y591-R595 VanDerWaalsContact O-CA 3.3Å; Y591-R595 WeakPolarHBondContact O-CA 3.33Å; Y591-R595 WeakPolarHBondContact O-CB 3.4Å; Y591-R595 PolarHBondContact O-N 3.04Å; Y591-I601 HydrophobicContact CD2-CD1 3.87Å; Y591-I601 HydrophobicContact CE2-CD1 4.48Å; Y591-M628 HydrophobicContact CD1-SD 3.97Å; Y591-M628 HydrophobicContact CD2-CE 3.68Å; Y591-M628 HydrophobicContact CD2-SD 3.71Å; Y591-M628 HydrophobicContact CE1-SD 4.31Å; Y591-M628 HydrophobicContact CE2-CE 3.8Å; Y591-M628 HydrophobicContact CE2-SD 4.09Å; Y591-M628 HydrophobicContact CG-CE 4.28Å; Y591-M628 HydrophobicContact CG-SD 3.67Å; Y591-H630 AromaticContact CZ-NE2 3.72Å; Y591-H630 PolarHBondContact OH-NE2 3.05Å; Y591-E631 HydrophobicContact CE2-CG 3.88Å; Y591-E631 WeakPolarHBondContact OH-CG 3.43Å; Y591-E631 PolarHBondContact OH-OE1 3.2Å
592	E	95.9	Very high	97.6	Very high	65 Å²	65	27.4 Å²	27.4	30%	0.304	13%	0.129	S	C	.	.	H	α-helix	trans	-55.5	-42.7	-176.8	-73.1	178.6	-175.3	0	0	112.5	K588 V589	K588-E592 WeakPolarHBondContact CE-OE1 3.49Å; K588-E592 WeakPolarHBondContact O-CG 3.23Å; K588-E592 PolarHBondContact O-N 3.31Å; V589-E592 PolarHBondContact O-N 3.4Å
593	V	96.7	Very high	97.7	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-80.5	-24.6	-178	-55.6	0	0	0	0	114	F483 S484 Q549 L552 V589 Y591	F483-V593 HydrophobicContact CD2-CB 4.21Å; F483-V593 HydrophobicContact CD2-CG2 4.39Å; F483-V593 HydrophobicContact CE2-CB 3.52Å; F483-V593 HydrophobicContact CE2-CG1 4.33Å; F483-V593 HydrophobicContact CE2-CG2 3.59Å; F483-V593 HydrophobicContact CZ-CB 3.7Å; F483-V593 HydrophobicContact CZ-CG1 4.04Å; F483-V593 HydrophobicContact CZ-CG2 4.12Å; S484-V593 PolarHBondContact N-O 3.02Å; S484-V593 WeakPolarHBondContact O-CA 3.32Å; Q549-V593 HydrophobicContact CB-CG1 4.29Å; Q549-V593 VanDerWaalsContact CD-CG1 3.43Å; Q549-V593 HydrophobicContact CG-CG1 3.57Å; L552-V593 HydrophobicContact CD1-CG2 3.8Å; V589-V593 HydrophobicContact CG1-CG1 4.44Å; V589-V593 WeakPolarHBondContact O-CG1 3.45Å; V589-V593 WeakPolarHBondContact O-CG2 3.47Å; V589-V593 PolarHBondContact O-N 3.03Å; V589-V593 VanDerWaalsContact O-N 3.1Å; Y591-V593 VanDerWaalsContact C-N 3.27Å; Y591-V593 PolarHBondContact O-N 2.65Å
594	W	97.8	Very high	97.8	Very high	6 Å²	6	27.9 Å²	27.9	2%	0.023	13%	0.134	C	C	.	.	H	α-helix	trans	-119.8	17.6	-176.2	-70.9	119.9	0	0	0	114.6	F483 A556 V590 Y591 N596 H597 M600 I601	F483-W594 HydrophobicContact CB-CE3 4.35Å; F483-W594 HydrophobicContact CB-CH2 3.9Å; F483-W594 HydrophobicContact CB-CZ2 4.46Å; F483-W594 HydrophobicContact CB-CZ3 3.83Å; F483-W594 AromaticContact CD2-CD2 3.78Å; F483-W594 HydrophobicContact CD2-CD2 3.78Å; F483-W594 AromaticContact CD2-CE2 3.42Å; F483-W594 VanDerWaalsContact CD2-CE2 3.42Å; F483-W594 HydrophobicContact CD2-CE3 4.03Å; F483-W594 AromaticContact CD2-CH2 3.7Å; F483-W594 HydrophobicContact CD2-CH2 3.7Å; F483-W594 AromaticContact CD2-CZ2 3.38Å; F483-W594 HydrophobicContact CD2-CZ2 3.38Å; F483-W594 AromaticContact CD2-CZ3 4Å; F483-W594 HydrophobicContact CD2-CZ3 4Å; F483-W594 AromaticContact CD2-NE1 3.94Å; F483-W594 HydrophobicContact CE2-CD2 4.39Å; F483-W594 AromaticContact CE2-CE2 3.82Å; F483-W594 HydrophobicContact CE2-CZ2 4Å; F483-W594 AromaticContact CE2-NE1 3.86Å; F483-W594 HydrophobicContact CG-CH2 4.26Å; F483-W594 HydrophobicContact CG-CZ2 4.34Å; F483-W594 HydrophobicContact CG-CZ3 4.44Å; A556-W594 HydrophobicContact CB-CH2 3.72Å; A556-W594 HydrophobicContact CB-CZ2 3.83Å; V590-W594 WeakPolarHBondContact O-CB 3.42Å; V590-W594 PolarHBondContact O-N 2.9Å; Y591-W594 CarbonylContact O-C 3.46Å; Y591-W594 PolarHBondContact O-N 3.18Å; Y591-W594 VanDerWaalsContact O-N 3.16Å; W594-N596 PolarHBondContact O-N 3.29Å; W594-H597 HydrophobicContact CE3-CB 3.8Å; W594-H597 HydrophobicContact CZ3-CB 4.37Å; W594-H597 AromaticContact CZ3-CD2 3.89Å; W594-H597 CarbonylContact O-C 3.48Å; W594-H597 WeakPolarHBondContact O-CA 3.31Å; W594-H597 PolarHBondContact O-N 3.48Å; W594-M600 HydrophobicContact CB-CG 4.42Å; W594-M600 HydrophobicContact CD2-CB 4.12Å; W594-M600 HydrophobicContact CD2-CG 3.52Å; W594-M600 VanDerWaalsContact CE2-CG 3.5Å; W594-M600 HydrophobicContact CE3-CB 4.28Å; W594-M600 HydrophobicContact CE3-CG 4.07Å; W594-M600 HydrophobicContact CG-CB 4.27Å; W594-M600 HydrophobicContact CG-CG 3.69Å; W594-M600 HydrophobicContact CH2-CE 3.85Å; W594-M600 HydrophobicContact CH2-CG 4.48Å; W594-M600 HydrophobicContact CZ2-CE 3.67Å; W594-M600 HydrophobicContact CZ2-CG 4.02Å; W594-M600 HydrophobicContact CZ2-SD 4.45Å; W594-M600 HydrophobicContact CZ3-CE 4.47Å; W594-I601 HydrophobicContact CB-CD1 4.39Å; W594-I601 HydrophobicContact CB-CG1 3.72Å; W594-I601 WeakPolarHBondContact O-CD1 3.43Å
595	R	96.1	Very high	97.8	Very high	125 Å²	125	25.1 Å²	25.1	47%	0.472	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-32.4	-176.6	61.2	-179.1	-177.8	-177.1	-1.1	114.5	Y591 H597	Y591-R595 HydrophobicContact CD2-CB 4.43Å; Y591-R595 HydrophobicContact CE1-CB 4.29Å; Y591-R595 HydrophobicContact CE2-CB 3.93Å; Y591-R595 VanDerWaalsContact O-CA 3.3Å; Y591-R595 WeakPolarHBondContact O-CA 3.33Å; Y591-R595 WeakPolarHBondContact O-CB 3.4Å; Y591-R595 PolarHBondContact O-N 3.04Å; R595-H597 VanDerWaalsContact C-N 3.34Å
596	N	96.1	Very high	97.9	Very high	54 Å²	54	25.3 Å²	25.3	29%	0.289	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-5.7	177.8	-65.2	-13.2	0	0	0	113.4	E480 P481 W594 P598	E480-N596 WeakPolarHBondContact O-CB 3.38Å; P481-N596 WeakPolarHBondContact CA-O 3.31Å; W594-N596 PolarHBondContact O-N 3.29Å; N596-P598 VanDerWaalsContact C-CD 3.48Å; N596-P598 WeakPolarHBondContact O-CD 3.46Å
597	H	98.3	Very high	97.9	Very high	31 Å²	31	28.6 Å²	28.6	14%	0.144	14%	0.136	C	C	.	.			trans	-125.4	71.7	-179.5	-164.5	-3.3	0	0	0	112.3	P481 F559 W594 R595 Q599 M600 I601	P481-H597 HydrophobicContact CB-CB 3.83Å; F559-H597 AromaticContact CE1-NE2 3.94Å; W594-H597 HydrophobicContact CE3-CB 3.8Å; W594-H597 HydrophobicContact CZ3-CB 4.37Å; W594-H597 AromaticContact CZ3-CD2 3.89Å; W594-H597 CarbonylContact O-C 3.48Å; W594-H597 WeakPolarHBondContact O-CA 3.31Å; W594-H597 PolarHBondContact O-N 3.48Å; R595-H597 VanDerWaalsContact C-N 3.34Å; H597-Q599 PolarHBondContact O-N 3.11Å; H597-Q599 VanDerWaalsContact O-N 3.09Å; H597-M600 HydrophobicContact CB-CB 4.09Å; H597-M600 WeakPolarHBondContact O-CB 3.38Å; H597-M600 PolarHBondContact O-N 3Å; H597-I601 PolarHBondContact O-N 3.17Å
598	P	98.3	Very high	97.9	Very high	5 Å²	5	28.7 Å²	28.7	3%	0.032	14%	0.136	C	C	.	.	H	α-helix	trans	-54.8	-33.6	-178.2	-29.9	37.4	0	0	0	115.3	E454 N596 M600 I601 A602 F636	E454-P598 WeakPolarHBondContact OE1-CG 3.34Å; N596-P598 VanDerWaalsContact C-CD 3.48Å; N596-P598 WeakPolarHBondContact O-CD 3.46Å; P598-M600 VanDerWaalsContact C-N 3.34Å; P598-M600 PolarHBondContact O-N 3.16Å; P598-I601 PolarHBondContact O-N 3.49Å; P598-A602 PolarHBondContact O-N 3.33Å; P598-F636 HydrophobicContact CB-CB 3.85Å; P598-F636 HydrophobicContact CB-CD1 4Å; P598-F636 HydrophobicContact CB-CD2 3.88Å; P598-F636 HydrophobicContact CB-CE2 4.44Å; P598-F636 HydrophobicContact CB-CG 3.64Å; P598-F636 HydrophobicContact CG-CD1 4.28Å; P598-F636 HydrophobicContact CG-CG 4.4Å
599	Q	98.6	Very high	97.9	Very high	62 Å²	62	26.9 Å²	26.9	29%	0.29	13%	0.129	S	C	.	.	H	α-helix	trans	-63.1	-38.7	175.8	-170.9	-174.5	15.6	0	0	112.3	R458 F559 H597 A602 V603	R458-Q599 HydrophobicContact CG-CB 4.31Å; F559-Q599 HydrophobicContact CE2-CG 4.26Å; F559-Q599 HydrophobicContact CZ-CB 4.46Å; F559-Q599 HydrophobicContact CZ-CG 3.8Å; H597-Q599 PolarHBondContact O-N 3.11Å; H597-Q599 VanDerWaalsContact O-N 3.09Å; Q599-A602 PolarHBondContact O-N 2.87Å; Q599-V603 PolarHBondContact O-N 3.01Å
600	M	98.5	Very high	97.9	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.015	16%	0.158	C	C	.	.	H	α-helix	trans	-65.6	-45.8	175.6	179	63.7	86.2	0	0	110.7	F559 W594 H597 P598 A602 V603 L604	F559-M600 HydrophobicContact CD1-CE 3.41Å; F559-M600 VanDerWaalsContact CD1-CE 3.41Å; F559-M600 HydrophobicContact CD1-SD 3.52Å; F559-M600 VanDerWaalsContact CD1-SD 3.52Å; F559-M600 HydrophobicContact CE1-CB 4.11Å; F559-M600 HydrophobicContact CE1-CE 3.68Å; F559-M600 HydrophobicContact CE1-SD 3.77Å; W594-M600 HydrophobicContact CB-CG 4.42Å; W594-M600 HydrophobicContact CD2-CB 4.12Å; W594-M600 HydrophobicContact CD2-CG 3.52Å; W594-M600 VanDerWaalsContact CE2-CG 3.5Å; W594-M600 HydrophobicContact CE3-CB 4.28Å; W594-M600 HydrophobicContact CE3-CG 4.07Å; W594-M600 HydrophobicContact CG-CB 4.27Å; W594-M600 HydrophobicContact CG-CG 3.69Å; W594-M600 HydrophobicContact CH2-CE 3.85Å; W594-M600 HydrophobicContact CH2-CG 4.48Å; W594-M600 HydrophobicContact CZ2-CE 3.67Å; W594-M600 HydrophobicContact CZ2-CG 4.02Å; W594-M600 HydrophobicContact CZ2-SD 4.45Å; W594-M600 HydrophobicContact CZ3-CE 4.47Å; H597-M600 HydrophobicContact CB-CB 4.09Å; H597-M600 WeakPolarHBondContact O-CB 3.38Å; H597-M600 PolarHBondContact O-N 3Å; P598-M600 VanDerWaalsContact C-N 3.34Å; P598-M600 PolarHBondContact O-N 3.16Å; M600-A602 VanDerWaalsContact C-N 3.29Å; M600-A602 PolarHBondContact O-N 3.15Å; M600-V603 VanDerWaalsContact O-CG2 3.26Å; M600-V603 WeakPolarHBondContact O-CG2 3.27Å; M600-V603 PolarHBondContact O-N 2.94Å; M600-V603 HydrophobicContact SD-CG2 4.17Å; M600-L604 HydrophobicContact CG-CD1 3.75Å; M600-L604 HydrophobicContact CG-CG 4.13Å; M600-L604 WeakPolarHBondContact O-CB 3.47Å; M600-L604 VanDerWaalsContact O-CG 3.3Å; M600-L604 WeakPolarHBondContact O-CG 3.12Å; M600-L604 PolarHBondContact O-N 2.71Å; M600-L604 HydrophobicContact SD-CD1 3.96Å; M600-L604 HydrophobicContact SD-CD2 4.18Å; M600-L604 HydrophobicContact SD-CG 3.86Å
601	I	98.7	Very high	97.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-53.5	-50.5	175.9	-60.7	175.4	0	0	0	109.9	V590 Y591 W594 H597 P598 V603 L604 V605 W622 F636 I640	V590-I601 HydrophobicContact CG1-CG2 4.46Å; Y591-I601 HydrophobicContact CD2-CD1 3.87Å; Y591-I601 HydrophobicContact CE2-CD1 4.48Å; W594-I601 HydrophobicContact CB-CD1 4.39Å; W594-I601 HydrophobicContact CB-CG1 3.72Å; W594-I601 WeakPolarHBondContact O-CD1 3.43Å; H597-I601 PolarHBondContact O-N 3.17Å; P598-I601 PolarHBondContact O-N 3.49Å; I601-V603 VanDerWaalsContact C-N 3.34Å; I601-V603 PolarHBondContact O-N 3.12Å; I601-L604 PolarHBondContact O-N 3.08Å; I601-V605 HydrophobicContact CG2-CG2 4.23Å; I601-V605 WeakPolarHBondContact O-CB 2.97Å; I601-V605 VanDerWaalsContact O-CG2 3.3Å; I601-V605 WeakPolarHBondContact O-CG2 3.45Å; I601-V605 PolarHBondContact O-N 2.83Å; I601-W622 HydrophobicContact CG2-CH2 3.74Å; I601-W622 HydrophobicContact CG2-CZ2 4.49Å; I601-F636 HydrophobicContact CD1-CE2 4.41Å; I601-I640 HydrophobicContact CG2-CD1 3.87Å
602	A	98.7	Very high	97.7	Very high	25 Å²	25	42 Å²	42	21%	0.207	20%	0.195	C	C	.	.	H	α-helix	trans	-59.5	-42.1	-177.5	0	0	0	0	0	113.2	P598 Q599 M600 D606 I640	P598-A602 PolarHBondContact O-N 3.33Å; Q599-A602 PolarHBondContact O-N 2.87Å; M600-A602 VanDerWaalsContact C-N 3.29Å; M600-A602 PolarHBondContact O-N 3.15Å; A602-D606 WeakPolarHBondContact O-CB 3.35Å; A602-D606 PolarHBondContact O-N 3.42Å; A602-I640 HydrophobicContact CB-CD1 4.18Å; A602-I640 HydrophobicContact CB-CG1 3.81Å
603	V	98.6	Very high	97.8	Very high	38 Å²	38	38.9 Å²	38.9	23%	0.23	18%	0.181	C	C	.	.	H	α-helix	trans	-77.1	-30.7	-179.9	-59.1	0	0	0	0	113.2	F559 F563 Q599 M600 I601 K607	F559-V603 HydrophobicContact CD1-CG2 3.98Å; F559-V603 HydrophobicContact CD2-CG2 4.25Å; F559-V603 HydrophobicContact CE1-CG2 4.11Å; F559-V603 HydrophobicContact CE2-CG1 4.4Å; F559-V603 HydrophobicContact CE2-CG2 4.36Å; F559-V603 HydrophobicContact CG-CG2 4.07Å; F559-V603 HydrophobicContact CZ-CG2 4.31Å; F563-V603 HydrophobicContact CE1-CB 4.11Å; F563-V603 HydrophobicContact CE1-CG2 3.94Å; F563-V603 HydrophobicContact CZ-CB 3.83Å; F563-V603 HydrophobicContact CZ-CG2 3.87Å; Q599-V603 PolarHBondContact O-N 3.01Å; M600-V603 VanDerWaalsContact O-CG2 3.26Å; M600-V603 WeakPolarHBondContact O-CG2 3.27Å; M600-V603 PolarHBondContact O-N 2.94Å; M600-V603 HydrophobicContact SD-CG2 4.17Å; I601-V603 VanDerWaalsContact C-N 3.34Å; I601-V603 PolarHBondContact O-N 3.12Å; V603-K607 WeakPolarHBondContact O-CB 3.32Å; V603-K607 PolarHBondContact O-N 3.08Å
604	L	98.8	Very high	97.8	Very high	1 Å²	1	39 Å²	39	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-67.9	-46	173	-68.9	177.3	0	0	0	110.7	L552 F563 L566 V590 M600 I601 D606 K607 M608	L552-L604 HydrophobicContact CD2-CD1 4.28Å; F563-L604 HydrophobicContact CE1-CD2 4.47Å; L566-L604 HydrophobicContact CD1-CD2 3.91Å; V590-L604 HydrophobicContact CG1-CB 4.29Å; V590-L604 HydrophobicContact CG1-CD1 4.08Å; M600-L604 HydrophobicContact CG-CD1 3.75Å; M600-L604 HydrophobicContact CG-CG 4.13Å; M600-L604 WeakPolarHBondContact O-CB 3.47Å; M600-L604 VanDerWaalsContact O-CG 3.3Å; M600-L604 WeakPolarHBondContact O-CG 3.12Å; M600-L604 PolarHBondContact O-N 2.71Å; M600-L604 HydrophobicContact SD-CD1 3.96Å; M600-L604 HydrophobicContact SD-CD2 4.18Å; M600-L604 HydrophobicContact SD-CG 3.86Å; I601-L604 PolarHBondContact O-N 3.08Å; L604-D606 PolarHBondContact O-N 3.2Å; L604-K607 PolarHBondContact O-N 3.45Å; L604-M608 HydrophobicContact CB-CE 4.28Å; L604-M608 WeakPolarHBondContact O-CB 3.32Å; L604-M608 VanDerWaalsContact O-CG 3.25Å; L604-M608 WeakPolarHBondContact O-CG 3.37Å; L604-M608 PolarHBondContact O-N 3.3Å
605	V	98.8	Very high	97.8	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.006	20%	0.195	C	C	.	.	H	α-helix	trans	-60.3	-45.4	175.3	174.7	0	0	0	0	110.9	L587 I601 K607 M608 I609 V619 W622 I640	L587-V605 HydrophobicContact CD2-CG2 3.86Å; I601-V605 HydrophobicContact CG2-CG2 4.23Å; I601-V605 WeakPolarHBondContact O-CB 2.97Å; I601-V605 VanDerWaalsContact O-CG2 3.3Å; I601-V605 WeakPolarHBondContact O-CG2 3.45Å; I601-V605 PolarHBondContact O-N 2.83Å; V605-K607 VanDerWaalsContact C-N 3.32Å; V605-K607 PolarHBondContact O-N 3.35Å; V605-M608 HydrophobicContact CG2-CE 4.12Å; V605-M608 PolarHBondContact O-N 3.43Å; V605-I609 HydrophobicContact CG1-CD1 4Å; V605-I609 WeakPolarHBondContact O-CG1 3.19Å; V605-I609 PolarHBondContact O-N 3.23Å; V605-V619 HydrophobicContact CG1-CB 4.45Å; V605-V619 HydrophobicContact CG1-CG1 3.79Å; V605-V619 HydrophobicContact CG1-CG2 3.72Å; V605-W622 HydrophobicContact CG2-CH2 4.34Å; V605-W622 HydrophobicContact CG2-CZ3 3.93Å; V605-I640 HydrophobicContact CB-CG2 4.29Å; V605-I640 HydrophobicContact CG1-CG2 3.73Å
606	D	98.3	Very high	97.9	Very high	36 Å²	36	36.1 Å²	36.1	19%	0.193	18%	0.177	C	C	.	.	H	α-helix	trans	-57.5	-44.9	174.5	-176.2	82.7	0	0	0	112	A602 L604 R610 K647	A602-D606 WeakPolarHBondContact O-CB 3.35Å; A602-D606 PolarHBondContact O-N 3.42Å; L604-D606 PolarHBondContact O-N 3.2Å; D606-R610 WeakPolarHBondContact O-CG 3.43Å; D606-R610 PolarHBondContact O-N 3.29Å; D606-R610 VanDerWaalsContact O-N 3.16Å; D606-R610 IonicContact OD1-CZ 3.38Å; D606-R610 IonicContact OD1-NE 3.39Å; D606-R610 IonicContact OD1-NH2 3.31Å; D606-R610 PolarHBondContact OD1-NH2 3.33Å; D606-R610 VanDerWaalsContact OD1-NH2 3.14Å; D606-R610 IonicContact OD2-CZ 2.78Å; D606-R610 IonicContact OD2-NE 2.75Å; D606-R610 PolarHBondContact OD2-NE 2.92Å; D606-R610 IonicContact OD2-NH2 2.69Å; D606-R610 PolarHBondContact OD2-NH2 2.92Å; D606-K647 WeakPolarHBondContact OD1-CD 3.39Å; D606-K647 WeakPolarHBondContact OD1-CE 3.42Å; D606-K647 IonicContact OD1-NZ 3.44Å; D606-K647 PolarHBondContact OD1-NZ 3.16Å
607	K	98.3	Very high	97.9	Very high	69 Å²	69	35.3 Å²	35.3	30%	0.3	18%	0.178	S	C	.	.	H	α-helix	trans	-65	-45.2	179.1	-174.2	60.9	175.4	176.4	0	111.8	F563 L566 V603 L604 V605 I609 R610 T611	F563-K607 HydrophobicContact CD1-CB 4.09Å; F563-K607 HydrophobicContact CD1-CD 4.47Å; F563-K607 HydrophobicContact CD1-CG 3.93Å; F563-K607 HydrophobicContact CE1-CB 4.13Å; F563-K607 HydrophobicContact CE1-CG 4.45Å; F563-K607 HydrophobicContact CG-CG 4.46Å; L566-K607 HydrophobicContact CD1-CB 4.38Å; L566-K607 HydrophobicContact CD1-CG 4.05Å; V603-K607 WeakPolarHBondContact O-CB 3.32Å; V603-K607 PolarHBondContact O-N 3.08Å; L604-K607 PolarHBondContact O-N 3.45Å; V605-K607 VanDerWaalsContact C-N 3.32Å; V605-K607 PolarHBondContact O-N 3.35Å; K607-I609 VanDerWaalsContact C-N 3.35Å; K607-I609 PolarHBondContact O-N 2.92Å; K607-R610 PolarHBondContact O-N 3.3Å; K607-T611 HydrophobicContact CD-CG2 4.26Å; K607-T611 PolarHBondContact O-N 3.31Å; K607-T611 PolarHBondContact O-OG1 2.9Å
608	M	98.6	Very high	97.8	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-63.6	-37.3	-179.3	-71.8	-175.5	-65.8	0	0	112.3	L566 I586 L587 V590 L604 V605 Q612 I613 V614	L566-M608 HydrophobicContact CD1-CG 4.07Å; I586-M608 HydrophobicContact CG2-CE 4.47Å; I586-M608 HydrophobicContact CG2-SD 3.6Å; L587-M608 HydrophobicContact CD2-CE 3.85Å; V590-M608 HydrophobicContact CB-CE 4.5Å; V590-M608 HydrophobicContact CG1-CE 4.4Å; V590-M608 HydrophobicContact CG2-CE 3.81Å; V590-M608 HydrophobicContact CG2-SD 4.23Å; L604-M608 HydrophobicContact CB-CE 4.28Å; L604-M608 WeakPolarHBondContact O-CB 3.32Å; L604-M608 VanDerWaalsContact O-CG 3.25Å; L604-M608 WeakPolarHBondContact O-CG 3.37Å; L604-M608 PolarHBondContact O-N 3.3Å; V605-M608 HydrophobicContact CG2-CE 4.12Å; V605-M608 PolarHBondContact O-N 3.43Å; M608-Q612 PolarHBondContact O-N 2.77Å; M608-Q612 VanDerWaalsContact O-N 3.13Å; M608-I613 HydrophobicContact CB-CB 4.07Å; M608-I613 HydrophobicContact CB-CG2 4.46Å; M608-I613 HydrophobicContact CG-CB 4.27Å; M608-I613 HydrophobicContact CG-CD1 4.07Å; M608-I613 HydrophobicContact CG-CG2 4.33Å; M608-I613 PolarHBondContact O-N 3.06Å; M608-I613 HydrophobicContact SD-CG2 4.44Å; M608-V614 HydrophobicContact CB-CG2 3.88Å; M608-V614 PolarHBondContact O-N 3.29Å
609	I	98	Very high	97.9	Very high	19 Å²	19	33.9 Å²	33.9	10%	0.097	17%	0.172	C	C	.	.	H	α-helix	trans	-62.8	-49.8	171.6	-66.7	162.6	0	0	0	110.4	V605 K607 T611 Q612 V614 V619 T644 K647	V605-I609 HydrophobicContact CG1-CD1 4Å; V605-I609 WeakPolarHBondContact O-CG1 3.19Å; V605-I609 PolarHBondContact O-N 3.23Å; K607-I609 VanDerWaalsContact C-N 3.35Å; K607-I609 PolarHBondContact O-N 2.92Å; I609-T611 PolarHBondContact O-N 2.85Å; I609-Q612 PolarHBondContact O-N 3.44Å; I609-V614 WeakPolarHBondContact CA-O 3.39Å; I609-V614 HydrophobicContact CG1-CG2 4.02Å; I609-V619 HydrophobicContact CD1-CG2 4.03Å; I609-V619 HydrophobicContact CG1-CG2 4.07Å; I609-T644 HydrophobicContact CD1-CG2 3.87Å; I609-T644 WeakPolarHBondContact CD1-OG1 3.47Å; I609-K647 VanDerWaalsContact CD1-CE 3.43Å; I609-K647 HydrophobicContact CG2-CD 4.09Å
610	R	96.1	Very high	97.9	Very high	160 Å²	160	30.9 Å²	30.9	60%	0.604	16%	0.158	S	C	*	.	H	α-helix	trans	-63.9	-29	-177.2	-71.2	179.2	-164.2	-78.4	-8.1	113.5	D606 K607 K647	D606-R610 WeakPolarHBondContact O-CG 3.43Å; D606-R610 PolarHBondContact O-N 3.29Å; D606-R610 VanDerWaalsContact O-N 3.16Å; D606-R610 IonicContact OD1-CZ 3.38Å; D606-R610 IonicContact OD1-NE 3.39Å; D606-R610 IonicContact OD1-NH2 3.31Å; D606-R610 PolarHBondContact OD1-NH2 3.33Å; D606-R610 VanDerWaalsContact OD1-NH2 3.14Å; D606-R610 IonicContact OD2-CZ 2.78Å; D606-R610 IonicContact OD2-NE 2.75Å; D606-R610 PolarHBondContact OD2-NE 2.92Å; D606-R610 IonicContact OD2-NH2 2.69Å; D606-R610 PolarHBondContact OD2-NH2 2.92Å; K607-R610 PolarHBondContact O-N 3.3Å; R610-K647 HydrophobicContact CG-CD 4.22Å
611	T	96.4	Very high	97.8	Very high	32 Å²	32	32.6 Å²	32.6	20%	0.196	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	10.8	176.6	58.9	0	0	0	0	112.7	H570 K607 I609 I613	H570-T611 PolarHBondContact NE2-O 3.46Å; K607-T611 HydrophobicContact CD-CG2 4.26Å; K607-T611 PolarHBondContact O-N 3.31Å; K607-T611 PolarHBondContact O-OG1 2.9Å; I609-T611 PolarHBondContact O-N 2.85Å; T611-I613 PolarHBondContact O-N 3.5Å; T611-I613 VanDerWaalsContact O-N 3.1Å; T611-I613 VanDerWaalsContact OG1-CD1 3.32Å; T611-I613 WeakPolarHBondContact OG1-CD1 3.49Å
612	Q	96.1	Very high	97.8	Very high	146 Å²	146	32.8 Å²	32.8	68%	0.682	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	29.2	177.6	-56.5	174.4	-12.1	0	0	114	K574 M608 I609	K574-Q612 WeakPolarHBondContact CD-O 3.48Å; K574-Q612 WeakPolarHBondContact CE-O 3.46Å; K574-Q612 PolarHBondContact NZ-O 3.29Å; M608-Q612 PolarHBondContact O-N 2.77Å; M608-Q612 VanDerWaalsContact O-N 3.13Å; I609-Q612 PolarHBondContact O-N 3.44Å
613	I	97.9	Very high	97.8	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.159	C	C	.	.	S	Bend	trans	-71.6	-40.7	169.4	-66	165.4	0	0	0	108.4	L573 T577 I586 M608 T611	L573-I613 HydrophobicContact CB-CD1 4.21Å; L573-I613 HydrophobicContact CB-CG1 4.19Å; L573-I613 HydrophobicContact CB-CG2 4.22Å; L573-I613 HydrophobicContact CD1-CD1 3.79Å; T577-I613 WeakPolarHBondContact CB-O 3.5Å; T577-I613 HydrophobicContact CG2-CG2 4.02Å; T577-I613 PolarHBondContact OG1-O 3.29Å; I586-I613 HydrophobicContact CD1-CG2 4.16Å; M608-I613 HydrophobicContact CB-CB 4.07Å; M608-I613 HydrophobicContact CB-CG2 4.46Å; M608-I613 HydrophobicContact CG-CB 4.27Å; M608-I613 HydrophobicContact CG-CD1 4.07Å; M608-I613 HydrophobicContact CG-CG2 4.33Å; M608-I613 PolarHBondContact O-N 3.06Å; M608-I613 HydrophobicContact SD-CG2 4.44Å; T611-I613 PolarHBondContact O-N 3.5Å; T611-I613 VanDerWaalsContact O-N 3.1Å; T611-I613 VanDerWaalsContact OG1-CD1 3.32Å; T611-I613 WeakPolarHBondContact OG1-CD1 3.49Å
614	V	98.1	Very high	97.8	Very high	3 Å²	3	30.5 Å²	30.5	2%	0.018	15%	0.15	C	C	.	.	S	Bend	trans	-128.2	158.5	169.8	-56	0	0	0	0	108.9	K583 I586 L587 M608 I609 V619	K583-V614 HydrophobicContact CB-CB 4.39Å; K583-V614 HydrophobicContact CB-CG1 4Å; K583-V614 HydrophobicContact CG-CG1 4.39Å; I586-V614 HydrophobicContact CG2-CG1 4.41Å; L587-V614 HydrophobicContact CD1-CG1 4.44Å; L587-V614 HydrophobicContact CD2-CG1 4.45Å; L587-V614 HydrophobicContact CD2-CG2 4.4Å; L587-V614 HydrophobicContact CG-CG1 4.22Å; M608-V614 HydrophobicContact CB-CG2 3.88Å; M608-V614 PolarHBondContact O-N 3.29Å; I609-V614 WeakPolarHBondContact CA-O 3.39Å; I609-V614 HydrophobicContact CG1-CG2 4.02Å; V614-V619 HydrophobicContact CG2-CG2 3.79Å
615	D	96.5	Very high	97.7	Very high	56 Å²	56	32 Å²	32	30%	0.299	16%	0.161	S	C	.	.			trans	-101.5	175	172.3	56.4	49.1	0	0	0	111.5	K583 A617 A618 V619	K583-D615 WeakPolarHBondContact CD-OD2 3.33Å; K583-D615 WeakPolarHBondContact CE-OD2 3.33Å; K583-D615 IonicContact NZ-OD2 3.77Å; K583-D615 PolarHBondContact NZ-OD2 3.39Å; D615-A617 VanDerWaalsContact C-N 3.3Å; D615-A617 PolarHBondContact O-N 3.34Å; D615-A617 PolarHBondContact OD1-N 3.05Å; D615-A618 WeakPolarHBondContact OD1-CB 3.41Å; D615-A618 PolarHBondContact OD1-N 2.94Å; D615-V619 PolarHBondContact O-N 3.14Å
616	C	97.8	Very high	97.4	Very high	16 Å²	16	38.5 Å²	38.5	11%	0.108	19%	0.191	C	C	.	.	H	α-helix	trans	-66.1	-32.6	-178.5	-63.4	0	0	0	0	112.6	V619 A620 T644 L718	C616-V619 PolarHBondContact O-N 3.08Å; C616-A620 PolarHBondContact O-N 3.46Å; C616-T644 HydrophobicContact CB-CG2 3.59Å; C616-L718 HydrophobicContact CB-CD1 3.88Å; C616-L718 HydrophobicContact CB-CD2 3.8Å; C616-L718 HydrophobicContact CB-CG 4.38Å; C616-L718 WeakPolarHBondContact O-CD1 3.29Å
617	A	96.4	Very high	97.1	Very high	36 Å²	36	40.2 Å²	40.2	30%	0.298	20%	0.2	S	C	.	.	H	α-helix	trans	-71.3	-41.4	-178.1	0	0	0	0	0	111.4	D615 V619 A620 N621	D615-A617 VanDerWaalsContact C-N 3.3Å; D615-A617 PolarHBondContact O-N 3.34Å; D615-A617 PolarHBondContact OD1-N 3.05Å; A617-V619 VanDerWaalsContact C-N 3.31Å; A617-V619 PolarHBondContact O-N 3.02Å; A617-A620 PolarHBondContact O-N 3.32Å; A617-N621 WeakPolarHBondContact O-CB 3.32Å; A617-N621 PolarHBondContact O-N 3.09Å; A617-N621 PolarHBondContact O-ND2 3.05Å
618	A	97.6	Very high	97.1	Very high	6 Å²	6	36.9 Å²	36.9	5%	0.05	19%	0.186	C	C	.	.	H	α-helix	trans	-58.6	-43.5	173.1	0	0	0	0	0	111.3	K583 L584 L587 D615 N621 W622	K583-A618 HydrophobicContact CB-CB 3.84Å; K583-A618 HydrophobicContact CD-CB 4.21Å; L584-A618 VanDerWaalsContact CD2-O 3.3Å; L584-A618 WeakPolarHBondContact CD2-O 3.4Å; L587-A618 HydrophobicContact CD1-CB 4.4Å; D615-A618 WeakPolarHBondContact OD1-CB 3.41Å; D615-A618 PolarHBondContact OD1-N 2.94Å; A618-N621 PolarHBondContact O-N 3.22Å; A618-W622 WeakPolarHBondContact O-CB 3.46Å; A618-W622 PolarHBondContact O-N 2.63Å
619	V	98.6	Very high	96.9	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65	-43.4	176.9	174.5	0	0	0	0	111.7	L587 V605 I609 V614 D615 C616 A617 W622 L623 I640 T644	L587-V619 HydrophobicContact CD1-CG2 3.92Å; L587-V619 HydrophobicContact CD2-CG2 4.23Å; V605-V619 HydrophobicContact CG1-CB 4.45Å; V605-V619 HydrophobicContact CG1-CG1 3.79Å; V605-V619 HydrophobicContact CG1-CG2 3.72Å; I609-V619 HydrophobicContact CD1-CG2 4.03Å; I609-V619 HydrophobicContact CG1-CG2 4.07Å; V614-V619 HydrophobicContact CG2-CG2 3.79Å; D615-V619 PolarHBondContact O-N 3.14Å; C616-V619 PolarHBondContact O-N 3.08Å; A617-V619 VanDerWaalsContact C-N 3.31Å; A617-V619 PolarHBondContact O-N 3.02Å; V619-W622 HydrophobicContact CG1-CE3 4.43Å; V619-W622 PolarHBondContact O-N 3.49Å; V619-L623 HydrophobicContact CG1-CD1 4.23Å; V619-L623 HydrophobicContact CG1-CG 4.5Å; V619-L623 WeakPolarHBondContact O-CG 2.89Å; V619-L623 PolarHBondContact O-N 3.3Å; V619-L623 VanDerWaalsContact O-N 3.08Å; V619-I640 HydrophobicContact CG1-CG2 3.91Å; V619-T644 HydrophobicContact CB-CG2 4.32Å; V619-T644 HydrophobicContact CG1-CG2 4.3Å
620	A	98.3	Very high	96.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.6	-52.6	174.9	0	0	0	0	0	110.9	C616 A617 W622 L623 F624 L641 L718 V721 I722	C616-A620 PolarHBondContact O-N 3.46Å; A617-A620 PolarHBondContact O-N 3.32Å; A620-W622 VanDerWaalsContact C-N 3.32Å; A620-W622 PolarHBondContact O-N 3.15Å; A620-L623 PolarHBondContact O-N 3.22Å; A620-F624 WeakPolarHBondContact O-CD2 3.37Å; A620-F624 PolarHBondContact O-N 2.95Å; A620-L641 HydrophobicContact CB-CD1 4.39Å; A620-L718 HydrophobicContact CB-CD1 3.92Å; A620-V721 HydrophobicContact CB-CG1 4.24Å; A620-I722 HydrophobicContact CB-CG1 4.02Å
621	N	98	Very high	96.8	Very high	38 Å²	38	37.1 Å²	37.1	20%	0.203	20%	0.201	C	C	.	.	H	α-helix	trans	-58.5	-40.5	178.9	-77.9	-53.6	0	0	0	113.2	L584 A617 A618 F624 S625 R725	L584-N621 HydrophobicContact CD2-CB 3.99Å; A617-N621 WeakPolarHBondContact O-CB 3.32Å; A617-N621 PolarHBondContact O-N 3.09Å; A617-N621 PolarHBondContact O-ND2 3.05Å; A618-N621 PolarHBondContact O-N 3.22Å; N621-F624 PolarHBondContact O-N 3.12Å; N621-S625 PolarHBondContact O-N 3.29Å; N621-S625 VanDerWaalsContact O-N 3.14Å; N621-R725 VanDerWaalsContact OD1-CZ 3.31Å; N621-R725 PolarHBondContact OD1-NE 3.4Å; N621-R725 PolarHBondContact OD1-NH2 3.34Å
622	W	98.4	Very high	96.9	Very high	5 Å²	5	35.9 Å²	35.9	2%	0.019	19%	0.193	C	C	.	.	H	α-helix	trans	-62.6	-43.9	176.7	166.2	62.4	0	0	0	112.5	L584 L587 I601 V605 A618 V619 A620 F624 S625 M628 I640	L584-W622 HydrophobicContact CD2-CB 4.01Å; L587-W622 HydrophobicContact CB-CB 4.17Å; L587-W622 HydrophobicContact CB-CD2 3.71Å; L587-W622 HydrophobicContact CB-CE3 4.24Å; L587-W622 HydrophobicContact CB-CG 3.63Å; L587-W622 HydrophobicContact CD1-CB 3.72Å; L587-W622 HydrophobicContact CD1-CD2 4.25Å; L587-W622 HydrophobicContact CD1-CE3 4.25Å; L587-W622 HydrophobicContact CD1-CG 4.03Å; L587-W622 HydrophobicContact CD2-CE3 4.22Å; L587-W622 HydrophobicContact CG-CD2 4.39Å; L587-W622 HydrophobicContact CG-CE3 4.48Å; L587-W622 HydrophobicContact CG-CG 4.42Å; I601-W622 HydrophobicContact CG2-CH2 3.74Å; I601-W622 HydrophobicContact CG2-CZ2 4.49Å; V605-W622 HydrophobicContact CG2-CH2 4.34Å; V605-W622 HydrophobicContact CG2-CZ3 3.93Å; A618-W622 WeakPolarHBondContact O-CB 3.46Å; A618-W622 PolarHBondContact O-N 2.63Å; V619-W622 HydrophobicContact CG1-CE3 4.43Å; V619-W622 PolarHBondContact O-N 3.49Å; A620-W622 VanDerWaalsContact C-N 3.32Å; A620-W622 PolarHBondContact O-N 3.15Å; W622-F624 PolarHBondContact O-N 3.28Å; W622-S625 VanDerWaalsContact O-CB 3.22Å; W622-S625 WeakPolarHBondContact O-CB 3.47Å; W622-S625 PolarHBondContact O-N 3.3Å; W622-S625 PolarHBondContact O-OG 3.33Å; W622-M628 HydrophobicContact CH2-CE 4.49Å; W622-M628 HydrophobicContact CZ2-CE 3.89Å; W622-M628 HydrophobicContact CZ2-CG 4.3Å; W622-M628 HydrophobicContact CZ2-SD 3.65Å; W622-M628 VanDerWaalsContact O-CG 3.25Å; W622-M628 WeakPolarHBondContact O-CG 3.47Å; W622-I640 HydrophobicContact CH2-CD1 4.44Å; W622-I640 HydrophobicContact CZ3-CD1 4.47Å; W622-I640 HydrophobicContact CZ3-CG2 4.44Å
623	L	98.3	Very high	97	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-64.4	-28.8	179.7	-67	174.9	0	0	0	113.2	V619 A620 I637 I640 L641	V619-L623 HydrophobicContact CG1-CD1 4.23Å; V619-L623 HydrophobicContact CG1-CG 4.5Å; V619-L623 WeakPolarHBondContact O-CG 2.89Å; V619-L623 PolarHBondContact O-N 3.3Å; V619-L623 VanDerWaalsContact O-N 3.08Å; A620-L623 PolarHBondContact O-N 3.22Å; L623-I637 HydrophobicContact CB-CG2 4.38Å; L623-I637 HydrophobicContact CD2-CD1 4Å; L623-I637 HydrophobicContact CD2-CG2 4.12Å; L623-I640 HydrophobicContact CD1-CB 4.34Å; L623-I640 HydrophobicContact CD1-CG2 4.08Å; L623-I640 HydrophobicContact CD2-CG2 4.37Å; L623-L641 HydrophobicContact CD1-CB 3.69Å; L623-L641 HydrophobicContact CD1-CD1 4.11Å; L623-L641 HydrophobicContact CD1-CG 4.44Å
624	F	98.1	Very high	97	Very high	13 Å²	13	31 Å²	31	6%	0.057	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	5.2	174.8	-69.6	-80.1	0	0	0	113.6	A620 N621 W622 F632 W638 L641 I722 R725 F726 L729	A620-F624 WeakPolarHBondContact O-CD2 3.37Å; A620-F624 PolarHBondContact O-N 2.95Å; N621-F624 PolarHBondContact O-N 3.12Å; W622-F624 PolarHBondContact O-N 3.28Å; F624-F632 AromaticContact CD1-CE2 3.61Å; F624-F632 HydrophobicContact CD1-CE2 3.61Å; F624-F632 HydrophobicContact CD1-CZ 4.1Å; F624-F632 AromaticContact CE1-CE2 3.7Å; F624-F632 HydrophobicContact CE1-CE2 3.7Å; F624-F632 AromaticContact CE1-CZ 3.88Å; F624-F632 HydrophobicContact CE1-CZ 3.88Å; F624-W638 HydrophobicContact CE1-CH2 4.38Å; F624-W638 HydrophobicContact CZ-CH2 4.47Å; F624-W638 HydrophobicContact CZ-CZ3 4.36Å; F624-L641 HydrophobicContact CE2-CD2 4.34Å; F624-L641 HydrophobicContact CZ-CD2 4.41Å; F624-I722 HydrophobicContact CE2-CG2 4.4Å; F624-I722 HydrophobicContact CZ-CG2 4.41Å; F624-R725 HydrophobicContact CB-CB 3.87Å; F624-R725 HydrophobicContact CB-CG 3.95Å; F624-R725 HydrophobicContact CD1-CB 3.76Å; F624-R725 HydrophobicContact CD2-CB 3.66Å; F624-R725 HydrophobicContact CD2-CG 3.97Å; F624-R725 HydrophobicContact CE1-CB 4.17Å; F624-R725 HydrophobicContact CE2-CB 4.13Å; F624-R725 HydrophobicContact CG-CB 3.49Å; F624-R725 VanDerWaalsContact CG-CB 3.49Å; F624-R725 HydrophobicContact CG-CG 3.99Å; F624-R725 HydrophobicContact CZ-CB 4.36Å; F624-F726 HydrophobicContact CE1-CD1 4.1Å; F624-F726 HydrophobicContact CE1-CD2 4.18Å; F624-F726 HydrophobicContact CE1-CE1 4.06Å; F624-F726 HydrophobicContact CE1-CE2 4.14Å; F624-F726 HydrophobicContact CE1-CG 4.16Å; F624-F726 HydrophobicContact CE1-CZ 4.1Å; F624-F726 HydrophobicContact CZ-CD1 4.48Å; F624-F726 AromaticContact CZ-CD2 3.81Å; F624-F726 HydrophobicContact CZ-CD2 3.81Å; F624-F726 HydrophobicContact CZ-CE1 4.29Å; F624-F726 AromaticContact CZ-CE2 3.59Å; F624-F726 HydrophobicContact CZ-CE2 3.59Å; F624-F726 HydrophobicContact CZ-CG 4.27Å; F624-F726 AromaticContact CZ-CZ 3.87Å; F624-F726 HydrophobicContact CZ-CZ 3.87Å; F624-L729 HydrophobicContact CD1-CD1 3.67Å; F624-L729 HydrophobicContact CE1-CD1 4.36Å
625	S	96.4	Very high	97	Very high	33 Å²	33	31.1 Å²	31.1	23%	0.231	17%	0.17	C	C	.	.	S	Bend	trans	-73.6	159.1	-178.9	72.1	0	0	0	0	112.2	N621 W622 D627 M628 A629	N621-S625 PolarHBondContact O-N 3.29Å; N621-S625 VanDerWaalsContact O-N 3.14Å; W622-S625 VanDerWaalsContact O-CB 3.22Å; W622-S625 WeakPolarHBondContact O-CB 3.47Å; W622-S625 PolarHBondContact O-N 3.3Å; W622-S625 PolarHBondContact O-OG 3.33Å; S625-D627 PolarHBondContact O-N 3.35Å; S625-M628 PolarHBondContact O-N 3.12Å; S625-A629 PolarHBondContact O-N 3.46Å
626	Q	94.2	Very high	97.1	Very high	137 Å²	137	28.5 Å²	28.5	64%	0.64	16%	0.156	S	C	*	.	G	3₁₀ helix	trans	-61.2	-31.3	175.9	-67.9	-63.9	-21.2	0	0	112.6	M628 A629	Q626-M628 PolarHBondContact O-N 2.64Å; Q626-A629 WeakPolarHBondContact O-CB 3.42Å; Q626-A629 PolarHBondContact O-N 2.92Å
627	D	91.2	Very high	97.2	Very high	71 Å²	71	27.8 Å²	27.8	38%	0.38	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-63.6	-21.9	175.9	-70.5	-27.7	0	0	0	112.7	K588 S625 H630	K588-D627 WeakPolarHBondContact CD-OD2 3.24Å; K588-D627 WeakPolarHBondContact CE-OD2 3.26Å; K588-D627 IonicContact NZ-OD1 3.46Å; K588-D627 PolarHBondContact NZ-OD1 2.95Å; K588-D627 IonicContact NZ-OD2 3.3Å; K588-D627 PolarHBondContact NZ-OD2 3.23Å; S625-D627 PolarHBondContact O-N 3.35Å; D627-H630 PolarHBondContact O-CE1 3.49Å
628	M	97.1	Very high	97.3	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-104.5	0.6	-179.9	-63.1	-54.5	-58.4	0	0	113.3	Y591 W622 S625 Q626 H630 E631 F632 F636 I637	Y591-M628 HydrophobicContact CD1-SD 3.97Å; Y591-M628 HydrophobicContact CD2-CE 3.68Å; Y591-M628 HydrophobicContact CD2-SD 3.71Å; Y591-M628 HydrophobicContact CE1-SD 4.31Å; Y591-M628 HydrophobicContact CE2-CE 3.8Å; Y591-M628 HydrophobicContact CE2-SD 4.09Å; Y591-M628 HydrophobicContact CG-CE 4.28Å; Y591-M628 HydrophobicContact CG-SD 3.67Å; W622-M628 HydrophobicContact CH2-CE 4.49Å; W622-M628 HydrophobicContact CZ2-CE 3.89Å; W622-M628 HydrophobicContact CZ2-CG 4.3Å; W622-M628 HydrophobicContact CZ2-SD 3.65Å; W622-M628 VanDerWaalsContact O-CG 3.25Å; W622-M628 WeakPolarHBondContact O-CG 3.47Å; S625-M628 PolarHBondContact O-N 3.12Å; Q626-M628 PolarHBondContact O-N 2.64Å; M628-H630 VanDerWaalsContact C-N 3.29Å; M628-H630 PolarHBondContact O-N 3.15Å; M628-E631 HydrophobicContact CE-CB 4.05Å; M628-E631 HydrophobicContact CE-CG 4.15Å; M628-E631 PolarHBondContact O-N 3.39Å; M628-F632 PolarHBondContact O-N 3.26Å; M628-F636 HydrophobicContact CE-CZ 4.36Å; M628-I637 HydrophobicContact CE-CD1 3.38Å
629	A	95.8	Very high	97.3	Very high	47 Å²	47	28.4 Å²	28.4	39%	0.388	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-36.1	-171.5	0	0	0	0	0	113.5	S625 Q626 E631 F632	S625-A629 PolarHBondContact O-N 3.46Å; Q626-A629 WeakPolarHBondContact O-CB 3.42Å; Q626-A629 PolarHBondContact O-N 2.92Å; A629-E631 VanDerWaalsContact C-N 3.34Å; A629-F632 WeakPolarHBondContact O-CB 3.22Å; A629-F632 PolarHBondContact O-N 2.83Å
630	H	95.3	Very high	97.3	Very high	118 Å²	118	28.7 Å²	28.7	55%	0.546	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-19.2	178.5	61.2	-75	0	0	0	113.9	Y591 D627 M628	Y591-H630 AromaticContact CZ-NE2 3.72Å; Y591-H630 PolarHBondContact OH-NE2 3.05Å; D627-H630 PolarHBondContact O-CE1 3.49Å; M628-H630 VanDerWaalsContact C-N 3.29Å; M628-H630 PolarHBondContact O-N 3.15Å
631	E	96.7	Very high	97.4	Very high	21 Å²	21	28.7 Å²	28.7	10%	0.098	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-11.5	175.8	-56.7	-66.7	-166.9	0	0	112.6	Y591 M628 A629 T633 R634 F636 I637	Y591-E631 HydrophobicContact CE2-CG 3.88Å; Y591-E631 WeakPolarHBondContact OH-CG 3.43Å; Y591-E631 PolarHBondContact OH-OE1 3.2Å; M628-E631 HydrophobicContact CE-CB 4.05Å; M628-E631 HydrophobicContact CE-CG 4.15Å; M628-E631 PolarHBondContact O-N 3.39Å; A629-E631 VanDerWaalsContact C-N 3.34Å; E631-T633 PolarHBondContact O-N 3.02Å; E631-R634 VanDerWaalsContact CD-NH1 3.35Å; E631-R634 VanDerWaalsContact O-CB 3.32Å; E631-R634 WeakPolarHBondContact O-CB 3.35Å; E631-R634 PolarHBondContact O-N 2.65Å; E631-R634 IonicContact OE1-NH1 3.63Å; E631-R634 PolarHBondContact OE1-NH1 3.03Å; E631-R634 WeakPolarHBondContact OE2-CD 3.13Å; E631-R634 IonicContact OE2-CZ 2.76Å; E631-R634 IonicContact OE2-NE 3.65Å; E631-R634 IonicContact OE2-NH1 3.57Å; E631-R634 PolarHBondContact OE2-NH1 3.27Å; E631-F636 HydrophobicContact CB-CE1 4.13Å; E631-F636 HydrophobicContact CB-CZ 4Å; E631-F636 HydrophobicContact CG-CZ 4.24Å; E631-I637 HydrophobicContact CB-CD1 4.05Å; E631-I637 HydrophobicContact CB-CG1 4.23Å; E631-I637 VanDerWaalsContact O-CG1 3.31Å; E631-I637 WeakPolarHBondContact O-CG1 3.37Å
632	F	97.9	Very high	97.4	Very high	6 Å²	6	27.1 Å²	27.1	3%	0.026	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-36.6	-166.4	-175.1	-105.5	0	0	0	113.9	F624 M628 A629 R634 W638 L729 W748 C752	F624-F632 AromaticContact CD1-CE2 3.61Å; F624-F632 HydrophobicContact CD1-CE2 3.61Å; F624-F632 HydrophobicContact CD1-CZ 4.1Å; F624-F632 AromaticContact CE1-CE2 3.7Å; F624-F632 HydrophobicContact CE1-CE2 3.7Å; F624-F632 AromaticContact CE1-CZ 3.88Å; F624-F632 HydrophobicContact CE1-CZ 3.88Å; M628-F632 PolarHBondContact O-N 3.26Å; A629-F632 WeakPolarHBondContact O-CB 3.22Å; A629-F632 PolarHBondContact O-N 2.83Å; F632-R634 VanDerWaalsContact C-N 3.32Å; F632-R634 PolarHBondContact O-N 3.44Å; F632-W638 HydrophobicContact CD1-CZ2 4.17Å; F632-W638 HydrophobicContact CD2-CH2 4.47Å; F632-W638 HydrophobicContact CD2-CZ2 4.18Å; F632-W638 HydrophobicContact CE1-CH2 4.08Å; F632-W638 AromaticContact CE1-CZ2 3.75Å; F632-W638 HydrophobicContact CE1-CZ2 3.75Å; F632-W638 AromaticContact CE2-CH2 3.63Å; F632-W638 HydrophobicContact CE2-CH2 3.63Å; F632-W638 AromaticContact CE2-CZ2 3.74Å; F632-W638 HydrophobicContact CE2-CZ2 3.74Å; F632-W638 HydrophobicContact CG-CZ2 4.39Å; F632-W638 AromaticContact CZ-CH2 3.42Å; F632-W638 HydrophobicContact CZ-CH2 3.42Å; F632-W638 VanDerWaalsContact CZ-CH2 3.42Å; F632-W638 AromaticContact CZ-CZ2 3.53Å; F632-W638 HydrophobicContact CZ-CZ2 3.53Å; F632-W638 PolarHBondContact O-NE1 3.07Å; F632-L729 HydrophobicContact CE2-CD1 4.21Å; F632-L729 HydrophobicContact CZ-CD1 4.05Å; F632-W748 AromaticContact CD1-NE1 3.67Å; F632-W748 HydrophobicContact CE1-CZ2 4.46Å; F632-C752 HydrophobicContact CE1-CB 4.11Å
633	T	98.2	Very high	97.4	Very high	8 Å²	8	28.4 Å²	28.4	5%	0.049	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-10.8	-177.9	70.3	0	0	0	0	113.5	E442 K447 E631 N751	E442-T633 PolarHBondContact OE2-OG1 3.48Å; K447-T633 WeakPolarHBondContact CE-O 3.24Å; K447-T633 PolarHBondContact NZ-O 3.45Å; K447-T633 PolarHBondContact NZ-OG1 3.05Å; E631-T633 PolarHBondContact O-N 3.02Å; T633-N751 WeakPolarHBondContact CA-OD1 3.32Å; T633-N751 HydrophobicContact CG2-CB 4.25Å
634	R	98.3	Very high	97.4	Very high	36 Å²	36	28.3 Å²	28.3	14%	0.136	15%	0.149	C	C	.	.	S	Bend	trans	-78.7	150.5	-175.6	-68.4	175.7	69.4	-169.3	-0.7	112.7	E451 E454 E631 F632 F636 I637	E451-R634 VanDerWaalsContact OE1-CA 3.23Å; E451-R634 WeakPolarHBondContact OE1-CA 3.14Å; E451-R634 WeakPolarHBondContact OE1-CB 3.46Å; E454-R634 IonicContact OE1-NH2 2.7Å; E454-R634 IonicContact OE2-CZ 2.68Å; E454-R634 IonicContact OE2-NE 3.55Å; E454-R634 IonicContact OE2-NH2 3.27Å; E454-R634 PolarHBondContact OE2-NH2 2.91Å; E631-R634 VanDerWaalsContact CD-NH1 3.35Å; E631-R634 VanDerWaalsContact O-CB 3.32Å; E631-R634 WeakPolarHBondContact O-CB 3.35Å; E631-R634 PolarHBondContact O-N 2.65Å; E631-R634 IonicContact OE1-NH1 3.63Å; E631-R634 PolarHBondContact OE1-NH1 3.03Å; E631-R634 WeakPolarHBondContact OE2-CD 3.13Å; E631-R634 IonicContact OE2-CZ 2.76Å; E631-R634 IonicContact OE2-NE 3.65Å; E631-R634 IonicContact OE2-NH1 3.57Å; E631-R634 PolarHBondContact OE2-NH1 3.27Å; F632-R634 VanDerWaalsContact C-N 3.32Å; F632-R634 PolarHBondContact O-N 3.44Å; R634-F636 VanDerWaalsContact C-N 3.34Å; R634-F636 HydrophobicContact CB-CD1 3.8Å; R634-F636 HydrophobicContact CB-CE1 3.88Å; R634-F636 PolarHBondContact O-N 2.85Å; R634-I637 PolarHBondContact O-N 3.45Å
635	L	98.5	Very high	97.5	Very high	5 Å²	5	27.7 Å²	27.7	3%	0.026	15%	0.146	C	C	.	.	H	α-helix	trans	-58.3	-43.8	-172.1	-177.3	54.6	0	0	0	112.8	D411 I414 E451 K455 I637 W638 E639	D411-L635 HydrophobicContact CB-CD1 3.99Å; D411-L635 WeakPolarHBondContact OD1-CD1 3.3Å; I414-L635 HydrophobicContact CD1-CD2 4.45Å; I414-L635 HydrophobicContact CG2-CD2 3.94Å; E451-L635 PolarHBondContact OE1-N 3.08Å; E451-L635 WeakPolarHBondContact OE2-CB 3.3Å; K455-L635 VanDerWaalsContact CE-CD2 3.49Å; L635-I637 VanDerWaalsContact C-N 3.25Å; L635-I637 PolarHBondContact O-N 3.24Å; L635-W638 PolarHBondContact O-N 2.87Å; L635-E639 HydrophobicContact CD1-CG 4.33Å; L635-E639 HydrophobicContact CG-CG 4.07Å; L635-E639 WeakPolarHBondContact O-CG 3.45Å; L635-E639 PolarHBondContact O-N 2.96Å
636	F	98.6	Very high	97.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-60.9	-29.8	-172.8	83.2	-85.7	0	0	0	114.1	P598 I601 M628 E631 R634 W638 E639 I640	P598-F636 HydrophobicContact CB-CB 3.85Å; P598-F636 HydrophobicContact CB-CD1 4Å; P598-F636 HydrophobicContact CB-CD2 3.88Å; P598-F636 HydrophobicContact CB-CE2 4.44Å; P598-F636 HydrophobicContact CB-CG 3.64Å; P598-F636 HydrophobicContact CG-CD1 4.28Å; P598-F636 HydrophobicContact CG-CG 4.4Å; I601-F636 HydrophobicContact CD1-CE2 4.41Å; M628-F636 HydrophobicContact CE-CZ 4.36Å; E631-F636 HydrophobicContact CB-CE1 4.13Å; E631-F636 HydrophobicContact CB-CZ 4Å; E631-F636 HydrophobicContact CG-CZ 4.24Å; R634-F636 VanDerWaalsContact C-N 3.34Å; R634-F636 HydrophobicContact CB-CD1 3.8Å; R634-F636 HydrophobicContact CB-CE1 3.88Å; R634-F636 PolarHBondContact O-N 2.85Å; F636-W638 VanDerWaalsContact C-N 3.33Å; F636-W638 PolarHBondContact O-N 3.33Å; F636-E639 PolarHBondContact O-N 3.19Å; F636-I640 HydrophobicContact CD2-CD1 3.92Å; F636-I640 HydrophobicContact CE2-CD1 4.4Å; F636-I640 VanDerWaalsContact O-CG1 3.25Å; F636-I640 WeakPolarHBondContact O-CG1 3.4Å; F636-I640 PolarHBondContact O-N 2.92Å
637	I	98.7	Very high	97.7	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-57.5	-50.2	174.6	-64.6	-60.4	0	0	0	109.7	L623 M628 E631 R634 L635 I640 L641	L623-I637 HydrophobicContact CB-CG2 4.38Å; L623-I637 HydrophobicContact CD2-CD1 4Å; L623-I637 HydrophobicContact CD2-CG2 4.12Å; M628-I637 HydrophobicContact CE-CD1 3.38Å; E631-I637 HydrophobicContact CB-CD1 4.05Å; E631-I637 HydrophobicContact CB-CG1 4.23Å; E631-I637 VanDerWaalsContact O-CG1 3.31Å; E631-I637 WeakPolarHBondContact O-CG1 3.37Å; R634-I637 PolarHBondContact O-N 3.45Å; L635-I637 VanDerWaalsContact C-N 3.25Å; L635-I637 PolarHBondContact O-N 3.24Å; I637-I640 PolarHBondContact O-N 3.35Å; I637-L641 PolarHBondContact O-N 2.9Å
638	W	98.8	Very high	98	Very high	3 Å²	3	23.1 Å²	23.1	1%	0.011	11%	0.113	C	C	.	.	H	α-helix	trans	-73.7	-32.8	-178.2	-53.2	103.5	0	0	0	111.8	F624 F632 L635 F636 I640 L641 H642 F726 R755	F624-W638 HydrophobicContact CE1-CH2 4.38Å; F624-W638 HydrophobicContact CZ-CH2 4.47Å; F624-W638 HydrophobicContact CZ-CZ3 4.36Å; F632-W638 HydrophobicContact CD1-CZ2 4.17Å; F632-W638 HydrophobicContact CD2-CH2 4.47Å; F632-W638 HydrophobicContact CD2-CZ2 4.18Å; F632-W638 HydrophobicContact CE1-CH2 4.08Å; F632-W638 AromaticContact CE1-CZ2 3.75Å; F632-W638 HydrophobicContact CE1-CZ2 3.75Å; F632-W638 AromaticContact CE2-CH2 3.63Å; F632-W638 HydrophobicContact CE2-CH2 3.63Å; F632-W638 AromaticContact CE2-CZ2 3.74Å; F632-W638 HydrophobicContact CE2-CZ2 3.74Å; F632-W638 HydrophobicContact CG-CZ2 4.39Å; F632-W638 AromaticContact CZ-CH2 3.42Å; F632-W638 HydrophobicContact CZ-CH2 3.42Å; F632-W638 VanDerWaalsContact CZ-CH2 3.42Å; F632-W638 AromaticContact CZ-CZ2 3.53Å; F632-W638 HydrophobicContact CZ-CZ2 3.53Å; F632-W638 PolarHBondContact O-NE1 3.07Å; L635-W638 PolarHBondContact O-N 2.87Å; F636-W638 VanDerWaalsContact C-N 3.33Å; F636-W638 PolarHBondContact O-N 3.33Å; W638-I640 VanDerWaalsContact C-N 3.3Å; W638-I640 PolarHBondContact O-N 3.25Å; W638-L641 HydrophobicContact CE3-CD2 3.81Å; W638-L641 HydrophobicContact CZ3-CD2 3.73Å; W638-L641 PolarHBondContact O-N 3.28Å; W638-H642 WeakPolarHBondContact O-CB 3.39Å; W638-H642 PolarHBondContact O-CD2 3.29Å; W638-H642 PolarHBondContact O-N 3.24Å; W638-F726 AromaticContact CH2-CE1 3.79Å; W638-F726 HydrophobicContact CH2-CE1 3.79Å; W638-F726 AromaticContact CH2-CZ 3.57Å; W638-F726 HydrophobicContact CH2-CZ 3.57Å; W638-F726 HydrophobicContact CZ3-CE1 4.18Å; W638-F726 HydrophobicContact CZ3-CE2 4.3Å; W638-F726 AromaticContact CZ3-CZ 3.46Å; W638-F726 HydrophobicContact CZ3-CZ 3.46Å; W638-F726 VanDerWaalsContact CZ3-CZ 3.46Å; W638-R755 HydrophobicContact CD2-CB 4.19Å; W638-R755 HydrophobicContact CD2-CG 3.74Å; W638-R755 VanDerWaalsContact CE2-CG 3.45Å; W638-R755 HydrophobicContact CE3-CB 4.03Å; W638-R755 HydrophobicContact CE3-CG 4.1Å; W638-R755 HydrophobicContact CG-CG 4.33Å; W638-R755 VanDerWaalsContact CG-NE 3.25Å; W638-R755 HydrophobicContact CH2-CB 3.62Å; W638-R755 HydrophobicContact CH2-CG 3.96Å; W638-R755 HydrophobicContact CZ2-CB 3.78Å; W638-R755 HydrophobicContact CZ2-CG 3.57Å; W638-R755 HydrophobicContact CZ3-CB 3.77Å; W638-R755 HydrophobicContact CZ3-CG 4.22Å
639	E	98.8	Very high	98	Very high	53 Å²	53	23.9 Å²	23.9	25%	0.248	12%	0.117	C	C	.	.	H	α-helix	trans	-58.2	-43.2	170.3	-60.3	-166.7	119.8	0	0	111.8	K455 R458 L635 F636 S643	K455-E639 VanDerWaalsContact NZ-CD 3.31Å; K455-E639 IonicContact NZ-OE1 3.95Å; K455-E639 PolarHBondContact NZ-OE1 2.77Å; K455-E639 IonicContact NZ-OE2 2.93Å; K455-E639 PolarHBondContact NZ-OE2 3.49Å; R458-E639 IonicContact CZ-OE2 2.76Å; R458-E639 IonicContact NH1-OE2 2.66Å; R458-E639 PolarHBondContact NH1-OE2 3.16Å; R458-E639 IonicContact NH2-OE2 3.69Å; L635-E639 HydrophobicContact CD1-CG 4.33Å; L635-E639 HydrophobicContact CG-CG 4.07Å; L635-E639 WeakPolarHBondContact O-CG 3.45Å; L635-E639 PolarHBondContact O-N 2.96Å; F636-E639 PolarHBondContact O-N 3.19Å; E639-S643 WeakPolarHBondContact O-CB 3.45Å; E639-S643 PolarHBondContact O-N 3.26Å
640	I	98.9	Very high	98	Very high	5 Å²	5	28.5 Å²	28.5	3%	0.026	13%	0.129	C	C	.	.	H	α-helix	trans	-66.6	-47.4	177.2	-66.1	168.4	0	0	0	110.3	I601 A602 V605 V619 W622 L623 F636 I637 W638 S643 T644	I601-I640 HydrophobicContact CG2-CD1 3.87Å; A602-I640 HydrophobicContact CB-CD1 4.18Å; A602-I640 HydrophobicContact CB-CG1 3.81Å; V605-I640 HydrophobicContact CB-CG2 4.29Å; V605-I640 HydrophobicContact CG1-CG2 3.73Å; V619-I640 HydrophobicContact CG1-CG2 3.91Å; W622-I640 HydrophobicContact CH2-CD1 4.44Å; W622-I640 HydrophobicContact CZ3-CD1 4.47Å; W622-I640 HydrophobicContact CZ3-CG2 4.44Å; L623-I640 HydrophobicContact CD1-CB 4.34Å; L623-I640 HydrophobicContact CD1-CG2 4.08Å; L623-I640 HydrophobicContact CD2-CG2 4.37Å; F636-I640 HydrophobicContact CD2-CD1 3.92Å; F636-I640 HydrophobicContact CE2-CD1 4.4Å; F636-I640 VanDerWaalsContact O-CG1 3.25Å; F636-I640 WeakPolarHBondContact O-CG1 3.4Å; F636-I640 PolarHBondContact O-N 2.92Å; I637-I640 PolarHBondContact O-N 3.35Å; W638-I640 VanDerWaalsContact C-N 3.3Å; W638-I640 PolarHBondContact O-N 3.25Å; I640-S643 PolarHBondContact O-N 3.44Å; I640-T644 WeakPolarHBondContact O-CB 3.41Å; I640-T644 PolarHBondContact O-N 3.45Å; I640-T644 PolarHBondContact O-OG1 3.36Å
641	L	98.9	Very high	98	Very high	0 Å²	0	27 Å²	27	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59	-53	179.5	-174.2	60.5	0	0	0	111.4	A620 L623 F624 I637 W638 S643 T644 I645 I722 I759	A620-L641 HydrophobicContact CB-CD1 4.39Å; L623-L641 HydrophobicContact CD1-CB 3.69Å; L623-L641 HydrophobicContact CD1-CD1 4.11Å; L623-L641 HydrophobicContact CD1-CG 4.44Å; F624-L641 HydrophobicContact CE2-CD2 4.34Å; F624-L641 HydrophobicContact CZ-CD2 4.41Å; I637-L641 PolarHBondContact O-N 2.9Å; W638-L641 HydrophobicContact CE3-CD2 3.81Å; W638-L641 HydrophobicContact CZ3-CD2 3.73Å; W638-L641 PolarHBondContact O-N 3.28Å; L641-S643 VanDerWaalsContact C-N 3.31Å; L641-S643 PolarHBondContact O-N 3.04Å; L641-T644 WeakPolarHBondContact O-CA 3.27Å; L641-T644 WeakPolarHBondContact O-CB 3.36Å; L641-T644 PolarHBondContact O-N 2.96Å; L641-I645 HydrophobicContact CG-CD1 4.18Å; L641-I645 WeakPolarHBondContact O-CG1 3.27Å; L641-I645 PolarHBondContact O-N 3.4Å; L641-I722 HydrophobicContact CD1-CD1 3.89Å; L641-I722 HydrophobicContact CD1-CG1 4.12Å; L641-I759 HydrophobicContact CD2-CD1 3.96Å
642	H	98.7	Very high	98	Very high	6 Å²	6	26.1 Å²	26.1	3%	0.028	12%	0.118	C	C	.	.	H	α-helix	trans	-66.6	-32.6	179.5	-71.9	-75.6	0	0	0	112.4	W638 T644 R646 Q758 M762 H763	W638-H642 WeakPolarHBondContact O-CB 3.39Å; W638-H642 PolarHBondContact O-CD2 3.29Å; W638-H642 PolarHBondContact O-N 3.24Å; H642-T644 VanDerWaalsContact C-N 3.29Å; H642-T644 PolarHBondContact O-N 3.3Å; H642-R646 WeakPolarHBondContact O-CB 3.35Å; H642-R646 VanDerWaalsContact O-CG 3.29Å; H642-R646 WeakPolarHBondContact O-CG 3.44Å; H642-R646 PolarHBondContact O-N 3.04Å; H642-Q758 PolarHBondContact NE2-OE1 3.17Å; H642-M762 PolarHBondContact CE1-SD 3.21Å; H642-M762 PolarHBondContact ND1-SD 3.05Å; H642-M762 VanDerWaalsContact ND1-SD 3.43Å; H642-H763 AromaticContact ND1-NE2 3.24Å; H642-H763 PolarHBondContact ND1-NE2 2.94Å
643	S	98.6	Very high	97.8	Very high	32 Å²	32	30.8 Å²	30.8	22%	0.224	14%	0.14	C	C	.	.	H	α-helix	trans	-64.6	-35.2	171.7	-175.2	0	0	0	0	112.2	E639 I640 L641 K647	E639-S643 WeakPolarHBondContact O-CB 3.45Å; E639-S643 PolarHBondContact O-N 3.26Å; I640-S643 PolarHBondContact O-N 3.44Å; L641-S643 VanDerWaalsContact C-N 3.31Å; L641-S643 PolarHBondContact O-N 3.04Å; S643-K647 WeakPolarHBondContact O-CG 3.45Å; S643-K647 PolarHBondContact O-N 3.46Å; S643-K647 PolarHBondContact O-NZ 2.87Å; S643-K647 PolarHBondContact OG-NZ 3.35Å
644	T	98.8	Very high	97.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-68.7	-50.2	176.7	-59.8	0	0	0	0	110.6	I609 C616 V619 I640 L641 H642 R646 K647 M648	I609-T644 HydrophobicContact CD1-CG2 3.87Å; I609-T644 WeakPolarHBondContact CD1-OG1 3.47Å; C616-T644 HydrophobicContact CB-CG2 3.59Å; V619-T644 HydrophobicContact CB-CG2 4.32Å; V619-T644 HydrophobicContact CG1-CG2 4.3Å; I640-T644 WeakPolarHBondContact O-CB 3.41Å; I640-T644 PolarHBondContact O-N 3.45Å; I640-T644 PolarHBondContact O-OG1 3.36Å; L641-T644 WeakPolarHBondContact O-CA 3.27Å; L641-T644 WeakPolarHBondContact O-CB 3.36Å; L641-T644 PolarHBondContact O-N 2.96Å; H642-T644 VanDerWaalsContact C-N 3.29Å; H642-T644 PolarHBondContact O-N 3.3Å; T644-R646 VanDerWaalsContact C-N 3.35Å; T644-R646 PolarHBondContact O-N 2.95Å; T644-K647 WeakPolarHBondContact O-CB 3.39Å; T644-K647 PolarHBondContact O-N 3.04Å; T644-K647 VanDerWaalsContact O-N 3.08Å; T644-M648 PolarHBondContact O-N 3.44Å
645	I	98.6	Very high	97.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-58.9	-44.7	176.1	-58.9	163.8	0	0	0	111.1	L641 K647 M648 N649 L718 F719 I722 I759 H763	L641-I645 HydrophobicContact CG-CD1 4.18Å; L641-I645 WeakPolarHBondContact O-CG1 3.27Å; L641-I645 PolarHBondContact O-N 3.4Å; I645-K647 VanDerWaalsContact C-N 3.27Å; I645-K647 PolarHBondContact O-N 3.42Å; I645-M648 WeakPolarHBondContact O-CB 3.45Å; I645-M648 PolarHBondContact O-N 3.09Å; I645-M648 VanDerWaalsContact O-N 3.11Å; I645-N649 VanDerWaalsContact O-CG 3.29Å; I645-N649 PolarHBondContact O-N 3.35Å; I645-N649 PolarHBondContact O-OD1 2.92Å; I645-L718 HydrophobicContact CG1-CD2 4.24Å; I645-F719 HydrophobicContact CG2-CE1 4.05Å; I645-F719 HydrophobicContact CG2-CE2 4.24Å; I645-F719 HydrophobicContact CG2-CZ 3.53Å; I645-I722 HydrophobicContact CD1-CD1 3.78Å; I645-I722 HydrophobicContact CG1-CD1 3.88Å; I645-I759 HydrophobicContact CD1-CD1 3.78Å; I645-H763 WeakPolarHBondContact CD1-NE2 3.27Å; I645-H763 WeakPolarHBondContact CG2-CE1 3.46Å; I645-H763 WeakPolarHBondContact CG2-NE2 3.49Å
646	R	98.2	Very high	97.3	Very high	110 Å²	110	37.7 Å²	37.7	42%	0.415	17%	0.171	S	C	.	.	H	α-helix	trans	-60.2	-35.4	177.2	-77.5	-171.9	-59	-94.9	0.7	112.9	H642 T644 K650	H642-R646 WeakPolarHBondContact O-CB 3.35Å; H642-R646 VanDerWaalsContact O-CG 3.29Å; H642-R646 WeakPolarHBondContact O-CG 3.44Å; H642-R646 PolarHBondContact O-N 3.04Å; T644-R646 VanDerWaalsContact C-N 3.35Å; T644-R646 PolarHBondContact O-N 2.95Å; R646-K650 WeakPolarHBondContact O-CB 3.48Å; R646-K650 VanDerWaalsContact O-CG 3.3Å; R646-K650 WeakPolarHBondContact O-CG 3.46Å; R646-K650 PolarHBondContact O-N 3.33Å
647	K	97.1	Very high	97.2	Very high	26 Å²	26	41.7 Å²	41.7	11%	0.113	19%	0.193	C	C	.	.	H	α-helix	trans	-67	-43.8	175.2	-80	-175.2	-71	-70.8	0	110.7	D606 I609 R610 S643 T644 I645 K650 H651	D606-K647 WeakPolarHBondContact OD1-CD 3.39Å; D606-K647 WeakPolarHBondContact OD1-CE 3.42Å; D606-K647 IonicContact OD1-NZ 3.44Å; D606-K647 PolarHBondContact OD1-NZ 3.16Å; I609-K647 VanDerWaalsContact CD1-CE 3.43Å; I609-K647 HydrophobicContact CG2-CD 4.09Å; R610-K647 HydrophobicContact CG-CD 4.22Å; S643-K647 WeakPolarHBondContact O-CG 3.45Å; S643-K647 PolarHBondContact O-N 3.46Å; S643-K647 PolarHBondContact O-NZ 2.87Å; S643-K647 PolarHBondContact OG-NZ 3.35Å; T644-K647 WeakPolarHBondContact O-CB 3.39Å; T644-K647 PolarHBondContact O-N 3.04Å; T644-K647 VanDerWaalsContact O-N 3.08Å; I645-K647 VanDerWaalsContact C-N 3.27Å; I645-K647 PolarHBondContact O-N 3.42Å; K647-K650 PolarHBondContact O-N 2.85Å; K647-H651 WeakPolarHBondContact O-CB 3.34Å; K647-H651 PolarHBondContact O-N 3.07Å
648	M	97.6	Very high	97	Very high	8 Å²	8	45.1 Å²	45.1	4%	0.039	21%	0.209	C	C	.	.	H	α-helix	trans	-60	-48.1	175.8	-165.2	63.7	-125.8	0	0	111.6	T644 I645 K650 H651 V652 A711 E714 Q715 L718	T644-M648 PolarHBondContact O-N 3.44Å; I645-M648 WeakPolarHBondContact O-CB 3.45Å; I645-M648 PolarHBondContact O-N 3.09Å; I645-M648 VanDerWaalsContact O-N 3.11Å; M648-K650 VanDerWaalsContact C-N 3.35Å; M648-K650 PolarHBondContact O-N 3.44Å; M648-H651 HydrophobicContact CE-CB 4.45Å; M648-H651 WeakPolarHBondContact O-CB 3.44Å; M648-H651 PolarHBondContact O-N 3.33Å; M648-H651 VanDerWaalsContact O-N 3.1Å; M648-V652 HydrophobicContact CE-CG2 3.96Å; M648-V652 PolarHBondContact O-N 2.94Å; M648-V652 VanDerWaalsContact O-N 3.09Å; M648-A711 WeakPolarHBondContact CE-O 3.32Å; M648-E714 HydrophobicContact CE-CB 3.76Å; M648-E714 HydrophobicContact SD-CB 4.26Å; M648-Q715 HydrophobicContact CE-CB 4.23Å; M648-Q715 HydrophobicContact CG-CB 3.91Å; M648-Q715 HydrophobicContact CG-CG 4.23Å; M648-L718 HydrophobicContact CB-CD2 3.77Å; M648-L718 HydrophobicContact CG-CD2 3.91Å
649	N	96.6	Very high	96.8	Very high	16 Å²	16	45.6 Å²	45.6	9%	0.086	21%	0.211	C	C	.	.	H	α-helix	trans	-60.3	-43.6	177.5	-63.5	-2.3	0	0	0	112	I645 H651 V652 Q653 Q715	I645-N649 VanDerWaalsContact O-CG 3.29Å; I645-N649 PolarHBondContact O-N 3.35Å; I645-N649 PolarHBondContact O-OD1 2.92Å; N649-H651 VanDerWaalsContact C-N 3.3Å; N649-H651 PolarHBondContact O-N 3.02Å; N649-V652 PolarHBondContact O-N 3.06Å; N649-Q653 WeakPolarHBondContact O-CB 3.46Å; N649-Q653 VanDerWaalsContact O-CG 3.3Å; N649-Q653 WeakPolarHBondContact O-CG 3.3Å; N649-Q653 PolarHBondContact O-N 3.31Å; N649-Q715 PolarHBondContact OD1-NE2 3.37Å
650	K	96.1	Very high	96.6	Very high	144 Å²	144	48.8 Å²	48.8	63%	0.626	23%	0.226	S	C	*	.	H	α-helix	trans	-66.3	-32	176.2	-76.9	-177.9	177.5	-173	0	112.8	R646 K647 M648 K654	R646-K650 WeakPolarHBondContact O-CB 3.48Å; R646-K650 VanDerWaalsContact O-CG 3.3Å; R646-K650 WeakPolarHBondContact O-CG 3.46Å; R646-K650 PolarHBondContact O-N 3.33Å; K647-K650 PolarHBondContact O-N 2.85Å; M648-K650 VanDerWaalsContact C-N 3.35Å; M648-K650 PolarHBondContact O-N 3.44Å; K650-K654 VanDerWaalsContact O-CB 3.25Å; K650-K654 WeakPolarHBondContact O-CB 3.26Å; K650-K654 PolarHBondContact O-N 3.17Å
651	H	95.2	Very high	96.4	Very high	86 Å²	86	54.1 Å²	54.1	40%	0.398	25%	0.251	S	S	.	.	H	α-helix	trans	-64.4	-49.3	176	-178.2	55.1	0	0	0	110.7	K647 M648 N649 K654 I655	K647-H651 WeakPolarHBondContact O-CB 3.34Å; K647-H651 PolarHBondContact O-N 3.07Å; M648-H651 HydrophobicContact CE-CB 4.45Å; M648-H651 WeakPolarHBondContact O-CB 3.44Å; M648-H651 PolarHBondContact O-N 3.33Å; M648-H651 VanDerWaalsContact O-N 3.1Å; N649-H651 VanDerWaalsContact C-N 3.3Å; N649-H651 PolarHBondContact O-N 3.02Å; H651-K654 PolarHBondContact O-N 2.85Å; H651-I655 VanDerWaalsContact CE1-CD1 3.42Å; H651-I655 WeakPolarHBondContact CE1-CD1 3.45Å; H651-I655 WeakPolarHBondContact NE2-CD1 3.24Å; H651-I655 WeakPolarHBondContact O-CG1 3.38Å; H651-I655 PolarHBondContact O-N 3.5Å; H651-I655 VanDerWaalsContact O-N 3.16Å
652	V	96.2	Very high	96.1	Very high	4 Å²	4	54.3 Å²	54.3	2%	0.024	25%	0.253	C	S	.	.	H	α-helix	trans	-58.9	-51.4	175.6	176.4	0	0	0	0	111.1	M648 N649 K654 I655 Q656 A711 Q712 Q715	M648-V652 HydrophobicContact CE-CG2 3.96Å; M648-V652 PolarHBondContact O-N 2.94Å; M648-V652 VanDerWaalsContact O-N 3.09Å; N649-V652 PolarHBondContact O-N 3.06Å; V652-K654 VanDerWaalsContact C-N 3.26Å; V652-K654 PolarHBondContact O-N 3.34Å; V652-I655 PolarHBondContact O-N 2.97Å; V652-Q656 HydrophobicContact CG1-CG 4.22Å; V652-Q656 WeakPolarHBondContact O-CB 3.44Å; V652-Q656 WeakPolarHBondContact O-CG 3.39Å; V652-Q656 PolarHBondContact O-N 3.38Å; V652-A711 HydrophobicContact CG2-CB 3.99Å; V652-A711 WeakPolarHBondContact CG2-O 3.28Å; V652-Q712 HydrophobicContact CG1-CG 3.83Å; V652-Q715 HydrophobicContact CG2-CB 3.89Å; V652-Q715 HydrophobicContact CG2-CG 4.42Å
653	Q	94.6	Very high	95.8	Very high	103 Å²	103	58.1 Å²	58.1	48%	0.481	27%	0.269	S	S	.	.	H	α-helix	trans	-57.6	-39.5	178.9	-74.2	173.5	-4.9	0	0	112.5	N649 Q656 N657	N649-Q653 WeakPolarHBondContact O-CB 3.46Å; N649-Q653 VanDerWaalsContact O-CG 3.3Å; N649-Q653 WeakPolarHBondContact O-CG 3.3Å; N649-Q653 PolarHBondContact O-N 3.31Å; Q653-Q656 PolarHBondContact O-N 3.46Å; Q653-N657 WeakPolarHBondContact O-CB 3.44Å; Q653-N657 PolarHBondContact O-N 3.18Å; Q653-N657 PolarHBondContact O-OD1 2.94Å
654	K	95.7	Very high	95.5	Very high	126 Å²	126	60.4 Å²	60.4	55%	0.548	28%	0.279	S	S	.	.	H	α-helix	trans	-62.8	-47.6	178.7	-172	-170.3	179	-134.9	0	111.2	K650 H651 V652 N657 E658	K650-K654 VanDerWaalsContact O-CB 3.25Å; K650-K654 WeakPolarHBondContact O-CB 3.26Å; K650-K654 PolarHBondContact O-N 3.17Å; H651-K654 PolarHBondContact O-N 2.85Å; V652-K654 VanDerWaalsContact C-N 3.26Å; V652-K654 PolarHBondContact O-N 3.34Å; K654-N657 PolarHBondContact O-N 3.32Å; K654-E658 WeakPolarHBondContact CE-OE1 3.41Å; K654-E658 IonicContact NZ-OE1 3.72Å; K654-E658 PolarHBondContact NZ-OE1 3.21Å; K654-E658 VanDerWaalsContact NZ-OE1 3.09Å; K654-E658 WeakPolarHBondContact O-CG 3.47Å; K654-E658 PolarHBondContact O-N 2.85Å
655	I	94.9	Very high	95.1	Very high	14 Å²	14	65.9 Å²	65.9	7%	0.072	30%	0.303	C	S	.	.	H	α-helix	trans	-69.2	-37.6	-179.2	-56.3	168.8	0	0	0	110.5	H651 V652 E658 L659 L704 K707 V708 A711	H651-I655 VanDerWaalsContact CE1-CD1 3.42Å; H651-I655 WeakPolarHBondContact CE1-CD1 3.45Å; H651-I655 WeakPolarHBondContact NE2-CD1 3.24Å; H651-I655 WeakPolarHBondContact O-CG1 3.38Å; H651-I655 PolarHBondContact O-N 3.5Å; H651-I655 VanDerWaalsContact O-N 3.16Å; V652-I655 PolarHBondContact O-N 2.97Å; I655-E658 PolarHBondContact O-N 2.9Å; I655-L659 PolarHBondContact O-N 3.14Å; I655-L704 HydrophobicContact CG2-CD2 4.49Å; I655-K707 HydrophobicContact CG2-CB 3.88Å; I655-V708 HydrophobicContact CB-CG2 4.19Å; I655-V708 HydrophobicContact CG2-CG2 3.53Å; I655-A711 HydrophobicContact CD1-CB 3.78Å
656	Q	94.8	Very high	94.7	Very high	55 Å²	55	67 Å²	67	26%	0.257	31%	0.309	S	S	.	.	H	α-helix	trans	-59.7	-46.4	173.7	-74.6	176.1	-35.5	0	0	111.9	V652 Q653 E658 L659 E660 V708	V652-Q656 HydrophobicContact CG1-CG 4.22Å; V652-Q656 WeakPolarHBondContact O-CB 3.44Å; V652-Q656 WeakPolarHBondContact O-CG 3.39Å; V652-Q656 PolarHBondContact O-N 3.38Å; Q653-Q656 PolarHBondContact O-N 3.46Å; Q656-E658 VanDerWaalsContact C-N 3.35Å; Q656-E658 PolarHBondContact O-N 2.84Å; Q656-L659 WeakPolarHBondContact O-CB 3.48Å; Q656-L659 PolarHBondContact O-N 3.41Å; Q656-E660 WeakPolarHBondContact O-CG 3.35Å; Q656-E660 PolarHBondContact O-N 2.89Å; Q656-V708 HydrophobicContact CG-CG1 3.89Å; Q656-V708 HydrophobicContact CG-CG2 4.18Å
657	N	95.1	Very high	94.3	Very high	83 Å²	83	66.9 Å²	66.9	44%	0.444	31%	0.313	S	S	.	.	H	α-helix	trans	-63.7	-40.2	176.1	-67.5	-3.2	0	0	0	111.7	Q653 K654 L659 E660 E661	Q653-N657 WeakPolarHBondContact O-CB 3.44Å; Q653-N657 PolarHBondContact O-N 3.18Å; Q653-N657 PolarHBondContact O-OD1 2.94Å; K654-N657 PolarHBondContact O-N 3.32Å; N657-L659 VanDerWaalsContact C-N 3.28Å; N657-L659 PolarHBondContact O-N 3.22Å; N657-E660 PolarHBondContact O-N 2.77Å; N657-E661 WeakPolarHBondContact O-CB 3.3Å; N657-E661 VanDerWaalsContact O-CG 3.31Å; N657-E661 WeakPolarHBondContact O-CG 3.28Å; N657-E661 PolarHBondContact O-N 3.37Å
658	E	94.8	Very high	93.8	Very high	74 Å²	74	71.6 Å²	71.6	35%	0.346	33%	0.333	S	S	.	.	H	α-helix	trans	-60.8	-37.8	175.2	-73.3	172.4	-165.8	0	0	111.5	K654 I655 Q656 A662 L704	K654-E658 WeakPolarHBondContact CE-OE1 3.41Å; K654-E658 IonicContact NZ-OE1 3.72Å; K654-E658 PolarHBondContact NZ-OE1 3.21Å; K654-E658 VanDerWaalsContact NZ-OE1 3.09Å; K654-E658 WeakPolarHBondContact O-CG 3.47Å; K654-E658 PolarHBondContact O-N 2.85Å; I655-E658 PolarHBondContact O-N 2.9Å; Q656-E658 VanDerWaalsContact C-N 3.35Å; Q656-E658 PolarHBondContact O-N 2.84Å; E658-A662 WeakPolarHBondContact O-CB 3.31Å; E658-A662 PolarHBondContact O-N 3.04Å; E658-A662 VanDerWaalsContact O-N 3.14Å; E658-L704 HydrophobicContact CB-CD2 4.26Å
659	L	94.7	Very high	93.1	Very high	12 Å²	12	74 Å²	74	6%	0.063	34%	0.344	C	S	.	.	H	α-helix	trans	-68.9	-45.8	174.8	176.5	66.7	0	0	0	112.4	I655 Q656 N657 A662 K663 I701 L704 Q705 V708	I655-L659 PolarHBondContact O-N 3.14Å; Q656-L659 WeakPolarHBondContact O-CB 3.48Å; Q656-L659 PolarHBondContact O-N 3.41Å; N657-L659 VanDerWaalsContact C-N 3.28Å; N657-L659 PolarHBondContact O-N 3.22Å; L659-A662 PolarHBondContact O-N 2.97Å; L659-K663 HydrophobicContact CG-CD 4.41Å; L659-K663 WeakPolarHBondContact O-CG 3.23Å; L659-K663 PolarHBondContact O-N 2.77Å; L659-I701 HydrophobicContact CD1-CG2 3.95Å; L659-L704 HydrophobicContact CB-CB 4.23Å; L659-L704 HydrophobicContact CD1-CB 3.77Å; L659-Q705 HydrophobicContact CD1-CB 4.5Å; L659-V708 HydrophobicContact CB-CG2 4.28Å; L659-V708 HydrophobicContact CD2-CB 4.49Å; L659-V708 HydrophobicContact CD2-CG2 3.86Å
660	E	94.3	Very high	92.4	Very high	121 Å²	121	76.7 Å²	76.7	57%	0.565	36%	0.356	S	S	*	.	H	α-helix	trans	-61.5	-44.6	176.4	-73.9	177.5	-175.2	0	0	111.2	Q656 N657 A662 K663 D664	Q656-E660 WeakPolarHBondContact O-CG 3.35Å; Q656-E660 PolarHBondContact O-N 2.89Å; N657-E660 PolarHBondContact O-N 2.77Å; E660-A662 VanDerWaalsContact C-N 3.27Å; E660-A662 PolarHBondContact O-N 3.39Å; E660-K663 PolarHBondContact O-N 3.17Å; E660-D664 WeakPolarHBondContact O-CB 3.46Å; E660-D664 PolarHBondContact O-N 3.46Å
661	E	94.4	Very high	91.7	Very high	116 Å²	116	76.5 Å²	76.5	54%	0.542	36%	0.357	S	S	.	.	H	α-helix	trans	-61.5	-34.1	175.2	-75.6	-179	-166.7	0	0	112.8	N657 K665	N657-E661 WeakPolarHBondContact O-CB 3.3Å; N657-E661 VanDerWaalsContact O-CG 3.31Å; N657-E661 WeakPolarHBondContact O-CG 3.28Å; N657-E661 PolarHBondContact O-N 3.37Å; E661-K665 WeakPolarHBondContact O-CD 3.45Å; E661-K665 VanDerWaalsContact O-CG 3.23Å; E661-K665 WeakPolarHBondContact O-CG 3.34Å; E661-K665 PolarHBondContact O-N 3.08Å
662	A	92.9	Very high	90.8	Very high	4 Å²	4	79.1 Å²	79.1	3%	0.033	37%	0.368	C	S	.	.	H	α-helix	trans	-71	-44.2	175.4	0	0	0	0	0	111.6	E658 L659 E660 K665 L666 I701 L704	E658-A662 WeakPolarHBondContact O-CB 3.31Å; E658-A662 PolarHBondContact O-N 3.04Å; E658-A662 VanDerWaalsContact O-N 3.14Å; L659-A662 PolarHBondContact O-N 2.97Å; E660-A662 VanDerWaalsContact C-N 3.27Å; E660-A662 PolarHBondContact O-N 3.39Å; A662-K665 WeakPolarHBondContact O-CB 3.41Å; A662-K665 PolarHBondContact O-N 3.21Å; A662-L666 PolarHBondContact O-N 3.27Å; A662-I701 HydrophobicContact CB-CD1 4.42Å; A662-I701 HydrophobicContact CB-CG1 3.73Å; A662-L704 HydrophobicContact CB-CD1 3.95Å
663	K	92.9	Very high	89.5	Confident	86 Å²	86	85 Å²	85	37%	0.374	39%	0.389	S	S	.	.	H	α-helix	trans	-60.9	-45.2	175.1	-73.1	178.3	179.4	175	0	111.8	L659 E660 K665 L666 E667 I701	L659-K663 HydrophobicContact CG-CD 4.41Å; L659-K663 WeakPolarHBondContact O-CG 3.23Å; L659-K663 PolarHBondContact O-N 2.77Å; E660-K663 PolarHBondContact O-N 3.17Å; K663-K665 VanDerWaalsContact C-N 3.26Å; K663-K665 PolarHBondContact O-N 3.49Å; K663-L666 WeakPolarHBondContact O-CB 3.26Å; K663-L666 PolarHBondContact O-N 3.07Å; K663-E667 PolarHBondContact O-N 2.94Å; K663-I701 HydrophobicContact CG-CD1 4.21Å; K663-I701 HydrophobicContact CG-CG1 4.44Å; K663-I701 HydrophobicContact CG-CG2 4.32Å
664	D	92.4	Very high	88.2	Confident	80 Å²	80	86.2 Å²	86.2	43%	0.428	40%	0.404	S	S	.	.	H	α-helix	trans	-59	-35.9	175.6	-90.6	15.9	0	0	0	112.9	E660 K668	E660-D664 WeakPolarHBondContact O-CB 3.46Å; E660-D664 PolarHBondContact O-N 3.46Å; D664-K668 WeakPolarHBondContact O-CB 3.36Å; D664-K668 WeakPolarHBondContact O-CD 3.35Å; D664-K668 WeakPolarHBondContact O-CG 3.44Å; D664-K668 PolarHBondContact O-N 3.13Å; D664-K668 VanDerWaalsContact O-N 3.15Å
665	K	90.9	Very high	86.8	Confident	116 Å²	116	82.7 Å²	82.7	50%	0.504	40%	0.398	S	S	.	.	H	α-helix	trans	-69.9	-43.8	176.7	-76.1	168.6	-170.8	168.3	0	111.1	E661 A662 K663 K668 Q669	E661-K665 WeakPolarHBondContact O-CD 3.45Å; E661-K665 VanDerWaalsContact O-CG 3.23Å; E661-K665 WeakPolarHBondContact O-CG 3.34Å; E661-K665 PolarHBondContact O-N 3.08Å; A662-K665 WeakPolarHBondContact O-CB 3.41Å; A662-K665 PolarHBondContact O-N 3.21Å; K663-K665 VanDerWaalsContact C-N 3.26Å; K663-K665 PolarHBondContact O-N 3.49Å; K665-K668 PolarHBondContact O-N 3.02Å; K665-Q669 PolarHBondContact O-N 2.98Å
666	L	89.6	Confident	85	Confident	23 Å²	23	88.5 Å²	88.5	12%	0.12	44%	0.436	C	S	.	.	H	α-helix	trans	-60.2	-49.3	176.1	-176.6	67	0	0	0	110.8	A662 K663 K668 Q669 Q670 E694 L697 E698 I701	A662-L666 PolarHBondContact O-N 3.27Å; K663-L666 WeakPolarHBondContact O-CB 3.26Å; K663-L666 PolarHBondContact O-N 3.07Å; L666-K668 VanDerWaalsContact C-N 3.3Å; L666-K668 PolarHBondContact O-N 3.02Å; L666-Q669 PolarHBondContact O-N 3.26Å; L666-Q669 VanDerWaalsContact O-N 3.09Å; L666-Q670 WeakPolarHBondContact O-CG 3.26Å; L666-Q670 PolarHBondContact O-N 3.43Å; L666-E694 HydrophobicContact CD1-CG 3.63Å; L666-L697 HydrophobicContact CD1-CB 4.4Å; L666-E698 HydrophobicContact CD1-CG 4.28Å; L666-E698 HydrophobicContact CD2-CG 4.15Å; L666-I701 HydrophobicContact CB-CD1 3.99Å; L666-I701 HydrophobicContact CD2-CD1 3.67Å; L666-I701 HydrophobicContact CG-CD1 4.42Å
667	E	89.1	Confident	83.3	Confident	108 Å²	108	91.8 Å²	91.8	51%	0.505	45%	0.447	S	S	.	.	H	α-helix	trans	-58.7	-40.6	177.4	-74.4	-174	-177.5	0	0	112.2	K663 Q670 H671	K663-E667 PolarHBondContact O-N 2.94Å; E667-Q670 PolarHBondContact O-N 3.35Å; E667-H671 WeakPolarHBondContact O-CB 3.33Å; E667-H671 PolarHBondContact O-N 3.35Å; E667-H671 PolarHBondContact O-ND1 3.35Å
668	K	87.2	Confident	81.3	Confident	125 Å²	125	95.9 Å²	95.9	54%	0.543	47%	0.468	S	S	.	.	H	α-helix	trans	-66.4	-36.7	176.7	-75.7	166.5	-168.9	155	0	112.4	D664 K665 L666 K672	D664-K668 WeakPolarHBondContact O-CB 3.36Å; D664-K668 WeakPolarHBondContact O-CD 3.35Å; D664-K668 WeakPolarHBondContact O-CG 3.44Å; D664-K668 PolarHBondContact O-N 3.13Å; D664-K668 VanDerWaalsContact O-N 3.15Å; K665-K668 PolarHBondContact O-N 3.02Å; L666-K668 VanDerWaalsContact C-N 3.3Å; L666-K668 PolarHBondContact O-N 3.02Å; K668-K672 WeakPolarHBondContact O-CG 3.31Å; K668-K672 PolarHBondContact O-N 3Å; K668-K672 VanDerWaalsContact O-N 3.15Å
669	Q	82.8	Confident	79.2	Confident	57 Å²	57	97.3 Å²	97.3	27%	0.266	49%	0.487	S	S	.	.	H	α-helix	trans	-69	-45.2	175.5	-80.3	-179.3	-19.3	0	0	111.3	K665 L666 H671 K672 R673	K665-Q669 PolarHBondContact O-N 2.98Å; L666-Q669 PolarHBondContact O-N 3.26Å; L666-Q669 VanDerWaalsContact O-N 3.09Å; Q669-H671 VanDerWaalsContact C-N 3.31Å; Q669-H671 PolarHBondContact O-N 3.01Å; Q669-K672 WeakPolarHBondContact O-CB 3.39Å; Q669-K672 PolarHBondContact O-N 2.87Å; Q669-R673 PolarHBondContact O-N 3.39Å; Q669-R673 VanDerWaalsContact O-N 3.1Å
670	Q	82.8	Confident	77.1	Confident	74 Å²	74	99 Å²	99	35%	0.346	51%	0.507	S	S	.	.	H	α-helix	trans	-59.5	-41.2	175.6	-71.5	178.6	-11.4	0	0	111.9	L666 E667 K672 R673 V674 E694	L666-Q670 WeakPolarHBondContact O-CG 3.26Å; L666-Q670 PolarHBondContact O-N 3.43Å; E667-Q670 PolarHBondContact O-N 3.35Å; Q670-K672 PolarHBondContact O-N 3.22Å; Q670-R673 WeakPolarHBondContact O-CB 3.49Å; Q670-R673 PolarHBondContact O-N 3.13Å; Q670-V674 WeakPolarHBondContact O-CG2 3.4Å; Q670-V674 PolarHBondContact O-N 3.38Å; Q670-E694 VanDerWaalsContact CG-OE1 3.29Å; Q670-E694 WeakPolarHBondContact CG-OE1 3.47Å; Q670-E694 PolarHBondContact NE2-OE1 2.98Å
671	H	80.2	Confident	75.1	Confident	139 Å²	139	102 Å²	102	64%	0.644	53%	0.527	S	S	*	.	H	α-helix	trans	-64.9	-36	174.3	-81.8	86.7	0	0	0	113.4	E667 Q669 R673 V674 A675	E667-H671 WeakPolarHBondContact O-CB 3.33Å; E667-H671 PolarHBondContact O-N 3.35Å; E667-H671 PolarHBondContact O-ND1 3.35Å; Q669-H671 VanDerWaalsContact C-N 3.31Å; Q669-H671 PolarHBondContact O-N 3.01Å; H671-R673 VanDerWaalsContact C-N 3.3Å; H671-R673 PolarHBondContact O-N 2.97Å; H671-V674 PolarHBondContact O-N 3.33Å; H671-A675 PolarHBondContact O-N 3.33Å
672	K	77	Confident	73.3	Confident	142 Å²	142	102.8 Å²	102.8	62%	0.617	54%	0.535	S	S	*	.	H	α-helix	trans	-66.9	-30.9	175.7	-76.9	177.2	-178.7	-178.6	0	112.7	K668 Q669 Q670	K668-K672 WeakPolarHBondContact O-CG 3.31Å; K668-K672 PolarHBondContact O-N 3Å; K668-K672 VanDerWaalsContact O-N 3.15Å; Q669-K672 WeakPolarHBondContact O-CB 3.39Å; Q669-K672 PolarHBondContact O-N 2.87Å; Q670-K672 PolarHBondContact O-N 3.22Å
673	R	68.9	Low	71.6	Confident	127 Å²	127	106.1 Å²	106.1	48%	0.479	55%	0.55	S	S	.	.	H	α-helix	trans	-70.4	-32.5	177	-170.2	178.3	175.9	175.4	5.6	112.6	Q669 Q670 H671 E691 E694	Q669-R673 PolarHBondContact O-N 3.39Å; Q669-R673 VanDerWaalsContact O-N 3.1Å; Q670-R673 WeakPolarHBondContact O-CB 3.49Å; Q670-R673 PolarHBondContact O-N 3.13Å; H671-R673 VanDerWaalsContact C-N 3.3Å; H671-R673 PolarHBondContact O-N 2.97Å; R673-E691 IonicContact CZ-OE1 2.78Å; R673-E691 IonicContact NH1-OE1 3.48Å; R673-E691 IonicContact NH2-OE1 3.57Å; R673-E691 PolarHBondContact NH2-OE1 2.59Å; R673-E694 IonicContact NH1-OE2 3.56Å; R673-E694 PolarHBondContact NH1-OE2 3.12Å
674	V	66.6	Low	69.9	Low	129 Å²	129	107.8 Å²	107.8	78%	0.782	56%	0.563	S	S	*	*	H	α-helix	trans	-88.1	-14.3	-178.2	-178	0	0	0	0	112.9	Q670 H671	Q670-V674 WeakPolarHBondContact O-CG2 3.4Å; Q670-V674 PolarHBondContact O-N 3.38Å; H671-V674 PolarHBondContact O-N 3.33Å
675	A	67.3	Low	68.2	Low	51 Å²	51	111.8 Å²	111.8	42%	0.421	58%	0.581	S	S	.	*	S	Bend	trans	-70.4	139.4	176.3	0	0	0	0	0	111.8	H671 R677	H671-A675 PolarHBondContact O-N 3.33Å; A675-R677 PolarHBondContact O-N 3.38Å
676	P	56.6	Low	66.8	Low	136 Å²	136	110.9 Å²	110.9	88%	0.883	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-65.2	119.8	-178.8	-9.6	22.3	0	0	0	110.7
677	R	59.8	Low	65.5	Low	125 Å²	125	114 Å²	114	47%	0.472	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-92.8	137	170	-66.8	-171.4	-178.2	-175.2	6.3	109.8	A675 E686 E690	A675-R677 PolarHBondContact O-N 3.38Å; R677-E686 IonicContact NH1-OE2 3.54Å; R677-E686 PolarHBondContact NH1-OE2 3.48Å; R677-E690 IonicContact CZ-OE1 3.44Å; R677-E690 IonicContact NH1-OE1 2.77Å; R677-E690 PolarHBondContact NH1-OE1 3.19Å; R677-E690 IonicContact NH2-OE1 3.27Å; R677-E690 PolarHBondContact NH2-OE1 3.15Å; R677-E690 IonicContact NH2-OE2 2.74Å; R677-E690 PolarHBondContact NH2-OE2 2.99Å
678	D	52.1	Low	64.2	Low	169 Å²	169	113.6 Å²	113.6	90%	0.904	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-79.5	125.9	171.9	-130.6	-4.7	0	0	0	108.1
679	S	51.1	Low	63.3	Low	104 Å²	104	110.4 Å²	110.4	73%	0.727	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-57.1	137.2	-161.8	48.5	0	0	0	0	117.1
680	G	51.3	Low	62.6	Low	48 Å²	48	110.6 Å²	110.6	50%	0.495	59%	0.587	S	S	.	*			trans	-163.7	141.9	163.7	0	0	0	0	0	112.4	D682	G680-D682 PolarHBondContact O-N 2.97Å
681	D	52	Low	62	Low	182 Å²	182	111.4 Å²	111.4	97%	0.973	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	17.5	-165.7	-75.5	-32.7	0	0	0	118.1
682	D	55.5	Low	61.9	Low	133 Å²	133	110.1 Å²	110.1	71%	0.711	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	10	176.4	-83.7	-37.5	0	0	0	113.6	G680 D684	G680-D682 PolarHBondContact O-N 2.97Å; D682-D684 PolarHBondContact O-N 3.28Å
683	E	57.2	Low	62	Low	74 Å²	74	108.2 Å²	108.2	35%	0.346	58%	0.581	S	S	.	*	H	α-helix	trans	-65.3	-29.9	-169.6	-74.7	-174.2	-162.2	0	0	116.1	K687	E683-K687 WeakPolarHBondContact O-CB 3.32Å; E683-K687 WeakPolarHBondContact O-CG 3.37Å; E683-K687 PolarHBondContact O-N 3.38Å; E683-K687 IonicContact OE2-NZ 3.57Å; E683-K687 PolarHBondContact OE2-NZ 3.41Å
684	D	57.5	Low	62.6	Low	122 Å²	122	103.5 Å²	103.5	65%	0.652	57%	0.565	S	S	*	*	H	α-helix	trans	-81	-30.4	-169.7	-72.4	-20.1	0	0	0	113.2	D682 N688	D682-D684 PolarHBondContact O-N 3.28Å; D684-N688 PolarHBondContact O-N 2.86Å; D684-N688 PolarHBondContact O-ND2 3.41Å
685	M	57.9	Low	63.4	Low	163 Å²	163	99 Å²	99	80%	0.803	55%	0.545	S	S	*	.	H	α-helix	trans	-76.8	-37.9	174.2	-78.3	-88	-97.5	0	0	111.4	S689	M685-S689 PolarHBondContact O-N 3.02Å; M685-S689 PolarHBondContact O-OG 2.97Å
686	E	61.2	Low	64.4	Low	97 Å²	97	102.8 Å²	102.8	45%	0.453	55%	0.554	S	S	.	*	H	α-helix	trans	-66.6	-43	174.9	-73	-170.5	165.5	0	0	111.7	R677 N688 S689 E690	R677-E686 IonicContact NH1-OE2 3.54Å; R677-E686 PolarHBondContact NH1-OE2 3.48Å; E686-N688 PolarHBondContact O-N 3.37Å; E686-S689 PolarHBondContact O-N 3.32Å; E686-S689 PolarHBondContact O-OG 3.48Å; E686-E690 WeakPolarHBondContact O-CG 3.19Å; E686-E690 PolarHBondContact O-N 3.47Å
687	K	61.7	Low	65.9	Low	89 Å²	89	97.5 Å²	97.5	39%	0.387	52%	0.518	S	S	.	.	H	α-helix	trans	-59.2	-43.9	177.1	-81.5	170.9	-169.3	155.9	0	113	E683 E690 E691	E683-K687 WeakPolarHBondContact O-CB 3.32Å; E683-K687 WeakPolarHBondContact O-CG 3.37Å; E683-K687 PolarHBondContact O-N 3.38Å; E683-K687 IonicContact OE2-NZ 3.57Å; E683-K687 PolarHBondContact OE2-NZ 3.41Å; K687-E690 PolarHBondContact O-N 2.85Å; K687-E691 WeakPolarHBondContact O-CG 3.32Å; K687-E691 PolarHBondContact O-N 3.25Å
688	N	62.7	Low	67.4	Low	99 Å²	99	96.3 Å²	96.3	53%	0.529	52%	0.518	S	S	.	.	H	α-helix	trans	-65.5	-39.3	178.6	-77	-19.2	0	0	0	112	D684 E686 E691 D692	D684-N688 PolarHBondContact O-N 2.86Å; D684-N688 PolarHBondContact O-ND2 3.41Å; E686-N688 PolarHBondContact O-N 3.37Å; N688-E691 PolarHBondContact O-N 3.33Å; N688-D692 PolarHBondContact O-N 3.4Å; N688-D692 VanDerWaalsContact O-N 3.09Å
689	S	66.8	Low	69.3	Low	58 Å²	58	92.7 Å²	92.7	41%	0.406	50%	0.496	S	S	.	.	H	α-helix	trans	-68.1	-35.4	176.1	62.2	0	0	0	0	113.2	M685 E686 E693	M685-S689 PolarHBondContact O-N 3.02Å; M685-S689 PolarHBondContact O-OG 2.97Å; E686-S689 PolarHBondContact O-N 3.32Å; E686-S689 PolarHBondContact O-OG 3.48Å; S689-E693 WeakPolarHBondContact O-CG 3.4Å; S689-E693 PolarHBondContact O-N 2.89Å; S689-E693 VanDerWaalsContact O-N 3.11Å
690	E	68	Low	71.3	Confident	62 Å²	62	92.5 Å²	92.5	29%	0.29	48%	0.483	S	S	.	.	H	α-helix	trans	-69	-36.9	176.1	-72.4	179.5	-179.4	0	0	111.6	R677 E686 K687 E694	R677-E690 IonicContact CZ-OE1 3.44Å; R677-E690 IonicContact NH1-OE1 2.77Å; R677-E690 PolarHBondContact NH1-OE1 3.19Å; R677-E690 IonicContact NH2-OE1 3.27Å; R677-E690 PolarHBondContact NH2-OE1 3.15Å; R677-E690 IonicContact NH2-OE2 2.74Å; R677-E690 PolarHBondContact NH2-OE2 2.99Å; E686-E690 WeakPolarHBondContact O-CG 3.19Å; E686-E690 PolarHBondContact O-N 3.47Å; K687-E690 PolarHBondContact O-N 2.85Å; E690-E694 WeakPolarHBondContact O-CB 3.46Å; E690-E694 PolarHBondContact O-N 2.89Å
691	E	71.4	Confident	73.3	Confident	90 Å²	90	91.3 Å²	91.3	42%	0.421	47%	0.465	S	S	.	.	H	α-helix	trans	-68.7	-39	174.9	-73.8	-175.9	170.3	0	0	112.8	R673 K687 N688 E694 G695	R673-E691 IonicContact CZ-OE1 2.78Å; R673-E691 IonicContact NH1-OE1 3.48Å; R673-E691 IonicContact NH2-OE1 3.57Å; R673-E691 PolarHBondContact NH2-OE1 2.59Å; K687-E691 WeakPolarHBondContact O-CG 3.32Å; K687-E691 PolarHBondContact O-N 3.25Å; N688-E691 PolarHBondContact O-N 3.33Å; E691-E694 PolarHBondContact O-N 3.28Å; E691-G695 PolarHBondContact O-N 3.41Å
692	D	76.9	Confident	75.4	Confident	112 Å²	112	88.5 Å²	88.5	60%	0.599	45%	0.446	S	S	*	.	H	α-helix	trans	-66.1	-38.1	175.1	-79.1	-20.8	0	0	0	112.1	N688 Q696	N688-D692 PolarHBondContact O-N 3.4Å; N688-D692 VanDerWaalsContact O-N 3.09Å; D692-Q696 VanDerWaalsContact O-CG 3.31Å; D692-Q696 WeakPolarHBondContact O-CG 3.36Å; D692-Q696 PolarHBondContact O-N 3.47Å
693	E	79.6	Confident	77.2	Confident	102 Å²	102	88.8 Å²	88.8	48%	0.477	44%	0.438	S	S	.	.	H	α-helix	trans	-68.5	-38.6	174.1	-75.9	-174.5	-175.6	0	0	112.4	S689 Q696 L697	S689-E693 WeakPolarHBondContact O-CG 3.4Å; S689-E693 PolarHBondContact O-N 2.89Å; S689-E693 VanDerWaalsContact O-N 3.11Å; E693-Q696 PolarHBondContact O-N 2.97Å; E693-L697 PolarHBondContact O-N 3.39Å
694	E	81.6	Confident	79	Confident	28 Å²	28	85.8 Å²	85.8	13%	0.131	42%	0.424	C	S	.	.	H	α-helix	trans	-61.5	-48.8	175.6	-169.9	170.6	-168.8	0	0	110.6	L666 Q670 R673 E690 E691 Q696 L697 E698	L666-E694 HydrophobicContact CD1-CG 3.63Å; Q670-E694 VanDerWaalsContact CG-OE1 3.29Å; Q670-E694 WeakPolarHBondContact CG-OE1 3.47Å; Q670-E694 PolarHBondContact NE2-OE1 2.98Å; R673-E694 IonicContact NH1-OE2 3.56Å; R673-E694 PolarHBondContact NH1-OE2 3.12Å; E690-E694 WeakPolarHBondContact O-CB 3.46Å; E690-E694 PolarHBondContact O-N 2.89Å; E691-E694 PolarHBondContact O-N 3.28Å; E694-Q696 VanDerWaalsContact C-N 3.32Å; E694-Q696 PolarHBondContact O-N 3.05Å; E694-L697 PolarHBondContact O-N 3.47Å; E694-L697 VanDerWaalsContact O-N 3.1Å; E694-E698 WeakPolarHBondContact O-CG 3.31Å; E694-E698 PolarHBondContact O-N 3.11Å
695	G	83.9	Confident	80.8	Confident	36 Å²	36	83.1 Å²	83.1	37%	0.371	41%	0.407	S	S	.	.	H	α-helix	trans	-61.2	-36.7	177.2	0	0	0	0	0	113.7	E691 E699	E691-G695 PolarHBondContact O-N 3.41Å; G695-E699 PolarHBondContact O-N 3.47Å
696	Q	87.1	Confident	82.7	Confident	130 Å²	130	81.3 Å²	81.3	61%	0.607	40%	0.397	S	S	*	.	H	α-helix	trans	-67.1	-37.3	174	-73.6	174.7	31.9	0	0	112.6	D692 E693 E694 Q700	D692-Q696 VanDerWaalsContact O-CG 3.31Å; D692-Q696 WeakPolarHBondContact O-CG 3.36Å; D692-Q696 PolarHBondContact O-N 3.47Å; E693-Q696 PolarHBondContact O-N 2.97Å; E694-Q696 VanDerWaalsContact C-N 3.32Å; E694-Q696 PolarHBondContact O-N 3.05Å; Q696-Q700 WeakPolarHBondContact O-CB 3.26Å; Q696-Q700 PolarHBondContact O-N 3.15Å
697	L	88.8	Confident	84.3	Confident	24 Å²	24	82.5 Å²	82.5	13%	0.126	40%	0.4	C	S	.	.	H	α-helix	trans	-70.6	-38.7	176.5	-81.4	162.7	0	0	0	111.9	L666 E693 E694 Q700 I701	L666-L697 HydrophobicContact CD1-CB 4.4Å; E693-L697 PolarHBondContact O-N 3.39Å; E694-L697 PolarHBondContact O-N 3.47Å; E694-L697 VanDerWaalsContact O-N 3.1Å; L697-Q700 PolarHBondContact O-N 2.95Å; L697-I701 WeakPolarHBondContact O-CB 3.46Å; L697-I701 VanDerWaalsContact O-CG1 3.24Å; L697-I701 WeakPolarHBondContact O-CG1 3.15Å; L697-I701 PolarHBondContact O-N 3.07Å
698	E	91.3	Very high	85.9	Confident	100 Å²	100	78.5 Å²	78.5	47%	0.467	38%	0.384	S	S	.	.	H	α-helix	trans	-61.3	-47.5	173.4	-72.2	-177.2	162.9	0	0	111.4	L666 E694 Q700 I701 E702	L666-E698 HydrophobicContact CD1-CG 4.28Å; L666-E698 HydrophobicContact CD2-CG 4.15Å; E694-E698 WeakPolarHBondContact O-CG 3.31Å; E694-E698 PolarHBondContact O-N 3.11Å; E698-Q700 VanDerWaalsContact C-N 3.3Å; E698-Q700 PolarHBondContact O-N 2.93Å; E698-I701 PolarHBondContact O-N 3.29Å; E698-I701 VanDerWaalsContact O-N 3.15Å; E698-E702 PolarHBondContact O-N 3.21Å
699	E	92.4	Very high	87.4	Confident	93 Å²	93	79 Å²	79	44%	0.435	38%	0.383	S	S	.	.	H	α-helix	trans	-62.1	-38.5	175.1	-169.6	-174.3	-172.5	0	0	111.5	G695 E702 R703	G695-E699 PolarHBondContact O-N 3.47Å; E699-E702 PolarHBondContact O-N 2.91Å; E699-R703 VanDerWaalsContact CD-NH2 3.34Å; E699-R703 VanDerWaalsContact O-CG 3.31Å; E699-R703 WeakPolarHBondContact O-CG 3.06Å; E699-R703 PolarHBondContact O-N 3.06Å; E699-R703 IonicContact OE1-CZ 3.07Å; E699-R703 IonicContact OE1-NE 2.82Å; E699-R703 IonicContact OE1-NH2 3.72Å; E699-R703 PolarHBondContact OE1-NH2 2.89Å; E699-R703 IonicContact OE2-NH2 2.63Å
700	Q	93.1	Very high	88.8	Confident	101 Å²	101	79.3 Å²	79.3	47%	0.472	39%	0.385	S	S	.	.	H	α-helix	trans	-63.9	-41.4	174.6	-175.9	177.8	10.3	0	0	111.9	Q696 L697 E698 R703 L704	Q696-Q700 WeakPolarHBondContact O-CB 3.26Å; Q696-Q700 PolarHBondContact O-N 3.15Å; L697-Q700 PolarHBondContact O-N 2.95Å; E698-Q700 VanDerWaalsContact C-N 3.3Å; E698-Q700 PolarHBondContact O-N 2.93Å; Q700-R703 PolarHBondContact O-N 3.17Å; Q700-L704 HydrophobicContact CG-CD1 4.03Å; Q700-L704 HydrophobicContact CG-CG 4.49Å; Q700-L704 WeakPolarHBondContact O-CB 2.86Å; Q700-L704 VanDerWaalsContact O-CG 3.28Å; Q700-L704 WeakPolarHBondContact O-CG 3.31Å; Q700-L704 PolarHBondContact O-N 3.1Å
701	I	93.8	Very high	90.2	Very high	22 Å²	22	76.5 Å²	76.5	11%	0.113	37%	0.373	C	S	.	.	H	α-helix	trans	-64.5	-43.6	177.4	-74.4	163.8	0	0	0	110.3	L659 A662 K663 L666 L697 E698 L704 Q705	L659-I701 HydrophobicContact CD1-CG2 3.95Å; A662-I701 HydrophobicContact CB-CD1 4.42Å; A662-I701 HydrophobicContact CB-CG1 3.73Å; K663-I701 HydrophobicContact CG-CD1 4.21Å; K663-I701 HydrophobicContact CG-CG1 4.44Å; K663-I701 HydrophobicContact CG-CG2 4.32Å; L666-I701 HydrophobicContact CB-CD1 3.99Å; L666-I701 HydrophobicContact CD2-CD1 3.67Å; L666-I701 HydrophobicContact CG-CD1 4.42Å; L697-I701 WeakPolarHBondContact O-CB 3.46Å; L697-I701 VanDerWaalsContact O-CG1 3.24Å; L697-I701 WeakPolarHBondContact O-CG1 3.15Å; L697-I701 PolarHBondContact O-N 3.07Å; E698-I701 PolarHBondContact O-N 3.29Å; E698-I701 VanDerWaalsContact O-N 3.15Å; I701-L704 PolarHBondContact O-N 3.05Å; I701-Q705 WeakPolarHBondContact O-CB 3.31Å; I701-Q705 PolarHBondContact O-N 3.4Å
702	E	94.9	Very high	91.3	Very high	124 Å²	124	75.1 Å²	75.1	58%	0.579	37%	0.366	S	S	*	.	H	α-helix	trans	-59.6	-49.5	176.5	-172.5	176	-163.5	0	0	111	E698 E699 L704 Q705 E706	E698-E702 PolarHBondContact O-N 3.21Å; E699-E702 PolarHBondContact O-N 2.91Å; E702-L704 VanDerWaalsContact C-N 3.29Å; E702-L704 PolarHBondContact O-N 3.35Å; E702-Q705 WeakPolarHBondContact O-CB 3.06Å; E702-Q705 PolarHBondContact O-N 3.19Å; E702-Q705 VanDerWaalsContact O-N 3.14Å; E702-E706 PolarHBondContact O-N 2.89Å
703	R	94.6	Very high	92.2	Very high	139 Å²	139	72.7 Å²	72.7	53%	0.525	36%	0.358	S	S	.	.	H	α-helix	trans	-61.4	-35	175.6	-69	173.1	-178.3	-177.8	3	113.1	E699 Q700 K707	E699-R703 VanDerWaalsContact CD-NH2 3.34Å; E699-R703 VanDerWaalsContact O-CG 3.31Å; E699-R703 WeakPolarHBondContact O-CG 3.06Å; E699-R703 PolarHBondContact O-N 3.06Å; E699-R703 IonicContact OE1-CZ 3.07Å; E699-R703 IonicContact OE1-NE 2.82Å; E699-R703 IonicContact OE1-NH2 3.72Å; E699-R703 PolarHBondContact OE1-NH2 2.89Å; E699-R703 IonicContact OE2-NH2 2.63Å; Q700-R703 PolarHBondContact O-N 3.17Å; R703-K707 VanDerWaalsContact O-CG 3.3Å; R703-K707 WeakPolarHBondContact O-CG 3.35Å; R703-K707 PolarHBondContact O-N 2.93Å
704	L	94.6	Very high	93	Very high	11 Å²	11	72.5 Å²	72.5	6%	0.058	36%	0.357	C	S	.	.	H	α-helix	trans	-72.8	-36.7	176.4	-77.6	170.9	0	0	0	111.4	I655 E658 L659 A662 Q700 I701 E702 K707 V708	I655-L704 HydrophobicContact CG2-CD2 4.49Å; E658-L704 HydrophobicContact CB-CD2 4.26Å; L659-L704 HydrophobicContact CB-CB 4.23Å; L659-L704 HydrophobicContact CD1-CB 3.77Å; A662-L704 HydrophobicContact CB-CD1 3.95Å; Q700-L704 HydrophobicContact CG-CD1 4.03Å; Q700-L704 HydrophobicContact CG-CG 4.49Å; Q700-L704 WeakPolarHBondContact O-CB 2.86Å; Q700-L704 VanDerWaalsContact O-CG 3.28Å; Q700-L704 WeakPolarHBondContact O-CG 3.31Å; Q700-L704 PolarHBondContact O-N 3.1Å; I701-L704 PolarHBondContact O-N 3.05Å; E702-L704 VanDerWaalsContact C-N 3.29Å; E702-L704 PolarHBondContact O-N 3.35Å; L704-K707 WeakPolarHBondContact O-CB 3.37Å; L704-K707 PolarHBondContact O-N 3.28Å; L704-V708 WeakPolarHBondContact O-CG2 3.39Å; L704-V708 PolarHBondContact O-N 3Å
705	Q	95.3	Very high	93.7	Very high	66 Å²	66	71.6 Å²	71.6	31%	0.308	35%	0.353	S	S	.	.	H	α-helix	trans	-61.6	-48.5	175.8	-173.8	69.8	41.4	0	0	110.7	L659 I701 E702 K707 V708 E709	L659-Q705 HydrophobicContact CD1-CB 4.5Å; I701-Q705 WeakPolarHBondContact O-CB 3.31Å; I701-Q705 PolarHBondContact O-N 3.4Å; E702-Q705 WeakPolarHBondContact O-CB 3.06Å; E702-Q705 PolarHBondContact O-N 3.19Å; E702-Q705 VanDerWaalsContact O-N 3.14Å; Q705-K707 VanDerWaalsContact C-N 3.29Å; Q705-K707 PolarHBondContact O-N 2.9Å; Q705-V708 PolarHBondContact O-N 3.41Å; Q705-V708 VanDerWaalsContact O-N 3.13Å; Q705-E709 PolarHBondContact NE2-OE1 2.91Å; Q705-E709 WeakPolarHBondContact O-CG 3.33Å; Q705-E709 PolarHBondContact O-N 3.16Å
706	E	96.3	Very high	94.3	Very high	124 Å²	124	72.8 Å²	72.8	58%	0.579	35%	0.348	S	S	*	.	H	α-helix	trans	-57.7	-41.1	174	-69.1	-177.8	162.2	0	0	112.2	E702 E709 S710	E702-E706 PolarHBondContact O-N 2.89Å; E706-E709 PolarHBondContact O-N 3.32Å; E706-S710 WeakPolarHBondContact O-CB 3.36Å; E706-S710 PolarHBondContact O-N 3.24Å
707	K	95.2	Very high	94.7	Very high	122 Å²	122	70.4 Å²	70.4	53%	0.53	34%	0.339	S	S	.	.	H	α-helix	trans	-65.7	-39.2	176.4	-76.4	175.3	-178.4	177.6	0	112.7	I655 R703 L704 Q705 A711	I655-K707 HydrophobicContact CG2-CB 3.88Å; R703-K707 VanDerWaalsContact O-CG 3.3Å; R703-K707 WeakPolarHBondContact O-CG 3.35Å; R703-K707 PolarHBondContact O-N 2.93Å; L704-K707 WeakPolarHBondContact O-CB 3.37Å; L704-K707 PolarHBondContact O-N 3.28Å; Q705-K707 VanDerWaalsContact C-N 3.29Å; Q705-K707 PolarHBondContact O-N 2.9Å; K707-A711 VanDerWaalsContact O-CB 3.29Å; K707-A711 WeakPolarHBondContact O-CB 3.49Å; K707-A711 PolarHBondContact O-N 3.07Å
708	V	95.2	Very high	95.2	Very high	6 Å²	6	69.4 Å²	69.4	4%	0.036	33%	0.334	C	S	.	.	H	α-helix	trans	-62.9	-46.9	175.5	170	0	0	0	0	109.9	I655 Q656 L659 L704 Q705 S710 A711 Q712	I655-V708 HydrophobicContact CB-CG2 4.19Å; I655-V708 HydrophobicContact CG2-CG2 3.53Å; Q656-V708 HydrophobicContact CG-CG1 3.89Å; Q656-V708 HydrophobicContact CG-CG2 4.18Å; L659-V708 HydrophobicContact CB-CG2 4.28Å; L659-V708 HydrophobicContact CD2-CB 4.49Å; L659-V708 HydrophobicContact CD2-CG2 3.86Å; L704-V708 WeakPolarHBondContact O-CG2 3.39Å; L704-V708 PolarHBondContact O-N 3Å; Q705-V708 PolarHBondContact O-N 3.41Å; Q705-V708 VanDerWaalsContact O-N 3.13Å; V708-S710 PolarHBondContact O-N 3.09Å; V708-A711 PolarHBondContact O-N 3.38Å; V708-Q712 HydrophobicContact CG1-CG 4.14Å; V708-Q712 WeakPolarHBondContact O-CB 3.36Å; V708-Q712 VanDerWaalsContact O-CG 3.27Å; V708-Q712 WeakPolarHBondContact O-CG 3.39Å; V708-Q712 PolarHBondContact O-N 2.99Å
709	E	95.8	Very high	95.5	Very high	108 Å²	108	64.7 Å²	64.7	51%	0.505	31%	0.312	S	S	.	.	H	α-helix	trans	-61.6	-44.1	179.9	-71.7	174.1	-165.1	0	0	111.8	Q705 E706 Q712 S713	Q705-E709 PolarHBondContact NE2-OE1 2.91Å; Q705-E709 WeakPolarHBondContact O-CG 3.33Å; Q705-E709 PolarHBondContact O-N 3.16Å; E706-E709 PolarHBondContact O-N 3.32Å; E709-Q712 PolarHBondContact O-N 3.04Å; E709-S713 WeakPolarHBondContact O-CB 3.41Å; E709-S713 PolarHBondContact O-N 3.31Å
710	S	96.1	Very high	95.7	Very high	66 Å²	66	61.4 Å²	61.4	46%	0.462	30%	0.297	S	S	.	.	H	α-helix	trans	-60.7	-49.3	174.2	-175.1	0	0	0	0	111.9	E706 V708 Q712 S713 E714	E706-S710 WeakPolarHBondContact O-CB 3.36Å; E706-S710 PolarHBondContact O-N 3.24Å; V708-S710 PolarHBondContact O-N 3.09Å; S710-Q712 PolarHBondContact O-N 3.43Å; S710-S713 WeakPolarHBondContact O-CB 3.46Å; S710-S713 PolarHBondContact O-N 3.27Å; S710-S713 VanDerWaalsContact O-N 3.14Å; S710-E714 PolarHBondContact O-N 3.41Å
711	A	95.6	Very high	95.9	Very high	3 Å²	3	57.9 Å²	57.9	3%	0.025	28%	0.283	C	S	.	.	H	α-helix	trans	-65.3	-36.8	-180	0	0	0	0	0	112.7	M648 V652 I655 K707 V708 E714 Q715	M648-A711 WeakPolarHBondContact CE-O 3.32Å; V652-A711 HydrophobicContact CG2-CB 3.99Å; V652-A711 WeakPolarHBondContact CG2-O 3.28Å; I655-A711 HydrophobicContact CD1-CB 3.78Å; K707-A711 VanDerWaalsContact O-CB 3.29Å; K707-A711 WeakPolarHBondContact O-CB 3.49Å; K707-A711 PolarHBondContact O-N 3.07Å; V708-A711 PolarHBondContact O-N 3.38Å; A711-E714 PolarHBondContact O-N 2.78Å; A711-Q715 WeakPolarHBondContact O-CB 3.26Å; A711-Q715 PolarHBondContact O-N 2.99Å
712	Q	95.5	Very high	96.1	Very high	60 Å²	60	56.9 Å²	56.9	28%	0.28	28%	0.277	S	S	.	.	H	α-helix	trans	-66.6	-38.1	173.2	-76	178.9	-24.8	0	0	111.7	V652 V708 E709 S710 Q715 K716	V652-Q712 HydrophobicContact CG1-CG 3.83Å; V708-Q712 HydrophobicContact CG1-CG 4.14Å; V708-Q712 WeakPolarHBondContact O-CB 3.36Å; V708-Q712 VanDerWaalsContact O-CG 3.27Å; V708-Q712 WeakPolarHBondContact O-CG 3.39Å; V708-Q712 PolarHBondContact O-N 2.99Å; E709-Q712 PolarHBondContact O-N 3.04Å; S710-Q712 PolarHBondContact O-N 3.43Å; Q712-Q715 PolarHBondContact O-N 3.04Å; Q712-K716 WeakPolarHBondContact O-CB 3.39Å; Q712-K716 PolarHBondContact O-N 2.82Å
713	S	95.8	Very high	96.3	Very high	61 Å²	61	51 Å²	51	43%	0.427	25%	0.25	S	C	.	.	H	α-helix	trans	-62.5	-46.2	173.4	-172.7	0	0	0	0	111.2	E709 S710 Q715 K716 N717	E709-S713 WeakPolarHBondContact O-CB 3.41Å; E709-S713 PolarHBondContact O-N 3.31Å; S710-S713 WeakPolarHBondContact O-CB 3.46Å; S710-S713 PolarHBondContact O-N 3.27Å; S710-S713 VanDerWaalsContact O-N 3.14Å; S713-Q715 PolarHBondContact O-N 2.99Å; S713-K716 PolarHBondContact O-N 2.64Å; S713-N717 WeakPolarHBondContact O-CB 3.35Å; S713-N717 PolarHBondContact O-N 3.32Å; S713-N717 PolarHBondContact O-ND2 3.1Å
714	E	95.4	Very high	96.4	Very high	99 Å²	99	49.3 Å²	49.3	46%	0.463	25%	0.248	S	C	.	.	H	α-helix	trans	-59.5	-44.1	174.2	-72.4	-178.7	-173.8	0	0	112.4	M648 S710 A711 N717 L718	M648-E714 HydrophobicContact CE-CB 3.76Å; M648-E714 HydrophobicContact SD-CB 4.26Å; S710-E714 PolarHBondContact O-N 3.41Å; A711-E714 PolarHBondContact O-N 2.78Å; E714-N717 PolarHBondContact O-N 3.03Å; E714-L718 WeakPolarHBondContact O-CB 3.45Å; E714-L718 PolarHBondContact O-N 3.23Å
715	Q	97.4	Very high	96.6	Very high	8 Å²	8	52.9 Å²	52.9	4%	0.037	26%	0.261	C	S	.	.	H	α-helix	trans	-61.7	-47.4	176.7	-179.8	-178.3	48.5	0	0	111.6	M648 N649 V652 A711 Q712 S713 L718 F719 T766 Y770	M648-Q715 HydrophobicContact CE-CB 4.23Å; M648-Q715 HydrophobicContact CG-CB 3.91Å; M648-Q715 HydrophobicContact CG-CG 4.23Å; N649-Q715 PolarHBondContact OD1-NE2 3.37Å; V652-Q715 HydrophobicContact CG2-CB 3.89Å; V652-Q715 HydrophobicContact CG2-CG 4.42Å; A711-Q715 WeakPolarHBondContact O-CB 3.26Å; A711-Q715 PolarHBondContact O-N 2.99Å; Q712-Q715 PolarHBondContact O-N 3.04Å; S713-Q715 PolarHBondContact O-N 2.99Å; Q715-L718 WeakPolarHBondContact O-CB 3.46Å; Q715-L718 PolarHBondContact O-N 2.97Å; Q715-F719 HydrophobicContact CG-CD2 4.3Å; Q715-F719 HydrophobicContact CG-CE2 4.07Å; Q715-F719 VanDerWaalsContact O-CD2 3.27Å; Q715-F719 WeakPolarHBondContact O-CD2 3.44Å; Q715-F719 PolarHBondContact O-N 3.16Å; Q715-T766 HydrophobicContact CG-CG2 4.23Å; Q715-Y770 PolarHBondContact OE1-OH 3.35Å
716	K	96.3	Very high	96.7	Very high	62 Å²	62	49.8 Å²	49.8	27%	0.27	25%	0.246	S	C	.	.	H	α-helix	trans	-58.9	-49.3	176.1	-178.6	-178.9	179.3	178.9	0	110.8	Q712 S713 L718 F719 L720 Y770 T773	Q712-K716 WeakPolarHBondContact O-CB 3.39Å; Q712-K716 PolarHBondContact O-N 2.82Å; S713-K716 PolarHBondContact O-N 2.64Å; K716-L718 VanDerWaalsContact C-N 3.31Å; K716-L718 PolarHBondContact O-N 3.5Å; K716-F719 PolarHBondContact O-N 2.85Å; K716-F719 VanDerWaalsContact O-N 3.16Å; K716-L720 HydrophobicContact CG-CD1 4.28Å; K716-L720 HydrophobicContact CG-CG 4.48Å; K716-L720 WeakPolarHBondContact O-CG 3.47Å; K716-L720 PolarHBondContact O-N 3.15Å; K716-Y770 HydrophobicContact CB-CD1 4.37Å; K716-Y770 HydrophobicContact CB-CD2 4.48Å; K716-Y770 HydrophobicContact CB-CE1 4Å; K716-Y770 HydrophobicContact CB-CE2 4.11Å; K716-Y770 HydrophobicContact CD-CD1 4.21Å; K716-Y770 HydrophobicContact CD-CE1 4.41Å; K716-Y770 HydrophobicContact CG-CD1 4.09Å; K716-Y770 HydrophobicContact CG-CD2 4.37Å; K716-Y770 HydrophobicContact CG-CE1 4.22Å; K716-Y770 HydrophobicContact CG-CE2 4.48Å; K716-Y770 HydrophobicContact CG-CG 4.17Å; K716-T773 VanDerWaalsContact CE-OG1 3.31Å; K716-T773 WeakPolarHBondContact CE-OG1 3.43Å; K716-T773 PolarHBondContact NZ-OG1 3.32Å
717	N	96.1	Very high	96.8	Very high	79 Å²	79	45 Å²	45	42%	0.422	22%	0.224	S	C	.	.	H	α-helix	trans	-61.5	-38.4	179.8	-70.8	-23.6	0	0	0	112	S713 E714 F719 L720 V721	S713-N717 WeakPolarHBondContact O-CB 3.35Å; S713-N717 PolarHBondContact O-N 3.32Å; S713-N717 PolarHBondContact O-ND2 3.1Å; E714-N717 PolarHBondContact O-N 3.03Å; N717-F719 PolarHBondContact O-N 3.37Å; N717-L720 PolarHBondContact O-N 2.82Å; N717-V721 WeakPolarHBondContact O-CG2 3.49Å; N717-V721 PolarHBondContact O-N 2.75Å
718	L	97.6	Very high	97	Very high	3 Å²	3	43.1 Å²	43.1	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-57.5	-47.7	173.6	177.2	62.3	0	0	0	111.8	C616 A620 I645 M648 E714 Q715 K716 V721 I722	C616-L718 HydrophobicContact CB-CD1 3.88Å; C616-L718 HydrophobicContact CB-CD2 3.8Å; C616-L718 HydrophobicContact CB-CG 4.38Å; C616-L718 WeakPolarHBondContact O-CD1 3.29Å; A620-L718 HydrophobicContact CB-CD1 3.92Å; I645-L718 HydrophobicContact CG1-CD2 4.24Å; M648-L718 HydrophobicContact CB-CD2 3.77Å; M648-L718 HydrophobicContact CG-CD2 3.91Å; E714-L718 WeakPolarHBondContact O-CB 3.45Å; E714-L718 PolarHBondContact O-N 3.23Å; Q715-L718 WeakPolarHBondContact O-CB 3.46Å; Q715-L718 PolarHBondContact O-N 2.97Å; K716-L718 VanDerWaalsContact C-N 3.31Å; K716-L718 PolarHBondContact O-N 3.5Å; L718-V721 PolarHBondContact O-N 3.09Å; L718-I722 HydrophobicContact CD1-CD1 4.02Å; L718-I722 HydrophobicContact CD1-CG1 4.47Å; L718-I722 HydrophobicContact CG-CD1 3.98Å; L718-I722 WeakPolarHBondContact O-CD1 3.37Å; L718-I722 VanDerWaalsContact O-CG1 3.24Å; L718-I722 WeakPolarHBondContact O-CG1 3.49Å; L718-I722 PolarHBondContact O-N 3.19Å
719	F	97.9	Very high	97.1	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.009	22%	0.222	C	C	.	.	H	α-helix	trans	-64.3	-42.3	176.2	-78.8	-73	0	0	0	112.1	I645 Q715 K716 N717 V721 I722 F723 I759 H763 T766 I767 Y770	I645-F719 HydrophobicContact CG2-CE1 4.05Å; I645-F719 HydrophobicContact CG2-CE2 4.24Å; I645-F719 HydrophobicContact CG2-CZ 3.53Å; Q715-F719 HydrophobicContact CG-CD2 4.3Å; Q715-F719 HydrophobicContact CG-CE2 4.07Å; Q715-F719 VanDerWaalsContact O-CD2 3.27Å; Q715-F719 WeakPolarHBondContact O-CD2 3.44Å; Q715-F719 PolarHBondContact O-N 3.16Å; K716-F719 PolarHBondContact O-N 2.85Å; K716-F719 VanDerWaalsContact O-N 3.16Å; N717-F719 PolarHBondContact O-N 3.37Å; F719-V721 VanDerWaalsContact C-N 3.35Å; F719-V721 PolarHBondContact O-N 3.37Å; F719-I722 PolarHBondContact O-N 2.89Å; F719-F723 HydrophobicContact CB-CD2 4.29Å; F719-F723 HydrophobicContact CB-CE2 3.99Å; F719-F723 HydrophobicContact CD1-CE2 4.22Å; F719-F723 HydrophobicContact CD1-CZ 4.37Å; F719-F723 WeakPolarHBondContact O-CD2 3.42Å; F719-F723 WeakPolarHBondContact O-CG 3.34Å; F719-F723 PolarHBondContact O-N 3.39Å; F719-I759 HydrophobicContact CD1-CG2 4.16Å; F719-I759 HydrophobicContact CE1-CG2 4.1Å; F719-H763 HydrophobicContact CE1-CB 3.93Å; F719-H763 HydrophobicContact CZ-CB 3.78Å; F719-T766 HydrophobicContact CE2-CG2 3.72Å; F719-T766 HydrophobicContact CZ-CG2 4.29Å; F719-I767 HydrophobicContact CD1-CD1 4.16Å; F719-I767 HydrophobicContact CD1-CG1 3.92Å; F719-I767 HydrophobicContact CE1-CD1 3.83Å; F719-I767 HydrophobicContact CE1-CG1 3.73Å; F719-I767 HydrophobicContact CG-CG1 4.47Å; F719-I767 HydrophobicContact CZ-CG1 4.13Å; F719-Y770 HydrophobicContact CD2-CE2 4.11Å
720	L	96.9	Very high	97.2	Very high	24 Å²	24	38.7 Å²	38.7	13%	0.126	20%	0.198	C	C	.	.	H	α-helix	trans	-58.7	-45.9	176.8	-67.4	178.1	0	0	0	111.6	K716 N717 I722 F723 Q724 T773 L774 L778	K716-L720 HydrophobicContact CG-CD1 4.28Å; K716-L720 HydrophobicContact CG-CG 4.48Å; K716-L720 WeakPolarHBondContact O-CG 3.47Å; K716-L720 PolarHBondContact O-N 3.15Å; N717-L720 PolarHBondContact O-N 2.82Å; L720-I722 PolarHBondContact O-N 3.38Å; L720-F723 PolarHBondContact O-N 3.48Å; L720-Q724 WeakPolarHBondContact O-CB 3.43Å; L720-Q724 VanDerWaalsContact O-CG 3.23Å; L720-Q724 WeakPolarHBondContact O-CG 3.19Å; L720-Q724 PolarHBondContact O-N 3.19Å; L720-T773 HydrophobicContact CD2-CG2 4.17Å; L720-L774 HydrophobicContact CD2-CD2 3.93Å; L720-L778 HydrophobicContact CD2-CD1 3.56Å; L720-L778 HydrophobicContact CD2-CG 4.25Å
721	V	97.2	Very high	97.3	Very high	27 Å²	27	38 Å²	38	16%	0.164	19%	0.191	C	C	.	.	H	α-helix	trans	-59.6	-47.4	176.1	169.3	0	0	0	0	110.7	A620 N717 L718 F719 F723 Q724 R725	A620-V721 HydrophobicContact CB-CG1 4.24Å; N717-V721 WeakPolarHBondContact O-CG2 3.49Å; N717-V721 PolarHBondContact O-N 2.75Å; L718-V721 PolarHBondContact O-N 3.09Å; F719-V721 VanDerWaalsContact C-N 3.35Å; F719-V721 PolarHBondContact O-N 3.37Å; V721-F723 PolarHBondContact O-N 3.32Å; V721-Q724 PolarHBondContact O-N 2.82Å; V721-R725 HydrophobicContact CG1-CG 4.48Å; V721-R725 VanDerWaalsContact O-CG 3.28Å; V721-R725 WeakPolarHBondContact O-CG 3.42Å; V721-R725 PolarHBondContact O-N 3.43Å
722	I	98.5	Very high	97.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59.2	-48.4	179.2	-68.9	164.2	0	0	0	110.8	A620 F624 L641 I645 L718 F719 L720 R725 F726 I759	A620-I722 HydrophobicContact CB-CG1 4.02Å; F624-I722 HydrophobicContact CE2-CG2 4.4Å; F624-I722 HydrophobicContact CZ-CG2 4.41Å; L641-I722 HydrophobicContact CD1-CD1 3.89Å; L641-I722 HydrophobicContact CD1-CG1 4.12Å; I645-I722 HydrophobicContact CD1-CD1 3.78Å; I645-I722 HydrophobicContact CG1-CD1 3.88Å; L718-I722 HydrophobicContact CD1-CD1 4.02Å; L718-I722 HydrophobicContact CD1-CG1 4.47Å; L718-I722 HydrophobicContact CG-CD1 3.98Å; L718-I722 WeakPolarHBondContact O-CD1 3.37Å; L718-I722 VanDerWaalsContact O-CG1 3.24Å; L718-I722 WeakPolarHBondContact O-CG1 3.49Å; L718-I722 PolarHBondContact O-N 3.19Å; F719-I722 PolarHBondContact O-N 2.89Å; L720-I722 PolarHBondContact O-N 3.38Å; I722-R725 PolarHBondContact O-N 3.08Å; I722-F726 HydrophobicContact CG2-CD2 3.78Å; I722-F726 HydrophobicContact CG2-CE2 3.73Å; I722-F726 VanDerWaalsContact O-CD2 3.31Å; I722-F726 WeakPolarHBondContact O-CD2 3.32Å; I722-F726 PolarHBondContact O-N 3.17Å; I722-I759 HydrophobicContact CG2-CD1 4.25Å; I722-I759 HydrophobicContact CG2-CG1 4.15Å
723	F	98.6	Very high	97.5	Very high	1 Å²	1	40 Å²	40	0%	0.004	20%	0.199	C	C	.	.	H	α-helix	trans	-65.9	-41.9	180	-68	-48.4	0	0	0	112.5	F719 L720 V721 R725 F726 I727 L756 I759 F760 I767 L774 L778 F779	F719-F723 HydrophobicContact CB-CD2 4.29Å; F719-F723 HydrophobicContact CB-CE2 3.99Å; F719-F723 HydrophobicContact CD1-CE2 4.22Å; F719-F723 HydrophobicContact CD1-CZ 4.37Å; F719-F723 WeakPolarHBondContact O-CD2 3.42Å; F719-F723 WeakPolarHBondContact O-CG 3.34Å; F719-F723 PolarHBondContact O-N 3.39Å; L720-F723 PolarHBondContact O-N 3.48Å; V721-F723 PolarHBondContact O-N 3.32Å; F723-R725 VanDerWaalsContact C-N 3.31Å; F723-R725 PolarHBondContact O-N 3.31Å; F723-F726 PolarHBondContact O-N 3.06Å; F723-I727 WeakPolarHBondContact O-CB 3.48Å; F723-I727 VanDerWaalsContact O-CG1 3.23Å; F723-I727 WeakPolarHBondContact O-CG1 3.49Å; F723-I727 PolarHBondContact O-N 2.97Å; F723-L756 HydrophobicContact CD1-CD1 3.69Å; F723-L756 HydrophobicContact CE1-CD1 3.95Å; F723-I759 HydrophobicContact CE1-CB 4.37Å; F723-I759 HydrophobicContact CE1-CG2 3.75Å; F723-I759 HydrophobicContact CZ-CG2 3.87Å; F723-F760 HydrophobicContact CD1-CE2 4.42Å; F723-F760 HydrophobicContact CD1-CZ 4.12Å; F723-F760 HydrophobicContact CE1-CD1 4.35Å; F723-F760 HydrophobicContact CE1-CD2 4.31Å; F723-F760 AromaticContact CE1-CE1 3.76Å; F723-F760 HydrophobicContact CE1-CE1 3.76Å; F723-F760 AromaticContact CE1-CE2 3.73Å; F723-F760 HydrophobicContact CE1-CE2 3.73Å; F723-F760 AromaticContact CE1-CZ 3.4Å; F723-F760 HydrophobicContact CE1-CZ 3.4Å; F723-F760 VanDerWaalsContact CE1-CZ 3.4Å; F723-F760 HydrophobicContact CE2-CE1 4.36Å; F723-F760 HydrophobicContact CZ-CD1 4.09Å; F723-F760 AromaticContact CZ-CE1 3.51Å; F723-F760 HydrophobicContact CZ-CE1 3.51Å; F723-F760 HydrophobicContact CZ-CE2 4.35Å; F723-F760 AromaticContact CZ-CZ 3.66Å; F723-F760 HydrophobicContact CZ-CZ 3.66Å; F723-I767 HydrophobicContact CZ-CD1 4.03Å; F723-I767 HydrophobicContact CZ-CG1 4.45Å; F723-I767 HydrophobicContact CZ-CG2 4.38Å; F723-L774 HydrophobicContact CD2-CD2 3.64Å; F723-L774 HydrophobicContact CE2-CD1 4Å; F723-L774 HydrophobicContact CE2-CD2 3.88Å; F723-L778 HydrophobicContact CB-CD1 3.69Å; F723-L778 HydrophobicContact CD2-CD1 4.43Å; F723-F779 HydrophobicContact CB-CE2 4.17Å; F723-F779 HydrophobicContact CB-CZ 4.17Å; F723-F779 HydrophobicContact CD1-CE2 4.15Å; F723-F779 AromaticContact CD1-CZ 3.86Å; F723-F779 HydrophobicContact CD1-CZ 3.86Å; F723-F779 HydrophobicContact CD2-CE2 4.31Å; F723-F779 HydrophobicContact CE1-CZ 4.46Å; F723-F779 AromaticContact CG-CE2 3.97Å; F723-F779 HydrophobicContact CG-CE2 3.97Å; F723-F779 HydrophobicContact CG-CZ 4.05Å
724	Q	97.8	Very high	97.6	Very high	104 Å²	104	37.5 Å²	37.5	49%	0.486	18%	0.181	S	C	.	.	H	α-helix	trans	-58.2	-43.5	174.9	-76.6	173.2	-12.1	0	0	111.7	L720 V721 I727 M728 L778	L720-Q724 WeakPolarHBondContact O-CB 3.43Å; L720-Q724 VanDerWaalsContact O-CG 3.23Å; L720-Q724 WeakPolarHBondContact O-CG 3.19Å; L720-Q724 PolarHBondContact O-N 3.19Å; V721-Q724 PolarHBondContact O-N 2.82Å; Q724-I727 PolarHBondContact O-N 3.34Å; Q724-M728 VanDerWaalsContact O-CB 3.31Å; Q724-M728 WeakPolarHBondContact O-CB 3.47Å; Q724-M728 PolarHBondContact O-N 3.27Å; Q724-L778 HydrophobicContact CG-CD1 4.41Å; Q724-L778 HydrophobicContact CG-CD2 3.52Å
725	R	98.1	Very high	97.7	Very high	86 Å²	86	36.4 Å²	36.4	33%	0.325	18%	0.181	S	C	.	.	H	α-helix	trans	-65.4	-41.6	177.5	-66.7	-61.1	-176.7	-172.4	1.1	112.4	N621 F624 V721 I722 F723 L729	N621-R725 VanDerWaalsContact OD1-CZ 3.31Å; N621-R725 PolarHBondContact OD1-NE 3.4Å; N621-R725 PolarHBondContact OD1-NH2 3.34Å; F624-R725 HydrophobicContact CB-CB 3.87Å; F624-R725 HydrophobicContact CB-CG 3.95Å; F624-R725 HydrophobicContact CD1-CB 3.76Å; F624-R725 HydrophobicContact CD2-CB 3.66Å; F624-R725 HydrophobicContact CD2-CG 3.97Å; F624-R725 HydrophobicContact CE1-CB 4.17Å; F624-R725 HydrophobicContact CE2-CB 4.13Å; F624-R725 HydrophobicContact CG-CB 3.49Å; F624-R725 VanDerWaalsContact CG-CB 3.49Å; F624-R725 HydrophobicContact CG-CG 3.99Å; F624-R725 HydrophobicContact CZ-CB 4.36Å; V721-R725 HydrophobicContact CG1-CG 4.48Å; V721-R725 VanDerWaalsContact O-CG 3.28Å; V721-R725 WeakPolarHBondContact O-CG 3.42Å; V721-R725 PolarHBondContact O-N 3.43Å; I722-R725 PolarHBondContact O-N 3.08Å; F723-R725 VanDerWaalsContact C-N 3.31Å; F723-R725 PolarHBondContact O-N 3.31Å; R725-L729 WeakPolarHBondContact O-CG 3.43Å; R725-L729 PolarHBondContact O-N 3.43Å
726	F	98.6	Very high	97.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.4	-49.8	173.4	-88	-64.9	0	0	0	112.3	F624 W638 I722 F723 M728 L729 L730 C752 R755 L756 I759	F624-F726 HydrophobicContact CE1-CD1 4.1Å; F624-F726 HydrophobicContact CE1-CD2 4.18Å; F624-F726 HydrophobicContact CE1-CE1 4.06Å; F624-F726 HydrophobicContact CE1-CE2 4.14Å; F624-F726 HydrophobicContact CE1-CG 4.16Å; F624-F726 HydrophobicContact CE1-CZ 4.1Å; F624-F726 HydrophobicContact CZ-CD1 4.48Å; F624-F726 AromaticContact CZ-CD2 3.81Å; F624-F726 HydrophobicContact CZ-CD2 3.81Å; F624-F726 HydrophobicContact CZ-CE1 4.29Å; F624-F726 AromaticContact CZ-CE2 3.59Å; F624-F726 HydrophobicContact CZ-CE2 3.59Å; F624-F726 HydrophobicContact CZ-CG 4.27Å; F624-F726 AromaticContact CZ-CZ 3.87Å; F624-F726 HydrophobicContact CZ-CZ 3.87Å; W638-F726 AromaticContact CH2-CE1 3.79Å; W638-F726 HydrophobicContact CH2-CE1 3.79Å; W638-F726 AromaticContact CH2-CZ 3.57Å; W638-F726 HydrophobicContact CH2-CZ 3.57Å; W638-F726 HydrophobicContact CZ3-CE1 4.18Å; W638-F726 HydrophobicContact CZ3-CE2 4.3Å; W638-F726 AromaticContact CZ3-CZ 3.46Å; W638-F726 HydrophobicContact CZ3-CZ 3.46Å; W638-F726 VanDerWaalsContact CZ3-CZ 3.46Å; I722-F726 HydrophobicContact CG2-CD2 3.78Å; I722-F726 HydrophobicContact CG2-CE2 3.73Å; I722-F726 VanDerWaalsContact O-CD2 3.31Å; I722-F726 WeakPolarHBondContact O-CD2 3.32Å; I722-F726 PolarHBondContact O-N 3.17Å; F723-F726 PolarHBondContact O-N 3.06Å; F726-M728 VanDerWaalsContact C-N 3.29Å; F726-M728 PolarHBondContact O-N 2.97Å; F726-L729 PolarHBondContact O-N 2.97Å; F726-L730 HydrophobicContact CB-CD1 4.45Å; F726-L730 VanDerWaalsContact O-CB 3.31Å; F726-L730 WeakPolarHBondContact O-CB 3.38Å; F726-L730 WeakPolarHBondContact O-CG 3.35Å; F726-L730 PolarHBondContact O-N 3.15Å; F726-C752 WeakPolarHBondContact CE1-O 3.35Å; F726-R755 HydrophobicContact CE1-CB 4.01Å; F726-R755 HydrophobicContact CZ-CB 3.89Å; F726-L756 HydrophobicContact CB-CD1 4Å; F726-L756 HydrophobicContact CD1-CB 3.91Å; F726-L756 HydrophobicContact CD2-CB 4.36Å; F726-L756 HydrophobicContact CD2-CD1 3.91Å; F726-L756 HydrophobicContact CE1-CB 4.09Å; F726-L756 HydrophobicContact CG-CB 4.05Å; F726-L756 HydrophobicContact CG-CD1 3.98Å; F726-L756 HydrophobicContact CZ-CB 4.37Å; F726-I759 HydrophobicContact CE2-CG1 3.82Å; F726-I759 HydrophobicContact CZ-CG1 4.46Å
727	I	98.4	Very high	97.6	Very high	24 Å²	24	40.3 Å²	40.3	12%	0.123	20%	0.195	C	C	.	.	H	α-helix	trans	-56.8	-47.3	179.6	-70.8	166.1	0	0	0	109.8	F723 Q724 T731 L778 F779 L783 I787	F723-I727 WeakPolarHBondContact O-CB 3.48Å; F723-I727 VanDerWaalsContact O-CG1 3.23Å; F723-I727 WeakPolarHBondContact O-CG1 3.49Å; F723-I727 PolarHBondContact O-N 2.97Å; Q724-I727 PolarHBondContact O-N 3.34Å; I727-T731 WeakPolarHBondContact O-CB 3.3Å; I727-T731 PolarHBondContact O-N 3.34Å; I727-T731 PolarHBondContact O-OG1 3.42Å; I727-L778 HydrophobicContact CD1-CB 4.02Å; I727-F779 HydrophobicContact CD1-CD1 4.46Å; I727-F779 HydrophobicContact CD1-CE1 4.1Å; I727-F779 HydrophobicContact CD1-CZ 4.17Å; I727-F779 HydrophobicContact CG1-CE1 4.29Å; I727-L783 HydrophobicContact CB-CD1 4.46Å; I727-L783 HydrophobicContact CD1-CD1 3.78Å; I727-L783 HydrophobicContact CG1-CD1 3.93Å; I727-L783 HydrophobicContact CG2-CD1 3.69Å; I727-I787 HydrophobicContact CG1-CG2 4.28Å
728	M	97.9	Very high	97.5	Very high	83 Å²	83	44 Å²	44	41%	0.409	21%	0.21	S	C	.	.	H	α-helix	trans	-58.3	-53.4	178.1	-172	-173.2	75.9	0	0	112.2	Q724 F726 T731 E732	Q724-M728 VanDerWaalsContact O-CB 3.31Å; Q724-M728 WeakPolarHBondContact O-CB 3.47Å; Q724-M728 PolarHBondContact O-N 3.27Å; F726-M728 VanDerWaalsContact C-N 3.29Å; F726-M728 PolarHBondContact O-N 2.97Å; M728-T731 PolarHBondContact O-N 2.95Å; M728-E732 WeakPolarHBondContact O-CB 3.31Å; M728-E732 PolarHBondContact O-N 3.17Å
729	L	97.9	Very high	97.3	Very high	21 Å²	21	49.3 Å²	49.3	11%	0.11	24%	0.243	C	C	.	.	H	α-helix	trans	-65.8	-41	-177.6	-70.3	-179.8	0	0	0	113	F624 F632 R725 F726 H733 W748	F624-L729 HydrophobicContact CD1-CD1 3.67Å; F624-L729 HydrophobicContact CE1-CD1 4.36Å; F632-L729 HydrophobicContact CE2-CD1 4.21Å; F632-L729 HydrophobicContact CZ-CD1 4.05Å; R725-L729 WeakPolarHBondContact O-CG 3.43Å; R725-L729 PolarHBondContact O-N 3.43Å; F726-L729 PolarHBondContact O-N 2.97Å; L729-H733 WeakPolarHBondContact O-CB 3.41Å; L729-H733 PolarHBondContact O-N 2.9Å; L729-W748 HydrophobicContact CB-CH2 4.3Å; L729-W748 HydrophobicContact CB-CZ2 4.47Å
730	L	98.4	Very high	97.1	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-67.7	-41.2	178.1	-72.3	164.9	0	0	0	110.7	F726 H733 L734 Y749 C752 I753 L756 I787	F726-L730 HydrophobicContact CB-CD1 4.45Å; F726-L730 VanDerWaalsContact O-CB 3.31Å; F726-L730 WeakPolarHBondContact O-CB 3.38Å; F726-L730 WeakPolarHBondContact O-CG 3.35Å; F726-L730 PolarHBondContact O-N 3.15Å; L730-H733 PolarHBondContact O-N 3.49Å; L730-L734 WeakPolarHBondContact O-CB 3.31Å; L730-L734 WeakPolarHBondContact O-CD1 3.28Å; L730-L734 WeakPolarHBondContact O-CG 3.46Å; L730-L734 PolarHBondContact O-N 2.84Å; L730-Y749 HydrophobicContact CD2-CD2 3.97Å; L730-Y749 HydrophobicContact CD2-CE2 3.86Å; L730-C752 HydrophobicContact CD2-CB 3.95Å; L730-I753 HydrophobicContact CD1-CD1 3.75Å; L730-I753 HydrophobicContact CD2-CB 4.3Å; L730-I753 HydrophobicContact CD2-CD1 4.13Å; L730-L756 HydrophobicContact CD1-CD2 3.85Å; L730-I787 HydrophobicContact CB-CD1 3.49Å; L730-I787 VanDerWaalsContact CB-CD1 3.49Å; L730-I787 HydrophobicContact CB-CG1 3.78Å; L730-I787 HydrophobicContact CD1-CD1 4.48Å; L730-I787 HydrophobicContact CD1-CG1 4.09Å; L730-I787 HydrophobicContact CD1-CG2 4.31Å
731	T	98.1	Very high	96.7	Very high	52 Å²	52	55.9 Å²	55.9	32%	0.319	30%	0.299	S	S	.	.	H	α-helix	trans	-64.8	-45.5	177.3	-56.9	0	0	0	0	111	I727 M728 H733 L734 V735	I727-T731 WeakPolarHBondContact O-CB 3.3Å; I727-T731 PolarHBondContact O-N 3.34Å; I727-T731 PolarHBondContact O-OG1 3.42Å; M728-T731 PolarHBondContact O-N 2.95Å; T731-H733 VanDerWaalsContact C-N 3.3Å; T731-H733 PolarHBondContact O-N 3.45Å; T731-L734 PolarHBondContact O-N 3.26Å; T731-V735 HydrophobicContact CG2-CG2 4.23Å; T731-V735 WeakPolarHBondContact O-CB 3.43Å; T731-V735 VanDerWaalsContact O-CG2 3.3Å; T731-V735 WeakPolarHBondContact O-CG2 3.5Å; T731-V735 PolarHBondContact O-N 3.46Å
732	E	97.3	Very high	96.6	Very high	97 Å²	97	59.1 Å²	59.1	45%	0.453	32%	0.318	S	S	.	.	H	α-helix	trans	-56.7	-44.9	175.1	-173.1	-170.2	153.5	0	0	111.4	M728 R736	M728-E732 WeakPolarHBondContact O-CB 3.31Å; M728-E732 PolarHBondContact O-N 3.17Å; E732-R736 WeakPolarHBondContact O-CB 3.34Å; E732-R736 PolarHBondContact O-N 3.27Å
733	H	97.4	Very high	96.3	Very high	6 Å²	6	64.2 Å²	64.2	3%	0.028	35%	0.345	C	S	.	.	H	α-helix	trans	-62.3	-48.7	176.8	-179.2	89.7	0	0	0	112.5	L729 L730 T731 R736 C737 I744 T746 W748 Y749	L729-H733 WeakPolarHBondContact O-CB 3.41Å; L729-H733 PolarHBondContact O-N 2.9Å; L730-H733 PolarHBondContact O-N 3.49Å; T731-H733 VanDerWaalsContact C-N 3.3Å; T731-H733 PolarHBondContact O-N 3.45Å; H733-R736 PolarHBondContact ND1-NH2 3.45Å; H733-R736 PolarHBondContact O-N 3.17Å; H733-C737 PolarHBondContact NE2-SG 2.91Å; H733-C737 WeakPolarHBondContact O-CB 3.4Å; H733-C737 PolarHBondContact O-N 2.99Å; H733-C737 PolarHBondContact O-SG 3.49Å; H733-C737 VanDerWaalsContact O-SG 3.41Å; H733-I744 PolarHBondContact NE2-O 2.88Å; H733-T746 PolarHBondContact CE1-OG1 3.15Å; H733-W748 HydrophobicContact CB-CE3 4.4Å; H733-W748 HydrophobicContact CB-CH2 3.93Å; H733-W748 HydrophobicContact CB-CZ3 3.44Å; H733-W748 VanDerWaalsContact CB-CZ3 3.44Å; H733-W748 AromaticContact CE1-CE3 3.85Å; H733-W748 AromaticContact CG-CE3 3.91Å; H733-W748 AromaticContact CG-CZ3 3.38Å; H733-W748 AromaticContact ND1-CE3 3.4Å; H733-W748 AromaticContact ND1-CZ3 3.33Å; H733-W748 VanDerWaalsContact ND1-CZ3 3.33Å; H733-W748 WeakPolarHBondContact ND1-CZ3 3.43Å; H733-Y749 AromaticContact CD2-CD2 3.64Å; H733-Y749 AromaticContact NE2-CD2 3.98Å
734	L	97.5	Very high	96.1	Very high	9 Å²	9	66.5 Å²	66.5	5%	0.047	36%	0.357	C	S	.	.	H	α-helix	trans	-62.2	-47.7	-178.1	-70.2	164.8	0	0	0	111.1	L730 T731 R736 C737 E738 I744 Y749 D784 H786 I787	L730-L734 WeakPolarHBondContact O-CB 3.31Å; L730-L734 WeakPolarHBondContact O-CD1 3.28Å; L730-L734 WeakPolarHBondContact O-CG 3.46Å; L730-L734 PolarHBondContact O-N 2.84Å; T731-L734 PolarHBondContact O-N 3.26Å; L734-R736 VanDerWaalsContact C-N 3.32Å; L734-R736 PolarHBondContact O-N 2.85Å; L734-C737 PolarHBondContact O-N 3.17Å; L734-E738 WeakPolarHBondContact O-CB 3.37Å; L734-E738 PolarHBondContact O-N 3.3Å; L734-I744 HydrophobicContact CD2-CD1 3.92Å; L734-I744 HydrophobicContact CD2-CG1 4.2Å; L734-I744 HydrophobicContact CD2-CG2 3.59Å; L734-Y749 HydrophobicContact CD2-CE2 4.07Å; L734-Y749 HydrophobicContact CG-CE2 4.46Å; L734-D784 HydrophobicContact CD1-CB 3.95Å; L734-H786 HydrophobicContact CD1-CB 4.49Å; L734-I787 HydrophobicContact CD1-CD1 3.99Å; L734-I787 HydrophobicContact CD1-CG1 4.04Å
735	V	97.1	Very high	95.9	Very high	76 Å²	76	65.8 Å²	65.8	46%	0.461	36%	0.363	S	S	.	.	H	α-helix	trans	-61.7	-40.5	176.5	172.3	0	0	0	0	111.2	T731 E738 T739	T731-V735 HydrophobicContact CG2-CG2 4.23Å; T731-V735 WeakPolarHBondContact O-CB 3.43Å; T731-V735 VanDerWaalsContact O-CG2 3.3Å; T731-V735 WeakPolarHBondContact O-CG2 3.5Å; T731-V735 PolarHBondContact O-N 3.46Å; V735-E738 PolarHBondContact O-N 3.32Å; V735-T739 VanDerWaalsContact O-CB 3.28Å; V735-T739 WeakPolarHBondContact O-CB 3.4Å; V735-T739 PolarHBondContact O-N 2.8Å; V735-T739 PolarHBondContact O-OG1 3.09Å
736	R	96.2	Very high	95.8	Very high	144 Å²	144	63.5 Å²	63.5	54%	0.543	36%	0.359	S	S	.	.	H	α-helix	trans	-65.5	-41.8	177	-175.1	179.2	67.8	-162.8	1.7	111.9	E732 H733 L734 G740	E732-R736 WeakPolarHBondContact O-CB 3.34Å; E732-R736 PolarHBondContact O-N 3.27Å; H733-R736 PolarHBondContact ND1-NH2 3.45Å; H733-R736 PolarHBondContact O-N 3.17Å; L734-R736 VanDerWaalsContact C-N 3.32Å; L734-R736 PolarHBondContact O-N 2.85Å; R736-G740 PolarHBondContact O-N 3.3Å
737	C	95.8	Very high	95.7	Very high	8 Å²	8	65.5 Å²	65.5	5%	0.054	37%	0.372	C	S	.	.	H	α-helix	trans	-67.1	-41.7	177.1	-73.8	0	0	0	0	111.7	H733 L734 G740 S741 V742 I744	H733-C737 PolarHBondContact NE2-SG 2.91Å; H733-C737 WeakPolarHBondContact O-CB 3.4Å; H733-C737 PolarHBondContact O-N 2.99Å; H733-C737 PolarHBondContact O-SG 3.49Å; H733-C737 VanDerWaalsContact O-SG 3.41Å; L734-C737 PolarHBondContact O-N 3.17Å; C737-G740 PolarHBondContact O-N 3.41Å; C737-S741 WeakPolarHBondContact O-CA 3.43Å; C737-S741 PolarHBondContact O-N 3.01Å; C737-V742 WeakPolarHBondContact CB-O 3.23Å; C737-V742 PolarHBondContact O-N 3.39Å; C737-I744 HydrophobicContact CB-CG1 3.93Å
738	E	93.8	Very high	95.7	Very high	156 Å²	156	67.5 Å²	67.5	73%	0.729	38%	0.378	S	S	*	.	H	α-helix	trans	-61.6	-51	174.7	-174.7	176	-161.4	0	0	111.3	L734 V735 G740 S741	L734-E738 WeakPolarHBondContact O-CB 3.37Å; L734-E738 PolarHBondContact O-N 3.3Å; V735-E738 PolarHBondContact O-N 3.32Å; E738-G740 VanDerWaalsContact C-N 3.32Å; E738-G740 PolarHBondContact O-N 2.96Å; E738-S741 PolarHBondContact O-N 2.63Å
739	T	94.9	Very high	95.7	Very high	115 Å²	115	64.7 Å²	64.7	71%	0.706	36%	0.363	S	S	*	.	H	α-helix	trans	-62.8	-39.2	179.2	-55	0	0	0	0	111.9	V735	V735-T739 VanDerWaalsContact O-CB 3.28Å; V735-T739 WeakPolarHBondContact O-CB 3.4Å; V735-T739 PolarHBondContact O-N 2.8Å; V735-T739 PolarHBondContact O-OG1 3.09Å
740	G	92.4	Very high	95.7	Very high	47 Å²	47	65.7 Å²	65.7	49%	0.485	37%	0.367	S	S	.	.	H	α-helix	trans	-83.3	-7.1	-179.5	0	0	0	0	0	114.8	R736 C737 E738 V742	R736-G740 PolarHBondContact O-N 3.3Å; C737-G740 PolarHBondContact O-N 3.41Å; E738-G740 VanDerWaalsContact C-N 3.32Å; E738-G740 PolarHBondContact O-N 2.96Å; G740-V742 WeakPolarHBondContact O-CG2 3.42Å; G740-V742 PolarHBondContact O-N 2.86Å
741	S	89.9	Confident	95.7	Very high	118 Å²	118	66.3 Å²	66.3	83%	0.825	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	41.1	-169.5	-58.7	0	0	0	0	113.1	C737 E738	C737-S741 WeakPolarHBondContact O-CA 3.43Å; C737-S741 PolarHBondContact O-N 3.01Å; E738-S741 PolarHBondContact O-N 2.63Å
742	V	93.6	Very high	95.7	Very high	94 Å²	94	63.8 Å²	63.8	57%	0.57	36%	0.355	S	S	*	.			trans	-106.7	151.5	179.8	-165.4	0	0	0	0	109.5	C737 G740 I744	C737-V742 WeakPolarHBondContact CB-O 3.23Å; C737-V742 PolarHBondContact O-N 3.39Å; G740-V742 WeakPolarHBondContact O-CG2 3.42Å; G740-V742 PolarHBondContact O-N 2.86Å; V742-I744 PolarHBondContact O-N 3.2Å
743	D	92.9	Very high	95.8	Very high	107 Å²	107	60.3 Å²	60.3	57%	0.572	34%	0.339	S	S	*	.			trans	-59.7	133.3	176.4	-173.5	12	0	0	0	111.9	S745	D743-S745 VanDerWaalsContact C-N 3.3Å; D743-S745 WeakPolarHBondContact OD1-CB 3.34Å; D743-S745 PolarHBondContact OD1-N 3.08Å
744	I	94.6	Very high	95.8	Very high	49 Å²	49	61.1 Å²	61.1	25%	0.251	34%	0.342	S	S	.	.	S	Bend	trans	-70.7	-31.1	174.2	-63	168.5	0	0	0	110	H733 L734 C737 V742 T746 Y749	H733-I744 PolarHBondContact NE2-O 2.88Å; L734-I744 HydrophobicContact CD2-CD1 3.92Å; L734-I744 HydrophobicContact CD2-CG1 4.2Å; L734-I744 HydrophobicContact CD2-CG2 3.59Å; C737-I744 HydrophobicContact CB-CG1 3.93Å; V742-I744 PolarHBondContact O-N 3.2Å; I744-T746 PolarHBondContact O-N 3.28Å; I744-Y749 HydrophobicContact CG2-CD1 3.98Å; I744-Y749 HydrophobicContact CG2-CD2 4.08Å; I744-Y749 HydrophobicContact CG2-CE1 3.82Å; I744-Y749 HydrophobicContact CG2-CE2 3.92Å; I744-Y749 HydrophobicContact CG2-CG 4.1Å; I744-Y749 VanDerWaalsContact O-CB 3.23Å; I744-Y749 WeakPolarHBondContact O-CB 3.45Å; I744-Y749 WeakPolarHBondContact O-CD1 3.49Å
745	S	93.8	Very high	95.9	Very high	89 Å²	89	60.9 Å²	60.9	62%	0.622	34%	0.341	S	S	*	.			trans	-76.7	59.6	-172.4	-153.3	0	0	0	0	113.5	D743	D743-S745 VanDerWaalsContact C-N 3.3Å; D743-S745 WeakPolarHBondContact OD1-CB 3.34Å; D743-S745 PolarHBondContact OD1-N 3.08Å
746	T	96.1	Very high	96	Very high	39 Å²	39	57.2 Å²	57.2	24%	0.239	32%	0.319	C	S	.	.			trans	-86.8	155.3	175.1	66.9	0	0	0	0	111.3	H733 I744 W748 Y749 K750	H733-T746 PolarHBondContact CE1-OG1 3.15Å; I744-T746 PolarHBondContact O-N 3.28Å; T746-W748 PolarHBondContact O-N 3.11Å; T746-Y749 PolarHBondContact O-N 2.95Å; T746-Y749 VanDerWaalsContact O-N 3.1Å; T746-Y749 VanDerWaalsContact OG1-CB 3.28Å; T746-Y749 WeakPolarHBondContact OG1-CB 3.34Å; T746-Y749 PolarHBondContact OG1-N 3.39Å; T746-K750 PolarHBondContact O-N 3.19Å
747	P	96.1	Very high	96.1	Very high	41 Å²	41	51 Å²	51	27%	0.266	30%	0.296	S	S	.	.	H	α-helix	trans	-57.7	-36.4	173.5	-24.1	33.8	0	0	0	113.1	E442 K443 N751	E442-P747 HydrophobicContact CB-CB 4.05Å; E442-P747 HydrophobicContact CB-CG 4.46Å; E442-P747 WeakPolarHBondContact O-CB 3.45Å; K443-P747 HydrophobicContact CD-CG 4.2Å; P747-N751 PolarHBondContact O-N 3.01Å
748	W	97.4	Very high	96.2	Very high	67 Å²	67	50.8 Å²	50.8	25%	0.254	29%	0.294	S	S	.	.	H	α-helix	trans	-62.6	-45.7	173.7	178	92.1	0	0	0	111.6	F632 L729 H733 T746 N751 C752	F632-W748 AromaticContact CD1-NE1 3.67Å; F632-W748 HydrophobicContact CE1-CZ2 4.46Å; L729-W748 HydrophobicContact CB-CH2 4.3Å; L729-W748 HydrophobicContact CB-CZ2 4.47Å; H733-W748 HydrophobicContact CB-CE3 4.4Å; H733-W748 HydrophobicContact CB-CH2 3.93Å; H733-W748 HydrophobicContact CB-CZ3 3.44Å; H733-W748 VanDerWaalsContact CB-CZ3 3.44Å; H733-W748 AromaticContact CE1-CE3 3.85Å; H733-W748 AromaticContact CG-CE3 3.91Å; H733-W748 AromaticContact CG-CZ3 3.38Å; H733-W748 AromaticContact ND1-CE3 3.4Å; H733-W748 AromaticContact ND1-CZ3 3.33Å; H733-W748 VanDerWaalsContact ND1-CZ3 3.33Å; H733-W748 WeakPolarHBondContact ND1-CZ3 3.43Å; T746-W748 PolarHBondContact O-N 3.11Å; W748-N751 PolarHBondContact O-N 3.09Å; W748-C752 HydrophobicContact CE3-CB 4.42Å; W748-C752 HydrophobicContact CH2-CB 4.2Å; W748-C752 HydrophobicContact CZ2-CB 4.32Å; W748-C752 HydrophobicContact CZ3-CB 4.22Å; W748-C752 WeakPolarHBondContact O-CB 3.24Å; W748-C752 PolarHBondContact O-N 3.01Å
749	Y	98.2	Very high	96.5	Very high	23 Å²	23	43.4 Å²	43.4	9%	0.09	26%	0.26	C	S	.	.	H	α-helix	trans	-63.2	-46.4	179.1	176.2	-99.8	0	0	0	111.4	L730 H733 L734 I744 T746 N751 C752 I753 H786	L730-Y749 HydrophobicContact CD2-CD2 3.97Å; L730-Y749 HydrophobicContact CD2-CE2 3.86Å; H733-Y749 AromaticContact CD2-CD2 3.64Å; H733-Y749 AromaticContact NE2-CD2 3.98Å; L734-Y749 HydrophobicContact CD2-CE2 4.07Å; L734-Y749 HydrophobicContact CG-CE2 4.46Å; I744-Y749 HydrophobicContact CG2-CD1 3.98Å; I744-Y749 HydrophobicContact CG2-CD2 4.08Å; I744-Y749 HydrophobicContact CG2-CE1 3.82Å; I744-Y749 HydrophobicContact CG2-CE2 3.92Å; I744-Y749 HydrophobicContact CG2-CG 4.1Å; I744-Y749 VanDerWaalsContact O-CB 3.23Å; I744-Y749 WeakPolarHBondContact O-CB 3.45Å; I744-Y749 WeakPolarHBondContact O-CD1 3.49Å; T746-Y749 PolarHBondContact O-N 2.95Å; T746-Y749 VanDerWaalsContact O-N 3.1Å; T746-Y749 VanDerWaalsContact OG1-CB 3.28Å; T746-Y749 WeakPolarHBondContact OG1-CB 3.34Å; T746-Y749 PolarHBondContact OG1-N 3.39Å; Y749-N751 VanDerWaalsContact C-N 3.29Å; Y749-N751 PolarHBondContact O-N 3.45Å; Y749-C752 PolarHBondContact O-N 2.74Å; Y749-C752 VanDerWaalsContact O-N 3.16Å; Y749-I753 HydrophobicContact CD1-CG2 4.44Å; Y749-I753 HydrophobicContact CE1-CB 4.48Å; Y749-I753 HydrophobicContact CE1-CG2 4.16Å; Y749-I753 VanDerWaalsContact O-CG2 3.31Å; Y749-I753 WeakPolarHBondContact O-CG2 3.41Å; Y749-I753 PolarHBondContact O-N 3.47Å; Y749-H786 VanDerWaalsContact OH-CB 3.28Å; Y749-H786 WeakPolarHBondContact OH-CB 3.37Å
750	K	97.8	Very high	96.6	Very high	43 Å²	43	37.9 Å²	37.9	19%	0.187	23%	0.226	C	C	.	.	H	α-helix	trans	-52.7	-48.6	174.1	175	177.7	165.1	65.4	0	111	M405 T746 E754	M405-K750 PolarHBondContact O-NZ 3.18Å; T746-K750 PolarHBondContact O-N 3.19Å; K750-E754 IonicContact NZ-OE1 3.09Å; K750-E754 PolarHBondContact NZ-OE1 3.29Å; K750-E754 IonicContact NZ-OE2 3.59Å; K750-E754 PolarHBondContact NZ-OE2 3.38Å; K750-E754 VanDerWaalsContact O-CB 3.26Å; K750-E754 WeakPolarHBondContact O-CB 3.39Å; K750-E754 VanDerWaalsContact O-CG 3.25Å; K750-E754 WeakPolarHBondContact O-CG 3.35Å; K750-E754 PolarHBondContact O-N 2.79Å; K750-E754 VanDerWaalsContact O-N 3.13Å
751	N	98.1	Very high	96.9	Very high	12 Å²	12	35.7 Å²	35.7	6%	0.064	20%	0.203	C	C	.	.	H	α-helix	trans	-62.2	-51.1	177.1	-173.6	-97.4	0	0	0	111.3	T633 P747 W748 Y749 I753 E754 R755	T633-N751 WeakPolarHBondContact CA-OD1 3.32Å; T633-N751 HydrophobicContact CG2-CB 4.25Å; P747-N751 PolarHBondContact O-N 3.01Å; W748-N751 PolarHBondContact O-N 3.09Å; Y749-N751 VanDerWaalsContact C-N 3.29Å; Y749-N751 PolarHBondContact O-N 3.45Å; N751-I753 PolarHBondContact O-N 2.91Å; N751-E754 PolarHBondContact O-N 2.96Å; N751-R755 WeakPolarHBondContact O-CB 3.47Å; N751-R755 WeakPolarHBondContact O-CG 3.4Å; N751-R755 PolarHBondContact O-N 3.15Å
752	C	98.6	Very high	97.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.2	-47.6	-175.9	-166.9	0	0	0	0	112.6	F632 F726 L730 W748 Y749 R755 L756	F632-C752 HydrophobicContact CE1-CB 4.11Å; F726-C752 WeakPolarHBondContact CE1-O 3.35Å; L730-C752 HydrophobicContact CD2-CB 3.95Å; W748-C752 HydrophobicContact CE3-CB 4.42Å; W748-C752 HydrophobicContact CH2-CB 4.2Å; W748-C752 HydrophobicContact CZ2-CB 4.32Å; W748-C752 HydrophobicContact CZ3-CB 4.22Å; W748-C752 WeakPolarHBondContact O-CB 3.24Å; W748-C752 PolarHBondContact O-N 3.01Å; Y749-C752 PolarHBondContact O-N 2.74Å; Y749-C752 VanDerWaalsContact O-N 3.16Å; C752-R755 PolarHBondContact O-N 2.94Å; C752-L756 PolarHBondContact O-N 3.45Å
753	I	98.7	Very high	97.5	Very high	24 Å²	24	28.6 Å²	28.6	12%	0.123	15%	0.151	C	C	.	.	H	α-helix	trans	-69.3	-38.2	-178.9	-161.6	67	0	0	0	112	L730 Y749 N751 R755 L756 Q757 V790	L730-I753 HydrophobicContact CD1-CD1 3.75Å; L730-I753 HydrophobicContact CD2-CB 4.3Å; L730-I753 HydrophobicContact CD2-CD1 4.13Å; Y749-I753 HydrophobicContact CD1-CG2 4.44Å; Y749-I753 HydrophobicContact CE1-CB 4.48Å; Y749-I753 HydrophobicContact CE1-CG2 4.16Å; Y749-I753 VanDerWaalsContact O-CG2 3.31Å; Y749-I753 WeakPolarHBondContact O-CG2 3.41Å; Y749-I753 PolarHBondContact O-N 3.47Å; N751-I753 PolarHBondContact O-N 2.91Å; I753-R755 VanDerWaalsContact C-N 3.33Å; I753-L756 HydrophobicContact CD1-CD2 4.34Å; I753-L756 WeakPolarHBondContact O-CB 3.3Å; I753-L756 PolarHBondContact O-N 3.22Å; I753-Q757 PolarHBondContact O-N 3.29Å; I753-V790 HydrophobicContact CD1-CG2 3.65Å; I753-V790 HydrophobicContact CG1-CG2 3.83Å
754	E	98.8	Very high	97.6	Very high	22 Å²	22	25.8 Å²	25.8	10%	0.103	13%	0.134	C	C	.	.	H	α-helix	trans	-74.3	-24.3	177	-68.8	177.2	-179.8	0	0	112.2	T407 K750 N751 Q757 Q758	T407-E754 WeakPolarHBondContact CB-OE2 3.47Å; T407-E754 PolarHBondContact N-OE2 3.28Å; T407-E754 PolarHBondContact OG1-OE2 3.26Å; K750-E754 IonicContact NZ-OE1 3.09Å; K750-E754 PolarHBondContact NZ-OE1 3.29Å; K750-E754 IonicContact NZ-OE2 3.59Å; K750-E754 PolarHBondContact NZ-OE2 3.38Å; K750-E754 VanDerWaalsContact O-CB 3.26Å; K750-E754 WeakPolarHBondContact O-CB 3.39Å; K750-E754 VanDerWaalsContact O-CG 3.25Å; K750-E754 WeakPolarHBondContact O-CG 3.35Å; K750-E754 PolarHBondContact O-N 2.79Å; K750-E754 VanDerWaalsContact O-N 3.13Å; N751-E754 PolarHBondContact O-N 2.96Å; E754-Q757 WeakPolarHBondContact O-CB 3.35Å; E754-Q757 PolarHBondContact O-N 2.78Å; E754-Q758 WeakPolarHBondContact O-CB 3.38Å; E754-Q758 PolarHBondContact O-N 3.42Å
755	R	98.8	Very high	97.4	Very high	4 Å²	4	25.1 Å²	25.1	2%	0.015	14%	0.14	C	C	.	.	H	α-helix	trans	-73.9	-37	171	-68.8	-69	-173.1	-171.3	-7.6	112	T407 D411 W638 F726 N751 C752 I753 Q757 Q758 I759	T407-R755 HydrophobicContact CG2-CG 4.46Å; D411-R755 IonicContact OD1-CZ 2.62Å; D411-R755 IonicContact OD1-NH1 3.47Å; D411-R755 IonicContact OD1-NH2 2.7Å; D411-R755 PolarHBondContact OD1-NH2 3.27Å; D411-R755 IonicContact OD2-CZ 3.87Å; D411-R755 IonicContact OD2-NH1 3.89Å; D411-R755 PolarHBondContact OD2-NH1 3.45Å; D411-R755 IonicContact OD2-NH2 3.7Å; D411-R755 PolarHBondContact OD2-NH2 3.37Å; W638-R755 HydrophobicContact CD2-CB 4.19Å; W638-R755 HydrophobicContact CD2-CG 3.74Å; W638-R755 VanDerWaalsContact CE2-CG 3.45Å; W638-R755 HydrophobicContact CE3-CB 4.03Å; W638-R755 HydrophobicContact CE3-CG 4.1Å; W638-R755 HydrophobicContact CG-CG 4.33Å; W638-R755 VanDerWaalsContact CG-NE 3.25Å; W638-R755 HydrophobicContact CH2-CB 3.62Å; W638-R755 HydrophobicContact CH2-CG 3.96Å; W638-R755 HydrophobicContact CZ2-CB 3.78Å; W638-R755 HydrophobicContact CZ2-CG 3.57Å; W638-R755 HydrophobicContact CZ3-CB 3.77Å; W638-R755 HydrophobicContact CZ3-CG 4.22Å; F726-R755 HydrophobicContact CE1-CB 4.01Å; F726-R755 HydrophobicContact CZ-CB 3.89Å; N751-R755 WeakPolarHBondContact O-CB 3.47Å; N751-R755 WeakPolarHBondContact O-CG 3.4Å; N751-R755 PolarHBondContact O-N 3.15Å; C752-R755 PolarHBondContact O-N 2.94Å; I753-R755 VanDerWaalsContact C-N 3.33Å; R755-Q757 VanDerWaalsContact C-N 3.31Å; R755-Q758 WeakPolarHBondContact O-CB 3.45Å; R755-Q758 PolarHBondContact O-N 3.43Å; R755-I759 WeakPolarHBondContact O-CG1 3.29Å; R755-I759 PolarHBondContact O-N 2.99Å; R755-I759 VanDerWaalsContact O-N 3.14Å
756	L	98.8	Very high	97.5	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-58.2	-47.4	167.6	173	61.5	0	0	0	110.4	F723 F726 L730 C752 I753 Q758 I759 F760 I787 V790	F723-L756 HydrophobicContact CD1-CD1 3.69Å; F723-L756 HydrophobicContact CE1-CD1 3.95Å; F726-L756 HydrophobicContact CB-CD1 4Å; F726-L756 HydrophobicContact CD1-CB 3.91Å; F726-L756 HydrophobicContact CD2-CB 4.36Å; F726-L756 HydrophobicContact CD2-CD1 3.91Å; F726-L756 HydrophobicContact CE1-CB 4.09Å; F726-L756 HydrophobicContact CG-CB 4.05Å; F726-L756 HydrophobicContact CG-CD1 3.98Å; F726-L756 HydrophobicContact CZ-CB 4.37Å; L730-L756 HydrophobicContact CD1-CD2 3.85Å; C752-L756 PolarHBondContact O-N 3.45Å; I753-L756 HydrophobicContact CD1-CD2 4.34Å; I753-L756 WeakPolarHBondContact O-CB 3.3Å; I753-L756 PolarHBondContact O-N 3.22Å; L756-Q758 VanDerWaalsContact C-N 3.31Å; L756-Q758 PolarHBondContact O-N 2.94Å; L756-I759 WeakPolarHBondContact O-CB 3.47Å; L756-I759 PolarHBondContact O-N 3.32Å; L756-F760 HydrophobicContact CD1-CD2 4.44Å; L756-F760 HydrophobicContact CD1-CE2 3.85Å; L756-F760 HydrophobicContact CG-CE2 4.17Å; L756-F760 WeakPolarHBondContact O-CD2 3.42Å; L756-F760 PolarHBondContact O-N 3.49Å; L756-I787 HydrophobicContact CD2-CG2 3.88Å; L756-V790 HydrophobicContact CD2-CB 4.26Å; L756-V790 HydrophobicContact CD2-CG1 4.27Å; L756-V790 HydrophobicContact CD2-CG2 4.44Å; L756-V790 HydrophobicContact CG-CG1 4.06Å
757	Q	98.8	Very high	97.4	Very high	12 Å²	12	20.1 Å²	20.1	6%	0.056	11%	0.106	C	C	.	.	H	α-helix	trans	-58.7	-41.6	175.4	-172.6	-176.8	65.8	0	0	112.1	M213 N406 I753 E754 R755 I759 F760 L761 V790	M213-Q757 HydrophobicContact CE-CG 3.98Å; M213-Q757 HydrophobicContact CG-CG 3.85Å; M213-Q757 HydrophobicContact SD-CG 4.43Å; N406-Q757 PolarHBondContact ND2-OE1 3.11Å; I753-Q757 PolarHBondContact O-N 3.29Å; E754-Q757 WeakPolarHBondContact O-CB 3.35Å; E754-Q757 PolarHBondContact O-N 2.78Å; R755-Q757 VanDerWaalsContact C-N 3.31Å; Q757-I759 VanDerWaalsContact C-N 3.3Å; Q757-I759 PolarHBondContact O-N 2.87Å; Q757-F760 PolarHBondContact O-N 3.18Å; Q757-F760 VanDerWaalsContact O-N 3.16Å; Q757-L761 HydrophobicContact CG-CD1 3.99Å; Q757-L761 HydrophobicContact CG-CG 4.33Å; Q757-L761 WeakPolarHBondContact O-CG 3.36Å; Q757-L761 PolarHBondContact O-N 3.46Å; Q757-V790 HydrophobicContact CB-CG1 3.93Å; Q757-V790 HydrophobicContact CG-CG1 4.38Å
758	Q	98.8	Very high	97.3	Very high	5 Å²	5	21.3 Å²	21.3	2%	0.023	11%	0.108	C	C	.	.	H	α-helix	trans	-61	-34.5	177.4	-171.8	-179.1	38.1	0	0	112.9	T408 D411 H642 E754 R755 L756 L761 M762	T408-Q758 HydrophobicContact CG2-CG 4.3Å; T408-Q758 WeakPolarHBondContact OG1-CG 3.38Å; D411-Q758 PolarHBondContact OD2-NE2 3.49Å; D411-Q758 VanDerWaalsContact OD2-NE2 3.12Å; H642-Q758 PolarHBondContact NE2-OE1 3.17Å; E754-Q758 WeakPolarHBondContact O-CB 3.38Å; E754-Q758 PolarHBondContact O-N 3.42Å; R755-Q758 WeakPolarHBondContact O-CB 3.45Å; R755-Q758 PolarHBondContact O-N 3.43Å; L756-Q758 VanDerWaalsContact C-N 3.31Å; L756-Q758 PolarHBondContact O-N 2.94Å; Q758-L761 PolarHBondContact O-N 3.07Å; Q758-M762 HydrophobicContact CG-CG 3.96Å; Q758-M762 HydrophobicContact CG-SD 3.72Å; Q758-M762 WeakPolarHBondContact O-CB 3.46Å; Q758-M762 WeakPolarHBondContact O-CG 3.46Å; Q758-M762 PolarHBondContact O-N 3.3Å
759	I	98.7	Very high	97	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59.8	-48	174	-63	-63.2	0	0	0	110.5	L641 I645 F719 I722 F723 F726 R755 L756 Q757 H763 I767	L641-I759 HydrophobicContact CD2-CD1 3.96Å; I645-I759 HydrophobicContact CD1-CD1 3.78Å; F719-I759 HydrophobicContact CD1-CG2 4.16Å; F719-I759 HydrophobicContact CE1-CG2 4.1Å; I722-I759 HydrophobicContact CG2-CD1 4.25Å; I722-I759 HydrophobicContact CG2-CG1 4.15Å; F723-I759 HydrophobicContact CE1-CB 4.37Å; F723-I759 HydrophobicContact CE1-CG2 3.75Å; F723-I759 HydrophobicContact CZ-CG2 3.87Å; F726-I759 HydrophobicContact CE2-CG1 3.82Å; F726-I759 HydrophobicContact CZ-CG1 4.46Å; R755-I759 WeakPolarHBondContact O-CG1 3.29Å; R755-I759 PolarHBondContact O-N 2.99Å; R755-I759 VanDerWaalsContact O-N 3.14Å; L756-I759 WeakPolarHBondContact O-CB 3.47Å; L756-I759 PolarHBondContact O-N 3.32Å; Q757-I759 VanDerWaalsContact C-N 3.3Å; Q757-I759 PolarHBondContact O-N 2.87Å; I759-H763 PolarHBondContact O-CD2 3.15Å; I759-H763 PolarHBondContact O-N 3.4Å; I759-I767 HydrophobicContact CG2-CD1 4.08Å; I759-I767 WeakPolarHBondContact O-CD1 3.48Å
760	F	98.5	Very high	96.7	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.2	-46.4	176.2	-71.6	-67.7	0	0	0	111.9	M213 F723 L756 Q757 H764 I767 F779 V790 Y791 F794	M213-F760 HydrophobicContact CE-CB 3.54Å; F723-F760 HydrophobicContact CD1-CE2 4.42Å; F723-F760 HydrophobicContact CD1-CZ 4.12Å; F723-F760 HydrophobicContact CE1-CD1 4.35Å; F723-F760 HydrophobicContact CE1-CD2 4.31Å; F723-F760 AromaticContact CE1-CE1 3.76Å; F723-F760 HydrophobicContact CE1-CE1 3.76Å; F723-F760 AromaticContact CE1-CE2 3.73Å; F723-F760 HydrophobicContact CE1-CE2 3.73Å; F723-F760 AromaticContact CE1-CZ 3.4Å; F723-F760 HydrophobicContact CE1-CZ 3.4Å; F723-F760 VanDerWaalsContact CE1-CZ 3.4Å; F723-F760 HydrophobicContact CE2-CE1 4.36Å; F723-F760 HydrophobicContact CZ-CD1 4.09Å; F723-F760 AromaticContact CZ-CE1 3.51Å; F723-F760 HydrophobicContact CZ-CE1 3.51Å; F723-F760 HydrophobicContact CZ-CE2 4.35Å; F723-F760 AromaticContact CZ-CZ 3.66Å; F723-F760 HydrophobicContact CZ-CZ 3.66Å; L756-F760 HydrophobicContact CD1-CD2 4.44Å; L756-F760 HydrophobicContact CD1-CE2 3.85Å; L756-F760 HydrophobicContact CG-CE2 4.17Å; L756-F760 WeakPolarHBondContact O-CD2 3.42Å; L756-F760 PolarHBondContact O-N 3.49Å; Q757-F760 PolarHBondContact O-N 3.18Å; Q757-F760 VanDerWaalsContact O-N 3.16Å; F760-H764 VanDerWaalsContact O-CA 3.24Å; F760-H764 WeakPolarHBondContact O-CA 3.33Å; F760-H764 VanDerWaalsContact O-CB 3.27Å; F760-H764 WeakPolarHBondContact O-CB 3.32Å; F760-H764 PolarHBondContact O-N 3.05Å; F760-I767 HydrophobicContact CD1-CD1 4.06Å; F760-I767 HydrophobicContact CD1-CG2 3.94Å; F760-I767 HydrophobicContact CE1-CG2 3.92Å; F760-F779 HydrophobicContact CE2-CZ 4.2Å; F760-F779 HydrophobicContact CZ-CE1 4.46Å; F760-F779 AromaticContact CZ-CE2 3.88Å; F760-F779 HydrophobicContact CZ-CE2 3.88Å; F760-F779 AromaticContact CZ-CZ 3.73Å; F760-F779 HydrophobicContact CZ-CZ 3.73Å; F760-V790 HydrophobicContact CD2-CG1 3.92Å; F760-V790 HydrophobicContact CE2-CG1 4.13Å; F760-Y791 AromaticContact CE1-CD2 3.9Å; F760-Y791 HydrophobicContact CE1-CD2 3.9Å; F760-Y791 HydrophobicContact CE1-CE2 4.31Å; F760-Y791 AromaticContact CZ-CD2 3.75Å; F760-Y791 HydrophobicContact CZ-CD2 3.75Å; F760-F794 HydrophobicContact CB-CB 4.04Å; F760-F794 HydrophobicContact CB-CD2 3.79Å; F760-F794 HydrophobicContact CB-CG 4.06Å; F760-F794 HydrophobicContact CD1-CB 3.87Å; F760-F794 AromaticContact CD1-CD1 3.67Å; F760-F794 HydrophobicContact CD1-CD1 3.67Å; F760-F794 AromaticContact CD1-CD2 3.68Å; F760-F794 HydrophobicContact CD1-CD2 3.68Å; F760-F794 HydrophobicContact CD1-CE1 4.1Å; F760-F794 HydrophobicContact CD1-CE2 4.1Å; F760-F794 AromaticContact CD1-CG 3.43Å; F760-F794 HydrophobicContact CD1-CG 3.43Å; F760-F794 VanDerWaalsContact CD1-CG 3.43Å; F760-F794 HydrophobicContact CD1-CZ 4.29Å; F760-F794 HydrophobicContact CD2-CB 4.47Å; F760-F794 HydrophobicContact CE1-CB 4.45Å; F760-F794 AromaticContact CE1-CD1 3.87Å; F760-F794 HydrophobicContact CE1-CD1 3.87Å; F760-F794 HydrophobicContact CE1-CE1 4.27Å; F760-F794 HydrophobicContact CE1-CG 4.06Å; F760-F794 HydrophobicContact CG-CB 3.89Å; F760-F794 HydrophobicContact CG-CD2 4.08Å; F760-F794 AromaticContact CG-CG 3.9Å; F760-F794 HydrophobicContact CG-CG 3.9Å
761	L	98.3	Very high	96.3	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.4	-46.3	-179	-69.2	171.6	0	0	0	112.6	M213 L214 L362 P363 Q757 Q758 H764	M213-L761 HydrophobicContact CE-CD2 3.54Å; M213-L761 HydrophobicContact CE-CG 3.63Å; M213-L761 HydrophobicContact CG-CD2 3.73Å; M213-L761 HydrophobicContact CG-CG 4.31Å; M213-L761 HydrophobicContact SD-CD2 4.29Å; L214-L761 HydrophobicContact CD2-CD2 4.15Å; L362-L761 HydrophobicContact CB-CD1 4.48Å; L362-L761 HydrophobicContact CB-CD2 4.47Å; L362-L761 HydrophobicContact CD1-CD1 4.22Å; L362-L761 HydrophobicContact CD2-CD1 4.19Å; P363-L761 HydrophobicContact CB-CB 3.95Å; P363-L761 HydrophobicContact CB-CD2 3.73Å; P363-L761 HydrophobicContact CB-CG 4.46Å; P363-L761 WeakPolarHBondContact CB-O 3.46Å; P363-L761 HydrophobicContact CG-CD2 3.93Å; Q757-L761 HydrophobicContact CG-CD1 3.99Å; Q757-L761 HydrophobicContact CG-CG 4.33Å; Q757-L761 WeakPolarHBondContact O-CG 3.36Å; Q757-L761 PolarHBondContact O-N 3.46Å; Q758-L761 PolarHBondContact O-N 3.07Å; L761-H764 PolarHBondContact O-CD2 3.37Å
762	M	97.6	Very high	95.9	Very high	51 Å²	51	25.5 Å²	25.5	25%	0.251	14%	0.142	S	C	.	.	H	α-helix	trans	-77.7	-22.5	-173.6	-69.6	-169.8	68.6	0	0	113.9	L364 H642 Q758	L364-M762 HydrophobicContact CD2-CG 4.43Å; H642-M762 PolarHBondContact CE1-SD 3.21Å; H642-M762 PolarHBondContact ND1-SD 3.05Å; H642-M762 VanDerWaalsContact ND1-SD 3.43Å; Q758-M762 HydrophobicContact CG-CG 3.96Å; Q758-M762 HydrophobicContact CG-SD 3.72Å; Q758-M762 WeakPolarHBondContact O-CB 3.46Å; Q758-M762 WeakPolarHBondContact O-CG 3.46Å; Q758-M762 PolarHBondContact O-N 3.3Å
763	H	97.5	Very high	95.6	Very high	12 Å²	12	26.9 Å²	26.9	6%	0.056	15%	0.151	C	C	.	.	H	α-helix	trans	-127.7	22.8	-172.9	-51.6	-72.2	0	0	0	113.1	H642 I645 F719 I759 G765 T766 I767	H642-H763 AromaticContact ND1-NE2 3.24Å; H642-H763 PolarHBondContact ND1-NE2 2.94Å; I645-H763 WeakPolarHBondContact CD1-NE2 3.27Å; I645-H763 WeakPolarHBondContact CG2-CE1 3.46Å; I645-H763 WeakPolarHBondContact CG2-NE2 3.49Å; F719-H763 HydrophobicContact CE1-CB 3.93Å; F719-H763 HydrophobicContact CZ-CB 3.78Å; I759-H763 PolarHBondContact O-CD2 3.15Å; I759-H763 PolarHBondContact O-N 3.4Å; H763-G765 VanDerWaalsContact C-N 3.3Å; H763-G765 PolarHBondContact O-N 3Å; H763-T766 PolarHBondContact O-N 3.23Å; H763-I767 HydrophobicContact CB-CD1 3.87Å; H763-I767 HydrophobicContact CB-CG1 4.27Å; H763-I767 WeakPolarHBondContact O-CG1 3.46Å; H763-I767 PolarHBondContact O-N 3Å
764	H	95.3	Very high	95.3	Very high	48 Å²	48	25.8 Å²	25.8	22%	0.222	15%	0.145	C	C	.	.	H	α-helix	trans	-50.8	-45.4	-174	66.6	90.6	0	0	0	113.1	F760 L761 T766 I767 Q768 F794	F760-H764 VanDerWaalsContact O-CA 3.24Å; F760-H764 WeakPolarHBondContact O-CA 3.33Å; F760-H764 VanDerWaalsContact O-CB 3.27Å; F760-H764 WeakPolarHBondContact O-CB 3.32Å; F760-H764 PolarHBondContact O-N 3.05Å; L761-H764 PolarHBondContact O-CD2 3.37Å; H764-T766 VanDerWaalsContact C-N 3.28Å; H764-T766 PolarHBondContact O-N 3.32Å; H764-I767 PolarHBondContact O-N 2.9Å; H764-Q768 WeakPolarHBondContact O-CB 3.46Å; H764-Q768 WeakPolarHBondContact O-CG 3.27Å; H764-Q768 PolarHBondContact O-N 3.02Å; H764-F794 HydrophobicContact CB-CE2 3.89Å
765	G	91.9	Very high	95	Very high	36 Å²	36	28.9 Å²	28.9	37%	0.371	16%	0.159	S	C	.	.	H	α-helix	trans	-65.3	-27.7	-178.3	0	0	0	0	0	114.2	H763	H763-G765 VanDerWaalsContact C-N 3.3Å; H763-G765 PolarHBondContact O-N 3Å
766	T	94.1	Very high	94.7	Very high	22 Å²	22	34.5 Å²	34.5	14%	0.135	19%	0.19	C	C	.	.	H	α-helix	trans	-80.7	-45.7	172.6	-56.7	0	0	0	0	110.7	Q715 F719 H763 H764 Q768 Q769 Y770	Q715-T766 HydrophobicContact CG-CG2 4.23Å; F719-T766 HydrophobicContact CE2-CG2 3.72Å; F719-T766 HydrophobicContact CZ-CG2 4.29Å; H763-T766 PolarHBondContact O-N 3.23Å; H764-T766 VanDerWaalsContact C-N 3.28Å; H764-T766 PolarHBondContact O-N 3.32Å; T766-Q768 VanDerWaalsContact C-N 3.29Å; T766-Q768 PolarHBondContact O-N 3.32Å; T766-Q769 WeakPolarHBondContact O-CB 3.32Å; T766-Q769 PolarHBondContact O-N 3.35Å; T766-Y770 HydrophobicContact CG2-CE2 4.14Å
767	I	95.8	Very high	94.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.4	-32.4	-175.7	-65.6	163.6	0	0	0	112	F719 F723 I759 F760 H763 H764 Q769 Y770 L774 F794	F719-I767 HydrophobicContact CD1-CD1 4.16Å; F719-I767 HydrophobicContact CD1-CG1 3.92Å; F719-I767 HydrophobicContact CE1-CD1 3.83Å; F719-I767 HydrophobicContact CE1-CG1 3.73Å; F719-I767 HydrophobicContact CG-CG1 4.47Å; F719-I767 HydrophobicContact CZ-CG1 4.13Å; F723-I767 HydrophobicContact CZ-CD1 4.03Å; F723-I767 HydrophobicContact CZ-CG1 4.45Å; F723-I767 HydrophobicContact CZ-CG2 4.38Å; I759-I767 HydrophobicContact CG2-CD1 4.08Å; I759-I767 WeakPolarHBondContact O-CD1 3.48Å; F760-I767 HydrophobicContact CD1-CD1 4.06Å; F760-I767 HydrophobicContact CD1-CG2 3.94Å; F760-I767 HydrophobicContact CE1-CG2 3.92Å; H763-I767 HydrophobicContact CB-CD1 3.87Å; H763-I767 HydrophobicContact CB-CG1 4.27Å; H763-I767 WeakPolarHBondContact O-CG1 3.46Å; H763-I767 PolarHBondContact O-N 3Å; H764-I767 PolarHBondContact O-N 2.9Å; I767-Q769 PolarHBondContact O-N 2.95Å; I767-Q769 VanDerWaalsContact O-N 3.15Å; I767-Y770 PolarHBondContact O-N 3.31Å; I767-L774 HydrophobicContact CG2-CD1 3.59Å; I767-F794 HydrophobicContact CB-CE2 4.49Å; I767-F794 HydrophobicContact CB-CZ 4.04Å; I767-F794 HydrophobicContact CG2-CE1 3.9Å; I767-F794 HydrophobicContact CG2-CE2 4.36Å; I767-F794 HydrophobicContact CG2-CZ 3.64Å
768	Q	92.9	Very high	94.2	Very high	66 Å²	66	40.6 Å²	40.6	31%	0.308	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-54.1	-32.3	175.7	-81.5	168.3	-4	0	0	113	H764 T766 Y770 M771 F794	H764-Q768 WeakPolarHBondContact O-CB 3.46Å; H764-Q768 WeakPolarHBondContact O-CG 3.27Å; H764-Q768 PolarHBondContact O-N 3.02Å; T766-Q768 VanDerWaalsContact C-N 3.29Å; T766-Q768 PolarHBondContact O-N 3.32Å; Q768-Y770 PolarHBondContact O-N 2.82Å; Q768-M771 PolarHBondContact O-N 3.36Å; Q768-F794 HydrophobicContact CG-CE2 4.37Å; Q768-F794 HydrophobicContact CG-CZ 3.87Å
769	Q	90.9	Very high	94	Very high	125 Å²	125	40.8 Å²	40.8	58%	0.584	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-67.6	-17.2	178.1	-56.5	177.3	17.5	0	0	112.9	T766 I767	T766-Q769 WeakPolarHBondContact O-CB 3.32Å; T766-Q769 PolarHBondContact O-N 3.35Å; I767-Q769 PolarHBondContact O-N 2.95Å; I767-Q769 VanDerWaalsContact O-N 3.15Å
770	Y	91.8	Very high	93.8	Very high	22 Å²	22	43 Å²	43	9%	0.086	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-112.5	7.7	-175	-50	-39.3	0	0	0	113.5	Q715 K716 F719 T766 I767 Q768 G772 T773 L774	Q715-Y770 PolarHBondContact OE1-OH 3.35Å; K716-Y770 HydrophobicContact CB-CD1 4.37Å; K716-Y770 HydrophobicContact CB-CD2 4.48Å; K716-Y770 HydrophobicContact CB-CE1 4Å; K716-Y770 HydrophobicContact CB-CE2 4.11Å; K716-Y770 HydrophobicContact CD-CD1 4.21Å; K716-Y770 HydrophobicContact CD-CE1 4.41Å; K716-Y770 HydrophobicContact CG-CD1 4.09Å; K716-Y770 HydrophobicContact CG-CD2 4.37Å; K716-Y770 HydrophobicContact CG-CE1 4.22Å; K716-Y770 HydrophobicContact CG-CE2 4.48Å; K716-Y770 HydrophobicContact CG-CG 4.17Å; F719-Y770 HydrophobicContact CD2-CE2 4.11Å; T766-Y770 HydrophobicContact CG2-CE2 4.14Å; I767-Y770 PolarHBondContact O-N 3.31Å; Q768-Y770 PolarHBondContact O-N 2.82Å; Y770-G772 VanDerWaalsContact C-N 3.33Å; Y770-G772 PolarHBondContact O-N 3.23Å; Y770-T773 WeakPolarHBondContact O-CB 3.12Å; Y770-T773 PolarHBondContact O-N 3.2Å; Y770-L774 WeakPolarHBondContact O-CG 3.39Å; Y770-L774 PolarHBondContact O-N 3.36Å
771	M	90.1	Very high	93.5	Very high	44 Å²	44	47.7 Å²	47.7	22%	0.217	28%	0.275	C	S	.	.	H	α-helix	trans	-49.6	-50.4	-176.8	-84	-167.3	57.5	0	0	112.9	Q768 T773 L774 E775 F794 C795	Q768-M771 PolarHBondContact O-N 3.36Å; M771-T773 PolarHBondContact O-N 3.22Å; M771-T773 VanDerWaalsContact O-N 3.12Å; M771-L774 PolarHBondContact O-N 3.33Å; M771-E775 WeakPolarHBondContact CE-OE1 3.44Å; M771-E775 WeakPolarHBondContact O-CG 3.44Å; M771-E775 PolarHBondContact O-N 3.27Å; M771-F794 HydrophobicContact CG-CE1 4.14Å; M771-F794 HydrophobicContact SD-CE1 4.35Å; M771-C795 HydrophobicContact CE-CB 4.43Å
772	G	89.7	Confident	93.2	Very high	42 Å²	42	56.7 Å²	56.7	43%	0.433	32%	0.317	S	S	.	.	H	α-helix	trans	-61.3	-25.9	-179.9	0	0	0	0	0	114.2	Y770 N776	Y770-G772 VanDerWaalsContact C-N 3.33Å; Y770-G772 PolarHBondContact O-N 3.23Å; G772-N776 WeakPolarHBondContact O-CB 3.35Å; G772-N776 PolarHBondContact O-ND2 3.39Å
773	T	92.8	Very high	93.1	Very high	29 Å²	29	55.4 Å²	55.4	18%	0.178	31%	0.312	C	S	.	.	H	α-helix	trans	-78.3	-41.3	171.4	-56.3	0	0	0	0	111.2	K716 L720 Y770 M771 N776 L777	K716-T773 VanDerWaalsContact CE-OG1 3.31Å; K716-T773 WeakPolarHBondContact CE-OG1 3.43Å; K716-T773 PolarHBondContact NZ-OG1 3.32Å; L720-T773 HydrophobicContact CD2-CG2 4.17Å; Y770-T773 WeakPolarHBondContact O-CB 3.12Å; Y770-T773 PolarHBondContact O-N 3.2Å; M771-T773 PolarHBondContact O-N 3.22Å; M771-T773 VanDerWaalsContact O-N 3.12Å; T773-N776 PolarHBondContact O-N 2.72Å; T773-L777 HydrophobicContact CG2-CD1 3.66Å; T773-L777 HydrophobicContact CG2-CG 4.27Å; T773-L777 WeakPolarHBondContact O-CB 3.46Å; T773-L777 PolarHBondContact O-N 3Å
774	L	92	Very high	93.1	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.01	32%	0.323	C	S	.	.	H	α-helix	trans	-64.5	-43.8	-178.2	-66.1	179.3	0	0	0	112.1	L720 F723 I767 Y770 M771 L778 F779 Y791	L720-L774 HydrophobicContact CD2-CD2 3.93Å; F723-L774 HydrophobicContact CD2-CD2 3.64Å; F723-L774 HydrophobicContact CE2-CD1 4Å; F723-L774 HydrophobicContact CE2-CD2 3.88Å; I767-L774 HydrophobicContact CG2-CD1 3.59Å; Y770-L774 WeakPolarHBondContact O-CG 3.39Å; Y770-L774 PolarHBondContact O-N 3.36Å; M771-L774 PolarHBondContact O-N 3.33Å; L774-L778 HydrophobicContact CD2-CD1 3.89Å; L774-L778 PolarHBondContact O-N 3.16Å; L774-F779 HydrophobicContact CB-CD2 4.14Å; L774-F779 HydrophobicContact CD2-CE2 4.34Å; L774-F779 PolarHBondContact O-N 3.48Å; L774-Y791 HydrophobicContact CB-CE2 4.06Å; L774-Y791 HydrophobicContact CD1-CE2 4.24Å
775	E	91.9	Very high	93.2	Very high	86 Å²	86	61.2 Å²	61.2	40%	0.402	34%	0.34	S	S	.	.	H	α-helix	trans	-63.6	-41.9	178.3	-67.6	177.6	159.3	0	0	112.1	M771 Y791	M771-E775 WeakPolarHBondContact CE-OE1 3.44Å; M771-E775 WeakPolarHBondContact O-CG 3.44Å; M771-E775 PolarHBondContact O-N 3.27Å; E775-Y791 HydrophobicContact CG-CE1 3.7Å; E775-Y791 WeakPolarHBondContact CG-OH 3.49Å; E775-Y791 PolarHBondContact OE1-OH 3.47Å
776	N	92.1	Very high	93.4	Very high	122 Å²	122	62.4 Å²	62.4	65%	0.652	34%	0.336	S	S	*	.	H	α-helix	trans	-83.4	-29.2	-173.1	-72	-43.3	0	0	0	113.5	G772 T773	G772-N776 WeakPolarHBondContact O-CB 3.35Å; G772-N776 PolarHBondContact O-ND2 3.39Å; T773-N776 PolarHBondContact O-N 2.72Å
777	L	93.3	Very high	93.6	Very high	122 Å²	122	61.4 Å²	61.4	64%	0.639	33%	0.33	S	S	*	.	H	α-helix	trans	-113.4	-28.9	-171.2	-59	-174.8	0	0	0	115	T773	T773-L777 HydrophobicContact CG2-CD1 3.66Å; T773-L777 HydrophobicContact CG2-CG 4.27Å; T773-L777 WeakPolarHBondContact O-CB 3.46Å; T773-L777 PolarHBondContact O-N 3Å
778	L	94.6	Very high	93.7	Very high	19 Å²	19	62.6 Å²	62.6	10%	0.099	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119	-57	-171.6	-65.3	-173.7	0	0	0	112.7	L720 F723 Q724 I727 L774 T780 L783	L720-L778 HydrophobicContact CD2-CD1 3.56Å; L720-L778 HydrophobicContact CD2-CG 4.25Å; F723-L778 HydrophobicContact CB-CD1 3.69Å; F723-L778 HydrophobicContact CD2-CD1 4.43Å; Q724-L778 HydrophobicContact CG-CD1 4.41Å; Q724-L778 HydrophobicContact CG-CD2 3.52Å; I727-L778 HydrophobicContact CD1-CB 4.02Å; L774-L778 HydrophobicContact CD2-CD1 3.89Å; L774-L778 PolarHBondContact O-N 3.16Å; L778-T780 VanDerWaalsContact C-N 3.34Å; L778-T780 PolarHBondContact O-N 3.1Å; L778-L783 WeakPolarHBondContact O-CD1 3.38Å
779	F	95.4	Very high	94	Very high	8 Å²	8	60.8 Å²	60.8	4%	0.035	33%	0.332	C	S	.	.	S	Bend	trans	-97.3	58.3	-174.7	-62.6	-81.7	0	0	0	110.9	F723 I727 F760 L774 I787 L788 Y791	F723-F779 HydrophobicContact CB-CE2 4.17Å; F723-F779 HydrophobicContact CB-CZ 4.17Å; F723-F779 HydrophobicContact CD1-CE2 4.15Å; F723-F779 AromaticContact CD1-CZ 3.86Å; F723-F779 HydrophobicContact CD1-CZ 3.86Å; F723-F779 HydrophobicContact CD2-CE2 4.31Å; F723-F779 HydrophobicContact CE1-CZ 4.46Å; F723-F779 AromaticContact CG-CE2 3.97Å; F723-F779 HydrophobicContact CG-CE2 3.97Å; F723-F779 HydrophobicContact CG-CZ 4.05Å; I727-F779 HydrophobicContact CD1-CD1 4.46Å; I727-F779 HydrophobicContact CD1-CE1 4.1Å; I727-F779 HydrophobicContact CD1-CZ 4.17Å; I727-F779 HydrophobicContact CG1-CE1 4.29Å; F760-F779 HydrophobicContact CE2-CZ 4.2Å; F760-F779 HydrophobicContact CZ-CE1 4.46Å; F760-F779 AromaticContact CZ-CE2 3.88Å; F760-F779 HydrophobicContact CZ-CE2 3.88Å; F760-F779 AromaticContact CZ-CZ 3.73Å; F760-F779 HydrophobicContact CZ-CZ 3.73Å; L774-F779 HydrophobicContact CB-CD2 4.14Å; L774-F779 HydrophobicContact CD2-CE2 4.34Å; L774-F779 PolarHBondContact O-N 3.48Å; F779-I787 HydrophobicContact CE1-CG2 4.27Å; F779-L788 HydrophobicContact CB-CD1 4.13Å; F779-Y791 HydrophobicContact CB-CD1 3.66Å; F779-Y791 HydrophobicContact CB-CD2 4.23Å; F779-Y791 HydrophobicContact CB-CE1 4.2Å; F779-Y791 HydrophobicContact CB-CG 3.69Å; F779-Y791 HydrophobicContact CD1-CD2 4.43Å; F779-Y791 HydrophobicContact CD1-CG 4.05Å; F779-Y791 AromaticContact CD2-CD2 3.75Å; F779-Y791 HydrophobicContact CD2-CD2 3.75Å; F779-Y791 HydrophobicContact CD2-CE2 4.19Å; F779-Y791 HydrophobicContact CD2-CG 4.03Å; F779-Y791 HydrophobicContact CE2-CD2 4.18Å; F779-Y791 HydrophobicContact CG-CD1 4.17Å; F779-Y791 AromaticContact CG-CD2 3.88Å; F779-Y791 HydrophobicContact CG-CD2 3.88Å; F779-Y791 AromaticContact CG-CG 3.65Å; F779-Y791 HydrophobicContact CG-CG 3.65Å
780	T	94.2	Very high	94.3	Very high	46 Å²	46	55 Å²	55	28%	0.282	31%	0.306	S	S	.	.			trans	-79.8	168.5	179.4	69.6	0	0	0	0	111.5	L778 E782 L783	L778-T780 VanDerWaalsContact C-N 3.34Å; L778-T780 PolarHBondContact O-N 3.1Å; T780-E782 PolarHBondContact O-N 3.07Å; T780-E782 VanDerWaalsContact O-N 3.16Å; T780-L783 VanDerWaalsContact O-CB 3.3Å; T780-L783 WeakPolarHBondContact O-CB 3.48Å; T780-L783 PolarHBondContact O-N 3.27Å
781	A	92.1	Very high	94.6	Very high	99 Å²	99	54.4 Å²	54.4	82%	0.818	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-13.6	178.5	0	0	0	0	0	114.5	L783	A781-L783 VanDerWaalsContact C-N 3.31Å
782	E	92.3	Very high	95	Very high	189 Å²	189	56.9 Å²	56.9	88%	0.883	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-14.5	177.9	-61.7	-177.2	169.6	0	0	112.7	T780	T780-E782 PolarHBondContact O-N 3.07Å; T780-E782 VanDerWaalsContact O-N 3.16Å
783	L	95	Very high	95.4	Very high	25 Å²	25	56.2 Å²	56.2	13%	0.131	30%	0.3	C	S	.	.	S	Bend	trans	-75.8	144.9	-176	-162.9	136.9	0	0	0	110.8	I727 L778 T780 A781 H785 I787 L788	I727-L783 HydrophobicContact CB-CD1 4.46Å; I727-L783 HydrophobicContact CD1-CD1 3.78Å; I727-L783 HydrophobicContact CG1-CD1 3.93Å; I727-L783 HydrophobicContact CG2-CD1 3.69Å; L778-L783 WeakPolarHBondContact O-CD1 3.38Å; T780-L783 VanDerWaalsContact O-CB 3.3Å; T780-L783 WeakPolarHBondContact O-CB 3.48Å; T780-L783 PolarHBondContact O-N 3.27Å; A781-L783 VanDerWaalsContact C-N 3.31Å; L783-H785 PolarHBondContact O-N 3.3Å; L783-I787 HydrophobicContact CD2-CB 3.39Å; L783-I787 HydrophobicContact CD2-CD1 4.26Å; L783-I787 HydrophobicContact CD2-CG1 4.39Å; L783-I787 HydrophobicContact CD2-CG2 3.51Å; L783-L788 HydrophobicContact CD2-CB 4.17Å
784	D	97.1	Very high	95.6	Very high	56 Å²	56	55 Å²	55	30%	0.299	29%	0.292	S	S	.	.			trans	-54.6	134.2	-177.9	-174.9	-84	0	0	0	111.8	L734 H786 I787 L788	L734-D784 HydrophobicContact CD1-CB 3.95Å; D784-H786 PolarHBondContact O-N 3.49Å; D784-H786 WeakPolarHBondContact OD1-CB 3.23Å; D784-H786 IonicContact OD1-CE1 3.79Å; D784-H786 IonicContact OD1-CG 3.93Å; D784-H786 PolarHBondContact OD1-N 3.24Å; D784-H786 IonicContact OD1-ND1 3.4Å; D784-H786 PolarHBondContact OD1-ND1 3.05Å; D784-I787 HydrophobicContact CB-CD1 4.46Å; D784-I787 PolarHBondContact O-N 3.4Å; D784-L788 PolarHBondContact O-N 3.35Å
785	H	96.6	Very high	95.9	Very high	126 Å²	126	55.4 Å²	55.4	58%	0.583	30%	0.295	S	S	*	.	H	α-helix	trans	-55.7	-29.6	-173.2	70.9	-72.6	0	0	0	114.2	L783 A789	L783-H785 PolarHBondContact O-N 3.3Å; H785-A789 WeakPolarHBondContact O-CB 3.43Å; H785-A789 PolarHBondContact O-N 3.22Å
786	H	97.4	Very high	96.1	Very high	61 Å²	61	52.1 Å²	52.1	28%	0.282	28%	0.283	S	S	.	.	H	α-helix	trans	-66.3	-40.7	177.8	-63.2	91.7	0	0	0	112.4	L734 Y749 D784	L734-H786 HydrophobicContact CD1-CB 4.49Å; Y749-H786 VanDerWaalsContact OH-CB 3.28Å; Y749-H786 WeakPolarHBondContact OH-CB 3.37Å; D784-H786 PolarHBondContact O-N 3.49Å; D784-H786 WeakPolarHBondContact OD1-CB 3.23Å; D784-H786 IonicContact OD1-CE1 3.79Å; D784-H786 IonicContact OD1-CG 3.93Å; D784-H786 PolarHBondContact OD1-N 3.24Å; D784-H786 IonicContact OD1-ND1 3.4Å; D784-H786 PolarHBondContact OD1-ND1 3.05Å
787	I	98.1	Very high	96.3	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-78.5	-42.1	-179.4	-52.1	167.6	0	0	0	109	I727 L730 L734 L756 F779 L783 D784 A789 V790	I727-I787 HydrophobicContact CG1-CG2 4.28Å; L730-I787 HydrophobicContact CB-CD1 3.49Å; L730-I787 VanDerWaalsContact CB-CD1 3.49Å; L730-I787 HydrophobicContact CB-CG1 3.78Å; L730-I787 HydrophobicContact CD1-CD1 4.48Å; L730-I787 HydrophobicContact CD1-CG1 4.09Å; L730-I787 HydrophobicContact CD1-CG2 4.31Å; L734-I787 HydrophobicContact CD1-CD1 3.99Å; L734-I787 HydrophobicContact CD1-CG1 4.04Å; L756-I787 HydrophobicContact CD2-CG2 3.88Å; F779-I787 HydrophobicContact CE1-CG2 4.27Å; L783-I787 HydrophobicContact CD2-CB 3.39Å; L783-I787 HydrophobicContact CD2-CD1 4.26Å; L783-I787 HydrophobicContact CD2-CG1 4.39Å; L783-I787 HydrophobicContact CD2-CG2 3.51Å; D784-I787 HydrophobicContact CB-CD1 4.46Å; D784-I787 PolarHBondContact O-N 3.4Å; I787-A789 PolarHBondContact O-N 3.46Å; I787-V790 PolarHBondContact O-N 2.74Å; I787-V790 VanDerWaalsContact O-N 3.13Å
788	L	97.8	Very high	96.2	Very high	25 Å²	25	42.9 Å²	42.9	13%	0.131	23%	0.232	C	C	.	.	H	α-helix	trans	-60.9	-34.5	176.7	-173.9	62	0	0	0	111.8	F779 L783 D784 V790 Y791 Q792	F779-L788 HydrophobicContact CB-CD1 4.13Å; L783-L788 HydrophobicContact CD2-CB 4.17Å; D784-L788 PolarHBondContact O-N 3.35Å; L788-V790 VanDerWaalsContact C-N 3.27Å; L788-V790 PolarHBondContact O-N 3.44Å; L788-Y791 WeakPolarHBondContact O-CB 3.36Å; L788-Y791 PolarHBondContact O-N 3.1Å; L788-Y791 VanDerWaalsContact O-N 3.11Å; L788-Q792 HydrophobicContact CG-CG 4.39Å; L788-Q792 WeakPolarHBondContact O-CG 3.45Å; L788-Q792 PolarHBondContact O-N 3.06Å
789	A	98.1	Very high	95.6	Very high	28 Å²	28	47.8 Å²	47.8	23%	0.231	26%	0.258	C	S	.	.	H	α-helix	trans	-58.3	-36.3	175.7	0	0	0	0	0	112.9	H785 I787 Y791 Q792 Q793	H785-A789 WeakPolarHBondContact O-CB 3.43Å; H785-A789 PolarHBondContact O-N 3.22Å; I787-A789 PolarHBondContact O-N 3.46Å; A789-Y791 VanDerWaalsContact C-N 3.33Å; A789-Y791 PolarHBondContact O-N 3.27Å; A789-Q792 PolarHBondContact O-N 2.89Å; A789-Q793 WeakPolarHBondContact O-CB 3.43Å; A789-Q793 VanDerWaalsContact O-CD 3.3Å; A789-Q793 WeakPolarHBondContact O-CG 3.46Å; A789-Q793 PolarHBondContact O-N 3.47Å
790	V	98.4	Very high	95.6	Very high	5 Å²	5	49.8 Å²	49.8	3%	0.03	27%	0.269	C	S	.	.	H	α-helix	trans	-65.2	-39.6	176.9	-178.1	0	0	0	0	111	I753 L756 Q757 F760 I787 L788 F794	I753-V790 HydrophobicContact CD1-CG2 3.65Å; I753-V790 HydrophobicContact CG1-CG2 3.83Å; L756-V790 HydrophobicContact CD2-CB 4.26Å; L756-V790 HydrophobicContact CD2-CG1 4.27Å; L756-V790 HydrophobicContact CD2-CG2 4.44Å; L756-V790 HydrophobicContact CG-CG1 4.06Å; Q757-V790 HydrophobicContact CB-CG1 3.93Å; Q757-V790 HydrophobicContact CG-CG1 4.38Å; F760-V790 HydrophobicContact CD2-CG1 3.92Å; F760-V790 HydrophobicContact CE2-CG1 4.13Å; I787-V790 PolarHBondContact O-N 2.74Å; I787-V790 VanDerWaalsContact O-N 3.13Å; L788-V790 VanDerWaalsContact C-N 3.27Å; L788-V790 PolarHBondContact O-N 3.44Å; V790-F794 PolarHBondContact O-N 3.27Å; V790-F794 VanDerWaalsContact O-N 3.09Å
791	Y	98	Very high	95.6	Very high	8 Å²	8	49.9 Å²	49.9	3%	0.031	27%	0.269	C	S	.	.	H	α-helix	trans	-68	-43.3	175.7	-177.1	-107.1	0	0	0	111.9	F760 L774 E775 F779 L788 A789 Q793 F794 C795	F760-Y791 AromaticContact CE1-CD2 3.9Å; F760-Y791 HydrophobicContact CE1-CD2 3.9Å; F760-Y791 HydrophobicContact CE1-CE2 4.31Å; F760-Y791 AromaticContact CZ-CD2 3.75Å; F760-Y791 HydrophobicContact CZ-CD2 3.75Å; L774-Y791 HydrophobicContact CB-CE2 4.06Å; L774-Y791 HydrophobicContact CD1-CE2 4.24Å; E775-Y791 HydrophobicContact CG-CE1 3.7Å; E775-Y791 WeakPolarHBondContact CG-OH 3.49Å; E775-Y791 PolarHBondContact OE1-OH 3.47Å; F779-Y791 HydrophobicContact CB-CD1 3.66Å; F779-Y791 HydrophobicContact CB-CD2 4.23Å; F779-Y791 HydrophobicContact CB-CE1 4.2Å; F779-Y791 HydrophobicContact CB-CG 3.69Å; F779-Y791 HydrophobicContact CD1-CD2 4.43Å; F779-Y791 HydrophobicContact CD1-CG 4.05Å; F779-Y791 AromaticContact CD2-CD2 3.75Å; F779-Y791 HydrophobicContact CD2-CD2 3.75Å; F779-Y791 HydrophobicContact CD2-CE2 4.19Å; F779-Y791 HydrophobicContact CD2-CG 4.03Å; F779-Y791 HydrophobicContact CE2-CD2 4.18Å; F779-Y791 HydrophobicContact CG-CD1 4.17Å; F779-Y791 AromaticContact CG-CD2 3.88Å; F779-Y791 HydrophobicContact CG-CD2 3.88Å; F779-Y791 AromaticContact CG-CG 3.65Å; F779-Y791 HydrophobicContact CG-CG 3.65Å; L788-Y791 WeakPolarHBondContact O-CB 3.36Å; L788-Y791 PolarHBondContact O-N 3.1Å; L788-Y791 VanDerWaalsContact O-N 3.11Å; A789-Y791 VanDerWaalsContact C-N 3.33Å; A789-Y791 PolarHBondContact O-N 3.27Å; Y791-Q793 VanDerWaalsContact C-N 3.32Å; Y791-Q793 PolarHBondContact O-N 3.47Å; Y791-F794 HydrophobicContact CD2-CD1 4.14Å; Y791-F794 AromaticContact CE2-CD1 3.92Å; Y791-F794 HydrophobicContact CE2-CD1 3.92Å; Y791-F794 HydrophobicContact CE2-CE1 4.25Å; Y791-F794 WeakPolarHBondContact O-CB 3.11Å; Y791-F794 PolarHBondContact O-N 3.41Å; Y791-F794 VanDerWaalsContact O-N 3.11Å; Y791-C795 VanDerWaalsContact CE1-SG 3.51Å; Y791-C795 PolarHBondContact O-N 3.25Å; Y791-C795 PolarHBondContact O-SG 2.77Å
792	Q	97.8	Very high	95.8	Very high	97 Å²	97	47.2 Å²	47.2	45%	0.453	24%	0.238	S	C	.	.	H	α-helix	trans	-61.7	-39	175.5	-69.1	171.7	-10.3	0	0	112.3	T209 L788 A789 F794 C795 A796	T209-Q792 HydrophobicContact CG2-CB 4.15Å; L788-Q792 HydrophobicContact CG-CG 4.39Å; L788-Q792 WeakPolarHBondContact O-CG 3.45Å; L788-Q792 PolarHBondContact O-N 3.06Å; A789-Q792 PolarHBondContact O-N 2.89Å; Q792-F794 VanDerWaalsContact C-N 3.34Å; Q792-C795 PolarHBondContact O-N 3.03Å; Q792-A796 WeakPolarHBondContact O-CB 3.46Å; Q792-A796 PolarHBondContact O-N 3.43Å
793	Q	98.4	Very high	96	Very high	27 Å²	27	38.9 Å²	38.9	13%	0.126	20%	0.2	C	C	.	.	H	α-helix	trans	-60.1	-43.2	172.2	-73.1	159.2	21.6	0	0	111.7	T209 M213 A789 Y791 A796	T209-Q793 HydrophobicContact CG2-CG 4.4Å; T209-Q793 WeakPolarHBondContact O-CG 3.42Å; M213-Q793 HydrophobicContact CB-CB 3.72Å; M213-Q793 HydrophobicContact CB-CG 4.13Å; M213-Q793 HydrophobicContact CG-CB 4.28Å; M213-Q793 HydrophobicContact SD-CB 3.58Å; M213-Q793 VanDerWaalsContact SD-CB 3.58Å; A789-Q793 WeakPolarHBondContact O-CB 3.43Å; A789-Q793 VanDerWaalsContact O-CD 3.3Å; A789-Q793 WeakPolarHBondContact O-CG 3.46Å; A789-Q793 PolarHBondContact O-N 3.47Å; Y791-Q793 VanDerWaalsContact C-N 3.32Å; Y791-Q793 PolarHBondContact O-N 3.47Å; Q793-A796 PolarHBondContact O-N 3.41Å
794	F	97.9	Very high	96.1	Very high	3 Å²	3	39.8 Å²	39.8	1%	0.013	20%	0.204	C	C	.	.	H	α-helix	trans	-62	-45.7	175.8	162.2	-106.4	0	0	0	111.9	M213 F760 H764 I767 Q768 M771 V790 Y791 Q792 A796 L797	M213-F794 HydrophobicContact CE-CB 4.07Å; M213-F794 HydrophobicContact SD-CB 4.25Å; M213-F794 PolarHBondContact SD-N 3.21Å; M213-F794 VanDerWaalsContact SD-N 3.42Å; F760-F794 HydrophobicContact CB-CB 4.04Å; F760-F794 HydrophobicContact CB-CD2 3.79Å; F760-F794 HydrophobicContact CB-CG 4.06Å; F760-F794 HydrophobicContact CD1-CB 3.87Å; F760-F794 AromaticContact CD1-CD1 3.67Å; F760-F794 HydrophobicContact CD1-CD1 3.67Å; F760-F794 AromaticContact CD1-CD2 3.68Å; F760-F794 HydrophobicContact CD1-CD2 3.68Å; F760-F794 HydrophobicContact CD1-CE1 4.1Å; F760-F794 HydrophobicContact CD1-CE2 4.1Å; F760-F794 AromaticContact CD1-CG 3.43Å; F760-F794 HydrophobicContact CD1-CG 3.43Å; F760-F794 VanDerWaalsContact CD1-CG 3.43Å; F760-F794 HydrophobicContact CD1-CZ 4.29Å; F760-F794 HydrophobicContact CD2-CB 4.47Å; F760-F794 HydrophobicContact CE1-CB 4.45Å; F760-F794 AromaticContact CE1-CD1 3.87Å; F760-F794 HydrophobicContact CE1-CD1 3.87Å; F760-F794 HydrophobicContact CE1-CE1 4.27Å; F760-F794 HydrophobicContact CE1-CG 4.06Å; F760-F794 HydrophobicContact CG-CB 3.89Å; F760-F794 HydrophobicContact CG-CD2 4.08Å; F760-F794 AromaticContact CG-CG 3.9Å; F760-F794 HydrophobicContact CG-CG 3.9Å; H764-F794 HydrophobicContact CB-CE2 3.89Å; I767-F794 HydrophobicContact CB-CE2 4.49Å; I767-F794 HydrophobicContact CB-CZ 4.04Å; I767-F794 HydrophobicContact CG2-CE1 3.9Å; I767-F794 HydrophobicContact CG2-CE2 4.36Å; I767-F794 HydrophobicContact CG2-CZ 3.64Å; Q768-F794 HydrophobicContact CG-CE2 4.37Å; Q768-F794 HydrophobicContact CG-CZ 3.87Å; M771-F794 HydrophobicContact CG-CE1 4.14Å; M771-F794 HydrophobicContact SD-CE1 4.35Å; V790-F794 PolarHBondContact O-N 3.27Å; V790-F794 VanDerWaalsContact O-N 3.09Å; Y791-F794 HydrophobicContact CD2-CD1 4.14Å; Y791-F794 AromaticContact CE2-CD1 3.92Å; Y791-F794 HydrophobicContact CE2-CD1 3.92Å; Y791-F794 HydrophobicContact CE2-CE1 4.25Å; Y791-F794 WeakPolarHBondContact O-CB 3.11Å; Y791-F794 PolarHBondContact O-N 3.41Å; Y791-F794 VanDerWaalsContact O-N 3.11Å; Q792-F794 VanDerWaalsContact C-N 3.34Å; F794-A796 VanDerWaalsContact C-N 3.28Å; F794-A796 PolarHBondContact O-N 3.15Å; F794-L797 HydrophobicContact CD2-CD1 4.31Å; F794-L797 VanDerWaalsContact O-CB 3.28Å; F794-L797 WeakPolarHBondContact O-CB 3.32Å; F794-L797 VanDerWaalsContact O-CG 3.3Å; F794-L797 WeakPolarHBondContact O-CG 3.5Å; F794-L797 PolarHBondContact O-N 3.04Å; F794-L797 VanDerWaalsContact O-N 3.13Å
795	C	96.4	Very high	96	Very high	12 Å²	12	38.7 Å²	38.7	8%	0.081	20%	0.198	C	C	.	.	H	α-helix	trans	-61.5	-39	177.6	-62.3	0	0	0	0	111.5	M771 Y791 Q792 L797 Q798 L799	M771-C795 HydrophobicContact CE-CB 4.43Å; Y791-C795 VanDerWaalsContact CE1-SG 3.51Å; Y791-C795 PolarHBondContact O-N 3.25Å; Y791-C795 PolarHBondContact O-SG 2.77Å; Q792-C795 PolarHBondContact O-N 3.03Å; C795-L797 PolarHBondContact O-N 2.71Å; C795-Q798 PolarHBondContact O-N 3.2Å; C795-L799 HydrophobicContact CB-CD1 3.69Å; C795-L799 HydrophobicContact CB-CG 4.46Å; C795-L799 WeakPolarHBondContact O-CB 3.22Å; C795-L799 WeakPolarHBondContact O-CG 3.34Å; C795-L799 PolarHBondContact O-N 3.33Å; C795-L799 VanDerWaalsContact O-N 3.14Å
796	A	97.1	Very high	96	Very high	17 Å²	17	32.4 Å²	32.4	14%	0.14	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-5.7	177.2	0	0	0	0	0	114.8	T209 H210 Q792 Q793 F794 Q798	T209-A796 HydrophobicContact CG2-CB 4.19Å; H210-A796 HydrophobicContact CB-CB 4.12Å; Q792-A796 WeakPolarHBondContact O-CB 3.46Å; Q792-A796 PolarHBondContact O-N 3.43Å; Q793-A796 PolarHBondContact O-N 3.41Å; F794-A796 VanDerWaalsContact C-N 3.28Å; F794-A796 PolarHBondContact O-N 3.15Å; A796-Q798 VanDerWaalsContact C-N 3.29Å
797	L	96.4	Very high	95.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-19.3	173.7	-59.4	-176.5	0	0	0	113.3	H210 M213 L214 I284 P363 F794 C795	H210-L797 HydrophobicContact CB-CD2 4.26Å; M213-L797 HydrophobicContact CE-CD1 4.23Å; M213-L797 HydrophobicContact SD-CD1 4.23Å; M213-L797 HydrophobicContact SD-CG 4.45Å; L214-L797 HydrophobicContact CD1-CD2 3.93Å; L214-L797 HydrophobicContact CD2-CD2 3.92Å; L214-L797 HydrophobicContact CG-CD2 4.1Å; I284-L797 HydrophobicContact CG2-CB 4.04Å; I284-L797 HydrophobicContact CG2-CD2 3.82Å; I284-L797 HydrophobicContact CG2-CG 4.39Å; P363-L797 HydrophobicContact CG-CD1 4.47Å; F794-L797 HydrophobicContact CD2-CD1 4.31Å; F794-L797 VanDerWaalsContact O-CB 3.28Å; F794-L797 WeakPolarHBondContact O-CB 3.32Å; F794-L797 VanDerWaalsContact O-CG 3.3Å; F794-L797 WeakPolarHBondContact O-CG 3.5Å; F794-L797 PolarHBondContact O-N 3.04Å; F794-L797 VanDerWaalsContact O-N 3.13Å; C795-L797 PolarHBondContact O-N 2.71Å
798	Q	91.5	Very high	95.7	Very high	49 Å²	49	32.8 Å²	32.8	23%	0.229	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.2	-8.2	-179.2	-70.8	-64.2	-74.8	0	0	114.7	V164 Y282 C795 A796	V164-Q798 VanDerWaalsContact CG2-O 3.28Å; V164-Q798 WeakPolarHBondContact CG2-O 3.36Å; Y282-Q798 PolarHBondContact O-NE2 2.82Å; C795-Q798 PolarHBondContact O-N 3.2Å; A796-Q798 VanDerWaalsContact C-N 3.29Å
799	L	80.6	Confident	95.5	Very high	122 Å²	122	33.5 Å²	33.5	64%	0.639	18%	0.18	S	C	*	.			trans	-81.6	0	176.8	-69.7	178.8	0	0	0	113.7	P162 Q163 C795	P162-L799 WeakPolarHBondContact CA-OXT 3.45Å; Q163-L799 WeakPolarHBondContact CB-O 3.49Å; Q163-L799 PolarHBondContact N-O 2.85Å; Q163-L799 PolarHBondContact N-OXT 3.28Å; C795-L799 HydrophobicContact CB-CD1 3.69Å; C795-L799 HydrophobicContact CB-CG 4.46Å; C795-L799 WeakPolarHBondContact O-CB 3.22Å; C795-L799 WeakPolarHBondContact O-CG 3.34Å; C795-L799 PolarHBondContact O-N 3.33Å; C795-L799 VanDerWaalsContact O-N 3.14Å

Retrieved 799 of 799 residues in 815.8 ms (Link to these results)

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