ANXA2_HUMAN Loading...

Annexin A2

Calcium-regulated membrane-binding protein whose affinity for calcium is greatly enhanced by anionic phospholipids. It binds two calcium ions with high affinity. May be involved in heat-stress response. Inhibits PCSK9-enhanced LDLR degradation, probably reduces PCSK9 protein levels via a translational mechanism but also competes with LDLR for binding with PCSK9^1,2,3. Binds to endosomes damaged by phagocytosis of particulate wear debris and participates in endosomal membrane stabilization, thereby limiting NLRP3 inflammasome activation (By similarity). Required for endothelial cell surface plasmin generation and may support fibrinolytic surveillance and neoangiogenesis (By similarity). (Microbial infection) Binds M.pneumoniae CARDS toxin, probably serves as one receptor for this pathogen. When ANXA2 is down-regulated by siRNA, less toxin binds to human cells and less vacuolization (a symptom of M.pneumoniae infection) is seen.

AlphaFold DB , UniProt , Accession P07355, Species HUMAN (Homo sapiens, Human), Gene ANXA2, Length 339 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.8	Very low	47.7	Very low	224 Å²	224	115.6 Å²	115.6	100%	1.103	61%	0.612	S	S	*	*				0	-3.8	0	-75.6	-148.4	-79.9	0	0	114.5
2	S	51.6	Low	47	Very low	88 Å²	88	114.8 Å²	114.8	62%	0.615	62%	0.622	S	S	*	*	H	α-helix	trans	-85.8	-18.9	-178.9	96.7	0	0	0	0	115.1
3	T	59.6	Low	46.6	Very low	91 Å²	91	114.2 Å²	114.2	56%	0.558	62%	0.618	S	S	*	*	H	α-helix	trans	-77.7	-24.6	-178.3	36.9	0	0	0	0	114.4	I7	T3-I7 WeakPolarHBondContact O-CD1 3.46Å; T3-I7 VanDerWaalsContact O-CG1 3.26Å; T3-I7 WeakPolarHBondContact O-CG1 3.3Å; T3-I7 PolarHBondContact O-N 2.85Å
4	V	48.7	Very low	46	Very low	91 Å²	91	118.6 Å²	118.6	55%	0.552	63%	0.632	S	S	*	*	H	α-helix	trans	-79.3	-30.9	179.6	-178.3	0	0	0	0	111.2	I7 L8	V4-I7 PolarHBondContact O-N 3.09Å; V4-L8 HydrophobicContact CG1-CD1 3.89Å; V4-L8 WeakPolarHBondContact O-CB 3.43Å; V4-L8 WeakPolarHBondContact O-CG 3.41Å; V4-L8 PolarHBondContact O-N 2.87Å
5	H	45	Very low	44.9	Very low	136 Å²	136	114.7 Å²	114.7	63%	0.63	63%	0.631	S	S	*	*	H	α-helix	trans	-73.8	-35.6	178.6	-155.1	65.2	0	0	0	112.2	I7 L8 C9	H5-I7 VanDerWaalsContact C-N 3.34Å; H5-I7 PolarHBondContact O-N 2.62Å; H5-L8 PolarHBondContact O-N 3.16Å; H5-C9 PolarHBondContact O-N 3.48Å
6	E	51.4	Low	44.3	Very low	132 Å²	132	115.7 Å²	115.7	62%	0.617	64%	0.635	S	S	*	*	H	α-helix	trans	-68.9	-30	173.8	-75	178.3	163.6	0	0	113.2
7	I	50.2	Low	43.7	Very low	103 Å²	103	119.4 Å²	119.4	53%	0.528	65%	0.646	S	S	.	*	H	α-helix	trans	-78.2	-37.5	175.9	-65.9	168.9	0	0	0	110.8	T3 V4 H5 K10 L11	T3-I7 WeakPolarHBondContact O-CD1 3.46Å; T3-I7 VanDerWaalsContact O-CG1 3.26Å; T3-I7 WeakPolarHBondContact O-CG1 3.3Å; T3-I7 PolarHBondContact O-N 2.85Å; V4-I7 PolarHBondContact O-N 3.09Å; H5-I7 VanDerWaalsContact C-N 3.34Å; H5-I7 PolarHBondContact O-N 2.62Å; I7-K10 PolarHBondContact O-N 3.25Å; I7-L11 HydrophobicContact CG2-CD1 4.02Å; I7-L11 PolarHBondContact O-N 3.4Å
8	L	41.1	Very low	43.9	Very low	95 Å²	95	116.9 Å²	116.9	50%	0.497	64%	0.639	S	S	.	*	H	α-helix	trans	-69.6	-34.9	176.6	-79.3	163.4	0	0	0	112.9	V4 H5 K10 L11 S12	V4-L8 HydrophobicContact CG1-CD1 3.89Å; V4-L8 WeakPolarHBondContact O-CB 3.43Å; V4-L8 WeakPolarHBondContact O-CG 3.41Å; V4-L8 PolarHBondContact O-N 2.87Å; H5-L8 PolarHBondContact O-N 3.16Å; L8-K10 PolarHBondContact O-N 3.41Å; L8-L11 PolarHBondContact O-N 3.04Å; L8-S12 PolarHBondContact O-N 3.06Å; L8-S12 VanDerWaalsContact O-N 3.14Å
9	C	43.1	Very low	44.3	Very low	77 Å²	77	115.2 Å²	115.2	52%	0.52	63%	0.633	S	S	.	*	H	α-helix	trans	-65	-25.7	172.1	-80.6	0	0	0	0	113.3	H5	H5-C9 PolarHBondContact O-N 3.48Å
10	K	47.7	Very low	45.2	Very low	136 Å²	136	115.1 Å²	115.1	59%	0.591	64%	0.638	S	S	*	*	H	α-helix	trans	-81.2	-25	174.6	-73.8	-173.1	177.1	-174.6	0	113.3	I7 L8	I7-K10 PolarHBondContact O-N 3.25Å; L8-K10 PolarHBondContact O-N 3.41Å
11	L	40	Very low	46.6	Very low	99 Å²	99	115.8 Å²	115.8	52%	0.518	65%	0.648	S	S	.	*	H	α-helix	trans	-88.1	-18.5	179.3	-70.3	164.8	0	0	0	113.3	I7 L8 L13	I7-L11 HydrophobicContact CG2-CD1 4.02Å; I7-L11 PolarHBondContact O-N 3.4Å; L8-L11 PolarHBondContact O-N 3.04Å; L11-L13 VanDerWaalsContact C-N 3.27Å; L11-L13 PolarHBondContact O-N 2.94Å
12	S	39.3	Very low	48.6	Very low	105 Å²	105	107.3 Å²	107.3	73%	0.734	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	8.1	173.5	-68.7	0	0	0	0	114.7	L8	L8-S12 PolarHBondContact O-N 3.06Å; L8-S12 VanDerWaalsContact O-N 3.14Å
13	L	43	Very low	50.6	Low	108 Å²	108	106.5 Å²	106.5	57%	0.565	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	11.8	174.8	-71.2	168.6	0	0	0	113.3	L11 G15	L11-L13 VanDerWaalsContact C-N 3.27Å; L11-L13 PolarHBondContact O-N 2.94Å; L13-G15 PolarHBondContact O-N 3.49Å
14	E	37	Very low	52.4	Low	176 Å²	176	107.8 Å²	107.8	82%	0.822	61%	0.605	S	S	*	*			trans	-79.3	63	168.6	-67.5	-176.9	179.3	0	0	110.8
15	G	30.6	Very low	54.7	Low	59 Å²	59	103.4 Å²	103.4	61%	0.608	58%	0.578	S	S	*	*			trans	-135.5	64.6	166.9	0	0	0	0	0	107.2	L13 H17	L13-G15 PolarHBondContact O-N 3.49Å; G15-H17 VanDerWaalsContact C-N 3.29Å; G15-H17 PolarHBondContact O-N 3.28Å
16	D	34.4	Very low	57.2	Low	131 Å²	131	98 Å²	98	70%	0.701	56%	0.556	S	S	*	*			trans	-70.9	81.4	-169	-161.2	31.4	0	0	0	111	S18	D16-S18 PolarHBondContact O-N 2.89Å; D16-S18 VanDerWaalsContact O-N 3.16Å; D16-S18 WeakPolarHBondContact OD1-CB 3.47Å; D16-S18 PolarHBondContact OD1-N 3.36Å; D16-S18 PolarHBondContact OD1-OG 3.33Å; D16-S18 WeakPolarHBondContact OD2-CB 3.44Å; D16-S18 PolarHBondContact OD2-OG 2.94Å
17	H	33.9	Very low	59.4	Low	179 Å²	179	92.2 Å²	92.2	83%	0.829	53%	0.53	S	S	*	.			trans	-78.4	58.3	152.6	-69.4	-54.5	0	0	0	108.5	G15 T19	G15-H17 VanDerWaalsContact C-N 3.29Å; G15-H17 PolarHBondContact O-N 3.28Å; H17-T19 PolarHBondContact O-N 2.83Å; H17-T19 VanDerWaalsContact O-N 3.13Å
18	S	47.2	Very low	61.6	Low	74 Å²	74	92.9 Å²	92.9	52%	0.517	53%	0.529	S	S	.	.			trans	-68.3	110.5	170.7	44.5	0	0	0	0	108.1	D16	D16-S18 PolarHBondContact O-N 2.89Å; D16-S18 VanDerWaalsContact O-N 3.16Å; D16-S18 WeakPolarHBondContact OD1-CB 3.47Å; D16-S18 PolarHBondContact OD1-N 3.36Å; D16-S18 PolarHBondContact OD1-OG 3.33Å; D16-S18 WeakPolarHBondContact OD2-CB 3.44Å; D16-S18 PolarHBondContact OD2-OG 2.94Å
19	T	53.3	Low	64.2	Low	85 Å²	85	91.4 Å²	91.4	52%	0.521	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-53.4	134.3	164.4	25.2	0	0	0	0	108.7	H17 Q138	H17-T19 PolarHBondContact O-N 2.83Å; H17-T19 VanDerWaalsContact O-N 3.13Å; T19-Q138 VanDerWaalsContact CG2-NE2 3.29Å
20	P	60.9	Low	66.8	Low	112 Å²	112	92.6 Å²	92.6	73%	0.727	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-54.1	141.6	-179.9	20.2	-31.2	0	0	0	110.2	S22	P20-S22 PolarHBondContact O-N 2.99Å
21	P	75.4	Confident	69.2	Low	130 Å²	130	92.4 Å²	92.4	84%	0.844	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-52.2	130.7	-179.7	-26.5	33.4	0	0	0	111.2	A23	P21-A23 PolarHBondContact O-N 2.77Å
22	S	88.5	Confident	71.8	Confident	47 Å²	47	93.3 Å²	93.3	33%	0.329	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-65.4	125.8	179.2	-179.2	0	0	0	0	110.7	P20 Y24 G25 V298	P20-S22 PolarHBondContact O-N 2.99Å; S22-Y24 PolarHBondContact O-N 3.33Å; S22-Y24 VanDerWaalsContact O-N 3.16Å; S22-Y24 PolarHBondContact OG-N 3.44Å; S22-G25 PolarHBondContact O-N 2.59Å; S22-V298 VanDerWaalsContact CB-O 3.29Å; S22-V298 WeakPolarHBondContact CB-O 3.18Å; S22-V298 PolarHBondContact OG-O 3.12Å
23	A	92.7	Very high	74.6	Confident	71 Å²	71	91 Å²	91	59%	0.587	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-17.5	173	0	0	0	0	0	113	P21	P21-A23 PolarHBondContact O-N 2.77Å
24	Y	96.7	Very high	77.3	Confident	117 Å²	117	89.2 Å²	89.2	46%	0.459	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	5.7	-172.8	-55.3	-72.5	0	0	0	114.5	S22 V298 D299 M300 L301 K302	S22-Y24 PolarHBondContact O-N 3.33Å; S22-Y24 VanDerWaalsContact O-N 3.16Å; S22-Y24 PolarHBondContact OG-N 3.44Å; Y24-V298 CarbonylContact C-O 3.58Å; Y24-D299 CarbonylContact O-C 3.26Å; Y24-D299 WeakPolarHBondContact O-CA 3.48Å; Y24-M300 PolarHBondContact O-N 3.49Å; Y24-L301 WeakPolarHBondContact O-CB 3.46Å; Y24-L301 WeakPolarHBondContact O-CG 3.2Å; Y24-L301 PolarHBondContact O-N 2.79Å; Y24-K302 HydrophobicContact CD1-CD 4.19Å; Y24-K302 VanDerWaalsContact CD1-CE 3.47Å; Y24-K302 HydrophobicContact CD1-CG 3.94Å; Y24-K302 HydrophobicContact CD2-CD 4.37Å; Y24-K302 VanDerWaalsContact CE1-CE 3.46Å; Y24-K302 VanDerWaalsContact CE2-CE 3.5Å; Y24-K302 VanDerWaalsContact CE2-NZ 3.33Å; Y24-K302 HydrophobicContact CG-CD 4.07Å; Y24-K302 VanDerWaalsContact CG-CE 3.48Å; Y24-K302 HydrophobicContact CG-CG 4.13Å; Y24-K302 VanDerWaalsContact CZ-CE 3.48Å
25	G	97.3	Very high	80.2	Confident	0 Å²	0	81.8 Å²	81.8	0%	0	48%	0.476	C	S	.	.			trans	-71.9	142.5	168.7	0	0	0	0	0	112.2	S22 K28 S296 V298	S22-G25 PolarHBondContact O-N 2.59Å; G25-K28 PolarHBondContact O-NZ 2.78Å; G25-S296 CarbonylContact C-O 3.49Å; G25-S296 VanDerWaalsContact CA-O 3.29Å; G25-S296 WeakPolarHBondContact CA-O 3.39Å; G25-V298 PolarHBondContact N-O 3.34Å
26	S	97.9	Very high	83.4	Confident	23 Å²	23	84.7 Å²	84.7	16%	0.161	47%	0.474	C	S	.	.	S	Bend	trans	-75.7	-39.9	170.6	50.9	0	0	0	0	111.5	S296 M300 L334 C335	S26-S296 PolarHBondContact N-O 2.76Å; S26-S296 PolarHBondContact OG-O 3.48Å; S26-M300 WeakPolarHBondContact OG-CB 3.3Å; S26-M300 WeakPolarHBondContact OG-CG 3.17Å; S26-L334 WeakPolarHBondContact CB-O 3.38Å; S26-L334 PolarHBondContact OG-O 2.98Å; S26-C335 WeakPolarHBondContact CB-O 3.49Å
27	V	97.7	Very high	86.5	Confident	10 Å²	10	83.9 Å²	83.9	6%	0.061	46%	0.461	C	S	.	.	S	Bend	trans	-88.9	132.7	174.8	-179.8	0	0	0	0	109.1	R63 S296 E297 L334	V27-R63 VanDerWaalsContact CG1-O 3.31Å; V27-R63 WeakPolarHBondContact CG1-O 3.38Å; V27-S296 PolarHBondContact N-O 2.77Å; V27-E297 HydrophobicContact CB-CG 3.87Å; V27-E297 HydrophobicContact CG1-CG 4.19Å; V27-L334 HydrophobicContact CG2-CD2 3.89Å
28	K	95.7	Very high	89.6	Confident	117 Å²	117	75.6 Å²	75.6	51%	0.509	42%	0.423	S	S	.	.			trans	-129.7	163.9	180	-68.1	-176.1	170.1	67.9	0	109.9	G25 Y30	G25-K28 PolarHBondContact O-NZ 2.78Å; K28-Y30 PolarHBondContact O-N 2.86Å
29	A	97.2	Very high	92	Very high	63 Å²	63	72 Å²	72	52%	0.521	40%	0.398	S	S	.	.			trans	-58.8	130.5	174.3	0	0	0	0	0	110.5
30	Y	97.5	Very high	94.2	Very high	102 Å²	102	71.4 Å²	71.4	40%	0.4	39%	0.391	S	S	.	.			trans	-72.9	127.7	176.8	-173.6	-114.6	0	0	0	110.4	K28 N32 F33 R63 Q67	K28-Y30 PolarHBondContact O-N 2.86Å; Y30-N32 HydrophobicContact CE1-CB 4.32Å; Y30-N32 PolarHBondContact O-N 3.28Å; Y30-F33 HydrophobicContact CD1-CB 4.45Å; Y30-F33 WeakPolarHBondContact O-CB 3.23Å; Y30-F33 PolarHBondContact O-N 2.88Å; Y30-R63 VanDerWaalsContact CD1-CZ 3.49Å; Y30-R63 VanDerWaalsContact CG-NH1 3.34Å; Y30-Q67 PolarHBondContact O-NE2 3.03Å
31	T	96.3	Very high	96	Very high	132 Å²	132	69.1 Å²	69.1	81%	0.81	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-44.6	-169.1	-50.8	0	0	0	0	113.6	F33	T31-F33 PolarHBondContact O-N 3.25Å
32	N	96	Very high	97.1	Very high	119 Å²	119	63 Å²	63	64%	0.636	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	49.5	-177.8	-67.4	-39.9	0	0	0	111	Y30 R37	Y30-N32 HydrophobicContact CE1-CB 4.32Å; Y30-N32 PolarHBondContact O-N 3.28Å; N32-R37 PolarHBondContact O-NH2 3.1Å
33	F	98.3	Very high	97.6	Very high	56 Å²	56	62.1 Å²	62.1	25%	0.246	32%	0.324	C	S	.	.			trans	-70.6	135.8	-175.2	173.9	-116.3	0	0	0	113	Y30 T31 A35 D38 Q67 D70 I71	Y30-F33 HydrophobicContact CD1-CB 4.45Å; Y30-F33 WeakPolarHBondContact O-CB 3.23Å; Y30-F33 PolarHBondContact O-N 2.88Å; T31-F33 PolarHBondContact O-N 3.25Å; F33-A35 HydrophobicContact CE1-CB 4.08Å; F33-A35 HydrophobicContact CE2-CB 4.35Å; F33-A35 HydrophobicContact CZ-CB 3.61Å; F33-D38 WeakPolarHBondContact CE2-OD2 3.48Å; F33-Q67 HydrophobicContact CD1-CB 4.35Å; F33-Q67 HydrophobicContact CD1-CG 3.7Å; F33-Q67 HydrophobicContact CD2-CB 4.09Å; F33-Q67 HydrophobicContact CD2-CG 4.02Å; F33-Q67 HydrophobicContact CE1-CB 4.01Å; F33-Q67 HydrophobicContact CE1-CG 3.76Å; F33-Q67 HydrophobicContact CE2-CB 3.76Å; F33-Q67 HydrophobicContact CE2-CG 4.11Å; F33-Q67 HydrophobicContact CG-CB 4.37Å; F33-Q67 HydrophobicContact CG-CG 3.82Å; F33-Q67 HydrophobicContact CZ-CB 3.69Å; F33-Q67 HydrophobicContact CZ-CG 3.97Å; F33-Q67 WeakPolarHBondContact CZ-O 3.3Å; F33-D70 HydrophobicContact CE1-CB 4Å; F33-D70 HydrophobicContact CZ-CB 3.87Å; F33-I71 HydrophobicContact CE2-CD1 3.89Å; F33-I71 HydrophobicContact CE2-CG1 3.74Å; F33-I71 HydrophobicContact CZ-CG1 3.99Å
34	D	98.4	Very high	97.8	Very high	71 Å²	71	62.3 Å²	62.3	38%	0.38	32%	0.318	S	S	.	.			trans	-143.2	109.6	172.6	179	-32.5	0	0	0	107.9	E36 R37 D38	D34-E36 VanDerWaalsContact C-N 3.34Å; D34-E36 PolarHBondContact O-N 3.14Å; D34-E36 WeakPolarHBondContact OD1-CA 3.4Å; D34-E36 PolarHBondContact OD1-N 3.13Å; D34-R37 HydrophobicContact CB-CB 3.97Å; D34-R37 PolarHBondContact O-N 3.44Å; D34-R37 PolarHBondContact OD1-N 2.94Å; D34-D38 PolarHBondContact O-N 3.25Å
35	A	98.6	Very high	97.9	Very high	19 Å²	19	56.9 Å²	56.9	16%	0.157	30%	0.297	C	S	.	.	H	α-helix	trans	-63.9	-36.3	-177.3	0	0	0	0	0	112.9	F33 A39 D70 A74	F33-A35 HydrophobicContact CE1-CB 4.08Å; F33-A35 HydrophobicContact CE2-CB 4.35Å; F33-A35 HydrophobicContact CZ-CB 3.61Å; A35-A39 WeakPolarHBondContact O-CB 3.42Å; A35-A39 PolarHBondContact O-N 3.42Å; A35-D70 HydrophobicContact CB-CB 3.94Å; A35-A74 HydrophobicContact CB-CB 4Å
36	E	98.4	Very high	98	Very high	120 Å²	120	58.3 Å²	58.3	56%	0.561	30%	0.304	S	S	*	.	H	α-helix	trans	-72.2	-37.8	-177.7	-69	-158.5	171.8	0	0	112	D34 L40 A74 R78	D34-E36 VanDerWaalsContact C-N 3.34Å; D34-E36 PolarHBondContact O-N 3.14Å; D34-E36 WeakPolarHBondContact OD1-CA 3.4Å; D34-E36 PolarHBondContact OD1-N 3.13Å; E36-L40 WeakPolarHBondContact O-CB 3.36Å; E36-L40 PolarHBondContact O-N 2.97Å; E36-A74 HydrophobicContact CG-CB 4.47Å; E36-R78 PolarHBondContact O-NH2 2.93Å
37	R	98.6	Very high	98	Very high	115 Å²	115	64.5 Å²	64.5	43%	0.434	33%	0.328	S	S	.	.	H	α-helix	trans	-67.8	-47	174.9	-177.3	177.7	61.4	-179.4	-6.8	111.2	N32 D34 A39 L40 N41	N32-R37 PolarHBondContact O-NH2 3.1Å; D34-R37 HydrophobicContact CB-CB 3.97Å; D34-R37 PolarHBondContact O-N 3.44Å; D34-R37 PolarHBondContact OD1-N 2.94Å; R37-A39 VanDerWaalsContact C-N 3.34Å; R37-A39 PolarHBondContact O-N 3.08Å; R37-L40 PolarHBondContact O-N 3.31Å; R37-N41 VanDerWaalsContact O-CG 3.28Å; R37-N41 PolarHBondContact O-N 2.91Å; R37-N41 PolarHBondContact O-ND2 2.84Å
38	D	98.7	Very high	98	Very high	4 Å²	4	67 Å²	67	2%	0.021	34%	0.343	C	S	.	.	H	α-helix	trans	-62.8	-41.4	177	-77.4	-23.5	0	0	0	111.3	F33 D34 L40 N41 I42 I59 R63 I71	F33-D38 WeakPolarHBondContact CE2-OD2 3.48Å; D34-D38 PolarHBondContact O-N 3.25Å; D38-L40 PolarHBondContact O-N 3.32Å; D38-N41 PolarHBondContact O-N 3.32Å; D38-I42 VanDerWaalsContact O-CG1 3.32Å; D38-I42 WeakPolarHBondContact O-CG1 3.09Å; D38-I42 PolarHBondContact O-N 3.22Å; D38-I59 HydrophobicContact CB-CG2 4.05Å; D38-R63 IonicContact OD1-CZ 3.38Å; D38-R63 IonicContact OD1-NE 2.86Å; D38-R63 IonicContact OD1-NH2 3.14Å; D38-R63 PolarHBondContact OD1-NH2 3.01Å; D38-R63 IonicContact OD2-CZ 3.51Å; D38-R63 VanDerWaalsContact OD2-CZ 3.31Å; D38-R63 IonicContact OD2-NE 2.74Å; D38-R63 PolarHBondContact OD2-NE 3.15Å; D38-R63 IonicContact OD2-NH2 3.66Å; D38-R63 PolarHBondContact OD2-NH2 3.32Å; D38-R63 VanDerWaalsContact OD2-NH2 3.08Å; D38-I71 HydrophobicContact CB-CD1 3.74Å; D38-I71 HydrophobicContact CB-CG1 3.77Å; D38-I71 HydrophobicContact CB-CG2 4.46Å
39	A	98.8	Very high	98	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-60.1	-41.6	174.6	0	0	0	0	0	112.8	A35 R37 E43 A74 Y75	A35-A39 WeakPolarHBondContact O-CB 3.42Å; A35-A39 PolarHBondContact O-N 3.42Å; R37-A39 VanDerWaalsContact C-N 3.34Å; R37-A39 PolarHBondContact O-N 3.08Å; A39-E43 WeakPolarHBondContact O-CB 3.43Å; A39-E43 PolarHBondContact O-N 2.97Å; A39-A74 HydrophobicContact CB-CB 3.98Å; A39-Y75 HydrophobicContact CB-CD2 4.44Å
40	L	98.6	Very high	97.8	Very high	71 Å²	71	71.5 Å²	71.5	37%	0.372	37%	0.369	S	S	.	.	H	α-helix	trans	-65.2	-43.4	175.7	176.7	63.1	0	0	0	112.1	E36 R37 D38 E43 T44	E36-L40 WeakPolarHBondContact O-CB 3.36Å; E36-L40 PolarHBondContact O-N 2.97Å; R37-L40 PolarHBondContact O-N 3.31Å; D38-L40 PolarHBondContact O-N 3.32Å; L40-E43 PolarHBondContact O-N 3.27Å; L40-T44 WeakPolarHBondContact O-CB 3.3Å; L40-T44 PolarHBondContact O-N 2.92Å; L40-T44 PolarHBondContact O-OG1 3.43Å
41	N	98.6	Very high	97.8	Very high	65 Å²	65	68.1 Å²	68.1	35%	0.348	36%	0.359	S	S	.	.	H	α-helix	trans	-64.5	-42.2	179	-70.2	-22.7	0	0	0	111.1	R37 D38 T44 A45 I59	R37-N41 VanDerWaalsContact O-CG 3.28Å; R37-N41 PolarHBondContact O-N 2.91Å; R37-N41 PolarHBondContact O-ND2 2.84Å; D38-N41 PolarHBondContact O-N 3.32Å; N41-T44 PolarHBondContact O-N 2.96Å; N41-A45 WeakPolarHBondContact O-CB 3.46Å; N41-A45 PolarHBondContact O-N 3.29Å; N41-I59 HydrophobicContact CB-CD1 3.65Å
42	I	98.7	Very high	97.9	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-64.1	-42.6	174.6	-67.7	166.3	0	0	0	111.1	D38 T44 A45 I46 I59 L60 I71 Y75 L83 L87	D38-I42 VanDerWaalsContact O-CG1 3.32Å; D38-I42 WeakPolarHBondContact O-CG1 3.09Å; D38-I42 PolarHBondContact O-N 3.22Å; I42-T44 VanDerWaalsContact C-N 3.32Å; I42-T44 PolarHBondContact O-N 3.26Å; I42-A45 PolarHBondContact O-N 2.99Å; I42-I46 HydrophobicContact CG2-CD1 3.81Å; I42-I46 HydrophobicContact CG2-CG1 4.37Å; I42-I46 VanDerWaalsContact O-CG1 3.3Å; I42-I46 WeakPolarHBondContact O-CG1 3.36Å; I42-I46 PolarHBondContact O-N 3.24Å; I42-I59 HydrophobicContact CD1-CG2 4.02Å; I42-I59 HydrophobicContact CG1-CD1 3.95Å; I42-I59 HydrophobicContact CG1-CG2 4.35Å; I42-L60 HydrophobicContact CD1-CD2 3.87Å; I42-L60 HydrophobicContact CD1-CG 4.26Å; I42-I71 HydrophobicContact CD1-CG2 3.6Å; I42-Y75 HydrophobicContact CG2-CE2 4.31Å; I42-L83 HydrophobicContact CG2-CD1 3.74Å; I42-L87 HydrophobicContact CG2-CD2 4.34Å
43	E	98.3	Very high	98	Very high	29 Å²	29	61.1 Å²	61.1	14%	0.136	32%	0.315	C	S	.	.	H	α-helix	trans	-59.4	-43.7	175.2	-175.6	-176.8	-171.2	0	0	111.9	A39 L40 I46 K47 Y75 R78 T79	A39-E43 WeakPolarHBondContact O-CB 3.43Å; A39-E43 PolarHBondContact O-N 2.97Å; L40-E43 PolarHBondContact O-N 3.27Å; E43-I46 PolarHBondContact O-N 3.36Å; E43-K47 HydrophobicContact CG-CD 4.33Å; E43-K47 WeakPolarHBondContact O-CG 3.4Å; E43-K47 PolarHBondContact O-N 3.13Å; E43-K47 VanDerWaalsContact OE1-CE 3.3Å; E43-K47 WeakPolarHBondContact OE1-CE 3.35Å; E43-K47 IonicContact OE1-NZ 2.62Å; E43-K47 PolarHBondContact OE1-NZ 3.48Å; E43-Y75 HydrophobicContact CB-CD2 4.47Å; E43-Y75 HydrophobicContact CB-CE2 3.79Å; E43-Y75 HydrophobicContact CG-CE2 4.42Å; E43-R78 WeakPolarHBondContact OE2-CD 3.45Å; E43-T79 VanDerWaalsContact CD-CG2 3.5Å; E43-T79 HydrophobicContact CG-CG2 4.12Å
44	T	98.6	Very high	98	Very high	76 Å²	76	61.1 Å²	61.1	47%	0.466	32%	0.319	S	S	.	.	H	α-helix	trans	-64	-43.4	178.2	-56.5	0	0	0	0	111	L40 N41 I42 I46 K47 T48	L40-T44 WeakPolarHBondContact O-CB 3.3Å; L40-T44 PolarHBondContact O-N 2.92Å; L40-T44 PolarHBondContact O-OG1 3.43Å; N41-T44 PolarHBondContact O-N 2.96Å; I42-T44 VanDerWaalsContact C-N 3.32Å; I42-T44 PolarHBondContact O-N 3.26Å; T44-I46 PolarHBondContact O-N 3.11Å; T44-K47 PolarHBondContact O-N 3.18Å; T44-T48 PolarHBondContact O-N 3.32Å; T44-T48 PolarHBondContact O-OG1 3.35Å
45	A	98.5	Very high	98	Very high	2 Å²	2	59.8 Å²	59.8	2%	0.017	31%	0.314	C	S	.	.	H	α-helix	trans	-62.6	-41.7	176.9	0	0	0	0	0	112.4	N41 I42 K47 T48 D52 T55 I56	N41-A45 WeakPolarHBondContact O-CB 3.46Å; N41-A45 PolarHBondContact O-N 3.29Å; I42-A45 PolarHBondContact O-N 2.99Å; A45-K47 PolarHBondContact O-N 3.14Å; A45-T48 PolarHBondContact O-N 3.36Å; A45-D52 HydrophobicContact CB-CB 3.91Å; A45-D52 PolarHBondContact O-N 2.84Å; A45-T55 HydrophobicContact CB-CG2 3.97Å; A45-I56 HydrophobicContact CB-CD1 4.23Å; A45-I56 HydrophobicContact CB-CG1 3.78Å
46	I	98.3	Very high	98	Very high	31 Å²	31	58.9 Å²	58.9	16%	0.159	31%	0.306	C	S	.	.	H	α-helix	trans	-63.7	-38.8	175.1	-70.6	168.1	0	0	0	111.9	I42 E43 T44 T48 I56 Y75 A86 L87 A90	I42-I46 HydrophobicContact CG2-CD1 3.81Å; I42-I46 HydrophobicContact CG2-CG1 4.37Å; I42-I46 VanDerWaalsContact O-CG1 3.3Å; I42-I46 WeakPolarHBondContact O-CG1 3.36Å; I42-I46 PolarHBondContact O-N 3.24Å; E43-I46 PolarHBondContact O-N 3.36Å; T44-I46 PolarHBondContact O-N 3.11Å; I46-T48 VanDerWaalsContact C-N 3.34Å; I46-I56 HydrophobicContact CG1-CD1 4.07Å; I46-Y75 HydrophobicContact CD1-CE2 4.34Å; I46-A86 HydrophobicContact CD1-CB 4.1Å; I46-L87 HydrophobicContact CD1-CD2 3.78Å; I46-L87 HydrophobicContact CD1-CG 4.02Å; I46-L87 HydrophobicContact CG1-CD2 4.01Å; I46-A90 HydrophobicContact CG1-CB 4.17Å; I46-A90 HydrophobicContact CG2-CB 4.01Å
47	K	97.3	Very high	98	Very high	152 Å²	152	53.2 Å²	53.2	66%	0.661	28%	0.28	S	S	*	.	H	α-helix	trans	-80.6	-13.7	-178.2	-71.6	-178.8	-173.1	169.4	0	114	E43 T44 A45	E43-K47 HydrophobicContact CG-CD 4.33Å; E43-K47 WeakPolarHBondContact O-CG 3.4Å; E43-K47 PolarHBondContact O-N 3.13Å; E43-K47 VanDerWaalsContact OE1-CE 3.3Å; E43-K47 WeakPolarHBondContact OE1-CE 3.35Å; E43-K47 IonicContact OE1-NZ 2.62Å; E43-K47 PolarHBondContact OE1-NZ 3.48Å; T44-K47 PolarHBondContact O-N 3.18Å; A45-K47 PolarHBondContact O-N 3.14Å
48	T	97.8	Very high	98	Very high	62 Å²	62	50.4 Å²	50.4	38%	0.38	27%	0.274	S	S	.	.	S	Bend	trans	-62.8	140.3	179.2	-65.7	0	0	0	0	109.8	T44 A45 I46 G50 V51 D52	T44-T48 PolarHBondContact O-N 3.32Å; T44-T48 PolarHBondContact O-OG1 3.35Å; A45-T48 PolarHBondContact O-N 3.36Å; I46-T48 VanDerWaalsContact C-N 3.34Å; T48-G50 PolarHBondContact O-N 3.17Å; T48-G50 VanDerWaalsContact O-N 3.09Å; T48-V51 WeakPolarHBondContact O-CA 3.28Å; T48-V51 PolarHBondContact O-N 2.94Å; T48-D52 HydrophobicContact CG2-CB 4.49Å
49	K	96	Very high	98	Very high	213 Å²	213	50.9 Å²	50.9	93%	0.926	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	116.6	179.6	-177.2	-177.7	178.5	-177.4	0	109.4
50	G	94.5	Very high	98	Very high	62 Å²	62	50.9 Å²	50.9	64%	0.639	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.2	-1	-175.2	0	0	0	0	0	114.5	T48	T48-G50 PolarHBondContact O-N 3.17Å; T48-G50 VanDerWaalsContact O-N 3.09Å
51	V	97.5	Very high	98	Very high	31 Å²	31	47.6 Å²	47.6	19%	0.188	26%	0.259	C	S	.	.			trans	64.7	145.3	-171.9	-173.9	0	0	0	0	111.6	T48 E53 I56 A90 L91	T48-V51 WeakPolarHBondContact O-CA 3.28Å; T48-V51 PolarHBondContact O-N 2.94Å; V51-E53 HydrophobicContact CG1-CG 4.33Å; V51-E53 VanDerWaalsContact O-OE2 3.12Å; V51-I56 HydrophobicContact CG1-CD1 3.74Å; V51-A90 HydrophobicContact CG1-CB 4.36Å; V51-A90 HydrophobicContact CG2-CB 4.15Å; V51-L91 HydrophobicContact CG1-CD2 4.29Å
52	D	98.2	Very high	98	Very high	52 Å²	52	47.6 Å²	47.6	28%	0.278	26%	0.259	S	S	.	.			trans	-104.8	80.7	171	178	3.3	0	0	0	109.5	A45 T48 V54 T55 I56	A45-D52 HydrophobicContact CB-CB 3.91Å; A45-D52 PolarHBondContact O-N 2.84Å; T48-D52 HydrophobicContact CG2-CB 4.49Å; D52-V54 PolarHBondContact O-N 3.49Å; D52-V54 PolarHBondContact OD1-N 3.08Å; D52-T55 VanDerWaalsContact CG-OG1 3.26Å; D52-T55 PolarHBondContact O-N 2.92Å; D52-T55 PolarHBondContact OD1-N 3.46Å; D52-T55 PolarHBondContact OD1-OG1 3Å; D52-T55 WeakPolarHBondContact OD2-CB 3.48Å; D52-T55 PolarHBondContact OD2-OG1 3.46Å; D52-I56 WeakPolarHBondContact O-CG1 3.38Å; D52-I56 PolarHBondContact O-N 3.2Å
53	E	98.3	Very high	98	Very high	53 Å²	53	48.4 Å²	48.4	25%	0.248	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-33.4	179.9	-64.7	88.4	165.3	0	0	111.8	V51 T55 I56 V57 L91 L95 D326	V51-E53 HydrophobicContact CG1-CG 4.33Å; V51-E53 VanDerWaalsContact O-OE2 3.12Å; E53-T55 PolarHBondContact O-N 3Å; E53-I56 PolarHBondContact O-N 3.06Å; E53-V57 WeakPolarHBondContact O-CB 3.25Å; E53-V57 VanDerWaalsContact O-CG2 3.27Å; E53-V57 WeakPolarHBondContact O-CG2 3.35Å; E53-V57 PolarHBondContact O-N 3.07Å; E53-L91 HydrophobicContact CG-CD2 3.85Å; E53-L95 HydrophobicContact CB-CD2 3.94Å; E53-L95 HydrophobicContact CG-CD2 3.75Å; E53-D326 HydrophobicContact CB-CB 4.17Å
54	V	97.8	Very high	98	Very high	55 Å²	55	47.7 Å²	47.7	33%	0.333	26%	0.26	S	S	.	.	H	α-helix	trans	-61.8	-46.6	-179.2	177	0	0	0	0	110.4	D52 N58	D52-V54 PolarHBondContact O-N 3.49Å; D52-V54 PolarHBondContact OD1-N 3.08Å; V54-N58 WeakPolarHBondContact CG1-ND2 3.37Å; V54-N58 VanDerWaalsContact O-CB 3.25Å; V54-N58 WeakPolarHBondContact O-CB 3.27Å; V54-N58 PolarHBondContact O-N 2.7Å; V54-N58 PolarHBondContact O-ND2 2.71Å
55	T	98.4	Very high	97.9	Very high	43 Å²	43	45 Å²	45	26%	0.264	24%	0.243	S	C	.	.	H	α-helix	trans	-64.3	-43.1	176.2	-69.2	0	0	0	0	111.8	A45 D52 E53 N58 I59	A45-T55 HydrophobicContact CB-CG2 3.97Å; D52-T55 VanDerWaalsContact CG-OG1 3.26Å; D52-T55 PolarHBondContact O-N 2.92Å; D52-T55 PolarHBondContact OD1-N 3.46Å; D52-T55 PolarHBondContact OD1-OG1 3Å; D52-T55 WeakPolarHBondContact OD2-CB 3.48Å; D52-T55 PolarHBondContact OD2-OG1 3.46Å; E53-T55 PolarHBondContact O-N 3Å; T55-N58 PolarHBondContact O-N 3.47Å; T55-I59 HydrophobicContact CG2-CD1 3.84Å; T55-I59 WeakPolarHBondContact O-CG1 3.48Å; T55-I59 PolarHBondContact O-N 3Å; T55-I59 VanDerWaalsContact O-N 3.08Å
56	I	98.7	Very high	97.9	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-60.4	-49.2	178.8	-66.1	164.9	0	0	0	110.8	A45 I46 V51 D52 E53 L60 L87 L91 I99	A45-I56 HydrophobicContact CB-CD1 4.23Å; A45-I56 HydrophobicContact CB-CG1 3.78Å; I46-I56 HydrophobicContact CG1-CD1 4.07Å; V51-I56 HydrophobicContact CG1-CD1 3.74Å; D52-I56 WeakPolarHBondContact O-CG1 3.38Å; D52-I56 PolarHBondContact O-N 3.2Å; E53-I56 PolarHBondContact O-N 3.06Å; I56-L60 HydrophobicContact CG2-CD1 3.99Å; I56-L60 WeakPolarHBondContact O-CB 3.36Å; I56-L60 WeakPolarHBondContact O-CG 3.27Å; I56-L60 PolarHBondContact O-N 3.46Å; I56-L87 HydrophobicContact CD1-CD2 3.8Å; I56-L87 HydrophobicContact CG1-CD2 4.2Å; I56-L87 HydrophobicContact CG2-CD2 3.65Å; I56-L91 HydrophobicContact CD1-CD2 4.18Å; I56-L91 HydrophobicContact CG2-CD1 4.4Å; I56-I99 HydrophobicContact CG2-CD1 4.45Å; I56-I99 HydrophobicContact CG2-CG2 4.48Å
57	V	98.6	Very high	97.9	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-60.4	-54.1	178.2	168.9	0	0	0	0	110	E53 I59 L60 T61 L95 I99 K329 A330 Y333	E53-V57 WeakPolarHBondContact O-CB 3.25Å; E53-V57 VanDerWaalsContact O-CG2 3.27Å; E53-V57 WeakPolarHBondContact O-CG2 3.35Å; E53-V57 PolarHBondContact O-N 3.07Å; V57-I59 VanDerWaalsContact C-N 3.25Å; V57-I59 PolarHBondContact O-N 2.78Å; V57-L60 PolarHBondContact O-N 3.37Å; V57-T61 HydrophobicContact CG1-CG2 4.11Å; V57-T61 PolarHBondContact O-N 3.14Å; V57-T61 PolarHBondContact O-OG1 3.35Å; V57-L95 HydrophobicContact CG2-CD1 3.59Å; V57-I99 HydrophobicContact CG2-CD1 4.35Å; V57-K329 HydrophobicContact CG1-CB 4.46Å; V57-A330 HydrophobicContact CG1-CB 3.89Å; V57-A330 HydrophobicContact CG2-CB 4.24Å; V57-Y333 HydrophobicContact CG1-CD2 3.84Å; V57-Y333 HydrophobicContact CG1-CE2 4.17Å
58	N	97.9	Very high	98	Very high	56 Å²	56	40.1 Å²	40.1	30%	0.299	23%	0.232	S	C	.	.	H	α-helix	trans	-54.7	-41.2	-176.8	-77.6	-21.2	0	0	0	112.6	V54 T55 N62 Y333	V54-N58 WeakPolarHBondContact CG1-ND2 3.37Å; V54-N58 VanDerWaalsContact O-CB 3.25Å; V54-N58 WeakPolarHBondContact O-CB 3.27Å; V54-N58 PolarHBondContact O-N 2.7Å; V54-N58 PolarHBondContact O-ND2 2.71Å; T55-N58 PolarHBondContact O-N 3.47Å; N58-N62 WeakPolarHBondContact O-CB 3.41Å; N58-N62 PolarHBondContact O-ND2 2.89Å; N58-Y333 WeakPolarHBondContact OD1-CE2 2.95Å; N58-Y333 VanDerWaalsContact OD1-CZ 3.24Å; N58-Y333 PolarHBondContact OD1-OH 3.42Å; N58-Y333 VanDerWaalsContact OD1-OH 3.04Å
59	I	98.6	Very high	98.1	Very high	14 Å²	14	39.9 Å²	39.9	7%	0.072	23%	0.226	C	C	.	.	H	α-helix	trans	-68.8	-59.8	176.6	-65.3	169.6	0	0	0	109.5	D38 N41 I42 T55 V57 T61 N62 R63 I71	D38-I59 HydrophobicContact CB-CG2 4.05Å; N41-I59 HydrophobicContact CB-CD1 3.65Å; I42-I59 HydrophobicContact CD1-CG2 4.02Å; I42-I59 HydrophobicContact CG1-CD1 3.95Å; I42-I59 HydrophobicContact CG1-CG2 4.35Å; T55-I59 HydrophobicContact CG2-CD1 3.84Å; T55-I59 WeakPolarHBondContact O-CG1 3.48Å; T55-I59 PolarHBondContact O-N 3Å; T55-I59 VanDerWaalsContact O-N 3.08Å; V57-I59 VanDerWaalsContact C-N 3.25Å; V57-I59 PolarHBondContact O-N 2.78Å; I59-T61 VanDerWaalsContact C-N 3.33Å; I59-T61 PolarHBondContact O-N 3.17Å; I59-N62 CarbonylContact O-C 3.38Å; I59-N62 PolarHBondContact O-N 3.48Å; I59-N62 VanDerWaalsContact O-N 3.12Å; I59-R63 HydrophobicContact CG2-CG 4.38Å; I59-R63 VanDerWaalsContact O-CG 3.23Å; I59-R63 WeakPolarHBondContact O-CG 3.22Å; I59-R63 PolarHBondContact O-N 3.36Å; I59-I71 HydrophobicContact CG2-CD1 4.23Å
60	L	98.7	Very high	98.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-70.1	-26.7	-167.1	-65.2	179.4	0	0	0	113.9	I42 I56 V57 R68 L87 I99 L103	I42-L60 HydrophobicContact CD1-CD2 3.87Å; I42-L60 HydrophobicContact CD1-CG 4.26Å; I56-L60 HydrophobicContact CG2-CD1 3.99Å; I56-L60 WeakPolarHBondContact O-CB 3.36Å; I56-L60 WeakPolarHBondContact O-CG 3.27Å; I56-L60 PolarHBondContact O-N 3.46Å; V57-L60 PolarHBondContact O-N 3.37Å; L60-R68 HydrophobicContact CD2-CG 4.26Å; L60-R68 PolarHBondContact O-NE 3.34Å; L60-L87 HydrophobicContact CD1-CD1 3.86Å; L60-I99 HydrophobicContact CB-CD1 4.4Å; L60-I99 HydrophobicContact CD1-CD1 4.31Å; L60-I99 HydrophobicContact CD1-CG2 3.65Å; L60-L103 HydrophobicContact CD1-CD2 4.15Å; L60-L103 HydrophobicContact CD2-CD2 4.01Å
61	T	98.5	Very high	98.4	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.006	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-10.4	175.6	62.3	0	0	0	0	113.8	V57 I59 L102 A330 Y333 L334	V57-T61 HydrophobicContact CG1-CG2 4.11Å; V57-T61 PolarHBondContact O-N 3.14Å; V57-T61 PolarHBondContact O-OG1 3.35Å; I59-T61 VanDerWaalsContact C-N 3.33Å; I59-T61 PolarHBondContact O-N 3.17Å; T61-L102 HydrophobicContact CG2-CD1 3.95Å; T61-A330 HydrophobicContact CG2-CB 4.2Å; T61-Y333 WeakPolarHBondContact OG1-CB 3.39Å; T61-L334 HydrophobicContact CG2-CD2 4.11Å; T61-L334 HydrophobicContact CG2-CG 4.26Å
62	N	98.2	Very high	98.5	Very high	66 Å²	66	30.3 Å²	30.3	35%	0.353	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.1	28.5	177.9	-67.8	-81.9	0	0	0	112.4	N58 I59	N58-N62 WeakPolarHBondContact O-CB 3.41Å; N58-N62 PolarHBondContact O-ND2 2.89Å; I59-N62 CarbonylContact O-C 3.38Å; I59-N62 PolarHBondContact O-N 3.48Å; I59-N62 VanDerWaalsContact O-N 3.12Å
63	R	98.4	Very high	98.5	Very high	17 Å²	17	32.8 Å²	32.8	6%	0.064	18%	0.181	C	C	.	.	S	Bend	trans	-128.9	143.2	172.4	-64.4	-64.9	179.2	-77	-9	108.5	V27 Y30 D38 I59 Q67 R68 I71	V27-R63 VanDerWaalsContact CG1-O 3.31Å; V27-R63 WeakPolarHBondContact CG1-O 3.38Å; Y30-R63 VanDerWaalsContact CD1-CZ 3.49Å; Y30-R63 VanDerWaalsContact CG-NH1 3.34Å; D38-R63 IonicContact OD1-CZ 3.38Å; D38-R63 IonicContact OD1-NE 2.86Å; D38-R63 IonicContact OD1-NH2 3.14Å; D38-R63 PolarHBondContact OD1-NH2 3.01Å; D38-R63 IonicContact OD2-CZ 3.51Å; D38-R63 VanDerWaalsContact OD2-CZ 3.31Å; D38-R63 IonicContact OD2-NE 2.74Å; D38-R63 PolarHBondContact OD2-NE 3.15Å; D38-R63 IonicContact OD2-NH2 3.66Å; D38-R63 PolarHBondContact OD2-NH2 3.32Å; D38-R63 VanDerWaalsContact OD2-NH2 3.08Å; I59-R63 HydrophobicContact CG2-CG 4.38Å; I59-R63 VanDerWaalsContact O-CG 3.23Å; I59-R63 WeakPolarHBondContact O-CG 3.22Å; I59-R63 PolarHBondContact O-N 3.36Å; R63-Q67 HydrophobicContact CB-CB 3.99Å; R63-R68 HydrophobicContact CB-CG 4.07Å; R63-R68 VanDerWaalsContact O-CZ 3.3Å; R63-R68 PolarHBondContact O-NE 2.89Å; R63-R68 PolarHBondContact O-NH2 3.5Å; R63-I71 HydrophobicContact CB-CD1 4.46Å; R63-I71 HydrophobicContact CG-CD1 3.93Å
64	S	98.4	Very high	98.5	Very high	14 Å²	14	30.9 Å²	30.9	10%	0.098	17%	0.174	C	C	.	.			trans	-65.7	161.8	170.6	64.2	0	0	0	0	110.7	A66 Q67 R68 E297	S64-A66 VanDerWaalsContact C-N 3.26Å; S64-A66 PolarHBondContact O-N 2.95Å; S64-Q67 WeakPolarHBondContact O-CB 3.42Å; S64-Q67 PolarHBondContact O-N 2.85Å; S64-Q67 VanDerWaalsContact O-N 3.11Å; S64-Q67 WeakPolarHBondContact OG-CG 3.46Å; S64-Q67 PolarHBondContact OG-N 3Å; S64-R68 WeakPolarHBondContact O-CG 3.37Å; S64-R68 PolarHBondContact O-N 3.33Å; S64-E297 WeakPolarHBondContact CA-OE2 3.23Å; S64-E297 WeakPolarHBondContact CB-OE2 3.41Å
65	N	98.4	Very high	98.5	Very high	19 Å²	19	28.7 Å²	28.7	10%	0.102	16%	0.16	C	C	.	.	H	α-helix	trans	-57.7	-41.9	179.7	-172.1	-87.9	0	0	0	111.8	Q67 R68 Q69 L102 K104 T105 E297	N65-Q67 PolarHBondContact O-N 3.27Å; N65-R68 WeakPolarHBondContact O-CB 3.2Å; N65-R68 PolarHBondContact O-N 2.88Å; N65-R68 VanDerWaalsContact O-N 3.09Å; N65-Q69 WeakPolarHBondContact O-CG 3.24Å; N65-Q69 PolarHBondContact O-N 3.23Å; N65-Q69 PolarHBondContact OD1-NE2 3.31Å; N65-L102 PolarHBondContact ND2-O 2.9Å; N65-K104 PolarHBondContact ND2-O 3.32Å; N65-T105 WeakPolarHBondContact OD1-CA 3.49Å; N65-E297 VanDerWaalsContact N-CD 3.26Å; N65-E297 PolarHBondContact N-OE1 2.78Å; N65-E297 PolarHBondContact N-OE2 3.18Å
66	A	98.1	Very high	98.5	Very high	62 Å²	62	29.5 Å²	29.5	51%	0.512	16%	0.161	S	C	.	.	H	α-helix	trans	-57.3	-47.5	175.1	0	0	0	0	0	111.8	S64 R68 Q69 D70	S64-A66 VanDerWaalsContact C-N 3.26Å; S64-A66 PolarHBondContact O-N 2.95Å; A66-R68 VanDerWaalsContact C-N 3.29Å; A66-R68 PolarHBondContact O-N 3.5Å; A66-Q69 WeakPolarHBondContact O-CB 3.43Å; A66-Q69 PolarHBondContact O-N 3.25Å; A66-D70 PolarHBondContact O-N 3.07Å; A66-D70 VanDerWaalsContact O-N 3.11Å
67	Q	98.7	Very high	98.5	Very high	18 Å²	18	37 Å²	37	8%	0.084	19%	0.189	C	C	.	.	H	α-helix	trans	-62.2	-35.7	175.5	-70.8	177.4	-25.6	0	0	112.1	Y30 F33 R63 S64 N65 Q69 D70 I71	Y30-Q67 PolarHBondContact O-NE2 3.03Å; F33-Q67 HydrophobicContact CD1-CB 4.35Å; F33-Q67 HydrophobicContact CD1-CG 3.7Å; F33-Q67 HydrophobicContact CD2-CB 4.09Å; F33-Q67 HydrophobicContact CD2-CG 4.02Å; F33-Q67 HydrophobicContact CE1-CB 4.01Å; F33-Q67 HydrophobicContact CE1-CG 3.76Å; F33-Q67 HydrophobicContact CE2-CB 3.76Å; F33-Q67 HydrophobicContact CE2-CG 4.11Å; F33-Q67 HydrophobicContact CG-CB 4.37Å; F33-Q67 HydrophobicContact CG-CG 3.82Å; F33-Q67 HydrophobicContact CZ-CB 3.69Å; F33-Q67 HydrophobicContact CZ-CG 3.97Å; F33-Q67 WeakPolarHBondContact CZ-O 3.3Å; R63-Q67 HydrophobicContact CB-CB 3.99Å; S64-Q67 WeakPolarHBondContact O-CB 3.42Å; S64-Q67 PolarHBondContact O-N 2.85Å; S64-Q67 VanDerWaalsContact O-N 3.11Å; S64-Q67 WeakPolarHBondContact OG-CG 3.46Å; S64-Q67 PolarHBondContact OG-N 3Å; N65-Q67 PolarHBondContact O-N 3.27Å; Q67-Q69 VanDerWaalsContact C-N 3.3Å; Q67-Q69 PolarHBondContact O-N 3.36Å; Q67-D70 PolarHBondContact O-N 3.26Å; Q67-I71 VanDerWaalsContact O-CG1 3.22Å; Q67-I71 WeakPolarHBondContact O-CG1 3.25Å; Q67-I71 PolarHBondContact O-N 3.43Å
68	R	98.8	Very high	98.4	Very high	3 Å²	3	41.9 Å²	41.9	1%	0.011	21%	0.207	C	C	.	.	H	α-helix	trans	-64.9	-33.6	173.6	-63.1	179.8	-149.1	119.7	16.6	112.2	L60 R63 S64 N65 A66 I71 A72 L102 L103 E297	L60-R68 HydrophobicContact CD2-CG 4.26Å; L60-R68 PolarHBondContact O-NE 3.34Å; R63-R68 HydrophobicContact CB-CG 4.07Å; R63-R68 VanDerWaalsContact O-CZ 3.3Å; R63-R68 PolarHBondContact O-NE 2.89Å; R63-R68 PolarHBondContact O-NH2 3.5Å; S64-R68 WeakPolarHBondContact O-CG 3.37Å; S64-R68 PolarHBondContact O-N 3.33Å; N65-R68 WeakPolarHBondContact O-CB 3.2Å; N65-R68 PolarHBondContact O-N 2.88Å; N65-R68 VanDerWaalsContact O-N 3.09Å; A66-R68 VanDerWaalsContact C-N 3.29Å; A66-R68 PolarHBondContact O-N 3.5Å; R68-I71 PolarHBondContact O-N 3.26Å; R68-A72 WeakPolarHBondContact O-CB 3.41Å; R68-A72 PolarHBondContact O-N 3.45Å; R68-L102 WeakPolarHBondContact CD-O 3.46Å; R68-L102 PolarHBondContact NH1-O 2.97Å; R68-L103 HydrophobicContact CB-CD2 4.47Å; R68-E297 IonicContact CZ-OE1 3.94Å; R68-E297 IonicContact NH1-OE1 2.66Å; R68-E297 PolarHBondContact NH1-OE1 3.29Å; R68-E297 IonicContact NH2-OE1 3.46Å; R68-E297 PolarHBondContact NH2-OE1 3.18Å
69	Q	98.7	Very high	98.4	Very high	57 Å²	57	40.6 Å²	40.6	27%	0.266	20%	0.202	S	C	.	.	H	α-helix	trans	-65	-44.1	173.1	-57.1	-46.2	-57.7	0	0	111.2	N65 A66 Q67 I71 A72 F73 L103 T105	N65-Q69 WeakPolarHBondContact O-CG 3.24Å; N65-Q69 PolarHBondContact O-N 3.23Å; N65-Q69 PolarHBondContact OD1-NE2 3.31Å; A66-Q69 WeakPolarHBondContact O-CB 3.43Å; A66-Q69 PolarHBondContact O-N 3.25Å; Q67-Q69 VanDerWaalsContact C-N 3.3Å; Q67-Q69 PolarHBondContact O-N 3.36Å; Q69-I71 PolarHBondContact O-N 2.94Å; Q69-A72 PolarHBondContact O-N 3.48Å; Q69-F73 PolarHBondContact O-N 3.11Å; Q69-L103 PolarHBondContact NE2-O 3.32Å; Q69-T105 HydrophobicContact CG-CG2 4.2Å
70	D	98.6	Very high	98.4	Very high	81 Å²	81	47.9 Å²	47.9	43%	0.433	23%	0.233	S	C	.	.	H	α-helix	trans	-62.7	-42	176.6	-65.5	-29.5	0	0	0	111.8	F33 A35 A66 Q67 A72 F73 A74	F33-D70 HydrophobicContact CE1-CB 4Å; F33-D70 HydrophobicContact CZ-CB 3.87Å; A35-D70 HydrophobicContact CB-CB 3.94Å; A66-D70 PolarHBondContact O-N 3.07Å; A66-D70 VanDerWaalsContact O-N 3.11Å; Q67-D70 PolarHBondContact O-N 3.26Å; D70-A72 PolarHBondContact O-N 2.96Å; D70-F73 PolarHBondContact O-N 2.94Å; D70-A74 WeakPolarHBondContact O-CB 3.42Å; D70-A74 PolarHBondContact O-N 2.85Å
71	I	98.8	Very high	98.3	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60	-45.9	174	-68.2	166.4	0	0	0	110.4	F33 D38 I42 I59 R63 Q67 R68 Q69 F73 A74 Y75 L83	F33-I71 HydrophobicContact CE2-CD1 3.89Å; F33-I71 HydrophobicContact CE2-CG1 3.74Å; F33-I71 HydrophobicContact CZ-CG1 3.99Å; D38-I71 HydrophobicContact CB-CD1 3.74Å; D38-I71 HydrophobicContact CB-CG1 3.77Å; D38-I71 HydrophobicContact CB-CG2 4.46Å; I42-I71 HydrophobicContact CD1-CG2 3.6Å; I59-I71 HydrophobicContact CG2-CD1 4.23Å; R63-I71 HydrophobicContact CB-CD1 4.46Å; R63-I71 HydrophobicContact CG-CD1 3.93Å; Q67-I71 VanDerWaalsContact O-CG1 3.22Å; Q67-I71 WeakPolarHBondContact O-CG1 3.25Å; Q67-I71 PolarHBondContact O-N 3.43Å; R68-I71 PolarHBondContact O-N 3.26Å; Q69-I71 PolarHBondContact O-N 2.94Å; I71-F73 VanDerWaalsContact C-N 3.32Å; I71-F73 PolarHBondContact O-N 3.11Å; I71-A74 PolarHBondContact O-N 3.44Å; I71-Y75 VanDerWaalsContact O-CB 3.25Å; I71-Y75 WeakPolarHBondContact O-CB 3.47Å; I71-Y75 PolarHBondContact O-N 3.43Å; I71-L83 HydrophobicContact CG2-CD2 3.94Å
72	A	98.7	Very high	98.3	Very high	23 Å²	23	59 Å²	59	19%	0.19	28%	0.282	C	S	.	.	H	α-helix	trans	-60.7	-42.4	178.8	0	0	0	0	0	111.6	R68 Q69 D70 Y75 Q76 L83	R68-A72 WeakPolarHBondContact O-CB 3.41Å; R68-A72 PolarHBondContact O-N 3.45Å; Q69-A72 PolarHBondContact O-N 3.48Å; D70-A72 PolarHBondContact O-N 2.96Å; A72-Y75 PolarHBondContact O-N 3.05Å; A72-Q76 WeakPolarHBondContact O-CB 3.26Å; A72-Q76 PolarHBondContact O-N 3.2Å; A72-L83 HydrophobicContact CB-CB 4.2Å; A72-L83 HydrophobicContact CB-CD2 3.98Å
73	F	98.5	Very high	98.3	Very high	105 Å²	105	55.9 Å²	55.9	46%	0.461	27%	0.266	S	S	.	.	H	α-helix	trans	-65.2	-46.5	175.7	-177.9	-106.2	0	0	0	112.4	Q69 D70 I71 Y75 Q76 R77	Q69-F73 PolarHBondContact O-N 3.11Å; D70-F73 PolarHBondContact O-N 2.94Å; I71-F73 VanDerWaalsContact C-N 3.32Å; I71-F73 PolarHBondContact O-N 3.11Å; F73-Y75 VanDerWaalsContact C-N 3.34Å; F73-Y75 PolarHBondContact O-N 2.94Å; F73-Q76 PolarHBondContact O-N 3.35Å; F73-R77 VanDerWaalsContact CE1-CD 3.44Å; F73-R77 HydrophobicContact CE1-CG 4.19Å; F73-R77 HydrophobicContact CZ-CG 4.21Å; F73-R77 WeakPolarHBondContact O-CG 3.35Å; F73-R77 PolarHBondContact O-N 3.06Å
74	A	98.7	Very high	98.3	Very high	12 Å²	12	57.2 Å²	57.2	10%	0.099	28%	0.281	C	S	.	.	H	α-helix	trans	-61.5	-41.6	176.7	0	0	0	0	0	111.9	A35 E36 A39 D70 I71 R77 R78	A35-A74 HydrophobicContact CB-CB 4Å; E36-A74 HydrophobicContact CG-CB 4.47Å; A39-A74 HydrophobicContact CB-CB 3.98Å; D70-A74 WeakPolarHBondContact O-CB 3.42Å; D70-A74 PolarHBondContact O-N 2.85Å; I71-A74 PolarHBondContact O-N 3.44Å; A74-R77 PolarHBondContact O-N 3.49Å; A74-R78 WeakPolarHBondContact O-CB 3.39Å; A74-R78 PolarHBondContact O-N 2.81Å
75	Y	98.7	Very high	98.3	Very high	10 Å²	10	60 Å²	60	4%	0.039	30%	0.3	C	S	.	.	H	α-helix	trans	-61.1	-45.2	175.1	-172.5	-81.9	0	0	0	111.8	A39 I42 E43 I46 I71 A72 F73 R77 R78 T79 K81 L83 A86	A39-Y75 HydrophobicContact CB-CD2 4.44Å; I42-Y75 HydrophobicContact CG2-CE2 4.31Å; E43-Y75 HydrophobicContact CB-CD2 4.47Å; E43-Y75 HydrophobicContact CB-CE2 3.79Å; E43-Y75 HydrophobicContact CG-CE2 4.42Å; I46-Y75 HydrophobicContact CD1-CE2 4.34Å; I71-Y75 VanDerWaalsContact O-CB 3.25Å; I71-Y75 WeakPolarHBondContact O-CB 3.47Å; I71-Y75 PolarHBondContact O-N 3.43Å; A72-Y75 PolarHBondContact O-N 3.05Å; F73-Y75 VanDerWaalsContact C-N 3.34Å; F73-Y75 PolarHBondContact O-N 2.94Å; Y75-R77 PolarHBondContact O-N 3.03Å; Y75-R78 PolarHBondContact O-N 3.12Å; Y75-T79 HydrophobicContact CD1-CG2 4.2Å; Y75-T79 WeakPolarHBondContact CD1-OG1 3.48Å; Y75-T79 HydrophobicContact CD2-CG2 4.41Å; Y75-T79 HydrophobicContact CE1-CG2 3.91Å; Y75-T79 VanDerWaalsContact CE1-OG1 3.24Å; Y75-T79 WeakPolarHBondContact CE1-OG1 3.21Å; Y75-T79 HydrophobicContact CE2-CG2 4.16Å; Y75-T79 HydrophobicContact CG-CG2 4.44Å; Y75-T79 PolarHBondContact O-N 3.47Å; Y75-T79 PolarHBondContact O-OG1 3.32Å; Y75-K81 WeakPolarHBondContact CD1-O 3.13Å; Y75-K81 HydrophobicContact CE1-CB 4.49Å; Y75-L83 HydrophobicContact CD1-CB 3.82Å; Y75-L83 HydrophobicContact CD1-CD1 4.11Å; Y75-L83 HydrophobicContact CD2-CD1 3.72Å; Y75-L83 HydrophobicContact CE1-CB 4.47Å; Y75-L83 HydrophobicContact CE1-CD1 4.31Å; Y75-L83 HydrophobicContact CE2-CD1 3.92Å; Y75-L83 HydrophobicContact CG-CB 3.98Å; Y75-L83 HydrophobicContact CG-CD1 3.82Å; Y75-L83 HydrophobicContact CG-CG 4.38Å; Y75-A86 HydrophobicContact CE1-CB 4Å; Y75-A86 WeakPolarHBondContact OH-CB 3.48Å
76	Q	98.2	Very high	98.3	Very high	60 Å²	60	59.8 Å²	59.8	28%	0.28	30%	0.301	S	S	.	.	H	α-helix	trans	-62.6	-42.8	176.9	-166.9	-166.5	15.2	0	0	111.3	A72 F73 R78 K80 K81 E82	A72-Q76 WeakPolarHBondContact O-CB 3.26Å; A72-Q76 PolarHBondContact O-N 3.2Å; F73-Q76 PolarHBondContact O-N 3.35Å; Q76-R78 PolarHBondContact O-N 2.86Å; Q76-K80 WeakPolarHBondContact O-CA 3.46Å; Q76-K80 PolarHBondContact O-N 3.44Å; Q76-K81 WeakPolarHBondContact CA-O 3.49Å; Q76-E82 WeakPolarHBondContact CG-OE1 3.26Å; Q76-E82 PolarHBondContact NE2-OE1 3.19Å
77	R	98	Very high	98.3	Very high	158 Å²	158	56.9 Å²	56.9	60%	0.596	28%	0.277	S	S	*	.	H	α-helix	trans	-62.3	-41.5	176.2	-74.4	-169.9	67.6	-179	0.7	112.4	F73 A74 Y75 K80	F73-R77 VanDerWaalsContact CE1-CD 3.44Å; F73-R77 HydrophobicContact CE1-CG 4.19Å; F73-R77 HydrophobicContact CZ-CG 4.21Å; F73-R77 WeakPolarHBondContact O-CG 3.35Å; F73-R77 PolarHBondContact O-N 3.06Å; A74-R77 PolarHBondContact O-N 3.49Å; Y75-R77 PolarHBondContact O-N 3.03Å; R77-K80 PolarHBondContact O-NZ 2.94Å
78	R	97.7	Very high	98.3	Very high	103 Å²	103	62 Å²	62	39%	0.389	30%	0.299	S	S	.	.	H	α-helix	trans	-69.5	-51.9	179.7	-179.5	-177.5	-63.2	-72.8	1.1	112.4	E36 E43 A74 Y75 Q76	E36-R78 PolarHBondContact O-NH2 2.93Å; E43-R78 WeakPolarHBondContact OE2-CD 3.45Å; A74-R78 WeakPolarHBondContact O-CB 3.39Å; A74-R78 PolarHBondContact O-N 2.81Å; Y75-R78 PolarHBondContact O-N 3.12Å; Q76-R78 PolarHBondContact O-N 2.86Å
79	T	97	Very high	98.2	Very high	29 Å²	29	67 Å²	67	18%	0.178	33%	0.334	C	S	.	.	H	α-helix	trans	-100.7	-13.3	-166.4	68.8	0	0	0	0	114.4	E43 Y75 K81	E43-T79 VanDerWaalsContact CD-CG2 3.5Å; E43-T79 HydrophobicContact CG-CG2 4.12Å; Y75-T79 HydrophobicContact CD1-CG2 4.2Å; Y75-T79 WeakPolarHBondContact CD1-OG1 3.48Å; Y75-T79 HydrophobicContact CD2-CG2 4.41Å; Y75-T79 HydrophobicContact CE1-CG2 3.91Å; Y75-T79 VanDerWaalsContact CE1-OG1 3.24Å; Y75-T79 WeakPolarHBondContact CE1-OG1 3.21Å; Y75-T79 HydrophobicContact CE2-CG2 4.16Å; Y75-T79 HydrophobicContact CG-CG2 4.44Å; Y75-T79 PolarHBondContact O-N 3.47Å; Y75-T79 PolarHBondContact O-OG1 3.32Å; T79-K81 PolarHBondContact O-N 3.03Å; T79-K81 PolarHBondContact OG1-N 3.28Å; T79-K81 VanDerWaalsContact OG1-N 3.14Å; T79-K81 PolarHBondContact OG1-O 2.85Å
80	K	97.9	Very high	98.2	Very high	168 Å²	168	65.4 Å²	65.4	73%	0.73	33%	0.331	S	S	*	.	S	Bend	trans	59.1	21.4	-168.4	-47.7	-53.2	-178.1	-156.8	0	113.8	Q76 R77	Q76-K80 WeakPolarHBondContact O-CA 3.46Å; Q76-K80 PolarHBondContact O-N 3.44Å; R77-K80 PolarHBondContact O-NZ 2.94Å
81	K	97.6	Very high	98.2	Very high	142 Å²	142	62.1 Å²	62.1	62%	0.617	31%	0.313	S	S	*	.	S	Bend	trans	-124.3	148.2	176.6	-64.8	-178.7	178.8	-178.3	0	110.5	Y75 Q76 T79 L83	Y75-K81 WeakPolarHBondContact CD1-O 3.13Å; Y75-K81 HydrophobicContact CE1-CB 4.49Å; Q76-K81 WeakPolarHBondContact CA-O 3.49Å; T79-K81 PolarHBondContact O-N 3.03Å; T79-K81 PolarHBondContact OG1-N 3.28Å; T79-K81 VanDerWaalsContact OG1-N 3.14Å; T79-K81 PolarHBondContact OG1-O 2.85Å; K81-L83 PolarHBondContact O-N 2.87Å
82	E	98	Very high	98.1	Very high	91 Å²	91	66.5 Å²	66.5	43%	0.425	34%	0.344	S	S	.	.			trans	-68.6	128.7	172.8	-63.5	-51	126.9	0	0	111.2	Q76 A84 S85 A86	Q76-E82 WeakPolarHBondContact CG-OE1 3.26Å; Q76-E82 PolarHBondContact NE2-OE1 3.19Å; E82-A84 VanDerWaalsContact C-N 3.32Å; E82-A84 PolarHBondContact O-N 2.92Å; E82-S85 PolarHBondContact O-N 3.46Å; E82-A86 PolarHBondContact O-N 3.34Å
83	L	98.6	Very high	98.1	Very high	2 Å²	2	67.7 Å²	67.7	1%	0.01	36%	0.358	C	S	.	.	H	α-helix	trans	-57	-44.7	178.8	176	57.9	0	0	0	112	I42 I71 A72 Y75 K81 S85 A86 L87 L103	I42-L83 HydrophobicContact CG2-CD1 3.74Å; I71-L83 HydrophobicContact CG2-CD2 3.94Å; A72-L83 HydrophobicContact CB-CB 4.2Å; A72-L83 HydrophobicContact CB-CD2 3.98Å; Y75-L83 HydrophobicContact CD1-CB 3.82Å; Y75-L83 HydrophobicContact CD1-CD1 4.11Å; Y75-L83 HydrophobicContact CD2-CD1 3.72Å; Y75-L83 HydrophobicContact CE1-CB 4.47Å; Y75-L83 HydrophobicContact CE1-CD1 4.31Å; Y75-L83 HydrophobicContact CE2-CD1 3.92Å; Y75-L83 HydrophobicContact CG-CB 3.98Å; Y75-L83 HydrophobicContact CG-CD1 3.82Å; Y75-L83 HydrophobicContact CG-CG 4.38Å; K81-L83 PolarHBondContact O-N 2.87Å; L83-S85 VanDerWaalsContact C-N 3.3Å; L83-S85 PolarHBondContact O-N 2.77Å; L83-A86 PolarHBondContact O-N 3.03Å; L83-L87 HydrophobicContact CD1-CD1 3.58Å; L83-L87 HydrophobicContact CD1-CG 3.98Å; L83-L87 HydrophobicContact CG-CD1 3.86Å; L83-L87 PolarHBondContact O-N 3.2Å; L83-L103 HydrophobicContact CD2-CD2 3.88Å; L83-L103 HydrophobicContact CG-CD1 4.28Å; L83-L103 HydrophobicContact CG-CD2 4.49Å
84	A	98.3	Very high	98.1	Very high	45 Å²	45	66.8 Å²	66.8	37%	0.372	36%	0.355	S	S	.	.	H	α-helix	trans	-61.8	-38.8	-179.6	0	0	0	0	0	112.1	E82 K88 L100 L103	E82-A84 VanDerWaalsContact C-N 3.32Å; E82-A84 PolarHBondContact O-N 2.92Å; A84-K88 VanDerWaalsContact O-CB 3.23Å; A84-K88 WeakPolarHBondContact O-CB 3.5Å; A84-K88 PolarHBondContact O-N 2.98Å; A84-L100 HydrophobicContact CB-CD2 4.32Å; A84-L100 VanDerWaalsContact O-CD2 3.3Å; A84-L100 WeakPolarHBondContact O-CD2 3.4Å; A84-L103 HydrophobicContact CB-CD1 4.19Å
85	S	98.2	Very high	98	Very high	72 Å²	72	67 Å²	67	50%	0.503	36%	0.355	S	S	.	.	H	α-helix	trans	-70.7	-39.6	177.9	-62.9	0	0	0	0	111.7	E82 L83 K88 S89	E82-S85 PolarHBondContact O-N 3.46Å; L83-S85 VanDerWaalsContact C-N 3.3Å; L83-S85 PolarHBondContact O-N 2.77Å; S85-K88 PolarHBondContact O-N 3.04Å; S85-S89 PolarHBondContact O-N 3.48Å; S85-S89 VanDerWaalsContact O-N 3.13Å; S85-S89 PolarHBondContact O-OG 2.89Å
86	A	98.4	Very high	98	Very high	15 Å²	15	68.7 Å²	68.7	12%	0.124	36%	0.363	C	S	.	.	H	α-helix	trans	-61.9	-48.4	176.3	0	0	0	0	0	111.4	I46 Y75 E82 L83 S89 A90	I46-A86 HydrophobicContact CD1-CB 4.1Å; Y75-A86 HydrophobicContact CE1-CB 4Å; Y75-A86 WeakPolarHBondContact OH-CB 3.48Å; E82-A86 PolarHBondContact O-N 3.34Å; L83-A86 PolarHBondContact O-N 3.03Å; A86-S89 PolarHBondContact O-N 3.29Å; A86-S89 VanDerWaalsContact O-N 3.14Å; A86-A90 PolarHBondContact O-N 3.33Å; A86-A90 VanDerWaalsContact O-N 3.1Å
87	L	98.5	Very high	98	Very high	0 Å²	0	69 Å²	69	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-67.1	-36.8	177.5	-75.4	167.7	0	0	0	112.7	I42 I46 I56 L60 L83 S89 A90 L91 I99 L103	I42-L87 HydrophobicContact CG2-CD2 4.34Å; I46-L87 HydrophobicContact CD1-CD2 3.78Å; I46-L87 HydrophobicContact CD1-CG 4.02Å; I46-L87 HydrophobicContact CG1-CD2 4.01Å; I56-L87 HydrophobicContact CD1-CD2 3.8Å; I56-L87 HydrophobicContact CG1-CD2 4.2Å; I56-L87 HydrophobicContact CG2-CD2 3.65Å; L60-L87 HydrophobicContact CD1-CD1 3.86Å; L83-L87 HydrophobicContact CD1-CD1 3.58Å; L83-L87 HydrophobicContact CD1-CG 3.98Å; L83-L87 HydrophobicContact CG-CD1 3.86Å; L83-L87 PolarHBondContact O-N 3.2Å; L87-S89 PolarHBondContact O-N 3.1Å; L87-A90 PolarHBondContact O-N 3.3Å; L87-A90 VanDerWaalsContact O-N 3.16Å; L87-L91 HydrophobicContact CB-CD1 4.41Å; L87-L91 HydrophobicContact CD2-CD1 4.08Å; L87-L91 HydrophobicContact CD2-CG 4.43Å; L87-L91 WeakPolarHBondContact O-CB 3.32Å; L87-L91 WeakPolarHBondContact O-CG 3.34Å; L87-L91 PolarHBondContact O-N 2.98Å; L87-I99 HydrophobicContact CB-CG2 4.42Å; L87-I99 HydrophobicContact CD1-CG2 3.83Å; L87-L103 HydrophobicContact CD1-CD1 3.71Å
88	K	98.1	Very high	98.1	Very high	126 Å²	126	61.5 Å²	61.5	55%	0.548	34%	0.341	S	S	.	.	H	α-helix	trans	-58.8	-30.9	171.8	-175.9	173.1	-176.1	-176.1	0	112.9	A84 S85 L100	A84-K88 VanDerWaalsContact O-CB 3.23Å; A84-K88 WeakPolarHBondContact O-CB 3.5Å; A84-K88 PolarHBondContact O-N 2.98Å; S85-K88 PolarHBondContact O-N 3.04Å; K88-L100 HydrophobicContact CB-CD1 3.99Å; K88-L100 HydrophobicContact CB-CD2 4.21Å; K88-L100 HydrophobicContact CD-CD1 4.25Å; K88-L100 HydrophobicContact CG-CD1 4.05Å
89	S	97.8	Very high	98.1	Very high	108 Å²	108	56.6 Å²	56.6	76%	0.755	32%	0.322	S	S	*	.	H	α-helix	trans	-84.5	-25.1	179.4	-51.8	0	0	0	0	112.4	S85 A86 L87	S85-S89 PolarHBondContact O-N 3.48Å; S85-S89 VanDerWaalsContact O-N 3.13Å; S85-S89 PolarHBondContact O-OG 2.89Å; A86-S89 PolarHBondContact O-N 3.29Å; A86-S89 VanDerWaalsContact O-N 3.14Å; L87-S89 PolarHBondContact O-N 3.1Å
90	A	97.7	Very high	98.2	Very high	24 Å²	24	56.4 Å²	56.4	20%	0.198	32%	0.32	C	S	.	.	H	α-helix	trans	-91.6	-30.7	-176.5	0	0	0	0	0	113.1	I46 V51 A86 L87	I46-A90 HydrophobicContact CG1-CB 4.17Å; I46-A90 HydrophobicContact CG2-CB 4.01Å; V51-A90 HydrophobicContact CG1-CB 4.36Å; V51-A90 HydrophobicContact CG2-CB 4.15Å; A86-A90 PolarHBondContact O-N 3.33Å; A86-A90 VanDerWaalsContact O-N 3.1Å; L87-A90 PolarHBondContact O-N 3.3Å; L87-A90 VanDerWaalsContact O-N 3.16Å
91	L	98	Very high	98.2	Very high	12 Å²	12	48.6 Å²	48.6	6%	0.063	29%	0.287	C	S	.	.			trans	-105.4	166.2	-176.6	-55.4	179.3	0	0	0	110.8	V51 E53 I56 L87 L95 E96 I99	V51-L91 HydrophobicContact CG1-CD2 4.29Å; E53-L91 HydrophobicContact CG-CD2 3.85Å; I56-L91 HydrophobicContact CD1-CD2 4.18Å; I56-L91 HydrophobicContact CG2-CD1 4.4Å; L87-L91 HydrophobicContact CB-CD1 4.41Å; L87-L91 HydrophobicContact CD2-CD1 4.08Å; L87-L91 HydrophobicContact CD2-CG 4.43Å; L87-L91 WeakPolarHBondContact O-CB 3.32Å; L87-L91 WeakPolarHBondContact O-CG 3.34Å; L87-L91 PolarHBondContact O-N 2.98Å; L91-L95 HydrophobicContact CD1-CG 4.47Å; L91-L95 HydrophobicContact CD2-CD2 4.06Å; L91-E96 HydrophobicContact CB-CB 3.96Å; L91-E96 HydrophobicContact CB-CG 4.36Å; L91-I99 HydrophobicContact CD1-CB 3.8Å; L91-I99 HydrophobicContact CD1-CG1 3.74Å; L91-I99 HydrophobicContact CD1-CG2 3.82Å
92	S	97.5	Very high	98.3	Very high	91 Å²	91	41.9 Å²	41.9	64%	0.636	26%	0.258	S	S	*	.			trans	-144.9	166.8	172.4	64.4	0	0	0	0	112.3	E96	S92-E96 WeakPolarHBondContact CA-OE2 3.19Å; S92-E96 PolarHBondContact O-N 3.27Å
93	G	97.9	Very high	98.3	Very high	48 Å²	48	38.1 Å²	38.1	50%	0.495	24%	0.241	S	C	.	.	H	α-helix	trans	64.6	-144.8	170.2	0	0	0	0	0	114.9	L95 E96 T97	G93-L95 VanDerWaalsContact C-N 3.3Å; G93-L95 PolarHBondContact O-N 3.04Å; G93-E96 WeakPolarHBondContact O-CB 3.29Å; G93-E96 PolarHBondContact O-N 3.45Å; G93-T97 PolarHBondContact O-N 3.21Å; G93-T97 VanDerWaalsContact O-N 3.15Å; G93-T97 PolarHBondContact O-OG1 3.41Å; G93-T97 VanDerWaalsContact O-OG1 3.08Å
94	H	98.3	Very high	98.3	Very high	86 Å²	86	41 Å²	41	40%	0.398	25%	0.253	S	S	.	.	H	α-helix	trans	-66.4	-32.3	-177.8	-61.6	-55.8	0	0	0	112.7	T97 V98 D285 I289 Y327	H94-T97 WeakPolarHBondContact O-CB 3.29Å; H94-T97 PolarHBondContact O-N 2.82Å; H94-V98 WeakPolarHBondContact O-CG2 3.36Å; H94-V98 PolarHBondContact O-N 3.42Å; H94-D285 VanDerWaalsContact CE1-CB 3.46Å; H94-D285 WeakPolarHBondContact CE1-CB 3.32Å; H94-D285 VanDerWaalsContact CE1-CG 3.45Å; H94-D285 IonicContact CE1-OD2 3.8Å; H94-D285 IonicContact NE2-OD2 2.78Å; H94-I289 HydrophobicContact CB-CD1 4.16Å; H94-Y327 HydrophobicContact CB-CD1 3.67Å; H94-Y327 HydrophobicContact CB-CD2 3.72Å; H94-Y327 HydrophobicContact CB-CE1 3.82Å; H94-Y327 HydrophobicContact CB-CE2 3.88Å; H94-Y327 HydrophobicContact CB-CG 3.62Å
95	L	98.5	Very high	98.3	Very high	17 Å²	17	40.5 Å²	40.5	9%	0.089	25%	0.246	C	C	.	.	H	α-helix	trans	-62.7	-47.7	174.4	177.1	63.4	0	0	0	111.1	E53 V57 L91 G93 T97 V98 I99 D326 A330	E53-L95 HydrophobicContact CB-CD2 3.94Å; E53-L95 HydrophobicContact CG-CD2 3.75Å; V57-L95 HydrophobicContact CG2-CD1 3.59Å; L91-L95 HydrophobicContact CD1-CG 4.47Å; L91-L95 HydrophobicContact CD2-CD2 4.06Å; G93-L95 VanDerWaalsContact C-N 3.3Å; G93-L95 PolarHBondContact O-N 3.04Å; L95-T97 PolarHBondContact O-N 3.38Å; L95-V98 PolarHBondContact O-N 2.97Å; L95-I99 HydrophobicContact CD1-CD1 4.41Å; L95-I99 HydrophobicContact CD1-CG1 3.92Å; L95-I99 HydrophobicContact CG-CG1 4.37Å; L95-I99 WeakPolarHBondContact O-CG1 3.4Å; L95-I99 PolarHBondContact O-N 3.31Å; L95-D326 HydrophobicContact CD1-CB 4.46Å; L95-D326 HydrophobicContact CD2-CB 3.91Å; L95-A330 HydrophobicContact CD1-CB 4.29Å
96	E	98.6	Very high	98.4	Very high	45 Å²	45	41.1 Å²	41.1	21%	0.21	25%	0.248	C	C	.	.	H	α-helix	trans	-53.9	-45.8	173.8	-176	-165.4	139.3	0	0	110.6	L91 S92 G93 V98 I99 L100	L91-E96 HydrophobicContact CB-CB 3.96Å; L91-E96 HydrophobicContact CB-CG 4.36Å; S92-E96 WeakPolarHBondContact CA-OE2 3.19Å; S92-E96 PolarHBondContact O-N 3.27Å; G93-E96 WeakPolarHBondContact O-CB 3.29Å; G93-E96 PolarHBondContact O-N 3.45Å; E96-V98 PolarHBondContact O-N 3.36Å; E96-I99 PolarHBondContact O-N 3.48Å; E96-L100 HydrophobicContact CG-CD1 3.71Å; E96-L100 HydrophobicContact CG-CG 4.11Å; E96-L100 WeakPolarHBondContact O-CB 3.14Å; E96-L100 VanDerWaalsContact O-CG 3.26Å; E96-L100 WeakPolarHBondContact O-CG 3.09Å; E96-L100 PolarHBondContact O-N 2.62Å
97	T	98.5	Very high	98.4	Very high	67 Å²	67	40.8 Å²	40.8	41%	0.411	25%	0.245	S	C	.	.	H	α-helix	trans	-60.7	-45.7	-179.3	-53.4	0	0	0	0	112	G93 H94 L95 G101 I289	G93-T97 PolarHBondContact O-N 3.21Å; G93-T97 VanDerWaalsContact O-N 3.15Å; G93-T97 PolarHBondContact O-OG1 3.41Å; G93-T97 VanDerWaalsContact O-OG1 3.08Å; H94-T97 WeakPolarHBondContact O-CB 3.29Å; H94-T97 PolarHBondContact O-N 2.82Å; L95-T97 PolarHBondContact O-N 3.38Å; T97-G101 PolarHBondContact O-N 2.87Å; T97-I289 HydrophobicContact CG2-CD1 3.99Å; T97-I289 HydrophobicContact CG2-CG2 4.18Å
98	V	98.7	Very high	98.4	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.1	-51.7	176.5	173.5	0	0	0	0	110.9	H94 L95 E96 L100 G101 L102 I289 V293 Y327 A330 L331 L334	H94-V98 WeakPolarHBondContact O-CG2 3.36Å; H94-V98 PolarHBondContact O-N 3.42Å; L95-V98 PolarHBondContact O-N 2.97Å; E96-V98 PolarHBondContact O-N 3.36Å; V98-L100 PolarHBondContact O-N 3.25Å; V98-G101 PolarHBondContact O-N 2.72Å; V98-G101 VanDerWaalsContact O-N 3.16Å; V98-L102 HydrophobicContact CG1-CD1 3.93Å; V98-L102 HydrophobicContact CG1-CG 4.38Å; V98-L102 WeakPolarHBondContact O-CG 3.43Å; V98-L102 PolarHBondContact O-N 3.49Å; V98-I289 HydrophobicContact CG2-CB 4.35Å; V98-I289 HydrophobicContact CG2-CD1 3.96Å; V98-I289 HydrophobicContact CG2-CG1 3.7Å; V98-I289 HydrophobicContact CG2-CG2 3.82Å; V98-V293 HydrophobicContact CG1-CG2 4.48Å; V98-Y327 HydrophobicContact CG2-CD2 3.8Å; V98-Y327 HydrophobicContact CG2-CE2 3.68Å; V98-A330 HydrophobicContact CG1-CB 4.01Å; V98-L331 HydrophobicContact CG2-CD2 4.01Å; V98-L334 HydrophobicContact CG1-CD1 4.13Å
99	I	98.7	Very high	98.4	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.8	-44.5	-174.7	-65.2	-58.4	0	0	0	111.2	I56 V57 L60 L87 L91 L95 E96 G101 L102 L103	I56-I99 HydrophobicContact CG2-CD1 4.45Å; I56-I99 HydrophobicContact CG2-CG2 4.48Å; V57-I99 HydrophobicContact CG2-CD1 4.35Å; L60-I99 HydrophobicContact CB-CD1 4.4Å; L60-I99 HydrophobicContact CD1-CD1 4.31Å; L60-I99 HydrophobicContact CD1-CG2 3.65Å; L87-I99 HydrophobicContact CB-CG2 4.42Å; L87-I99 HydrophobicContact CD1-CG2 3.83Å; L91-I99 HydrophobicContact CD1-CB 3.8Å; L91-I99 HydrophobicContact CD1-CG1 3.74Å; L91-I99 HydrophobicContact CD1-CG2 3.82Å; L95-I99 HydrophobicContact CD1-CD1 4.41Å; L95-I99 HydrophobicContact CD1-CG1 3.92Å; L95-I99 HydrophobicContact CG-CG1 4.37Å; L95-I99 WeakPolarHBondContact O-CG1 3.4Å; L95-I99 PolarHBondContact O-N 3.31Å; E96-I99 PolarHBondContact O-N 3.48Å; I99-G101 VanDerWaalsContact C-N 3.25Å; I99-G101 PolarHBondContact O-N 3.23Å; I99-L102 HydrophobicContact CD1-CD1 4.37Å; I99-L102 PolarHBondContact O-N 2.9Å; I99-L103 WeakPolarHBondContact O-CG 3.27Å; I99-L103 PolarHBondContact O-N 3.43Å
100	L	98.7	Very high	98.5	Very high	26 Å²	26	33.8 Å²	33.8	14%	0.136	20%	0.202	C	C	.	.	H	α-helix	trans	-68.3	-24.7	176.6	-64.5	-175	0	0	0	113.1	A84 K88 E96 V98 L103 K104	A84-L100 HydrophobicContact CB-CD2 4.32Å; A84-L100 VanDerWaalsContact O-CD2 3.3Å; A84-L100 WeakPolarHBondContact O-CD2 3.4Å; K88-L100 HydrophobicContact CB-CD1 3.99Å; K88-L100 HydrophobicContact CB-CD2 4.21Å; K88-L100 HydrophobicContact CD-CD1 4.25Å; K88-L100 HydrophobicContact CG-CD1 4.05Å; E96-L100 HydrophobicContact CG-CD1 3.71Å; E96-L100 HydrophobicContact CG-CG 4.11Å; E96-L100 WeakPolarHBondContact O-CB 3.14Å; E96-L100 VanDerWaalsContact O-CG 3.26Å; E96-L100 WeakPolarHBondContact O-CG 3.09Å; E96-L100 PolarHBondContact O-N 2.62Å; V98-L100 PolarHBondContact O-N 3.25Å; L100-L103 HydrophobicContact CD2-CD1 4.48Å; L100-K104 PolarHBondContact O-NZ 2.95Å
101	G	98.7	Very high	98.5	Very high	3 Å²	3	32.7 Å²	32.7	3%	0.031	19%	0.193	C	C	.	.	H	α-helix	trans	-68.4	-50.2	169.4	0	0	0	0	0	111.5	T97 V98 I99 L103 K104	T97-G101 PolarHBondContact O-N 2.87Å; V98-G101 PolarHBondContact O-N 2.72Å; V98-G101 VanDerWaalsContact O-N 3.16Å; I99-G101 VanDerWaalsContact C-N 3.25Å; I99-G101 PolarHBondContact O-N 3.23Å; G101-L103 PolarHBondContact O-N 3.44Å; G101-K104 PolarHBondContact O-N 3.5Å
102	L	98.7	Very high	98.5	Very high	1 Å²	1	33 Å²	33	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-60.4	-29.4	-178.2	-71.7	171.2	0	0	0	113.9	T61 N65 R68 V98 I99 V293 L334	T61-L102 HydrophobicContact CG2-CD1 3.95Å; N65-L102 PolarHBondContact ND2-O 2.9Å; R68-L102 WeakPolarHBondContact CD-O 3.46Å; R68-L102 PolarHBondContact NH1-O 2.97Å; V98-L102 HydrophobicContact CG1-CD1 3.93Å; V98-L102 HydrophobicContact CG1-CG 4.38Å; V98-L102 WeakPolarHBondContact O-CG 3.43Å; V98-L102 PolarHBondContact O-N 3.49Å; I99-L102 HydrophobicContact CD1-CD1 4.37Å; I99-L102 PolarHBondContact O-N 2.9Å; L102-V293 HydrophobicContact CD2-CG1 4.14Å; L102-V293 HydrophobicContact CD2-CG2 4.13Å; L102-V293 HydrophobicContact CG-CG2 4.21Å; L102-L334 HydrophobicContact CD1-CD1 4.32Å; L102-L334 HydrophobicContact CD1-CD2 4.18Å; L102-L334 HydrophobicContact CD2-CD1 4.04Å; L102-L334 HydrophobicContact CD2-CD2 3.67Å
103	L	98.7	Very high	98.6	Very high	13 Å²	13	29.9 Å²	29.9	7%	0.068	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-21	179.9	-68.1	175.6	0	0	0	114.4	L60 R68 Q69 L83 A84 L87 I99 L100 G101	L60-L103 HydrophobicContact CD1-CD2 4.15Å; L60-L103 HydrophobicContact CD2-CD2 4.01Å; R68-L103 HydrophobicContact CB-CD2 4.47Å; Q69-L103 PolarHBondContact NE2-O 3.32Å; L83-L103 HydrophobicContact CD2-CD2 3.88Å; L83-L103 HydrophobicContact CG-CD1 4.28Å; L83-L103 HydrophobicContact CG-CD2 4.49Å; A84-L103 HydrophobicContact CB-CD1 4.19Å; L87-L103 HydrophobicContact CD1-CD1 3.71Å; I99-L103 WeakPolarHBondContact O-CG 3.27Å; I99-L103 PolarHBondContact O-N 3.43Å; L100-L103 HydrophobicContact CD2-CD1 4.48Å; G101-L103 PolarHBondContact O-N 3.44Å
104	K	98.6	Very high	98.6	Very high	62 Å²	62	27.6 Å²	27.6	27%	0.27	15%	0.148	S	C	.	.	S	Bend	trans	-76.9	149.5	176	-69.3	-175.6	-170.4	70.8	0	109.6	N65 L100 G101 Q108 Y109	N65-K104 PolarHBondContact ND2-O 3.32Å; L100-K104 PolarHBondContact O-NZ 2.95Å; G101-K104 PolarHBondContact O-N 3.5Å; K104-Q108 HydrophobicContact CB-CB 3.88Å; K104-Q108 HydrophobicContact CD-CB 4.43Å; K104-Q108 HydrophobicContact CG-CB 4.36Å; K104-Y109 HydrophobicContact CD-CD2 4.38Å
105	T	98.6	Very high	98.6	Very high	35 Å²	35	26.1 Å²	26.1	22%	0.215	14%	0.141	C	C	.	.			trans	-61.5	158.4	165	70.2	0	0	0	0	110.1	N65 Q69 A107 Q108 Y109	N65-T105 WeakPolarHBondContact OD1-CA 3.49Å; Q69-T105 HydrophobicContact CG-CG2 4.2Å; T105-A107 VanDerWaalsContact C-N 3.26Å; T105-A107 PolarHBondContact O-N 3.45Å; T105-Q108 PolarHBondContact O-N 2.83Å; T105-Q108 VanDerWaalsContact O-N 3.09Å; T105-Q108 WeakPolarHBondContact OG1-CB 3.49Å; T105-Q108 VanDerWaalsContact OG1-CG 3.24Å; T105-Q108 WeakPolarHBondContact OG1-CG 3.32Å; T105-Q108 PolarHBondContact OG1-N 3.35Å; T105-Q108 PolarHBondContact OG1-OE1 2.85Å; T105-Y109 PolarHBondContact O-N 2.67Å
106	P	98.6	Very high	98.6	Very high	84 Å²	84	27.7 Å²	27.7	55%	0.545	16%	0.156	S	C	.	.	H	α-helix	trans	-51.7	-45	-179.9	-29.3	36.4	0	0	0	113.1	Y109 D110	P106-Y109 PolarHBondContact O-N 2.74Å; P106-D110 PolarHBondContact O-N 2.96Å
107	A	98.7	Very high	98.5	Very high	9 Å²	9	25.6 Å²	25.6	7%	0.074	15%	0.146	C	C	.	.	H	α-helix	trans	-70.8	-36	178.7	0	0	0	0	0	113.8	T105 Y109 A111 E142 I143 V146	T105-A107 VanDerWaalsContact C-N 3.26Å; T105-A107 PolarHBondContact O-N 3.45Å; A107-Y109 VanDerWaalsContact C-N 3.3Å; A107-A111 WeakPolarHBondContact O-CB 3.47Å; A107-A111 PolarHBondContact O-N 3.31Å; A107-E142 HydrophobicContact CB-CB 4.36Å; A107-E142 HydrophobicContact CB-CG 3.5Å; A107-I143 HydrophobicContact CB-CG1 4.34Å; A107-V146 HydrophobicContact CB-CB 4.21Å; A107-V146 HydrophobicContact CB-CG2 3.88Å
108	Q	98.7	Very high	98.5	Very high	70 Å²	70	22.8 Å²	22.8	33%	0.327	13%	0.129	S	C	.	.	H	α-helix	trans	-64.8	-38.1	172.1	-75.8	172.4	-17.1	0	0	111.5	K104 T105 S112 V146 M150	K104-Q108 HydrophobicContact CB-CB 3.88Å; K104-Q108 HydrophobicContact CD-CB 4.43Å; K104-Q108 HydrophobicContact CG-CB 4.36Å; T105-Q108 PolarHBondContact O-N 2.83Å; T105-Q108 VanDerWaalsContact O-N 3.09Å; T105-Q108 WeakPolarHBondContact OG1-CB 3.49Å; T105-Q108 VanDerWaalsContact OG1-CG 3.24Å; T105-Q108 WeakPolarHBondContact OG1-CG 3.32Å; T105-Q108 PolarHBondContact OG1-N 3.35Å; T105-Q108 PolarHBondContact OG1-OE1 2.85Å; Q108-S112 WeakPolarHBondContact O-CB 3.46Å; Q108-S112 PolarHBondContact O-N 3.17Å; Q108-S112 PolarHBondContact O-OG 2.97Å; Q108-V146 HydrophobicContact CB-CG1 4.26Å; Q108-V146 HydrophobicContact CG-CG1 3.65Å; Q108-M150 HydrophobicContact CB-SD 4.2Å; Q108-M150 HydrophobicContact CG-SD 4.06Å
109	Y	98.8	Very high	98.2	Very high	9 Å²	9	30.8 Å²	30.8	4%	0.035	16%	0.163	C	C	.	.	H	α-helix	trans	-64.4	-54.1	177.6	-173	-124.5	0	0	0	110.5	K104 T105 P106 A107 A111 S112 E113 R290 V293	K104-Y109 HydrophobicContact CD-CD2 4.38Å; T105-Y109 PolarHBondContact O-N 2.67Å; P106-Y109 PolarHBondContact O-N 2.74Å; A107-Y109 VanDerWaalsContact C-N 3.3Å; Y109-A111 PolarHBondContact O-N 3.16Å; Y109-S112 PolarHBondContact O-N 2.83Å; Y109-S112 VanDerWaalsContact O-N 3.07Å; Y109-S112 PolarHBondContact O-OG 2.97Å; Y109-E113 HydrophobicContact CE1-CG 4.4Å; Y109-E113 HydrophobicContact CE2-CG 4.13Å; Y109-E113 PolarHBondContact O-N 3.49Å; Y109-R290 HydrophobicContact CE1-CG 4.08Å; Y109-R290 VanDerWaalsContact OH-CA 3.25Å; Y109-R290 WeakPolarHBondContact OH-CA 3.35Å; Y109-V293 HydrophobicContact CD1-CG1 3.85Å; Y109-V293 HydrophobicContact CE1-CB 3.86Å; Y109-V293 HydrophobicContact CE1-CG1 3.61Å; Y109-V293 HydrophobicContact CG-CG1 4.41Å
110	D	98.8	Very high	97.8	Very high	8 Å²	8	33.8 Å²	33.8	4%	0.043	19%	0.194	C	C	.	.	H	α-helix	trans	-61.6	-42	178.4	-73.6	-19.2	0	0	0	112.6	P106 S112 E113 L114 I131 R135 I143	P106-D110 PolarHBondContact O-N 2.96Å; D110-S112 VanDerWaalsContact C-N 3.27Å; D110-S112 PolarHBondContact O-N 3.2Å; D110-E113 PolarHBondContact O-N 3.5Å; D110-L114 WeakPolarHBondContact O-CB 3.5Å; D110-L114 WeakPolarHBondContact O-CG 3.46Å; D110-L114 PolarHBondContact O-N 3.21Å; D110-I131 HydrophobicContact CB-CG2 4.29Å; D110-R135 IonicContact OD1-CZ 2.65Å; D110-R135 IonicContact OD1-NE 3.52Å; D110-R135 IonicContact OD1-NH2 3.55Å; D110-R135 PolarHBondContact OD1-NH2 3.18Å; D110-R135 IonicContact OD2-CZ 2.91Å; D110-R135 IonicContact OD2-NE 2.73Å; D110-R135 PolarHBondContact OD2-NE 2.89Å; D110-R135 IonicContact OD2-NH2 2.78Å; D110-R135 PolarHBondContact OD2-NH2 3.29Å; D110-I143 HydrophobicContact CB-CD1 3.64Å; D110-I143 HydrophobicContact CB-CG1 3.82Å
111	A	98.8	Very high	97.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.2	-37.3	174.9	0	0	0	0	0	111.8	A107 Y109 K115 V146 Y147 M150 Y151	A107-A111 WeakPolarHBondContact O-CB 3.47Å; A107-A111 PolarHBondContact O-N 3.31Å; Y109-A111 PolarHBondContact O-N 3.16Å; A111-K115 WeakPolarHBondContact O-CB 3.43Å; A111-K115 PolarHBondContact O-N 3.48Å; A111-V146 HydrophobicContact CB-CG1 4.23Å; A111-Y147 HydrophobicContact CB-CD2 3.89Å; A111-Y147 HydrophobicContact CB-CG 4.45Å; A111-Y147 WeakPolarHBondContact O-CE2 3.33Å; A111-M150 HydrophobicContact CB-SD 4.12Å; A111-Y151 HydrophobicContact CB-CE2 4.43Å
112	S	98.6	Very high	96.6	Very high	19 Å²	19	44 Å²	44	13%	0.133	26%	0.261	C	S	.	.	H	α-helix	trans	-70.5	-37.1	175.3	72.7	0	0	0	0	113.8	Q108 Y109 D110 K115 A116 Y151	Q108-S112 WeakPolarHBondContact O-CB 3.46Å; Q108-S112 PolarHBondContact O-N 3.17Å; Q108-S112 PolarHBondContact O-OG 2.97Å; Y109-S112 PolarHBondContact O-N 2.83Å; Y109-S112 VanDerWaalsContact O-N 3.07Å; Y109-S112 PolarHBondContact O-OG 2.97Å; D110-S112 VanDerWaalsContact C-N 3.27Å; D110-S112 PolarHBondContact O-N 3.2Å; S112-K115 PolarHBondContact O-N 3.37Å; S112-A116 VanDerWaalsContact O-CB 3.32Å; S112-A116 WeakPolarHBondContact O-CB 3.25Å; S112-A116 PolarHBondContact O-N 2.89Å; S112-Y151 VanDerWaalsContact CA-OH 3.26Å; S112-Y151 WeakPolarHBondContact CA-OH 3.49Å
113	E	98.7	Very high	96.4	Very high	26 Å²	26	45.2 Å²	45.2	12%	0.121	27%	0.268	C	S	.	.	H	α-helix	trans	-69.2	-41.6	175.2	-70.4	-65.8	118.7	0	0	111.5	Y109 D110 A116 S117 I131 R290	Y109-E113 HydrophobicContact CE1-CG 4.4Å; Y109-E113 HydrophobicContact CE2-CG 4.13Å; Y109-E113 PolarHBondContact O-N 3.49Å; D110-E113 PolarHBondContact O-N 3.5Å; E113-A116 PolarHBondContact O-N 2.68Å; E113-S117 PolarHBondContact O-N 2.86Å; E113-I131 HydrophobicContact CB-CD1 3.5Å; E113-R290 HydrophobicContact CG-CG 4.21Å; E113-R290 WeakPolarHBondContact OE2-CD 3.38Å; E113-R290 IonicContact OE2-NH1 2.77Å; E113-R290 PolarHBondContact OE2-NH1 3.02Å
114	L	98.6	Very high	96.3	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.8	-39.4	173.2	-72.8	169.7	0	0	0	111.9	D110 A116 S117 M118 L128 I131 I132 I143 Y147 L155	D110-L114 WeakPolarHBondContact O-CB 3.5Å; D110-L114 WeakPolarHBondContact O-CG 3.46Å; D110-L114 PolarHBondContact O-N 3.21Å; L114-A116 VanDerWaalsContact C-N 3.33Å; L114-S117 PolarHBondContact O-N 3.36Å; L114-S117 PolarHBondContact O-OG 3.41Å; L114-M118 VanDerWaalsContact O-CE 3.27Å; L114-M118 WeakPolarHBondContact O-CE 3.36Å; L114-M118 PolarHBondContact O-N 3.05Å; L114-L128 HydrophobicContact CD2-CD1 3.59Å; L114-I131 HydrophobicContact CD1-CG2 4.01Å; L114-I131 HydrophobicContact CD2-CB 4.01Å; L114-I131 HydrophobicContact CD2-CD1 4.1Å; L114-I131 HydrophobicContact CD2-CG2 4.03Å; L114-I131 HydrophobicContact CG-CB 4.39Å; L114-I131 HydrophobicContact CG-CD1 3.98Å; L114-I131 HydrophobicContact CG-CG2 3.99Å; L114-I132 HydrophobicContact CD1-CD1 4.18Å; L114-I132 HydrophobicContact CD2-CD1 4Å; L114-I132 HydrophobicContact CD2-CG1 4.04Å; L114-I143 HydrophobicContact CD1-CG2 3.64Å; L114-Y147 HydrophobicContact CB-CE2 4.12Å; L114-L155 HydrophobicContact CB-CD1 4.22Å; L114-L155 HydrophobicContact CD1-CD1 4.07Å; L114-L155 HydrophobicContact CD1-CD2 3.83Å
115	K	98.3	Very high	96.2	Very high	55 Å²	55	46.6 Å²	46.6	24%	0.239	28%	0.277	C	S	.	.	H	α-helix	trans	-65.8	-40.9	174.5	-171.8	63.8	176.7	168.4	0	110.8	A111 S112 S117 M118 K119 Y147 Y151 D158	A111-K115 WeakPolarHBondContact O-CB 3.43Å; A111-K115 PolarHBondContact O-N 3.48Å; S112-K115 PolarHBondContact O-N 3.37Å; K115-S117 VanDerWaalsContact C-N 3.3Å; K115-S117 PolarHBondContact O-N 2.93Å; K115-M118 PolarHBondContact O-N 3.46Å; K115-K119 VanDerWaalsContact O-CB 3.27Å; K115-K119 WeakPolarHBondContact O-CB 3.5Å; K115-K119 PolarHBondContact O-N 3.48Å; K115-Y147 HydrophobicContact CB-CE2 3.97Å; K115-Y147 HydrophobicContact CD-CE2 4.37Å; K115-Y147 WeakPolarHBondContact CD-OH 3.45Å; K115-Y151 HydrophobicContact CB-CD2 4.2Å; K115-Y151 HydrophobicContact CB-CE1 4.15Å; K115-Y151 HydrophobicContact CB-CE2 3.6Å; K115-Y151 HydrophobicContact CD-CD1 4.27Å; K115-Y151 HydrophobicContact CD-CD2 4.2Å; K115-Y151 HydrophobicContact CD-CE1 4.49Å; K115-Y151 HydrophobicContact CD-CE2 4.43Å; K115-Y151 HydrophobicContact CD-CG 4.12Å; K115-Y151 HydrophobicContact CG-CD1 4.01Å; K115-Y151 HydrophobicContact CG-CD2 4.21Å; K115-Y151 HydrophobicContact CG-CE1 3.76Å; K115-Y151 HydrophobicContact CG-CE2 3.97Å; K115-Y151 HydrophobicContact CG-CG 4.24Å; K115-D158 IonicContact NZ-OD2 3.79Å; K115-D158 PolarHBondContact NZ-OD2 3.3Å
116	A	97.5	Very high	96.1	Very high	49 Å²	49	47 Å²	47	41%	0.405	28%	0.278	S	S	.	.	H	α-helix	trans	-66.3	-31.4	177.3	0	0	0	0	0	112.6	S112 E113 L114 M118	S112-A116 VanDerWaalsContact O-CB 3.32Å; S112-A116 WeakPolarHBondContact O-CB 3.25Å; S112-A116 PolarHBondContact O-N 2.89Å; E113-A116 PolarHBondContact O-N 2.68Å; L114-A116 VanDerWaalsContact C-N 3.33Å; A116-M118 VanDerWaalsContact C-N 3.3Å; A116-M118 PolarHBondContact O-N 3.1Å
117	S	97.5	Very high	96.1	Very high	1 Å²	1	43 Å²	43	1%	0.007	25%	0.252	C	S	.	.	H	α-helix	trans	-74.8	-17.4	178.1	71.2	0	0	0	0	114.1	E113 L114 K115 T123 D124	E113-S117 PolarHBondContact O-N 2.86Å; L114-S117 PolarHBondContact O-N 3.36Å; L114-S117 PolarHBondContact O-OG 3.41Å; K115-S117 VanDerWaalsContact C-N 3.3Å; K115-S117 PolarHBondContact O-N 2.93Å; S117-T123 WeakPolarHBondContact O-CA 3.32Å; S117-T123 WeakPolarHBondContact O-CG2 3.14Å; S117-D124 PolarHBondContact O-N 3.33Å
118	M	97.3	Very high	96.1	Very high	9 Å²	9	42.6 Å²	42.6	4%	0.044	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.9	22.4	179.6	-60.2	-178.9	-67.5	0	0	111.9	L114 K115 A116 T123 L128 Y147 L155 D158 I159 D162	L114-M118 VanDerWaalsContact O-CE 3.27Å; L114-M118 WeakPolarHBondContact O-CE 3.36Å; L114-M118 PolarHBondContact O-N 3.05Å; K115-M118 PolarHBondContact O-N 3.46Å; A116-M118 VanDerWaalsContact C-N 3.3Å; A116-M118 PolarHBondContact O-N 3.1Å; M118-T123 HydrophobicContact CG-CG2 4.41Å; M118-L128 HydrophobicContact SD-CD1 4.5Å; M118-Y147 HydrophobicContact CE-CE2 4.48Å; M118-Y147 WeakPolarHBondContact CE-OH 3.23Å; M118-L155 HydrophobicContact CE-CD1 3.7Å; M118-D158 HydrophobicContact CE-CB 3.95Å; M118-D158 HydrophobicContact SD-CB 4.36Å; M118-I159 HydrophobicContact CE-CG1 4.17Å; M118-I159 HydrophobicContact SD-CB 4.36Å; M118-I159 HydrophobicContact SD-CG1 3.74Å; M118-D162 VanDerWaalsContact CA-OD1 3.23Å; M118-D162 WeakPolarHBondContact CA-OD1 3.36Å; M118-D162 HydrophobicContact CB-CB 4.09Å; M118-D162 WeakPolarHBondContact CB-OD1 3.4Å; M118-D162 HydrophobicContact CG-CB 4.03Å; M118-D162 HydrophobicContact SD-CB 4.32Å
119	K	92.3	Very high	96.1	Very high	167 Å²	167	39.2 Å²	39.2	73%	0.726	23%	0.233	S	C	*	.	S	Bend	trans	-108.3	119.3	-179.1	-178.3	-178.1	178.3	-175.3	0	110	K115	K115-K119 VanDerWaalsContact O-CB 3.27Å; K115-K119 WeakPolarHBondContact O-CB 3.5Å; K115-K119 PolarHBondContact O-N 3.48Å
120	G	89.8	Confident	96.1	Very high	63 Å²	63	38.8 Å²	38.8	65%	0.649	23%	0.231	S	C	*	.	S	Bend	trans	113.1	-154.8	170.6	0	0	0	0	0	111.9
121	L	84.5	Confident	96.1	Very high	187 Å²	187	38.4 Å²	38.4	98%	0.979	23%	0.229	S	C	*	.	S	Bend	trans	-87.6	120.7	173.1	-67.8	176.2	0	0	0	108.9
122	G	89	Confident	96.1	Very high	58 Å²	58	38.5 Å²	38.5	60%	0.598	23%	0.229	S	C	*	.	S	Bend	trans	85.9	173.7	-175.1	0	0	0	0	0	112.7
123	T	93.2	Very high	96.1	Very high	25 Å²	25	38 Å²	38	15%	0.153	23%	0.226	C	C	.	.			trans	-120.9	148.6	-176.6	-52	0	0	0	0	108.2	S117 M118 E125 L128 D162	S117-T123 WeakPolarHBondContact O-CA 3.32Å; S117-T123 WeakPolarHBondContact O-CG2 3.14Å; M118-T123 HydrophobicContact CG-CG2 4.41Å; T123-E125 WeakPolarHBondContact CB-OE1 3.5Å; T123-E125 HydrophobicContact CG2-CG 4.27Å; T123-L128 HydrophobicContact CG2-CD2 4.37Å; T123-D162 HydrophobicContact CG2-CB 4.47Å; T123-D162 PolarHBondContact OG1-O 3.29Å; T123-D162 PolarHBondContact OG1-OD1 3.34Å
124	D	96.5	Very high	96.1	Very high	46 Å²	46	36.8 Å²	36.8	25%	0.246	22%	0.22	C	C	.	.			trans	-94.6	80.5	165	176.2	-6.4	0	0	0	107.2	S117 D126 S127 L128 K286	S117-D124 PolarHBondContact O-N 3.33Å; D124-D126 PolarHBondContact O-N 3.33Å; D124-S127 VanDerWaalsContact CG-OG 3.23Å; D124-S127 PolarHBondContact O-N 2.69Å; D124-S127 WeakPolarHBondContact OD1-CB 3.31Å; D124-S127 PolarHBondContact OD1-N 3.16Å; D124-S127 PolarHBondContact OD1-OG 3.47Å; D124-S127 WeakPolarHBondContact OD2-CB 3.4Å; D124-S127 PolarHBondContact OD2-OG 3.32Å; D124-L128 PolarHBondContact O-N 2.96Å; D124-L128 VanDerWaalsContact O-N 3.09Å; D124-K286 IonicContact OD2-NZ 2.68Å; D124-K286 PolarHBondContact OD2-NZ 2.89Å
125	E	97.4	Very high	96.1	Very high	58 Å²	58	37.4 Å²	37.4	27%	0.271	22%	0.223	S	C	.	.	H	α-helix	trans	-59.8	-32.9	-176.5	-63.9	83.2	-177.7	0	0	111.2	T123 L128 I129 F167 D251	T123-E125 WeakPolarHBondContact CB-OE1 3.5Å; T123-E125 HydrophobicContact CG2-CG 4.27Å; E125-L128 PolarHBondContact O-N 3.03Å; E125-I129 HydrophobicContact CB-CD1 4.32Å; E125-I129 VanDerWaalsContact O-CB 3.23Å; E125-I129 WeakPolarHBondContact O-CB 3.41Å; E125-I129 WeakPolarHBondContact O-CD1 3.22Å; E125-I129 WeakPolarHBondContact O-CG1 3.45Å; E125-I129 PolarHBondContact O-N 3.45Å; E125-F167 HydrophobicContact CB-CE1 4.4Å; E125-F167 HydrophobicContact CB-CZ 4.16Å; E125-F167 HydrophobicContact CG-CE1 3.83Å; E125-F167 HydrophobicContact CG-CZ 4.11Å; E125-D251 HydrophobicContact CG-CB 4.37Å
126	D	97.4	Very high	96.1	Very high	43 Å²	43	37.8 Å²	37.8	23%	0.23	23%	0.229	C	C	.	.	H	α-helix	trans	-63.3	-46.4	-179.8	-169.4	66.9	0	0	0	112.1	D124 E130 R273	D124-D126 PolarHBondContact O-N 3.33Å; D126-E130 WeakPolarHBondContact O-CB 3.37Å; D126-E130 PolarHBondContact O-N 2.8Å; D126-R273 VanDerWaalsContact CG-NH1 3.29Å; D126-R273 IonicContact OD1-CZ 3.29Å; D126-R273 IonicContact OD1-NH1 3.75Å; D126-R273 PolarHBondContact OD1-NH1 3.47Å; D126-R273 IonicContact OD1-NH2 2.68Å; D126-R273 IonicContact OD2-CZ 3.03Å; D126-R273 IonicContact OD2-NH1 2.55Å; D126-R273 PolarHBondContact OD2-NH1 3.24Å; D126-R273 VanDerWaalsContact OD2-NH1 3.1Å; D126-R273 IonicContact OD2-NH2 3.14Å; D126-R273 PolarHBondContact OD2-NH2 3.08Å
127	S	97.8	Very high	96.1	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.007	22%	0.216	C	C	.	.	H	α-helix	trans	-70.9	-37.2	175.6	-61.4	0	0	0	0	112.3	D124 I131 R290	D124-S127 VanDerWaalsContact CG-OG 3.23Å; D124-S127 PolarHBondContact O-N 2.69Å; D124-S127 WeakPolarHBondContact OD1-CB 3.31Å; D124-S127 PolarHBondContact OD1-N 3.16Å; D124-S127 PolarHBondContact OD1-OG 3.47Å; D124-S127 WeakPolarHBondContact OD2-CB 3.4Å; D124-S127 PolarHBondContact OD2-OG 3.32Å; S127-I131 WeakPolarHBondContact O-CG1 3.25Å; S127-I131 PolarHBondContact O-N 3.22Å; S127-R290 PolarHBondContact OG-NH1 3.39Å; S127-R290 PolarHBondContact OG-NH2 3.17Å
128	L	98.5	Very high	96.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.9	-49.5	175.8	176.6	61.4	0	0	0	110.9	L114 M118 T123 D124 E125 I131 I132 I159 T163 F167 M171	L114-L128 HydrophobicContact CD2-CD1 3.59Å; M118-L128 HydrophobicContact SD-CD1 4.5Å; T123-L128 HydrophobicContact CG2-CD2 4.37Å; D124-L128 PolarHBondContact O-N 2.96Å; D124-L128 VanDerWaalsContact O-N 3.09Å; E125-L128 PolarHBondContact O-N 3.03Å; L128-I131 PolarHBondContact O-N 3.12Å; L128-I132 HydrophobicContact CD1-CG1 3.76Å; L128-I132 WeakPolarHBondContact O-CB 3.23Å; L128-I132 VanDerWaalsContact O-CG1 3.32Å; L128-I132 WeakPolarHBondContact O-CG1 3.18Å; L128-I132 PolarHBondContact O-N 2.85Å; L128-I159 HydrophobicContact CD1-CD1 4.42Å; L128-I159 HydrophobicContact CD1-CG1 4.31Å; L128-T163 HydrophobicContact CD2-CG2 3.72Å; L128-F167 HydrophobicContact CD2-CE1 4.47Å; L128-F167 HydrophobicContact CD2-CZ 4.15Å; L128-M171 HydrophobicContact CD2-CG 4.29Å; L128-M171 HydrophobicContact CG-SD 4.2Å
129	I	98.7	Very high	96.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-61.4	-47.9	178.7	-72.9	165.1	0	0	0	110.6	E125 I131 I132 C133 F167 M171 N254 A255 N258	E125-I129 HydrophobicContact CB-CD1 4.32Å; E125-I129 VanDerWaalsContact O-CB 3.23Å; E125-I129 WeakPolarHBondContact O-CB 3.41Å; E125-I129 WeakPolarHBondContact O-CD1 3.22Å; E125-I129 WeakPolarHBondContact O-CG1 3.45Å; E125-I129 PolarHBondContact O-N 3.45Å; I129-I131 VanDerWaalsContact C-N 3.31Å; I129-I131 PolarHBondContact O-N 2.66Å; I129-I132 PolarHBondContact O-N 3.4Å; I129-C133 WeakPolarHBondContact O-CB 3.47Å; I129-C133 PolarHBondContact O-N 2.98Å; I129-C133 PolarHBondContact O-SG 3.42Å; I129-F167 HydrophobicContact CD1-CE2 3.75Å; I129-F167 HydrophobicContact CD1-CZ 4.08Å; I129-F167 HydrophobicContact CG1-CE2 3.66Å; I129-F167 HydrophobicContact CG1-CZ 3.98Å; I129-M171 HydrophobicContact CG1-CE 4.41Å; I129-M171 HydrophobicContact CG1-SD 4.18Å; I129-N254 HydrophobicContact CD1-CB 3.96Å; I129-N254 WeakPolarHBondContact CD1-ND2 3.17Å; I129-A255 HydrophobicContact CD1-CB 4.05Å; I129-A255 HydrophobicContact CG1-CB 4.04Å; I129-N258 HydrophobicContact CG2-CB 3.37Å
130	E	98.7	Very high	96.4	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-55.8	-46.2	-178.6	-178.9	-170.3	115.9	0	0	111.9	D126 S134 Y269 F270 R273 R290	D126-E130 WeakPolarHBondContact O-CB 3.37Å; D126-E130 PolarHBondContact O-N 2.8Å; E130-S134 VanDerWaalsContact O-CB 3.27Å; E130-S134 WeakPolarHBondContact O-CB 3.27Å; E130-S134 PolarHBondContact O-N 3.46Å; E130-S134 PolarHBondContact O-OG 2.95Å; E130-Y269 WeakPolarHBondContact CA-OH 3.35Å; E130-Y269 HydrophobicContact CG-CE1 4.35Å; E130-Y269 WeakPolarHBondContact CG-OH 3.38Å; E130-F270 HydrophobicContact CG-CE1 4.26Å; E130-R273 IonicContact OE2-CZ 3.33Å; E130-R273 IonicContact OE2-NE 3.48Å; E130-R273 PolarHBondContact OE2-NE 2.89Å; E130-R273 IonicContact OE2-NH2 3.1Å; E130-R273 PolarHBondContact OE2-NH2 3.5Å; E130-R290 VanDerWaalsContact CD-NH2 3.32Å; E130-R290 IonicContact OE1-CZ 3.54Å; E130-R290 IonicContact OE1-NE 3.36Å; E130-R290 PolarHBondContact OE1-NE 2.67Å; E130-R290 IonicContact OE1-NH2 2.86Å; E130-R290 PolarHBondContact OE1-NH2 2.98Å; E130-R290 IonicContact OE2-CZ 3.63Å; E130-R290 IonicContact OE2-NE 2.86Å; E130-R290 IonicContact OE2-NH2 3.82Å; E130-R290 PolarHBondContact OE2-NH2 3.48Å
131	I	98.7	Very high	96.8	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-71.7	-57.4	-178.7	-61.2	169.2	0	0	0	109.4	D110 E113 L114 S127 L128 I129 C133 S134 R135	D110-I131 HydrophobicContact CB-CG2 4.29Å; E113-I131 HydrophobicContact CB-CD1 3.5Å; L114-I131 HydrophobicContact CD1-CG2 4.01Å; L114-I131 HydrophobicContact CD2-CB 4.01Å; L114-I131 HydrophobicContact CD2-CD1 4.1Å; L114-I131 HydrophobicContact CD2-CG2 4.03Å; L114-I131 HydrophobicContact CG-CB 4.39Å; L114-I131 HydrophobicContact CG-CD1 3.98Å; L114-I131 HydrophobicContact CG-CG2 3.99Å; S127-I131 WeakPolarHBondContact O-CG1 3.25Å; S127-I131 PolarHBondContact O-N 3.22Å; L128-I131 PolarHBondContact O-N 3.12Å; I129-I131 VanDerWaalsContact C-N 3.31Å; I129-I131 PolarHBondContact O-N 2.66Å; I131-C133 VanDerWaalsContact C-N 3.32Å; I131-C133 PolarHBondContact O-N 3.47Å; I131-S134 PolarHBondContact O-N 3.29Å; I131-S134 PolarHBondContact O-OG 2.93Å; I131-R135 HydrophobicContact CG2-CG 4.06Å; I131-R135 VanDerWaalsContact O-CG 3.27Å; I131-R135 WeakPolarHBondContact O-CG 3.26Å; I131-R135 PolarHBondContact O-N 2.65Å
132	I	98.8	Very high	97.5	Very high	1 Å²	1	32 Å²	32	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-62.5	-36.2	-172.3	-63.7	-59.8	0	0	0	112.7	L114 L128 I129 L140 L155 I159 M171 L174 A175	L114-I132 HydrophobicContact CD1-CD1 4.18Å; L114-I132 HydrophobicContact CD2-CD1 4Å; L114-I132 HydrophobicContact CD2-CG1 4.04Å; L128-I132 HydrophobicContact CD1-CG1 3.76Å; L128-I132 WeakPolarHBondContact O-CB 3.23Å; L128-I132 VanDerWaalsContact O-CG1 3.32Å; L128-I132 WeakPolarHBondContact O-CG1 3.18Å; L128-I132 PolarHBondContact O-N 2.85Å; I129-I132 PolarHBondContact O-N 3.4Å; I132-L140 HydrophobicContact CD1-CD2 4.01Å; I132-L155 HydrophobicContact CD1-CD2 4.45Å; I132-I159 HydrophobicContact CD1-CD1 4.39Å; I132-M171 HydrophobicContact CB-SD 4.18Å; I132-M171 HydrophobicContact CG2-SD 4.12Å; I132-L174 HydrophobicContact CG2-CB 3.36Å; I132-L174 HydrophobicContact CG2-CD1 4.03Å; I132-L174 HydrophobicContact CG2-CG 4.36Å; I132-A175 HydrophobicContact CD1-CB 3.97Å; I132-A175 HydrophobicContact CG2-CB 4.47Å
133	C	98.7	Very high	98	Very high	9 Å²	9	29.3 Å²	29.3	6%	0.061	15%	0.147	C	C	.	.	H	α-helix	trans	-77.7	-23	-179.3	-68.3	0	0	0	0	114.3	I129 I131 N258 L259 C262	I129-C133 WeakPolarHBondContact O-CB 3.47Å; I129-C133 PolarHBondContact O-N 2.98Å; I129-C133 PolarHBondContact O-SG 3.42Å; I131-C133 VanDerWaalsContact C-N 3.32Å; I131-C133 PolarHBondContact O-N 3.47Å; C133-N258 HydrophobicContact CB-CB 4.31Å; C133-L259 HydrophobicContact CB-CB 4.34Å; C133-C262 WeakPolarHBondContact O-CB 3.36Å
134	S	98.6	Very high	98.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-102.5	-20.4	-172.7	66.7	0	0	0	0	114.3	E130 I131 K266	E130-S134 VanDerWaalsContact O-CB 3.27Å; E130-S134 WeakPolarHBondContact O-CB 3.27Å; E130-S134 PolarHBondContact O-N 3.46Å; E130-S134 PolarHBondContact O-OG 2.95Å; I131-S134 PolarHBondContact O-N 3.29Å; I131-S134 PolarHBondContact O-OG 2.93Å; S134-K266 VanDerWaalsContact O-CE 3.24Å; S134-K266 WeakPolarHBondContact O-CE 3.21Å; S134-K266 PolarHBondContact O-NZ 2.79Å
135	R	98.5	Very high	98.3	Very high	14 Å²	14	31.3 Å²	31.3	5%	0.053	15%	0.151	C	C	.	.			trans	-76.8	145.6	178.5	-61.9	-52.2	178.6	-89.3	-1.5	112.1	D110 I131 E139 L140 I143	D110-R135 IonicContact OD1-CZ 2.65Å; D110-R135 IonicContact OD1-NE 3.52Å; D110-R135 IonicContact OD1-NH2 3.55Å; D110-R135 PolarHBondContact OD1-NH2 3.18Å; D110-R135 IonicContact OD2-CZ 2.91Å; D110-R135 IonicContact OD2-NE 2.73Å; D110-R135 PolarHBondContact OD2-NE 2.89Å; D110-R135 IonicContact OD2-NH2 2.78Å; D110-R135 PolarHBondContact OD2-NH2 3.29Å; I131-R135 HydrophobicContact CG2-CG 4.06Å; I131-R135 VanDerWaalsContact O-CG 3.27Å; I131-R135 WeakPolarHBondContact O-CG 3.26Å; I131-R135 PolarHBondContact O-N 2.65Å; R135-E139 WeakPolarHBondContact CA-OE2 3.43Å; R135-E139 HydrophobicContact CB-CB 3.96Å; R135-E139 HydrophobicContact CG-CB 4.42Å; R135-L140 HydrophobicContact CB-CD1 4.41Å; R135-L140 HydrophobicContact CB-CD2 4Å; R135-L140 HydrophobicContact CB-CG 3.77Å; R135-I143 HydrophobicContact CB-CD1 4.45Å; R135-I143 HydrophobicContact CG-CD1 3.9Å
136	T	97.8	Very high	98.4	Very high	62 Å²	62	28.9 Å²	28.9	38%	0.38	14%	0.14	S	C	.	.			trans	-78.5	170.3	176.2	58.8	0	0	0	0	111.3	Q138 E139 L140	T136-Q138 VanDerWaalsContact C-N 3.34Å; T136-Q138 PolarHBondContact O-N 3.28Å; T136-E139 WeakPolarHBondContact CB-OE2 3.36Å; T136-E139 WeakPolarHBondContact CG2-OE2 3.46Å; T136-E139 PolarHBondContact N-OE2 2.58Å; T136-E139 PolarHBondContact O-N 2.78Å; T136-E139 WeakPolarHBondContact OG1-CG 3.45Å; T136-E139 PolarHBondContact OG1-N 3.39Å; T136-E139 PolarHBondContact OG1-OE2 3.26Å; T136-L140 WeakPolarHBondContact O-CB 3.49Å; T136-L140 WeakPolarHBondContact O-CG 3.44Å; T136-L140 PolarHBondContact O-N 3.16Å
137	N	98	Very high	98.4	Very high	24 Å²	24	26.9 Å²	26.9	13%	0.128	13%	0.129	C	C	.	.	H	α-helix	trans	-53.9	-50.6	173.9	-75.5	-17.2	0	0	0	111.7	E139 L140 Q141 G177 R178 R179 E181	N137-E139 PolarHBondContact O-N 3.35Å; N137-L140 PolarHBondContact O-N 3Å; N137-Q141 WeakPolarHBondContact O-CG 3.46Å; N137-Q141 PolarHBondContact O-N 3.46Å; N137-G177 WeakPolarHBondContact CB-O 3.31Å; N137-G177 VanDerWaalsContact CG-O 3.32Å; N137-G177 WeakPolarHBondContact OD1-CA 3.29Å; N137-G177 PolarHBondContact OD1-O 3.03Å; N137-R178 PolarHBondContact OD1-N 2.78Å; N137-R179 PolarHBondContact ND2-N 3.05Å; N137-R179 PolarHBondContact ND2-O 3.48Å; N137-R179 WeakPolarHBondContact OD1-CB 3.32Å; N137-R179 PolarHBondContact OD1-N 2.83Å; N137-E181 PolarHBondContact ND2-OE1 2.71Å
138	Q	97.3	Very high	98.5	Very high	107 Å²	107	32.1 Å²	32.1	50%	0.5	15%	0.152	S	C	.	.	H	α-helix	trans	-58.8	-47.7	-179.9	-175.8	-174.7	-24.9	0	0	111.9	T19 T136 L140 Q141 E142	T19-Q138 VanDerWaalsContact CG2-NE2 3.29Å; T136-Q138 VanDerWaalsContact C-N 3.34Å; T136-Q138 PolarHBondContact O-N 3.28Å; Q138-L140 PolarHBondContact O-N 3.37Å; Q138-Q141 PolarHBondContact O-N 2.93Å; Q138-E142 PolarHBondContact O-N 2.96Å; Q138-E142 VanDerWaalsContact O-N 3.15Å
139	E	98.3	Very high	98.5	Very high	54 Å²	54	36.8 Å²	36.8	25%	0.252	17%	0.174	S	C	.	.	H	α-helix	trans	-60.9	-44.3	177	-70.9	165.2	133.7	0	0	111.2	R135 T136 N137 E142 I143	R135-E139 WeakPolarHBondContact CA-OE2 3.43Å; R135-E139 HydrophobicContact CB-CB 3.96Å; R135-E139 HydrophobicContact CG-CB 4.42Å; T136-E139 WeakPolarHBondContact CB-OE2 3.36Å; T136-E139 WeakPolarHBondContact CG2-OE2 3.46Å; T136-E139 PolarHBondContact N-OE2 2.58Å; T136-E139 PolarHBondContact O-N 2.78Å; T136-E139 WeakPolarHBondContact OG1-CG 3.45Å; T136-E139 PolarHBondContact OG1-N 3.39Å; T136-E139 PolarHBondContact OG1-OE2 3.26Å; N137-E139 PolarHBondContact O-N 3.35Å; E139-E142 PolarHBondContact O-N 3.44Å; E139-I143 WeakPolarHBondContact O-CB 3.37Å; E139-I143 WeakPolarHBondContact O-CD1 3.45Å; E139-I143 WeakPolarHBondContact O-CG1 3.36Å; E139-I143 PolarHBondContact O-N 3.13Å
140	L	98.6	Very high	98.4	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.026	19%	0.191	C	C	.	.	H	α-helix	trans	-66.8	-39.9	179.9	-74.8	165.6	0	0	0	112.9	I132 R135 T136 N137 Q138 E142 I143 N144 L174	I132-L140 HydrophobicContact CD1-CD2 4.01Å; R135-L140 HydrophobicContact CB-CD1 4.41Å; R135-L140 HydrophobicContact CB-CD2 4Å; R135-L140 HydrophobicContact CB-CG 3.77Å; T136-L140 WeakPolarHBondContact O-CB 3.49Å; T136-L140 WeakPolarHBondContact O-CG 3.44Å; T136-L140 PolarHBondContact O-N 3.16Å; N137-L140 PolarHBondContact O-N 3Å; Q138-L140 PolarHBondContact O-N 3.37Å; L140-E142 VanDerWaalsContact C-N 3.3Å; L140-E142 PolarHBondContact O-N 2.45Å; L140-I143 PolarHBondContact O-N 3.39Å; L140-N144 PolarHBondContact O-N 2.93Å; L140-N144 PolarHBondContact O-ND2 3.46Å; L140-L174 VanDerWaalsContact CD1-O 3.31Å; L140-L174 WeakPolarHBondContact CD1-O 3.48Å
141	Q	98.4	Very high	98.4	Very high	92 Å²	92	43.7 Å²	43.7	43%	0.43	20%	0.204	S	C	.	.	H	α-helix	trans	-60.3	-44.5	174.9	-69.2	-56.4	-23.6	0	0	110.9	N137 Q138 N144 R145 K176 G177	N137-Q141 WeakPolarHBondContact O-CG 3.46Å; N137-Q141 PolarHBondContact O-N 3.46Å; Q138-Q141 PolarHBondContact O-N 2.93Å; Q141-N144 PolarHBondContact O-N 2.91Å; Q141-R145 PolarHBondContact O-N 3.5Å; Q141-K176 PolarHBondContact NE2-O 3.03Å; Q141-G177 PolarHBondContact NE2-O 3.02Å
142	E	98.4	Very high	98.4	Very high	73 Å²	73	51.8 Å²	51.8	34%	0.341	24%	0.24	S	C	.	.	H	α-helix	trans	-68.2	-39.7	178.9	-178.8	61.1	-174.2	0	0	111.9	A107 Q138 E139 L140 N144 R145 V146	A107-E142 HydrophobicContact CB-CB 4.36Å; A107-E142 HydrophobicContact CB-CG 3.5Å; Q138-E142 PolarHBondContact O-N 2.96Å; Q138-E142 VanDerWaalsContact O-N 3.15Å; E139-E142 PolarHBondContact O-N 3.44Å; L140-E142 VanDerWaalsContact C-N 3.3Å; L140-E142 PolarHBondContact O-N 2.45Å; E142-N144 PolarHBondContact O-N 2.73Å; E142-R145 PolarHBondContact O-N 3.48Å; E142-R145 IonicContact OE1-CZ 2.65Å; E142-R145 IonicContact OE1-NE 3.54Å; E142-R145 IonicContact OE1-NH2 2.72Å; E142-R145 PolarHBondContact OE1-NH2 3.39Å; E142-R145 IonicContact OE2-CZ 2.65Å; E142-R145 IonicContact OE2-NE 3.62Å; E142-R145 PolarHBondContact OE2-NE 3.38Å; E142-R145 IonicContact OE2-NH2 3.57Å; E142-R145 PolarHBondContact OE2-NH2 3.04Å; E142-V146 HydrophobicContact CG-CG2 4.48Å; E142-V146 WeakPolarHBondContact O-CB 3.17Å; E142-V146 WeakPolarHBondContact O-CG2 3.3Å; E142-V146 PolarHBondContact O-N 2.99Å
143	I	98.8	Very high	98.3	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-58.7	-46.9	172.1	-71.1	162.9	0	0	0	110.6	A107 D110 L114 R135 E139 L140 R145 V146 Y147 L155	A107-I143 HydrophobicContact CB-CG1 4.34Å; D110-I143 HydrophobicContact CB-CD1 3.64Å; D110-I143 HydrophobicContact CB-CG1 3.82Å; L114-I143 HydrophobicContact CD1-CG2 3.64Å; R135-I143 HydrophobicContact CB-CD1 4.45Å; R135-I143 HydrophobicContact CG-CD1 3.9Å; E139-I143 WeakPolarHBondContact O-CB 3.37Å; E139-I143 WeakPolarHBondContact O-CD1 3.45Å; E139-I143 WeakPolarHBondContact O-CG1 3.36Å; E139-I143 PolarHBondContact O-N 3.13Å; L140-I143 PolarHBondContact O-N 3.39Å; I143-R145 VanDerWaalsContact C-N 3.34Å; I143-R145 PolarHBondContact O-N 2.94Å; I143-V146 PolarHBondContact O-N 2.65Å; I143-Y147 WeakPolarHBondContact O-CB 3.26Å; I143-Y147 PolarHBondContact O-N 3.34Å; I143-L155 HydrophobicContact CG2-CD2 3.99Å
144	N	98.7	Very high	98.3	Very high	34 Å²	34	55.3 Å²	55.3	18%	0.182	26%	0.259	C	S	.	.	H	α-helix	trans	-59.7	-44.4	178.6	-82.5	-73.2	0	0	0	111.8	L140 Q141 E142 K148 A175	L140-N144 PolarHBondContact O-N 2.93Å; L140-N144 PolarHBondContact O-ND2 3.46Å; Q141-N144 PolarHBondContact O-N 2.91Å; E142-N144 PolarHBondContact O-N 2.73Å; N144-K148 WeakPolarHBondContact O-CB 3.41Å; N144-K148 PolarHBondContact O-N 3.38Å; N144-K148 VanDerWaalsContact O-N 3.17Å; N144-A175 PolarHBondContact ND2-O 3.28Å
145	R	98.7	Very high	98.3	Very high	80 Å²	80	55.3 Å²	55.3	30%	0.302	26%	0.259	S	S	.	.	H	α-helix	trans	-60.1	-53.3	177	-172	-169.7	69.7	77.6	-0.7	111	Q141 E142 I143 Y147 K148 E149	Q141-R145 PolarHBondContact O-N 3.5Å; E142-R145 PolarHBondContact O-N 3.48Å; E142-R145 IonicContact OE1-CZ 2.65Å; E142-R145 IonicContact OE1-NE 3.54Å; E142-R145 IonicContact OE1-NH2 2.72Å; E142-R145 PolarHBondContact OE1-NH2 3.39Å; E142-R145 IonicContact OE2-CZ 2.65Å; E142-R145 IonicContact OE2-NE 3.62Å; E142-R145 PolarHBondContact OE2-NE 3.38Å; E142-R145 IonicContact OE2-NH2 3.57Å; E142-R145 PolarHBondContact OE2-NH2 3.04Å; I143-R145 VanDerWaalsContact C-N 3.34Å; I143-R145 PolarHBondContact O-N 2.94Å; R145-Y147 PolarHBondContact O-N 2.85Å; R145-K148 PolarHBondContact O-N 2.94Å; R145-E149 IonicContact CZ-OE1 2.76Å; R145-E149 IonicContact CZ-OE2 3.58Å; R145-E149 IonicContact NH1-OE1 3.73Å; R145-E149 PolarHBondContact NH1-OE1 3.07Å; R145-E149 IonicContact NH1-OE2 2.67Å; R145-E149 PolarHBondContact NH1-OE2 3.01Å; R145-E149 WeakPolarHBondContact O-CG 3.01Å; R145-E149 PolarHBondContact O-N 2.87Å; R145-E149 VanDerWaalsContact O-N 3.08Å
146	V	98.6	Very high	98.3	Very high	7 Å²	7	57.8 Å²	57.8	4%	0.042	27%	0.271	C	S	.	.	H	α-helix	trans	-66.2	-39.2	-177.7	170.8	0	0	0	0	112	A107 Q108 A111 E142 I143 K148 E149 M150	A107-V146 HydrophobicContact CB-CB 4.21Å; A107-V146 HydrophobicContact CB-CG2 3.88Å; Q108-V146 HydrophobicContact CB-CG1 4.26Å; Q108-V146 HydrophobicContact CG-CG1 3.65Å; A111-V146 HydrophobicContact CB-CG1 4.23Å; E142-V146 HydrophobicContact CG-CG2 4.48Å; E142-V146 WeakPolarHBondContact O-CB 3.17Å; E142-V146 WeakPolarHBondContact O-CG2 3.3Å; E142-V146 PolarHBondContact O-N 2.99Å; I143-V146 PolarHBondContact O-N 2.65Å; V146-K148 VanDerWaalsContact C-N 3.33Å; V146-K148 PolarHBondContact O-N 2.95Å; V146-E149 PolarHBondContact O-N 3.25Å; V146-M150 HydrophobicContact CG1-CG 4.07Å; V146-M150 HydrophobicContact CG1-SD 3.54Å; V146-M150 VanDerWaalsContact CG1-SD 3.54Å; V146-M150 WeakPolarHBondContact O-CB 3.13Å; V146-M150 VanDerWaalsContact O-CG 3.29Å; V146-M150 WeakPolarHBondContact O-CG 3.27Å; V146-M150 PolarHBondContact O-N 2.87Å
147	Y	98.7	Very high	98.3	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59	-45.4	176.5	-165.8	-80.6	0	0	0	111.3	A111 L114 K115 M118 I143 R145 E149 M150 Y151 T153 L155 D158	A111-Y147 HydrophobicContact CB-CD2 3.89Å; A111-Y147 HydrophobicContact CB-CG 4.45Å; A111-Y147 WeakPolarHBondContact O-CE2 3.33Å; L114-Y147 HydrophobicContact CB-CE2 4.12Å; K115-Y147 HydrophobicContact CB-CE2 3.97Å; K115-Y147 HydrophobicContact CD-CE2 4.37Å; K115-Y147 WeakPolarHBondContact CD-OH 3.45Å; M118-Y147 HydrophobicContact CE-CE2 4.48Å; M118-Y147 WeakPolarHBondContact CE-OH 3.23Å; I143-Y147 WeakPolarHBondContact O-CB 3.26Å; I143-Y147 PolarHBondContact O-N 3.34Å; R145-Y147 PolarHBondContact O-N 2.85Å; Y147-E149 VanDerWaalsContact C-N 3.34Å; Y147-E149 PolarHBondContact O-N 2.93Å; Y147-M150 PolarHBondContact O-N 3.42Å; Y147-Y151 AromaticContact CD1-CD2 3.84Å; Y147-Y151 HydrophobicContact CD1-CD2 3.84Å; Y147-Y151 AromaticContact CD2-CD2 3.84Å; Y147-Y151 HydrophobicContact CD2-CD2 3.84Å; Y147-Y151 AromaticContact CD2-CE2 3.92Å; Y147-Y151 HydrophobicContact CD2-CE2 3.92Å; Y147-Y151 AromaticContact CE1-CD2 3.88Å; Y147-Y151 HydrophobicContact CE1-CD2 3.88Å; Y147-Y151 AromaticContact CE2-CD2 3.88Å; Y147-Y151 HydrophobicContact CE2-CD2 3.88Å; Y147-Y151 AromaticContact CE2-CE2 3.99Å; Y147-Y151 HydrophobicContact CE2-CE2 3.99Å; Y147-Y151 AromaticContact CG-CD2 3.82Å; Y147-Y151 HydrophobicContact CG-CD2 3.82Å; Y147-Y151 HydrophobicContact CG-CE2 4.3Å; Y147-Y151 AromaticContact CZ-CD2 3.92Å; Y147-Y151 WeakPolarHBondContact O-CD2 3.36Å; Y147-Y151 PolarHBondContact O-N 3.29Å; Y147-T153 HydrophobicContact CE1-CG2 3.97Å; Y147-L155 HydrophobicContact CD1-CB 3.87Å; Y147-L155 HydrophobicContact CD2-CB 4.33Å; Y147-L155 HydrophobicContact CD2-CD1 3.87Å; Y147-L155 HydrophobicContact CE1-CB 4.26Å; Y147-L155 HydrophobicContact CE1-CD1 4.33Å; Y147-L155 HydrophobicContact CE2-CD1 3.65Å; Y147-L155 HydrophobicContact CG-CB 3.91Å; Y147-L155 HydrophobicContact CG-CD1 4.3Å; Y147-D158 HydrophobicContact CE1-CB 4.47Å; Y147-D158 PolarHBondContact OH-OD2 2.85Å
148	K	98.5	Very high	98.3	Very high	111 Å²	111	60.7 Å²	60.7	48%	0.483	28%	0.279	S	S	.	.	H	α-helix	trans	-62.2	-41.2	175.8	-174.6	174.2	-171.2	144.9	0	112.3	N144 R145 V146 K152 T153 D154	N144-K148 WeakPolarHBondContact O-CB 3.41Å; N144-K148 PolarHBondContact O-N 3.38Å; N144-K148 VanDerWaalsContact O-N 3.17Å; R145-K148 PolarHBondContact O-N 2.94Å; V146-K148 VanDerWaalsContact C-N 3.33Å; V146-K148 PolarHBondContact O-N 2.95Å; K148-K152 WeakPolarHBondContact O-CA 3.39Å; K148-K152 PolarHBondContact O-N 3.45Å; K148-T153 VanDerWaalsContact CA-O 3.31Å; K148-T153 WeakPolarHBondContact CA-O 3.29Å; K148-D154 WeakPolarHBondContact CE-OD1 3.45Å; K148-D154 IonicContact NZ-OD1 2.74Å; K148-D154 PolarHBondContact NZ-OD1 3.32Å
149	E	98.4	Very high	98.3	Very high	99 Å²	99	55.6 Å²	55.6	46%	0.463	26%	0.255	S	S	.	.	H	α-helix	trans	-65.7	-42.5	176.6	-74.2	173.1	-172.1	0	0	112.4	R145 V146 Y147 K152	R145-E149 IonicContact CZ-OE1 2.76Å; R145-E149 IonicContact CZ-OE2 3.58Å; R145-E149 IonicContact NH1-OE1 3.73Å; R145-E149 PolarHBondContact NH1-OE1 3.07Å; R145-E149 IonicContact NH1-OE2 2.67Å; R145-E149 PolarHBondContact NH1-OE2 3.01Å; R145-E149 WeakPolarHBondContact O-CG 3.01Å; R145-E149 PolarHBondContact O-N 2.87Å; R145-E149 VanDerWaalsContact O-N 3.08Å; V146-E149 PolarHBondContact O-N 3.25Å; Y147-E149 VanDerWaalsContact C-N 3.34Å; Y147-E149 PolarHBondContact O-N 2.93Å; E149-K152 VanDerWaalsContact O-CE 3.3Å; E149-K152 WeakPolarHBondContact O-CE 3.26Å; E149-K152 PolarHBondContact O-NZ 3.36Å
150	M	98.1	Very high	98.3	Very high	74 Å²	74	56.1 Å²	56.1	37%	0.365	26%	0.259	S	S	.	.	H	α-helix	trans	-73.6	-41.9	-177.4	-71	176.7	71.3	0	0	113	Q108 A111 V146 Y147	Q108-M150 HydrophobicContact CB-SD 4.2Å; Q108-M150 HydrophobicContact CG-SD 4.06Å; A111-M150 HydrophobicContact CB-SD 4.12Å; V146-M150 HydrophobicContact CG1-CG 4.07Å; V146-M150 HydrophobicContact CG1-SD 3.54Å; V146-M150 VanDerWaalsContact CG1-SD 3.54Å; V146-M150 WeakPolarHBondContact O-CB 3.13Å; V146-M150 VanDerWaalsContact O-CG 3.29Å; V146-M150 WeakPolarHBondContact O-CG 3.27Å; V146-M150 PolarHBondContact O-N 2.87Å; Y147-M150 PolarHBondContact O-N 3.42Å
151	Y	98	Very high	98.2	Very high	70 Å²	70	60.4 Å²	60.4	28%	0.275	29%	0.289	S	S	.	.	H	α-helix	trans	-115.5	-1.8	-168.5	-53.2	-61.6	0	0	0	114.6	A111 S112 K115 Y147 T153	A111-Y151 HydrophobicContact CB-CE2 4.43Å; S112-Y151 VanDerWaalsContact CA-OH 3.26Å; S112-Y151 WeakPolarHBondContact CA-OH 3.49Å; K115-Y151 HydrophobicContact CB-CD2 4.2Å; K115-Y151 HydrophobicContact CB-CE1 4.15Å; K115-Y151 HydrophobicContact CB-CE2 3.6Å; K115-Y151 HydrophobicContact CD-CD1 4.27Å; K115-Y151 HydrophobicContact CD-CD2 4.2Å; K115-Y151 HydrophobicContact CD-CE1 4.49Å; K115-Y151 HydrophobicContact CD-CE2 4.43Å; K115-Y151 HydrophobicContact CD-CG 4.12Å; K115-Y151 HydrophobicContact CG-CD1 4.01Å; K115-Y151 HydrophobicContact CG-CD2 4.21Å; K115-Y151 HydrophobicContact CG-CE1 3.76Å; K115-Y151 HydrophobicContact CG-CE2 3.97Å; K115-Y151 HydrophobicContact CG-CG 4.24Å; Y147-Y151 AromaticContact CD1-CD2 3.84Å; Y147-Y151 HydrophobicContact CD1-CD2 3.84Å; Y147-Y151 AromaticContact CD2-CD2 3.84Å; Y147-Y151 HydrophobicContact CD2-CD2 3.84Å; Y147-Y151 AromaticContact CD2-CE2 3.92Å; Y147-Y151 HydrophobicContact CD2-CE2 3.92Å; Y147-Y151 AromaticContact CE1-CD2 3.88Å; Y147-Y151 HydrophobicContact CE1-CD2 3.88Å; Y147-Y151 AromaticContact CE2-CD2 3.88Å; Y147-Y151 HydrophobicContact CE2-CD2 3.88Å; Y147-Y151 AromaticContact CE2-CE2 3.99Å; Y147-Y151 HydrophobicContact CE2-CE2 3.99Å; Y147-Y151 AromaticContact CG-CD2 3.82Å; Y147-Y151 HydrophobicContact CG-CD2 3.82Å; Y147-Y151 HydrophobicContact CG-CE2 4.3Å; Y147-Y151 AromaticContact CZ-CD2 3.92Å; Y147-Y151 WeakPolarHBondContact O-CD2 3.36Å; Y147-Y151 PolarHBondContact O-N 3.29Å; Y151-T153 PolarHBondContact O-N 3.09Å; Y151-T153 VanDerWaalsContact O-N 3.13Å
152	K	98	Very high	98.1	Very high	171 Å²	171	58.3 Å²	58.3	74%	0.743	28%	0.281	S	S	*	.	S	Bend	trans	56.7	26.7	178.2	-47.6	-52.8	-176.3	-165.3	0	113.8	K148 E149	K148-K152 WeakPolarHBondContact O-CA 3.39Å; K148-K152 PolarHBondContact O-N 3.45Å; E149-K152 VanDerWaalsContact O-CE 3.3Å; E149-K152 WeakPolarHBondContact O-CE 3.26Å; E149-K152 PolarHBondContact O-NZ 3.36Å
153	T	98	Very high	98.1	Very high	36 Å²	36	55.3 Å²	55.3	22%	0.221	27%	0.267	C	S	.	.	S	Bend	trans	-139.9	156.8	173.9	-175.3	0	0	0	0	109.2	Y147 K148 Y151 D158	Y147-T153 HydrophobicContact CE1-CG2 3.97Å; K148-T153 VanDerWaalsContact CA-O 3.31Å; K148-T153 WeakPolarHBondContact CA-O 3.29Å; Y151-T153 PolarHBondContact O-N 3.09Å; Y151-T153 VanDerWaalsContact O-N 3.13Å; T153-D158 VanDerWaalsContact CG2-OD1 3.27Å; T153-D158 WeakPolarHBondContact CG2-OD1 3.24Å; T153-D158 WeakPolarHBondContact CG2-OD2 3.43Å; T153-D158 PolarHBondContact OG1-OD1 2.97Å; T153-D158 VanDerWaalsContact OG1-OD1 3.07Å
154	D	98.2	Very high	98	Very high	47 Å²	47	59.2 Å²	59.2	25%	0.251	30%	0.295	S	S	.	.			trans	-82.9	134.3	179.2	-53.8	-74.4	0	0	0	109.6	K148 E156 K157 D158	K148-D154 WeakPolarHBondContact CE-OD1 3.45Å; K148-D154 IonicContact NZ-OD1 2.74Å; K148-D154 PolarHBondContact NZ-OD1 3.32Å; D154-E156 PolarHBondContact O-N 3.37Å; D154-K157 HydrophobicContact CB-CD 4.17Å; D154-K157 HydrophobicContact CB-CG 4.2Å; D154-K157 WeakPolarHBondContact O-CB 3.33Å; D154-K157 PolarHBondContact O-N 3.09Å; D154-K157 WeakPolarHBondContact OD2-CE 3.12Å; D154-K157 IonicContact OD2-NZ 3.03Å; D154-K157 PolarHBondContact OD2-NZ 2.83Å; D154-D158 PolarHBondContact O-N 3.22Å
155	L	98.4	Very high	98	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-54	-40.9	178.7	172.3	64	0	0	0	112	L114 M118 I132 I143 Y147 K157 D158 I159	L114-L155 HydrophobicContact CB-CD1 4.22Å; L114-L155 HydrophobicContact CD1-CD1 4.07Å; L114-L155 HydrophobicContact CD1-CD2 3.83Å; M118-L155 HydrophobicContact CE-CD1 3.7Å; I132-L155 HydrophobicContact CD1-CD2 4.45Å; I143-L155 HydrophobicContact CG2-CD2 3.99Å; Y147-L155 HydrophobicContact CD1-CB 3.87Å; Y147-L155 HydrophobicContact CD2-CB 4.33Å; Y147-L155 HydrophobicContact CD2-CD1 3.87Å; Y147-L155 HydrophobicContact CE1-CB 4.26Å; Y147-L155 HydrophobicContact CE1-CD1 4.33Å; Y147-L155 HydrophobicContact CE2-CD1 3.65Å; Y147-L155 HydrophobicContact CG-CB 3.91Å; Y147-L155 HydrophobicContact CG-CD1 4.3Å; L155-K157 VanDerWaalsContact C-N 3.28Å; L155-K157 PolarHBondContact O-N 3.03Å; L155-D158 PolarHBondContact O-N 2.72Å; L155-I159 HydrophobicContact CD1-CD1 4.04Å; L155-I159 HydrophobicContact CD1-CG1 4.14Å; L155-I159 HydrophobicContact CD2-CD1 4.46Å; L155-I159 HydrophobicContact CG-CD1 3.88Å; L155-I159 HydrophobicContact CG-CG1 4.39Å; L155-I159 WeakPolarHBondContact O-CG1 3.41Å; L155-I159 PolarHBondContact O-N 3.21Å
156	E	98.3	Very high	98	Very high	66 Å²	66	58.5 Å²	58.5	31%	0.308	31%	0.309	S	S	.	.	H	α-helix	trans	-57.3	-39.4	176.7	178.7	168.7	167.4	0	0	112.4	D154 I159 I160 V172 K176	D154-E156 PolarHBondContact O-N 3.37Å; E156-I159 PolarHBondContact O-N 2.75Å; E156-I160 HydrophobicContact CG-CD1 3.9Å; E156-I160 WeakPolarHBondContact O-CB 3.39Å; E156-I160 WeakPolarHBondContact O-CG1 3.12Å; E156-I160 PolarHBondContact O-N 3.47Å; E156-V172 HydrophobicContact CG-CG1 3.94Å; E156-V172 HydrophobicContact CG-CG2 4.41Å; E156-K176 WeakPolarHBondContact OE1-CE 3.28Å; E156-K176 IonicContact OE1-NZ 3.77Å; E156-K176 PolarHBondContact OE1-NZ 3.24Å; E156-K176 WeakPolarHBondContact OE2-CE 3.29Å; E156-K176 IonicContact OE2-NZ 3.31Å
157	K	98	Very high	98	Very high	124 Å²	124	59 Å²	59	54%	0.539	31%	0.31	S	S	.	.	H	α-helix	trans	-68.2	-42.5	179.3	-71.1	176.2	178.8	154.5	0	111.4	D154 L155 I160 S161	D154-K157 HydrophobicContact CB-CD 4.17Å; D154-K157 HydrophobicContact CB-CG 4.2Å; D154-K157 WeakPolarHBondContact O-CB 3.33Å; D154-K157 PolarHBondContact O-N 3.09Å; D154-K157 WeakPolarHBondContact OD2-CE 3.12Å; D154-K157 IonicContact OD2-NZ 3.03Å; D154-K157 PolarHBondContact OD2-NZ 2.83Å; L155-K157 VanDerWaalsContact C-N 3.28Å; L155-K157 PolarHBondContact O-N 3.03Å; K157-I160 PolarHBondContact O-N 3.27Å; K157-S161 PolarHBondContact O-N 3.46Å
158	D	98	Very high	97.9	Very high	24 Å²	24	63.1 Å²	63.1	13%	0.128	33%	0.326	C	S	.	.	H	α-helix	trans	-65.6	-41.1	177.8	-75.6	23.3	0	0	0	110.4	K115 M118 Y147 T153 D154 L155 I160 S161 D162	K115-D158 IonicContact NZ-OD2 3.79Å; K115-D158 PolarHBondContact NZ-OD2 3.3Å; M118-D158 HydrophobicContact CE-CB 3.95Å; M118-D158 HydrophobicContact SD-CB 4.36Å; Y147-D158 HydrophobicContact CE1-CB 4.47Å; Y147-D158 PolarHBondContact OH-OD2 2.85Å; T153-D158 VanDerWaalsContact CG2-OD1 3.27Å; T153-D158 WeakPolarHBondContact CG2-OD1 3.24Å; T153-D158 WeakPolarHBondContact CG2-OD2 3.43Å; T153-D158 PolarHBondContact OG1-OD1 2.97Å; T153-D158 VanDerWaalsContact OG1-OD1 3.07Å; D154-D158 PolarHBondContact O-N 3.22Å; L155-D158 PolarHBondContact O-N 2.72Å; D158-I160 PolarHBondContact O-N 3.01Å; D158-S161 WeakPolarHBondContact O-CB 3.23Å; D158-S161 PolarHBondContact O-N 3.03Å; D158-S161 VanDerWaalsContact O-N 3.14Å; D158-D162 PolarHBondContact O-N 3.46Å
159	I	98.3	Very high	97.9	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60	-44.6	172.5	-68.4	171.8	0	0	0	111.2	M118 L128 I132 L155 E156 S161 D162 T163 M171 V172 A175	M118-I159 HydrophobicContact CE-CG1 4.17Å; M118-I159 HydrophobicContact SD-CB 4.36Å; M118-I159 HydrophobicContact SD-CG1 3.74Å; L128-I159 HydrophobicContact CD1-CD1 4.42Å; L128-I159 HydrophobicContact CD1-CG1 4.31Å; I132-I159 HydrophobicContact CD1-CD1 4.39Å; L155-I159 HydrophobicContact CD1-CD1 4.04Å; L155-I159 HydrophobicContact CD1-CG1 4.14Å; L155-I159 HydrophobicContact CD2-CD1 4.46Å; L155-I159 HydrophobicContact CG-CD1 3.88Å; L155-I159 HydrophobicContact CG-CG1 4.39Å; L155-I159 WeakPolarHBondContact O-CG1 3.41Å; L155-I159 PolarHBondContact O-N 3.21Å; E156-I159 PolarHBondContact O-N 2.75Å; I159-S161 VanDerWaalsContact C-N 3.25Å; I159-S161 PolarHBondContact O-N 3.09Å; I159-D162 PolarHBondContact O-N 3.11Å; I159-T163 HydrophobicContact CG2-CG2 4.37Å; I159-T163 WeakPolarHBondContact O-CB 3.43Å; I159-T163 PolarHBondContact O-N 2.92Å; I159-T163 PolarHBondContact O-OG1 2.73Å; I159-M171 HydrophobicContact CG2-CB 3.78Å; I159-V172 HydrophobicContact CG2-CG2 3.87Å; I159-A175 HydrophobicContact CD1-CB 3.66Å
160	I	98	Very high	98	Very high	65 Å²	65	58.5 Å²	58.5	33%	0.333	30%	0.304	S	S	.	.	H	α-helix	trans	-62.1	-35.6	177.8	-71.7	166.6	0	0	0	111.1	E156 K157 D158 R168 V172	E156-I160 HydrophobicContact CG-CD1 3.9Å; E156-I160 WeakPolarHBondContact O-CB 3.39Å; E156-I160 WeakPolarHBondContact O-CG1 3.12Å; E156-I160 PolarHBondContact O-N 3.47Å; K157-I160 PolarHBondContact O-N 3.27Å; D158-I160 PolarHBondContact O-N 3.01Å; I160-R168 HydrophobicContact CG1-CG 4.4Å; I160-R168 PolarHBondContact O-NE 2.93Å; I160-R168 VanDerWaalsContact O-NE 3.08Å; I160-R168 PolarHBondContact O-NH2 3.41Å; I160-V172 HydrophobicContact CD1-CG2 4.36Å; I160-V172 HydrophobicContact CG1-CG2 3.72Å
161	S	96.9	Very high	98	Very high	95 Å²	95	55 Å²	55	66%	0.664	29%	0.287	S	S	*	.	H	α-helix	trans	-69.6	-41.2	178.9	-171.6	0	0	0	0	112.5	K157 D158 I159	K157-S161 PolarHBondContact O-N 3.46Å; D158-S161 WeakPolarHBondContact O-CB 3.23Å; D158-S161 PolarHBondContact O-N 3.03Å; D158-S161 VanDerWaalsContact O-N 3.14Å; I159-S161 VanDerWaalsContact C-N 3.25Å; I159-S161 PolarHBondContact O-N 3.09Å
162	D	96.1	Very high	98	Very high	48 Å²	48	52.4 Å²	52.4	26%	0.257	28%	0.279	S	S	.	.	H	α-helix	trans	-95.1	-13.1	-170.4	-94.9	-124.7	0	0	0	115	M118 T123 D158 I159	M118-D162 VanDerWaalsContact CA-OD1 3.23Å; M118-D162 WeakPolarHBondContact CA-OD1 3.36Å; M118-D162 HydrophobicContact CB-CB 4.09Å; M118-D162 WeakPolarHBondContact CB-OD1 3.4Å; M118-D162 HydrophobicContact CG-CB 4.03Å; M118-D162 HydrophobicContact SD-CB 4.32Å; T123-D162 HydrophobicContact CG2-CB 4.47Å; T123-D162 PolarHBondContact OG1-O 3.29Å; T123-D162 PolarHBondContact OG1-OD1 3.34Å; D158-D162 PolarHBondContact O-N 3.46Å; I159-D162 PolarHBondContact O-N 3.11Å
163	T	97.2	Very high	98.1	Very high	9 Å²	9	45.8 Å²	45.8	6%	0.055	26%	0.256	C	S	.	.			trans	-119.8	166.4	-179.7	67.3	0	0	0	0	110.9	L128 I159 F167 R168	L128-T163 HydrophobicContact CD2-CG2 3.72Å; I159-T163 HydrophobicContact CG2-CG2 4.37Å; I159-T163 WeakPolarHBondContact O-CB 3.43Å; I159-T163 PolarHBondContact O-N 2.92Å; I159-T163 PolarHBondContact O-OG1 2.73Å; T163-F167 HydrophobicContact CG2-CD1 4.03Å; T163-F167 HydrophobicContact CG2-CE1 3.57Å; T163-F167 HydrophobicContact CG2-CZ 4.4Å; T163-R168 PolarHBondContact O-NE 3.46Å; T163-R168 PolarHBondContact O-NH2 3.27Å; T163-R168 VanDerWaalsContact OG1-CA 3.3Å; T163-R168 WeakPolarHBondContact OG1-CA 3.48Å; T163-R168 WeakPolarHBondContact OG1-CB 3.43Å; T163-R168 WeakPolarHBondContact OG1-CG 3.35Å
164	S	97.2	Very high	98.1	Very high	83 Å²	83	44.7 Å²	44.7	58%	0.58	25%	0.249	S	C	*	.			trans	-143.6	174.1	176.8	71.7	0	0	0	0	112.9	R168	S164-R168 PolarHBondContact O-N 2.73Å
165	G	97.9	Very high	98.1	Very high	50 Å²	50	42.6 Å²	42.6	52%	0.515	24%	0.238	S	C	.	.	H	α-helix	trans	59.9	-147.7	174.1	0	0	0	0	0	114.4	F167 R168 K169	G165-F167 VanDerWaalsContact C-N 3.33Å; G165-R168 WeakPolarHBondContact O-CB 3.45Å; G165-R168 PolarHBondContact O-N 2.73Å; G165-K169 PolarHBondContact O-N 2.77Å
166	D	98.4	Very high	98	Very high	50 Å²	50	45.6 Å²	45.6	27%	0.267	25%	0.251	S	S	.	.	H	α-helix	trans	-74	-24.7	179.2	-68.9	-33.4	0	0	0	113	R168 K169 L170 V210 I214 L252	D166-R168 VanDerWaalsContact C-N 3.35Å; D166-R168 PolarHBondContact O-N 2.7Å; D166-K169 PolarHBondContact O-N 2.79Å; D166-K169 WeakPolarHBondContact OD1-CD 3.4Å; D166-K169 WeakPolarHBondContact OD1-CE 3.23Å; D166-K169 IonicContact OD1-NZ 2.73Å; D166-K169 PolarHBondContact OD1-NZ 2.86Å; D166-L170 PolarHBondContact O-N 2.75Å; D166-V210 HydrophobicContact CB-CB 4.48Å; D166-V210 HydrophobicContact CB-CG1 3.64Å; D166-I214 HydrophobicContact CB-CD1 4.49Å; D166-L252 HydrophobicContact CB-CD1 4.08Å; D166-L252 HydrophobicContact CB-CD2 4.01Å
167	F	98.5	Very high	98	Very high	16 Å²	16	42.6 Å²	42.6	7%	0.07	24%	0.238	C	C	.	.	H	α-helix	trans	-59.2	-46.6	171.2	173.9	-123.2	0	0	0	110.9	E125 L128 I129 T163 G165 K169 L170 M171 D251 A255	E125-F167 HydrophobicContact CB-CE1 4.4Å; E125-F167 HydrophobicContact CB-CZ 4.16Å; E125-F167 HydrophobicContact CG-CE1 3.83Å; E125-F167 HydrophobicContact CG-CZ 4.11Å; L128-F167 HydrophobicContact CD2-CE1 4.47Å; L128-F167 HydrophobicContact CD2-CZ 4.15Å; I129-F167 HydrophobicContact CD1-CE2 3.75Å; I129-F167 HydrophobicContact CD1-CZ 4.08Å; I129-F167 HydrophobicContact CG1-CE2 3.66Å; I129-F167 HydrophobicContact CG1-CZ 3.98Å; T163-F167 HydrophobicContact CG2-CD1 4.03Å; T163-F167 HydrophobicContact CG2-CE1 3.57Å; T163-F167 HydrophobicContact CG2-CZ 4.4Å; G165-F167 VanDerWaalsContact C-N 3.33Å; F167-K169 VanDerWaalsContact C-N 3.34Å; F167-K169 PolarHBondContact O-N 3.34Å; F167-L170 PolarHBondContact O-N 2.88Å; F167-M171 HydrophobicContact CD2-CE 4.43Å; F167-M171 HydrophobicContact CD2-CG 3.94Å; F167-M171 HydrophobicContact CE1-CG 4.35Å; F167-M171 HydrophobicContact CE2-CE 3.96Å; F167-M171 HydrophobicContact CE2-CG 3.44Å; F167-M171 VanDerWaalsContact CE2-CG 3.44Å; F167-M171 HydrophobicContact CE2-SD 3.74Å; F167-M171 HydrophobicContact CZ-CG 3.69Å; F167-M171 HydrophobicContact CZ-SD 4.14Å; F167-M171 WeakPolarHBondContact O-CG 3.35Å; F167-M171 PolarHBondContact O-N 3.31Å; F167-D251 HydrophobicContact CB-CB 4.45Å; F167-D251 HydrophobicContact CD1-CB 3.91Å; F167-D251 HydrophobicContact CD2-CB 3.94Å; F167-D251 HydrophobicContact CE1-CB 4.09Å; F167-D251 HydrophobicContact CE2-CB 4.15Å; F167-D251 HydrophobicContact CG-CB 3.83Å; F167-D251 HydrophobicContact CZ-CB 4.22Å; F167-A255 HydrophobicContact CD2-CB 3.98Å; F167-A255 HydrophobicContact CE2-CB 3.95Å
168	R	98.5	Very high	98	Very high	87 Å²	87	45.4 Å²	45.4	33%	0.328	25%	0.245	S	C	.	.	H	α-helix	trans	-54.6	-48.4	171.7	-179.8	-168.8	-67.9	-179.7	-1.2	111.7	I160 T163 S164 G165 D166 L170 M171 V172	I160-R168 HydrophobicContact CG1-CG 4.4Å; I160-R168 PolarHBondContact O-NE 2.93Å; I160-R168 VanDerWaalsContact O-NE 3.08Å; I160-R168 PolarHBondContact O-NH2 3.41Å; T163-R168 PolarHBondContact O-NE 3.46Å; T163-R168 PolarHBondContact O-NH2 3.27Å; T163-R168 VanDerWaalsContact OG1-CA 3.3Å; T163-R168 WeakPolarHBondContact OG1-CA 3.48Å; T163-R168 WeakPolarHBondContact OG1-CB 3.43Å; T163-R168 WeakPolarHBondContact OG1-CG 3.35Å; S164-R168 PolarHBondContact O-N 2.73Å; G165-R168 WeakPolarHBondContact O-CB 3.45Å; G165-R168 PolarHBondContact O-N 2.73Å; D166-R168 VanDerWaalsContact C-N 3.35Å; D166-R168 PolarHBondContact O-N 2.7Å; R168-L170 VanDerWaalsContact C-N 3.31Å; R168-L170 PolarHBondContact O-N 2.95Å; R168-M171 PolarHBondContact O-N 3.11Å; R168-V172 HydrophobicContact CG-CG2 4.18Å; R168-V172 WeakPolarHBondContact O-CB 3.47Å; R168-V172 VanDerWaalsContact O-CG2 3.27Å; R168-V172 WeakPolarHBondContact O-CG2 3.43Å; R168-V172 PolarHBondContact O-N 3.48Å
169	K	98.6	Very high	98	Very high	113 Å²	113	46 Å²	46	49%	0.491	25%	0.246	S	C	.	.	H	α-helix	trans	-59.9	-42.9	-177.8	-65.3	177.7	-165.8	159.1	0	111.3	G165 D166 F167 A173 I214	G165-K169 PolarHBondContact O-N 2.77Å; D166-K169 PolarHBondContact O-N 2.79Å; D166-K169 WeakPolarHBondContact OD1-CD 3.4Å; D166-K169 WeakPolarHBondContact OD1-CE 3.23Å; D166-K169 IonicContact OD1-NZ 2.73Å; D166-K169 PolarHBondContact OD1-NZ 2.86Å; F167-K169 VanDerWaalsContact C-N 3.34Å; F167-K169 PolarHBondContact O-N 3.34Å; K169-A173 VanDerWaalsContact O-CB 3.25Å; K169-A173 WeakPolarHBondContact O-CB 3.25Å; K169-A173 PolarHBondContact O-N 2.99Å; K169-I214 HydrophobicContact CB-CD1 3.83Å
170	L	98.7	Very high	97.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-65.6	-48.1	177.7	178.4	56.5	0	0	0	111.8	D166 F167 R168 V172 A173 L174 I214 T218 L252 A255 F256 L259	D166-L170 PolarHBondContact O-N 2.75Å; F167-L170 PolarHBondContact O-N 2.88Å; R168-L170 VanDerWaalsContact C-N 3.31Å; R168-L170 PolarHBondContact O-N 2.95Å; L170-V172 PolarHBondContact O-N 3.41Å; L170-A173 PolarHBondContact O-N 3.3Å; L170-L174 HydrophobicContact CD1-CD1 4.02Å; L170-L174 HydrophobicContact CD1-CG 4.2Å; L170-L174 HydrophobicContact CG-CD1 4.25Å; L170-L174 WeakPolarHBondContact O-CG 3.49Å; L170-L174 PolarHBondContact O-N 3.42Å; L170-I214 HydrophobicContact CB-CD1 4.02Å; L170-I214 HydrophobicContact CB-CG1 4.14Å; L170-I214 HydrophobicContact CD1-CG1 4.28Å; L170-I214 HydrophobicContact CD1-CG2 4.36Å; L170-T218 HydrophobicContact CD1-CG2 3.57Å; L170-L252 HydrophobicContact CD2-CD1 4.29Å; L170-A255 HydrophobicContact CD2-CB 3.6Å; L170-F256 HydrophobicContact CD1-CE1 4.24Å; L170-F256 HydrophobicContact CD2-CD1 3.94Å; L170-F256 HydrophobicContact CD2-CD2 4.22Å; L170-F256 HydrophobicContact CD2-CE1 3.96Å; L170-F256 HydrophobicContact CD2-CE2 4.25Å; L170-F256 HydrophobicContact CD2-CG 4.07Å; L170-F256 HydrophobicContact CD2-CZ 4.12Å; L170-L259 HydrophobicContact CD1-CD2 4.23Å
171	M	98.7	Very high	97.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.6	-43.5	178.7	-68	-59.1	96.3	0	0	111.9	L128 I129 I132 I159 F167 R168 L174 A175 A255	L128-M171 HydrophobicContact CD2-CG 4.29Å; L128-M171 HydrophobicContact CG-SD 4.2Å; I129-M171 HydrophobicContact CG1-CE 4.41Å; I129-M171 HydrophobicContact CG1-SD 4.18Å; I132-M171 HydrophobicContact CB-SD 4.18Å; I132-M171 HydrophobicContact CG2-SD 4.12Å; I159-M171 HydrophobicContact CG2-CB 3.78Å; F167-M171 HydrophobicContact CD2-CE 4.43Å; F167-M171 HydrophobicContact CD2-CG 3.94Å; F167-M171 HydrophobicContact CE1-CG 4.35Å; F167-M171 HydrophobicContact CE2-CE 3.96Å; F167-M171 HydrophobicContact CE2-CG 3.44Å; F167-M171 VanDerWaalsContact CE2-CG 3.44Å; F167-M171 HydrophobicContact CE2-SD 3.74Å; F167-M171 HydrophobicContact CZ-CG 3.69Å; F167-M171 HydrophobicContact CZ-SD 4.14Å; F167-M171 WeakPolarHBondContact O-CG 3.35Å; F167-M171 PolarHBondContact O-N 3.31Å; R168-M171 PolarHBondContact O-N 3.11Å; M171-L174 HydrophobicContact CE-CD1 4.04Å; M171-L174 PolarHBondContact O-N 2.9Å; M171-A175 WeakPolarHBondContact O-CB 3.46Å; M171-A175 PolarHBondContact O-N 3.4Å; M171-A255 HydrophobicContact CE-CB 3.68Å
172	V	98.7	Very high	97.4	Very high	17 Å²	17	52.8 Å²	52.8	10%	0.103	28%	0.278	C	S	.	.	H	α-helix	trans	-64.8	-42.1	176.3	169.7	0	0	0	0	111.5	E156 I159 I160 R168 L170 K176	E156-V172 HydrophobicContact CG-CG1 3.94Å; E156-V172 HydrophobicContact CG-CG2 4.41Å; I159-V172 HydrophobicContact CG2-CG2 3.87Å; I160-V172 HydrophobicContact CD1-CG2 4.36Å; I160-V172 HydrophobicContact CG1-CG2 3.72Å; R168-V172 HydrophobicContact CG-CG2 4.18Å; R168-V172 WeakPolarHBondContact O-CB 3.47Å; R168-V172 VanDerWaalsContact O-CG2 3.27Å; R168-V172 WeakPolarHBondContact O-CG2 3.43Å; R168-V172 PolarHBondContact O-N 3.48Å; L170-V172 PolarHBondContact O-N 3.41Å; V172-K176 WeakPolarHBondContact O-CG 3.5Å; V172-K176 PolarHBondContact O-N 2.97Å
173	A	98.6	Very high	96.9	Very high	31 Å²	31	52.8 Å²	52.8	26%	0.256	29%	0.289	S	S	.	.	H	α-helix	trans	-61.9	-44.7	178.9	0	0	0	0	0	111.8	K169 L170 I214 T218	K169-A173 VanDerWaalsContact O-CB 3.25Å; K169-A173 WeakPolarHBondContact O-CB 3.25Å; K169-A173 PolarHBondContact O-N 2.99Å; L170-A173 PolarHBondContact O-N 3.3Å; A173-I214 HydrophobicContact CB-CG2 4.02Å; A173-T218 HydrophobicContact CB-CG2 3.95Å
174	L	98.6	Very high	96.5	Very high	14 Å²	14	58.6 Å²	58.6	7%	0.073	33%	0.33	C	S	.	.	H	α-helix	trans	-67.9	-49.7	176.2	-71.7	172.7	0	0	0	111.9	I132 L140 L170 M171 K176 G177 T218 L259	I132-L174 HydrophobicContact CG2-CB 3.36Å; I132-L174 HydrophobicContact CG2-CD1 4.03Å; I132-L174 HydrophobicContact CG2-CG 4.36Å; L140-L174 VanDerWaalsContact CD1-O 3.31Å; L140-L174 WeakPolarHBondContact CD1-O 3.48Å; L170-L174 HydrophobicContact CD1-CD1 4.02Å; L170-L174 HydrophobicContact CD1-CG 4.2Å; L170-L174 HydrophobicContact CG-CD1 4.25Å; L170-L174 WeakPolarHBondContact O-CG 3.49Å; L170-L174 PolarHBondContact O-N 3.42Å; M171-L174 HydrophobicContact CE-CD1 4.04Å; M171-L174 PolarHBondContact O-N 2.9Å; L174-K176 PolarHBondContact O-N 3.25Å; L174-G177 PolarHBondContact O-N 3.16Å; L174-T218 HydrophobicContact CD2-CG2 3.72Å; L174-T218 HydrophobicContact CG-CG2 3.83Å; L174-L259 HydrophobicContact CD1-CD1 4.27Å; L174-L259 HydrophobicContact CD1-CD2 4.25Å; L174-L259 HydrophobicContact CD2-CD1 3.88Å; L174-L259 HydrophobicContact CD2-CD2 4.19Å
175	A	98.6	Very high	96.3	Very high	3 Å²	3	60.4 Å²	60.4	3%	0.025	34%	0.337	C	S	.	.	H	α-helix	trans	-57.2	-22	-175.5	0	0	0	0	0	113.5	I132 N144 I159 M171 G177	I132-A175 HydrophobicContact CD1-CB 3.97Å; I132-A175 HydrophobicContact CG2-CB 4.47Å; N144-A175 PolarHBondContact ND2-O 3.28Å; I159-A175 HydrophobicContact CD1-CB 3.66Å; M171-A175 WeakPolarHBondContact O-CB 3.46Å; M171-A175 PolarHBondContact O-N 3.4Å; A175-G177 PolarHBondContact O-N 3.46Å
176	K	97.2	Very high	96.1	Very high	62 Å²	62	61.6 Å²	61.6	27%	0.27	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-24.6	173.9	-75.6	172.6	-177	-177	0	113.8	Q141 E156 V172 L174 R178	Q141-K176 PolarHBondContact NE2-O 3.03Å; E156-K176 WeakPolarHBondContact OE1-CE 3.28Å; E156-K176 IonicContact OE1-NZ 3.77Å; E156-K176 PolarHBondContact OE1-NZ 3.24Å; E156-K176 WeakPolarHBondContact OE2-CE 3.29Å; E156-K176 IonicContact OE2-NZ 3.31Å; V172-K176 WeakPolarHBondContact O-CG 3.5Å; V172-K176 PolarHBondContact O-N 2.97Å; L174-K176 PolarHBondContact O-N 3.25Å; K176-R178 HydrophobicContact CB-CG 4.29Å; K176-R178 WeakPolarHBondContact O-CG 3.38Å; K176-R178 PolarHBondContact O-N 3.36Å
177	G	97.6	Very high	96	Very high	4 Å²	4	62.8 Å²	62.8	4%	0.041	34%	0.337	C	S	.	.			trans	58.7	45.5	179.9	0	0	0	0	0	113.1	N137 Q141 L174 A175	N137-G177 WeakPolarHBondContact CB-O 3.31Å; N137-G177 VanDerWaalsContact CG-O 3.32Å; N137-G177 WeakPolarHBondContact OD1-CA 3.29Å; N137-G177 PolarHBondContact OD1-O 3.03Å; Q141-G177 PolarHBondContact NE2-O 3.02Å; L174-G177 PolarHBondContact O-N 3.16Å; A175-G177 PolarHBondContact O-N 3.46Å
178	R	97.6	Very high	96	Very high	182 Å²	182	69.9 Å²	69.9	69%	0.687	37%	0.365	S	S	*	.			trans	-125.3	29.9	-178.1	-58.9	-174.7	-59.2	168.9	8	112.7	N137 K176	N137-R178 PolarHBondContact OD1-N 2.78Å; K176-R178 HydrophobicContact CB-CG 4.29Å; K176-R178 WeakPolarHBondContact O-CG 3.38Å; K176-R178 PolarHBondContact O-N 3.36Å
179	R	97.5	Very high	95.9	Very high	37 Å²	37	73.4 Å²	73.4	14%	0.14	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-58.3	145.5	171.3	-176.5	-179.1	-65.3	-74	-1.9	109.1	N137 E181 M217 T218 R220	N137-R179 PolarHBondContact ND2-N 3.05Å; N137-R179 PolarHBondContact ND2-O 3.48Å; N137-R179 WeakPolarHBondContact OD1-CB 3.32Å; N137-R179 PolarHBondContact OD1-N 2.83Å; R179-E181 PolarHBondContact O-N 3.46Å; R179-M217 VanDerWaalsContact CZ-O 3.31Å; R179-M217 PolarHBondContact NH1-O 2.93Å; R179-M217 PolarHBondContact NH2-O 3.49Å; R179-T218 PolarHBondContact NH1-O 2.99Å; R179-R220 WeakPolarHBondContact CD-O 3.33Å; R179-R220 WeakPolarHBondContact CG-O 3.18Å; R179-R220 PolarHBondContact NH1-O 3.46Å
180	A	97	Very high	95.9	Very high	54 Å²	54	70.7 Å²	70.7	45%	0.446	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-56.8	131.9	171.3	0	0	0	0	0	110.2	E219 S221	A180-E219 WeakPolarHBondContact CB-O 3.42Å; A180-E219 PolarHBondContact N-O 3.37Å; A180-S221 VanDerWaalsContact O-CA 3.26Å; A180-S221 WeakPolarHBondContact O-CA 3.4Å; A180-S221 WeakPolarHBondContact O-CB 3.27Å
181	E	94.6	Very high	95.9	Very high	146 Å²	146	71.2 Å²	71.2	68%	0.682	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-65.5	155.8	172.1	-65.6	-57.2	148.4	0	0	110.3	N137 R179 G183	N137-E181 PolarHBondContact ND2-OE1 2.71Å; R179-E181 PolarHBondContact O-N 3.46Å; E181-G183 PolarHBondContact O-N 2.89Å
182	D	89.9	Confident	95.9	Very high	103 Å²	103	72.8 Å²	72.8	55%	0.551	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-68.9	124.3	178.9	-167.6	44.1	0	0	0	111.1	S221 P223	D182-S221 PolarHBondContact OD1-OG 3.4Å; D182-P223 HydrophobicContact CB-CG 4.14Å; D182-P223 VanDerWaalsContact CG-CG 3.48Å; D182-P223 WeakPolarHBondContact OD1-CB 3.45Å; D182-P223 WeakPolarHBondContact OD1-CG 3.27Å
183	G	86.3	Confident	95.9	Very high	48 Å²	48	76.6 Å²	76.6	50%	0.495	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-88.6	154.5	175.2	0	0	0	0	0	111.3	E181 V185	E181-G183 PolarHBondContact O-N 2.89Å; G183-V185 PolarHBondContact O-N 2.92Å
184	S	88	Confident	95.9	Very high	130 Å²	130	75.2 Å²	75.2	91%	0.909	39%	0.392	S	S	*	.	S	Bend	trans	-69.6	-17.7	173.3	55.3	0	0	0	0	113.6
185	V	91.9	Very high	95.9	Very high	121 Å²	121	74.5 Å²	74.5	73%	0.733	39%	0.388	S	S	*	.	S	Bend	trans	-98.5	127	-177.8	-178.9	0	0	0	0	109.8	G183	G183-V185 PolarHBondContact O-N 2.92Å
186	I	95	Very high	95.9	Very high	76 Å²	76	79.6 Å²	79.6	39%	0.39	41%	0.407	S	S	.	.			trans	-85.2	112.6	171.8	-58.8	169.1	0	0	0	108.4	Y188 I191 K227	I186-Y188 HydrophobicContact CB-CE2 4.16Å; I186-Y188 HydrophobicContact CG2-CD1 4.04Å; I186-Y188 HydrophobicContact CG2-CD2 4.26Å; I186-Y188 HydrophobicContact CG2-CE1 3.69Å; I186-Y188 HydrophobicContact CG2-CE2 3.94Å; I186-Y188 HydrophobicContact CG2-CG 4.31Å; I186-Y188 PolarHBondContact O-N 3.18Å; I186-I191 HydrophobicContact CG2-CD1 3.7Å; I186-K227 HydrophobicContact CG2-CD 3.86Å
187	D	96.2	Very high	96	Very high	74 Å²	74	78.3 Å²	78.3	40%	0.396	40%	0.403	S	S	.	.			trans	-88.4	89	177.5	-170.7	-19.6	0	0	0	111	E189 L190 I191	D187-E189 VanDerWaalsContact C-N 3.28Å; D187-E189 PolarHBondContact O-N 3Å; D187-E189 PolarHBondContact OD1-N 3.48Å; D187-L190 HydrophobicContact CB-CB 3.99Å; D187-L190 PolarHBondContact O-N 2.89Å; D187-L190 WeakPolarHBondContact OD1-CB 3.44Å; D187-L190 PolarHBondContact OD1-N 2.86Å; D187-L190 WeakPolarHBondContact OD2-CB 3.25Å; D187-I191 WeakPolarHBondContact O-CD1 3.34Å; D187-I191 VanDerWaalsContact O-CG1 3.22Å; D187-I191 WeakPolarHBondContact O-CG1 3.3Å; D187-I191 PolarHBondContact O-N 2.96Å
188	Y	97.4	Very high	96	Very high	165 Å²	165	78.1 Å²	78.1	65%	0.647	40%	0.401	S	S	*	.	H	α-helix	trans	-65.3	-29	-178.6	-65.8	-75.8	0	0	0	113.7	I186 I191 D192	I186-Y188 HydrophobicContact CB-CE2 4.16Å; I186-Y188 HydrophobicContact CG2-CD1 4.04Å; I186-Y188 HydrophobicContact CG2-CD2 4.26Å; I186-Y188 HydrophobicContact CG2-CE1 3.69Å; I186-Y188 HydrophobicContact CG2-CE2 3.94Å; I186-Y188 HydrophobicContact CG2-CG 4.31Å; I186-Y188 PolarHBondContact O-N 3.18Å; Y188-I191 HydrophobicContact CD1-CD1 4.46Å; Y188-D192 PolarHBondContact O-N 3.27Å
189	E	98	Very high	96.1	Very high	162 Å²	162	71.9 Å²	71.9	76%	0.757	38%	0.378	S	S	*	.	H	α-helix	trans	-70.5	-46.7	178	-175.2	174.1	-178	0	0	110	D187 I191 D192 Q193	D187-E189 VanDerWaalsContact C-N 3.28Å; D187-E189 PolarHBondContact O-N 3Å; D187-E189 PolarHBondContact OD1-N 3.48Å; E189-I191 VanDerWaalsContact C-N 3.3Å; E189-I191 PolarHBondContact O-N 3.33Å; E189-D192 PolarHBondContact O-N 3.46Å; E189-Q193 WeakPolarHBondContact O-CB 3.44Å; E189-Q193 PolarHBondContact O-N 3.01Å
190	L	98.1	Very high	96.1	Very high	56 Å²	56	73.3 Å²	73.3	29%	0.293	39%	0.388	S	S	.	.	H	α-helix	trans	-64.2	-35.6	174.6	-173.9	61.6	0	0	0	112.1	D187 Q193 D194	D187-L190 HydrophobicContact CB-CB 3.99Å; D187-L190 PolarHBondContact O-N 2.89Å; D187-L190 WeakPolarHBondContact OD1-CB 3.44Å; D187-L190 PolarHBondContact OD1-N 2.86Å; D187-L190 WeakPolarHBondContact OD2-CB 3.25Å; L190-Q193 PolarHBondContact O-N 3.49Å; L190-D194 WeakPolarHBondContact O-CB 3.35Å; L190-D194 PolarHBondContact O-N 3.25Å
191	I	98.6	Very high	96.2	Very high	11 Å²	11	71 Å²	71	6%	0.056	37%	0.369	C	S	.	.	H	α-helix	trans	-60.8	-47.1	174.1	-72.6	162.6	0	0	0	111	I186 D187 Y188 E189 A195 H224 K227 V228 R231	I186-I191 HydrophobicContact CG2-CD1 3.7Å; D187-I191 WeakPolarHBondContact O-CD1 3.34Å; D187-I191 VanDerWaalsContact O-CG1 3.22Å; D187-I191 WeakPolarHBondContact O-CG1 3.3Å; D187-I191 PolarHBondContact O-N 2.96Å; Y188-I191 HydrophobicContact CD1-CD1 4.46Å; E189-I191 VanDerWaalsContact C-N 3.3Å; E189-I191 PolarHBondContact O-N 3.33Å; I191-A195 VanDerWaalsContact O-CB 3.28Å; I191-A195 WeakPolarHBondContact O-CB 3.45Å; I191-A195 PolarHBondContact O-N 2.55Å; I191-A195 VanDerWaalsContact O-N 3.07Å; I191-H224 VanDerWaalsContact CG1-CE1 3.49Å; I191-H224 WeakPolarHBondContact CG1-CE1 3.37Å; I191-K227 HydrophobicContact CD1-CB 3.71Å; I191-K227 HydrophobicContact CD1-CD 3.61Å; I191-K227 HydrophobicContact CD1-CG 4.31Å; I191-K227 HydrophobicContact CG1-CB 4.17Å; I191-K227 HydrophobicContact CG2-CB 4.19Å; I191-V228 HydrophobicContact CB-CG2 4.42Å; I191-V228 HydrophobicContact CG1-CG2 4.32Å; I191-V228 HydrophobicContact CG2-CG2 4.32Å; I191-R231 HydrophobicContact CG2-CB 3.92Å; I191-R231 HydrophobicContact CG2-CG 4.27Å
192	D	98.7	Very high	96.4	Very high	33 Å²	33	64 Å²	64	18%	0.176	34%	0.336	C	S	.	.	H	α-helix	trans	-64.3	-43.7	177.9	-162.4	70.9	0	0	0	111.3	Y188 E189 A195 R196 R231 Y235	Y188-D192 PolarHBondContact O-N 3.27Å; E189-D192 PolarHBondContact O-N 3.46Å; D192-A195 PolarHBondContact O-N 3.36Å; D192-R196 WeakPolarHBondContact O-CG 3.24Å; D192-R196 PolarHBondContact O-N 2.53Å; D192-R196 IonicContact OD2-CZ 2.84Å; D192-R196 IonicContact OD2-NE 3.45Å; D192-R196 PolarHBondContact OD2-NE 2.96Å; D192-R196 IonicContact OD2-NH2 2.73Å; D192-R196 PolarHBondContact OD2-NH2 3.42Å; D192-R231 IonicContact OD1-CZ 3.38Å; D192-R231 IonicContact OD1-NE 3.84Å; D192-R231 PolarHBondContact OD1-NE 2.86Å; D192-R231 IonicContact OD1-NH2 2.69Å; D192-R231 PolarHBondContact OD1-NH2 2.56Å; D192-Y235 PolarHBondContact OD1-OH 3.48Å; D192-Y235 PolarHBondContact OD2-OH 2.82Å; D192-Y235 VanDerWaalsContact OD2-OH 3.11Å
193	Q	98.7	Very high	96.7	Very high	96 Å²	96	60.6 Å²	60.6	45%	0.449	32%	0.319	S	S	.	.	H	α-helix	trans	-64.1	-49.3	179.9	-172.8	61	56.7	0	0	111.9	E189 L190 A195 R196 D197	E189-Q193 WeakPolarHBondContact O-CB 3.44Å; E189-Q193 PolarHBondContact O-N 3.01Å; L190-Q193 PolarHBondContact O-N 3.49Å; Q193-A195 VanDerWaalsContact C-N 3.29Å; Q193-A195 PolarHBondContact O-N 3.36Å; Q193-R196 PolarHBondContact O-N 3.45Å; Q193-D197 PolarHBondContact NE2-OD1 3.05Å; Q193-D197 WeakPolarHBondContact O-CB 3.46Å; Q193-D197 PolarHBondContact O-N 3.14Å
194	D	98.8	Very high	97.2	Very high	2 Å²	2	64 Å²	64	1%	0.011	32%	0.32	C	S	.	.	H	α-helix	trans	-63.2	-36.7	178.3	-75.5	-23	0	0	0	111.2	L190 D197 L198 I216 R220 H224 V228	L190-D194 WeakPolarHBondContact O-CB 3.35Å; L190-D194 PolarHBondContact O-N 3.25Å; D194-D197 PolarHBondContact O-N 3.28Å; D194-L198 WeakPolarHBondContact O-CB 3.39Å; D194-L198 VanDerWaalsContact O-CG 3.29Å; D194-L198 WeakPolarHBondContact O-CG 3.47Å; D194-L198 PolarHBondContact O-N 3.45Å; D194-I216 HydrophobicContact CB-CD1 4.3Å; D194-I216 HydrophobicContact CB-CG2 4.12Å; D194-R220 IonicContact OD1-CZ 2.74Å; D194-R220 IonicContact OD1-NE 3.21Å; D194-R220 PolarHBondContact OD1-NE 3.24Å; D194-R220 IonicContact OD1-NH2 2.73Å; D194-R220 PolarHBondContact OD1-NH2 3.45Å; D194-R220 WeakPolarHBondContact OD2-CD 3.32Å; D194-R220 IonicContact OD2-CZ 3.34Å; D194-R220 IonicContact OD2-NE 3.68Å; D194-R220 PolarHBondContact OD2-NE 3.38Å; D194-R220 IonicContact OD2-NH2 2.71Å; D194-H224 IonicContact OD2-CD2 3.16Å; D194-H224 IonicContact OD2-CE1 2.82Å; D194-H224 IonicContact OD2-NE2 2.82Å; D194-H224 PolarHBondContact OD2-NE2 3.35Å; D194-V228 HydrophobicContact CB-CG1 4Å; D194-V228 HydrophobicContact CB-CG2 3.87Å
195	A	98.8	Very high	97.6	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.2	-42.4	175.9	0	0	0	0	0	112.1	I191 D192 Q193 Y199 V228 R231 Y235	I191-A195 VanDerWaalsContact O-CB 3.28Å; I191-A195 WeakPolarHBondContact O-CB 3.45Å; I191-A195 PolarHBondContact O-N 2.55Å; I191-A195 VanDerWaalsContact O-N 3.07Å; D192-A195 PolarHBondContact O-N 3.36Å; Q193-A195 VanDerWaalsContact C-N 3.29Å; Q193-A195 PolarHBondContact O-N 3.36Å; A195-Y199 PolarHBondContact O-N 2.68Å; A195-V228 HydrophobicContact CB-CG1 4.26Å; A195-R231 HydrophobicContact CB-CB 3.96Å; A195-R231 HydrophobicContact CB-CG 3.7Å; A195-Y235 HydrophobicContact CB-CD2 4.24Å; A195-Y235 HydrophobicContact CB-CE2 4.34Å
196	R	98.4	Very high	97.7	Very high	109 Å²	109	68.2 Å²	68.2	41%	0.411	31%	0.309	S	S	.	.	H	α-helix	trans	-65.9	-45.6	173.3	-70.3	179.4	-165.3	-146.1	5.5	111.8	D192 Q193 L198 Y199 D200 Y235	D192-R196 WeakPolarHBondContact O-CG 3.24Å; D192-R196 PolarHBondContact O-N 2.53Å; D192-R196 IonicContact OD2-CZ 2.84Å; D192-R196 IonicContact OD2-NE 3.45Å; D192-R196 PolarHBondContact OD2-NE 2.96Å; D192-R196 IonicContact OD2-NH2 2.73Å; D192-R196 PolarHBondContact OD2-NH2 3.42Å; Q193-R196 PolarHBondContact O-N 3.45Å; R196-L198 VanDerWaalsContact C-N 3.3Å; R196-L198 PolarHBondContact O-N 3.02Å; R196-Y199 PolarHBondContact O-N 2.89Å; R196-Y199 VanDerWaalsContact O-N 3.1Å; R196-D200 WeakPolarHBondContact O-CB 3.25Å; R196-D200 PolarHBondContact O-N 2.65Å; R196-Y235 HydrophobicContact CG-CD1 4.15Å; R196-Y235 HydrophobicContact CG-CD2 4.15Å; R196-Y235 HydrophobicContact CG-CE1 3.72Å; R196-Y235 HydrophobicContact CG-CE2 3.72Å; R196-Y235 HydrophobicContact CG-CG 4.36Å; R196-Y235 VanDerWaalsContact CG-CZ 3.5Å; R196-Y235 PolarHBondContact NE-OH 3.38Å; R196-Y235 PolarHBondContact NH2-OH 3.16Å; R196-Y235 VanDerWaalsContact NH2-OH 3.1Å
197	D	98.7	Very high	97.7	Very high	35 Å²	35	66.9 Å²	66.9	19%	0.187	31%	0.314	C	S	.	.	H	α-helix	trans	-58.9	-42.1	179.3	-88	25.4	0	0	0	111.3	Q193 D194 Y199 A201 K212 I216	Q193-D197 PolarHBondContact NE2-OD1 3.05Å; Q193-D197 WeakPolarHBondContact O-CB 3.46Å; Q193-D197 PolarHBondContact O-N 3.14Å; D194-D197 PolarHBondContact O-N 3.28Å; D197-Y199 VanDerWaalsContact C-N 3.34Å; D197-Y199 PolarHBondContact O-N 3.07Å; D197-A201 WeakPolarHBondContact O-CB 3.44Å; D197-A201 PolarHBondContact O-N 3.43Å; D197-K212 HydrophobicContact CB-CD 4.22Å; D197-K212 HydrophobicContact CB-CG 4.48Å; D197-K212 IonicContact OD2-NZ 2.79Å; D197-K212 PolarHBondContact OD2-NZ 2.79Å; D197-I216 HydrophobicContact CB-CD1 3.67Å
198	L	98.7	Very high	97.6	Very high	0 Å²	0	65 Å²	65	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-62.5	-40.5	175.3	-74.1	174.8	0	0	0	112	D194 R196 G202 W213 I216 M217 V228 F229 Y232 M240	D194-L198 WeakPolarHBondContact O-CB 3.39Å; D194-L198 VanDerWaalsContact O-CG 3.29Å; D194-L198 WeakPolarHBondContact O-CG 3.47Å; D194-L198 PolarHBondContact O-N 3.45Å; R196-L198 VanDerWaalsContact C-N 3.3Å; R196-L198 PolarHBondContact O-N 3.02Å; L198-G202 PolarHBondContact O-N 3.47Å; L198-W213 HydrophobicContact CD2-CB 4.48Å; L198-W213 HydrophobicContact CD2-CG 3.97Å; L198-W213 PolarHBondContact O-NE1 2.84Å; L198-I216 HydrophobicContact CD1-CG2 4.25Å; L198-I216 HydrophobicContact CD2-CB 4.27Å; L198-I216 HydrophobicContact CD2-CD1 4.12Å; L198-I216 HydrophobicContact CD2-CG2 4.26Å; L198-I216 HydrophobicContact CG-CD1 4.05Å; L198-I216 HydrophobicContact CG-CG2 4.27Å; L198-M217 HydrophobicContact CD1-CE 4.46Å; L198-M217 HydrophobicContact CD2-CE 3.75Å; L198-V228 HydrophobicContact CD1-CG1 3.67Å; L198-F229 HydrophobicContact CD1-CD1 4.39Å; L198-F229 HydrophobicContact CD1-CE1 4.13Å; L198-Y232 HydrophobicContact CB-CD2 3.92Å; L198-Y232 HydrophobicContact CB-CE2 3.93Å; L198-M240 HydrophobicContact CD1-SD 4.02Å
199	Y	98.5	Very high	97.7	Very high	51 Å²	51	59.9 Å²	59.9	20%	0.2	29%	0.289	C	S	.	.	H	α-helix	trans	-69.7	-46.9	179	173.6	-116	0	0	0	111.7	A195 R196 D197 A201 G202 V203 K204	A195-Y199 PolarHBondContact O-N 2.68Å; R196-Y199 PolarHBondContact O-N 2.89Å; R196-Y199 VanDerWaalsContact O-N 3.1Å; D197-Y199 VanDerWaalsContact C-N 3.34Å; D197-Y199 PolarHBondContact O-N 3.07Å; Y199-A201 VanDerWaalsContact C-N 3.26Å; Y199-A201 PolarHBondContact O-N 2.95Å; Y199-G202 CarbonylContact O-C 3.47Å; Y199-G202 PolarHBondContact O-N 2.93Å; Y199-G202 VanDerWaalsContact O-N 3.16Å; Y199-V203 HydrophobicContact CD2-CB 3.98Å; Y199-V203 HydrophobicContact CD2-CG1 4.46Å; Y199-V203 HydrophobicContact CE2-CB 3.9Å; Y199-V203 HydrophobicContact CE2-CG1 3.92Å; Y199-V203 PolarHBondContact O-N 2.75Å; Y199-K204 HydrophobicContact CD1-CB 4.01Å; Y199-K204 HydrophobicContact CD1-CD 3.95Å; Y199-K204 HydrophobicContact CD1-CG 4.35Å; Y199-K204 HydrophobicContact CD2-CB 4.41Å; Y199-K204 HydrophobicContact CE1-CB 3.71Å; Y199-K204 HydrophobicContact CE1-CD 3.67Å; Y199-K204 HydrophobicContact CE1-CG 3.77Å; Y199-K204 HydrophobicContact CE2-CB 4.11Å; Y199-K204 HydrophobicContact CG-CB 4.36Å; Y199-K204 WeakPolarHBondContact O-CB 3.37Å; Y199-K204 PolarHBondContact O-N 3.08Å; Y199-K204 VanDerWaalsContact O-N 3.11Å
200	D	98.4	Very high	97.7	Very high	68 Å²	68	52.7 Å²	52.7	36%	0.364	26%	0.255	S	S	.	.	H	α-helix	trans	-63.9	-32.3	177.6	-77.9	25	0	0	0	111.8	R196 K204 R205	R196-D200 WeakPolarHBondContact O-CB 3.25Å; R196-D200 PolarHBondContact O-N 2.65Å; D200-K204 HydrophobicContact CB-CD 4.26Å; D200-K204 WeakPolarHBondContact OD1-CD 3.45Å; D200-K204 WeakPolarHBondContact OD1-CE 3.36Å; D200-K204 IonicContact OD1-NZ 2.55Å; D200-K204 PolarHBondContact OD1-NZ 3.28Å; D200-K204 IonicContact OD2-NZ 3.66Å; D200-K204 PolarHBondContact OD2-NZ 3.04Å; D200-R205 WeakPolarHBondContact O-CD 3.49Å; D200-R205 VanDerWaalsContact O-CG 3.29Å; D200-R205 WeakPolarHBondContact O-CG 3.31Å
201	A	98.3	Very high	97.7	Very high	4 Å²	4	53.4 Å²	53.4	3%	0.033	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-10.7	176	0	0	0	0	0	114.5	D197 Y199 T208 D209 K212	D197-A201 WeakPolarHBondContact O-CB 3.44Å; D197-A201 PolarHBondContact O-N 3.43Å; Y199-A201 VanDerWaalsContact C-N 3.26Å; Y199-A201 PolarHBondContact O-N 2.95Å; A201-T208 CarbonylContact O-C 3.52Å; A201-T208 WeakPolarHBondContact O-CA 3.46Å; A201-T208 WeakPolarHBondContact O-CG2 3.33Å; A201-D209 HydrophobicContact CB-CB 3.89Å; A201-D209 PolarHBondContact O-N 3.19Å; A201-K212 HydrophobicContact CB-CB 4.01Å; A201-K212 HydrophobicContact CB-CG 3.85Å
202	G	98.1	Very high	97.7	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.3	-104.4	-179.5	0	0	0	0	0	111.7	L198 Y199 K204 R205 E247	L198-G202 PolarHBondContact O-N 3.47Å; Y199-G202 CarbonylContact O-C 3.47Å; Y199-G202 PolarHBondContact O-N 2.93Å; Y199-G202 VanDerWaalsContact O-N 3.16Å; G202-K204 PolarHBondContact O-N 3.25Å; G202-R205 WeakPolarHBondContact O-CG 3.21Å; G202-R205 PolarHBondContact O-N 3.33Å; G202-E247 WeakPolarHBondContact CA-OE2 3.48Å
203	V	97.4	Very high	97.7	Very high	31 Å²	31	54.9 Å²	54.9	19%	0.188	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-31.4	-168.3	179.4	0	0	0	0	114.5	Y199 R205 Y232 P237 Y238 E247	Y199-V203 HydrophobicContact CD2-CB 3.98Å; Y199-V203 HydrophobicContact CD2-CG1 4.46Å; Y199-V203 HydrophobicContact CE2-CB 3.9Å; Y199-V203 HydrophobicContact CE2-CG1 3.92Å; Y199-V203 PolarHBondContact O-N 2.75Å; V203-R205 VanDerWaalsContact C-N 3.3Å; V203-R205 PolarHBondContact O-N 2.98Å; V203-Y232 WeakPolarHBondContact CG2-OH 3.27Å; V203-P237 HydrophobicContact CG1-CG 4.31Å; V203-Y238 HydrophobicContact CG1-CD2 4.01Å; V203-Y238 HydrophobicContact CG1-CE2 4.06Å; V203-Y238 HydrophobicContact CG2-CD2 4.19Å; V203-E247 HydrophobicContact CG2-CG 4.35Å
204	K	97.4	Very high	97.7	Very high	119 Å²	119	50.9 Å²	50.9	52%	0.517	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-23.3	-178.9	-168.2	-179.5	-178.3	-179.7	0	113.9	Y199 D200 G202	Y199-K204 HydrophobicContact CD1-CB 4.01Å; Y199-K204 HydrophobicContact CD1-CD 3.95Å; Y199-K204 HydrophobicContact CD1-CG 4.35Å; Y199-K204 HydrophobicContact CD2-CB 4.41Å; Y199-K204 HydrophobicContact CE1-CB 3.71Å; Y199-K204 HydrophobicContact CE1-CD 3.67Å; Y199-K204 HydrophobicContact CE1-CG 3.77Å; Y199-K204 HydrophobicContact CE2-CB 4.11Å; Y199-K204 HydrophobicContact CG-CB 4.36Å; Y199-K204 WeakPolarHBondContact O-CB 3.37Å; Y199-K204 PolarHBondContact O-N 3.08Å; Y199-K204 VanDerWaalsContact O-N 3.11Å; D200-K204 HydrophobicContact CB-CD 4.26Å; D200-K204 WeakPolarHBondContact OD1-CD 3.45Å; D200-K204 WeakPolarHBondContact OD1-CE 3.36Å; D200-K204 IonicContact OD1-NZ 2.55Å; D200-K204 PolarHBondContact OD1-NZ 3.28Å; D200-K204 IonicContact OD2-NZ 3.66Å; D200-K204 PolarHBondContact OD2-NZ 3.04Å; G202-K204 PolarHBondContact O-N 3.25Å
205	R	96.1	Very high	97.7	Very high	133 Å²	133	52.7 Å²	52.7	50%	0.502	26%	0.262	S	S	.	.	S	Bend	trans	-121.1	168.4	-171.1	58	173.9	-64.4	163.3	1.1	111.4	D200 G202 V203 G207	D200-R205 WeakPolarHBondContact O-CD 3.49Å; D200-R205 VanDerWaalsContact O-CG 3.29Å; D200-R205 WeakPolarHBondContact O-CG 3.31Å; G202-R205 WeakPolarHBondContact O-CG 3.21Å; G202-R205 PolarHBondContact O-N 3.33Å; V203-R205 VanDerWaalsContact C-N 3.3Å; V203-R205 PolarHBondContact O-N 2.98Å; R205-G207 VanDerWaalsContact CG-O 3.32Å; R205-G207 WeakPolarHBondContact CG-O 3.42Å; R205-G207 PolarHBondContact NE-O 3.22Å
206	K	93.8	Very high	97.7	Very high	208 Å²	208	52.8 Å²	52.8	90%	0.904	26%	0.263	S	S	*	.	S	Bend	trans	-81.2	122.1	168.8	-71.7	-173	178.5	-178.8	0	109.5
207	G	93.7	Very high	97.7	Very high	48 Å²	48	47.6 Å²	47.6	50%	0.495	24%	0.243	S	C	.	.	S	Bend	trans	70.9	169.6	-175.8	0	0	0	0	0	112.3	R205	R205-G207 VanDerWaalsContact CG-O 3.32Å; R205-G207 WeakPolarHBondContact CG-O 3.42Å; R205-G207 PolarHBondContact NE-O 3.22Å
208	T	96	Very high	97.7	Very high	33 Å²	33	46.5 Å²	46.5	20%	0.202	24%	0.238	C	C	.	.			trans	-112.9	134.5	-166.5	-40.5	0	0	0	0	111.7	A201 V210 W213 E247 V248	A201-T208 CarbonylContact O-C 3.52Å; A201-T208 WeakPolarHBondContact O-CA 3.46Å; A201-T208 WeakPolarHBondContact O-CG2 3.33Å; T208-V210 HydrophobicContact CG2-CG2 4.12Å; T208-V210 PolarHBondContact O-N 3.47Å; T208-W213 HydrophobicContact CG2-CD2 4.12Å; T208-W213 HydrophobicContact CG2-CE3 4.3Å; T208-W213 HydrophobicContact CG2-CH2 4.44Å; T208-W213 HydrophobicContact CG2-CZ2 4.27Å; T208-W213 HydrophobicContact CG2-CZ3 4.43Å; T208-E247 HydrophobicContact CG2-CB 4.14Å; T208-E247 WeakPolarHBondContact OG1-CB 3.5Å; T208-E247 PolarHBondContact OG1-O 2.84Å; T208-E247 VanDerWaalsContact OG1-O 3.1Å; T208-E247 PolarHBondContact OG1-OE2 3.35Å; T208-V248 HydrophobicContact CG2-CG1 4.36Å
209	D	98	Very high	97.7	Very high	59 Å²	59	51 Å²	51	32%	0.316	26%	0.259	S	S	.	.			trans	-79.5	76.6	163.8	-175.5	-9.3	0	0	0	109	A201 P211 K212 W213	A201-D209 HydrophobicContact CB-CB 3.89Å; A201-D209 PolarHBondContact O-N 3.19Å; D209-P211 VanDerWaalsContact OD1-CD 3.3Å; D209-P211 WeakPolarHBondContact OD1-CD 3.3Å; D209-K212 HydrophobicContact CB-CB 4.29Å; D209-K212 PolarHBondContact O-N 3.17Å; D209-K212 PolarHBondContact OD1-N 3.5Å; D209-W213 PolarHBondContact O-N 2.92Å
210	V	98.1	Very high	97.6	Very high	10 Å²	10	51.2 Å²	51.2	6%	0.061	26%	0.259	C	S	.	.	H	α-helix	trans	-56.8	-41.4	-179.8	179.6	0	0	0	0	112.5	D166 T208 K212 W213 I214 V248 L252 F256	D166-V210 HydrophobicContact CB-CB 4.48Å; D166-V210 HydrophobicContact CB-CG1 3.64Å; T208-V210 HydrophobicContact CG2-CG2 4.12Å; T208-V210 PolarHBondContact O-N 3.47Å; V210-K212 VanDerWaalsContact C-N 3.3Å; V210-K212 PolarHBondContact O-N 3.08Å; V210-W213 PolarHBondContact O-N 3.42Å; V210-W213 VanDerWaalsContact O-N 3.15Å; V210-I214 HydrophobicContact CG1-CD1 3.88Å; V210-I214 HydrophobicContact CG1-CG1 4.12Å; V210-I214 WeakPolarHBondContact O-CG1 3.21Å; V210-I214 PolarHBondContact O-N 3.34Å; V210-V248 HydrophobicContact CG2-CG1 4.11Å; V210-L252 HydrophobicContact CG1-CD1 4.2Å; V210-L252 HydrophobicContact CG1-CD2 3.85Å; V210-L252 HydrophobicContact CG2-CD2 4.04Å; V210-F256 HydrophobicContact CG1-CE2 4.15Å; V210-F256 HydrophobicContact CG1-CZ 4.37Å
211	P	98.5	Very high	97.6	Very high	71 Å²	71	48.6 Å²	48.6	46%	0.461	25%	0.246	S	C	.	.	H	α-helix	trans	-54	-41.9	174.3	-29.1	36	0	0	0	114.2	D209 I214 S215	D209-P211 VanDerWaalsContact OD1-CD 3.3Å; D209-P211 WeakPolarHBondContact OD1-CD 3.3Å; P211-I214 PolarHBondContact O-N 3.23Å; P211-S215 PolarHBondContact O-N 3.24Å
212	K	98.5	Very high	97.6	Very high	75 Å²	75	51 Å²	51	33%	0.326	26%	0.26	S	S	.	.	H	α-helix	trans	-63.8	-43.7	176.3	176.7	60.1	69.4	152.1	0	111.8	D197 A201 D209 V210 S215 I216	D197-K212 HydrophobicContact CB-CD 4.22Å; D197-K212 HydrophobicContact CB-CG 4.48Å; D197-K212 IonicContact OD2-NZ 2.79Å; D197-K212 PolarHBondContact OD2-NZ 2.79Å; A201-K212 HydrophobicContact CB-CB 4.01Å; A201-K212 HydrophobicContact CB-CG 3.85Å; D209-K212 HydrophobicContact CB-CB 4.29Å; D209-K212 PolarHBondContact O-N 3.17Å; D209-K212 PolarHBondContact OD1-N 3.5Å; V210-K212 VanDerWaalsContact C-N 3.3Å; V210-K212 PolarHBondContact O-N 3.08Å; K212-S215 PolarHBondContact O-N 3Å; K212-I216 HydrophobicContact CD-CD1 3.76Å; K212-I216 HydrophobicContact CD-CG1 4.18Å; K212-I216 HydrophobicContact CG-CD1 4.21Å; K212-I216 PolarHBondContact O-N 3.42Å; K212-I216 VanDerWaalsContact O-N 3.12Å
213	W	98.6	Very high	97.6	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.5	-45.1	174.8	-82	24.2	0	0	0	112.3	L198 T208 D209 V210 M217 M240 I244 E247 F256	L198-W213 HydrophobicContact CD2-CB 4.48Å; L198-W213 HydrophobicContact CD2-CG 3.97Å; L198-W213 PolarHBondContact O-NE1 2.84Å; T208-W213 HydrophobicContact CG2-CD2 4.12Å; T208-W213 HydrophobicContact CG2-CE3 4.3Å; T208-W213 HydrophobicContact CG2-CH2 4.44Å; T208-W213 HydrophobicContact CG2-CZ2 4.27Å; T208-W213 HydrophobicContact CG2-CZ3 4.43Å; D209-W213 PolarHBondContact O-N 2.92Å; V210-W213 PolarHBondContact O-N 3.42Å; V210-W213 VanDerWaalsContact O-N 3.15Å; W213-M217 HydrophobicContact CD2-CE 4.19Å; W213-M217 HydrophobicContact CE3-CE 4.24Å; W213-M217 HydrophobicContact CG-CE 4.36Å; W213-M217 WeakPolarHBondContact O-CB 3.45Å; W213-M217 WeakPolarHBondContact O-CG 3.39Å; W213-M217 PolarHBondContact O-N 3.38Å; W213-M240 HydrophobicContact CH2-CE 3.67Å; W213-M240 HydrophobicContact CZ2-CE 3.65Å; W213-M240 HydrophobicContact CZ3-CE 4.18Å; W213-I244 HydrophobicContact CE3-CG1 4.3Å; W213-I244 HydrophobicContact CH2-CG1 3.98Å; W213-I244 HydrophobicContact CZ3-CB 4.22Å; W213-I244 HydrophobicContact CZ3-CG1 3.49Å; W213-I244 VanDerWaalsContact CZ3-CG1 3.49Å; W213-E247 HydrophobicContact CH2-CB 3.69Å; W213-E247 HydrophobicContact CH2-CG 3.87Å; W213-E247 HydrophobicContact CZ2-CB 4.38Å; W213-E247 HydrophobicContact CZ2-CG 4.19Å; W213-E247 HydrophobicContact CZ3-CB 4.22Å; W213-F256 HydrophobicContact CB-CE1 4.13Å; W213-F256 HydrophobicContact CB-CZ 3.81Å; W213-F256 HydrophobicContact CE3-CD2 4.39Å; W213-F256 HydrophobicContact CE3-CE2 4.21Å; W213-F256 HydrophobicContact CE3-CZ 4.31Å
214	I	98.7	Very high	97.6	Very high	13 Å²	13	52.1 Å²	52.1	7%	0.067	27%	0.266	C	S	.	.	H	α-helix	trans	-59.7	-48.9	176.6	-66.7	175.7	0	0	0	110.4	D166 K169 L170 A173 V210 P211 I216 M217 T218 F256	D166-I214 HydrophobicContact CB-CD1 4.49Å; K169-I214 HydrophobicContact CB-CD1 3.83Å; L170-I214 HydrophobicContact CB-CD1 4.02Å; L170-I214 HydrophobicContact CB-CG1 4.14Å; L170-I214 HydrophobicContact CD1-CG1 4.28Å; L170-I214 HydrophobicContact CD1-CG2 4.36Å; A173-I214 HydrophobicContact CB-CG2 4.02Å; V210-I214 HydrophobicContact CG1-CD1 3.88Å; V210-I214 HydrophobicContact CG1-CG1 4.12Å; V210-I214 WeakPolarHBondContact O-CG1 3.21Å; V210-I214 PolarHBondContact O-N 3.34Å; P211-I214 PolarHBondContact O-N 3.23Å; I214-I216 PolarHBondContact O-N 3.25Å; I214-M217 PolarHBondContact O-N 3.04Å; I214-T218 HydrophobicContact CG2-CG2 4.15Å; I214-T218 VanDerWaalsContact O-CB 3.31Å; I214-T218 WeakPolarHBondContact O-CB 3.15Å; I214-T218 VanDerWaalsContact O-CG2 3.23Å; I214-T218 WeakPolarHBondContact O-CG2 3.47Å; I214-T218 PolarHBondContact O-N 3.08Å; I214-T218 PolarHBondContact O-OG1 3.48Å; I214-F256 HydrophobicContact CG1-CE1 4.41Å; I214-F256 HydrophobicContact CG1-CZ 3.75Å
215	S	98.6	Very high	97.7	Very high	39 Å²	39	46.4 Å²	46.4	27%	0.273	24%	0.242	S	C	.	.	H	α-helix	trans	-57.7	-53.3	-178.3	177.3	0	0	0	0	111.3	P211 K212 M217 T218 E219	P211-S215 PolarHBondContact O-N 3.24Å; K212-S215 PolarHBondContact O-N 3Å; S215-M217 PolarHBondContact O-N 2.84Å; S215-T218 PolarHBondContact O-N 3.32Å; S215-E219 WeakPolarHBondContact CA-OE1 3.4Å; S215-E219 WeakPolarHBondContact CB-OE1 3.21Å; S215-E219 WeakPolarHBondContact O-CB 3.44Å; S215-E219 VanDerWaalsContact O-CG 3.22Å; S215-E219 WeakPolarHBondContact O-CG 3.37Å; S215-E219 PolarHBondContact O-N 3.21Å; S215-E219 VanDerWaalsContact OG-CD 3.24Å; S215-E219 PolarHBondContact OG-OE1 3.19Å; S215-E219 PolarHBondContact OG-OE2 3.44Å
216	I	98.6	Very high	97.8	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-61.7	-51.8	-179.4	-66.6	173.9	0	0	0	111.2	D194 D197 L198 K212 I214 T218 R220 L225	D194-I216 HydrophobicContact CB-CD1 4.3Å; D194-I216 HydrophobicContact CB-CG2 4.12Å; D197-I216 HydrophobicContact CB-CD1 3.67Å; L198-I216 HydrophobicContact CD1-CG2 4.25Å; L198-I216 HydrophobicContact CD2-CB 4.27Å; L198-I216 HydrophobicContact CD2-CD1 4.12Å; L198-I216 HydrophobicContact CD2-CG2 4.26Å; L198-I216 HydrophobicContact CG-CD1 4.05Å; L198-I216 HydrophobicContact CG-CG2 4.27Å; K212-I216 HydrophobicContact CD-CD1 3.76Å; K212-I216 HydrophobicContact CD-CG1 4.18Å; K212-I216 HydrophobicContact CG-CD1 4.21Å; K212-I216 PolarHBondContact O-N 3.42Å; K212-I216 VanDerWaalsContact O-N 3.12Å; I214-I216 PolarHBondContact O-N 3.25Å; I216-T218 VanDerWaalsContact C-N 3.26Å; I216-T218 PolarHBondContact O-N 3.26Å; I216-R220 HydrophobicContact CG2-CG 4.28Å; I216-R220 WeakPolarHBondContact O-CB 3.47Å; I216-R220 WeakPolarHBondContact O-CG 3.41Å; I216-R220 PolarHBondContact O-N 3.48Å; I216-L225 HydrophobicContact CG2-CD2 3.9Å
217	M	98.6	Very high	98	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-73.7	-13.9	-171.9	-63.1	-171.4	-166	0	0	113.9	R179 L198 W213 I214 S215 F229 M240 F256 L259 V260	R179-M217 VanDerWaalsContact CZ-O 3.31Å; R179-M217 PolarHBondContact NH1-O 2.93Å; R179-M217 PolarHBondContact NH2-O 3.49Å; L198-M217 HydrophobicContact CD1-CE 4.46Å; L198-M217 HydrophobicContact CD2-CE 3.75Å; W213-M217 HydrophobicContact CD2-CE 4.19Å; W213-M217 HydrophobicContact CE3-CE 4.24Å; W213-M217 HydrophobicContact CG-CE 4.36Å; W213-M217 WeakPolarHBondContact O-CB 3.45Å; W213-M217 WeakPolarHBondContact O-CG 3.39Å; W213-M217 PolarHBondContact O-N 3.38Å; I214-M217 PolarHBondContact O-N 3.04Å; S215-M217 PolarHBondContact O-N 2.84Å; M217-F229 HydrophobicContact CE-CE1 4.39Å; M217-F229 HydrophobicContact CG-CZ 4.42Å; M217-F229 HydrophobicContact SD-CZ 4.49Å; M217-M240 HydrophobicContact CE-CE 3.81Å; M217-M240 HydrophobicContact CE-CG 4.19Å; M217-M240 HydrophobicContact CE-SD 3.7Å; M217-F256 HydrophobicContact SD-CD1 3.54Å; M217-F256 VanDerWaalsContact SD-CD1 3.54Å; M217-F256 HydrophobicContact SD-CE1 3.73Å; M217-L259 HydrophobicContact CB-CD2 3.85Å; M217-V260 HydrophobicContact SD-CG2 4.03Å
218	T	98.5	Very high	98.2	Very high	13 Å²	13	34.9 Å²	34.9	8%	0.08	18%	0.183	C	C	.	.	H	α-helix	trans	-104.9	-27.7	178.2	65	0	0	0	0	113.5	L170 A173 L174 R179 I214 S215 I216	L170-T218 HydrophobicContact CD1-CG2 3.57Å; A173-T218 HydrophobicContact CB-CG2 3.95Å; L174-T218 HydrophobicContact CD2-CG2 3.72Å; L174-T218 HydrophobicContact CG-CG2 3.83Å; R179-T218 PolarHBondContact NH1-O 2.99Å; I214-T218 HydrophobicContact CG2-CG2 4.15Å; I214-T218 VanDerWaalsContact O-CB 3.31Å; I214-T218 WeakPolarHBondContact O-CB 3.15Å; I214-T218 VanDerWaalsContact O-CG2 3.23Å; I214-T218 WeakPolarHBondContact O-CG2 3.47Å; I214-T218 PolarHBondContact O-N 3.08Å; I214-T218 PolarHBondContact O-OG1 3.48Å; S215-T218 PolarHBondContact O-N 3.32Å; I216-T218 VanDerWaalsContact C-N 3.26Å; I216-T218 PolarHBondContact O-N 3.26Å
219	E	98.4	Very high	98.4	Very high	94 Å²	94	33.4 Å²	33.4	44%	0.439	17%	0.173	S	C	.	.	H	α-helix	trans	-95.4	-30.5	-174.1	-63.6	168.3	-150.7	0	0	113.8	A180 S215	A180-E219 WeakPolarHBondContact CB-O 3.42Å; A180-E219 PolarHBondContact N-O 3.37Å; S215-E219 WeakPolarHBondContact CA-OE1 3.4Å; S215-E219 WeakPolarHBondContact CB-OE1 3.21Å; S215-E219 WeakPolarHBondContact O-CB 3.44Å; S215-E219 VanDerWaalsContact O-CG 3.22Å; S215-E219 WeakPolarHBondContact O-CG 3.37Å; S215-E219 PolarHBondContact O-N 3.21Å; S215-E219 VanDerWaalsContact OG-CD 3.24Å; S215-E219 PolarHBondContact OG-OE1 3.19Å; S215-E219 PolarHBondContact OG-OE2 3.44Å
220	R	98.2	Very high	98.4	Very high	56 Å²	56	35.2 Å²	35.2	21%	0.211	18%	0.183	C	C	.	.	S	Bend	trans	-78.5	150.1	-178.8	-61.2	-63.6	-176.4	-87.6	-10.5	112.6	R179 D194 I216 L225	R179-R220 WeakPolarHBondContact CD-O 3.33Å; R179-R220 WeakPolarHBondContact CG-O 3.18Å; R179-R220 PolarHBondContact NH1-O 3.46Å; D194-R220 IonicContact OD1-CZ 2.74Å; D194-R220 IonicContact OD1-NE 3.21Å; D194-R220 PolarHBondContact OD1-NE 3.24Å; D194-R220 IonicContact OD1-NH2 2.73Å; D194-R220 PolarHBondContact OD1-NH2 3.45Å; D194-R220 WeakPolarHBondContact OD2-CD 3.32Å; D194-R220 IonicContact OD2-CZ 3.34Å; D194-R220 IonicContact OD2-NE 3.68Å; D194-R220 PolarHBondContact OD2-NE 3.38Å; D194-R220 IonicContact OD2-NH2 2.71Å; I216-R220 HydrophobicContact CG2-CG 4.28Å; I216-R220 WeakPolarHBondContact O-CB 3.47Å; I216-R220 WeakPolarHBondContact O-CG 3.41Å; I216-R220 PolarHBondContact O-N 3.48Å; R220-L225 HydrophobicContact CB-CD1 4.09Å; R220-L225 HydrophobicContact CB-CD2 3.77Å; R220-L225 HydrophobicContact CB-CG 3.67Å; R220-L225 HydrophobicContact CG-CD2 4.24Å; R220-L225 WeakPolarHBondContact O-CD1 3.45Å
221	S	98.2	Very high	98.4	Very high	12 Å²	12	39.6 Å²	39.6	8%	0.084	20%	0.199	C	C	.	.			trans	-61.7	155.3	176.6	79.8	0	0	0	0	111.7	A180 D182 H224 L225	A180-S221 VanDerWaalsContact O-CA 3.26Å; A180-S221 WeakPolarHBondContact O-CA 3.4Å; A180-S221 WeakPolarHBondContact O-CB 3.27Å; D182-S221 PolarHBondContact OD1-OG 3.4Å; S221-H224 WeakPolarHBondContact O-CB 3.42Å; S221-H224 PolarHBondContact O-N 2.69Å; S221-H224 VanDerWaalsContact OG-CB 3.31Å; S221-H224 WeakPolarHBondContact OG-CB 3.16Å; S221-H224 PolarHBondContact OG-N 2.96Å; S221-L225 WeakPolarHBondContact O-CG 3.27Å; S221-L225 PolarHBondContact O-N 3.34Å
222	V	97.7	Very high	98.4	Very high	55 Å²	55	36.2 Å²	36.2	33%	0.333	18%	0.177	S	C	.	.	H	α-helix	trans	-60	-47.1	178.1	171.4	0	0	0	0	111.5	H224 L225 Q226 I263	V222-H224 VanDerWaalsContact C-N 3.28Å; V222-H224 PolarHBondContact O-N 2.9Å; V222-L225 PolarHBondContact O-N 2.69Å; V222-Q226 WeakPolarHBondContact O-CG 3.49Å; V222-Q226 PolarHBondContact O-N 3.42Å; V222-I263 HydrophobicContact CG1-CG2 4.24Å
223	P	97.6	Very high	98.4	Very high	34 Å²	34	37.6 Å²	37.6	22%	0.221	18%	0.183	C	C	.	.	H	α-helix	trans	-67.3	-25.8	179.5	-25.6	40	0	0	0	114.3	D182 K227	D182-P223 HydrophobicContact CB-CG 4.14Å; D182-P223 VanDerWaalsContact CG-CG 3.48Å; D182-P223 WeakPolarHBondContact OD1-CB 3.45Å; D182-P223 WeakPolarHBondContact OD1-CG 3.27Å; P223-K227 PolarHBondContact O-NZ 2.75Å; P223-K227 VanDerWaalsContact O-NZ 3.11Å
224	H	98.4	Very high	98.4	Very high	20 Å²	20	40.9 Å²	40.9	9%	0.093	21%	0.206	C	C	.	.	H	α-helix	trans	-67.7	-52.5	168.7	179	88.1	0	0	0	110.9	I191 D194 S221 V222 Q226 K227 V228	I191-H224 VanDerWaalsContact CG1-CE1 3.49Å; I191-H224 WeakPolarHBondContact CG1-CE1 3.37Å; D194-H224 IonicContact OD2-CD2 3.16Å; D194-H224 IonicContact OD2-CE1 2.82Å; D194-H224 IonicContact OD2-NE2 2.82Å; D194-H224 PolarHBondContact OD2-NE2 3.35Å; S221-H224 WeakPolarHBondContact O-CB 3.42Å; S221-H224 PolarHBondContact O-N 2.69Å; S221-H224 VanDerWaalsContact OG-CB 3.31Å; S221-H224 WeakPolarHBondContact OG-CB 3.16Å; S221-H224 PolarHBondContact OG-N 2.96Å; V222-H224 VanDerWaalsContact C-N 3.28Å; V222-H224 PolarHBondContact O-N 2.9Å; H224-Q226 VanDerWaalsContact C-N 3.28Å; H224-Q226 PolarHBondContact O-N 2.6Å; H224-K227 WeakPolarHBondContact O-CB 3.43Å; H224-K227 PolarHBondContact O-N 3.3Å; H224-V228 VanDerWaalsContact NE2-CG2 3.34Å; H224-V228 WeakPolarHBondContact NE2-CG2 3.41Å; H224-V228 WeakPolarHBondContact O-CG2 3.09Å; H224-V228 PolarHBondContact O-N 3.48Å
225	L	98.6	Very high	98.3	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.6	-34	-177.9	-72.9	171.7	0	0	0	113.2	I216 R220 S221 V222 K227 V228 F229 I263	I216-L225 HydrophobicContact CG2-CD2 3.9Å; R220-L225 HydrophobicContact CB-CD1 4.09Å; R220-L225 HydrophobicContact CB-CD2 3.77Å; R220-L225 HydrophobicContact CB-CG 3.67Å; R220-L225 HydrophobicContact CG-CD2 4.24Å; R220-L225 WeakPolarHBondContact O-CD1 3.45Å; S221-L225 WeakPolarHBondContact O-CG 3.27Å; S221-L225 PolarHBondContact O-N 3.34Å; V222-L225 PolarHBondContact O-N 2.69Å; L225-K227 VanDerWaalsContact C-N 3.32Å; L225-K227 PolarHBondContact O-N 3.35Å; L225-V228 PolarHBondContact O-N 2.9Å; L225-F229 HydrophobicContact CB-CE2 4.36Å; L225-F229 HydrophobicContact CB-CZ 4.3Å; L225-F229 HydrophobicContact CD2-CE1 4.47Å; L225-F229 HydrophobicContact CD2-CZ 4.47Å; L225-F229 WeakPolarHBondContact O-CD2 3.36Å; L225-F229 WeakPolarHBondContact O-CG 3.44Å; L225-F229 PolarHBondContact O-N 3.1Å; L225-I263 HydrophobicContact CB-CD1 4.4Å; L225-I263 HydrophobicContact CB-CG2 3.69Å; L225-I263 HydrophobicContact CD1-CD1 3.68Å; L225-I263 HydrophobicContact CD1-CG1 4.45Å
226	Q	98.3	Very high	98.3	Very high	73 Å²	73	41.5 Å²	41.5	34%	0.341	20%	0.203	S	C	.	.	H	α-helix	trans	-56.5	-46.7	171.4	-73.7	175.9	-23.3	0	0	111.6	V222 H224 F229 D230 I263 Q264	V222-Q226 WeakPolarHBondContact O-CG 3.49Å; V222-Q226 PolarHBondContact O-N 3.42Å; H224-Q226 VanDerWaalsContact C-N 3.28Å; H224-Q226 PolarHBondContact O-N 2.6Å; Q226-F229 PolarHBondContact O-N 3.43Å; Q226-D230 PolarHBondContact O-N 3.43Å; Q226-D230 VanDerWaalsContact O-N 3.14Å; Q226-I263 HydrophobicContact CG-CG2 4Å; Q226-I263 WeakPolarHBondContact CG-O 3.49Å; Q226-I263 PolarHBondContact NE2-O 3.32Å; Q226-Q264 PolarHBondContact NE2-O 2.91Å
227	K	98.4	Very high	98.2	Very high	74 Å²	74	46 Å²	46	32%	0.322	23%	0.232	S	C	.	.	H	α-helix	trans	-69	-37.3	177.4	-63.8	178.4	-174.7	72.5	0	112.2	I186 I191 P223 H224 L225 D230 R231	I186-K227 HydrophobicContact CG2-CD 3.86Å; I191-K227 HydrophobicContact CD1-CB 3.71Å; I191-K227 HydrophobicContact CD1-CD 3.61Å; I191-K227 HydrophobicContact CD1-CG 4.31Å; I191-K227 HydrophobicContact CG1-CB 4.17Å; I191-K227 HydrophobicContact CG2-CB 4.19Å; P223-K227 PolarHBondContact O-NZ 2.75Å; P223-K227 VanDerWaalsContact O-NZ 3.11Å; H224-K227 WeakPolarHBondContact O-CB 3.43Å; H224-K227 PolarHBondContact O-N 3.3Å; L225-K227 VanDerWaalsContact C-N 3.32Å; L225-K227 PolarHBondContact O-N 3.35Å; K227-D230 PolarHBondContact O-N 3.27Å; K227-R231 WeakPolarHBondContact O-CB 3.23Å; K227-R231 PolarHBondContact O-N 2.78Å
228	V	98.7	Very high	98.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-59.3	-45.9	173.2	172.4	0	0	0	0	110.7	I191 D194 A195 L198 H224 L225 D230 R231 Y232	I191-V228 HydrophobicContact CB-CG2 4.42Å; I191-V228 HydrophobicContact CG1-CG2 4.32Å; I191-V228 HydrophobicContact CG2-CG2 4.32Å; D194-V228 HydrophobicContact CB-CG1 4Å; D194-V228 HydrophobicContact CB-CG2 3.87Å; A195-V228 HydrophobicContact CB-CG1 4.26Å; L198-V228 HydrophobicContact CD1-CG1 3.67Å; H224-V228 VanDerWaalsContact NE2-CG2 3.34Å; H224-V228 WeakPolarHBondContact NE2-CG2 3.41Å; H224-V228 WeakPolarHBondContact O-CG2 3.09Å; H224-V228 PolarHBondContact O-N 3.48Å; L225-V228 PolarHBondContact O-N 2.9Å; V228-D230 VanDerWaalsContact C-N 3.32Å; V228-D230 PolarHBondContact O-N 3.44Å; V228-R231 CarbonylContact O-C 3.6Å; V228-R231 PolarHBondContact O-N 3.14Å; V228-Y232 VanDerWaalsContact O-CB 3.27Å; V228-Y232 WeakPolarHBondContact O-CB 3.3Å; V228-Y232 PolarHBondContact O-N 3.44Å
229	F	98.6	Very high	98.2	Very high	1 Å²	1	53.1 Å²	53.1	0%	0.004	26%	0.264	C	S	.	.	H	α-helix	trans	-68.2	-30.1	-179.9	-62	-22.1	0	0	0	113.2	L198 M217 L225 Q226 M240 V260 I263 Q264	L198-F229 HydrophobicContact CD1-CD1 4.39Å; L198-F229 HydrophobicContact CD1-CE1 4.13Å; M217-F229 HydrophobicContact CE-CE1 4.39Å; M217-F229 HydrophobicContact CG-CZ 4.42Å; M217-F229 HydrophobicContact SD-CZ 4.49Å; L225-F229 HydrophobicContact CB-CE2 4.36Å; L225-F229 HydrophobicContact CB-CZ 4.3Å; L225-F229 HydrophobicContact CD2-CE1 4.47Å; L225-F229 HydrophobicContact CD2-CZ 4.47Å; L225-F229 WeakPolarHBondContact O-CD2 3.36Å; L225-F229 WeakPolarHBondContact O-CG 3.44Å; L225-F229 PolarHBondContact O-N 3.1Å; Q226-F229 PolarHBondContact O-N 3.43Å; F229-M240 HydrophobicContact CD1-CB 4.16Å; F229-M240 HydrophobicContact CD1-CG 3.79Å; F229-M240 HydrophobicContact CD1-SD 4.12Å; F229-M240 HydrophobicContact CE1-CG 3.82Å; F229-M240 HydrophobicContact CE1-SD 4.11Å; F229-M240 HydrophobicContact CG-CB 4.33Å; F229-M240 HydrophobicContact CG-CG 4.35Å; F229-M240 HydrophobicContact CZ-CG 4.38Å; F229-V260 HydrophobicContact CD2-CG1 4.11Å; F229-V260 HydrophobicContact CE2-CB 4.26Å; F229-V260 HydrophobicContact CE2-CG1 3.86Å; F229-V260 HydrophobicContact CE2-CG2 4Å; F229-V260 HydrophobicContact CZ-CG1 4.43Å; F229-V260 HydrophobicContact CZ-CG2 3.82Å; F229-I263 HydrophobicContact CD2-CG2 4.08Å; F229-I263 HydrophobicContact CE2-CB 3.98Å; F229-I263 HydrophobicContact CE2-CD1 4.02Å; F229-I263 HydrophobicContact CE2-CG2 3.58Å; F229-I263 HydrophobicContact CZ-CD1 4.11Å; F229-I263 HydrophobicContact CZ-CG2 4.5Å; F229-Q264 HydrophobicContact CD2-CG 3.96Å
230	D	98.4	Very high	98.2	Very high	97 Å²	97	48.7 Å²	48.7	52%	0.519	24%	0.243	S	C	.	.	H	α-helix	trans	-72.5	-42.1	170.5	-76.5	-29.9	0	0	0	112	Q226 K227 V228 Y232 K233	Q226-D230 PolarHBondContact O-N 3.43Å; Q226-D230 VanDerWaalsContact O-N 3.14Å; K227-D230 PolarHBondContact O-N 3.27Å; V228-D230 VanDerWaalsContact C-N 3.32Å; V228-D230 PolarHBondContact O-N 3.44Å; D230-Y232 VanDerWaalsContact C-N 3.34Å; D230-Y232 PolarHBondContact O-N 2.68Å; D230-K233 WeakPolarHBondContact O-CB 3.4Å; D230-K233 PolarHBondContact O-N 3.15Å; D230-K233 IonicContact OD1-NZ 2.73Å; D230-K233 PolarHBondContact OD1-NZ 2.9Å
231	R	98.6	Very high	98.2	Very high	102 Å²	102	47.6 Å²	47.6	39%	0.385	24%	0.241	S	C	.	.	H	α-helix	trans	-65.9	-35.2	175.6	-177.4	55.8	176.9	167.9	-1.7	112.6	I191 D192 A195 K227 V228 K233 S234 Y235	I191-R231 HydrophobicContact CG2-CB 3.92Å; I191-R231 HydrophobicContact CG2-CG 4.27Å; D192-R231 IonicContact OD1-CZ 3.38Å; D192-R231 IonicContact OD1-NE 3.84Å; D192-R231 PolarHBondContact OD1-NE 2.86Å; D192-R231 IonicContact OD1-NH2 2.69Å; D192-R231 PolarHBondContact OD1-NH2 2.56Å; A195-R231 HydrophobicContact CB-CB 3.96Å; A195-R231 HydrophobicContact CB-CG 3.7Å; K227-R231 WeakPolarHBondContact O-CB 3.23Å; K227-R231 PolarHBondContact O-N 2.78Å; V228-R231 CarbonylContact O-C 3.6Å; V228-R231 PolarHBondContact O-N 3.14Å; R231-K233 PolarHBondContact O-N 2.96Å; R231-K233 VanDerWaalsContact O-N 3.12Å; R231-S234 PolarHBondContact NH1-OG 2.8Å; R231-S234 VanDerWaalsContact NH1-OG 3.12Å; R231-S234 PolarHBondContact O-N 3.09Å; R231-S234 PolarHBondContact O-OG 3.28Å; R231-Y235 HydrophobicContact CG-CE2 4.29Å; R231-Y235 PolarHBondContact NH2-OH 2.55Å; R231-Y235 VanDerWaalsContact NH2-OH 3.14Å
232	Y	98.7	Very high	98.2	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-53.6	-34.1	178.2	177.8	-98.3	0	0	0	112.6	L198 V203 V228 D230 S234 Y235 S236 Y238 M240 S243	L198-Y232 HydrophobicContact CB-CD2 3.92Å; L198-Y232 HydrophobicContact CB-CE2 3.93Å; V203-Y232 WeakPolarHBondContact CG2-OH 3.27Å; V228-Y232 VanDerWaalsContact O-CB 3.27Å; V228-Y232 WeakPolarHBondContact O-CB 3.3Å; V228-Y232 PolarHBondContact O-N 3.44Å; D230-Y232 VanDerWaalsContact C-N 3.34Å; D230-Y232 PolarHBondContact O-N 2.68Å; Y232-S234 PolarHBondContact O-N 2.98Å; Y232-S234 VanDerWaalsContact O-N 3.13Å; Y232-Y235 PolarHBondContact O-N 2.94Å; Y232-S236 VanDerWaalsContact CZ-CB 3.41Å; Y232-S236 PolarHBondContact O-N 2.95Å; Y232-S236 PolarHBondContact OH-OG 3.08Å; Y232-Y238 VanDerWaalsContact CE1-O 3.29Å; Y232-Y238 WeakPolarHBondContact CE1-O 3.29Å; Y232-M240 HydrophobicContact CD1-CB 4.41Å; Y232-M240 HydrophobicContact CD1-SD 4.36Å; Y232-M240 HydrophobicContact CD2-SD 4.45Å; Y232-M240 HydrophobicContact CE1-CE 4.48Å; Y232-M240 HydrophobicContact CE1-SD 4.29Å; Y232-M240 HydrophobicContact CE2-SD 4.37Å; Y232-M240 HydrophobicContact CG-SD 4.44Å; Y232-S243 VanDerWaalsContact CE1-OG 3.3Å; Y232-S243 WeakPolarHBondContact CE1-OG 3.44Å; Y232-S243 WeakPolarHBondContact OH-CB 3.46Å; Y232-S243 PolarHBondContact OH-OG 3.28Å
233	K	98.1	Very high	98.3	Very high	104 Å²	104	47.6 Å²	47.6	45%	0.452	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-16.1	177.5	-60.6	166.7	-174.3	163.1	0	113.8	D230 R231 D239	D230-K233 WeakPolarHBondContact O-CB 3.4Å; D230-K233 PolarHBondContact O-N 3.15Å; D230-K233 IonicContact OD1-NZ 2.73Å; D230-K233 PolarHBondContact OD1-NZ 2.9Å; R231-K233 PolarHBondContact O-N 2.96Å; R231-K233 VanDerWaalsContact O-N 3.12Å; K233-D239 HydrophobicContact CG-CB 4.49Å
234	S	98	Very high	98.3	Very high	70 Å²	70	46 Å²	46	49%	0.49	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-12.3	173.6	67.7	0	0	0	0	114.1	R231 Y232	R231-S234 PolarHBondContact NH1-OG 2.8Å; R231-S234 VanDerWaalsContact NH1-OG 3.12Å; R231-S234 PolarHBondContact O-N 3.09Å; R231-S234 PolarHBondContact O-OG 3.28Å; Y232-S234 PolarHBondContact O-N 2.98Å; Y232-S234 VanDerWaalsContact O-N 3.13Å
235	Y	98	Very high	98.3	Very high	57 Å²	57	50.9 Å²	50.9	22%	0.224	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-41.6	179.1	-67.4	-71.7	0	0	0	112.3	D192 A195 R196 R231 Y232	D192-Y235 PolarHBondContact OD1-OH 3.48Å; D192-Y235 PolarHBondContact OD2-OH 2.82Å; D192-Y235 VanDerWaalsContact OD2-OH 3.11Å; A195-Y235 HydrophobicContact CB-CD2 4.24Å; A195-Y235 HydrophobicContact CB-CE2 4.34Å; R196-Y235 HydrophobicContact CG-CD1 4.15Å; R196-Y235 HydrophobicContact CG-CD2 4.15Å; R196-Y235 HydrophobicContact CG-CE1 3.72Å; R196-Y235 HydrophobicContact CG-CE2 3.72Å; R196-Y235 HydrophobicContact CG-CG 4.36Å; R196-Y235 VanDerWaalsContact CG-CZ 3.5Å; R196-Y235 PolarHBondContact NE-OH 3.38Å; R196-Y235 PolarHBondContact NH2-OH 3.16Å; R196-Y235 VanDerWaalsContact NH2-OH 3.1Å; R231-Y235 HydrophobicContact CG-CE2 4.29Å; R231-Y235 PolarHBondContact NH2-OH 2.55Å; R231-Y235 VanDerWaalsContact NH2-OH 3.14Å; Y232-Y235 PolarHBondContact O-N 2.94Å
236	S	97.8	Very high	98.3	Very high	7 Å²	7	55.4 Å²	55.4	5%	0.049	26%	0.263	C	S	.	.			trans	-95.1	141.7	-177.4	175.4	0	0	0	0	111.8	Y232 Y238 S243	Y232-S236 VanDerWaalsContact CZ-CB 3.41Å; Y232-S236 PolarHBondContact O-N 2.95Å; Y232-S236 PolarHBondContact OH-OG 3.08Å; S236-Y238 VanDerWaalsContact CB-O 3.25Å; S236-Y238 WeakPolarHBondContact CB-O 3.5Å; S236-Y238 PolarHBondContact O-N 2.74Å; S236-Y238 PolarHBondContact OG-N 2.83Å; S236-Y238 VanDerWaalsContact OG-N 3.07Å; S236-Y238 PolarHBondContact OG-O 2.97Å; S236-S243 PolarHBondContact OG-OG 2.97Å
237	P	97.5	Very high	98.2	Very high	97 Å²	97	54.1 Å²	54.1	63%	0.63	26%	0.257	S	S	*	.	S	Bend	trans	-69.4	-10.6	169.7	30.4	-35.6	0	0	0	113.4	V203	V203-P237 HydrophobicContact CG1-CG 4.31Å
238	Y	97.8	Very high	98.2	Very high	94 Å²	94	51 Å²	51	37%	0.369	24%	0.244	S	C	.	.	S	Bend	trans	-120.8	150	179.7	-47.1	-59.8	0	0	0	109.9	V203 Y232 S236 E242 K246	V203-Y238 HydrophobicContact CG1-CD2 4.01Å; V203-Y238 HydrophobicContact CG1-CE2 4.06Å; V203-Y238 HydrophobicContact CG2-CD2 4.19Å; Y232-Y238 VanDerWaalsContact CE1-O 3.29Å; Y232-Y238 WeakPolarHBondContact CE1-O 3.29Å; S236-Y238 VanDerWaalsContact CB-O 3.25Å; S236-Y238 WeakPolarHBondContact CB-O 3.5Å; S236-Y238 PolarHBondContact O-N 2.74Å; S236-Y238 PolarHBondContact OG-N 2.83Å; S236-Y238 VanDerWaalsContact OG-N 3.07Å; S236-Y238 PolarHBondContact OG-O 2.97Å; Y238-E242 HydrophobicContact CD1-CG 3.93Å; Y238-E242 HydrophobicContact CG-CG 4.02Å; Y238-K246 HydrophobicContact CD2-CD 3.81Å; Y238-K246 HydrophobicContact CE1-CD 4.35Å; Y238-K246 VanDerWaalsContact CE1-CE 3.43Å; Y238-K246 HydrophobicContact CE2-CD 3.54Å; Y238-K246 HydrophobicContact CG-CD 4.32Å
239	D	98.3	Very high	98.2	Very high	69 Å²	69	59.1 Å²	59.1	37%	0.369	28%	0.279	S	S	.	.			trans	-68.5	176	167.8	71.6	30.5	0	0	0	111.7	K233 L241 E242 S243	K233-D239 HydrophobicContact CG-CB 4.49Å; D239-L241 VanDerWaalsContact C-N 3.33Å; D239-L241 PolarHBondContact O-N 3.14Å; D239-L241 PolarHBondContact OD1-N 3.21Å; D239-E242 PolarHBondContact O-N 3.33Å; D239-E242 PolarHBondContact OD1-N 3.32Å; D239-S243 VanDerWaalsContact O-CB 3.29Å; D239-S243 WeakPolarHBondContact O-CB 3.47Å; D239-S243 PolarHBondContact O-N 3.43Å; D239-S243 PolarHBondContact O-OG 3.4Å
240	M	98.5	Very high	98.1	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-62.8	-38.4	-177.1	-166.5	69.4	-101.6	0	0	112.5	L198 W213 M217 F229 Y232 S243 I244 V260	L198-M240 HydrophobicContact CD1-SD 4.02Å; W213-M240 HydrophobicContact CH2-CE 3.67Å; W213-M240 HydrophobicContact CZ2-CE 3.65Å; W213-M240 HydrophobicContact CZ3-CE 4.18Å; M217-M240 HydrophobicContact CE-CE 3.81Å; M217-M240 HydrophobicContact CE-CG 4.19Å; M217-M240 HydrophobicContact CE-SD 3.7Å; F229-M240 HydrophobicContact CD1-CB 4.16Å; F229-M240 HydrophobicContact CD1-CG 3.79Å; F229-M240 HydrophobicContact CD1-SD 4.12Å; F229-M240 HydrophobicContact CE1-CG 3.82Å; F229-M240 HydrophobicContact CE1-SD 4.11Å; F229-M240 HydrophobicContact CG-CB 4.33Å; F229-M240 HydrophobicContact CG-CG 4.35Å; F229-M240 HydrophobicContact CZ-CG 4.38Å; Y232-M240 HydrophobicContact CD1-CB 4.41Å; Y232-M240 HydrophobicContact CD1-SD 4.36Å; Y232-M240 HydrophobicContact CD2-SD 4.45Å; Y232-M240 HydrophobicContact CE1-CE 4.48Å; Y232-M240 HydrophobicContact CE1-SD 4.29Å; Y232-M240 HydrophobicContact CE2-SD 4.37Å; Y232-M240 HydrophobicContact CG-SD 4.44Å; M240-S243 PolarHBondContact O-N 2.65Å; M240-I244 HydrophobicContact CE-CD1 4.3Å; M240-I244 HydrophobicContact CE-CG1 3.95Å; M240-I244 HydrophobicContact CG-CD1 4.14Å; M240-I244 WeakPolarHBondContact O-CD1 3.49Å; M240-I244 VanDerWaalsContact O-CG1 3.25Å; M240-I244 WeakPolarHBondContact O-CG1 3.38Å; M240-I244 PolarHBondContact O-N 3.39Å; M240-V260 HydrophobicContact CB-CG1 4.3Å; M240-V260 HydrophobicContact CG-CG1 4.22Å; M240-V260 HydrophobicContact CG-CG2 3.99Å
241	L	98.4	Very high	98.1	Very high	32 Å²	32	60.1 Å²	60.1	17%	0.168	30%	0.296	C	S	.	.	H	α-helix	trans	-68	-46.6	-179.3	-69.1	173.1	0	0	0	110.9	D239 S243 I244 R245 L257 V260 Q261	D239-L241 VanDerWaalsContact C-N 3.33Å; D239-L241 PolarHBondContact O-N 3.14Å; D239-L241 PolarHBondContact OD1-N 3.21Å; L241-S243 VanDerWaalsContact C-N 3.33Å; L241-I244 PolarHBondContact O-N 3.18Å; L241-R245 WeakPolarHBondContact O-CG 3.38Å; L241-R245 PolarHBondContact O-N 3.5Å; L241-R245 VanDerWaalsContact O-N 3.15Å; L241-L257 HydrophobicContact CB-CD2 4.27Å; L241-L257 HydrophobicContact CD2-CD2 3.77Å; L241-V260 HydrophobicContact CD2-CB 3.82Å; L241-V260 HydrophobicContact CD2-CG1 3.56Å; L241-V260 HydrophobicContact CG-CG1 3.95Å; L241-Q261 HydrophobicContact CD1-CG 4.4Å; L241-Q261 HydrophobicContact CD2-CG 4.05Å
242	E	98.3	Very high	98.1	Very high	67 Å²	67	56.3 Å²	56.3	31%	0.313	28%	0.283	S	S	.	.	H	α-helix	trans	-67.3	-35.6	177.9	179.6	60.8	-165.4	0	0	111.6	Y238 D239 R245 K246	Y238-E242 HydrophobicContact CD1-CG 3.93Å; Y238-E242 HydrophobicContact CG-CG 4.02Å; D239-E242 PolarHBondContact O-N 3.33Å; D239-E242 PolarHBondContact OD1-N 3.32Å; E242-R245 PolarHBondContact O-N 3.04Å; E242-K246 WeakPolarHBondContact O-CG 3.41Å; E242-K246 PolarHBondContact O-N 3.46Å; E242-K246 WeakPolarHBondContact OE1-CE 3.29Å; E242-K246 IonicContact OE1-NZ 3.45Å; E242-K246 PolarHBondContact OE1-NZ 3.47Å
243	S	98.4	Very high	98.1	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.6	-44.7	172.8	-58.1	0	0	0	0	111.2	Y232 S236 D239 M240 L241 R245 K246 E247	Y232-S243 VanDerWaalsContact CE1-OG 3.3Å; Y232-S243 WeakPolarHBondContact CE1-OG 3.44Å; Y232-S243 WeakPolarHBondContact OH-CB 3.46Å; Y232-S243 PolarHBondContact OH-OG 3.28Å; S236-S243 PolarHBondContact OG-OG 2.97Å; D239-S243 VanDerWaalsContact O-CB 3.29Å; D239-S243 WeakPolarHBondContact O-CB 3.47Å; D239-S243 PolarHBondContact O-N 3.43Å; D239-S243 PolarHBondContact O-OG 3.4Å; M240-S243 PolarHBondContact O-N 2.65Å; L241-S243 VanDerWaalsContact C-N 3.33Å; S243-R245 VanDerWaalsContact C-N 3.34Å; S243-R245 PolarHBondContact O-N 3.44Å; S243-K246 PolarHBondContact O-N 2.97Å; S243-K246 VanDerWaalsContact O-N 3.14Å; S243-E247 VanDerWaalsContact O-CB 3.29Å; S243-E247 WeakPolarHBondContact O-CB 3.32Å; S243-E247 VanDerWaalsContact O-CG 3.23Å; S243-E247 WeakPolarHBondContact O-CG 3.48Å; S243-E247 PolarHBondContact O-N 2.9Å
244	I	98.5	Very high	98.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-57.1	-46.5	175.9	-72.4	158	0	0	0	111.3	W213 M240 L241 K246 E247 V248 E253 F256 L257 V260	W213-I244 HydrophobicContact CE3-CG1 4.3Å; W213-I244 HydrophobicContact CH2-CG1 3.98Å; W213-I244 HydrophobicContact CZ3-CB 4.22Å; W213-I244 HydrophobicContact CZ3-CG1 3.49Å; W213-I244 VanDerWaalsContact CZ3-CG1 3.49Å; M240-I244 HydrophobicContact CE-CD1 4.3Å; M240-I244 HydrophobicContact CE-CG1 3.95Å; M240-I244 HydrophobicContact CG-CD1 4.14Å; M240-I244 WeakPolarHBondContact O-CD1 3.49Å; M240-I244 VanDerWaalsContact O-CG1 3.25Å; M240-I244 WeakPolarHBondContact O-CG1 3.38Å; M240-I244 PolarHBondContact O-N 3.39Å; L241-I244 PolarHBondContact O-N 3.18Å; I244-K246 PolarHBondContact O-N 3.41Å; I244-E247 PolarHBondContact O-N 3.49Å; I244-V248 HydrophobicContact CG2-CG2 3.73Å; I244-V248 VanDerWaalsContact O-CG2 3.22Å; I244-V248 WeakPolarHBondContact O-CG2 3.27Å; I244-V248 PolarHBondContact O-N 3Å; I244-E253 HydrophobicContact CG2-CG 4.09Å; I244-F256 HydrophobicContact CD1-CB 3.84Å; I244-F256 HydrophobicContact CG1-CB 4.07Å; I244-F256 HydrophobicContact CG2-CB 3.71Å; I244-L257 HydrophobicContact CB-CD2 4.01Å; I244-L257 HydrophobicContact CG2-CD2 3.75Å; I244-L257 HydrophobicContact CG2-CG 3.78Å; I244-V260 HydrophobicContact CD1-CB 4.24Å; I244-V260 HydrophobicContact CD1-CG2 3.5Å; I244-V260 VanDerWaalsContact CD1-CG2 3.5Å
245	R	98.3	Very high	98.1	Very high	124 Å²	124	52.5 Å²	52.5	47%	0.468	26%	0.261	S	S	.	.	H	α-helix	trans	-61	-27.7	179	-65.9	179.5	-161.6	-76.9	0.7	113.7	L241 E242 S243 L257	L241-R245 WeakPolarHBondContact O-CG 3.38Å; L241-R245 PolarHBondContact O-N 3.5Å; L241-R245 VanDerWaalsContact O-N 3.15Å; E242-R245 PolarHBondContact O-N 3.04Å; S243-R245 VanDerWaalsContact C-N 3.34Å; S243-R245 PolarHBondContact O-N 3.44Å; R245-L257 HydrophobicContact CG-CD1 4.22Å; R245-L257 HydrophobicContact CG-CD2 4.1Å
246	K	97.9	Very high	98.2	Very high	95 Å²	95	49.8 Å²	49.8	41%	0.413	25%	0.25	S	S	.	.	H	α-helix	trans	-86.4	-33.6	179	-69.5	-172.8	-168.1	-48.9	0	113	Y238 E242 S243 I244	Y238-K246 HydrophobicContact CD2-CD 3.81Å; Y238-K246 HydrophobicContact CE1-CD 4.35Å; Y238-K246 VanDerWaalsContact CE1-CE 3.43Å; Y238-K246 HydrophobicContact CE2-CD 3.54Å; Y238-K246 HydrophobicContact CG-CD 4.32Å; E242-K246 WeakPolarHBondContact O-CG 3.41Å; E242-K246 PolarHBondContact O-N 3.46Å; E242-K246 WeakPolarHBondContact OE1-CE 3.29Å; E242-K246 IonicContact OE1-NZ 3.45Å; E242-K246 PolarHBondContact OE1-NZ 3.47Å; S243-K246 PolarHBondContact O-N 2.97Å; S243-K246 VanDerWaalsContact O-N 3.14Å; I244-K246 PolarHBondContact O-N 3.41Å
247	E	97.9	Very high	98.2	Very high	45 Å²	45	50 Å²	50	21%	0.21	25%	0.251	C	S	.	.	H	α-helix	trans	-90.5	-38.8	-168.9	-73.5	-56.2	124.3	0	0	113.2	G202 V203 T208 W213 S243 I244	G202-E247 WeakPolarHBondContact CA-OE2 3.48Å; V203-E247 HydrophobicContact CG2-CG 4.35Å; T208-E247 HydrophobicContact CG2-CB 4.14Å; T208-E247 WeakPolarHBondContact OG1-CB 3.5Å; T208-E247 PolarHBondContact OG1-O 2.84Å; T208-E247 VanDerWaalsContact OG1-O 3.1Å; T208-E247 PolarHBondContact OG1-OE2 3.35Å; W213-E247 HydrophobicContact CH2-CB 3.69Å; W213-E247 HydrophobicContact CH2-CG 3.87Å; W213-E247 HydrophobicContact CZ2-CB 4.38Å; W213-E247 HydrophobicContact CZ2-CG 4.19Å; W213-E247 HydrophobicContact CZ3-CB 4.22Å; S243-E247 VanDerWaalsContact O-CB 3.29Å; S243-E247 WeakPolarHBondContact O-CB 3.32Å; S243-E247 VanDerWaalsContact O-CG 3.23Å; S243-E247 WeakPolarHBondContact O-CG 3.48Å; S243-E247 PolarHBondContact O-N 2.9Å; I244-E247 PolarHBondContact O-N 3.49Å
248	V	97.7	Very high	98.3	Very high	8 Å²	8	45.8 Å²	45.8	5%	0.048	22%	0.223	C	C	.	.			trans	-126	166.5	-175.3	-65.3	0	0	0	0	111.7	T208 V210 I244 L252 E253 F256	T208-V248 HydrophobicContact CG2-CG1 4.36Å; V210-V248 HydrophobicContact CG2-CG1 4.11Å; I244-V248 HydrophobicContact CG2-CG2 3.73Å; I244-V248 VanDerWaalsContact O-CG2 3.22Å; I244-V248 WeakPolarHBondContact O-CG2 3.27Å; I244-V248 PolarHBondContact O-N 3Å; V248-L252 HydrophobicContact CB-CD2 4.06Å; V248-L252 HydrophobicContact CB-CG 4.31Å; V248-L252 HydrophobicContact CG1-CD2 3.78Å; V248-L252 HydrophobicContact CG1-CG 4.37Å; V248-E253 HydrophobicContact CG2-CB 3.94Å; V248-E253 HydrophobicContact CG2-CG 4.3Å; V248-F256 HydrophobicContact CG2-CD2 4.24Å
249	K	97.6	Very high	98.3	Very high	172 Å²	172	41.4 Å²	41.4	75%	0.748	21%	0.206	S	C	*	.			trans	-140.7	165.8	-177.5	-61.8	-175.8	-178.1	177.3	0	111.8	E253	K249-E253 WeakPolarHBondContact CA-OE2 3.37Å; K249-E253 PolarHBondContact O-N 3.31Å
250	G	97.9	Very high	98.3	Very high	49 Å²	49	38.1 Å²	38.1	51%	0.505	19%	0.188	S	C	.	.	H	α-helix	trans	67	-146.5	172.8	0	0	0	0	0	112.5	L252 E253 N254	G250-L252 PolarHBondContact O-N 2.77Å; G250-E253 WeakPolarHBondContact O-CB 3.21Å; G250-E253 PolarHBondContact O-N 2.88Å; G250-E253 VanDerWaalsContact O-N 3.08Å; G250-N254 PolarHBondContact O-N 3.28Å
251	D	97.8	Very high	98.3	Very high	69 Å²	69	40.3 Å²	40.3	37%	0.369	20%	0.199	S	C	.	.	H	α-helix	trans	-65	-27.6	-175.6	-51.9	-50.2	0	0	0	113	E125 F167 N254 A255	E125-D251 HydrophobicContact CG-CB 4.37Å; F167-D251 HydrophobicContact CB-CB 4.45Å; F167-D251 HydrophobicContact CD1-CB 3.91Å; F167-D251 HydrophobicContact CD2-CB 3.94Å; F167-D251 HydrophobicContact CE1-CB 4.09Å; F167-D251 HydrophobicContact CE2-CB 4.15Å; F167-D251 HydrophobicContact CG-CB 3.83Å; F167-D251 HydrophobicContact CZ-CB 4.22Å; D251-N254 PolarHBondContact O-N 3.35Å; D251-A255 WeakPolarHBondContact O-CB 3.31Å; D251-A255 PolarHBondContact O-N 2.78Å
252	L	98.5	Very high	98.3	Very high	23 Å²	23	39.1 Å²	39.1	12%	0.12	19%	0.193	C	C	.	.	H	α-helix	trans	-65	-44.6	173.2	-176.7	65.8	0	0	0	111.5	D166 L170 V210 V248 G250 A255 F256	D166-L252 HydrophobicContact CB-CD1 4.08Å; D166-L252 HydrophobicContact CB-CD2 4.01Å; L170-L252 HydrophobicContact CD2-CD1 4.29Å; V210-L252 HydrophobicContact CG1-CD1 4.2Å; V210-L252 HydrophobicContact CG1-CD2 3.85Å; V210-L252 HydrophobicContact CG2-CD2 4.04Å; V248-L252 HydrophobicContact CB-CD2 4.06Å; V248-L252 HydrophobicContact CB-CG 4.31Å; V248-L252 HydrophobicContact CG1-CD2 3.78Å; V248-L252 HydrophobicContact CG1-CG 4.37Å; G250-L252 PolarHBondContact O-N 2.77Å; L252-A255 PolarHBondContact O-N 2.89Å; L252-F256 HydrophobicContact CD1-CD2 3.84Å; L252-F256 HydrophobicContact CD1-CE2 3.48Å; L252-F256 VanDerWaalsContact CD1-CE2 3.48Å; L252-F256 HydrophobicContact CD1-CZ 4.38Å; L252-F256 HydrophobicContact CD2-CE2 4.37Å; L252-F256 HydrophobicContact CG-CD2 3.9Å; L252-F256 HydrophobicContact CG-CE2 3.82Å; L252-F256 VanDerWaalsContact O-CD2 3.29Å; L252-F256 WeakPolarHBondContact O-CD2 3.49Å; L252-F256 PolarHBondContact O-N 3.48Å
253	E	98.6	Very high	98.3	Very high	45 Å²	45	36.1 Å²	36.1	21%	0.21	18%	0.179	C	C	.	.	H	α-helix	trans	-61.2	-49.4	173.7	-174.5	-167.6	163.1	0	0	110.3	I244 V248 K249 G250 A255 F256 L257	I244-E253 HydrophobicContact CG2-CG 4.09Å; V248-E253 HydrophobicContact CG2-CB 3.94Å; V248-E253 HydrophobicContact CG2-CG 4.3Å; K249-E253 WeakPolarHBondContact CA-OE2 3.37Å; K249-E253 PolarHBondContact O-N 3.31Å; G250-E253 WeakPolarHBondContact O-CB 3.21Å; G250-E253 PolarHBondContact O-N 2.88Å; G250-E253 VanDerWaalsContact O-N 3.08Å; E253-A255 VanDerWaalsContact C-N 3.31Å; E253-A255 PolarHBondContact O-N 3.46Å; E253-F256 PolarHBondContact O-N 3.45Å; E253-L257 HydrophobicContact CG-CD1 3.92Å; E253-L257 HydrophobicContact CG-CG 4.3Å; E253-L257 WeakPolarHBondContact O-CB 3.14Å; E253-L257 VanDerWaalsContact O-CG 3.27Å; E253-L257 WeakPolarHBondContact O-CG 3.48Å; E253-L257 PolarHBondContact O-N 3.37Å
254	N	98.3	Very high	98.3	Very high	48 Å²	48	39.3 Å²	39.3	26%	0.257	19%	0.194	S	C	.	.	H	α-helix	trans	-57	-46	179.3	-167.5	25.9	0	0	0	111.1	I129 G250 D251 L257 N258	I129-N254 HydrophobicContact CD1-CB 3.96Å; I129-N254 WeakPolarHBondContact CD1-ND2 3.17Å; G250-N254 PolarHBondContact O-N 3.28Å; D251-N254 PolarHBondContact O-N 3.35Å; N254-L257 PolarHBondContact O-N 3.47Å; N254-N258 WeakPolarHBondContact O-CB 3.29Å; N254-N258 PolarHBondContact O-N 2.86Å; N254-N258 PolarHBondContact O-ND2 3.35Å; N254-N258 PolarHBondContact OD1-ND2 3.15Å
255	A	98.7	Very high	98.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.9	-47.9	179	0	0	0	0	0	112.9	I129 F167 L170 M171 D251 L252 E253 N258 L259	I129-A255 HydrophobicContact CD1-CB 4.05Å; I129-A255 HydrophobicContact CG1-CB 4.04Å; F167-A255 HydrophobicContact CD2-CB 3.98Å; F167-A255 HydrophobicContact CE2-CB 3.95Å; L170-A255 HydrophobicContact CD2-CB 3.6Å; M171-A255 HydrophobicContact CE-CB 3.68Å; D251-A255 WeakPolarHBondContact O-CB 3.31Å; D251-A255 PolarHBondContact O-N 2.78Å; L252-A255 PolarHBondContact O-N 2.89Å; E253-A255 VanDerWaalsContact C-N 3.31Å; E253-A255 PolarHBondContact O-N 3.46Å; A255-N258 PolarHBondContact O-N 3.04Å; A255-L259 WeakPolarHBondContact O-CB 3.34Å; A255-L259 PolarHBondContact O-N 3.48Å
256	F	98.8	Very high	98.3	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.5	-42.2	177.6	-83.1	-58.9	0	0	0	112.2	L170 V210 W213 I214 M217 I244 V248 L252 E253 N258 L259 V260	L170-F256 HydrophobicContact CD1-CE1 4.24Å; L170-F256 HydrophobicContact CD2-CD1 3.94Å; L170-F256 HydrophobicContact CD2-CD2 4.22Å; L170-F256 HydrophobicContact CD2-CE1 3.96Å; L170-F256 HydrophobicContact CD2-CE2 4.25Å; L170-F256 HydrophobicContact CD2-CG 4.07Å; L170-F256 HydrophobicContact CD2-CZ 4.12Å; V210-F256 HydrophobicContact CG1-CE2 4.15Å; V210-F256 HydrophobicContact CG1-CZ 4.37Å; W213-F256 HydrophobicContact CB-CE1 4.13Å; W213-F256 HydrophobicContact CB-CZ 3.81Å; W213-F256 HydrophobicContact CE3-CD2 4.39Å; W213-F256 HydrophobicContact CE3-CE2 4.21Å; W213-F256 HydrophobicContact CE3-CZ 4.31Å; I214-F256 HydrophobicContact CG1-CE1 4.41Å; I214-F256 HydrophobicContact CG1-CZ 3.75Å; M217-F256 HydrophobicContact SD-CD1 3.54Å; M217-F256 VanDerWaalsContact SD-CD1 3.54Å; M217-F256 HydrophobicContact SD-CE1 3.73Å; I244-F256 HydrophobicContact CD1-CB 3.84Å; I244-F256 HydrophobicContact CG1-CB 4.07Å; I244-F256 HydrophobicContact CG2-CB 3.71Å; V248-F256 HydrophobicContact CG2-CD2 4.24Å; L252-F256 HydrophobicContact CD1-CD2 3.84Å; L252-F256 HydrophobicContact CD1-CE2 3.48Å; L252-F256 VanDerWaalsContact CD1-CE2 3.48Å; L252-F256 HydrophobicContact CD1-CZ 4.38Å; L252-F256 HydrophobicContact CD2-CE2 4.37Å; L252-F256 HydrophobicContact CG-CD2 3.9Å; L252-F256 HydrophobicContact CG-CE2 3.82Å; L252-F256 VanDerWaalsContact O-CD2 3.29Å; L252-F256 WeakPolarHBondContact O-CD2 3.49Å; L252-F256 PolarHBondContact O-N 3.48Å; E253-F256 PolarHBondContact O-N 3.45Å; F256-N258 VanDerWaalsContact C-N 3.32Å; F256-N258 PolarHBondContact O-N 3.47Å; F256-L259 PolarHBondContact O-N 2.66Å; F256-V260 WeakPolarHBondContact O-CB 3.34Å; F256-V260 WeakPolarHBondContact O-CG2 3.39Å; F256-V260 PolarHBondContact O-N 2.81Å
257	L	98.7	Very high	98.4	Very high	13 Å²	13	34.4 Å²	34.4	7%	0.068	18%	0.18	C	C	.	.	H	α-helix	trans	-60.5	-42.2	176.2	-70.5	177	0	0	0	111.6	L241 I244 R245 E253 N254 Q261	L241-L257 HydrophobicContact CB-CD2 4.27Å; L241-L257 HydrophobicContact CD2-CD2 3.77Å; I244-L257 HydrophobicContact CB-CD2 4.01Å; I244-L257 HydrophobicContact CG2-CD2 3.75Å; I244-L257 HydrophobicContact CG2-CG 3.78Å; R245-L257 HydrophobicContact CG-CD1 4.22Å; R245-L257 HydrophobicContact CG-CD2 4.1Å; E253-L257 HydrophobicContact CG-CD1 3.92Å; E253-L257 HydrophobicContact CG-CG 4.3Å; E253-L257 WeakPolarHBondContact O-CB 3.14Å; E253-L257 VanDerWaalsContact O-CG 3.27Å; E253-L257 WeakPolarHBondContact O-CG 3.48Å; E253-L257 PolarHBondContact O-N 3.37Å; N254-L257 PolarHBondContact O-N 3.47Å; L257-Q261 WeakPolarHBondContact O-CB 3.49Å; L257-Q261 VanDerWaalsContact O-CG 3.23Å; L257-Q261 WeakPolarHBondContact O-CG 3.37Å; L257-Q261 PolarHBondContact O-N 2.95Å; L257-Q261 VanDerWaalsContact O-N 3.1Å; L257-Q261 PolarHBondContact O-NE2 3.1Å
258	N	98.7	Very high	98.4	Very high	7 Å²	7	34.2 Å²	34.2	4%	0.037	18%	0.18	C	C	.	.	H	α-helix	trans	-67.3	-43.1	177.8	-81.3	-109.8	0	0	0	111.3	I129 C133 N254 A255 F256 Q261 C262 Y269	I129-N258 HydrophobicContact CG2-CB 3.37Å; C133-N258 HydrophobicContact CB-CB 4.31Å; N254-N258 WeakPolarHBondContact O-CB 3.29Å; N254-N258 PolarHBondContact O-N 2.86Å; N254-N258 PolarHBondContact O-ND2 3.35Å; N254-N258 PolarHBondContact OD1-ND2 3.15Å; A255-N258 PolarHBondContact O-N 3.04Å; F256-N258 VanDerWaalsContact C-N 3.32Å; F256-N258 PolarHBondContact O-N 3.47Å; N258-Q261 PolarHBondContact O-N 3.45Å; N258-C262 WeakPolarHBondContact O-CB 3.14Å; N258-C262 PolarHBondContact O-N 3Å; N258-C262 PolarHBondContact O-SG 2.9Å; N258-Y269 HydrophobicContact CB-CE2 4.14Å; N258-Y269 WeakPolarHBondContact OD1-CE2 3.44Å; N258-Y269 VanDerWaalsContact OD1-CZ 3.29Å; N258-Y269 PolarHBondContact OD1-OH 3.23Å
259	L	98.7	Very high	98.4	Very high	2 Å²	2	34 Å²	34	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-62.1	-48.1	177.6	179.4	60.7	0	0	0	112	C133 L170 L174 M217 A255 F256 Q261 C262 I263	C133-L259 HydrophobicContact CB-CB 4.34Å; L170-L259 HydrophobicContact CD1-CD2 4.23Å; L174-L259 HydrophobicContact CD1-CD1 4.27Å; L174-L259 HydrophobicContact CD1-CD2 4.25Å; L174-L259 HydrophobicContact CD2-CD1 3.88Å; L174-L259 HydrophobicContact CD2-CD2 4.19Å; M217-L259 HydrophobicContact CB-CD2 3.85Å; A255-L259 WeakPolarHBondContact O-CB 3.34Å; A255-L259 PolarHBondContact O-N 3.48Å; F256-L259 PolarHBondContact O-N 2.66Å; L259-Q261 PolarHBondContact O-N 3.39Å; L259-C262 WeakPolarHBondContact O-CB 3.29Å; L259-C262 PolarHBondContact O-N 3.26Å; L259-I263 HydrophobicContact CD1-CD1 3.94Å; L259-I263 HydrophobicContact CD1-CG1 4.32Å; L259-I263 HydrophobicContact CG-CD1 3.81Å; L259-I263 VanDerWaalsContact O-CG1 3.31Å; L259-I263 WeakPolarHBondContact O-CG1 3.22Å; L259-I263 PolarHBondContact O-N 3.43Å
260	V	98.7	Very high	98.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.6	-42.8	179.4	171.8	0	0	0	0	111	M217 F229 M240 L241 I244 F256 C262 I263 Q264	M217-V260 HydrophobicContact SD-CG2 4.03Å; F229-V260 HydrophobicContact CD2-CG1 4.11Å; F229-V260 HydrophobicContact CE2-CB 4.26Å; F229-V260 HydrophobicContact CE2-CG1 3.86Å; F229-V260 HydrophobicContact CE2-CG2 4Å; F229-V260 HydrophobicContact CZ-CG1 4.43Å; F229-V260 HydrophobicContact CZ-CG2 3.82Å; M240-V260 HydrophobicContact CB-CG1 4.3Å; M240-V260 HydrophobicContact CG-CG1 4.22Å; M240-V260 HydrophobicContact CG-CG2 3.99Å; L241-V260 HydrophobicContact CD2-CB 3.82Å; L241-V260 HydrophobicContact CD2-CG1 3.56Å; L241-V260 HydrophobicContact CG-CG1 3.95Å; I244-V260 HydrophobicContact CD1-CB 4.24Å; I244-V260 HydrophobicContact CD1-CG2 3.5Å; I244-V260 VanDerWaalsContact CD1-CG2 3.5Å; F256-V260 WeakPolarHBondContact O-CB 3.34Å; F256-V260 WeakPolarHBondContact O-CG2 3.39Å; F256-V260 PolarHBondContact O-N 2.81Å; V260-C262 PolarHBondContact O-N 3.22Å; V260-I263 PolarHBondContact O-N 3.34Å; V260-Q264 HydrophobicContact CG1-CG 4.24Å; V260-Q264 WeakPolarHBondContact O-CB 3.25Å; V260-Q264 WeakPolarHBondContact O-CG 3.39Å; V260-Q264 PolarHBondContact O-N 3.35Å
261	Q	98.6	Very high	98.5	Very high	48 Å²	48	23.4 Å²	23.4	22%	0.224	12%	0.119	C	C	.	.	H	α-helix	trans	-61	-42.6	174.3	-73.7	172.5	91.3	0	0	112	L241 L257 N258 L259 I263 Q264 N265 Y269	L241-Q261 HydrophobicContact CD1-CG 4.4Å; L241-Q261 HydrophobicContact CD2-CG 4.05Å; L257-Q261 WeakPolarHBondContact O-CB 3.49Å; L257-Q261 VanDerWaalsContact O-CG 3.23Å; L257-Q261 WeakPolarHBondContact O-CG 3.37Å; L257-Q261 PolarHBondContact O-N 2.95Å; L257-Q261 VanDerWaalsContact O-N 3.1Å; L257-Q261 PolarHBondContact O-NE2 3.1Å; N258-Q261 PolarHBondContact O-N 3.45Å; L259-Q261 PolarHBondContact O-N 3.39Å; Q261-I263 VanDerWaalsContact C-N 3.35Å; Q261-I263 PolarHBondContact O-N 3.29Å; Q261-Q264 PolarHBondContact O-N 2.72Å; Q261-N265 CarbonylContact O-C 3.59Å; Q261-N265 VanDerWaalsContact O-C 3.26Å; Q261-N265 PolarHBondContact O-N 3.06Å; Q261-Y269 HydrophobicContact CB-CD2 3.91Å; Q261-Y269 HydrophobicContact CB-CG 4.43Å
262	C	98.6	Very high	98.6	Very high	7 Å²	7	21.2 Å²	21.2	5%	0.047	11%	0.107	C	C	.	.	H	α-helix	trans	-62.1	-39.1	175	-75.9	0	0	0	0	112.9	C133 N258 L259 V260 K266 Y269	C133-C262 WeakPolarHBondContact O-CB 3.36Å; N258-C262 WeakPolarHBondContact O-CB 3.14Å; N258-C262 PolarHBondContact O-N 3Å; N258-C262 PolarHBondContact O-SG 2.9Å; L259-C262 WeakPolarHBondContact O-CB 3.29Å; L259-C262 PolarHBondContact O-N 3.26Å; V260-C262 PolarHBondContact O-N 3.22Å; C262-K266 WeakPolarHBondContact O-CB 3.41Å; C262-K266 PolarHBondContact O-N 2.89Å; C262-Y269 WeakPolarHBondContact SG-CD1 3.45Å
263	I	98.4	Very high	98.6	Very high	4 Å²	4	21.3 Å²	21.3	2%	0.021	11%	0.106	C	C	.	.	H	α-helix	trans	-68.7	-46.2	176.8	-70.7	161.1	0	0	0	110.7	V222 L225 Q226 F229 L259 V260 Q261	V222-I263 HydrophobicContact CG1-CG2 4.24Å; L225-I263 HydrophobicContact CB-CD1 4.4Å; L225-I263 HydrophobicContact CB-CG2 3.69Å; L225-I263 HydrophobicContact CD1-CD1 3.68Å; L225-I263 HydrophobicContact CD1-CG1 4.45Å; Q226-I263 HydrophobicContact CG-CG2 4Å; Q226-I263 WeakPolarHBondContact CG-O 3.49Å; Q226-I263 PolarHBondContact NE2-O 3.32Å; F229-I263 HydrophobicContact CD2-CG2 4.08Å; F229-I263 HydrophobicContact CE2-CB 3.98Å; F229-I263 HydrophobicContact CE2-CD1 4.02Å; F229-I263 HydrophobicContact CE2-CG2 3.58Å; F229-I263 HydrophobicContact CZ-CD1 4.11Å; F229-I263 HydrophobicContact CZ-CG2 4.5Å; L259-I263 HydrophobicContact CD1-CD1 3.94Å; L259-I263 HydrophobicContact CD1-CG1 4.32Å; L259-I263 HydrophobicContact CG-CD1 3.81Å; L259-I263 VanDerWaalsContact O-CG1 3.31Å; L259-I263 WeakPolarHBondContact O-CG1 3.22Å; L259-I263 PolarHBondContact O-N 3.43Å; V260-I263 PolarHBondContact O-N 3.34Å; Q261-I263 VanDerWaalsContact C-N 3.35Å; Q261-I263 PolarHBondContact O-N 3.29Å
264	Q	98	Very high	98.6	Very high	67 Å²	67	19.2 Å²	19.2	31%	0.313	10%	0.096	S	C	.	.	H	α-helix	trans	-69.7	-51.8	-176.6	-72.3	179.4	-38.4	0	0	112	Q226 F229 V260 Q261	Q226-Q264 PolarHBondContact NE2-O 2.91Å; F229-Q264 HydrophobicContact CD2-CG 3.96Å; V260-Q264 HydrophobicContact CG1-CG 4.24Å; V260-Q264 WeakPolarHBondContact O-CB 3.25Å; V260-Q264 WeakPolarHBondContact O-CG 3.39Å; V260-Q264 PolarHBondContact O-N 3.35Å; Q261-Q264 PolarHBondContact O-N 2.72Å
265	N	98.2	Very high	98.6	Very high	47 Å²	47	19.9 Å²	19.9	25%	0.251	10%	0.095	S	C	.	.	H	α-helix	trans	-158.7	87.9	-179.2	-172.2	-17.9	0	0	0	110.7	Q261 P267 L268 Y269 E306	Q261-N265 CarbonylContact O-C 3.59Å; Q261-N265 VanDerWaalsContact O-C 3.26Å; Q261-N265 PolarHBondContact O-N 3.06Å; N265-P267 VanDerWaalsContact OD1-CD 3.27Å; N265-P267 WeakPolarHBondContact OD1-CD 3.4Å; N265-L268 HydrophobicContact CB-CB 3.86Å; N265-L268 HydrophobicContact CB-CD2 4.46Å; N265-L268 WeakPolarHBondContact O-CB 3.24Å; N265-L268 PolarHBondContact O-N 3.14Å; N265-L268 VanDerWaalsContact O-N 3.15Å; N265-L268 PolarHBondContact OD1-N 3.21Å; N265-L268 VanDerWaalsContact OD1-N 3.08Å; N265-Y269 PolarHBondContact O-N 3.4Å; N265-E306 PolarHBondContact ND2-OE1 2.93Å; N265-E306 VanDerWaalsContact ND2-OE1 3.16Å
266	K	98.5	Very high	98.5	Very high	50 Å²	50	22.3 Å²	22.3	22%	0.217	11%	0.108	C	C	.	.	H	α-helix	trans	-57.4	-42.4	179.2	-167.5	-175	-55.6	-173.6	0	114.1	S134 C262 L268 Y269 F270	S134-K266 VanDerWaalsContact O-CE 3.24Å; S134-K266 WeakPolarHBondContact O-CE 3.21Å; S134-K266 PolarHBondContact O-NZ 2.79Å; C262-K266 WeakPolarHBondContact O-CB 3.41Å; C262-K266 PolarHBondContact O-N 2.89Å; K266-L268 VanDerWaalsContact C-N 3.34Å; K266-L268 PolarHBondContact O-N 2.74Å; K266-Y269 WeakPolarHBondContact O-CB 3.33Å; K266-Y269 PolarHBondContact O-N 2.73Å; K266-F270 HydrophobicContact CD-CE2 4.09Å; K266-F270 HydrophobicContact CG-CD2 4.02Å; K266-F270 HydrophobicContact CG-CE2 3.74Å; K266-F270 WeakPolarHBondContact O-CD2 3.42Å; K266-F270 PolarHBondContact O-N 3.29Å; K266-F270 VanDerWaalsContact O-N 3.1Å
267	P	98.7	Very high	98.5	Very high	19 Å²	19	22.4 Å²	22.4	12%	0.123	11%	0.109	C	C	.	.	H	α-helix	trans	-58.9	-40.7	172.8	-29.4	37.2	0	0	0	114.1	N265 F270 A271 K302 I303 E306	N265-P267 VanDerWaalsContact OD1-CD 3.27Å; N265-P267 WeakPolarHBondContact OD1-CD 3.4Å; P267-F270 PolarHBondContact O-N 2.99Å; P267-A271 PolarHBondContact O-N 2.9Å; P267-K302 HydrophobicContact CB-CB 3.73Å; P267-K302 HydrophobicContact CG-CB 3.74Å; P267-K302 HydrophobicContact CG-CD 4.1Å; P267-I303 HydrophobicContact CB-CG1 4.19Å; P267-E306 HydrophobicContact CB-CG 3.95Å
268	L	98.7	Very high	98.5	Very high	41 Å²	41	22 Å²	22	22%	0.215	11%	0.107	C	C	.	.	H	α-helix	trans	-66.8	-39.8	175.4	178	59.4	0	0	0	111.9	N265 K266 F270 A271 D272 E306 K310	N265-L268 HydrophobicContact CB-CB 3.86Å; N265-L268 HydrophobicContact CB-CD2 4.46Å; N265-L268 WeakPolarHBondContact O-CB 3.24Å; N265-L268 PolarHBondContact O-N 3.14Å; N265-L268 VanDerWaalsContact O-N 3.15Å; N265-L268 PolarHBondContact OD1-N 3.21Å; N265-L268 VanDerWaalsContact OD1-N 3.08Å; K266-L268 VanDerWaalsContact C-N 3.34Å; K266-L268 PolarHBondContact O-N 2.74Å; L268-F270 PolarHBondContact O-N 3.48Å; L268-A271 WeakPolarHBondContact O-CB 3.31Å; L268-A271 PolarHBondContact O-N 3.1Å; L268-D272 PolarHBondContact O-N 3.41Å; L268-E306 HydrophobicContact CB-CB 4.42Å; L268-E306 HydrophobicContact CB-CG 4.25Å; L268-E306 HydrophobicContact CD1-CB 4.43Å; L268-K310 HydrophobicContact CD1-CD 3.7Å
269	Y	98.7	Very high	98.2	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.008	13%	0.125	C	C	.	.	H	α-helix	trans	-53.7	-51	173.1	165.4	-102.6	0	0	0	111.7	E130 N258 Q261 C262 N265 K266 A271 D272 R273	E130-Y269 WeakPolarHBondContact CA-OH 3.35Å; E130-Y269 HydrophobicContact CG-CE1 4.35Å; E130-Y269 WeakPolarHBondContact CG-OH 3.38Å; N258-Y269 HydrophobicContact CB-CE2 4.14Å; N258-Y269 WeakPolarHBondContact OD1-CE2 3.44Å; N258-Y269 VanDerWaalsContact OD1-CZ 3.29Å; N258-Y269 PolarHBondContact OD1-OH 3.23Å; Q261-Y269 HydrophobicContact CB-CD2 3.91Å; Q261-Y269 HydrophobicContact CB-CG 4.43Å; C262-Y269 WeakPolarHBondContact SG-CD1 3.45Å; N265-Y269 PolarHBondContact O-N 3.4Å; K266-Y269 WeakPolarHBondContact O-CB 3.33Å; K266-Y269 PolarHBondContact O-N 2.73Å; Y269-A271 VanDerWaalsContact C-N 3.34Å; Y269-A271 PolarHBondContact O-N 3.33Å; Y269-D272 PolarHBondContact O-N 3.15Å; Y269-R273 HydrophobicContact CD1-CG 4.49Å; Y269-R273 HydrophobicContact CD2-CG 4.17Å; Y269-R273 HydrophobicContact CE1-CG 4.05Å; Y269-R273 HydrophobicContact CE2-CG 3.67Å; Y269-R273 VanDerWaalsContact O-CG 3.25Å; Y269-R273 WeakPolarHBondContact O-CG 3.46Å; Y269-R273 PolarHBondContact O-N 3.24Å
270	F	98.8	Very high	97.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-68.2	-32.8	178.4	-76.2	-62.7	0	0	0	112.8	E130 K266 P267 L268 D272 R273 L274 I291 R295 I303	E130-F270 HydrophobicContact CG-CE1 4.26Å; K266-F270 HydrophobicContact CD-CE2 4.09Å; K266-F270 HydrophobicContact CG-CD2 4.02Å; K266-F270 HydrophobicContact CG-CE2 3.74Å; K266-F270 WeakPolarHBondContact O-CD2 3.42Å; K266-F270 PolarHBondContact O-N 3.29Å; K266-F270 VanDerWaalsContact O-N 3.1Å; P267-F270 PolarHBondContact O-N 2.99Å; L268-F270 PolarHBondContact O-N 3.48Å; F270-D272 VanDerWaalsContact C-N 3.33Å; F270-R273 PolarHBondContact O-N 2.94Å; F270-L274 WeakPolarHBondContact O-CB 3.35Å; F270-L274 WeakPolarHBondContact O-CD1 3.44Å; F270-L274 VanDerWaalsContact O-CG 3.26Å; F270-L274 WeakPolarHBondContact O-CG 3.04Å; F270-L274 PolarHBondContact O-N 3.47Å; F270-I291 HydrophobicContact CB-CG2 4.25Å; F270-I291 HydrophobicContact CD1-CD1 4.06Å; F270-I291 HydrophobicContact CD1-CG1 3.96Å; F270-I291 HydrophobicContact CD1-CG2 3.82Å; F270-I291 HydrophobicContact CE1-CG1 4.27Å; F270-I291 HydrophobicContact CG-CG2 4.31Å; F270-R295 HydrophobicContact CD1-CG 4.28Å; F270-R295 HydrophobicContact CD2-CG 4.24Å; F270-R295 HydrophobicContact CE1-CG 4.31Å; F270-R295 HydrophobicContact CE2-CG 4.28Å; F270-R295 VanDerWaalsContact CE2-NE 3.34Å; F270-R295 HydrophobicContact CG-CG 4.24Å; F270-R295 HydrophobicContact CZ-CG 4.31Å; F270-I303 HydrophobicContact CB-CD1 3.59Å; F270-I303 HydrophobicContact CB-CG1 3.92Å; F270-I303 HydrophobicContact CB-CG2 4.32Å; F270-I303 HydrophobicContact CD2-CD1 4.11Å; F270-I303 HydrophobicContact CG-CD1 4.08Å
271	A	98.8	Very high	97.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.9	-43.5	172.8	0	0	0	0	0	111.6	P267 L268 Y269 L274 Y275 I303 E306 F307	P267-A271 PolarHBondContact O-N 2.9Å; L268-A271 WeakPolarHBondContact O-CB 3.31Å; L268-A271 PolarHBondContact O-N 3.1Å; Y269-A271 VanDerWaalsContact C-N 3.34Å; Y269-A271 PolarHBondContact O-N 3.33Å; A271-L274 PolarHBondContact O-N 2.88Å; A271-Y275 PolarHBondContact O-N 2.91Å; A271-I303 HydrophobicContact CB-CG2 4.28Å; A271-E306 HydrophobicContact CB-CB 4.13Å; A271-F307 HydrophobicContact CB-CB 3.82Å; A271-F307 HydrophobicContact CB-CD2 4.09Å; A271-F307 HydrophobicContact CB-CG 4.43Å; A271-F307 WeakPolarHBondContact O-CD2 3.2Å
272	D	98.6	Very high	96.8	Very high	22 Å²	22	40.3 Å²	40.3	12%	0.118	22%	0.219	C	C	.	.	H	α-helix	trans	-65.7	-43.1	177.1	-71	-7	0	0	0	111.8	L268 Y269 F270 L274 Y275 D276 K310 Y311	L268-D272 PolarHBondContact O-N 3.41Å; Y269-D272 PolarHBondContact O-N 3.15Å; F270-D272 VanDerWaalsContact C-N 3.33Å; D272-L274 PolarHBondContact O-N 3.24Å; D272-Y275 PolarHBondContact O-N 3.27Å; D272-D276 WeakPolarHBondContact O-CB 3.27Å; D272-D276 PolarHBondContact O-N 3.42Å; D272-K310 VanDerWaalsContact OD1-CD 3.3Å; D272-K310 WeakPolarHBondContact OD1-CD 3.49Å; D272-K310 VanDerWaalsContact OD1-CE 3.25Å; D272-K310 WeakPolarHBondContact OD1-CE 3.41Å; D272-K310 IonicContact OD1-NZ 2.81Å; D272-K310 PolarHBondContact OD1-NZ 2.97Å; D272-K310 IonicContact OD2-NZ 2.84Å; D272-K310 PolarHBondContact OD2-NZ 3.46Å; D272-Y311 WeakPolarHBondContact CA-OH 3.01Å; D272-Y311 PolarHBondContact OD1-OH 3.45Å
273	R	98.5	Very high	96.5	Very high	26 Å²	26	41.4 Å²	41.4	10%	0.098	23%	0.225	C	C	.	.	H	α-helix	trans	-62.5	-40.6	175.7	-66.4	-75.8	-66	166.9	1.4	112.2	D126 E130 Y269 F270 D276 S277 I291	D126-R273 VanDerWaalsContact CG-NH1 3.29Å; D126-R273 IonicContact OD1-CZ 3.29Å; D126-R273 IonicContact OD1-NH1 3.75Å; D126-R273 PolarHBondContact OD1-NH1 3.47Å; D126-R273 IonicContact OD1-NH2 2.68Å; D126-R273 IonicContact OD2-CZ 3.03Å; D126-R273 IonicContact OD2-NH1 2.55Å; D126-R273 PolarHBondContact OD2-NH1 3.24Å; D126-R273 VanDerWaalsContact OD2-NH1 3.1Å; D126-R273 IonicContact OD2-NH2 3.14Å; D126-R273 PolarHBondContact OD2-NH2 3.08Å; E130-R273 IonicContact OE2-CZ 3.33Å; E130-R273 IonicContact OE2-NE 3.48Å; E130-R273 PolarHBondContact OE2-NE 2.89Å; E130-R273 IonicContact OE2-NH2 3.1Å; E130-R273 PolarHBondContact OE2-NH2 3.5Å; Y269-R273 HydrophobicContact CD1-CG 4.49Å; Y269-R273 HydrophobicContact CD2-CG 4.17Å; Y269-R273 HydrophobicContact CE1-CG 4.05Å; Y269-R273 HydrophobicContact CE2-CG 3.67Å; Y269-R273 VanDerWaalsContact O-CG 3.25Å; Y269-R273 WeakPolarHBondContact O-CG 3.46Å; Y269-R273 PolarHBondContact O-N 3.24Å; F270-R273 PolarHBondContact O-N 2.94Å; R273-D276 PolarHBondContact O-N 3.41Å; R273-S277 WeakPolarHBondContact O-CB 3.42Å; R273-S277 PolarHBondContact O-N 3.26Å; R273-I291 HydrophobicContact CB-CD1 3.53Å
274	L	98.7	Very high	96.4	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-64.6	-44.3	174.8	-77	165.2	0	0	0	111.3	F270 A271 D272 D276 S277 M278 L288 I291 M292 I303 F307 L315	F270-L274 WeakPolarHBondContact O-CB 3.35Å; F270-L274 WeakPolarHBondContact O-CD1 3.44Å; F270-L274 VanDerWaalsContact O-CG 3.26Å; F270-L274 WeakPolarHBondContact O-CG 3.04Å; F270-L274 PolarHBondContact O-N 3.47Å; A271-L274 PolarHBondContact O-N 2.88Å; D272-L274 PolarHBondContact O-N 3.24Å; L274-D276 VanDerWaalsContact C-N 3.33Å; L274-D276 PolarHBondContact O-N 3.19Å; L274-S277 PolarHBondContact O-N 2.67Å; L274-S277 PolarHBondContact O-OG 3.49Å; L274-M278 HydrophobicContact CB-CE 4.35Å; L274-M278 VanDerWaalsContact O-CE 3.27Å; L274-M278 WeakPolarHBondContact O-CE 3Å; L274-M278 PolarHBondContact O-N 2.91Å; L274-L288 HydrophobicContact CD2-CD1 3.57Å; L274-I291 HydrophobicContact CD1-CG2 3.83Å; L274-I291 HydrophobicContact CD2-CB 3.94Å; L274-I291 HydrophobicContact CD2-CD1 4.36Å; L274-I291 HydrophobicContact CD2-CG2 3.83Å; L274-I291 HydrophobicContact CG-CB 4.29Å; L274-I291 HydrophobicContact CG-CD1 4.21Å; L274-I291 HydrophobicContact CG-CG2 3.75Å; L274-M292 HydrophobicContact CD1-SD 4.42Å; L274-M292 HydrophobicContact CD2-CG 4.25Å; L274-M292 HydrophobicContact CD2-SD 3.95Å; L274-I303 HydrophobicContact CD1-CG2 3.62Å; L274-F307 HydrophobicContact CB-CD2 4.33Å; L274-F307 HydrophobicContact CB-CE2 4.12Å; L274-L315 HydrophobicContact CB-CD1 4.02Å; L274-L315 HydrophobicContact CD1-CD1 3.91Å; L274-L315 HydrophobicContact CD1-CD2 3.75Å; L274-L315 HydrophobicContact CD2-CD1 4.48Å; L274-L315 HydrophobicContact CG-CD1 4.37Å
275	Y	98.4	Very high	96.4	Very high	62 Å²	62	46.4 Å²	46.4	24%	0.243	24%	0.243	C	C	.	.	H	α-helix	trans	-60.4	-46.4	175.4	-179.4	-100.6	0	0	0	110.6	A271 D272 S277 M278 K279 F307 Y311 Y318	A271-Y275 PolarHBondContact O-N 2.91Å; D272-Y275 PolarHBondContact O-N 3.27Å; Y275-S277 PolarHBondContact O-N 2.82Å; Y275-M278 CarbonylContact O-C 3.4Å; Y275-M278 PolarHBondContact O-N 2.78Å; Y275-K279 HydrophobicContact CD1-CB 4.14Å; Y275-K279 HydrophobicContact CD1-CD 3.79Å; Y275-K279 HydrophobicContact CD1-CG 4.5Å; Y275-K279 HydrophobicContact CE1-CB 3.81Å; Y275-K279 HydrophobicContact CE1-CD 3.6Å; Y275-K279 HydrophobicContact CE1-CG 4.32Å; Y275-K279 VanDerWaalsContact O-CB 3.32Å; Y275-K279 WeakPolarHBondContact O-CB 3.18Å; Y275-K279 PolarHBondContact O-N 3.16Å; Y275-F307 HydrophobicContact CD2-CZ 4.1Å; Y275-Y311 VanDerWaalsContact CB-CE2 3.47Å; Y275-Y311 HydrophobicContact CD1-CD1 4.1Å; Y275-Y311 AromaticContact CD1-CE1 3.38Å; Y275-Y311 HydrophobicContact CD1-CE1 3.38Å; Y275-Y311 HydrophobicContact CD1-CE2 4.47Å; Y275-Y311 AromaticContact CD1-CZ 3.59Å; Y275-Y311 AromaticContact CD2-CD1 3.51Å; Y275-Y311 HydrophobicContact CD2-CD1 3.51Å; Y275-Y311 HydrophobicContact CD2-CD2 4.03Å; Y275-Y311 AromaticContact CD2-CE1 3.64Å; Y275-Y311 HydrophobicContact CD2-CE1 3.64Å; Y275-Y311 HydrophobicContact CD2-CE2 4.16Å; Y275-Y311 AromaticContact CD2-CG 3.71Å; Y275-Y311 HydrophobicContact CD2-CG 3.71Å; Y275-Y311 AromaticContact CD2-CZ 3.95Å; Y275-Y311 HydrophobicContact CE1-CD1 4.16Å; Y275-Y311 AromaticContact CE1-CE1 3.66Å; Y275-Y311 HydrophobicContact CE1-CE1 3.66Å; Y275-Y311 AromaticContact CE2-CD1 3.59Å; Y275-Y311 HydrophobicContact CE2-CD1 3.59Å; Y275-Y311 AromaticContact CE2-CE1 3.91Å; Y275-Y311 HydrophobicContact CE2-CE1 3.91Å; Y275-Y311 HydrophobicContact CE2-CG 4.09Å; Y275-Y311 AromaticContact CG-CD1 3.78Å; Y275-Y311 HydrophobicContact CG-CD1 3.78Å; Y275-Y311 HydrophobicContact CG-CD2 4.16Å; Y275-Y311 AromaticContact CG-CE1 3.36Å; Y275-Y311 HydrophobicContact CG-CE1 3.36Å; Y275-Y311 AromaticContact CG-CE2 3.8Å; Y275-Y311 HydrophobicContact CG-CE2 3.8Å; Y275-Y311 HydrophobicContact CG-CG 4.14Å; Y275-Y311 AromaticContact CG-CZ 3.36Å; Y275-Y311 AromaticContact CZ-CD1 3.92Å; Y275-Y311 AromaticContact CZ-CE1 3.92Å; Y275-Y318 HydrophobicContact CD2-CE1 4.06Å; Y275-Y318 AromaticContact CE2-CE1 3.72Å; Y275-Y318 HydrophobicContact CE2-CE1 3.72Å; Y275-Y318 AromaticContact CE2-CZ 3.81Å
276	D	97.6	Very high	96.4	Very high	51 Å²	51	48.3 Å²	48.3	27%	0.273	25%	0.25	S	C	.	.	H	α-helix	trans	-63.2	-25.6	177.8	-79.6	17.7	0	0	0	113.7	D272 R273 L274 M278 K279	D272-D276 WeakPolarHBondContact O-CB 3.27Å; D272-D276 PolarHBondContact O-N 3.42Å; R273-D276 PolarHBondContact O-N 3.41Å; L274-D276 VanDerWaalsContact C-N 3.33Å; L274-D276 PolarHBondContact O-N 3.19Å; D276-M278 VanDerWaalsContact C-N 3.34Å; D276-K279 HydrophobicContact CB-CD 4.49Å; D276-K279 WeakPolarHBondContact OD1-CD 3.3Å; D276-K279 WeakPolarHBondContact OD1-CE 3.41Å; D276-K279 IonicContact OD1-NZ 2.67Å; D276-K279 PolarHBondContact OD1-NZ 2.73Å; D276-K279 IonicContact OD2-NZ 2.83Å; D276-K279 PolarHBondContact OD2-NZ 3.27Å
277	S	97.8	Very high	96.4	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-76.1	-19.6	174.8	78.2	0	0	0	0	114.2	R273 L274 Y275 R284	R273-S277 WeakPolarHBondContact O-CB 3.42Å; R273-S277 PolarHBondContact O-N 3.26Å; L274-S277 PolarHBondContact O-N 2.67Å; L274-S277 PolarHBondContact O-OG 3.49Å; Y275-S277 PolarHBondContact O-N 2.82Å; S277-R284 PolarHBondContact O-N 3.35Å
278	M	97.8	Very high	96.4	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.02	24%	0.237	C	C	.	.	H	α-helix	trans	-122.7	-1.9	-176.2	-64.4	178.8	-71.2	0	0	113.1	L274 Y275 D276 G280 T283 L288 L315 I319 D322	L274-M278 HydrophobicContact CB-CE 4.35Å; L274-M278 VanDerWaalsContact O-CE 3.27Å; L274-M278 WeakPolarHBondContact O-CE 3Å; L274-M278 PolarHBondContact O-N 2.91Å; Y275-M278 CarbonylContact O-C 3.4Å; Y275-M278 PolarHBondContact O-N 2.78Å; D276-M278 VanDerWaalsContact C-N 3.34Å; M278-G280 PolarHBondContact O-N 3.18Å; M278-T283 HydrophobicContact CG-CG2 4.25Å; M278-L288 HydrophobicContact CE-CD1 4.21Å; M278-L288 HydrophobicContact CG-CD1 4.48Å; M278-L288 HydrophobicContact CG-CD2 4.12Å; M278-L288 HydrophobicContact SD-CD1 4Å; M278-L288 HydrophobicContact SD-CD2 4.04Å; M278-L315 HydrophobicContact CE-CD1 3.7Å; M278-I319 HydrophobicContact CE-CG1 4.26Å; M278-I319 HydrophobicContact SD-CG1 3.87Å; M278-D322 WeakPolarHBondContact CA-OD2 3.49Å; M278-D322 HydrophobicContact CB-CB 4.27Å; M278-D322 WeakPolarHBondContact CB-OD2 3.47Å; M278-D322 HydrophobicContact CG-CB 4.1Å; M278-D322 HydrophobicContact SD-CB 4.37Å
279	K	92.9	Very high	96.4	Very high	99 Å²	99	43.8 Å²	43.8	43%	0.43	23%	0.227	S	C	.	.	S	Bend	trans	-79.2	123.7	177.9	77.3	-174.7	179.3	-170.2	0	109.5	Y275 D276	Y275-K279 HydrophobicContact CD1-CB 4.14Å; Y275-K279 HydrophobicContact CD1-CD 3.79Å; Y275-K279 HydrophobicContact CD1-CG 4.5Å; Y275-K279 HydrophobicContact CE1-CB 3.81Å; Y275-K279 HydrophobicContact CE1-CD 3.6Å; Y275-K279 HydrophobicContact CE1-CG 4.32Å; Y275-K279 VanDerWaalsContact O-CB 3.32Å; Y275-K279 WeakPolarHBondContact O-CB 3.18Å; Y275-K279 PolarHBondContact O-N 3.16Å; D276-K279 HydrophobicContact CB-CD 4.49Å; D276-K279 WeakPolarHBondContact OD1-CD 3.3Å; D276-K279 WeakPolarHBondContact OD1-CE 3.41Å; D276-K279 IonicContact OD1-NZ 2.67Å; D276-K279 PolarHBondContact OD1-NZ 2.73Å; D276-K279 IonicContact OD2-NZ 2.83Å; D276-K279 PolarHBondContact OD2-NZ 3.27Å
280	G	89.4	Confident	96.4	Very high	67 Å²	67	43.7 Å²	43.7	69%	0.691	23%	0.227	S	C	*	.	S	Bend	trans	97.6	-146.1	170.8	0	0	0	0	0	113.5	M278	M278-G280 PolarHBondContact O-N 3.18Å
281	K	86.8	Confident	96.4	Very high	224 Å²	224	43.7 Å²	43.7	97%	0.974	23%	0.227	S	C	*	.	S	Bend	trans	-89.4	114.5	-172.8	-175.2	178.3	177.9	179.6	0	110.5
282	G	90.1	Very high	96.4	Very high	51 Å²	51	43.7 Å²	43.7	53%	0.526	23%	0.227	S	C	.	.	S	Bend	trans	77.1	177.8	-179.9	0	0	0	0	0	112.2
283	T	93.7	Very high	96.4	Very high	31 Å²	31	43.2 Å²	43.2	19%	0.19	23%	0.225	C	C	.	.			trans	-117.1	139.9	-170.6	-43.5	0	0	0	0	109.4	M278 D285 L288 D322	M278-T283 HydrophobicContact CG-CG2 4.25Å; T283-D285 PolarHBondContact O-N 3.28Å; T283-D285 VanDerWaalsContact O-N 3.11Å; T283-L288 HydrophobicContact CG2-CD2 3.68Å; T283-D322 PolarHBondContact OG1-O 2.95Å; T283-D322 PolarHBondContact OG1-OD2 2.89Å
284	R	97	Very high	96.4	Very high	143 Å²	143	43 Å²	43	54%	0.54	23%	0.227	S	C	.	.			trans	-84.4	69.2	166.4	-60	179.4	-179.4	177.4	-1.2	108.6	S277 K286 V287 L288	S277-R284 PolarHBondContact O-N 3.35Å; R284-K286 PolarHBondContact O-N 3.45Å; R284-V287 HydrophobicContact CB-CB 4.39Å; R284-V287 HydrophobicContact CB-CG2 4.36Å; R284-V287 PolarHBondContact O-N 2.96Å; R284-L288 PolarHBondContact O-N 3.45Å; R284-L288 VanDerWaalsContact O-N 3.11Å
285	D	97.7	Very high	96.4	Very high	32 Å²	32	43.1 Å²	43.1	17%	0.171	23%	0.228	C	C	.	.	H	α-helix	trans	-53.8	-34.3	-169.4	-61.3	-82	0	0	0	113.3	H94 T283 V287 L288 I289 Y327	H94-D285 VanDerWaalsContact CE1-CB 3.46Å; H94-D285 WeakPolarHBondContact CE1-CB 3.32Å; H94-D285 VanDerWaalsContact CE1-CG 3.45Å; H94-D285 IonicContact CE1-OD2 3.8Å; H94-D285 IonicContact NE2-OD2 2.78Å; T283-D285 PolarHBondContact O-N 3.28Å; T283-D285 VanDerWaalsContact O-N 3.11Å; D285-V287 PolarHBondContact O-N 2.96Å; D285-L288 PolarHBondContact O-N 3.24Å; D285-I289 HydrophobicContact CB-CD1 4.35Å; D285-I289 VanDerWaalsContact O-CB 3.26Å; D285-I289 WeakPolarHBondContact O-CB 3.42Å; D285-I289 WeakPolarHBondContact O-CD1 3.36Å; D285-I289 WeakPolarHBondContact O-CG1 3.34Å; D285-I289 PolarHBondContact O-N 2.75Å; D285-Y327 VanDerWaalsContact OD1-CE1 3.28Å; D285-Y327 WeakPolarHBondContact OD1-CE1 3.33Å; D285-Y327 PolarHBondContact OD1-OH 2.82Å; D285-Y327 VanDerWaalsContact OD1-OH 3.11Å
286	K	97.3	Very high	96.4	Very high	88 Å²	88	40.3 Å²	40.3	38%	0.383	22%	0.217	S	C	.	.	H	α-helix	trans	-57.7	-46.7	176	-172.2	-178.2	-178.5	-174.3	0	112.2	D124 R284 R290	D124-K286 IonicContact OD2-NZ 2.68Å; D124-K286 PolarHBondContact OD2-NZ 2.89Å; R284-K286 PolarHBondContact O-N 3.45Å; K286-R290 VanDerWaalsContact O-CB 3.32Å; K286-R290 WeakPolarHBondContact O-CB 3.4Å; K286-R290 PolarHBondContact O-N 3.32Å; K286-R290 VanDerWaalsContact O-N 3.16Å
287	V	98.2	Very high	96.4	Very high	12 Å²	12	40.4 Å²	40.4	7%	0.073	22%	0.215	C	C	.	.	H	α-helix	trans	-70.7	-47	179.7	178.7	0	0	0	0	110.1	R284 D285 I289 R290 I291	R284-V287 HydrophobicContact CB-CB 4.39Å; R284-V287 HydrophobicContact CB-CG2 4.36Å; R284-V287 PolarHBondContact O-N 2.96Å; D285-V287 PolarHBondContact O-N 2.96Å; V287-I289 PolarHBondContact O-N 2.77Å; V287-R290 PolarHBondContact O-N 2.89Å; V287-I291 HydrophobicContact CG1-CD1 3.72Å; V287-I291 HydrophobicContact CG1-CG1 4.47Å; V287-I291 WeakPolarHBondContact O-CG1 3.25Å; V287-I291 PolarHBondContact O-N 3.26Å
288	L	98.7	Very high	96.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-57.2	-51.5	179.6	178	57.3	0	0	0	111.1	L274 M278 T283 R284 D285 R290 I291 M292 I319 T323 L331	L274-L288 HydrophobicContact CD2-CD1 3.57Å; M278-L288 HydrophobicContact CE-CD1 4.21Å; M278-L288 HydrophobicContact CG-CD1 4.48Å; M278-L288 HydrophobicContact CG-CD2 4.12Å; M278-L288 HydrophobicContact SD-CD1 4Å; M278-L288 HydrophobicContact SD-CD2 4.04Å; T283-L288 HydrophobicContact CG2-CD2 3.68Å; R284-L288 PolarHBondContact O-N 3.45Å; R284-L288 VanDerWaalsContact O-N 3.11Å; D285-L288 PolarHBondContact O-N 3.24Å; L288-R290 PolarHBondContact O-N 3.48Å; L288-I291 PolarHBondContact O-N 2.97Å; L288-M292 HydrophobicContact CD1-CG 3.82Å; L288-M292 HydrophobicContact CG-CG 4.45Å; L288-M292 WeakPolarHBondContact O-CB 3.33Å; L288-M292 WeakPolarHBondContact O-CG 3.34Å; L288-M292 PolarHBondContact O-N 2.76Å; L288-I319 HydrophobicContact CD1-CG1 4.48Å; L288-T323 HydrophobicContact CD2-CG2 3.8Å; L288-L331 HydrophobicContact CD1-CD1 4.49Å; L288-L331 HydrophobicContact CD2-CD1 3.62Å; L288-L331 HydrophobicContact CG-CD1 3.86Å
289	I	98.7	Very high	96.4	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-60.6	-47.8	-179.9	-67.9	169.4	0	0	0	110.7	H94 T97 V98 D285 V287 I291 M292 V293 Y327	H94-I289 HydrophobicContact CB-CD1 4.16Å; T97-I289 HydrophobicContact CG2-CD1 3.99Å; T97-I289 HydrophobicContact CG2-CG2 4.18Å; V98-I289 HydrophobicContact CG2-CB 4.35Å; V98-I289 HydrophobicContact CG2-CD1 3.96Å; V98-I289 HydrophobicContact CG2-CG1 3.7Å; V98-I289 HydrophobicContact CG2-CG2 3.82Å; D285-I289 HydrophobicContact CB-CD1 4.35Å; D285-I289 VanDerWaalsContact O-CB 3.26Å; D285-I289 WeakPolarHBondContact O-CB 3.42Å; D285-I289 WeakPolarHBondContact O-CD1 3.36Å; D285-I289 WeakPolarHBondContact O-CG1 3.34Å; D285-I289 PolarHBondContact O-N 2.75Å; V287-I289 PolarHBondContact O-N 2.77Å; I289-I291 PolarHBondContact O-N 3.16Å; I289-M292 PolarHBondContact O-N 3.06Å; I289-V293 HydrophobicContact CG2-CG2 4.15Å; I289-V293 WeakPolarHBondContact O-CB 3.46Å; I289-V293 VanDerWaalsContact O-CG2 3.31Å; I289-V293 WeakPolarHBondContact O-CG2 3.42Å; I289-V293 PolarHBondContact O-N 3.15Å; I289-Y327 HydrophobicContact CD1-CE2 3.83Å; I289-Y327 HydrophobicContact CG1-CE2 3.69Å; I289-Y327 WeakPolarHBondContact CG1-OH 3.32Å
290	R	98.8	Very high	96.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.8	-43.8	-177.2	-178.3	177.9	56.3	-119	2.6	113	Y109 E113 S127 E130 K286 V287 L288 S294	Y109-R290 HydrophobicContact CE1-CG 4.08Å; Y109-R290 VanDerWaalsContact OH-CA 3.25Å; Y109-R290 WeakPolarHBondContact OH-CA 3.35Å; E113-R290 HydrophobicContact CG-CG 4.21Å; E113-R290 WeakPolarHBondContact OE2-CD 3.38Å; E113-R290 IonicContact OE2-NH1 2.77Å; E113-R290 PolarHBondContact OE2-NH1 3.02Å; S127-R290 PolarHBondContact OG-NH1 3.39Å; S127-R290 PolarHBondContact OG-NH2 3.17Å; E130-R290 VanDerWaalsContact CD-NH2 3.32Å; E130-R290 IonicContact OE1-CZ 3.54Å; E130-R290 IonicContact OE1-NE 3.36Å; E130-R290 PolarHBondContact OE1-NE 2.67Å; E130-R290 IonicContact OE1-NH2 2.86Å; E130-R290 PolarHBondContact OE1-NH2 2.98Å; E130-R290 IonicContact OE2-CZ 3.63Å; E130-R290 IonicContact OE2-NE 2.86Å; E130-R290 IonicContact OE2-NH2 3.82Å; E130-R290 PolarHBondContact OE2-NH2 3.48Å; K286-R290 VanDerWaalsContact O-CB 3.32Å; K286-R290 WeakPolarHBondContact O-CB 3.4Å; K286-R290 PolarHBondContact O-N 3.32Å; K286-R290 VanDerWaalsContact O-N 3.16Å; V287-R290 PolarHBondContact O-N 2.89Å; L288-R290 PolarHBondContact O-N 3.48Å; R290-S294 VanDerWaalsContact O-CB 3.23Å; R290-S294 WeakPolarHBondContact O-CB 3.23Å; R290-S294 PolarHBondContact O-N 3.49Å; R290-S294 PolarHBondContact O-OG 3.49Å
291	I	98.8	Very high	97.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-69.2	-46.5	178.2	-62.6	171.5	0	0	0	110.2	F270 R273 L274 V287 L288 I289 V293 S294 R295	F270-I291 HydrophobicContact CB-CG2 4.25Å; F270-I291 HydrophobicContact CD1-CD1 4.06Å; F270-I291 HydrophobicContact CD1-CG1 3.96Å; F270-I291 HydrophobicContact CD1-CG2 3.82Å; F270-I291 HydrophobicContact CE1-CG1 4.27Å; F270-I291 HydrophobicContact CG-CG2 4.31Å; R273-I291 HydrophobicContact CB-CD1 3.53Å; L274-I291 HydrophobicContact CD1-CG2 3.83Å; L274-I291 HydrophobicContact CD2-CB 3.94Å; L274-I291 HydrophobicContact CD2-CD1 4.36Å; L274-I291 HydrophobicContact CD2-CG2 3.83Å; L274-I291 HydrophobicContact CG-CB 4.29Å; L274-I291 HydrophobicContact CG-CD1 4.21Å; L274-I291 HydrophobicContact CG-CG2 3.75Å; V287-I291 HydrophobicContact CG1-CD1 3.72Å; V287-I291 HydrophobicContact CG1-CG1 4.47Å; V287-I291 WeakPolarHBondContact O-CG1 3.25Å; V287-I291 PolarHBondContact O-N 3.26Å; L288-I291 PolarHBondContact O-N 2.97Å; I289-I291 PolarHBondContact O-N 3.16Å; I291-V293 VanDerWaalsContact C-N 3.3Å; I291-V293 PolarHBondContact O-N 2.9Å; I291-S294 PolarHBondContact O-N 2.7Å; I291-R295 HydrophobicContact CG2-CG 3.84Å; I291-R295 VanDerWaalsContact O-CB 3.29Å; I291-R295 WeakPolarHBondContact O-CB 3.31Å; I291-R295 VanDerWaalsContact O-CG 3.28Å; I291-R295 WeakPolarHBondContact O-CG 3.35Å; I291-R295 PolarHBondContact O-N 3.13Å
292	M	98.8	Very high	97.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.9	-39.6	-179.3	-67.4	-55.3	-63.8	0	0	112.2	L274 L288 I289 S296 M300 L315 I319 L331 L334 C335	L274-M292 HydrophobicContact CD1-SD 4.42Å; L274-M292 HydrophobicContact CD2-CG 4.25Å; L274-M292 HydrophobicContact CD2-SD 3.95Å; L288-M292 HydrophobicContact CD1-CG 3.82Å; L288-M292 HydrophobicContact CG-CG 4.45Å; L288-M292 WeakPolarHBondContact O-CB 3.33Å; L288-M292 WeakPolarHBondContact O-CG 3.34Å; L288-M292 PolarHBondContact O-N 2.76Å; I289-M292 PolarHBondContact O-N 3.06Å; M292-S296 VanDerWaalsContact O-CB 3.25Å; M292-S296 WeakPolarHBondContact O-CB 3.33Å; M292-S296 PolarHBondContact O-N 2.93Å; M292-M300 HydrophobicContact CE-CE 3.86Å; M292-M300 HydrophobicContact CE-SD 4.17Å; M292-M300 HydrophobicContact SD-CE 3.69Å; M292-M300 HydrophobicContact SD-SD 4.18Å; M292-L315 HydrophobicContact SD-CD2 4.11Å; M292-I319 HydrophobicContact CE-CD1 3.74Å; M292-I319 HydrophobicContact SD-CD1 4.01Å; M292-L331 HydrophobicContact CB-CD2 3.92Å; M292-L331 WeakPolarHBondContact CE-O 3.34Å; M292-L331 HydrophobicContact CG-CD2 4.1Å; M292-L334 HydrophobicContact CB-CD1 4.35Å; M292-L334 HydrophobicContact CE-CB 4.2Å; M292-C335 HydrophobicContact CE-CB 3.71Å
293	V	98.8	Very high	98.1	Very high	12 Å²	12	28.7 Å²	28.7	7%	0.073	14%	0.138	C	C	.	.	H	α-helix	trans	-70	-58.4	175.6	171.6	0	0	0	0	110.8	V98 L102 Y109 I289 I291 R295 S296 L334	V98-V293 HydrophobicContact CG1-CG2 4.48Å; L102-V293 HydrophobicContact CD2-CG1 4.14Å; L102-V293 HydrophobicContact CD2-CG2 4.13Å; L102-V293 HydrophobicContact CG-CG2 4.21Å; Y109-V293 HydrophobicContact CD1-CG1 3.85Å; Y109-V293 HydrophobicContact CE1-CB 3.86Å; Y109-V293 HydrophobicContact CE1-CG1 3.61Å; Y109-V293 HydrophobicContact CG-CG1 4.41Å; I289-V293 HydrophobicContact CG2-CG2 4.15Å; I289-V293 WeakPolarHBondContact O-CB 3.46Å; I289-V293 VanDerWaalsContact O-CG2 3.31Å; I289-V293 WeakPolarHBondContact O-CG2 3.42Å; I289-V293 PolarHBondContact O-N 3.15Å; I291-V293 VanDerWaalsContact C-N 3.3Å; I291-V293 PolarHBondContact O-N 2.9Å; V293-R295 VanDerWaalsContact C-N 3.29Å; V293-R295 PolarHBondContact O-N 2.77Å; V293-S296 PolarHBondContact O-N 2.75Å; V293-S296 PolarHBondContact O-OG 2.77Å; V293-L334 HydrophobicContact CG2-CD1 4.18Å
294	S	98.6	Very high	98.3	Very high	21 Å²	21	28.1 Å²	28.1	15%	0.147	13%	0.132	C	C	.	.	H	α-helix	trans	-67.3	-26.3	-170.5	63.5	0	0	0	0	114.1	R290 I291	R290-S294 VanDerWaalsContact O-CB 3.23Å; R290-S294 WeakPolarHBondContact O-CB 3.23Å; R290-S294 PolarHBondContact O-N 3.49Å; R290-S294 PolarHBondContact O-OG 3.49Å; I291-S294 PolarHBondContact O-N 2.7Å
295	R	98.7	Very high	98.4	Very high	4 Å²	4	25 Å²	25	2%	0.015	13%	0.131	C	C	.	.	H	α-helix	trans	-100.2	-11.2	-176.9	-49.4	-45.8	-63	174.9	-7.9	113.9	F270 I291 V293 E297 V298 D299 M300 I303	F270-R295 HydrophobicContact CD1-CG 4.28Å; F270-R295 HydrophobicContact CD2-CG 4.24Å; F270-R295 HydrophobicContact CE1-CG 4.31Å; F270-R295 HydrophobicContact CE2-CG 4.28Å; F270-R295 VanDerWaalsContact CE2-NE 3.34Å; F270-R295 HydrophobicContact CG-CG 4.24Å; F270-R295 HydrophobicContact CZ-CG 4.31Å; I291-R295 HydrophobicContact CG2-CG 3.84Å; I291-R295 VanDerWaalsContact O-CB 3.29Å; I291-R295 WeakPolarHBondContact O-CB 3.31Å; I291-R295 VanDerWaalsContact O-CG 3.28Å; I291-R295 WeakPolarHBondContact O-CG 3.35Å; I291-R295 PolarHBondContact O-N 3.13Å; V293-R295 VanDerWaalsContact C-N 3.29Å; V293-R295 PolarHBondContact O-N 2.77Å; R295-E297 PolarHBondContact O-N 3.37Å; R295-E297 VanDerWaalsContact O-N 3.16Å; R295-V298 PolarHBondContact O-N 2.82Å; R295-D299 IonicContact CZ-OD1 2.79Å; R295-D299 IonicContact CZ-OD2 3.84Å; R295-D299 IonicContact NE-OD1 3.57Å; R295-D299 PolarHBondContact NE-OD1 3.38Å; R295-D299 IonicContact NE-OD2 2.77Å; R295-D299 IonicContact NH2-OD1 2.8Å; R295-D299 PolarHBondContact NH2-OD1 2.96Å; R295-D299 VanDerWaalsContact NH2-OD1 3.14Å; R295-D299 IonicContact NH2-OD2 3.18Å; R295-D299 PolarHBondContact NH2-OD2 3.01Å; R295-D299 PolarHBondContact O-N 3.07Å; R295-M300 HydrophobicContact CB-CE 3.99Å; R295-M300 PolarHBondContact O-N 3.28Å; R295-I303 HydrophobicContact CB-CD1 3.68Å; R295-I303 HydrophobicContact CG-CD1 3.87Å
296	S	98.5	Very high	98.4	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.014	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-34.4	-176.9	56.9	0	0	0	0	114	G25 S26 V27 M292 V293	G25-S296 CarbonylContact C-O 3.49Å; G25-S296 VanDerWaalsContact CA-O 3.29Å; G25-S296 WeakPolarHBondContact CA-O 3.39Å; S26-S296 PolarHBondContact N-O 2.76Å; S26-S296 PolarHBondContact OG-O 3.48Å; V27-S296 PolarHBondContact N-O 2.77Å; M292-S296 VanDerWaalsContact O-CB 3.25Å; M292-S296 WeakPolarHBondContact O-CB 3.33Å; M292-S296 PolarHBondContact O-N 2.93Å; V293-S296 PolarHBondContact O-N 2.75Å; V293-S296 PolarHBondContact O-OG 2.77Å
297	E	98.2	Very high	98.5	Very high	53 Å²	53	20.2 Å²	20.2	25%	0.248	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	10	-179.5	-66.7	179	-132.2	0	0	113	V27 S64 N65 R68 R295	V27-E297 HydrophobicContact CB-CG 3.87Å; V27-E297 HydrophobicContact CG1-CG 4.19Å; S64-E297 WeakPolarHBondContact CA-OE2 3.23Å; S64-E297 WeakPolarHBondContact CB-OE2 3.41Å; N65-E297 VanDerWaalsContact N-CD 3.26Å; N65-E297 PolarHBondContact N-OE1 2.78Å; N65-E297 PolarHBondContact N-OE2 3.18Å; R68-E297 IonicContact CZ-OE1 3.94Å; R68-E297 IonicContact NH1-OE1 2.66Å; R68-E297 PolarHBondContact NH1-OE1 3.29Å; R68-E297 IonicContact NH2-OE1 3.46Å; R68-E297 PolarHBondContact NH2-OE1 3.18Å; R295-E297 PolarHBondContact O-N 3.37Å; R295-E297 VanDerWaalsContact O-N 3.16Å
298	V	98.1	Very high	98.5	Very high	45 Å²	45	23.8 Å²	23.8	27%	0.273	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-72.6	-175.7	-173.5	0	0	0	0	111.7	S22 Y24 G25 R295	S22-V298 VanDerWaalsContact CB-O 3.29Å; S22-V298 WeakPolarHBondContact CB-O 3.18Å; S22-V298 PolarHBondContact OG-O 3.12Å; Y24-V298 CarbonylContact C-O 3.58Å; G25-V298 PolarHBondContact N-O 3.34Å; R295-V298 PolarHBondContact O-N 2.82Å
299	D	97.7	Very high	98.4	Very high	14 Å²	14	31.6 Å²	31.6	8%	0.075	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-143.2	17.8	-169	56.8	-0.8	0	0	0	113.7	Y24 R295 L301 K302 I303	Y24-D299 CarbonylContact O-C 3.26Å; Y24-D299 WeakPolarHBondContact O-CA 3.48Å; R295-D299 IonicContact CZ-OD1 2.79Å; R295-D299 IonicContact CZ-OD2 3.84Å; R295-D299 IonicContact NE-OD1 3.57Å; R295-D299 PolarHBondContact NE-OD1 3.38Å; R295-D299 IonicContact NE-OD2 2.77Å; R295-D299 IonicContact NH2-OD1 2.8Å; R295-D299 PolarHBondContact NH2-OD1 2.96Å; R295-D299 VanDerWaalsContact NH2-OD1 3.14Å; R295-D299 IonicContact NH2-OD2 3.18Å; R295-D299 PolarHBondContact NH2-OD2 3.01Å; R295-D299 PolarHBondContact O-N 3.07Å; D299-L301 PolarHBondContact O-N 2.74Å; D299-L301 VanDerWaalsContact O-N 3.09Å; D299-K302 WeakPolarHBondContact O-CA 3.38Å; D299-K302 WeakPolarHBondContact O-CB 3.33Å; D299-K302 PolarHBondContact O-N 3.31Å; D299-I303 WeakPolarHBondContact O-CG1 3.25Å; D299-I303 PolarHBondContact O-N 3.42Å; D299-I303 VanDerWaalsContact OD1-CD1 3.3Å; D299-I303 WeakPolarHBondContact OD1-CD1 3.45Å
300	M	98.5	Very high	98.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-50.7	-36.8	179.5	-171.5	57	69.5	0	0	113.5	Y24 S26 M292 R295 K302 I303 R304 L315	Y24-M300 PolarHBondContact O-N 3.49Å; S26-M300 WeakPolarHBondContact OG-CB 3.3Å; S26-M300 WeakPolarHBondContact OG-CG 3.17Å; M292-M300 HydrophobicContact CE-CE 3.86Å; M292-M300 HydrophobicContact CE-SD 4.17Å; M292-M300 HydrophobicContact SD-CE 3.69Å; M292-M300 HydrophobicContact SD-SD 4.18Å; R295-M300 HydrophobicContact CB-CE 3.99Å; R295-M300 PolarHBondContact O-N 3.28Å; M300-K302 PolarHBondContact O-N 2.81Å; M300-I303 PolarHBondContact O-N 3.5Å; M300-R304 HydrophobicContact CG-CG 4.47Å; M300-R304 WeakPolarHBondContact O-CB 3.22Å; M300-R304 WeakPolarHBondContact O-CD 3.29Å; M300-R304 VanDerWaalsContact O-CG 3.24Å; M300-R304 WeakPolarHBondContact O-CG 3.29Å; M300-R304 PolarHBondContact O-N 3.47Å; M300-R304 HydrophobicContact SD-CG 4.47Å; M300-L315 HydrophobicContact SD-CD2 3.95Å
301	L	98.2	Very high	98.4	Very high	58 Å²	58	38.7 Å²	38.7	30%	0.304	18%	0.183	S	C	.	.	H	α-helix	trans	-66.4	-36.6	177.6	-60.2	-175.8	0	0	0	112.4	Y24 D299 S305	Y24-L301 WeakPolarHBondContact O-CB 3.46Å; Y24-L301 WeakPolarHBondContact O-CG 3.2Å; Y24-L301 PolarHBondContact O-N 2.79Å; D299-L301 PolarHBondContact O-N 2.74Å; D299-L301 VanDerWaalsContact O-N 3.09Å; L301-S305 PolarHBondContact O-N 3.28Å
302	K	98.2	Very high	98.3	Very high	86 Å²	86	41.5 Å²	41.5	37%	0.374	21%	0.212	S	C	.	.	H	α-helix	trans	-71.1	-41.5	173.8	-68.2	180	174.3	173.4	0	110.8	Y24 P267 D299 M300 R304 S305 E306	Y24-K302 HydrophobicContact CD1-CD 4.19Å; Y24-K302 VanDerWaalsContact CD1-CE 3.47Å; Y24-K302 HydrophobicContact CD1-CG 3.94Å; Y24-K302 HydrophobicContact CD2-CD 4.37Å; Y24-K302 VanDerWaalsContact CE1-CE 3.46Å; Y24-K302 VanDerWaalsContact CE2-CE 3.5Å; Y24-K302 VanDerWaalsContact CE2-NZ 3.33Å; Y24-K302 HydrophobicContact CG-CD 4.07Å; Y24-K302 VanDerWaalsContact CG-CE 3.48Å; Y24-K302 HydrophobicContact CG-CG 4.13Å; Y24-K302 VanDerWaalsContact CZ-CE 3.48Å; P267-K302 HydrophobicContact CB-CB 3.73Å; P267-K302 HydrophobicContact CG-CB 3.74Å; P267-K302 HydrophobicContact CG-CD 4.1Å; D299-K302 WeakPolarHBondContact O-CA 3.38Å; D299-K302 WeakPolarHBondContact O-CB 3.33Å; D299-K302 PolarHBondContact O-N 3.31Å; M300-K302 PolarHBondContact O-N 2.81Å; K302-R304 VanDerWaalsContact C-N 3.33Å; K302-R304 PolarHBondContact O-N 2.95Å; K302-S305 WeakPolarHBondContact O-CB 3.45Å; K302-S305 PolarHBondContact O-N 3.39Å; K302-E306 WeakPolarHBondContact O-CG 3.19Å; K302-E306 PolarHBondContact O-N 3.11Å
303	I	98.7	Very high	98.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-58.4	-46.3	176.7	-66.5	169.2	0	0	0	110.4	P267 F270 A271 L274 R295 D299 M300 S305 E306 F307	P267-I303 HydrophobicContact CB-CG1 4.19Å; F270-I303 HydrophobicContact CB-CD1 3.59Å; F270-I303 HydrophobicContact CB-CG1 3.92Å; F270-I303 HydrophobicContact CB-CG2 4.32Å; F270-I303 HydrophobicContact CD2-CD1 4.11Å; F270-I303 HydrophobicContact CG-CD1 4.08Å; A271-I303 HydrophobicContact CB-CG2 4.28Å; L274-I303 HydrophobicContact CD1-CG2 3.62Å; R295-I303 HydrophobicContact CB-CD1 3.68Å; R295-I303 HydrophobicContact CG-CD1 3.87Å; D299-I303 WeakPolarHBondContact O-CG1 3.25Å; D299-I303 PolarHBondContact O-N 3.42Å; D299-I303 VanDerWaalsContact OD1-CD1 3.3Å; D299-I303 WeakPolarHBondContact OD1-CD1 3.45Å; M300-I303 PolarHBondContact O-N 3.5Å; I303-S305 PolarHBondContact O-N 2.87Å; I303-E306 PolarHBondContact O-N 2.95Å; I303-F307 VanDerWaalsContact O-CB 3.25Å; I303-F307 WeakPolarHBondContact O-CB 3.17Å; I303-F307 PolarHBondContact O-N 3.28Å
304	R	98.5	Very high	98.1	Very high	19 Å²	19	46 Å²	46	7%	0.072	23%	0.233	C	C	.	.	H	α-helix	trans	-58.6	-45.3	176.6	-75.1	163.4	57.2	-173.3	-5.3	112.5	M300 K302 F307 K308 L315 C335 G336 G337 D339	M300-R304 HydrophobicContact CG-CG 4.47Å; M300-R304 WeakPolarHBondContact O-CB 3.22Å; M300-R304 WeakPolarHBondContact O-CD 3.29Å; M300-R304 VanDerWaalsContact O-CG 3.24Å; M300-R304 WeakPolarHBondContact O-CG 3.29Å; M300-R304 PolarHBondContact O-N 3.47Å; M300-R304 HydrophobicContact SD-CG 4.47Å; K302-R304 VanDerWaalsContact C-N 3.33Å; K302-R304 PolarHBondContact O-N 2.95Å; R304-F307 PolarHBondContact O-N 3.33Å; R304-K308 PolarHBondContact O-N 3.25Å; R304-L315 HydrophobicContact CG-CB 4.37Å; R304-L315 HydrophobicContact CG-CD2 4.07Å; R304-C335 WeakPolarHBondContact CD-O 3.44Å; R304-C335 PolarHBondContact NH1-O 3.39Å; R304-G336 VanDerWaalsContact NH1-C 3.34Å; R304-G336 PolarHBondContact NH1-O 3.1Å; R304-G337 PolarHBondContact NH2-O 2.83Å; R304-D339 IonicContact CZ-OD2 3.41Å; R304-D339 IonicContact NH2-OD2 3.31Å; R304-D339 PolarHBondContact NH2-OD2 3.16Å
305	S	98.1	Very high	98.1	Very high	76 Å²	76	45.1 Å²	45.1	53%	0.531	23%	0.226	S	C	.	.	H	α-helix	trans	-61.2	-48.4	177.6	-178.7	0	0	0	0	111.7	L301 K302 I303 K308 R309	L301-S305 PolarHBondContact O-N 3.28Å; K302-S305 WeakPolarHBondContact O-CB 3.45Å; K302-S305 PolarHBondContact O-N 3.39Å; I303-S305 PolarHBondContact O-N 2.87Å; S305-K308 PolarHBondContact O-N 3.37Å; S305-R309 VanDerWaalsContact O-CB 3.29Å; S305-R309 WeakPolarHBondContact O-CB 3.22Å; S305-R309 PolarHBondContact O-N 2.8Å
306	E	98.5	Very high	98.1	Very high	20 Å²	20	47.5 Å²	47.5	9%	0.093	24%	0.235	C	C	.	.	H	α-helix	trans	-60.7	-45.2	175.8	-74.8	-66	159.8	0	0	112.5	N265 P267 L268 A271 K302 I303 R309 K310	N265-E306 PolarHBondContact ND2-OE1 2.93Å; N265-E306 VanDerWaalsContact ND2-OE1 3.16Å; P267-E306 HydrophobicContact CB-CG 3.95Å; L268-E306 HydrophobicContact CB-CB 4.42Å; L268-E306 HydrophobicContact CB-CG 4.25Å; L268-E306 HydrophobicContact CD1-CB 4.43Å; A271-E306 HydrophobicContact CB-CB 4.13Å; K302-E306 WeakPolarHBondContact O-CG 3.19Å; K302-E306 PolarHBondContact O-N 3.11Å; I303-E306 PolarHBondContact O-N 2.95Å; E306-R309 PolarHBondContact O-N 3.39Å; E306-R309 IonicContact OE1-CZ 2.69Å; E306-R309 IonicContact OE1-NH1 2.73Å; E306-R309 PolarHBondContact OE1-NH1 3.28Å; E306-R309 IonicContact OE1-NH2 3.57Å; E306-R309 PolarHBondContact OE1-NH2 2.93Å; E306-R309 IonicContact OE2-CZ 3.08Å; E306-R309 IonicContact OE2-NE 3.64Å; E306-R309 IonicContact OE2-NH1 3.62Å; E306-R309 IonicContact OE2-NH2 3.47Å; E306-R309 PolarHBondContact OE2-NH2 3.49Å; E306-K310 WeakPolarHBondContact O-CB 3.29Å; E306-K310 PolarHBondContact O-N 3.38Å
307	F	98.5	Very high	98.1	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.2	-51.9	178.5	-168.9	-74.5	0	0	0	111.2	A271 L274 Y275 I303 R304 R309 K310 Y311 K313 L315 Y318	A271-F307 HydrophobicContact CB-CB 3.82Å; A271-F307 HydrophobicContact CB-CD2 4.09Å; A271-F307 HydrophobicContact CB-CG 4.43Å; A271-F307 WeakPolarHBondContact O-CD2 3.2Å; L274-F307 HydrophobicContact CB-CD2 4.33Å; L274-F307 HydrophobicContact CB-CE2 4.12Å; Y275-F307 HydrophobicContact CD2-CZ 4.1Å; I303-F307 VanDerWaalsContact O-CB 3.25Å; I303-F307 WeakPolarHBondContact O-CB 3.17Å; I303-F307 PolarHBondContact O-N 3.28Å; R304-F307 PolarHBondContact O-N 3.33Å; F307-R309 VanDerWaalsContact C-N 3.35Å; F307-R309 PolarHBondContact O-N 2.97Å; F307-K310 PolarHBondContact O-N 3.1Å; F307-Y311 HydrophobicContact CD1-CD2 4.01Å; F307-Y311 AromaticContact CD2-CD2 3.97Å; F307-Y311 HydrophobicContact CD2-CD2 3.97Å; F307-Y311 HydrophobicContact CD2-CE2 4.26Å; F307-Y311 HydrophobicContact CE1-CD2 4.06Å; F307-Y311 HydrophobicContact CE1-CG 4.42Å; F307-Y311 HydrophobicContact CE2-CD2 4.04Å; F307-Y311 HydrophobicContact CE2-CE2 4.34Å; F307-Y311 AromaticContact CG-CD2 3.95Å; F307-Y311 HydrophobicContact CG-CD2 3.95Å; F307-Y311 HydrophobicContact CZ-CD2 4.08Å; F307-Y311 WeakPolarHBondContact O-CB 3.07Å; F307-Y311 WeakPolarHBondContact O-CD2 3.34Å; F307-Y311 PolarHBondContact O-N 2.99Å; F307-K313 WeakPolarHBondContact CD1-O 3.29Å; F307-L315 HydrophobicContact CB-CB 4.36Å; F307-L315 HydrophobicContact CD1-CB 4.03Å; F307-L315 HydrophobicContact CD2-CB 4.34Å; F307-L315 HydrophobicContact CD2-CD1 3.9Å; F307-L315 HydrophobicContact CE1-CB 4.44Å; F307-L315 HydrophobicContact CE2-CD1 3.76Å; F307-L315 HydrophobicContact CG-CB 3.99Å; F307-L315 HydrophobicContact CG-CD1 4.39Å; F307-L315 HydrophobicContact CZ-CD1 4.17Å; F307-Y318 AromaticContact CE1-CD2 3.46Å; F307-Y318 HydrophobicContact CE1-CD2 3.46Å; F307-Y318 VanDerWaalsContact CE1-CD2 3.46Å; F307-Y318 AromaticContact CE1-CE2 3.75Å; F307-Y318 HydrophobicContact CE1-CE2 3.75Å; F307-Y318 HydrophobicContact CE1-CG 4.14Å; F307-Y318 AromaticContact CZ-CD2 3.72Å; F307-Y318 HydrophobicContact CZ-CD2 3.72Å; F307-Y318 HydrophobicContact CZ-CE2 4.14Å; F307-Y318 AromaticContact CZ-CG 3.93Å; F307-Y318 HydrophobicContact CZ-CG 3.93Å
308	K	98.1	Very high	98.1	Very high	87 Å²	87	50.7 Å²	50.7	38%	0.378	25%	0.246	S	C	.	.	H	α-helix	trans	-64.6	-41	-179.9	-177.5	162.6	179.2	-162.9	0	111.7	R304 S305 K310 G312 D339	R304-K308 PolarHBondContact O-N 3.25Å; S305-K308 PolarHBondContact O-N 3.37Å; K308-K310 VanDerWaalsContact C-N 3.28Å; K308-K310 PolarHBondContact O-N 3.28Å; K308-G312 WeakPolarHBondContact O-CA 3.47Å; K308-G312 PolarHBondContact O-N 3.2Å; K308-D339 WeakPolarHBondContact CD-O 3.43Å; K308-D339 VanDerWaalsContact NZ-C 3.32Å; K308-D339 PolarHBondContact NZ-O 2.73Å; K308-D339 PolarHBondContact NZ-OXT 2.87Å
309	R	98.1	Very high	98.1	Very high	165 Å²	165	48.5 Å²	48.5	62%	0.623	23%	0.233	S	C	*	.	H	α-helix	trans	-57.8	-41	176.7	-172.7	179.7	75.1	-157.7	11.5	111.9	S305 E306 F307	S305-R309 VanDerWaalsContact O-CB 3.29Å; S305-R309 WeakPolarHBondContact O-CB 3.22Å; S305-R309 PolarHBondContact O-N 2.8Å; E306-R309 PolarHBondContact O-N 3.39Å; E306-R309 IonicContact OE1-CZ 2.69Å; E306-R309 IonicContact OE1-NH1 2.73Å; E306-R309 PolarHBondContact OE1-NH1 3.28Å; E306-R309 IonicContact OE1-NH2 3.57Å; E306-R309 PolarHBondContact OE1-NH2 2.93Å; E306-R309 IonicContact OE2-CZ 3.08Å; E306-R309 IonicContact OE2-NE 3.64Å; E306-R309 IonicContact OE2-NH1 3.62Å; E306-R309 IonicContact OE2-NH2 3.47Å; E306-R309 PolarHBondContact OE2-NH2 3.49Å; F307-R309 VanDerWaalsContact C-N 3.35Å; F307-R309 PolarHBondContact O-N 2.97Å
310	K	98.4	Very high	98	Very high	105 Å²	105	50.8 Å²	50.8	46%	0.457	24%	0.243	S	C	.	.	H	α-helix	trans	-85.4	-40.2	-176.4	-175.8	164.4	174.3	177.7	0	114.1	L268 D272 E306 F307 K308	L268-K310 HydrophobicContact CD1-CD 3.7Å; D272-K310 VanDerWaalsContact OD1-CD 3.3Å; D272-K310 WeakPolarHBondContact OD1-CD 3.49Å; D272-K310 VanDerWaalsContact OD1-CE 3.25Å; D272-K310 WeakPolarHBondContact OD1-CE 3.41Å; D272-K310 IonicContact OD1-NZ 2.81Å; D272-K310 PolarHBondContact OD1-NZ 2.97Å; D272-K310 IonicContact OD2-NZ 2.84Å; D272-K310 PolarHBondContact OD2-NZ 3.46Å; E306-K310 WeakPolarHBondContact O-CB 3.29Å; E306-K310 PolarHBondContact O-N 3.38Å; F307-K310 PolarHBondContact O-N 3.1Å; K308-K310 VanDerWaalsContact C-N 3.28Å; K308-K310 PolarHBondContact O-N 3.28Å
311	Y	97.6	Very high	97.9	Very high	45 Å²	45	55.6 Å²	55.6	18%	0.176	27%	0.265	C	S	.	.	H	α-helix	trans	-106.9	0.6	-170.6	-59.6	-67	0	0	0	114.4	D272 Y275 F307 K313	D272-Y311 WeakPolarHBondContact CA-OH 3.01Å; D272-Y311 PolarHBondContact OD1-OH 3.45Å; Y275-Y311 VanDerWaalsContact CB-CE2 3.47Å; Y275-Y311 HydrophobicContact CD1-CD1 4.1Å; Y275-Y311 AromaticContact CD1-CE1 3.38Å; Y275-Y311 HydrophobicContact CD1-CE1 3.38Å; Y275-Y311 HydrophobicContact CD1-CE2 4.47Å; Y275-Y311 AromaticContact CD1-CZ 3.59Å; Y275-Y311 AromaticContact CD2-CD1 3.51Å; Y275-Y311 HydrophobicContact CD2-CD1 3.51Å; Y275-Y311 HydrophobicContact CD2-CD2 4.03Å; Y275-Y311 AromaticContact CD2-CE1 3.64Å; Y275-Y311 HydrophobicContact CD2-CE1 3.64Å; Y275-Y311 HydrophobicContact CD2-CE2 4.16Å; Y275-Y311 AromaticContact CD2-CG 3.71Å; Y275-Y311 HydrophobicContact CD2-CG 3.71Å; Y275-Y311 AromaticContact CD2-CZ 3.95Å; Y275-Y311 HydrophobicContact CE1-CD1 4.16Å; Y275-Y311 AromaticContact CE1-CE1 3.66Å; Y275-Y311 HydrophobicContact CE1-CE1 3.66Å; Y275-Y311 AromaticContact CE2-CD1 3.59Å; Y275-Y311 HydrophobicContact CE2-CD1 3.59Å; Y275-Y311 AromaticContact CE2-CE1 3.91Å; Y275-Y311 HydrophobicContact CE2-CE1 3.91Å; Y275-Y311 HydrophobicContact CE2-CG 4.09Å; Y275-Y311 AromaticContact CG-CD1 3.78Å; Y275-Y311 HydrophobicContact CG-CD1 3.78Å; Y275-Y311 HydrophobicContact CG-CD2 4.16Å; Y275-Y311 AromaticContact CG-CE1 3.36Å; Y275-Y311 HydrophobicContact CG-CE1 3.36Å; Y275-Y311 AromaticContact CG-CE2 3.8Å; Y275-Y311 HydrophobicContact CG-CE2 3.8Å; Y275-Y311 HydrophobicContact CG-CG 4.14Å; Y275-Y311 AromaticContact CG-CZ 3.36Å; Y275-Y311 AromaticContact CZ-CD1 3.92Å; Y275-Y311 AromaticContact CZ-CE1 3.92Å; F307-Y311 HydrophobicContact CD1-CD2 4.01Å; F307-Y311 AromaticContact CD2-CD2 3.97Å; F307-Y311 HydrophobicContact CD2-CD2 3.97Å; F307-Y311 HydrophobicContact CD2-CE2 4.26Å; F307-Y311 HydrophobicContact CE1-CD2 4.06Å; F307-Y311 HydrophobicContact CE1-CG 4.42Å; F307-Y311 HydrophobicContact CE2-CD2 4.04Å; F307-Y311 HydrophobicContact CE2-CE2 4.34Å; F307-Y311 AromaticContact CG-CD2 3.95Å; F307-Y311 HydrophobicContact CG-CD2 3.95Å; F307-Y311 HydrophobicContact CZ-CD2 4.08Å; F307-Y311 WeakPolarHBondContact O-CB 3.07Å; F307-Y311 WeakPolarHBondContact O-CD2 3.34Å; F307-Y311 PolarHBondContact O-N 2.99Å; Y311-K313 PolarHBondContact O-N 2.99Å
312	G	96.9	Very high	97.9	Very high	59 Å²	59	54.9 Å²	54.9	61%	0.608	26%	0.262	S	S	*	.	S	Bend	trans	75.4	-28.1	172.6	0	0	0	0	0	115.7	K308	K308-G312 WeakPolarHBondContact O-CA 3.47Å; K308-G312 PolarHBondContact O-N 3.2Å
313	K	96.8	Very high	97.8	Very high	98 Å²	98	51 Å²	51	43%	0.426	25%	0.245	S	C	.	.	S	Bend	trans	-109.2	156.3	171	-52.6	-177.6	-178	165.4	0	110.4	F307 Y311 Y317 Y318	F307-K313 WeakPolarHBondContact CD1-O 3.29Å; Y311-K313 PolarHBondContact O-N 2.99Å; K313-Y317 HydrophobicContact CB-CD1 3.91Å; K313-Y317 HydrophobicContact CB-CG 4.25Å; K313-Y317 HydrophobicContact CD-CD1 3.41Å; K313-Y317 VanDerWaalsContact CD-CD1 3.41Å; K313-Y317 HydrophobicContact CD-CE1 3.19Å; K313-Y317 HydrophobicContact CD-CE2 4.37Å; K313-Y317 HydrophobicContact CD-CG 4.09Å; K313-Y317 HydrophobicContact CG-CD1 4.3Å; K313-Y317 HydrophobicContact CG-CE1 4.48Å; K313-Y317 PolarHBondContact NZ-OH 3.13Å; K313-Y317 VanDerWaalsContact NZ-OH 3.07Å; K313-Y318 HydrophobicContact CB-CD2 4.3Å; K313-Y318 HydrophobicContact CB-CE2 3.85Å
314	S	98.1	Very high	97.7	Very high	10 Å²	10	57.1 Å²	57.1	7%	0.07	27%	0.272	C	S	.	.			trans	-64.9	155.4	179.6	67	0	0	0	0	111.8	Y316 Y317 Y318 D338 D339	S314-Y316 PolarHBondContact O-N 3.26Å; S314-Y317 PolarHBondContact O-N 3.11Å; S314-Y317 VanDerWaalsContact OG-CB 3.29Å; S314-Y317 WeakPolarHBondContact OG-CB 3.48Å; S314-Y317 PolarHBondContact OG-N 3.41Å; S314-Y318 WeakPolarHBondContact O-CD2 3.37Å; S314-Y318 PolarHBondContact O-N 2.95Å; S314-D338 WeakPolarHBondContact CB-OD1 3.47Å; S314-D338 PolarHBondContact OG-OD1 3.34Å; S314-D339 WeakPolarHBondContact CB-O 3.5Å
315	L	98.5	Very high	97.7	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-57.3	-39.7	169.3	174	61.5	0	0	0	111.1	L274 M278 M292 M300 R304 F307 Y317 Y318 I319	L274-L315 HydrophobicContact CB-CD1 4.02Å; L274-L315 HydrophobicContact CD1-CD1 3.91Å; L274-L315 HydrophobicContact CD1-CD2 3.75Å; L274-L315 HydrophobicContact CD2-CD1 4.48Å; L274-L315 HydrophobicContact CG-CD1 4.37Å; M278-L315 HydrophobicContact CE-CD1 3.7Å; M292-L315 HydrophobicContact SD-CD2 4.11Å; M300-L315 HydrophobicContact SD-CD2 3.95Å; R304-L315 HydrophobicContact CG-CB 4.37Å; R304-L315 HydrophobicContact CG-CD2 4.07Å; F307-L315 HydrophobicContact CB-CB 4.36Å; F307-L315 HydrophobicContact CD1-CB 4.03Å; F307-L315 HydrophobicContact CD2-CB 4.34Å; F307-L315 HydrophobicContact CD2-CD1 3.9Å; F307-L315 HydrophobicContact CE1-CB 4.44Å; F307-L315 HydrophobicContact CE2-CD1 3.76Å; F307-L315 HydrophobicContact CG-CB 3.99Å; F307-L315 HydrophobicContact CG-CD1 4.39Å; F307-L315 HydrophobicContact CZ-CD1 4.17Å; L315-Y317 VanDerWaalsContact C-N 3.34Å; L315-Y317 PolarHBondContact O-N 3.02Å; L315-Y318 PolarHBondContact O-N 3.12Å; L315-I319 HydrophobicContact CD1-CD1 4.16Å; L315-I319 HydrophobicContact CD1-CG1 4.33Å; L315-I319 HydrophobicContact CG-CD1 3.9Å; L315-I319 HydrophobicContact CG-CG1 4.49Å; L315-I319 WeakPolarHBondContact O-CG1 3.5Å; L315-I319 PolarHBondContact O-N 3.49Å
316	Y	98.5	Very high	97.7	Very high	53 Å²	53	56.9 Å²	56.9	21%	0.208	28%	0.277	C	S	.	.	H	α-helix	trans	-56.7	-46.1	178.4	-168.8	-85.2	0	0	0	112.1	S314 Y318 I319 Q320 L332 C335 G337 D338	S314-Y316 PolarHBondContact O-N 3.26Å; Y316-Y318 PolarHBondContact O-N 3.41Å; Y316-I319 PolarHBondContact O-N 2.76Å; Y316-Q320 HydrophobicContact CD1-CG 4.08Å; Y316-Q320 HydrophobicContact CE1-CG 3.93Å; Y316-Q320 VanDerWaalsContact CE1-NE2 3.33Å; Y316-Q320 WeakPolarHBondContact O-CG 3.26Å; Y316-Q320 PolarHBondContact O-N 3.42Å; Y316-L332 HydrophobicContact CD1-CD2 3.98Å; Y316-L332 HydrophobicContact CD2-CB 4.27Å; Y316-L332 HydrophobicContact CD2-CD2 3.62Å; Y316-L332 HydrophobicContact CD2-CG 4.46Å; Y316-L332 HydrophobicContact CE1-CD1 4.23Å; Y316-L332 HydrophobicContact CE1-CD2 3.95Å; Y316-L332 HydrophobicContact CE2-CB 3.57Å; Y316-L332 HydrophobicContact CE2-CD1 4.29Å; Y316-L332 HydrophobicContact CE2-CD2 3.6Å; Y316-L332 HydrophobicContact CE2-CG 3.97Å; Y316-L332 HydrophobicContact CG-CD2 3.81Å; Y316-C335 HydrophobicContact CD2-CB 4.22Å; Y316-G337 WeakPolarHBondContact CB-O 3.43Å; Y316-G337 WeakPolarHBondContact CD2-O 3.44Å; Y316-D338 HydrophobicContact CD1-CB 3.66Å; Y316-D338 HydrophobicContact CD2-CB 4.49Å; Y316-D338 HydrophobicContact CE1-CB 4.21Å; Y316-D338 HydrophobicContact CG-CB 3.83Å
317	Y	97.6	Very high	97.7	Very high	77 Å²	77	56.9 Å²	56.9	30%	0.302	28%	0.277	S	S	.	.	H	α-helix	trans	-58.2	-47.3	176.7	173.1	-88.8	0	0	0	111.7	K313 S314 L315 I319 Q320 Q321	K313-Y317 HydrophobicContact CB-CD1 3.91Å; K313-Y317 HydrophobicContact CB-CG 4.25Å; K313-Y317 HydrophobicContact CD-CD1 3.41Å; K313-Y317 VanDerWaalsContact CD-CD1 3.41Å; K313-Y317 HydrophobicContact CD-CE1 3.19Å; K313-Y317 HydrophobicContact CD-CE2 4.37Å; K313-Y317 HydrophobicContact CD-CG 4.09Å; K313-Y317 HydrophobicContact CG-CD1 4.3Å; K313-Y317 HydrophobicContact CG-CE1 4.48Å; K313-Y317 PolarHBondContact NZ-OH 3.13Å; K313-Y317 VanDerWaalsContact NZ-OH 3.07Å; S314-Y317 PolarHBondContact O-N 3.11Å; S314-Y317 VanDerWaalsContact OG-CB 3.29Å; S314-Y317 WeakPolarHBondContact OG-CB 3.48Å; S314-Y317 PolarHBondContact OG-N 3.41Å; L315-Y317 VanDerWaalsContact C-N 3.34Å; L315-Y317 PolarHBondContact O-N 3.02Å; Y317-I319 PolarHBondContact O-N 3.23Å; Y317-Q320 WeakPolarHBondContact O-CB 3.22Å; Y317-Q320 PolarHBondContact O-N 3.34Å; Y317-Q321 HydrophobicContact CD1-CG 4.13Å; Y317-Q321 HydrophobicContact CE1-CG 3.64Å; Y317-Q321 HydrophobicContact CE2-CG 4.29Å; Y317-Q321 WeakPolarHBondContact O-CG 3.02Å; Y317-Q321 PolarHBondContact O-N 2.79Å
318	Y	98.1	Very high	97.7	Very high	45 Å²	45	58.7 Å²	58.7	18%	0.176	29%	0.285	C	S	.	.	H	α-helix	trans	-62.9	-43.1	179.4	-83.5	-96.7	0	0	0	111.5	Y275 F307 K313 S314 L315 Y316 Q320 Q321 D322	Y275-Y318 HydrophobicContact CD2-CE1 4.06Å; Y275-Y318 AromaticContact CE2-CE1 3.72Å; Y275-Y318 HydrophobicContact CE2-CE1 3.72Å; Y275-Y318 AromaticContact CE2-CZ 3.81Å; F307-Y318 AromaticContact CE1-CD2 3.46Å; F307-Y318 HydrophobicContact CE1-CD2 3.46Å; F307-Y318 VanDerWaalsContact CE1-CD2 3.46Å; F307-Y318 AromaticContact CE1-CE2 3.75Å; F307-Y318 HydrophobicContact CE1-CE2 3.75Å; F307-Y318 HydrophobicContact CE1-CG 4.14Å; F307-Y318 AromaticContact CZ-CD2 3.72Å; F307-Y318 HydrophobicContact CZ-CD2 3.72Å; F307-Y318 HydrophobicContact CZ-CE2 4.14Å; F307-Y318 AromaticContact CZ-CG 3.93Å; F307-Y318 HydrophobicContact CZ-CG 3.93Å; K313-Y318 HydrophobicContact CB-CD2 4.3Å; K313-Y318 HydrophobicContact CB-CE2 3.85Å; S314-Y318 WeakPolarHBondContact O-CD2 3.37Å; S314-Y318 PolarHBondContact O-N 2.95Å; L315-Y318 PolarHBondContact O-N 3.12Å; Y316-Y318 PolarHBondContact O-N 3.41Å; Y318-Q320 VanDerWaalsContact C-N 3.28Å; Y318-Q320 PolarHBondContact O-N 3.14Å; Y318-Q321 PolarHBondContact O-N 3Å; Y318-Q321 VanDerWaalsContact O-N 3.1Å; Y318-D322 PolarHBondContact O-N 2.8Å
319	I	98.1	Very high	97.7	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-58.5	-41.5	175.3	-65.8	168.4	0	0	0	110.9	M278 L288 M292 L315 Y316 Y317 Q321 D322 T323 L331 L332 C335	M278-I319 HydrophobicContact CE-CG1 4.26Å; M278-I319 HydrophobicContact SD-CG1 3.87Å; L288-I319 HydrophobicContact CD1-CG1 4.48Å; M292-I319 HydrophobicContact CE-CD1 3.74Å; M292-I319 HydrophobicContact SD-CD1 4.01Å; L315-I319 HydrophobicContact CD1-CD1 4.16Å; L315-I319 HydrophobicContact CD1-CG1 4.33Å; L315-I319 HydrophobicContact CG-CD1 3.9Å; L315-I319 HydrophobicContact CG-CG1 4.49Å; L315-I319 WeakPolarHBondContact O-CG1 3.5Å; L315-I319 PolarHBondContact O-N 3.49Å; Y316-I319 PolarHBondContact O-N 2.76Å; Y317-I319 PolarHBondContact O-N 3.23Å; I319-Q321 VanDerWaalsContact C-N 3.34Å; I319-Q321 PolarHBondContact O-N 2.87Å; I319-D322 PolarHBondContact O-N 2.77Å; I319-T323 PolarHBondContact O-N 2.83Å; I319-T323 PolarHBondContact O-OG1 3.24Å; I319-L331 HydrophobicContact CG2-CB 3.66Å; I319-L331 HydrophobicContact CG2-CD1 4.02Å; I319-L332 HydrophobicContact CB-CD2 3.82Å; I319-L332 HydrophobicContact CG2-CD2 3.54Å; I319-L332 HydrophobicContact CG2-CG 4.11Å; I319-C335 HydrophobicContact CD1-CB 4.2Å
320	Q	97.2	Very high	97.7	Very high	61 Å²	61	50.6 Å²	50.6	29%	0.285	26%	0.255	S	S	.	.	H	α-helix	trans	-62.7	-38.1	176.3	-75.2	-176.3	-46.1	0	0	113.1	Y316 Y317 Y318 K324 Q328 L332	Y316-Q320 HydrophobicContact CD1-CG 4.08Å; Y316-Q320 HydrophobicContact CE1-CG 3.93Å; Y316-Q320 VanDerWaalsContact CE1-NE2 3.33Å; Y316-Q320 WeakPolarHBondContact O-CG 3.26Å; Y316-Q320 PolarHBondContact O-N 3.42Å; Y317-Q320 WeakPolarHBondContact O-CB 3.22Å; Y317-Q320 PolarHBondContact O-N 3.34Å; Y318-Q320 VanDerWaalsContact C-N 3.28Å; Y318-Q320 PolarHBondContact O-N 3.14Å; Q320-K324 PolarHBondContact O-NZ 3.39Å; Q320-Q328 PolarHBondContact O-NE2 3.33Å; Q320-L332 HydrophobicContact CG-CD1 3.71Å; Q320-L332 HydrophobicContact CG-CD2 3.76Å; Q320-L332 HydrophobicContact CG-CG 4.38Å
321	Q	96.3	Very high	97.7	Very high	101 Å²	101	45.6 Å²	45.6	47%	0.472	23%	0.233	S	C	.	.	H	α-helix	trans	-71	-41.8	179	-61.4	-43.5	-63.6	0	0	111.6	Y317 Y318 I319 K324	Y317-Q321 HydrophobicContact CD1-CG 4.13Å; Y317-Q321 HydrophobicContact CE1-CG 3.64Å; Y317-Q321 HydrophobicContact CE2-CG 4.29Å; Y317-Q321 WeakPolarHBondContact O-CG 3.02Å; Y317-Q321 PolarHBondContact O-N 2.79Å; Y318-Q321 PolarHBondContact O-N 3Å; Y318-Q321 VanDerWaalsContact O-N 3.1Å; I319-Q321 VanDerWaalsContact C-N 3.34Å; I319-Q321 PolarHBondContact O-N 2.87Å; Q321-K324 PolarHBondContact O-NZ 2.84Å
322	D	96.3	Very high	97.7	Very high	44 Å²	44	44.1 Å²	44.1	24%	0.235	23%	0.228	C	C	.	.	H	α-helix	trans	-89.5	-27.2	-169.8	-102.3	46.2	0	0	0	115.2	M278 T283 Y318 I319	M278-D322 WeakPolarHBondContact CA-OD2 3.49Å; M278-D322 HydrophobicContact CB-CB 4.27Å; M278-D322 WeakPolarHBondContact CB-OD2 3.47Å; M278-D322 HydrophobicContact CG-CB 4.1Å; M278-D322 HydrophobicContact SD-CB 4.37Å; T283-D322 PolarHBondContact OG1-O 2.95Å; T283-D322 PolarHBondContact OG1-OD2 2.89Å; Y318-D322 PolarHBondContact O-N 2.8Å; I319-D322 PolarHBondContact O-N 2.77Å
323	T	97.2	Very high	97.8	Very high	4 Å²	4	45.9 Å²	45.9	3%	0.025	22%	0.217	C	C	.	.			trans	-114.2	165	-176.9	68.6	0	0	0	0	110.9	L288 I319 Y327 Q328 L331	L288-T323 HydrophobicContact CD2-CG2 3.8Å; I319-T323 PolarHBondContact O-N 2.83Å; I319-T323 PolarHBondContact O-OG1 3.24Å; T323-Y327 HydrophobicContact CG2-CD1 4.2Å; T323-Y327 HydrophobicContact CG2-CE1 3.52Å; T323-Q328 PolarHBondContact O-NE2 3.42Å; T323-Q328 WeakPolarHBondContact OG1-CA 3.42Å; T323-Q328 VanDerWaalsContact OG1-CB 3.27Å; T323-Q328 WeakPolarHBondContact OG1-CB 3.4Å; T323-Q328 WeakPolarHBondContact OG1-CG 3.31Å; T323-L331 HydrophobicContact CG2-CD1 3.92Å
324	K	97.3	Very high	97.9	Very high	129 Å²	129	41.2 Å²	41.2	56%	0.561	20%	0.196	S	C	*	.			trans	-144.7	170	178.2	-61.1	-67.8	168.1	-82.4	0	111.4	Q320 Q321 Q328	Q320-K324 PolarHBondContact O-NZ 3.39Å; Q321-K324 PolarHBondContact O-NZ 2.84Å; K324-Q328 PolarHBondContact O-N 3.07Å
325	G	97.6	Very high	97.9	Very high	49 Å²	49	40.7 Å²	40.7	51%	0.505	19%	0.193	S	C	.	.	H	α-helix	trans	65.9	-156.6	174.3	0	0	0	0	0	114	Y327 Q328 K329	G325-Y327 PolarHBondContact O-N 3.33Å; G325-Q328 WeakPolarHBondContact O-CB 3.42Å; G325-Q328 PolarHBondContact O-N 3.42Å; G325-Q328 VanDerWaalsContact O-N 3.13Å; G325-K329 PolarHBondContact O-N 3.47Å
326	D	97.8	Very high	97.8	Very high	40 Å²	40	42.8 Å²	42.8	21%	0.214	22%	0.215	C	C	.	.	H	α-helix	trans	-70.3	-22.2	-179.1	-60.1	-52.2	0	0	0	112.9	E53 L95 K329 A330	E53-D326 HydrophobicContact CB-CB 4.17Å; L95-D326 HydrophobicContact CD1-CB 4.46Å; L95-D326 HydrophobicContact CD2-CB 3.91Å; D326-K329 PolarHBondContact O-N 2.85Å; D326-K329 WeakPolarHBondContact OD1-CD 3.46Å; D326-K329 WeakPolarHBondContact OD1-CE 3.37Å; D326-K329 IonicContact OD1-NZ 3.72Å; D326-K329 PolarHBondContact OD1-NZ 2.76Å; D326-A330 WeakPolarHBondContact O-CB 3.27Å; D326-A330 PolarHBondContact O-N 2.74Å
327	Y	98.4	Very high	97.5	Very high	20 Å²	20	41.3 Å²	41.3	8%	0.078	22%	0.216	C	C	.	.	H	α-helix	trans	-58.2	-49.6	166.4	169.8	-135.4	0	0	0	111.4	H94 V98 D285 I289 T323 G325 K329 A330 L331	H94-Y327 HydrophobicContact CB-CD1 3.67Å; H94-Y327 HydrophobicContact CB-CD2 3.72Å; H94-Y327 HydrophobicContact CB-CE1 3.82Å; H94-Y327 HydrophobicContact CB-CE2 3.88Å; H94-Y327 HydrophobicContact CB-CG 3.62Å; V98-Y327 HydrophobicContact CG2-CD2 3.8Å; V98-Y327 HydrophobicContact CG2-CE2 3.68Å; D285-Y327 VanDerWaalsContact OD1-CE1 3.28Å; D285-Y327 WeakPolarHBondContact OD1-CE1 3.33Å; D285-Y327 PolarHBondContact OD1-OH 2.82Å; D285-Y327 VanDerWaalsContact OD1-OH 3.11Å; I289-Y327 HydrophobicContact CD1-CE2 3.83Å; I289-Y327 HydrophobicContact CG1-CE2 3.69Å; I289-Y327 WeakPolarHBondContact CG1-OH 3.32Å; T323-Y327 HydrophobicContact CG2-CD1 4.2Å; T323-Y327 HydrophobicContact CG2-CE1 3.52Å; G325-Y327 PolarHBondContact O-N 3.33Å; Y327-K329 PolarHBondContact O-N 2.74Å; Y327-A330 PolarHBondContact O-N 3Å; Y327-L331 HydrophobicContact CD2-CD1 4.27Å; Y327-L331 HydrophobicContact CD2-CG 4.09Å; Y327-L331 HydrophobicContact CE1-CD1 4.35Å; Y327-L331 HydrophobicContact CE2-CD1 3.49Å; Y327-L331 VanDerWaalsContact CE2-CD1 3.49Å; Y327-L331 HydrophobicContact CE2-CD2 3.91Å; Y327-L331 HydrophobicContact CE2-CG 3.62Å; Y327-L331 PolarHBondContact O-N 3.39Å; Y327-L331 VanDerWaalsContact O-N 3.14Å
328	Q	98.2	Very high	97.1	Very high	38 Å²	38	42 Å²	42	18%	0.178	23%	0.225	C	C	.	.	H	α-helix	trans	-58.1	-49.7	174.4	178.9	-170.4	95.3	0	0	110.8	Q320 T323 K324 G325 A330 L331 L332	Q320-Q328 PolarHBondContact O-NE2 3.33Å; T323-Q328 PolarHBondContact O-NE2 3.42Å; T323-Q328 WeakPolarHBondContact OG1-CA 3.42Å; T323-Q328 VanDerWaalsContact OG1-CB 3.27Å; T323-Q328 WeakPolarHBondContact OG1-CB 3.4Å; T323-Q328 WeakPolarHBondContact OG1-CG 3.31Å; K324-Q328 PolarHBondContact O-N 3.07Å; G325-Q328 WeakPolarHBondContact O-CB 3.42Å; G325-Q328 PolarHBondContact O-N 3.42Å; G325-Q328 VanDerWaalsContact O-N 3.13Å; Q328-A330 VanDerWaalsContact C-N 3.26Å; Q328-A330 PolarHBondContact O-N 3.12Å; Q328-L331 PolarHBondContact O-N 2.96Å; Q328-L331 VanDerWaalsContact O-N 3.12Å; Q328-L332 HydrophobicContact CG-CD1 3.65Å; Q328-L332 HydrophobicContact CG-CG 3.98Å; Q328-L332 VanDerWaalsContact O-CG 3.29Å; Q328-L332 WeakPolarHBondContact O-CG 3.38Å; Q328-L332 PolarHBondContact O-N 2.9Å
329	K	98	Very high	95.8	Very high	83 Å²	83	46.4 Å²	46.4	36%	0.361	25%	0.251	S	S	.	.	H	α-helix	trans	-55.2	-44.9	-179.4	-66	-177.7	-167.6	154.3	0	111.4	V57 G325 D326 Y327 L331 L332 Y333	V57-K329 HydrophobicContact CG1-CB 4.46Å; G325-K329 PolarHBondContact O-N 3.47Å; D326-K329 PolarHBondContact O-N 2.85Å; D326-K329 WeakPolarHBondContact OD1-CD 3.46Å; D326-K329 WeakPolarHBondContact OD1-CE 3.37Å; D326-K329 IonicContact OD1-NZ 3.72Å; D326-K329 PolarHBondContact OD1-NZ 2.76Å; Y327-K329 PolarHBondContact O-N 2.74Å; K329-L331 PolarHBondContact O-N 3.11Å; K329-L332 PolarHBondContact O-N 3.25Å; K329-Y333 HydrophobicContact CB-CE2 4.42Å; K329-Y333 WeakPolarHBondContact O-CD2 3.45Å; K329-Y333 PolarHBondContact O-N 3.06Å
330	A	98.7	Very high	95.6	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-58.4	-49.1	177.8	0	0	0	0	0	111.7	V57 T61 L95 V98 D326 Y327 Q328 L332 Y333 L334	V57-A330 HydrophobicContact CG1-CB 3.89Å; V57-A330 HydrophobicContact CG2-CB 4.24Å; T61-A330 HydrophobicContact CG2-CB 4.2Å; L95-A330 HydrophobicContact CD1-CB 4.29Å; V98-A330 HydrophobicContact CG1-CB 4.01Å; D326-A330 WeakPolarHBondContact O-CB 3.27Å; D326-A330 PolarHBondContact O-N 2.74Å; Y327-A330 PolarHBondContact O-N 3Å; Q328-A330 VanDerWaalsContact C-N 3.26Å; Q328-A330 PolarHBondContact O-N 3.12Å; A330-L332 PolarHBondContact O-N 2.83Å; A330-Y333 PolarHBondContact O-N 2.73Å; A330-L334 WeakPolarHBondContact O-CG 3.4Å; A330-L334 PolarHBondContact O-N 2.82Å
331	L	98.7	Very high	95.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.9	-38.5	178.3	-64.6	-171.3	0	0	0	113.4	V98 L288 M292 I319 T323 Y327 Q328 K329 L334 C335	V98-L331 HydrophobicContact CG2-CD2 4.01Å; L288-L331 HydrophobicContact CD1-CD1 4.49Å; L288-L331 HydrophobicContact CD2-CD1 3.62Å; L288-L331 HydrophobicContact CG-CD1 3.86Å; M292-L331 HydrophobicContact CB-CD2 3.92Å; M292-L331 WeakPolarHBondContact CE-O 3.34Å; M292-L331 HydrophobicContact CG-CD2 4.1Å; I319-L331 HydrophobicContact CG2-CB 3.66Å; I319-L331 HydrophobicContact CG2-CD1 4.02Å; T323-L331 HydrophobicContact CG2-CD1 3.92Å; Y327-L331 HydrophobicContact CD2-CD1 4.27Å; Y327-L331 HydrophobicContact CD2-CG 4.09Å; Y327-L331 HydrophobicContact CE1-CD1 4.35Å; Y327-L331 HydrophobicContact CE2-CD1 3.49Å; Y327-L331 VanDerWaalsContact CE2-CD1 3.49Å; Y327-L331 HydrophobicContact CE2-CD2 3.91Å; Y327-L331 HydrophobicContact CE2-CG 3.62Å; Y327-L331 PolarHBondContact O-N 3.39Å; Y327-L331 VanDerWaalsContact O-N 3.14Å; Q328-L331 PolarHBondContact O-N 2.96Å; Q328-L331 VanDerWaalsContact O-N 3.12Å; K329-L331 PolarHBondContact O-N 3.11Å; L331-L334 CarbonylContact O-C 3.35Å; L331-L334 PolarHBondContact O-N 2.82Å; L331-C335 WeakPolarHBondContact O-CB 3.28Å; L331-C335 PolarHBondContact O-N 2.95Å
332	L	98.5	Very high	95.5	Very high	14 Å²	14	45.2 Å²	45.2	7%	0.073	25%	0.251	C	S	.	.	H	α-helix	trans	-66.4	-37.3	178.1	-67	-179.5	0	0	0	111.8	Y316 I319 Q320 Q328 K329 A330 C335 G336	Y316-L332 HydrophobicContact CD1-CD2 3.98Å; Y316-L332 HydrophobicContact CD2-CB 4.27Å; Y316-L332 HydrophobicContact CD2-CD2 3.62Å; Y316-L332 HydrophobicContact CD2-CG 4.46Å; Y316-L332 HydrophobicContact CE1-CD1 4.23Å; Y316-L332 HydrophobicContact CE1-CD2 3.95Å; Y316-L332 HydrophobicContact CE2-CB 3.57Å; Y316-L332 HydrophobicContact CE2-CD1 4.29Å; Y316-L332 HydrophobicContact CE2-CD2 3.6Å; Y316-L332 HydrophobicContact CE2-CG 3.97Å; Y316-L332 HydrophobicContact CG-CD2 3.81Å; I319-L332 HydrophobicContact CB-CD2 3.82Å; I319-L332 HydrophobicContact CG2-CD2 3.54Å; I319-L332 HydrophobicContact CG2-CG 4.11Å; Q320-L332 HydrophobicContact CG-CD1 3.71Å; Q320-L332 HydrophobicContact CG-CD2 3.76Å; Q320-L332 HydrophobicContact CG-CG 4.38Å; Q328-L332 HydrophobicContact CG-CD1 3.65Å; Q328-L332 HydrophobicContact CG-CG 3.98Å; Q328-L332 VanDerWaalsContact O-CG 3.29Å; Q328-L332 WeakPolarHBondContact O-CG 3.38Å; Q328-L332 PolarHBondContact O-N 2.9Å; K329-L332 PolarHBondContact O-N 3.25Å; A330-L332 PolarHBondContact O-N 2.83Å; L332-C335 WeakPolarHBondContact O-CB 3.34Å; L332-C335 PolarHBondContact O-N 3.43Å; L332-G336 PolarHBondContact O-N 3.32Å
333	Y	98.3	Very high	95.5	Very high	95 Å²	95	45.2 Å²	45.2	37%	0.373	25%	0.252	S	S	.	.	H	α-helix	trans	-64.8	-43.1	170.7	-76	-59.3	0	0	0	112.1	V57 N58 T61 K329 A330 C335 G336	V57-Y333 HydrophobicContact CG1-CD2 3.84Å; V57-Y333 HydrophobicContact CG1-CE2 4.17Å; N58-Y333 WeakPolarHBondContact OD1-CE2 2.95Å; N58-Y333 VanDerWaalsContact OD1-CZ 3.24Å; N58-Y333 PolarHBondContact OD1-OH 3.42Å; N58-Y333 VanDerWaalsContact OD1-OH 3.04Å; T61-Y333 WeakPolarHBondContact OG1-CB 3.39Å; K329-Y333 HydrophobicContact CB-CE2 4.42Å; K329-Y333 WeakPolarHBondContact O-CD2 3.45Å; K329-Y333 PolarHBondContact O-N 3.06Å; A330-Y333 PolarHBondContact O-N 2.73Å; Y333-C335 VanDerWaalsContact C-N 3.26Å; Y333-C335 PolarHBondContact O-N 3.25Å; Y333-G336 WeakPolarHBondContact O-CA 3.22Å; Y333-G336 PolarHBondContact O-N 3.14Å; Y333-G336 VanDerWaalsContact O-N 3.16Å
334	L	98.6	Very high	95.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.2	-29.8	175.3	-62.9	179.8	0	0	0	112.5	S26 V27 T61 V98 L102 M292 V293 A330 L331	S26-L334 WeakPolarHBondContact CB-O 3.38Å; S26-L334 PolarHBondContact OG-O 2.98Å; V27-L334 HydrophobicContact CG2-CD2 3.89Å; T61-L334 HydrophobicContact CG2-CD2 4.11Å; T61-L334 HydrophobicContact CG2-CG 4.26Å; V98-L334 HydrophobicContact CG1-CD1 4.13Å; L102-L334 HydrophobicContact CD1-CD1 4.32Å; L102-L334 HydrophobicContact CD1-CD2 4.18Å; L102-L334 HydrophobicContact CD2-CD1 4.04Å; L102-L334 HydrophobicContact CD2-CD2 3.67Å; M292-L334 HydrophobicContact CB-CD1 4.35Å; M292-L334 HydrophobicContact CE-CB 4.2Å; V293-L334 HydrophobicContact CG2-CD1 4.18Å; A330-L334 WeakPolarHBondContact O-CG 3.4Å; A330-L334 PolarHBondContact O-N 2.82Å; L331-L334 CarbonylContact O-C 3.35Å; L331-L334 PolarHBondContact O-N 2.82Å
335	C	98.5	Very high	95.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66.8	-45.8	171.4	-171	0	0	0	0	110.6	S26 M292 R304 Y316 I319 L331 L332 Y333	S26-C335 WeakPolarHBondContact CB-O 3.49Å; M292-C335 HydrophobicContact CE-CB 3.71Å; R304-C335 WeakPolarHBondContact CD-O 3.44Å; R304-C335 PolarHBondContact NH1-O 3.39Å; Y316-C335 HydrophobicContact CD2-CB 4.22Å; I319-C335 HydrophobicContact CD1-CB 4.2Å; L331-C335 WeakPolarHBondContact O-CB 3.28Å; L331-C335 PolarHBondContact O-N 2.95Å; L332-C335 WeakPolarHBondContact O-CB 3.34Å; L332-C335 PolarHBondContact O-N 3.43Å; Y333-C335 VanDerWaalsContact C-N 3.26Å; Y333-C335 PolarHBondContact O-N 3.25Å
336	G	95.8	Very high	95.1	Very high	46 Å²	46	41.9 Å²	41.9	47%	0.474	23%	0.228	S	C	.	.			trans	83.9	9.3	172.9	0	0	0	0	0	115.6	R304 L332 Y333	R304-G336 VanDerWaalsContact NH1-C 3.34Å; R304-G336 PolarHBondContact NH1-O 3.1Å; L332-G336 PolarHBondContact O-N 3.32Å; Y333-G336 WeakPolarHBondContact O-CA 3.22Å; Y333-G336 PolarHBondContact O-N 3.14Å; Y333-G336 VanDerWaalsContact O-N 3.16Å
337	G	93.1	Very high	94.9	Very high	21 Å²	21	42.1 Å²	42.1	22%	0.216	23%	0.229	C	C	.	.			trans	155.6	166.6	173.8	0	0	0	0	0	114.7	R304 Y316	R304-G337 PolarHBondContact NH2-O 2.83Å; Y316-G337 WeakPolarHBondContact CB-O 3.43Å; Y316-G337 WeakPolarHBondContact CD2-O 3.44Å
338	D	88.1	Confident	94.6	Very high	92 Å²	92	43.9 Å²	43.9	49%	0.492	24%	0.242	S	C	.	.			trans	-110.4	43.2	-175.8	-164.7	12.9	0	0	0	111.6	S314 Y316	S314-D338 WeakPolarHBondContact CB-OD1 3.47Å; S314-D338 PolarHBondContact OG-OD1 3.34Å; Y316-D338 HydrophobicContact CD1-CB 3.66Å; Y316-D338 HydrophobicContact CD2-CB 4.49Å; Y316-D338 HydrophobicContact CE1-CB 4.21Å; Y316-D338 HydrophobicContact CG-CB 3.83Å
339	D	70.3	Confident	94.2	Very high	138 Å²	138	44.5 Å²	44.5	74%	0.738	25%	0.248	S	C	*	.			trans	-62.3	0	-179.1	-74.8	-64	0	0	0	113.6	R304 K308 S314	R304-D339 IonicContact CZ-OD2 3.41Å; R304-D339 IonicContact NH2-OD2 3.31Å; R304-D339 PolarHBondContact NH2-OD2 3.16Å; K308-D339 WeakPolarHBondContact CD-O 3.43Å; K308-D339 VanDerWaalsContact NZ-C 3.32Å; K308-D339 PolarHBondContact NZ-O 2.73Å; K308-D339 PolarHBondContact NZ-OXT 2.87Å; S314-D339 WeakPolarHBondContact CB-O 3.5Å

Retrieved 339 of 339 residues in 1151.9 ms (Link to these results)

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