A0A077Z2Q2_TRITR Loading...

MBOAT domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z2Q2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 525 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	35.6	Very low	32.6	Very low	240 Å²	240	194.5 Å²	194.5	100%	1.182	89%	0.885	S	S	*	*				0	108.2	0	-78.9	-178.8	171.7	0	0	109.3
2	Q	35.9	Very low	32.3	Very low	196 Å²	196	193.5 Å²	193.5	92%	0.916	88%	0.882	S	S	*	*			trans	-177.5	100.6	150.7	-104	174.9	10.1	0	0	108	K4	Q2-K4 PolarHBondContact O-N 3.28Å
3	R	35.2	Very low	32.4	Very low	246 Å²	246	183.8 Å²	183.8	93%	0.928	86%	0.858	S	S	*	*			trans	-68.4	106.1	174.6	-74	177.3	172.9	-177.4	-2.5	108.3	K5	R3-K5 PolarHBondContact O-N 3.49Å; R3-K5 VanDerWaalsContact O-N 3.09Å
4	K	37.2	Very low	32.1	Very low	194 Å²	194	177.8 Å²	177.8	84%	0.843	85%	0.846	S	S	*	*			trans	-68.8	103.3	166	-85.3	-177.7	174.7	178.9	0	108.3	Q2 W6	Q2-K4 PolarHBondContact O-N 3.28Å; K4-W6 PolarHBondContact O-N 3.12Å; K4-W6 VanDerWaalsContact O-N 3.14Å
5	K	34	Very low	32	Very low	197 Å²	197	174.3 Å²	174.3	86%	0.857	84%	0.84	S	S	*	*			trans	-58.3	110.3	168.9	-76.5	178.4	175.4	178.1	0	108	R3 H7	R3-K5 PolarHBondContact O-N 3.49Å; R3-K5 VanDerWaalsContact O-N 3.09Å; K5-H7 PolarHBondContact O-N 2.84Å
6	W	31	Very low	31.8	Very low	244 Å²	244	174.1 Å²	174.1	92%	0.924	84%	0.837	S	S	*	*			trans	-66.6	113.2	165.3	-79.5	66.8	0	0	0	107.4	K4 K8	K4-W6 PolarHBondContact O-N 3.12Å; K4-W6 VanDerWaalsContact O-N 3.14Å; W6-K8 PolarHBondContact O-N 3.21Å; W6-K8 VanDerWaalsContact O-N 3.11Å
7	H	29.3	Very low	31.9	Very low	185 Å²	185	169.8 Å²	169.8	86%	0.856	82%	0.824	S	S	*	*			trans	-55.5	115.3	165.2	-97.9	-69.2	0	0	0	107.6	K5 P9	K5-H7 PolarHBondContact O-N 2.84Å; H7-P9 WeakPolarHBondContact O-CD 3.48Å
8	K	29.5	Very low	31.9	Very low	188 Å²	188	169.8 Å²	169.8	82%	0.817	82%	0.823	S	S	*	*			trans	-60.7	123	163.2	-82.2	-177.8	173.6	-178.6	0	106.3	W6 D10	W6-K8 PolarHBondContact O-N 3.21Å; W6-K8 VanDerWaalsContact O-N 3.11Å; K8-D10 PolarHBondContact O-N 3Å
9	P	32.6	Very low	32.1	Very low	115 Å²	115	172.3 Å²	172.3	75%	0.747	82%	0.823	S	S	*	*			trans	-62.6	130.4	172.3	20	-21.1	0	0	0	107.4	H7 Q11	H7-P9 WeakPolarHBondContact O-CD 3.48Å; P9-Q11 PolarHBondContact O-N 2.99Å
10	D	31.5	Very low	32.7	Very low	149 Å²	149	173.3 Å²	173.3	80%	0.797	82%	0.823	S	S	*	*			trans	-45.7	113.6	176.2	-69.2	-51.1	0	0	0	108.7	K8 E12	K8-D10 PolarHBondContact O-N 3Å; D10-E12 PolarHBondContact O-N 3.47Å
11	Q	27.2	Very low	33.8	Very low	186 Å²	186	171.8 Å²	171.8	87%	0.869	81%	0.813	S	S	*	*			trans	-68.6	63.8	162	-73.4	-177.9	-36	0	0	107.8	P9 A13	P9-Q11 PolarHBondContact O-N 2.99Å; Q11-A13 PolarHBondContact O-N 3.42Å
12	E	28.3	Very low	35.2	Very low	182 Å²	182	169.3 Å²	169.3	85%	0.85	79%	0.791	S	S	*	*			trans	-73.4	57	142	-69.2	-169.8	167.4	0	0	107	D10 S14	D10-E12 PolarHBondContact O-N 3.47Å; E12-S14 PolarHBondContact O-N 3.16Å
13	A	33.6	Very low	37	Very low	68 Å²	68	165.9 Å²	165.9	56%	0.562	78%	0.777	S	S	*	*			trans	-61	99.7	162.7	0	0	0	0	0	104.5	Q11 V15	Q11-A13 PolarHBondContact O-N 3.42Å; A13-V15 PolarHBondContact O-N 3.37Å
14	S	28.5	Very low	39.3	Very low	99 Å²	99	156.7 Å²	156.7	69%	0.692	75%	0.746	S	S	*	*			trans	-3.9	88.4	164.3	58.2	0	0	0	0	111.7	E12 Q16	E12-S14 PolarHBondContact O-N 3.16Å; S14-Q16 PolarHBondContact O-N 2.99Å
15	V	30.4	Very low	41.8	Very low	125 Å²	125	149 Å²	149	76%	0.758	71%	0.713	S	S	*	*			trans	-69.3	78.8	157.8	-170.4	0	0	0	0	103.3	A13 V17	A13-V15 PolarHBondContact O-N 3.37Å; V15-V17 HydrophobicContact CB-CG2 4.47Å; V15-V17 HydrophobicContact CG1-CG2 3.48Å; V15-V17 VanDerWaalsContact CG1-CG2 3.48Å; V15-V17 PolarHBondContact O-N 3.49Å
16	Q	28.9	Very low	44.4	Very low	171 Å²	171	142.9 Å²	142.9	80%	0.799	70%	0.699	S	S	*	*			trans	-61.3	85.9	150	-71.5	-143.2	-5.6	0	0	103.4	S14 E18	S14-Q16 PolarHBondContact O-N 2.99Å; Q16-E18 PolarHBondContact O-N 3.12Å
17	V	33.1	Very low	47.3	Very low	101 Å²	101	134.4 Å²	134.4	61%	0.612	67%	0.668	S	S	*	*			trans	-58.1	90.1	154.7	-179.2	0	0	0	0	102.3	V15 R19	V15-V17 HydrophobicContact CB-CG2 4.47Å; V15-V17 HydrophobicContact CG1-CG2 3.48Å; V15-V17 VanDerWaalsContact CG1-CG2 3.48Å; V15-V17 PolarHBondContact O-N 3.49Å; V17-R19 HydrophobicContact CG1-CG 4.01Å; V17-R19 PolarHBondContact O-N 3.11Å
18	E	32.1	Very low	50.3	Low	170 Å²	170	126.9 Å²	126.9	79%	0.794	64%	0.635	S	S	*	*			trans	-59.8	88.5	162.6	-162.9	173.5	-148.1	0	0	102.9	Q16 K20	Q16-E18 PolarHBondContact O-N 3.12Å; E18-K20 PolarHBondContact O-N 3.39Å
19	R	35.7	Very low	53.4	Low	218 Å²	218	120.2 Å²	120.2	82%	0.823	61%	0.612	S	S	*	*			trans	-61.3	93.7	177.2	-87.5	-175.5	173.7	177.1	-0.7	104	V17 K21	V17-R19 HydrophobicContact CG1-CG 4.01Å; V17-R19 PolarHBondContact O-N 3.11Å; R19-K21 PolarHBondContact O-N 2.91Å
20	K	44.9	Very low	56.3	Low	191 Å²	191	115.1 Å²	115.1	83%	0.83	58%	0.578	S	S	*	*			trans	-42.7	119.1	169.4	-79.2	-173.2	174.4	-175.6	0	105.6	E18 R22	E18-K20 PolarHBondContact O-N 3.39Å; K20-R22 PolarHBondContact O-N 3.32Å
21	K	55.8	Low	59.4	Low	143 Å²	143	110.4 Å²	110.4	62%	0.622	56%	0.556	S	S	*	*			trans	-46.5	118	-176	-173.7	179.4	-179.9	-176.3	0	107	R19 I23	R19-K21 PolarHBondContact O-N 2.91Å; K21-I23 VanDerWaalsContact C-N 3.3Å; K21-I23 PolarHBondContact O-N 3.4Å
22	R	64.5	Low	62.5	Low	188 Å²	188	109.2 Å²	109.2	71%	0.709	56%	0.555	S	S	*	*			trans	-67.6	94.7	-179.7	-170	176.9	-177.2	-172.5	-1.2	107.4	K20 L24	K20-R22 PolarHBondContact O-N 3.32Å; R22-L24 PolarHBondContact O-N 3.13Å; R22-L24 VanDerWaalsContact O-N 3.16Å
23	I	74.3	Confident	65.8	Low	123 Å²	123	105.9 Å²	105.9	63%	0.631	55%	0.547	S	S	*	.			trans	-69.3	110.1	172.7	-62.3	172.3	0	0	0	105.7	K21 A26	K21-I23 VanDerWaalsContact C-N 3.3Å; K21-I23 PolarHBondContact O-N 3.4Å; I23-A26 HydrophobicContact CG2-CB 4.25Å
24	L	83.2	Confident	68.8	Low	54 Å²	54	104.2 Å²	104.2	28%	0.283	53%	0.528	S	S	.	.	S	Bend	trans	-69.8	-44	178.6	-71.5	174.4	0	0	0	110.5	R22 K426 Y429 A430	R22-L24 PolarHBondContact O-N 3.13Å; R22-L24 VanDerWaalsContact O-N 3.16Å; L24-K426 HydrophobicContact CD1-CB 3.76Å; L24-K426 HydrophobicContact CD1-CG 3.9Å; L24-Y429 HydrophobicContact CB-CD1 3.88Å; L24-Y429 HydrophobicContact CB-CE1 3.96Å; L24-Y429 VanDerWaalsContact O-CE1 3.28Å; L24-Y429 WeakPolarHBondContact O-CE1 3.32Å; L24-A430 HydrophobicContact CD2-CB 4.03Å
25	F	89.3	Confident	71.9	Confident	31 Å²	31	100.4 Å²	100.4	14%	0.136	50%	0.501	C	S	.	.			trans	-144.8	123.1	179.7	179.6	-117.8	0	0	0	109.6	Y27 P28 Y429 D444 F447 R448	F25-Y27 AromaticContact CD1-CD1 3.79Å; F25-Y27 HydrophobicContact CD1-CD1 3.79Å; F25-Y27 AromaticContact CD1-CE1 3.94Å; F25-Y27 HydrophobicContact CD1-CE1 3.94Å; F25-Y27 AromaticContact CE1-CD1 3.75Å; F25-Y27 HydrophobicContact CE1-CD1 3.75Å; F25-Y27 HydrophobicContact CE1-CE1 4.25Å; F25-P28 HydrophobicContact CZ-CG 4.48Å; F25-Y429 HydrophobicContact CB-CE1 4.15Å; F25-D444 HydrophobicContact CE2-CB 4.16Å; F25-D444 HydrophobicContact CZ-CB 4.29Å; F25-D444 WeakPolarHBondContact CZ-O 3.5Å; F25-F447 AromaticContact CD1-CD1 4Å; F25-F447 HydrophobicContact CD1-CD1 4Å; F25-F447 HydrophobicContact CD1-CE1 4.06Å; F25-F447 AromaticContact CD2-CD1 4Å; F25-F447 HydrophobicContact CD2-CD1 4Å; F25-F447 HydrophobicContact CD2-CE1 4.23Å; F25-F447 AromaticContact CE1-CD1 3.76Å; F25-F447 HydrophobicContact CE1-CD1 3.76Å; F25-F447 HydrophobicContact CE1-CE1 4.29Å; F25-F447 AromaticContact CE2-CD1 3.79Å; F25-F447 HydrophobicContact CE2-CD1 3.79Å; F25-F447 HydrophobicContact CE2-CE1 4.47Å; F25-F447 HydrophobicContact CG-CD1 4.11Å; F25-F447 HydrophobicContact CG-CE1 4.03Å; F25-F447 HydrophobicContact CZ-CB 4.46Å; F25-F447 AromaticContact CZ-CD1 3.67Å; F25-F447 HydrophobicContact CZ-CD1 3.67Å; F25-R448 HydrophobicContact CE1-CB 4.25Å; F25-R448 HydrophobicContact CZ-CB 4.43Å
26	A	89.4	Confident	75.1	Confident	69 Å²	69	96 Å²	96	57%	0.57	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-88.8	123.4	172.5	0	0	0	0	0	108.8	I23 P28	I23-A26 HydrophobicContact CG2-CB 4.25Å; A26-P28 VanDerWaalsContact O-CD 3.31Å; A26-P28 WeakPolarHBondContact O-CD 3.32Å
27	Y	91.4	Very high	78.4	Confident	67 Å²	67	91.5 Å²	91.5	26%	0.263	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-66.3	119.6	-177.8	-57.2	-58	0	0	0	110.8	F25 R448 V451 Q455 M511 R515	F25-Y27 AromaticContact CD1-CD1 3.79Å; F25-Y27 HydrophobicContact CD1-CD1 3.79Å; F25-Y27 AromaticContact CD1-CE1 3.94Å; F25-Y27 HydrophobicContact CD1-CE1 3.94Å; F25-Y27 AromaticContact CE1-CD1 3.75Å; F25-Y27 HydrophobicContact CE1-CD1 3.75Å; F25-Y27 HydrophobicContact CE1-CE1 4.25Å; Y27-R448 HydrophobicContact CD1-CG 4.3Å; Y27-V451 HydrophobicContact CE1-CG1 4.18Å; Y27-Q455 PolarHBondContact OH-NE2 2.81Å; Y27-M511 HydrophobicContact CD1-CB 4.45Å; Y27-M511 HydrophobicContact CD1-CE 4.49Å; Y27-M511 HydrophobicContact CD1-CG 3.99Å; Y27-M511 HydrophobicContact CD1-SD 3.79Å; Y27-M511 HydrophobicContact CD2-CB 3.92Å; Y27-M511 HydrophobicContact CD2-CG 3.88Å; Y27-M511 HydrophobicContact CE1-CE 4.03Å; Y27-M511 HydrophobicContact CE1-CG 4.05Å; Y27-M511 HydrophobicContact CE1-SD 3.92Å; Y27-M511 HydrophobicContact CE2-CB 4.43Å; Y27-M511 HydrophobicContact CE2-CG 3.94Å; Y27-M511 HydrophobicContact CG-CB 3.94Å; Y27-M511 HydrophobicContact CG-CG 3.91Å; Y27-M511 HydrophobicContact CG-SD 4.22Å; Y27-R515 VanDerWaalsContact O-CD 3.26Å; Y27-R515 WeakPolarHBondContact O-CD 3.35Å
28	P	92.9	Very high	81.4	Confident	27 Å²	27	88.2 Å²	88.2	18%	0.175	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-69.2	161.3	174.6	31.1	-39.6	0	0	0	111.5	F25 A26 D444 R445 R448	F25-P28 HydrophobicContact CZ-CG 4.48Å; A26-P28 VanDerWaalsContact O-CD 3.31Å; A26-P28 WeakPolarHBondContact O-CD 3.32Å; P28-D444 HydrophobicContact CB-CB 4.23Å; P28-D444 HydrophobicContact CG-CB 3.82Å; P28-D444 WeakPolarHBondContact CG-O 3.31Å; P28-R445 HydrophobicContact CB-CG 4.2Å; P28-R445 HydrophobicContact CG-CG 4.05Å; P28-R448 HydrophobicContact CG-CB 4.06Å; P28-R448 WeakPolarHBondContact O-CD 3.19Å; P28-R448 PolarHBondContact O-NE 3.49Å; P28-R448 VanDerWaalsContact O-NE 3.08Å
29	S	93.2	Very high	84.5	Confident	47 Å²	47	81.7 Å²	81.7	33%	0.329	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-66.7	140.6	166	46.9	0	0	0	0	111.4	R445	S29-R445 PolarHBondContact O-NE 3.28Å
30	L	94.8	Very high	87.5	Confident	8 Å²	8	75.7 Å²	75.7	4%	0.042	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-87	163.9	159.4	-68.6	-177.7	0	0	0	110.8	L32 E34 Y38 R445	L30-L32 PolarHBondContact O-N 3Å; L30-E34 HydrophobicContact CD1-CG 4.01Å; L30-E34 WeakPolarHBondContact CD1-OE1 3.38Å; L30-Y38 HydrophobicContact CD1-CD2 4.48Å; L30-Y38 HydrophobicContact CD1-CE2 3.83Å; L30-R445 HydrophobicContact CD2-CB 4.45Å; L30-R445 HydrophobicContact CD2-CG 4.49Å
31	P	95.4	Very high	90	Very high	50 Å²	50	69.9 Å²	69.9	33%	0.325	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-46.9	138.3	164.5	-26.9	34.9	0	0	0	111.7	T33 E34 S35	P31-T33 PolarHBondContact O-N 2.79Å; P31-E34 HydrophobicContact CB-CB 4.24Å; P31-E34 WeakPolarHBondContact CD-OE2 3.24Å; P31-E34 PolarHBondContact O-N 3.47Å; P31-E34 VanDerWaalsContact O-N 3.1Å; P31-S35 PolarHBondContact O-N 3.49Å
32	L	93.7	Very high	91.9	Very high	162 Å²	162	64.2 Å²	64.2	85%	0.848	36%	0.358	S	S	*	.	H	α-helix	trans	-58.2	-35.3	-178.7	-78.4	159.8	0	0	0	112.5	L30 G36	L30-L32 PolarHBondContact O-N 3Å; L32-G36 WeakPolarHBondContact O-CA 3.42Å; L32-G36 PolarHBondContact O-N 3.39Å
33	T	96.2	Very high	93.4	Very high	112 Å²	112	60 Å²	60	69%	0.687	35%	0.348	S	S	*	.	H	α-helix	trans	-62.3	-49.3	175.3	49.2	0	0	0	0	111.1	P31 G36 T37	P31-T33 PolarHBondContact O-N 2.79Å; T33-G36 PolarHBondContact O-N 3.48Å; T33-T37 WeakPolarHBondContact O-CB 3.34Å; T33-T37 PolarHBondContact O-N 2.98Å; T33-T37 PolarHBondContact O-OG1 2.93Å
34	E	96.7	Very high	94.5	Very high	33 Å²	33	57.6 Å²	57.6	15%	0.154	34%	0.342	C	S	.	.	H	α-helix	trans	-62.2	-52	178.5	-175.3	-179.9	171.7	0	0	112	L30 P31 G36 T37 Y38 R449	L30-E34 HydrophobicContact CD1-CG 4.01Å; L30-E34 WeakPolarHBondContact CD1-OE1 3.38Å; P31-E34 HydrophobicContact CB-CB 4.24Å; P31-E34 WeakPolarHBondContact CD-OE2 3.24Å; P31-E34 PolarHBondContact O-N 3.47Å; P31-E34 VanDerWaalsContact O-N 3.1Å; E34-G36 VanDerWaalsContact C-N 3.32Å; E34-G36 PolarHBondContact O-N 3.33Å; E34-T37 PolarHBondContact O-N 3.39Å; E34-Y38 HydrophobicContact CG-CD2 4.38Å; E34-Y38 HydrophobicContact CG-CE1 4.48Å; E34-Y38 HydrophobicContact CG-CE2 3.55Å; E34-Y38 WeakPolarHBondContact CG-OH 3.4Å; E34-Y38 WeakPolarHBondContact O-CD2 3.41Å; E34-Y38 PolarHBondContact O-N 3.48Å; E34-Y38 VanDerWaalsContact O-N 3.12Å; E34-Y38 PolarHBondContact OE1-OH 3.33Å; E34-Y38 VanDerWaalsContact OE1-OH 3.07Å; E34-R449 VanDerWaalsContact CD-NH2 3.35Å; E34-R449 IonicContact OE1-CZ 2.58Å; E34-R449 IonicContact OE1-NE 3.29Å; E34-R449 PolarHBondContact OE1-NE 2.9Å; E34-R449 IonicContact OE1-NH2 2.68Å; E34-R449 PolarHBondContact OE1-NH2 2.91Å; E34-R449 VanDerWaalsContact OE1-NH2 3.17Å; E34-R449 IonicContact OE2-CZ 3.4Å; E34-R449 IonicContact OE2-NE 2.8Å; E34-R449 IonicContact OE2-NH2 2.81Å; E34-R449 PolarHBondContact OE2-NH2 3.36Å
35	S	94.9	Very high	95.1	Very high	18 Å²	18	56.3 Å²	56.3	13%	0.126	34%	0.339	C	S	.	.	H	α-helix	trans	-61.2	-40.3	176.3	-76.8	0	0	0	0	112.4	P31 Y38 A39 D512	P31-S35 PolarHBondContact O-N 3.49Å; S35-Y38 PolarHBondContact O-N 3.35Å; S35-A39 PolarHBondContact O-N 2.92Å; S35-A39 VanDerWaalsContact O-N 3.08Å; S35-D512 WeakPolarHBondContact CB-OD2 3.5Å; S35-D512 PolarHBondContact OG-OD2 3.22Å
36	G	96.6	Very high	95.4	Very high	32 Å²	32	57.2 Å²	57.2	33%	0.33	35%	0.345	S	S	.	.	H	α-helix	trans	-63.9	-43.8	177.8	0	0	0	0	0	112.2	L32 T33 E34 Y38 A39 V40	L32-G36 WeakPolarHBondContact O-CA 3.42Å; L32-G36 PolarHBondContact O-N 3.39Å; T33-G36 PolarHBondContact O-N 3.48Å; E34-G36 VanDerWaalsContact C-N 3.32Å; E34-G36 PolarHBondContact O-N 3.33Å; G36-Y38 PolarHBondContact O-N 2.92Å; G36-A39 PolarHBondContact O-N 3.45Å; G36-V40 WeakPolarHBondContact O-CG2 3.41Å; G36-V40 PolarHBondContact O-N 3.05Å
37	T	97.9	Very high	95.8	Very high	77 Å²	77	59.2 Å²	59.2	47%	0.472	35%	0.345	S	S	.	.	H	α-helix	trans	-59.7	-45.8	175	-62.6	0	0	0	0	111.5	T33 E34 A39 V40 I41	T33-T37 WeakPolarHBondContact O-CB 3.34Å; T33-T37 PolarHBondContact O-N 2.98Å; T33-T37 PolarHBondContact O-OG1 2.93Å; E34-T37 PolarHBondContact O-N 3.39Å; T37-A39 VanDerWaalsContact C-N 3.32Å; T37-A39 PolarHBondContact O-N 3.26Å; T37-V40 PolarHBondContact O-N 3.46Å; T37-I41 HydrophobicContact CG2-CD1 3.76Å; T37-I41 HydrophobicContact CG2-CG1 4.4Å; T37-I41 VanDerWaalsContact O-CG1 3.29Å; T37-I41 WeakPolarHBondContact O-CG1 3.37Å; T37-I41 PolarHBondContact O-N 2.95Å
38	Y	97.4	Very high	96.1	Very high	33 Å²	33	61.1 Å²	61.1	13%	0.129	35%	0.352	C	S	.	.	H	α-helix	trans	-60.6	-41	176.7	-60.7	-30.5	0	0	0	112.6	L30 E34 S35 G36 L42 Y504 C505 N508	L30-Y38 HydrophobicContact CD1-CD2 4.48Å; L30-Y38 HydrophobicContact CD1-CE2 3.83Å; E34-Y38 HydrophobicContact CG-CD2 4.38Å; E34-Y38 HydrophobicContact CG-CE1 4.48Å; E34-Y38 HydrophobicContact CG-CE2 3.55Å; E34-Y38 WeakPolarHBondContact CG-OH 3.4Å; E34-Y38 WeakPolarHBondContact O-CD2 3.41Å; E34-Y38 PolarHBondContact O-N 3.48Å; E34-Y38 VanDerWaalsContact O-N 3.12Å; E34-Y38 PolarHBondContact OE1-OH 3.33Å; E34-Y38 VanDerWaalsContact OE1-OH 3.07Å; S35-Y38 PolarHBondContact O-N 3.35Å; G36-Y38 PolarHBondContact O-N 2.92Å; Y38-L42 WeakPolarHBondContact O-CB 3.28Å; Y38-L42 PolarHBondContact O-N 2.94Å; Y38-L42 VanDerWaalsContact O-N 3.08Å; Y38-Y504 HydrophobicContact CE1-CD1 4.41Å; Y38-Y504 AromaticContact CE1-CE1 3.93Å; Y38-Y504 HydrophobicContact CE1-CE1 3.93Å; Y38-Y504 HydrophobicContact CE2-CE1 4.25Å; Y38-Y504 AromaticContact CZ-CE1 3.59Å; Y38-Y504 WeakPolarHBondContact OH-CE1 3.1Å; Y38-Y504 PolarHBondContact OH-OH 3.13Å; Y38-C505 HydrophobicContact CD1-CB 4.19Å; Y38-C505 VanDerWaalsContact CD1-SG 3.55Å; Y38-C505 HydrophobicContact CG-CB 4.35Å; Y38-N508 HydrophobicContact CD2-CB 3.48Å; Y38-N508 VanDerWaalsContact CD2-CB 3.48Å; Y38-N508 HydrophobicContact CE2-CB 3.81Å; Y38-N508 HydrophobicContact CG-CB 4.33Å
39	A	96.3	Very high	96.2	Very high	33 Å²	33	60.1 Å²	60.1	27%	0.273	35%	0.346	S	S	.	.	H	α-helix	trans	-64.8	-45.4	177.6	0	0	0	0	0	112.1	S35 G36 T37 L42 I43 V509	S35-A39 PolarHBondContact O-N 2.92Å; S35-A39 VanDerWaalsContact O-N 3.08Å; G36-A39 PolarHBondContact O-N 3.45Å; T37-A39 VanDerWaalsContact C-N 3.32Å; T37-A39 PolarHBondContact O-N 3.26Å; A39-L42 PolarHBondContact O-N 2.95Å; A39-I43 VanDerWaalsContact O-CG1 3.26Å; A39-I43 WeakPolarHBondContact O-CG1 3.45Å; A39-I43 PolarHBondContact O-N 3.11Å; A39-V509 HydrophobicContact CB-CG2 4.28Å
40	V	98	Very high	96.4	Very high	91 Å²	91	61.2 Å²	61.2	55%	0.552	34%	0.343	S	S	*	.	H	α-helix	trans	-61.7	-47.2	177.8	171.1	0	0	0	0	111.1	G36 T37 L42 I43 C44	G36-V40 WeakPolarHBondContact O-CG2 3.41Å; G36-V40 PolarHBondContact O-N 3.05Å; T37-V40 PolarHBondContact O-N 3.46Å; V40-L42 VanDerWaalsContact C-N 3.3Å; V40-L42 PolarHBondContact O-N 3.13Å; V40-I43 PolarHBondContact O-N 3.05Å; V40-C44 PolarHBondContact O-N 3.09Å; V40-C44 PolarHBondContact O-SG 3.36Å
41	I	97.8	Very high	96.5	Very high	69 Å²	69	66.7 Å²	66.7	35%	0.354	36%	0.364	S	S	.	.	H	α-helix	trans	-56.4	-46.6	177.2	-70.6	169.3	0	0	0	110.6	T37 C44 A45 L502	T37-I41 HydrophobicContact CG2-CD1 3.76Å; T37-I41 HydrophobicContact CG2-CG1 4.4Å; T37-I41 VanDerWaalsContact O-CG1 3.29Å; T37-I41 WeakPolarHBondContact O-CG1 3.37Å; T37-I41 PolarHBondContact O-N 2.95Å; I41-C44 PolarHBondContact O-N 3.44Å; I41-A45 WeakPolarHBondContact O-CB 3.28Å; I41-A45 PolarHBondContact O-N 2.84Å; I41-L502 HydrophobicContact CG2-CD2 3.67Å
42	L	95.7	Very high	96.6	Very high	25 Å²	25	65.6 Å²	65.6	13%	0.131	36%	0.355	C	S	.	.	H	α-helix	trans	-66.6	-42	-178.8	-174.3	65.6	0	0	0	112.2	Y38 A39 V40 A45 I46 Y506 V509	Y38-L42 WeakPolarHBondContact O-CB 3.28Å; Y38-L42 PolarHBondContact O-N 2.94Å; Y38-L42 VanDerWaalsContact O-N 3.08Å; A39-L42 PolarHBondContact O-N 2.95Å; V40-L42 VanDerWaalsContact C-N 3.3Å; V40-L42 PolarHBondContact O-N 3.13Å; L42-A45 PolarHBondContact O-N 3.21Å; L42-I46 HydrophobicContact CD1-CD1 4.36Å; L42-I46 HydrophobicContact CG-CD1 4Å; L42-I46 VanDerWaalsContact O-CG1 3.28Å; L42-I46 WeakPolarHBondContact O-CG1 3.44Å; L42-I46 PolarHBondContact O-N 2.91Å; L42-Y506 HydrophobicContact CD1-CD2 4.22Å; L42-Y506 HydrophobicContact CD2-CD2 4.17Å; L42-V509 HydrophobicContact CD2-CB 4.26Å; L42-V509 HydrophobicContact CD2-CG1 4.16Å; L42-V509 HydrophobicContact CD2-CG2 4.35Å
43	I	96.1	Very high	96.8	Very high	98 Å²	98	57.9 Å²	57.9	50%	0.503	31%	0.314	S	S	.	.	H	α-helix	trans	-61.1	-47.6	176.9	-70.7	165.4	0	0	0	110.2	A39 V40 A45 I46 I47	A39-I43 VanDerWaalsContact O-CG1 3.26Å; A39-I43 WeakPolarHBondContact O-CG1 3.45Å; A39-I43 PolarHBondContact O-N 3.11Å; V40-I43 PolarHBondContact O-N 3.05Å; I43-A45 VanDerWaalsContact C-N 3.34Å; I43-A45 PolarHBondContact O-N 3.39Å; I43-I46 PolarHBondContact O-N 3.35Å; I43-I47 HydrophobicContact CG2-CD1 3.79Å; I43-I47 WeakPolarHBondContact O-CG1 3.3Å; I43-I47 PolarHBondContact O-N 3.28Å
44	C	97.8	Very high	96.8	Very high	74 Å²	74	56.6 Å²	56.6	50%	0.5	30%	0.299	S	S	.	.	H	α-helix	trans	-60.3	-43.6	176.8	-68.6	0	0	0	0	111.8	V40 I41 I46 I47 Y48	V40-C44 PolarHBondContact O-N 3.09Å; V40-C44 PolarHBondContact O-SG 3.36Å; I41-C44 PolarHBondContact O-N 3.44Å; C44-I46 PolarHBondContact O-N 2.99Å; C44-I47 PolarHBondContact O-N 3.26Å; C44-Y48 WeakPolarHBondContact O-CB 3.49Å; C44-Y48 PolarHBondContact O-N 2.86Å
45	A	96	Very high	96.7	Very high	27 Å²	27	58.8 Å²	58.8	22%	0.223	31%	0.309	C	S	.	.	H	α-helix	trans	-62.9	-40.2	177.9	0	0	0	0	0	112.4	I41 L42 I43 Y48 A49 L502	I41-A45 WeakPolarHBondContact O-CB 3.28Å; I41-A45 PolarHBondContact O-N 2.84Å; L42-A45 PolarHBondContact O-N 3.21Å; I43-A45 VanDerWaalsContact C-N 3.34Å; I43-A45 PolarHBondContact O-N 3.39Å; A45-Y48 PolarHBondContact O-N 3.19Å; A45-A49 WeakPolarHBondContact O-CB 3.36Å; A45-A49 PolarHBondContact O-N 2.98Å; A45-L502 HydrophobicContact CB-CD1 4.31Å; A45-L502 HydrophobicContact CB-CD2 3.86Å
46	I	95.3	Very high	96.8	Very high	50 Å²	50	58.4 Å²	58.4	26%	0.256	31%	0.306	S	S	.	.	H	α-helix	trans	-65.6	-48.2	176	-68.7	166.7	0	0	0	110.3	L42 I43 C44 Y48 A49 W50 L313 T349	L42-I46 HydrophobicContact CD1-CD1 4.36Å; L42-I46 HydrophobicContact CG-CD1 4Å; L42-I46 VanDerWaalsContact O-CG1 3.28Å; L42-I46 WeakPolarHBondContact O-CG1 3.44Å; L42-I46 PolarHBondContact O-N 2.91Å; I43-I46 PolarHBondContact O-N 3.35Å; C44-I46 PolarHBondContact O-N 2.99Å; I46-Y48 VanDerWaalsContact C-N 3.28Å; I46-Y48 PolarHBondContact O-N 3.46Å; I46-A49 PolarHBondContact O-N 3.2Å; I46-A49 VanDerWaalsContact O-N 3.17Å; I46-W50 PolarHBondContact O-N 3.3Å; I46-L313 HydrophobicContact CG1-CD2 4.35Å; I46-T349 HydrophobicContact CD1-CG2 4.19Å
47	I	97	Very high	96.6	Very high	110 Å²	110	57.3 Å²	57.3	56%	0.564	29%	0.293	S	S	*	.	H	α-helix	trans	-58.3	-44	178.1	-68.5	168.2	0	0	0	110.6	I43 C44 A49 W50 Y51	I43-I47 HydrophobicContact CG2-CD1 3.79Å; I43-I47 WeakPolarHBondContact O-CG1 3.3Å; I43-I47 PolarHBondContact O-N 3.28Å; C44-I47 PolarHBondContact O-N 3.26Å; I47-A49 PolarHBondContact O-N 3.48Å; I47-W50 PolarHBondContact O-N 3.04Å; I47-Y51 PolarHBondContact O-N 2.79Å
48	Y	97.7	Very high	96.4	Very high	107 Å²	107	57 Å²	57	42%	0.42	29%	0.294	S	S	.	.	H	α-helix	trans	-61.6	-43.2	176.9	-177.4	-104.3	0	0	0	112.2	C44 A45 I46 W50 Y51 K52 D306	C44-Y48 WeakPolarHBondContact O-CB 3.49Å; C44-Y48 PolarHBondContact O-N 2.86Å; A45-Y48 PolarHBondContact O-N 3.19Å; I46-Y48 VanDerWaalsContact C-N 3.28Å; I46-Y48 PolarHBondContact O-N 3.46Å; Y48-W50 PolarHBondContact O-N 3.27Å; Y48-Y51 WeakPolarHBondContact O-CB 3.49Å; Y48-Y51 PolarHBondContact O-N 3.45Å; Y48-K52 HydrophobicContact CD1-CG 4.21Å; Y48-K52 HydrophobicContact CE1-CG 3.78Å; Y48-K52 HydrophobicContact CE2-CG 4.33Å; Y48-K52 PolarHBondContact O-N 2.84Å; Y48-K52 WeakPolarHBondContact OH-CE 3.44Å; Y48-D306 HydrophobicContact CE1-CB 4.28Å; Y48-D306 PolarHBondContact OH-OD2 3.43Å
49	A	96.5	Very high	96.1	Very high	7 Å²	7	56.9 Å²	56.9	6%	0.058	30%	0.298	C	S	.	.	H	α-helix	trans	-63.4	-40.8	178.1	0	0	0	0	0	112.6	A45 I46 I47 K52 V53 S310 L313 M314	A45-A49 WeakPolarHBondContact O-CB 3.36Å; A45-A49 PolarHBondContact O-N 2.98Å; I46-A49 PolarHBondContact O-N 3.2Å; I46-A49 VanDerWaalsContact O-N 3.17Å; I47-A49 PolarHBondContact O-N 3.48Å; A49-K52 PolarHBondContact O-N 2.6Å; A49-V53 PolarHBondContact O-N 2.77Å; A49-S310 VanDerWaalsContact CA-OG 3.31Å; A49-S310 WeakPolarHBondContact CA-OG 3.47Å; A49-S310 WeakPolarHBondContact CB-OG 3.42Å; A49-S310 WeakPolarHBondContact O-CB 3.46Å; A49-L313 HydrophobicContact CB-CD2 3.61Å; A49-M314 HydrophobicContact CB-CE 4.44Å
50	W	96.7	Very high	95.5	Very high	70 Å²	70	61.8 Å²	61.8	27%	0.265	32%	0.315	S	S	.	.	H	α-helix	trans	-59.8	-48.1	172.2	-82.7	65.6	0	0	0	111	I46 I47 Y48 K52 V53 F54 F280 M284 M288 M314	I46-W50 PolarHBondContact O-N 3.3Å; I47-W50 PolarHBondContact O-N 3.04Å; Y48-W50 PolarHBondContact O-N 3.27Å; W50-K52 VanDerWaalsContact C-N 3.31Å; W50-K52 PolarHBondContact O-N 3.25Å; W50-V53 PolarHBondContact O-N 3.15Å; W50-F54 PolarHBondContact O-N 3.38Å; W50-F280 HydrophobicContact CH2-CE1 4.08Å; W50-F280 AromaticContact CH2-CZ 3.72Å; W50-F280 HydrophobicContact CH2-CZ 3.72Å; W50-F280 HydrophobicContact CZ3-CZ 4.05Å; W50-M284 HydrophobicContact CH2-SD 3.91Å; W50-M284 HydrophobicContact CZ3-SD 4.26Å; W50-M288 HydrophobicContact CB-CE 4.18Å; W50-M288 HydrophobicContact CD2-CE 4.18Å; W50-M288 HydrophobicContact CE3-CE 3.53Å; W50-M288 HydrophobicContact CG-CE 4.49Å; W50-M288 HydrophobicContact CZ3-CE 4.19Å; W50-M288 WeakPolarHBondContact O-CE 3.26Å; W50-M314 HydrophobicContact CD2-CE 4.43Å; W50-M314 HydrophobicContact CD2-SD 3.91Å; W50-M314 HydrophobicContact CG-CE 4Å; W50-M314 HydrophobicContact CG-SD 3.91Å; W50-M314 HydrophobicContact CZ2-SD 4.29Å; W50-M314 VanDerWaalsContact NE1-CE 3.31Å
51	Y	97.7	Very high	94.8	Very high	122 Å²	122	62.7 Å²	62.7	48%	0.478	32%	0.316	S	S	.	.	H	α-helix	trans	-57.7	-42.1	177.1	169.4	-105.8	0	0	0	112.5	I47 Y48 V53 F54 E55	I47-Y51 PolarHBondContact O-N 2.79Å; Y48-Y51 WeakPolarHBondContact O-CB 3.49Å; Y48-Y51 PolarHBondContact O-N 3.45Å; Y51-V53 PolarHBondContact O-N 3.02Å; Y51-F54 WeakPolarHBondContact O-CB 3.49Å; Y51-F54 PolarHBondContact O-N 3.01Å; Y51-E55 WeakPolarHBondContact O-CB 3.38Å; Y51-E55 PolarHBondContact O-N 2.88Å
52	K	97.3	Very high	94.2	Very high	28 Å²	28	59.4 Å²	59.4	12%	0.122	30%	0.3	C	S	.	.	H	α-helix	trans	-64.8	-38.4	179	-77.4	-57	-167	175.9	0	114.1	Y48 A49 W50 E55 L56 D306	Y48-K52 HydrophobicContact CD1-CG 4.21Å; Y48-K52 HydrophobicContact CE1-CG 3.78Å; Y48-K52 HydrophobicContact CE2-CG 4.33Å; Y48-K52 PolarHBondContact O-N 2.84Å; Y48-K52 WeakPolarHBondContact OH-CE 3.44Å; A49-K52 PolarHBondContact O-N 2.6Å; W50-K52 VanDerWaalsContact C-N 3.31Å; W50-K52 PolarHBondContact O-N 3.25Å; K52-E55 VanDerWaalsContact CD-OE2 3.3Å; K52-E55 WeakPolarHBondContact CD-OE2 3.11Å; K52-E55 IonicContact NZ-OE2 3.66Å; K52-E55 PolarHBondContact NZ-OE2 2.9Å; K52-E55 PolarHBondContact O-N 3.39Å; K52-L56 WeakPolarHBondContact O-CB 3.47Å; K52-L56 PolarHBondContact O-N 2.95Å; K52-D306 WeakPolarHBondContact CE-OD2 3.39Å; K52-D306 IonicContact NZ-OD2 3.17Å
53	V	96.6	Very high	93.5	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-71.1	-34.8	174.7	175.3	0	0	0	0	111.3	A49 W50 Y51 L56 S57 M288 F290 L311 M314	A49-V53 PolarHBondContact O-N 2.77Å; W50-V53 PolarHBondContact O-N 3.15Å; Y51-V53 PolarHBondContact O-N 3.02Å; V53-L56 PolarHBondContact O-N 3.48Å; V53-S57 VanDerWaalsContact O-CB 3.3Å; V53-S57 WeakPolarHBondContact O-CB 3.39Å; V53-S57 PolarHBondContact O-N 2.87Å; V53-S57 PolarHBondContact O-OG 2.86Å; V53-M288 HydrophobicContact CG1-CB 4.39Å; V53-M288 HydrophobicContact CG1-SD 4.22Å; V53-F290 HydrophobicContact CG1-CB 4.02Å; V53-F290 HydrophobicContact CG1-CD1 4.45Å; V53-L311 HydrophobicContact CG1-CD2 4.26Å; V53-L311 HydrophobicContact CG2-CD2 3.97Å; V53-L311 HydrophobicContact CG2-CG 4.37Å; V53-M314 HydrophobicContact CB-CG 3.82Å; V53-M314 HydrophobicContact CG1-CG 4.03Å; V53-M314 HydrophobicContact CG2-CB 4.18Å; V53-M314 HydrophobicContact CG2-CG 3.43Å; V53-M314 VanDerWaalsContact CG2-CG 3.43Å
54	F	96.1	Very high	92.7	Very high	84 Å²	84	61 Å²	61	37%	0.368	31%	0.314	S	S	.	.	H	α-helix	trans	-64	-44.6	172.5	177.2	-96.8	0	0	0	112.5	W50 Y51 S57 S58 Y287 M288	W50-F54 PolarHBondContact O-N 3.38Å; Y51-F54 WeakPolarHBondContact O-CB 3.49Å; Y51-F54 PolarHBondContact O-N 3.01Å; F54-S57 PolarHBondContact O-N 2.98Å; F54-S58 PolarHBondContact O-N 3.4Å; F54-S58 PolarHBondContact O-OG 3.46Å; F54-Y287 HydrophobicContact CE2-CD1 4.08Å; F54-M288 VanDerWaalsContact CA-SD 3.56Å; F54-M288 HydrophobicContact CB-CE 4.11Å; F54-M288 HydrophobicContact CB-SD 3.63Å; F54-M288 HydrophobicContact CD2-SD 4.24Å; F54-M288 HydrophobicContact CG-SD 4.46Å
55	E	96.3	Very high	91.9	Very high	80 Å²	80	58.1 Å²	58.1	37%	0.374	29%	0.294	S	S	.	.	H	α-helix	trans	-59.3	-48.6	175.2	178.5	177.4	-121	0	0	110.8	Y51 K52 S57 S58 S59	Y51-E55 WeakPolarHBondContact O-CB 3.38Å; Y51-E55 PolarHBondContact O-N 2.88Å; K52-E55 VanDerWaalsContact CD-OE2 3.3Å; K52-E55 WeakPolarHBondContact CD-OE2 3.11Å; K52-E55 IonicContact NZ-OE2 3.66Å; K52-E55 PolarHBondContact NZ-OE2 2.9Å; K52-E55 PolarHBondContact O-N 3.39Å; E55-S57 VanDerWaalsContact C-N 3.31Å; E55-S57 PolarHBondContact O-N 3.05Å; E55-S58 CarbonylContact O-C 3.57Å; E55-S58 PolarHBondContact O-N 3.04Å; E55-S58 VanDerWaalsContact O-N 3.15Å; E55-S59 PolarHBondContact O-N 2.84Å; E55-S59 VanDerWaalsContact O-N 3.08Å
56	L	95.6	Very high	91.1	Very high	10 Å²	10	66.7 Å²	66.7	5%	0.052	33%	0.327	C	S	.	.	H	α-helix	trans	-58.7	-43.6	174.9	179.2	65.4	0	0	0	111.7	K52 V53 S58 S59 A293 L299 I303 T307 L311	K52-L56 WeakPolarHBondContact O-CB 3.47Å; K52-L56 PolarHBondContact O-N 2.95Å; V53-L56 PolarHBondContact O-N 3.48Å; L56-S58 PolarHBondContact O-N 2.66Å; L56-S59 VanDerWaalsContact O-CB 3.31Å; L56-S59 WeakPolarHBondContact O-CB 3.43Å; L56-S59 PolarHBondContact O-N 2.77Å; L56-S59 PolarHBondContact O-OG 3.02Å; L56-A293 HydrophobicContact CD2-CB 3.96Å; L56-L299 HydrophobicContact CD1-CD1 4.23Å; L56-L299 HydrophobicContact CD1-CD2 4.48Å; L56-I303 HydrophobicContact CD1-CG2 3.87Å; L56-T307 HydrophobicContact CB-CG2 4.02Å; L56-T307 HydrophobicContact CD2-CG2 3.88Å; L56-T307 HydrophobicContact CG-CG2 4.36Å; L56-L311 HydrophobicContact CD2-CD1 3.97Å; L56-L311 HydrophobicContact CD2-CD2 4.04Å; L56-L311 HydrophobicContact CD2-CG 4.25Å
57	S	94	Very high	90.5	Very high	9 Å²	9	66.7 Å²	66.7	6%	0.063	33%	0.334	C	S	.	.	H	α-helix	trans	-64.9	-25.8	-179.8	-58.8	0	0	0	0	112.9	V53 F54 E55 Y287 Y289	V53-S57 VanDerWaalsContact O-CB 3.3Å; V53-S57 WeakPolarHBondContact O-CB 3.39Å; V53-S57 PolarHBondContact O-N 2.87Å; V53-S57 PolarHBondContact O-OG 2.86Å; F54-S57 PolarHBondContact O-N 2.98Å; E55-S57 VanDerWaalsContact C-N 3.31Å; E55-S57 PolarHBondContact O-N 3.05Å; S57-Y287 VanDerWaalsContact CB-O 3.25Å; S57-Y287 WeakPolarHBondContact CB-O 3.42Å; S57-Y289 VanDerWaalsContact O-CD2 3.29Å; S57-Y289 WeakPolarHBondContact O-CD2 3.37Å; S57-Y289 WeakPolarHBondContact O-CE2 3.4Å; S57-Y289 PolarHBondContact OG-N 3.43Å
58	S	91.9	Very high	89.7	Confident	71 Å²	71	61.9 Å²	61.9	50%	0.497	31%	0.312	S	S	.	.	H	α-helix	trans	-92.9	-5.2	176.5	-53.9	0	0	0	0	113.1	F54 E55 L56	F54-S58 PolarHBondContact O-N 3.4Å; F54-S58 PolarHBondContact O-OG 3.46Å; E55-S58 CarbonylContact O-C 3.57Å; E55-S58 PolarHBondContact O-N 3.04Å; E55-S58 VanDerWaalsContact O-N 3.15Å; L56-S58 PolarHBondContact O-N 2.66Å
59	S	91.1	Very high	89.1	Confident	29 Å²	29	59.1 Å²	59.1	20%	0.203	31%	0.311	C	S	.	.	S	Bend	trans	-79.1	151.8	-176.3	77.9	0	0	0	0	112.7	E55 L56 L61 L62 A63	E55-S59 PolarHBondContact O-N 2.84Å; E55-S59 VanDerWaalsContact O-N 3.08Å; L56-S59 VanDerWaalsContact O-CB 3.31Å; L56-S59 WeakPolarHBondContact O-CB 3.43Å; L56-S59 PolarHBondContact O-N 2.77Å; L56-S59 PolarHBondContact O-OG 3.02Å; S59-L61 PolarHBondContact O-N 2.91Å; S59-L62 PolarHBondContact O-N 3.41Å; S59-L62 PolarHBondContact OG-N 2.98Å; S59-A63 PolarHBondContact O-N 3.19Å; S59-A63 VanDerWaalsContact O-N 3.13Å
60	Q	84.8	Confident	88.8	Confident	137 Å²	137	61.3 Å²	61.3	64%	0.64	32%	0.319	S	S	*	.	H	α-helix	trans	-65.6	-23.4	172.5	-68.7	-63.7	-17.5	0	0	112.8	A63 N64	Q60-A63 PolarHBondContact O-N 2.87Å; Q60-N64 WeakPolarHBondContact O-CB 3.23Å; Q60-N64 VanDerWaalsContact O-CG 3.23Å; Q60-N64 PolarHBondContact O-N 3.46Å; Q60-N64 PolarHBondContact O-ND2 2.99Å
61	L	82.9	Confident	88.4	Confident	109 Å²	109	60.4 Å²	60.4	57%	0.571	32%	0.324	S	S	*	.	H	α-helix	trans	-59.7	-49.8	177.8	-65.1	173.7	0	0	0	111	S59 S65 L299	S59-L61 PolarHBondContact O-N 2.91Å; L61-S65 PolarHBondContact O-N 3.39Å; L61-L299 HydrophobicContact CB-CD1 3.73Å
62	L	84.5	Confident	87.8	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-78.6	-31.7	177.3	-171.5	63.4	0	0	0	112.1	S59 N64 S65 Y289 A292 A293 L299	S59-L62 PolarHBondContact O-N 3.41Å; S59-L62 PolarHBondContact OG-N 2.98Å; L62-N64 PolarHBondContact O-N 3.26Å; L62-S65 VanDerWaalsContact O-CB 3.3Å; L62-S65 WeakPolarHBondContact O-CB 3.4Å; L62-S65 PolarHBondContact O-N 3.31Å; L62-Y289 HydrophobicContact CD2-CD2 4.04Å; L62-Y289 HydrophobicContact CD2-CG 4.31Å; L62-A292 HydrophobicContact CD1-CB 4.4Å; L62-A293 HydrophobicContact CD1-CB 4.11Å; L62-A293 HydrophobicContact CD2-CB 4.32Å; L62-L299 HydrophobicContact CB-CD2 4.48Å; L62-L299 HydrophobicContact CD1-CD2 3.64Å
63	A	80.9	Confident	87.3	Confident	33 Å²	33	59.7 Å²	59.7	27%	0.273	34%	0.336	S	S	.	.	H	α-helix	trans	-60.9	-31.1	176.6	0	0	0	0	0	113	S59 Q60	S59-A63 PolarHBondContact O-N 3.19Å; S59-A63 VanDerWaalsContact O-N 3.13Å; Q60-A63 PolarHBondContact O-N 2.87Å
64	N	80.9	Confident	86.6	Confident	122 Å²	122	66.7 Å²	66.7	65%	0.652	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-9.8	176.8	-68.8	-22.2	0	0	0	113.6	Q60 L62 K66	Q60-N64 WeakPolarHBondContact O-CB 3.23Å; Q60-N64 VanDerWaalsContact O-CG 3.23Å; Q60-N64 PolarHBondContact O-N 3.46Å; Q60-N64 PolarHBondContact O-ND2 2.99Å; L62-N64 PolarHBondContact O-N 3.26Å; N64-K66 PolarHBondContact O-N 3.15Å
65	S	80.2	Confident	85.7	Confident	14 Å²	14	63.7 Å²	63.7	10%	0.098	36%	0.357	C	S	.	.			trans	-65	130.8	176.6	-179	0	0	0	0	110.3	L61 L62 A67 D296	L61-S65 PolarHBondContact O-N 3.39Å; L62-S65 VanDerWaalsContact O-CB 3.3Å; L62-S65 WeakPolarHBondContact O-CB 3.4Å; L62-S65 PolarHBondContact O-N 3.31Å; S65-A67 PolarHBondContact OG-N 3.08Å; S65-D296 WeakPolarHBondContact CB-OD2 3.26Å; S65-D296 PolarHBondContact OG-OD2 3.33Å
66	K	79.8	Confident	84.5	Confident	208 Å²	208	70.6 Å²	70.6	90%	0.904	38%	0.379	S	S	*	.	S	Bend	trans	-100.1	-2.1	172.4	-63.1	-176.1	-178.9	179.3	0	112.7	N64	N64-K66 PolarHBondContact O-N 3.15Å
67	A	81.2	Confident	83.6	Confident	49 Å²	49	77.7 Å²	77.7	41%	0.405	41%	0.405	S	S	.	.	S	Bend	trans	-75.4	-34.4	-176.5	0	0	0	0	0	111.8	S65 A295 D296	S65-A67 PolarHBondContact OG-N 3.08Å; A67-A295 HydrophobicContact CB-CB 4.43Å; A67-D296 HydrophobicContact CB-CB 3.74Å
68	G	80.9	Confident	82.8	Confident	10 Å²	10	80.1 Å²	80.1	10%	0.103	42%	0.418	C	S	.	.	S	Bend	trans	-90.4	136.7	177.8	0	0	0	0	0	113.3	F70 N86	G68-F70 WeakPolarHBondContact O-CD2 3.42Å; G68-N86 WeakPolarHBondContact CA-OD1 3.21Å
69	A	85.7	Confident	82.5	Confident	48 Å²	48	78.3 Å²	78.3	40%	0.397	41%	0.41	S	S	.	.			trans	-81.7	136.3	169.3	0	0	0	0	0	111.2	I85 N86	A69-I85 HydrophobicContact CB-CD1 4Å; A69-I85 HydrophobicContact CB-CG1 3.88Å; A69-I85 WeakPolarHBondContact O-CG1 3.37Å; A69-N86 PolarHBondContact N-ND2 3.33Å; A69-N86 PolarHBondContact N-OD1 3.3Å; A69-N86 PolarHBondContact O-ND2 3.47Å
70	F	89.5	Confident	82.2	Confident	54 Å²	54	84.9 Å²	84.9	24%	0.237	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	139.3	175.3	-63.6	-81.6	0	0	0	110.1	G68 R82 K83 Y289 A292	G68-F70 WeakPolarHBondContact O-CD2 3.42Å; F70-R82 HydrophobicContact CB-CB 4.41Å; F70-R82 HydrophobicContact CD1-CB 4.2Å; F70-K83 WeakPolarHBondContact CA-O 3.44Å; F70-Y289 HydrophobicContact CE1-CD1 4.02Å; F70-Y289 HydrophobicContact CE1-CD2 4.08Å; F70-Y289 AromaticContact CE1-CG 3.77Å; F70-Y289 HydrophobicContact CE1-CG 3.77Å; F70-Y289 HydrophobicContact CZ-CG 4.48Å; F70-A292 HydrophobicContact CE1-CB 3.92Å; F70-A292 HydrophobicContact CE2-CB 4.29Å; F70-A292 HydrophobicContact CZ-CB 3.52Å
71	S	87.9	Confident	82.4	Confident	51 Å²	51	82 Å²	82	36%	0.357	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	150.3	164.1	-176.6	0	0	0	0	109.6	R82 K83	S71-R82 CarbonylContact O-C 3.59Å; S71-R82 WeakPolarHBondContact O-CA 3.44Å; S71-K83 PolarHBondContact N-O 2.91Å; S71-K83 PolarHBondContact O-N 3.36Å
72	T	86	Confident	82.8	Confident	97 Å²	97	82 Å²	82	60%	0.595	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.3	115	171.4	-59.5	0	0	0	0	108.6	K80	T72-K80 HydrophobicContact CG2-CB 4.13Å
73	S	85.9	Confident	83.2	Confident	38 Å²	38	82.8 Å²	82.8	27%	0.266	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	147.3	175.5	29.6	0	0	0	0	110.9	R81 H286	S73-R81 PolarHBondContact N-O 2.99Å; S73-R81 VanDerWaalsContact N-O 3.07Å; S73-R81 PolarHBondContact O-N 3.29Å; S73-H286 PolarHBondContact OG-NE2 3.32Å
74	Q	82	Confident	83.8	Confident	146 Å²	146	81.4 Å²	81.4	68%	0.682	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	112.6	173.1	-176.1	170.9	-16.2	0	0	109	K80	Q74-K80 HydrophobicContact CB-CG 4.5Å
75	L	78.6	Confident	84.4	Confident	22 Å²	22	77.5 Å²	77.5	12%	0.115	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	128.2	166.7	-72.1	164.8	0	0	0	107.6	W77 L78 G79 R81 H286	L75-W77 PolarHBondContact O-N 3.05Å; L75-L78 HydrophobicContact CB-CB 3.81Å; L75-L78 HydrophobicContact CB-CD1 4.4Å; L75-L78 HydrophobicContact CD1-CB 4.04Å; L75-L78 HydrophobicContact CD1-CD1 3.89Å; L75-L78 PolarHBondContact O-N 2.94Å; L75-L78 VanDerWaalsContact O-N 3.17Å; L75-G79 PolarHBondContact N-O 3.33Å; L75-G79 PolarHBondContact O-N 3.46Å; L75-G79 VanDerWaalsContact O-N 3.12Å; L75-R81 HydrophobicContact CD1-CB 4.41Å; L75-H286 HydrophobicContact CD1-CB 3.98Å
76	W	70	Confident	85.1	Confident	225 Å²	225	79 Å²	79	85%	0.852	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.5	-37.3	-172.9	56.6	-75.2	0	0	0	115.1
77	W	76.4	Confident	85.8	Confident	158 Å²	158	70.1 Å²	70.1	60%	0.598	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	-14.4	-176.7	61.6	-55.7	0	0	0	114.6	L75	L75-W77 PolarHBondContact O-N 3.05Å
78	L	78.3	Confident	86.3	Confident	61 Å²	61	72.4 Å²	72.4	32%	0.319	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109	-0.5	-171.8	-66.4	158.3	0	0	0	113.1	L75 L283 Y287	L75-L78 HydrophobicContact CB-CB 3.81Å; L75-L78 HydrophobicContact CB-CD1 4.4Å; L75-L78 HydrophobicContact CD1-CB 4.04Å; L75-L78 HydrophobicContact CD1-CD1 3.89Å; L75-L78 PolarHBondContact O-N 2.94Å; L75-L78 VanDerWaalsContact O-N 3.17Å; L78-L283 HydrophobicContact CD1-CD1 4Å; L78-Y287 HydrophobicContact CD1-CE2 4.3Å; L78-Y287 VanDerWaalsContact CD1-OH 3.24Å; L78-Y287 WeakPolarHBondContact CD1-OH 3.46Å; L78-Y287 WeakPolarHBondContact CD2-OH 3.38Å
79	G	84.2	Confident	87	Confident	33 Å²	33	74.2 Å²	74.2	34%	0.34	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	77.6	-163.1	-179	0	0	0	0	0	113.3	L75	L75-G79 PolarHBondContact N-O 3.33Å; L75-G79 PolarHBondContact O-N 3.46Å; L75-G79 VanDerWaalsContact O-N 3.12Å
80	K	86.4	Confident	87.4	Confident	167 Å²	167	72.1 Å²	72.1	73%	0.726	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	126.3	179.2	-68.5	-177.4	-179.7	179.5	0	109.7	T72 Q74	T72-K80 HydrophobicContact CG2-CB 4.13Å; Q74-K80 HydrophobicContact CB-CG 4.5Å
81	R	88.3	Confident	87.7	Confident	77 Å²	77	73.3 Å²	73.3	29%	0.291	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	152.6	177	-164.7	163.4	-180	138.3	4.8	111	S73 L75 H286 Y287	S73-R81 PolarHBondContact N-O 2.99Å; S73-R81 VanDerWaalsContact N-O 3.07Å; S73-R81 PolarHBondContact O-N 3.29Å; L75-R81 HydrophobicContact CD1-CB 4.41Å; R81-H286 WeakPolarHBondContact CD-O 3.47Å; R81-H286 HydrophobicContact CG-CB 4.43Å; R81-H286 PolarHBondContact NE-O 3.05Å; R81-Y287 VanDerWaalsContact NH2-CD1 3.27Å
82	R	90.5	Very high	88	Confident	107 Å²	107	74.2 Å²	74.2	40%	0.404	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	145.9	172.2	-57.6	-173.4	-146	179.7	5.3	109.3	F70 S71 H286	F70-R82 HydrophobicContact CB-CB 4.41Å; F70-R82 HydrophobicContact CD1-CB 4.2Å; S71-R82 CarbonylContact O-C 3.59Å; S71-R82 WeakPolarHBondContact O-CA 3.44Å; R82-H286 WeakPolarHBondContact O-CA 3.3Å; R82-H286 PolarHBondContact O-CD2 2.8Å
83	K	92.8	Very high	88.5	Confident	19 Å²	19	69.8 Å²	69.8	8%	0.083	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	131.2	173.6	-175.4	-174.4	176	-178.4	0	108.2	F70 S71 I85 E282 L285	F70-K83 WeakPolarHBondContact CA-O 3.44Å; S71-K83 PolarHBondContact N-O 2.91Å; S71-K83 PolarHBondContact O-N 3.36Å; K83-I85 HydrophobicContact CD-CG2 4.39Å; K83-I85 HydrophobicContact CG-CG2 4.4Å; K83-I85 PolarHBondContact O-N 3.46Å; K83-E282 IonicContact NZ-OE1 2.91Å; K83-E282 PolarHBondContact NZ-OE1 2.84Å; K83-E282 IonicContact NZ-OE2 2.83Å; K83-E282 PolarHBondContact NZ-OE2 2.59Å; K83-L285 HydrophobicContact CG-CB 4.04Å
84	D	93.9	Very high	88.9	Confident	3 Å²	3	68.1 Å²	68.1	2%	0.016	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	121.3	168.8	-167.1	-18.8	0	0	0	109.8	N86 L285 Y289 F290 E291 A292	D84-N86 WeakPolarHBondContact OD1-CB 3.28Å; D84-N86 PolarHBondContact OD1-N 2.8Å; D84-N86 PolarHBondContact OD1-ND2 3.48Å; D84-L285 HydrophobicContact CB-CD2 4.32Å; D84-L285 PolarHBondContact N-O 2.85Å; D84-Y289 HydrophobicContact CB-CD1 4.12Å; D84-Y289 VanDerWaalsContact OD2-CA 3.29Å; D84-Y289 WeakPolarHBondContact OD2-CA 3.43Å; D84-F290 PolarHBondContact OD2-N 3.47Å; D84-E291 WeakPolarHBondContact OD2-CB 3.34Å; D84-E291 PolarHBondContact OD2-N 2.83Å; D84-E291 VanDerWaalsContact OD2-N 3.08Å; D84-A292 PolarHBondContact OD2-N 2.82Å
85	I	94.1	Very high	89.4	Confident	41 Å²	41	65.2 Å²	65.2	21%	0.21	28%	0.284	C	S	.	.			trans	-119.5	13.7	-179.9	59.5	163.9	0	0	0	112.4	A69 K83 N87 Y91	A69-I85 HydrophobicContact CB-CD1 4Å; A69-I85 HydrophobicContact CB-CG1 3.88Å; A69-I85 WeakPolarHBondContact O-CG1 3.37Å; K83-I85 HydrophobicContact CD-CG2 4.39Å; K83-I85 HydrophobicContact CG-CG2 4.4Å; K83-I85 PolarHBondContact O-N 3.46Å; I85-N87 VanDerWaalsContact C-N 3.32Å; I85-N87 PolarHBondContact O-N 3.38Å; I85-Y91 HydrophobicContact CB-CD2 3.89Å; I85-Y91 HydrophobicContact CB-CE2 4.25Å; I85-Y91 HydrophobicContact CG2-CD2 3.99Å; I85-Y91 HydrophobicContact CG2-CE2 4.16Å
86	N	94.2	Very high	90.2	Very high	45 Å²	45	64.4 Å²	64.4	24%	0.241	28%	0.28	C	S	.	.			trans	-74.5	-20.7	-173.6	-67.5	-78.7	0	0	0	113.3	G68 A69 D84 Y88 E291 A292	G68-N86 WeakPolarHBondContact CA-OD1 3.21Å; A69-N86 PolarHBondContact N-ND2 3.33Å; A69-N86 PolarHBondContact N-OD1 3.3Å; A69-N86 PolarHBondContact O-ND2 3.47Å; D84-N86 WeakPolarHBondContact OD1-CB 3.28Å; D84-N86 PolarHBondContact OD1-N 2.8Å; D84-N86 PolarHBondContact OD1-ND2 3.48Å; N86-Y88 PolarHBondContact O-N 3.47Å; N86-E291 HydrophobicContact CB-CB 3.69Å; N86-A292 WeakPolarHBondContact ND2-CA 3.42Å; N86-A292 WeakPolarHBondContact ND2-CB 3.42Å
87	N	94.6	Very high	91.4	Very high	22 Å²	22	54.2 Å²	54.2	12%	0.118	24%	0.242	C	C	.	.			trans	-73.6	98.9	172.6	-165.6	-89.6	0	0	0	110.8	I85 E89 W90 Y91 E291 F318 K322	I85-N87 VanDerWaalsContact C-N 3.32Å; I85-N87 PolarHBondContact O-N 3.38Å; N87-E89 PolarHBondContact O-N 2.92Å; N87-W90 HydrophobicContact CB-CB 4.11Å; N87-W90 PolarHBondContact O-N 3.48Å; N87-W90 WeakPolarHBondContact OD1-CB 3.38Å; N87-W90 PolarHBondContact OD1-N 3.22Å; N87-Y91 WeakPolarHBondContact O-CB 3.25Å; N87-Y91 PolarHBondContact O-N 3.24Å; N87-E291 HydrophobicContact CB-CG 4.08Å; N87-E291 PolarHBondContact ND2-OE1 3.47Å; N87-F318 HydrophobicContact CB-CE1 3.74Å; N87-F318 HydrophobicContact CB-CZ 4.05Å; N87-K322 PolarHBondContact OD1-NZ 3.5Å
88	Y	92.4	Very high	92.3	Very high	96 Å²	96	52.3 Å²	52.3	38%	0.376	24%	0.238	S	C	.	.	H	α-helix	trans	-47.9	-55.4	179	175.2	-92.9	0	0	0	112.5	N86 W90 Y91 Y92 F191	N86-Y88 PolarHBondContact O-N 3.47Å; Y88-W90 PolarHBondContact O-N 3.21Å; Y88-Y91 PolarHBondContact O-N 2.95Å; Y88-Y92 HydrophobicContact CD1-CD2 4.43Å; Y88-Y92 AromaticContact CD2-CD2 3.61Å; Y88-Y92 HydrophobicContact CD2-CD2 3.61Å; Y88-Y92 AromaticContact CD2-CE2 3.36Å; Y88-Y92 HydrophobicContact CD2-CE2 3.36Å; Y88-Y92 HydrophobicContact CE1-CD2 4.35Å; Y88-Y92 AromaticContact CE2-CD2 3.49Å; Y88-Y92 HydrophobicContact CE2-CD2 3.49Å; Y88-Y92 VanDerWaalsContact CE2-CD2 3.49Å; Y88-Y92 AromaticContact CE2-CE2 3.21Å; Y88-Y92 HydrophobicContact CE2-CE2 3.21Å; Y88-Y92 HydrophobicContact CG-CD2 4.07Å; Y88-Y92 HydrophobicContact CG-CE2 4.25Å; Y88-Y92 AromaticContact CZ-CD2 3.88Å; Y88-Y92 VanDerWaalsContact O-CD2 3.24Å; Y88-Y92 WeakPolarHBondContact O-CD2 3.41Å; Y88-Y92 PolarHBondContact O-N 3.41Å; Y88-Y92 VanDerWaalsContact O-N 3.11Å; Y88-F191 HydrophobicContact CE1-CB 4.1Å; Y88-F191 HydrophobicContact CE1-CD2 4.39Å; Y88-F191 PolarHBondContact OH-N 2.95Å; Y88-F191 VanDerWaalsContact OH-N 3.13Å
89	E	94.3	Very high	93.1	Very high	48 Å²	48	54.6 Å²	54.6	22%	0.224	25%	0.247	C	C	.	.	H	α-helix	trans	-61.7	-47.8	-175.6	-173.4	-175.9	-165.3	0	0	111.9	N87 Y91 W93 F191 K322 Y323 I326	N87-E89 PolarHBondContact O-N 2.92Å; E89-Y91 PolarHBondContact O-N 3.23Å; E89-W93 WeakPolarHBondContact O-CB 3.44Å; E89-W93 PolarHBondContact O-N 3.23Å; E89-F191 HydrophobicContact CG-CE2 3.92Å; E89-K322 WeakPolarHBondContact OE2-CE 3.32Å; E89-K322 IonicContact OE2-NZ 3.8Å; E89-K322 PolarHBondContact OE2-NZ 3.13Å; E89-Y323 VanDerWaalsContact CD-OH 3.28Å; E89-Y323 PolarHBondContact OE1-OH 3.12Å; E89-Y323 PolarHBondContact OE2-OH 2.99Å; E89-I326 HydrophobicContact CG-CD1 4.34Å
90	W	95.9	Very high	93.6	Very high	5 Å²	5	53 Å²	53	2%	0.019	23%	0.231	C	C	.	.	H	α-helix	trans	-64	-42.9	179.4	-177.6	-105.4	0	0	0	111.9	N87 Y88 W93 S94 Y278 I281 E282 F318 K322 V325 I326	N87-W90 HydrophobicContact CB-CB 4.11Å; N87-W90 PolarHBondContact O-N 3.48Å; N87-W90 WeakPolarHBondContact OD1-CB 3.38Å; N87-W90 PolarHBondContact OD1-N 3.22Å; Y88-W90 PolarHBondContact O-N 3.21Å; W90-W93 AromaticContact CE3-CE3 3.93Å; W90-W93 HydrophobicContact CE3-CE3 3.93Å; W90-W93 HydrophobicContact CE3-CZ3 4.28Å; W90-W93 HydrophobicContact CH2-CE3 4.4Å; W90-W93 AromaticContact CH2-CZ3 3.95Å; W90-W93 HydrophobicContact CH2-CZ3 3.95Å; W90-W93 AromaticContact CZ3-CE3 3.78Å; W90-W93 HydrophobicContact CZ3-CE3 3.78Å; W90-W93 AromaticContact CZ3-CZ3 3.65Å; W90-W93 HydrophobicContact CZ3-CZ3 3.65Å; W90-S94 WeakPolarHBondContact O-CB 3.32Å; W90-S94 PolarHBondContact O-N 3.41Å; W90-S94 PolarHBondContact O-OG 2.82Å; W90-S94 VanDerWaalsContact O-OG 3.1Å; W90-Y278 AromaticContact CH2-CD2 3.85Å; W90-Y278 HydrophobicContact CH2-CD2 3.85Å; W90-Y278 HydrophobicContact CH2-CE2 4.33Å; W90-Y278 HydrophobicContact CZ2-CD2 4.04Å; W90-Y278 HydrophobicContact CZ2-CE2 4.18Å; W90-I281 HydrophobicContact CD2-CG2 4.26Å; W90-I281 VanDerWaalsContact CE2-CG2 3.49Å; W90-I281 HydrophobicContact CH2-CB 4.23Å; W90-I281 HydrophobicContact CH2-CD1 3.72Å; W90-I281 HydrophobicContact CH2-CG2 3.99Å; W90-I281 HydrophobicContact CZ2-CB 3.86Å; W90-I281 HydrophobicContact CZ2-CD1 4.2Å; W90-I281 HydrophobicContact CZ2-CG2 3.34Å; W90-I281 HydrophobicContact CZ3-CD1 4.16Å; W90-E282 PolarHBondContact NE1-OE1 3.44Å; W90-F318 HydrophobicContact CB-CZ 4.02Å; W90-F318 HydrophobicContact CG-CZ 4.09Å; W90-K322 HydrophobicContact CB-CD 4.1Å; W90-K322 HydrophobicContact CE3-CB 4.36Å; W90-K322 HydrophobicContact CE3-CD 4.27Å; W90-K322 HydrophobicContact CE3-CG 3.73Å; W90-K322 HydrophobicContact CZ3-CG 4.22Å; W90-V325 HydrophobicContact CH2-CB 4.16Å; W90-V325 HydrophobicContact CH2-CG1 3.93Å; W90-V325 HydrophobicContact CZ3-CB 4.15Å; W90-V325 HydrophobicContact CZ3-CG1 4.14Å; W90-I326 HydrophobicContact CZ3-CG1 4.44Å
91	Y	94.5	Very high	94.1	Very high	79 Å²	79	46.6 Å²	46.6	31%	0.31	21%	0.209	S	C	.	.	H	α-helix	trans	-57.3	-57.7	179.9	179.1	-100.6	0	0	0	110.9	I85 N87 Y88 E89 S94 M95	I85-Y91 HydrophobicContact CB-CD2 3.89Å; I85-Y91 HydrophobicContact CB-CE2 4.25Å; I85-Y91 HydrophobicContact CG2-CD2 3.99Å; I85-Y91 HydrophobicContact CG2-CE2 4.16Å; N87-Y91 WeakPolarHBondContact O-CB 3.25Å; N87-Y91 PolarHBondContact O-N 3.24Å; Y88-Y91 PolarHBondContact O-N 2.95Å; E89-Y91 PolarHBondContact O-N 3.23Å; Y91-S94 PolarHBondContact O-N 2.87Å; Y91-S94 PolarHBondContact O-OG 3.04Å; Y91-M95 HydrophobicContact CD1-SD 4.18Å; Y91-M95 HydrophobicContact CE1-SD 3.56Å; Y91-M95 VanDerWaalsContact CE1-SD 3.56Å; Y91-M95 HydrophobicContact CE2-SD 4.2Å; Y91-M95 VanDerWaalsContact CZ-SD 3.57Å; Y91-M95 WeakPolarHBondContact O-CG 3.38Å; Y91-M95 PolarHBondContact O-N 2.92Å
92	Y	94.4	Very high	94.6	Very high	69 Å²	69	48.2 Å²	48.2	27%	0.271	22%	0.222	S	C	.	.	H	α-helix	trans	-68.9	-37.9	-178.6	-72.3	-77.1	0	0	0	112.8	Y88 M95 W96 F191	Y88-Y92 HydrophobicContact CD1-CD2 4.43Å; Y88-Y92 AromaticContact CD2-CD2 3.61Å; Y88-Y92 HydrophobicContact CD2-CD2 3.61Å; Y88-Y92 AromaticContact CD2-CE2 3.36Å; Y88-Y92 HydrophobicContact CD2-CE2 3.36Å; Y88-Y92 HydrophobicContact CE1-CD2 4.35Å; Y88-Y92 AromaticContact CE2-CD2 3.49Å; Y88-Y92 HydrophobicContact CE2-CD2 3.49Å; Y88-Y92 VanDerWaalsContact CE2-CD2 3.49Å; Y88-Y92 AromaticContact CE2-CE2 3.21Å; Y88-Y92 HydrophobicContact CE2-CE2 3.21Å; Y88-Y92 HydrophobicContact CG-CD2 4.07Å; Y88-Y92 HydrophobicContact CG-CE2 4.25Å; Y88-Y92 AromaticContact CZ-CD2 3.88Å; Y88-Y92 VanDerWaalsContact O-CD2 3.24Å; Y88-Y92 WeakPolarHBondContact O-CD2 3.41Å; Y88-Y92 PolarHBondContact O-N 3.41Å; Y88-Y92 VanDerWaalsContact O-N 3.11Å; Y92-M95 PolarHBondContact O-N 2.84Å; Y92-W96 WeakPolarHBondContact O-CB 3.34Å; Y92-W96 PolarHBondContact O-N 3.02Å; Y92-F191 HydrophobicContact CG-CB 4.21Å
93	W	95.7	Very high	94.9	Very high	4 Å²	4	45 Å²	45	2%	0.015	21%	0.211	C	C	.	.	H	α-helix	trans	-63.3	-42.6	175.5	-178.3	89.4	0	0	0	111.7	E89 W90 M95 W96 V97 F191 Y278 V325 I326 F329	E89-W93 WeakPolarHBondContact O-CB 3.44Å; E89-W93 PolarHBondContact O-N 3.23Å; W90-W93 AromaticContact CE3-CE3 3.93Å; W90-W93 HydrophobicContact CE3-CE3 3.93Å; W90-W93 HydrophobicContact CE3-CZ3 4.28Å; W90-W93 HydrophobicContact CH2-CE3 4.4Å; W90-W93 AromaticContact CH2-CZ3 3.95Å; W90-W93 HydrophobicContact CH2-CZ3 3.95Å; W90-W93 AromaticContact CZ3-CE3 3.78Å; W90-W93 HydrophobicContact CZ3-CE3 3.78Å; W90-W93 AromaticContact CZ3-CZ3 3.65Å; W90-W93 HydrophobicContact CZ3-CZ3 3.65Å; W93-M95 VanDerWaalsContact C-N 3.28Å; W93-M95 PolarHBondContact O-N 3.31Å; W93-W96 PolarHBondContact O-N 3.01Å; W93-V97 HydrophobicContact CD2-CB 4.38Å; W93-V97 HydrophobicContact CE3-CB 4.47Å; W93-V97 HydrophobicContact CE3-CG1 4.13Å; W93-V97 HydrophobicContact CH2-CB 4.06Å; W93-V97 HydrophobicContact CH2-CG1 3.93Å; W93-V97 HydrophobicContact CH2-CG2 3.87Å; W93-V97 HydrophobicContact CZ2-CB 4Å; W93-V97 HydrophobicContact CZ2-CG1 4.37Å; W93-V97 HydrophobicContact CZ2-CG2 3.75Å; W93-V97 HydrophobicContact CZ3-CB 4.32Å; W93-V97 HydrophobicContact CZ3-CG1 3.83Å; W93-V97 WeakPolarHBondContact O-CB 3.48Å; W93-V97 WeakPolarHBondContact O-CG1 3.46Å; W93-V97 PolarHBondContact O-N 2.85Å; W93-F191 HydrophobicContact CB-CE1 4.07Å; W93-F191 HydrophobicContact CB-CZ 3.74Å; W93-F191 AromaticContact CD1-CZ 3.99Å; W93-F191 HydrophobicContact CG-CZ 4.31Å; W93-Y278 HydrophobicContact CZ3-CD2 4.21Å; W93-Y278 HydrophobicContact CZ3-CE2 4.27Å; W93-V325 HydrophobicContact CH2-CG1 3.62Å; W93-V325 HydrophobicContact CZ3-CG1 3.89Å; W93-I326 HydrophobicContact CD2-CD1 4.31Å; W93-I326 HydrophobicContact CD2-CG1 3.72Å; W93-I326 HydrophobicContact CE3-CG1 4.09Å; W93-I326 HydrophobicContact CG-CD1 4.18Å; W93-I326 HydrophobicContact CG-CG1 4.06Å; W93-I326 HydrophobicContact CZ2-CB 4.45Å; W93-I326 HydrophobicContact CZ2-CG1 4.18Å; W93-I326 HydrophobicContact CZ3-CG1 4.48Å; W93-F329 HydrophobicContact CH2-CB 4.34Å; W93-F329 HydrophobicContact CZ2-CB 4.06Å; W93-F329 HydrophobicContact CZ2-CG 4.44Å
94	S	95	Very high	95.2	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.021	21%	0.208	C	C	.	.	H	α-helix	trans	-66.2	-30	180	74.5	0	0	0	0	112.9	W90 Y91 K98	W90-S94 WeakPolarHBondContact O-CB 3.32Å; W90-S94 PolarHBondContact O-N 3.41Å; W90-S94 PolarHBondContact O-OG 2.82Å; W90-S94 VanDerWaalsContact O-OG 3.1Å; Y91-S94 PolarHBondContact O-N 2.87Å; Y91-S94 PolarHBondContact O-OG 3.04Å; S94-K98 WeakPolarHBondContact O-CD 3.39Å; S94-K98 WeakPolarHBondContact O-CE 3.41Å; S94-K98 VanDerWaalsContact O-CG 3.29Å; S94-K98 WeakPolarHBondContact O-CG 3.5Å
95	M	93.4	Very high	95.4	Very high	86 Å²	86	47.3 Å²	47.3	42%	0.424	23%	0.229	S	C	.	.	H	α-helix	trans	-74	-46.5	172.1	-67.6	178.8	70.8	0	0	111.1	Y91 Y92 W93 K98	Y91-M95 HydrophobicContact CD1-SD 4.18Å; Y91-M95 HydrophobicContact CE1-SD 3.56Å; Y91-M95 VanDerWaalsContact CE1-SD 3.56Å; Y91-M95 HydrophobicContact CE2-SD 4.2Å; Y91-M95 VanDerWaalsContact CZ-SD 3.57Å; Y91-M95 WeakPolarHBondContact O-CG 3.38Å; Y91-M95 PolarHBondContact O-N 2.92Å; Y92-M95 PolarHBondContact O-N 2.84Å; W93-M95 VanDerWaalsContact C-N 3.28Å; W93-M95 PolarHBondContact O-N 3.31Å; M95-K98 PolarHBondContact O-N 3.43Å
96	W	94.6	Very high	95.5	Very high	5 Å²	5	48.9 Å²	48.9	2%	0.019	24%	0.237	C	C	.	.	H	α-helix	trans	-61.5	-45.3	178.9	173.3	82.4	0	0	0	112.1	Y92 W93 K98 Q99 A100 Y104 F139 L241	Y92-W96 WeakPolarHBondContact O-CB 3.34Å; Y92-W96 PolarHBondContact O-N 3.02Å; W93-W96 PolarHBondContact O-N 3.01Å; W96-K98 VanDerWaalsContact C-N 3.27Å; W96-K98 PolarHBondContact O-N 3.45Å; W96-Q99 PolarHBondContact O-N 3.21Å; W96-Q99 VanDerWaalsContact O-N 3.09Å; W96-A100 HydrophobicContact CD2-CB 4.17Å; W96-A100 HydrophobicContact CE3-CB 4.29Å; W96-A100 HydrophobicContact CH2-CB 3.98Å; W96-A100 HydrophobicContact CZ2-CB 3.84Å; W96-A100 HydrophobicContact CZ3-CB 4.19Å; W96-A100 WeakPolarHBondContact O-CB 3.47Å; W96-A100 PolarHBondContact O-N 3.37Å; W96-Y104 HydrophobicContact CH2-CE2 4.24Å; W96-F139 HydrophobicContact CZ2-CE2 4.47Å; W96-F139 AromaticContact CZ2-CZ 3.82Å; W96-F139 HydrophobicContact CZ2-CZ 3.82Å; W96-F139 AromaticContact NE1-CZ 3.93Å; W96-L241 HydrophobicContact CE3-CD2 4.36Å; W96-L241 HydrophobicContact CH2-CD2 3.54Å; W96-L241 HydrophobicContact CZ2-CD2 3.78Å; W96-L241 HydrophobicContact CZ3-CD2 3.86Å
97	V	95.9	Very high	95.7	Very high	10 Å²	10	46.7 Å²	46.7	6%	0.061	23%	0.226	C	C	.	.	H	α-helix	trans	-64.6	-31.5	-175.9	76.3	0	0	0	0	112.3	W93 Q99 A100 A101 F329	W93-V97 HydrophobicContact CD2-CB 4.38Å; W93-V97 HydrophobicContact CE3-CB 4.47Å; W93-V97 HydrophobicContact CE3-CG1 4.13Å; W93-V97 HydrophobicContact CH2-CB 4.06Å; W93-V97 HydrophobicContact CH2-CG1 3.93Å; W93-V97 HydrophobicContact CH2-CG2 3.87Å; W93-V97 HydrophobicContact CZ2-CB 4Å; W93-V97 HydrophobicContact CZ2-CG1 4.37Å; W93-V97 HydrophobicContact CZ2-CG2 3.75Å; W93-V97 HydrophobicContact CZ3-CB 4.32Å; W93-V97 HydrophobicContact CZ3-CG1 3.83Å; W93-V97 WeakPolarHBondContact O-CB 3.48Å; W93-V97 WeakPolarHBondContact O-CG1 3.46Å; W93-V97 PolarHBondContact O-N 2.85Å; V97-Q99 VanDerWaalsContact C-N 3.32Å; V97-Q99 PolarHBondContact O-N 3.44Å; V97-A100 PolarHBondContact O-N 3.11Å; V97-A101 VanDerWaalsContact O-CB 3.29Å; V97-A101 WeakPolarHBondContact O-CB 3.38Å; V97-A101 PolarHBondContact O-N 3.16Å; V97-F329 HydrophobicContact CG2-CD1 3.64Å; V97-F329 HydrophobicContact CG2-CD2 3.86Å; V97-F329 HydrophobicContact CG2-CE1 3.56Å; V97-F329 HydrophobicContact CG2-CE2 3.77Å; V97-F329 HydrophobicContact CG2-CG 3.8Å; V97-F329 HydrophobicContact CG2-CZ 3.63Å
98	K	94.6	Very high	95.8	Very high	119 Å²	119	48.2 Å²	48.2	52%	0.517	23%	0.231	S	C	.	.	H	α-helix	trans	-62.8	-39.2	175	-72.4	168.9	-173	172.9	0	111.9	S94 M95 W96 Y278	S94-K98 WeakPolarHBondContact O-CD 3.39Å; S94-K98 WeakPolarHBondContact O-CE 3.41Å; S94-K98 VanDerWaalsContact O-CG 3.29Å; S94-K98 WeakPolarHBondContact O-CG 3.5Å; M95-K98 PolarHBondContact O-N 3.43Å; W96-K98 VanDerWaalsContact C-N 3.27Å; W96-K98 PolarHBondContact O-N 3.45Å; K98-Y278 VanDerWaalsContact CE-OH 3.29Å; K98-Y278 WeakPolarHBondContact CE-OH 3.44Å
99	Q	94.5	Very high	96	Very high	108 Å²	108	47 Å²	47	51%	0.505	23%	0.234	S	C	.	.	H	α-helix	trans	-73.8	-45.7	174.2	-62.9	175.4	-2.1	0	0	110.6	W96 V97 A101 F103 L138	W96-Q99 PolarHBondContact O-N 3.21Å; W96-Q99 VanDerWaalsContact O-N 3.09Å; V97-Q99 VanDerWaalsContact C-N 3.32Å; V97-Q99 PolarHBondContact O-N 3.44Å; Q99-A101 VanDerWaalsContact C-N 3.3Å; Q99-A101 PolarHBondContact O-N 2.68Å; Q99-F103 WeakPolarHBondContact O-CD2 3.43Å; Q99-L138 HydrophobicContact CB-CD2 4.38Å
100	A	96.2	Very high	96.1	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63.1	-33	-178.5	0	0	0	0	0	113	W96 V97 I102 F103 Y104 L138	W96-A100 HydrophobicContact CD2-CB 4.17Å; W96-A100 HydrophobicContact CE3-CB 4.29Å; W96-A100 HydrophobicContact CH2-CB 3.98Å; W96-A100 HydrophobicContact CZ2-CB 3.84Å; W96-A100 HydrophobicContact CZ3-CB 4.19Å; W96-A100 WeakPolarHBondContact O-CB 3.47Å; W96-A100 PolarHBondContact O-N 3.37Å; V97-A100 PolarHBondContact O-N 3.11Å; A100-I102 PolarHBondContact O-N 2.96Å; A100-I102 VanDerWaalsContact O-N 3.15Å; A100-F103 CarbonylContact O-C 3.34Å; A100-F103 WeakPolarHBondContact O-CA 3.41Å; A100-F103 WeakPolarHBondContact O-CB 3.41Å; A100-F103 PolarHBondContact O-N 2.88Å; A100-Y104 HydrophobicContact CB-CD2 4.1Å; A100-Y104 HydrophobicContact CB-CE2 4.12Å; A100-Y104 WeakPolarHBondContact O-CD2 3.27Å; A100-Y104 PolarHBondContact O-N 2.81Å; A100-L138 HydrophobicContact CB-CD1 3.95Å; A100-L138 HydrophobicContact CB-CD2 3.99Å
101	A	97	Very high	96.1	Very high	32 Å²	32	46.2 Å²	46.2	26%	0.264	23%	0.231	S	C	.	.	H	α-helix	trans	-51.8	-40.2	-177.2	0	0	0	0	0	113.5	V97 Q99 F103 Y104 C105 F329	V97-A101 VanDerWaalsContact O-CB 3.29Å; V97-A101 WeakPolarHBondContact O-CB 3.38Å; V97-A101 PolarHBondContact O-N 3.16Å; Q99-A101 VanDerWaalsContact C-N 3.3Å; Q99-A101 PolarHBondContact O-N 2.68Å; A101-F103 PolarHBondContact O-N 2.83Å; A101-Y104 PolarHBondContact O-N 3.45Å; A101-C105 PolarHBondContact O-N 3.04Å; A101-C105 PolarHBondContact O-SG 2.64Å; A101-C105 VanDerWaalsContact O-SG 3.35Å; A101-F329 HydrophobicContact CB-CE2 4.49Å; A101-F329 HydrophobicContact CB-CZ 4.29Å
102	I	97.4	Very high	96.1	Very high	112 Å²	112	43.2 Å²	43.2	57%	0.574	22%	0.22	S	C	*	.	H	α-helix	trans	-62.2	-45.8	177.2	-63.2	170.9	0	0	0	110.5	A100 Y104 C105 I106	A100-I102 PolarHBondContact O-N 2.96Å; A100-I102 VanDerWaalsContact O-N 3.15Å; I102-Y104 VanDerWaalsContact C-N 3.32Å; I102-Y104 PolarHBondContact O-N 3.2Å; I102-C105 WeakPolarHBondContact O-CB 3.33Å; I102-C105 PolarHBondContact O-N 3.06Å; I102-I106 HydrophobicContact CG2-CD1 4.06Å; I102-I106 WeakPolarHBondContact O-CG1 3.42Å; I102-I106 PolarHBondContact O-N 2.8Å
103	F	98	Very high	95.9	Very high	39 Å²	39	42.6 Å²	42.6	17%	0.171	23%	0.226	C	C	.	.	H	α-helix	trans	-66.3	-32.8	176.3	-64.3	-92.9	0	0	0	112.3	Q99 A100 A101 H107 Y130 A134 Q137 L138 F237	Q99-F103 WeakPolarHBondContact O-CD2 3.43Å; A100-F103 CarbonylContact O-C 3.34Å; A100-F103 WeakPolarHBondContact O-CA 3.41Å; A100-F103 WeakPolarHBondContact O-CB 3.41Å; A100-F103 PolarHBondContact O-N 2.88Å; A101-F103 PolarHBondContact O-N 2.83Å; F103-H107 WeakPolarHBondContact O-CB 3.37Å; F103-H107 PolarHBondContact O-N 3.46Å; F103-Y130 VanDerWaalsContact C-OH 3.29Å; F103-Y130 VanDerWaalsContact CA-OH 3.27Å; F103-Y130 WeakPolarHBondContact CA-OH 3.22Å; F103-Y130 PolarHBondContact O-OH 3.45Å; F103-A134 HydrophobicContact CB-CB 4.49Å; F103-A134 HydrophobicContact CD1-CB 3.72Å; F103-A134 HydrophobicContact CE1-CB 4.4Å; F103-A134 HydrophobicContact CG-CB 4.44Å; F103-Q137 HydrophobicContact CE1-CB 3.81Å; F103-Q137 HydrophobicContact CE1-CG 4.11Å; F103-Q137 HydrophobicContact CZ-CB 3.59Å; F103-Q137 HydrophobicContact CZ-CG 4.16Å; F103-L138 HydrophobicContact CB-CD1 4.15Å; F103-L138 HydrophobicContact CD2-CD1 4.15Å; F103-L138 HydrophobicContact CD2-CD2 3.63Å; F103-L138 HydrophobicContact CD2-CG 3.96Å; F103-L138 HydrophobicContact CE2-CD2 3.74Å; F103-L138 HydrophobicContact CE2-CG 4.17Å; F103-L138 HydrophobicContact CG-CD1 4.15Å; F103-L138 HydrophobicContact CG-CD2 4.42Å; F103-L138 HydrophobicContact CG-CG 4.29Å; F103-F237 HydrophobicContact CB-CE1 3.97Å; F103-F237 HydrophobicContact CB-CZ 3.58Å
104	Y	98.1	Very high	95.6	Very high	1 Å²	1	44 Å²	44	0%	0.004	24%	0.235	C	C	.	.	H	α-helix	trans	-68.3	-36.6	173.5	-86.9	-91.1	0	0	0	112	W96 A100 A101 I102 H107 F108 F237 Q240 F329 P330 F333	W96-Y104 HydrophobicContact CH2-CE2 4.24Å; A100-Y104 HydrophobicContact CB-CD2 4.1Å; A100-Y104 HydrophobicContact CB-CE2 4.12Å; A100-Y104 WeakPolarHBondContact O-CD2 3.27Å; A100-Y104 PolarHBondContact O-N 2.81Å; A101-Y104 PolarHBondContact O-N 3.45Å; I102-Y104 VanDerWaalsContact C-N 3.32Å; I102-Y104 PolarHBondContact O-N 3.2Å; Y104-H107 WeakPolarHBondContact O-CB 3.45Å; Y104-H107 PolarHBondContact O-N 3.43Å; Y104-F108 PolarHBondContact O-N 3.33Å; Y104-F237 AromaticContact CD1-CD1 3.81Å; Y104-F237 HydrophobicContact CD1-CD1 3.81Å; Y104-F237 AromaticContact CD1-CE1 3.92Å; Y104-F237 HydrophobicContact CD1-CE1 3.92Å; Y104-F237 HydrophobicContact CD2-CD1 4.07Å; Y104-F237 AromaticContact CD2-CE1 3.33Å; Y104-F237 HydrophobicContact CD2-CE1 3.33Å; Y104-F237 HydrophobicContact CD2-CZ 4.12Å; Y104-F237 AromaticContact CE1-CD1 3.88Å; Y104-F237 HydrophobicContact CE1-CD1 3.88Å; Y104-F237 HydrophobicContact CE1-CE1 4.12Å; Y104-F237 HydrophobicContact CE2-CD1 4.07Å; Y104-F237 AromaticContact CE2-CE1 3.51Å; Y104-F237 HydrophobicContact CE2-CE1 3.51Å; Y104-F237 HydrophobicContact CE2-CZ 4.08Å; Y104-F237 AromaticContact CG-CD1 3.94Å; Y104-F237 HydrophobicContact CG-CD1 3.94Å; Y104-F237 AromaticContact CG-CE1 3.55Å; Y104-F237 HydrophobicContact CG-CE1 3.55Å; Y104-F237 AromaticContact CZ-CD1 3.99Å; Y104-F237 AromaticContact CZ-CE1 3.92Å; Y104-F237 PolarHBondContact OH-O 3.18Å; Y104-Q240 PolarHBondContact OH-NE2 3.1Å; Y104-F329 HydrophobicContact CD1-CE1 4.19Å; Y104-F329 AromaticContact CD2-CE1 3.51Å; Y104-F329 HydrophobicContact CD2-CE1 3.51Å; Y104-F329 AromaticContact CD2-CZ 3.83Å; Y104-F329 HydrophobicContact CD2-CZ 3.83Å; Y104-F329 HydrophobicContact CE1-CE1 4.19Å; Y104-F329 AromaticContact CE2-CE1 3.59Å; Y104-F329 HydrophobicContact CE2-CE1 3.59Å; Y104-F329 HydrophobicContact CE2-CZ 4.37Å; Y104-F329 AromaticContact CG-CE1 3.84Å; Y104-F329 HydrophobicContact CG-CE1 3.84Å; Y104-F329 AromaticContact CG-CZ 3.95Å; Y104-F329 HydrophobicContact CG-CZ 3.95Å; Y104-F329 AromaticContact CZ-CE1 3.93Å; Y104-P330 HydrophobicContact CE1-CB 4.43Å; Y104-F333 VanDerWaalsContact C-CE1 3.47Å; Y104-F333 HydrophobicContact CD1-CB 3.79Å; Y104-F333 HydrophobicContact CD1-CD1 4.14Å; Y104-F333 AromaticContact CD1-CD2 3.47Å; Y104-F333 HydrophobicContact CD1-CD2 3.47Å; Y104-F333 VanDerWaalsContact CD1-CD2 3.47Å; Y104-F333 HydrophobicContact CD1-CE2 4.07Å; Y104-F333 AromaticContact CD1-CG 3.52Å; Y104-F333 HydrophobicContact CD1-CG 3.52Å; Y104-F333 HydrophobicContact CE1-CB 4.32Å; Y104-F333 HydrophobicContact CE1-CD2 4.27Å; Y104-F333 HydrophobicContact CE1-CG 4.42Å; Y104-F333 AromaticContact CG-CD2 3.98Å; Y104-F333 HydrophobicContact CG-CD2 3.98Å; Y104-F333 HydrophobicContact CG-CE2 4.11Å; Y104-F333 HydrophobicContact CG-CG 4.23Å; Y104-F333 HydrophobicContact CG-CZ 4.46Å; Y104-F333 WeakPolarHBondContact O-CD1 3.28Å; Y104-F333 VanDerWaalsContact O-CE1 3.31Å; Y104-F333 WeakPolarHBondContact O-CE1 3.47Å
105	C	97.7	Very high	95.2	Very high	69 Å²	69	46 Å²	46	47%	0.466	24%	0.243	S	C	.	.	H	α-helix	trans	-66.4	-45.2	172.9	-69.2	0	0	0	0	112.2	A101 I102 H107 F108 V109	A101-C105 PolarHBondContact O-N 3.04Å; A101-C105 PolarHBondContact O-SG 2.64Å; A101-C105 VanDerWaalsContact O-SG 3.35Å; I102-C105 WeakPolarHBondContact O-CB 3.33Å; I102-C105 PolarHBondContact O-N 3.06Å; C105-H107 VanDerWaalsContact C-N 3.31Å; C105-H107 PolarHBondContact O-N 3.32Å; C105-F108 WeakPolarHBondContact O-CB 3.48Å; C105-F108 PolarHBondContact O-N 3.01Å; C105-V109 WeakPolarHBondContact O-CG2 3.21Å; C105-V109 PolarHBondContact O-N 2.79Å; C105-V109 VanDerWaalsContact O-N 3.12Å
106	I	97.7	Very high	94.8	Very high	74 Å²	74	48.1 Å²	48.1	38%	0.379	26%	0.256	S	S	.	.	H	α-helix	trans	-61.7	-43.2	175.3	-64.8	165.9	0	0	0	110.1	I102 F108 V109 L110 Y130	I102-I106 HydrophobicContact CG2-CD1 4.06Å; I102-I106 WeakPolarHBondContact O-CG1 3.42Å; I102-I106 PolarHBondContact O-N 2.8Å; I106-F108 VanDerWaalsContact C-N 3.34Å; I106-F108 PolarHBondContact O-N 3.07Å; I106-V109 PolarHBondContact O-N 2.93Å; I106-L110 HydrophobicContact CG2-CD1 3.78Å; I106-L110 HydrophobicContact CG2-CG 4.14Å; I106-L110 WeakPolarHBondContact O-CG 3.46Å; I106-L110 PolarHBondContact O-N 2.88Å; I106-Y130 HydrophobicContact CB-CE2 4.2Å; I106-Y130 WeakPolarHBondContact CB-OH 3.44Å; I106-Y130 HydrophobicContact CG2-CD2 4.24Å; I106-Y130 HydrophobicContact CG2-CE2 3.45Å; I106-Y130 VanDerWaalsContact CG2-CE2 3.45Å
107	H	97.8	Very high	94.6	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-53.9	-50.1	173.7	170.7	55.7	0	0	0	111.7	F103 Y104 C105 V109 L110 F111 M127 Y130 W131 F237 P238 D337	F103-H107 WeakPolarHBondContact O-CB 3.37Å; F103-H107 PolarHBondContact O-N 3.46Å; Y104-H107 WeakPolarHBondContact O-CB 3.45Å; Y104-H107 PolarHBondContact O-N 3.43Å; C105-H107 VanDerWaalsContact C-N 3.31Å; C105-H107 PolarHBondContact O-N 3.32Å; H107-V109 VanDerWaalsContact C-N 3.32Å; H107-V109 PolarHBondContact O-N 3.13Å; H107-L110 PolarHBondContact O-N 2.7Å; H107-F111 AromaticContact CE1-CD2 3.74Å; H107-F111 AromaticContact CE1-CG 3.95Å; H107-F111 WeakPolarHBondContact O-CB 3.33Å; H107-F111 PolarHBondContact O-N 3.41Å; H107-M127 VanDerWaalsContact ND1-CE 3.33Å; H107-M127 WeakPolarHBondContact ND1-CE 3.21Å; H107-Y130 HydrophobicContact CB-CE1 3.78Å; H107-W131 AromaticContact CE1-CE2 3.93Å; H107-W131 AromaticContact CE1-CZ2 3.91Å; H107-W131 AromaticContact CE1-NE1 3.33Å; H107-W131 PolarHBondContact CE1-NE1 2.98Å; H107-W131 VanDerWaalsContact CE1-NE1 3.33Å; H107-W131 AromaticContact ND1-CD1 3.94Å; H107-W131 AromaticContact ND1-NE1 3.05Å; H107-W131 PolarHBondContact ND1-NE1 3.45Å; H107-F237 HydrophobicContact CB-CD1 3.85Å; H107-F237 HydrophobicContact CB-CE1 4.42Å; H107-F237 HydrophobicContact CB-CG 4.45Å; H107-F237 AromaticContact CG-CD1 3.98Å; H107-P238 VanDerWaalsContact NE2-CD 3.28Å; H107-P238 WeakPolarHBondContact NE2-CD 3.34Å; H107-P238 VanDerWaalsContact NE2-CG 3.28Å; H107-P238 WeakPolarHBondContact NE2-CG 3.29Å; H107-D337 IonicContact CD2-OD2 2.77Å; H107-D337 IonicContact CE1-OD2 2.79Å; H107-D337 IonicContact NE2-OD2 2.66Å; H107-D337 PolarHBondContact NE2-OD2 2.84Å
108	F	96.8	Very high	94.3	Very high	53 Å²	53	58.9 Å²	58.9	23%	0.232	31%	0.305	C	S	.	.	H	α-helix	trans	-56.5	-45.7	179.1	167	-106.7	0	0	0	111.8	Y104 C105 I106 N112 W264 F333 L336	Y104-F108 PolarHBondContact O-N 3.33Å; C105-F108 WeakPolarHBondContact O-CB 3.48Å; C105-F108 PolarHBondContact O-N 3.01Å; I106-F108 VanDerWaalsContact C-N 3.34Å; I106-F108 PolarHBondContact O-N 3.07Å; F108-N112 HydrophobicContact CD2-CB 4.49Å; F108-N112 WeakPolarHBondContact CD2-ND2 3.49Å; F108-N112 HydrophobicContact CE2-CB 4.24Å; F108-N112 WeakPolarHBondContact CE2-ND2 3.12Å; F108-N112 VanDerWaalsContact O-CB 3.28Å; F108-N112 WeakPolarHBondContact O-CB 3.2Å; F108-N112 PolarHBondContact O-N 3.35Å; F108-N112 PolarHBondContact O-ND2 3.06Å; F108-W264 HydrophobicContact CE2-CH2 4.05Å; F108-W264 HydrophobicContact CE2-CZ3 4.16Å; F108-W264 HydrophobicContact CZ-CH2 4.1Å; F108-W264 HydrophobicContact CZ-CZ3 4.22Å; F108-F333 HydrophobicContact CB-CD1 4.22Å; F108-F333 HydrophobicContact CB-CE1 4.4Å; F108-L336 HydrophobicContact CD2-CB 3.63Å; F108-L336 HydrophobicContact CD2-CD1 3.83Å; F108-L336 HydrophobicContact CD2-CG 4.22Å; F108-L336 HydrophobicContact CE2-CB 3.74Å; F108-L336 HydrophobicContact CE2-CD1 4.14Å; F108-L336 HydrophobicContact CE2-CD2 4.05Å; F108-L336 HydrophobicContact CE2-CG 4.21Å; F108-L336 HydrophobicContact CG-CD1 4.25Å
109	V	96.1	Very high	94.2	Very high	72 Å²	72	61.6 Å²	61.6	44%	0.436	31%	0.312	S	S	.	.	H	α-helix	trans	-64	-49.4	178.4	175.8	0	0	0	0	110.8	C105 I106 H107 F111 C113 C114	C105-V109 WeakPolarHBondContact O-CG2 3.21Å; C105-V109 PolarHBondContact O-N 2.79Å; C105-V109 VanDerWaalsContact O-N 3.12Å; I106-V109 PolarHBondContact O-N 2.93Å; H107-V109 VanDerWaalsContact C-N 3.32Å; H107-V109 PolarHBondContact O-N 3.13Å; V109-F111 PolarHBondContact O-N 3.32Å; V109-C113 HydrophobicContact CG1-CB 4.31Å; V109-C113 WeakPolarHBondContact O-CA 3.28Å; V109-C113 WeakPolarHBondContact O-CB 3.4Å; V109-C113 PolarHBondContact O-N 3.29Å; V109-C114 PolarHBondContact O-N 2.92Å
110	L	96.4	Very high	94	Very high	36 Å²	36	60.6 Å²	60.6	19%	0.188	31%	0.314	C	S	.	.	H	α-helix	trans	-64.1	-42.3	-179.9	-65.8	176.9	0	0	0	112.1	I106 H107 C114 W123 M127 Y130	I106-L110 HydrophobicContact CG2-CD1 3.78Å; I106-L110 HydrophobicContact CG2-CG 4.14Å; I106-L110 WeakPolarHBondContact O-CG 3.46Å; I106-L110 PolarHBondContact O-N 2.88Å; H107-L110 PolarHBondContact O-N 2.7Å; L110-C114 VanDerWaalsContact O-CB 3.29Å; L110-C114 WeakPolarHBondContact O-CB 3.48Å; L110-C114 PolarHBondContact O-N 3.05Å; L110-W123 PolarHBondContact O-NE1 2.72Å; L110-M127 VanDerWaalsContact C-SD 3.58Å; L110-M127 HydrophobicContact CB-CE 4.23Å; L110-M127 HydrophobicContact CB-SD 3.61Å; L110-Y130 HydrophobicContact CD1-CD1 3.9Å; L110-Y130 HydrophobicContact CD1-CD2 3.52Å; L110-Y130 HydrophobicContact CD1-CE1 4.37Å; L110-Y130 HydrophobicContact CD1-CE2 4.02Å; L110-Y130 HydrophobicContact CD1-CG 3.46Å; L110-Y130 VanDerWaalsContact CD1-CG 3.46Å
111	F	96	Very high	93.7	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-71	-38.6	-176.9	-166.6	-86.9	0	0	0	112.1	H107 V109 R115 W123 M127 W131 W232 Y236 M254 I257 D337	H107-F111 AromaticContact CE1-CD2 3.74Å; H107-F111 AromaticContact CE1-CG 3.95Å; H107-F111 WeakPolarHBondContact O-CB 3.33Å; H107-F111 PolarHBondContact O-N 3.41Å; V109-F111 PolarHBondContact O-N 3.32Å; F111-R115 VanDerWaalsContact O-CB 3.28Å; F111-R115 WeakPolarHBondContact O-CB 3.36Å; F111-W123 HydrophobicContact CD1-CZ2 4.27Å; F111-W123 HydrophobicContact CD2-CH2 4.28Å; F111-W123 AromaticContact CD2-CZ2 3.57Å; F111-W123 HydrophobicContact CD2-CZ2 3.57Å; F111-W123 HydrophobicContact CE1-CZ2 4.16Å; F111-W123 AromaticContact CE2-CH2 3.7Å; F111-W123 HydrophobicContact CE2-CH2 3.7Å; F111-W123 AromaticContact CE2-CZ2 3.47Å; F111-W123 HydrophobicContact CE2-CZ2 3.47Å; F111-W123 VanDerWaalsContact CE2-CZ2 3.47Å; F111-W123 HydrophobicContact CG-CZ2 4Å; F111-W123 AromaticContact CZ-CH2 3.84Å; F111-W123 HydrophobicContact CZ-CH2 3.84Å; F111-W123 AromaticContact CZ-CZ2 3.79Å; F111-W123 HydrophobicContact CZ-CZ2 3.79Å; F111-W123 PolarHBondContact O-NE1 3.39Å; F111-M127 HydrophobicContact CB-CE 4.01Å; F111-M127 HydrophobicContact CB-SD 4.22Å; F111-M127 HydrophobicContact CD2-CE 4.01Å; F111-M127 HydrophobicContact CD2-CG 4.43Å; F111-M127 HydrophobicContact CD2-SD 4.41Å; F111-W131 HydrophobicContact CD2-CZ2 4.07Å; F111-W131 HydrophobicContact CE2-CH2 4.49Å; F111-W131 HydrophobicContact CE2-CZ2 4.16Å; F111-W232 HydrophobicContact CE2-CZ2 4.45Å; F111-Y236 HydrophobicContact CE2-CD2 4.47Å; F111-Y236 HydrophobicContact CE2-CE2 4.06Å; F111-Y236 HydrophobicContact CZ-CE2 4.33Å; F111-M254 HydrophobicContact CZ-CE 4.42Å; F111-M254 HydrophobicContact CZ-SD 4.19Å; F111-I257 HydrophobicContact CE1-CD1 4.29Å; F111-I257 HydrophobicContact CZ-CD1 3.99Å; F111-D337 HydrophobicContact CD1-CB 3.71Å; F111-D337 VanDerWaalsContact CD1-CG 3.42Å; F111-D337 VanDerWaalsContact CD1-OD1 3.23Å; F111-D337 WeakPolarHBondContact CD1-OD1 3.38Å; F111-D337 HydrophobicContact CE1-CB 3.57Å; F111-D337 HydrophobicContact CZ-CB 4.33Å
112	N	93.8	Very high	93.5	Very high	15 Å²	15	68.1 Å²	68.1	8%	0.08	34%	0.342	C	S	.	.	H	α-helix	trans	-99.6	-36.1	-173.3	-67.4	-75.8	0	0	0	114.4	F108 R262 D337	F108-N112 HydrophobicContact CD2-CB 4.49Å; F108-N112 WeakPolarHBondContact CD2-ND2 3.49Å; F108-N112 HydrophobicContact CE2-CB 4.24Å; F108-N112 WeakPolarHBondContact CE2-ND2 3.12Å; F108-N112 VanDerWaalsContact O-CB 3.28Å; F108-N112 WeakPolarHBondContact O-CB 3.2Å; F108-N112 PolarHBondContact O-N 3.35Å; F108-N112 PolarHBondContact O-ND2 3.06Å; N112-R262 VanDerWaalsContact OD1-CZ 3.32Å; N112-R262 PolarHBondContact OD1-NH1 3Å; N112-R262 PolarHBondContact OD1-NH2 3.2Å; N112-D337 PolarHBondContact ND2-OD1 2.85Å
113	C	90.7	Very high	93.4	Very high	56 Å²	56	63.3 Å²	63.3	38%	0.378	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-52.4	-177.9	-55.2	0	0	0	0	110.7	V109 R115 N116 F117	V109-C113 HydrophobicContact CG1-CB 4.31Å; V109-C113 WeakPolarHBondContact O-CA 3.28Å; V109-C113 WeakPolarHBondContact O-CB 3.4Å; V109-C113 PolarHBondContact O-N 3.29Å; C113-R115 PolarHBondContact O-N 2.98Å; C113-N116 PolarHBondContact O-N 3.35Å; C113-F117 WeakPolarHBondContact O-CD2 3.49Å; C113-F117 WeakPolarHBondContact O-CE2 3.38Å
114	C	89.8	Confident	93.2	Very high	33 Å²	33	64.9 Å²	64.9	22%	0.223	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-66.2	-24.4	-176.6	-57.9	0	0	0	0	113.4	V109 L110 N116 F117 L118	V109-C114 PolarHBondContact O-N 2.92Å; L110-C114 VanDerWaalsContact O-CB 3.29Å; L110-C114 WeakPolarHBondContact O-CB 3.48Å; L110-C114 PolarHBondContact O-N 3.05Å; C114-N116 PolarHBondContact O-N 3.36Å; C114-F117 PolarHBondContact O-N 2.88Å; C114-F117 VanDerWaalsContact O-N 3.11Å; C114-L118 HydrophobicContact CB-CD1 4.03Å; C114-L118 WeakPolarHBondContact O-CB 3.2Å; C114-L118 WeakPolarHBondContact O-CG 3.47Å; C114-L118 PolarHBondContact O-N 3.06Å
115	R	86.4	Confident	93	Very high	46 Å²	46	67.3 Å²	67.3	17%	0.174	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-56.5	-31.5	175.8	-175.3	-179.3	-178.3	-155.8	16.6	113.7	F111 C113 W123 H258	F111-R115 VanDerWaalsContact O-CB 3.28Å; F111-R115 WeakPolarHBondContact O-CB 3.36Å; C113-R115 PolarHBondContact O-N 2.98Å; R115-W123 HydrophobicContact CB-CD2 4.32Å; R115-W123 HydrophobicContact CB-CG 4.3Å; R115-W123 HydrophobicContact CB-CZ2 4.44Å; R115-W123 HydrophobicContact CG-CD2 4.16Å; R115-W123 HydrophobicContact CG-CG 4.49Å; R115-W123 HydrophobicContact CG-CZ2 4.27Å; R115-H258 PolarHBondContact NE-CE1 2.85Å; R115-H258 PolarHBondContact NH2-CD2 2.87Å; R115-H258 PolarHBondContact NH2-CE1 3.41Å; R115-H258 VanDerWaalsContact NH2-CG 3.29Å; R115-H258 PolarHBondContact NH2-ND1 2.99Å; R115-H258 PolarHBondContact NH2-NE2 3.14Å
116	N	85.7	Confident	92.8	Very high	130 Å²	130	66.7 Å²	66.7	70%	0.695	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-82.3	-17	-178.6	-64.3	-23.5	0	0	0	113	C113 C114	C113-N116 PolarHBondContact O-N 3.35Å; C114-N116 PolarHBondContact O-N 3.36Å
117	F	89.4	Confident	92.8	Very high	175 Å²	175	63.2 Å²	63.2	77%	0.768	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	-21.3	-175.1	-57.8	-72.6	0	0	0	113.2	C113 C114	C113-F117 WeakPolarHBondContact O-CD2 3.49Å; C113-F117 WeakPolarHBondContact O-CE2 3.38Å; C114-F117 PolarHBondContact O-N 2.88Å; C114-F117 VanDerWaalsContact O-N 3.11Å
118	L	90.7	Very high	92.7	Very high	66 Å²	66	65.2 Å²	65.2	35%	0.346	33%	0.33	S	S	.	.	S	Bend	trans	-104.7	148.3	-177.1	-61.9	177.6	0	0	0	111.3	C114 V122 W123 V126	C114-L118 HydrophobicContact CB-CD1 4.03Å; C114-L118 WeakPolarHBondContact O-CB 3.2Å; C114-L118 WeakPolarHBondContact O-CG 3.47Å; C114-L118 PolarHBondContact O-N 3.06Å; L118-V122 HydrophobicContact CB-CB 4.46Å; L118-V122 HydrophobicContact CD1-CG1 4.37Å; L118-V122 HydrophobicContact CD2-CG1 4.23Å; L118-W123 HydrophobicContact CB-CB 4.04Å; L118-W123 HydrophobicContact CD1-CB 4.49Å; L118-V126 HydrophobicContact CD1-CG2 4.32Å
119	R	91.8	Very high	92.7	Very high	176 Å²	176	70.1 Å²	70.1	66%	0.664	35%	0.352	S	S	*	.			trans	-61.2	145.6	166.2	-65.3	-178.9	175.3	-173.2	-3.5	109.5	Y121 V122 W123	R119-Y121 VanDerWaalsContact C-N 3.29Å; R119-Y121 HydrophobicContact CB-CD1 3.97Å; R119-Y121 HydrophobicContact CB-CE1 3.58Å; R119-Y121 WeakPolarHBondContact CD-OH 3.36Å; R119-Y121 HydrophobicContact CG-CE1 4.22Å; R119-Y121 PolarHBondContact NH1-OH 2.82Å; R119-Y121 PolarHBondContact O-N 2.88Å; R119-Y121 VanDerWaalsContact O-N 3.13Å; R119-V122 HydrophobicContact CB-CG2 4.27Å; R119-V122 WeakPolarHBondContact O-CB 3.4Å; R119-V122 PolarHBondContact O-N 3.45Å; R119-W123 PolarHBondContact O-N 3.23Å
120	T	90	Very high	92.7	Very high	88 Å²	88	67.7 Å²	67.7	54%	0.54	34%	0.335	S	S	.	.	H	α-helix	trans	-50.4	-44.1	-173	-50.8	0	0	0	0	113.8	W123 Q124	T120-W123 PolarHBondContact O-N 3.35Å; T120-Q124 WeakPolarHBondContact O-CG 3.48Å; T120-Q124 PolarHBondContact O-N 3.45Å
121	Y	89.7	Confident	92.8	Very high	139 Å²	139	66 Å²	66	55%	0.545	33%	0.326	S	S	.	.	H	α-helix	trans	-68.5	-36.2	179.9	66.1	-91.8	0	0	0	113	R119 A125	R119-Y121 VanDerWaalsContact C-N 3.29Å; R119-Y121 HydrophobicContact CB-CD1 3.97Å; R119-Y121 HydrophobicContact CB-CE1 3.58Å; R119-Y121 WeakPolarHBondContact CD-OH 3.36Å; R119-Y121 HydrophobicContact CG-CE1 4.22Å; R119-Y121 PolarHBondContact NH1-OH 2.82Å; R119-Y121 PolarHBondContact O-N 2.88Å; R119-Y121 VanDerWaalsContact O-N 3.13Å; Y121-A125 WeakPolarHBondContact O-CB 3.22Å; Y121-A125 PolarHBondContact O-N 3.35Å
122	V	93.5	Very high	92.7	Very high	51 Å²	51	69 Å²	69	31%	0.309	34%	0.339	S	S	.	.	H	α-helix	trans	-68.4	-45.1	176.1	-177.1	0	0	0	0	109.5	L118 R119 Q124 A125 V126	L118-V122 HydrophobicContact CB-CB 4.46Å; L118-V122 HydrophobicContact CD1-CG1 4.37Å; L118-V122 HydrophobicContact CD2-CG1 4.23Å; R119-V122 HydrophobicContact CB-CG2 4.27Å; R119-V122 WeakPolarHBondContact O-CB 3.4Å; R119-V122 PolarHBondContact O-N 3.45Å; V122-Q124 PolarHBondContact O-N 2.84Å; V122-A125 PolarHBondContact O-N 3.28Å; V122-V126 HydrophobicContact CG1-CG2 4.37Å; V122-V126 VanDerWaalsContact O-CG2 3.32Å; V122-V126 WeakPolarHBondContact O-CG2 3.48Å; V122-V126 PolarHBondContact O-N 2.92Å
123	W	94.5	Very high	92.8	Very high	11 Å²	11	72.8 Å²	72.8	4%	0.042	36%	0.355	C	S	.	.	H	α-helix	trans	-57.5	-47.6	175.6	170.9	70.8	0	0	0	111.6	L110 F111 R115 L118 R119 T120 A125 V126 M127 W232	L110-W123 PolarHBondContact O-NE1 2.72Å; F111-W123 HydrophobicContact CD1-CZ2 4.27Å; F111-W123 HydrophobicContact CD2-CH2 4.28Å; F111-W123 AromaticContact CD2-CZ2 3.57Å; F111-W123 HydrophobicContact CD2-CZ2 3.57Å; F111-W123 HydrophobicContact CE1-CZ2 4.16Å; F111-W123 AromaticContact CE2-CH2 3.7Å; F111-W123 HydrophobicContact CE2-CH2 3.7Å; F111-W123 AromaticContact CE2-CZ2 3.47Å; F111-W123 HydrophobicContact CE2-CZ2 3.47Å; F111-W123 VanDerWaalsContact CE2-CZ2 3.47Å; F111-W123 HydrophobicContact CG-CZ2 4Å; F111-W123 AromaticContact CZ-CH2 3.84Å; F111-W123 HydrophobicContact CZ-CH2 3.84Å; F111-W123 AromaticContact CZ-CZ2 3.79Å; F111-W123 HydrophobicContact CZ-CZ2 3.79Å; F111-W123 PolarHBondContact O-NE1 3.39Å; R115-W123 HydrophobicContact CB-CD2 4.32Å; R115-W123 HydrophobicContact CB-CG 4.3Å; R115-W123 HydrophobicContact CB-CZ2 4.44Å; R115-W123 HydrophobicContact CG-CD2 4.16Å; R115-W123 HydrophobicContact CG-CG 4.49Å; R115-W123 HydrophobicContact CG-CZ2 4.27Å; L118-W123 HydrophobicContact CB-CB 4.04Å; L118-W123 HydrophobicContact CD1-CB 4.49Å; R119-W123 PolarHBondContact O-N 3.23Å; T120-W123 PolarHBondContact O-N 3.35Å; W123-A125 PolarHBondContact O-N 3.09Å; W123-V126 PolarHBondContact O-N 3.21Å; W123-M127 HydrophobicContact CD2-CG 4.36Å; W123-M127 HydrophobicContact CG-CG 4.49Å; W123-M127 HydrophobicContact CZ2-CG 4.26Å; W123-M127 WeakPolarHBondContact O-CB 3.45Å; W123-M127 VanDerWaalsContact O-CG 3.3Å; W123-M127 WeakPolarHBondContact O-CG 3.15Å; W123-M127 PolarHBondContact O-N 3.44Å; W123-W232 HydrophobicContact CE3-CH2 4.46Å; W123-W232 AromaticContact CH2-CH2 3.86Å; W123-W232 HydrophobicContact CH2-CH2 3.86Å; W123-W232 AromaticContact CH2-CZ2 3.88Å; W123-W232 HydrophobicContact CH2-CZ2 3.88Å; W123-W232 HydrophobicContact CZ2-CH2 4.4Å; W123-W232 AromaticContact CZ3-CH2 3.88Å; W123-W232 HydrophobicContact CZ3-CH2 3.88Å; W123-W232 AromaticContact CZ3-CZ2 3.99Å; W123-W232 HydrophobicContact CZ3-CZ2 3.99Å
124	Q	93.8	Very high	93.1	Very high	72 Å²	72	70.1 Å²	70.1	34%	0.336	34%	0.337	S	S	.	.	H	α-helix	trans	-59.7	-44.6	176.8	-75.6	174	-25.6	0	0	112.3	T120 V122 M127 M128 W232	T120-Q124 WeakPolarHBondContact O-CG 3.48Å; T120-Q124 PolarHBondContact O-N 3.45Å; V122-Q124 PolarHBondContact O-N 2.84Å; Q124-M127 PolarHBondContact O-N 3.15Å; Q124-M128 WeakPolarHBondContact O-CG 3.31Å; Q124-M128 PolarHBondContact O-N 2.91Å; Q124-W232 HydrophobicContact CB-CE3 4.45Å; Q124-W232 HydrophobicContact CB-CH2 4.36Å; Q124-W232 HydrophobicContact CB-CZ3 3.94Å; Q124-W232 HydrophobicContact CG-CE3 4.44Å; Q124-W232 HydrophobicContact CG-CH2 3.89Å; Q124-W232 HydrophobicContact CG-CZ2 4.37Å; Q124-W232 HydrophobicContact CG-CZ3 3.93Å
125	A	93.7	Very high	93.4	Very high	52 Å²	52	68.6 Å²	68.6	43%	0.43	33%	0.327	S	S	.	.	H	α-helix	trans	-62.4	-45.2	177.7	0	0	0	0	0	112.3	Y121 V122 W123 M127 M128 F129	Y121-A125 WeakPolarHBondContact O-CB 3.22Å; Y121-A125 PolarHBondContact O-N 3.35Å; V122-A125 PolarHBondContact O-N 3.28Å; W123-A125 PolarHBondContact O-N 3.09Å; A125-M127 VanDerWaalsContact C-N 3.35Å; A125-M127 PolarHBondContact O-N 2.94Å; A125-M128 PolarHBondContact O-N 2.74Å; A125-F129 WeakPolarHBondContact O-CB 3.48Å; A125-F129 PolarHBondContact O-N 2.81Å
126	V	95.3	Very high	93.7	Very high	56 Å²	56	69.2 Å²	69.2	34%	0.339	33%	0.331	S	S	.	.	H	α-helix	trans	-59.9	-45.3	175.9	169.7	0	0	0	0	110.9	L118 V122 W123 F129 Y130	L118-V126 HydrophobicContact CD1-CG2 4.32Å; V122-V126 HydrophobicContact CG1-CG2 4.37Å; V122-V126 VanDerWaalsContact O-CG2 3.32Å; V122-V126 WeakPolarHBondContact O-CG2 3.48Å; V122-V126 PolarHBondContact O-N 2.92Å; W123-V126 PolarHBondContact O-N 3.21Å; V126-F129 PolarHBondContact O-N 2.94Å; V126-Y130 VanDerWaalsContact O-CB 3.28Å; V126-Y130 WeakPolarHBondContact O-CB 3.35Å; V126-Y130 PolarHBondContact O-N 2.95Å
127	M	97.1	Very high	94.1	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-64	-45.2	178.8	-70.7	-49.9	-49.1	0	0	112.2	H107 L110 F111 W123 Q124 A125 Y130 W131 W232	H107-M127 VanDerWaalsContact ND1-CE 3.33Å; H107-M127 WeakPolarHBondContact ND1-CE 3.21Å; L110-M127 VanDerWaalsContact C-SD 3.58Å; L110-M127 HydrophobicContact CB-CE 4.23Å; L110-M127 HydrophobicContact CB-SD 3.61Å; F111-M127 HydrophobicContact CB-CE 4.01Å; F111-M127 HydrophobicContact CB-SD 4.22Å; F111-M127 HydrophobicContact CD2-CE 4.01Å; F111-M127 HydrophobicContact CD2-CG 4.43Å; F111-M127 HydrophobicContact CD2-SD 4.41Å; W123-M127 HydrophobicContact CD2-CG 4.36Å; W123-M127 HydrophobicContact CG-CG 4.49Å; W123-M127 HydrophobicContact CZ2-CG 4.26Å; W123-M127 WeakPolarHBondContact O-CB 3.45Å; W123-M127 VanDerWaalsContact O-CG 3.3Å; W123-M127 WeakPolarHBondContact O-CG 3.15Å; W123-M127 PolarHBondContact O-N 3.44Å; Q124-M127 PolarHBondContact O-N 3.15Å; A125-M127 VanDerWaalsContact C-N 3.35Å; A125-M127 PolarHBondContact O-N 2.94Å; M127-Y130 HydrophobicContact CE-CD1 4.26Å; M127-Y130 PolarHBondContact O-N 3.19Å; M127-W131 HydrophobicContact CB-CH2 4.34Å; M127-W131 HydrophobicContact CB-CZ2 4.12Å; M127-W131 HydrophobicContact CE-CZ2 3.84Å; M127-W131 WeakPolarHBondContact O-CB 3.26Å; M127-W131 PolarHBondContact O-N 3.48Å; M127-W232 HydrophobicContact CB-CH2 4.02Å; M127-W232 HydrophobicContact CB-CZ3 3.81Å; M127-W232 HydrophobicContact CG-CH2 4.37Å
128	M	95.7	Very high	94.3	Very high	43 Å²	43	60.1 Å²	60.1	21%	0.212	29%	0.287	C	S	.	.	H	α-helix	trans	-62	-45.3	177.7	-73	-173.9	-67	0	0	111.9	Q124 A125 Y130 W131 F132 V228 L231 W232	Q124-M128 WeakPolarHBondContact O-CG 3.31Å; Q124-M128 PolarHBondContact O-N 2.91Å; A125-M128 PolarHBondContact O-N 2.74Å; M128-Y130 VanDerWaalsContact C-N 3.34Å; M128-Y130 PolarHBondContact O-N 3.01Å; M128-W131 PolarHBondContact O-N 3.46Å; M128-F132 WeakPolarHBondContact O-CB 3.27Å; M128-F132 PolarHBondContact O-N 3.33Å; M128-V228 HydrophobicContact CE-CG1 4.18Å; M128-V228 HydrophobicContact SD-CG1 4.19Å; M128-L231 HydrophobicContact SD-CB 4.4Å; M128-W232 HydrophobicContact CG-CE3 3.62Å; M128-W232 HydrophobicContact CG-CZ3 4.04Å; M128-W232 HydrophobicContact SD-CE3 4.18Å
129	F	95.8	Very high	94.4	Very high	156 Å²	156	57.3 Å²	57.3	68%	0.684	27%	0.272	S	S	*	.	H	α-helix	trans	-59.5	-47.7	176	178.2	-95.9	0	0	0	111.1	A125 V126 W131 F132 F133	A125-F129 WeakPolarHBondContact O-CB 3.48Å; A125-F129 PolarHBondContact O-N 2.81Å; V126-F129 PolarHBondContact O-N 2.94Å; F129-W131 PolarHBondContact O-N 3.35Å; F129-F132 PolarHBondContact O-N 2.97Å; F129-F133 WeakPolarHBondContact O-CB 3.44Å; F129-F133 PolarHBondContact O-N 3.41Å
130	Y	97.4	Very high	94.3	Very high	20 Å²	20	50.5 Å²	50.5	8%	0.078	25%	0.251	C	S	.	.	H	α-helix	trans	-60.1	-46.5	177.7	170.8	-100.2	0	0	0	112.2	F103 I106 H107 L110 V126 M127 M128 F132 F133 A134	F103-Y130 VanDerWaalsContact C-OH 3.29Å; F103-Y130 VanDerWaalsContact CA-OH 3.27Å; F103-Y130 WeakPolarHBondContact CA-OH 3.22Å; F103-Y130 PolarHBondContact O-OH 3.45Å; I106-Y130 HydrophobicContact CB-CE2 4.2Å; I106-Y130 WeakPolarHBondContact CB-OH 3.44Å; I106-Y130 HydrophobicContact CG2-CD2 4.24Å; I106-Y130 HydrophobicContact CG2-CE2 3.45Å; I106-Y130 VanDerWaalsContact CG2-CE2 3.45Å; H107-Y130 HydrophobicContact CB-CE1 3.78Å; L110-Y130 HydrophobicContact CD1-CD1 3.9Å; L110-Y130 HydrophobicContact CD1-CD2 3.52Å; L110-Y130 HydrophobicContact CD1-CE1 4.37Å; L110-Y130 HydrophobicContact CD1-CE2 4.02Å; L110-Y130 HydrophobicContact CD1-CG 3.46Å; L110-Y130 VanDerWaalsContact CD1-CG 3.46Å; V126-Y130 VanDerWaalsContact O-CB 3.28Å; V126-Y130 WeakPolarHBondContact O-CB 3.35Å; V126-Y130 PolarHBondContact O-N 2.95Å; M127-Y130 HydrophobicContact CE-CD1 4.26Å; M127-Y130 PolarHBondContact O-N 3.19Å; M128-Y130 VanDerWaalsContact C-N 3.34Å; M128-Y130 PolarHBondContact O-N 3.01Å; Y130-F132 VanDerWaalsContact C-N 3.34Å; Y130-F132 PolarHBondContact O-N 2.64Å; Y130-F133 PolarHBondContact O-N 3.22Å; Y130-A134 HydrophobicContact CE1-CB 4.32Å; Y130-A134 HydrophobicContact CE2-CB 4.42Å; Y130-A134 VanDerWaalsContact O-CB 3.28Å; Y130-A134 WeakPolarHBondContact O-CB 3.49Å; Y130-A134 PolarHBondContact O-N 3.5Å
131	W	97.3	Very high	94.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.2	-42	-179.9	-66.2	-24.5	0	0	0	112.2	H107 F111 M127 M128 F129 A134 C135 W232 Y235 Y236 F237	H107-W131 AromaticContact CE1-CE2 3.93Å; H107-W131 AromaticContact CE1-CZ2 3.91Å; H107-W131 AromaticContact CE1-NE1 3.33Å; H107-W131 PolarHBondContact CE1-NE1 2.98Å; H107-W131 VanDerWaalsContact CE1-NE1 3.33Å; H107-W131 AromaticContact ND1-CD1 3.94Å; H107-W131 AromaticContact ND1-NE1 3.05Å; H107-W131 PolarHBondContact ND1-NE1 3.45Å; F111-W131 HydrophobicContact CD2-CZ2 4.07Å; F111-W131 HydrophobicContact CE2-CH2 4.49Å; F111-W131 HydrophobicContact CE2-CZ2 4.16Å; M127-W131 HydrophobicContact CB-CH2 4.34Å; M127-W131 HydrophobicContact CB-CZ2 4.12Å; M127-W131 HydrophobicContact CE-CZ2 3.84Å; M127-W131 WeakPolarHBondContact O-CB 3.26Å; M127-W131 PolarHBondContact O-N 3.48Å; M128-W131 PolarHBondContact O-N 3.46Å; F129-W131 PolarHBondContact O-N 3.35Å; W131-A134 PolarHBondContact O-N 3.41Å; W131-C135 PolarHBondContact O-N 3.2Å; W131-C135 PolarHBondContact O-SG 3.42Å; W131-W232 HydrophobicContact CE3-CE3 4.47Å; W131-W232 HydrophobicContact CH2-CD2 4.08Å; W131-W232 AromaticContact CH2-CE3 3.85Å; W131-W232 HydrophobicContact CH2-CE3 3.85Å; W131-W232 AromaticContact CH2-CH2 3.53Å; W131-W232 HydrophobicContact CH2-CH2 3.53Å; W131-W232 AromaticContact CH2-CZ2 3.79Å; W131-W232 HydrophobicContact CH2-CZ2 3.79Å; W131-W232 AromaticContact CH2-CZ3 3.56Å; W131-W232 HydrophobicContact CH2-CZ3 3.56Å; W131-W232 HydrophobicContact CZ2-CH2 4.38Å; W131-W232 AromaticContact CZ3-CD2 3.85Å; W131-W232 HydrophobicContact CZ3-CD2 3.85Å; W131-W232 AromaticContact CZ3-CE3 3.46Å; W131-W232 HydrophobicContact CZ3-CE3 3.46Å; W131-W232 VanDerWaalsContact CZ3-CE3 3.46Å; W131-W232 HydrophobicContact CZ3-CH2 4.04Å; W131-W232 HydrophobicContact CZ3-CZ2 4.38Å; W131-W232 AromaticContact CZ3-CZ3 3.56Å; W131-W232 HydrophobicContact CZ3-CZ3 3.56Å; W131-Y235 VanDerWaalsContact CB-O 3.28Å; W131-Y235 WeakPolarHBondContact CB-O 3.33Å; W131-Y236 AromaticContact CH2-CD2 3.67Å; W131-Y236 HydrophobicContact CH2-CD2 3.67Å; W131-Y236 HydrophobicContact CH2-CG 4.37Å; W131-Y236 AromaticContact CZ2-CD2 3.62Å; W131-Y236 HydrophobicContact CZ2-CD2 3.62Å; W131-Y236 HydrophobicContact CZ2-CE2 4.38Å; W131-F237 HydrophobicContact CG-CB 4.25Å
132	F	94.4	Very high	94.4	Very high	65 Å²	65	46.5 Å²	46.5	29%	0.285	25%	0.245	S	C	.	.	H	α-helix	trans	-62.3	-50	175.3	-162.8	-108.3	0	0	0	110.3	M128 F129 Y130 A134 C135 F136 V144 F148 Y235	M128-F132 WeakPolarHBondContact O-CB 3.27Å; M128-F132 PolarHBondContact O-N 3.33Å; F129-F132 PolarHBondContact O-N 2.97Å; Y130-F132 VanDerWaalsContact C-N 3.34Å; Y130-F132 PolarHBondContact O-N 2.64Å; F132-A134 PolarHBondContact O-N 3.49Å; F132-C135 WeakPolarHBondContact O-CB 3.4Å; F132-C135 PolarHBondContact O-N 2.9Å; F132-C135 VanDerWaalsContact O-N 3.13Å; F132-F136 AromaticContact CD1-CD2 3.9Å; F132-F136 HydrophobicContact CD1-CD2 3.9Å; F132-F136 AromaticContact CD1-CE2 3.65Å; F132-F136 HydrophobicContact CD1-CE2 3.65Å; F132-F136 HydrophobicContact CD2-CE2 4.4Å; F132-F136 AromaticContact CE1-CD2 3.89Å; F132-F136 HydrophobicContact CE1-CD2 3.89Å; F132-F136 AromaticContact CE1-CE2 3.14Å; F132-F136 HydrophobicContact CE1-CE2 3.14Å; F132-F136 AromaticContact CE1-CZ 3.85Å; F132-F136 HydrophobicContact CE1-CZ 3.85Å; F132-F136 AromaticContact CE2-CE2 3.98Å; F132-F136 HydrophobicContact CE2-CE2 3.98Å; F132-F136 HydrophobicContact CG-CD2 4.39Å; F132-F136 HydrophobicContact CG-CE2 4.27Å; F132-F136 HydrophobicContact CZ-CD2 4.34Å; F132-F136 AromaticContact CZ-CE2 3.36Å; F132-F136 HydrophobicContact CZ-CE2 3.36Å; F132-F136 HydrophobicContact CZ-CZ 4.03Å; F132-F136 WeakPolarHBondContact O-CD2 3.01Å; F132-F136 PolarHBondContact O-N 3.47Å; F132-V144 HydrophobicContact CD2-CG1 4.38Å; F132-V144 HydrophobicContact CE2-CG1 4.07Å; F132-F148 HydrophobicContact CE2-CB 4.35Å; F132-F148 AromaticContact CE2-CD2 3.75Å; F132-F148 HydrophobicContact CE2-CD2 3.75Å; F132-F148 HydrophobicContact CE2-CE2 4.3Å; F132-F148 HydrophobicContact CE2-CG 4.2Å; F132-F148 HydrophobicContact CZ-CD2 4.31Å; F132-F148 HydrophobicContact CZ-CG 4.48Å; F132-Y235 HydrophobicContact CD2-CE1 4.06Å; F132-Y235 HydrophobicContact CD2-CE2 4.38Å; F132-Y235 AromaticContact CD2-CZ 3.99Å; F132-Y235 HydrophobicContact CE2-CE1 4.48Å
133	F	95.9	Very high	94.3	Very high	94 Å²	94	44.8 Å²	44.8	41%	0.412	23%	0.234	S	C	.	.	H	α-helix	trans	-57.2	-46.2	175.9	177	-99.3	0	0	0	112.7	F129 Y130 C135 F136 Q137	F129-F133 WeakPolarHBondContact O-CB 3.44Å; F129-F133 PolarHBondContact O-N 3.41Å; Y130-F133 PolarHBondContact O-N 3.22Å; F133-C135 VanDerWaalsContact C-N 3.29Å; F133-C135 PolarHBondContact O-N 3.05Å; F133-F136 WeakPolarHBondContact O-CB 3.33Å; F133-F136 PolarHBondContact O-N 3.48Å; F133-F136 VanDerWaalsContact O-N 3.12Å; F133-Q137 HydrophobicContact CD1-CG 4.38Å; F133-Q137 HydrophobicContact CE1-CG 3.91Å; F133-Q137 HydrophobicContact CE2-CG 4.29Å; F133-Q137 HydrophobicContact CZ-CG 3.86Å; F133-Q137 WeakPolarHBondContact O-CG 3.26Å; F133-Q137 PolarHBondContact O-N 3.4Å; F133-Q137 VanDerWaalsContact O-N 3.11Å
134	A	97	Very high	94.3	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.4	-37.2	177.7	0	0	0	0	0	111.8	F103 Y130 W131 F132 Q137 L138 F237	F103-A134 HydrophobicContact CB-CB 4.49Å; F103-A134 HydrophobicContact CD1-CB 3.72Å; F103-A134 HydrophobicContact CE1-CB 4.4Å; F103-A134 HydrophobicContact CG-CB 4.44Å; Y130-A134 HydrophobicContact CE1-CB 4.32Å; Y130-A134 HydrophobicContact CE2-CB 4.42Å; Y130-A134 VanDerWaalsContact O-CB 3.28Å; Y130-A134 WeakPolarHBondContact O-CB 3.49Å; Y130-A134 PolarHBondContact O-N 3.5Å; W131-A134 PolarHBondContact O-N 3.41Å; F132-A134 PolarHBondContact O-N 3.49Å; A134-Q137 PolarHBondContact O-N 2.97Å; A134-L138 WeakPolarHBondContact O-CB 3.17Å; A134-L138 WeakPolarHBondContact O-CG 3.39Å; A134-L138 PolarHBondContact O-N 3.42Å; A134-F237 HydrophobicContact CB-CD2 4.26Å; A134-F237 HydrophobicContact CB-CE2 3.52Å; A134-F237 HydrophobicContact CB-CZ 4.06Å
135	C	95.6	Very high	94.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.1	-43.1	172.6	-69	0	0	0	0	111.6	W131 F132 F133 Q137 L138 F139 V144 F196 Q240	W131-C135 PolarHBondContact O-N 3.2Å; W131-C135 PolarHBondContact O-SG 3.42Å; F132-C135 WeakPolarHBondContact O-CB 3.4Å; F132-C135 PolarHBondContact O-N 2.9Å; F132-C135 VanDerWaalsContact O-N 3.13Å; F133-C135 VanDerWaalsContact C-N 3.29Å; F133-C135 PolarHBondContact O-N 3.05Å; C135-Q137 PolarHBondContact O-N 3.4Å; C135-L138 PolarHBondContact O-N 2.82Å; C135-F139 HydrophobicContact CB-CD2 4.32Å; C135-F139 WeakPolarHBondContact O-CB 3.3Å; C135-F139 WeakPolarHBondContact O-CD2 3.3Å; C135-F139 PolarHBondContact O-N 3.13Å; C135-V144 HydrophobicContact CB-CG1 4.04Å; C135-V144 HydrophobicContact CB-CG2 3.96Å; C135-V144 WeakPolarHBondContact O-CG2 3.28Å; C135-F196 HydrophobicContact CB-CZ 4.25Å; C135-Q240 PolarHBondContact SG-OE1 3.38Å; C135-Q240 VanDerWaalsContact SG-OE1 3.33Å
136	F	94.2	Very high	94.3	Very high	60 Å²	60	43.1 Å²	43.1	26%	0.263	23%	0.229	S	C	.	.	H	α-helix	trans	-61.2	-29	176.8	-93.2	-100.8	0	0	0	113.7	F132 F133 F139 P141 V144	F132-F136 AromaticContact CD1-CD2 3.9Å; F132-F136 HydrophobicContact CD1-CD2 3.9Å; F132-F136 AromaticContact CD1-CE2 3.65Å; F132-F136 HydrophobicContact CD1-CE2 3.65Å; F132-F136 HydrophobicContact CD2-CE2 4.4Å; F132-F136 AromaticContact CE1-CD2 3.89Å; F132-F136 HydrophobicContact CE1-CD2 3.89Å; F132-F136 AromaticContact CE1-CE2 3.14Å; F132-F136 HydrophobicContact CE1-CE2 3.14Å; F132-F136 AromaticContact CE1-CZ 3.85Å; F132-F136 HydrophobicContact CE1-CZ 3.85Å; F132-F136 AromaticContact CE2-CE2 3.98Å; F132-F136 HydrophobicContact CE2-CE2 3.98Å; F132-F136 HydrophobicContact CG-CD2 4.39Å; F132-F136 HydrophobicContact CG-CE2 4.27Å; F132-F136 HydrophobicContact CZ-CD2 4.34Å; F132-F136 AromaticContact CZ-CE2 3.36Å; F132-F136 HydrophobicContact CZ-CE2 3.36Å; F132-F136 HydrophobicContact CZ-CZ 4.03Å; F132-F136 WeakPolarHBondContact O-CD2 3.01Å; F132-F136 PolarHBondContact O-N 3.47Å; F133-F136 WeakPolarHBondContact O-CB 3.33Å; F133-F136 PolarHBondContact O-N 3.48Å; F133-F136 VanDerWaalsContact O-N 3.12Å; F136-F139 CarbonylContact C-O 3.46Å; F136-P141 HydrophobicContact CD1-CB 3.61Å; F136-P141 HydrophobicContact CD1-CG 4.08Å; F136-P141 HydrophobicContact CE1-CB 3.75Å; F136-V144 HydrophobicContact CD2-CB 3.97Å; F136-V144 HydrophobicContact CD2-CG1 3.61Å; F136-V144 HydrophobicContact CD2-CG2 4.43Å; F136-V144 HydrophobicContact CE2-CB 3.78Å; F136-V144 HydrophobicContact CE2-CG1 3.38Å; F136-V144 HydrophobicContact CZ-CB 4.25Å; F136-V144 HydrophobicContact CZ-CG1 4.26Å
137	Q	94	Very high	94.3	Very high	112 Å²	112	40.5 Å²	40.5	52%	0.523	21%	0.212	S	C	.	.	H	α-helix	trans	-84.9	-37.4	178	-64.1	-60.7	-35.2	0	0	112.6	F103 F133 A134 C135	F103-Q137 HydrophobicContact CE1-CB 3.81Å; F103-Q137 HydrophobicContact CE1-CG 4.11Å; F103-Q137 HydrophobicContact CZ-CB 3.59Å; F103-Q137 HydrophobicContact CZ-CG 4.16Å; F133-Q137 HydrophobicContact CD1-CG 4.38Å; F133-Q137 HydrophobicContact CE1-CG 3.91Å; F133-Q137 HydrophobicContact CE2-CG 4.29Å; F133-Q137 HydrophobicContact CZ-CG 3.86Å; F133-Q137 WeakPolarHBondContact O-CG 3.26Å; F133-Q137 PolarHBondContact O-N 3.4Å; F133-Q137 VanDerWaalsContact O-N 3.11Å; A134-Q137 PolarHBondContact O-N 2.97Å; C135-Q137 PolarHBondContact O-N 3.4Å
138	L	94	Very high	94.2	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-84.7	-28.5	-175.9	-70.2	176.6	0	0	0	113.8	Q99 A100 F103 A134 C135 F237	Q99-L138 HydrophobicContact CB-CD2 4.38Å; A100-L138 HydrophobicContact CB-CD1 3.95Å; A100-L138 HydrophobicContact CB-CD2 3.99Å; F103-L138 HydrophobicContact CB-CD1 4.15Å; F103-L138 HydrophobicContact CD2-CD1 4.15Å; F103-L138 HydrophobicContact CD2-CD2 3.63Å; F103-L138 HydrophobicContact CD2-CG 3.96Å; F103-L138 HydrophobicContact CE2-CD2 3.74Å; F103-L138 HydrophobicContact CE2-CG 4.17Å; F103-L138 HydrophobicContact CG-CD1 4.15Å; F103-L138 HydrophobicContact CG-CD2 4.42Å; F103-L138 HydrophobicContact CG-CG 4.29Å; A134-L138 WeakPolarHBondContact O-CB 3.17Å; A134-L138 WeakPolarHBondContact O-CG 3.39Å; A134-L138 PolarHBondContact O-N 3.42Å; C135-L138 PolarHBondContact O-N 2.82Å; L138-F237 HydrophobicContact CD1-CE2 4.09Å; L138-F237 HydrophobicContact CD1-CZ 3.65Å
139	F	92.8	Very high	94.3	Very high	7 Å²	7	46.5 Å²	46.5	3%	0.031	24%	0.24	C	C	.	.	S	Bend	trans	-119.9	161.9	179.2	-54.1	-85	0	0	0	109	W96 C135 F136 V144 K192 F196 L241	W96-F139 HydrophobicContact CZ2-CE2 4.47Å; W96-F139 AromaticContact CZ2-CZ 3.82Å; W96-F139 HydrophobicContact CZ2-CZ 3.82Å; W96-F139 AromaticContact NE1-CZ 3.93Å; C135-F139 HydrophobicContact CB-CD2 4.32Å; C135-F139 WeakPolarHBondContact O-CB 3.3Å; C135-F139 WeakPolarHBondContact O-CD2 3.3Å; C135-F139 PolarHBondContact O-N 3.13Å; F136-F139 CarbonylContact C-O 3.46Å; F139-V144 HydrophobicContact CB-CG2 4Å; F139-K192 HydrophobicContact CD1-CB 4.05Å; F139-K192 HydrophobicContact CE1-CB 4.49Å; F139-F196 HydrophobicContact CD1-CB 3.78Å; F139-F196 AromaticContact CD1-CD2 3.84Å; F139-F196 HydrophobicContact CD1-CD2 3.84Å; F139-F196 AromaticContact CD1-CG 3.93Å; F139-F196 HydrophobicContact CD1-CG 3.93Å; F139-F196 AromaticContact CD2-CD2 3.76Å; F139-F196 HydrophobicContact CD2-CD2 3.76Å; F139-F196 AromaticContact CD2-CE2 3.76Å; F139-F196 HydrophobicContact CD2-CE2 3.76Å; F139-F196 HydrophobicContact CD2-CG 4.42Å; F139-F196 HydrophobicContact CD2-CZ 4.42Å; F139-F196 HydrophobicContact CE1-CB 3.86Å; F139-F196 AromaticContact CE1-CD2 3.67Å; F139-F196 HydrophobicContact CE1-CD2 3.67Å; F139-F196 HydrophobicContact CE1-CG 4.09Å; F139-F196 AromaticContact CE2-CD2 3.58Å; F139-F196 HydrophobicContact CE2-CD2 3.58Å; F139-F196 AromaticContact CE2-CE2 3.67Å; F139-F196 HydrophobicContact CE2-CE2 3.67Å; F139-F196 HydrophobicContact CG-CB 4.44Å; F139-F196 AromaticContact CG-CD2 3.9Å; F139-F196 HydrophobicContact CG-CD2 3.9Å; F139-F196 HydrophobicContact CG-CE2 4.27Å; F139-F196 HydrophobicContact CG-CG 4.12Å; F139-F196 AromaticContact CZ-CD2 3.55Å; F139-F196 HydrophobicContact CZ-CD2 3.55Å; F139-F196 HydrophobicContact CZ-CE2 4.11Å; F139-F196 HydrophobicContact CZ-CG 4.4Å; F139-L241 HydrophobicContact CZ-CD2 4.4Å
140	S	88.3	Confident	94.2	Very high	33 Å²	33	41.1 Å²	41.1	23%	0.231	22%	0.219	C	C	.	.			trans	-61.9	135.1	176.8	179.5	0	0	0	0	110.8	S142 I143 V144	S140-S142 PolarHBondContact O-N 3.09Å; S140-S142 VanDerWaalsContact O-N 3.16Å; S140-S142 PolarHBondContact OG-OG 3.45Å; S140-S142 VanDerWaalsContact OG-OG 3.05Å; S140-I143 WeakPolarHBondContact O-CB 3.49Å; S140-I143 PolarHBondContact O-N 2.99Å; S140-V144 PolarHBondContact O-N 3.47Å
141	P	91.6	Very high	94.2	Very high	70 Å²	70	40.2 Å²	40.2	46%	0.455	22%	0.215	S	C	.	.	H	α-helix	trans	-50.2	-38.2	176.2	-32.1	37.6	0	0	0	113.9	F136 I143 V144 A145	F136-P141 HydrophobicContact CD1-CB 3.61Å; F136-P141 HydrophobicContact CD1-CG 4.08Å; F136-P141 HydrophobicContact CE1-CB 3.75Å; P141-I143 VanDerWaalsContact C-N 3.34Å; P141-I143 PolarHBondContact O-N 3.34Å; P141-V144 PolarHBondContact O-N 3.14Å; P141-A145 WeakPolarHBondContact O-CB 3.34Å; P141-A145 PolarHBondContact O-N 3.22Å
142	S	90.9	Very high	94.2	Very high	73 Å²	73	41.5 Å²	41.5	51%	0.51	22%	0.223	S	C	.	.	H	α-helix	trans	-63.5	-40	178.4	57.1	0	0	0	0	111.9	S140 A145 V146	S140-S142 PolarHBondContact O-N 3.09Å; S140-S142 VanDerWaalsContact O-N 3.16Å; S140-S142 PolarHBondContact OG-OG 3.45Å; S140-S142 VanDerWaalsContact OG-OG 3.05Å; S142-A145 PolarHBondContact O-N 2.92Å; S142-V146 WeakPolarHBondContact O-CB 3.34Å; S142-V146 VanDerWaalsContact O-CG2 3.23Å; S142-V146 WeakPolarHBondContact O-CG2 3.28Å; S142-V146 PolarHBondContact O-N 3.39Å
143	I	91.1	Very high	94.3	Very high	14 Å²	14	42.4 Å²	42.4	7%	0.072	23%	0.234	C	C	.	.	H	α-helix	trans	-68.2	-42.7	-179.7	-58	164.9	0	0	0	110.4	S140 P141 A145 V146 T147 T193 F196 I197	S140-I143 WeakPolarHBondContact O-CB 3.49Å; S140-I143 PolarHBondContact O-N 2.99Å; P141-I143 VanDerWaalsContact C-N 3.34Å; P141-I143 PolarHBondContact O-N 3.34Å; I143-A145 VanDerWaalsContact C-N 3.34Å; I143-V146 PolarHBondContact O-N 3.31Å; I143-T147 HydrophobicContact CG2-CG2 4.46Å; I143-T147 WeakPolarHBondContact O-CB 3.38Å; I143-T147 WeakPolarHBondContact O-CG2 3.1Å; I143-T147 PolarHBondContact O-N 3.29Å; I143-T147 PolarHBondContact O-OG1 3.06Å; I143-T193 HydrophobicContact CD1-CG2 3.71Å; I143-T193 WeakPolarHBondContact CD1-OG1 3.21Å; I143-T193 HydrophobicContact CG1-CG2 3.99Å; I143-T193 HydrophobicContact CG2-CG2 4.4Å; I143-F196 HydrophobicContact CG2-CD1 3.88Å; I143-I197 HydrophobicContact CG2-CD1 4.45Å; I143-I197 HydrophobicContact CG2-CG1 4.1Å
144	V	94.5	Very high	94.4	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-42.3	177.7	-174	0	0	0	0	110.4	F132 C135 F136 F139 S140 P141 T147 F148 F196 Y235	F132-V144 HydrophobicContact CD2-CG1 4.38Å; F132-V144 HydrophobicContact CE2-CG1 4.07Å; C135-V144 HydrophobicContact CB-CG1 4.04Å; C135-V144 HydrophobicContact CB-CG2 3.96Å; C135-V144 WeakPolarHBondContact O-CG2 3.28Å; F136-V144 HydrophobicContact CD2-CB 3.97Å; F136-V144 HydrophobicContact CD2-CG1 3.61Å; F136-V144 HydrophobicContact CD2-CG2 4.43Å; F136-V144 HydrophobicContact CE2-CB 3.78Å; F136-V144 HydrophobicContact CE2-CG1 3.38Å; F136-V144 HydrophobicContact CZ-CB 4.25Å; F136-V144 HydrophobicContact CZ-CG1 4.26Å; F139-V144 HydrophobicContact CB-CG2 4Å; S140-V144 PolarHBondContact O-N 3.47Å; P141-V144 PolarHBondContact O-N 3.14Å; V144-T147 PolarHBondContact O-OG1 3.3Å; V144-T147 VanDerWaalsContact O-OG1 3.04Å; V144-F148 VanDerWaalsContact O-CB 3.25Å; V144-F148 WeakPolarHBondContact O-CB 3.36Å; V144-F148 PolarHBondContact O-N 2.91Å; V144-F196 HydrophobicContact CG2-CE1 4.19Å; V144-F196 HydrophobicContact CG2-CZ 4.36Å; V144-Y235 HydrophobicContact CG1-CE1 4.37Å
145	A	94.7	Very high	94.4	Very high	37 Å²	37	38 Å²	38	31%	0.306	22%	0.215	S	C	.	.	H	α-helix	trans	-62.8	-46.4	175	0	0	0	0	0	112.4	P141 S142 I143 F148 M149	P141-A145 WeakPolarHBondContact O-CB 3.34Å; P141-A145 PolarHBondContact O-N 3.22Å; S142-A145 PolarHBondContact O-N 2.92Å; I143-A145 VanDerWaalsContact C-N 3.34Å; A145-F148 PolarHBondContact O-N 3.35Å; A145-M149 WeakPolarHBondContact O-CG 3.29Å; A145-M149 PolarHBondContact O-N 3.04Å
146	V	92.7	Very high	94.5	Very high	64 Å²	64	41.2 Å²	41.2	39%	0.388	23%	0.232	S	C	.	.	H	α-helix	trans	-62.2	-48.5	179	167.1	0	0	0	0	111.2	S142 I143 F148 M149 L150	S142-V146 WeakPolarHBondContact O-CB 3.34Å; S142-V146 VanDerWaalsContact O-CG2 3.23Å; S142-V146 WeakPolarHBondContact O-CG2 3.28Å; S142-V146 PolarHBondContact O-N 3.39Å; I143-V146 PolarHBondContact O-N 3.31Å; V146-F148 PolarHBondContact O-N 3.07Å; V146-M149 HydrophobicContact CG2-CE 4.33Å; V146-M149 PolarHBondContact O-N 3.49Å; V146-L150 HydrophobicContact CG1-CD1 3.71Å; V146-L150 HydrophobicContact CG1-CG 4.22Å; V146-L150 WeakPolarHBondContact O-CB 3.44Å; V146-L150 VanDerWaalsContact O-CG 3.26Å; V146-L150 WeakPolarHBondContact O-CG 3.33Å; V146-L150 PolarHBondContact O-N 3.46Å
147	T	94.7	Very high	94.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64	-39.5	178.4	50.9	0	0	0	0	112.4	I143 V144 L150 S151 F196 I197 K200	I143-T147 HydrophobicContact CG2-CG2 4.46Å; I143-T147 WeakPolarHBondContact O-CB 3.38Å; I143-T147 WeakPolarHBondContact O-CG2 3.1Å; I143-T147 PolarHBondContact O-N 3.29Å; I143-T147 PolarHBondContact O-OG1 3.06Å; V144-T147 PolarHBondContact O-OG1 3.3Å; V144-T147 VanDerWaalsContact O-OG1 3.04Å; T147-L150 PolarHBondContact O-N 2.95Å; T147-S151 WeakPolarHBondContact O-CB 3.41Å; T147-S151 PolarHBondContact O-N 2.92Å; T147-S151 PolarHBondContact O-OG 2.95Å; T147-F196 HydrophobicContact CG2-CD1 3.99Å; T147-F196 HydrophobicContact CG2-CE1 4.18Å; T147-F196 WeakPolarHBondContact OG1-CE1 3.23Å; T147-I197 HydrophobicContact CG2-CB 4.43Å; T147-I197 HydrophobicContact CG2-CG1 3.78Å; T147-K200 HydrophobicContact CG2-CB 4.18Å; T147-K200 HydrophobicContact CG2-CG 4.07Å
148	F	96.4	Very high	94.8	Very high	59 Å²	59	33.9 Å²	33.9	26%	0.259	20%	0.201	S	C	.	.	H	α-helix	trans	-58.6	-47.1	172.9	177	-94	0	0	0	112	F132 V144 A145 V146 T152 F227 L231 Y235	F132-F148 HydrophobicContact CE2-CB 4.35Å; F132-F148 AromaticContact CE2-CD2 3.75Å; F132-F148 HydrophobicContact CE2-CD2 3.75Å; F132-F148 HydrophobicContact CE2-CE2 4.3Å; F132-F148 HydrophobicContact CE2-CG 4.2Å; F132-F148 HydrophobicContact CZ-CD2 4.31Å; F132-F148 HydrophobicContact CZ-CG 4.48Å; V144-F148 VanDerWaalsContact O-CB 3.25Å; V144-F148 WeakPolarHBondContact O-CB 3.36Å; V144-F148 PolarHBondContact O-N 2.91Å; A145-F148 PolarHBondContact O-N 3.35Å; V146-F148 PolarHBondContact O-N 3.07Å; F148-T152 WeakPolarHBondContact O-CB 3.4Å; F148-T152 PolarHBondContact O-N 3.34Å; F148-T152 PolarHBondContact O-OG1 2.89Å; F148-F227 HydrophobicContact CE2-CZ 4.05Å; F148-F227 AromaticContact CZ-CZ 3.71Å; F148-F227 HydrophobicContact CZ-CZ 3.71Å; F148-L231 HydrophobicContact CD2-CD2 3.86Å; F148-L231 HydrophobicContact CE2-CD1 4.2Å; F148-L231 HydrophobicContact CE2-CD2 3.55Å; F148-Y235 WeakPolarHBondContact CB-OH 3.46Å; F148-Y235 HydrophobicContact CD2-CE2 4.35Å
149	M	96.3	Very high	94.9	Very high	110 Å²	110	36.1 Å²	36.1	54%	0.542	21%	0.209	S	C	.	.	H	α-helix	trans	-62.7	-47.3	176.6	-72.7	-171.2	-67.9	0	0	111.5	A145 V146 S151 T152 V153	A145-M149 WeakPolarHBondContact O-CG 3.29Å; A145-M149 PolarHBondContact O-N 3.04Å; V146-M149 HydrophobicContact CG2-CE 4.33Å; V146-M149 PolarHBondContact O-N 3.49Å; M149-S151 PolarHBondContact O-N 2.83Å; M149-T152 WeakPolarHBondContact O-CB 3.48Å; M149-T152 PolarHBondContact O-N 3.35Å; M149-T152 VanDerWaalsContact O-N 3.15Å; M149-V153 WeakPolarHBondContact O-CG2 3.15Å; M149-V153 PolarHBondContact O-N 3.43Å
150	L	95.4	Very high	95.1	Very high	44 Å²	44	42.3 Å²	42.3	23%	0.23	24%	0.238	C	C	.	.	H	α-helix	trans	-60	-46.9	178.6	-72.3	172.6	0	0	0	111.9	V146 T147 T152 V153 M154 L174 M201	V146-L150 HydrophobicContact CG1-CD1 3.71Å; V146-L150 HydrophobicContact CG1-CG 4.22Å; V146-L150 WeakPolarHBondContact O-CB 3.44Å; V146-L150 VanDerWaalsContact O-CG 3.26Å; V146-L150 WeakPolarHBondContact O-CG 3.33Å; V146-L150 PolarHBondContact O-N 3.46Å; T147-L150 PolarHBondContact O-N 2.95Å; L150-T152 VanDerWaalsContact C-N 3.27Å; L150-T152 PolarHBondContact O-N 3.4Å; L150-V153 PolarHBondContact O-N 3.08Å; L150-M154 WeakPolarHBondContact O-CB 3.28Å; L150-M154 VanDerWaalsContact O-CG 3.31Å; L150-M154 WeakPolarHBondContact O-CG 3.19Å; L150-M154 PolarHBondContact O-N 3.43Å; L150-L174 HydrophobicContact CD1-CD1 4.18Å; L150-L174 HydrophobicContact CD1-CD2 4.31Å; L150-L174 HydrophobicContact CD2-CD1 3.96Å; L150-L174 HydrophobicContact CD2-CD2 4.2Å; L150-M201 HydrophobicContact CB-CE 4.06Å; L150-M201 HydrophobicContact CD1-CE 4.28Å
151	S	97.2	Very high	95.4	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.007	25%	0.251	C	S	.	.	H	α-helix	trans	-60.2	-38.4	175.4	-64.2	0	0	0	0	112.1	T147 M149 M154 L155 S204 L234	T147-S151 WeakPolarHBondContact O-CB 3.41Å; T147-S151 PolarHBondContact O-N 2.92Å; T147-S151 PolarHBondContact O-OG 2.95Å; M149-S151 PolarHBondContact O-N 2.83Å; S151-M154 PolarHBondContact O-N 3.14Å; S151-L155 PolarHBondContact O-N 2.96Å; S151-S204 WeakPolarHBondContact CB-OG 3.22Å; S151-S204 PolarHBondContact OG-OG 3.16Å; S151-L234 WeakPolarHBondContact OG-CD1 3.31Å
152	T	97.3	Very high	95.5	Very high	27 Å²	27	46.7 Å²	46.7	17%	0.166	25%	0.251	C	S	.	.	H	α-helix	trans	-66.8	-44.5	176.1	-55.7	0	0	0	0	111.7	F148 M149 L150 M154 L155 L156 F227	F148-T152 WeakPolarHBondContact O-CB 3.4Å; F148-T152 PolarHBondContact O-N 3.34Å; F148-T152 PolarHBondContact O-OG1 2.89Å; M149-T152 WeakPolarHBondContact O-CB 3.48Å; M149-T152 PolarHBondContact O-N 3.35Å; M149-T152 VanDerWaalsContact O-N 3.15Å; L150-T152 VanDerWaalsContact C-N 3.27Å; L150-T152 PolarHBondContact O-N 3.4Å; T152-M154 VanDerWaalsContact C-N 3.33Å; T152-M154 PolarHBondContact O-N 2.96Å; T152-L155 WeakPolarHBondContact O-CB 3.47Å; T152-L155 PolarHBondContact O-N 3.42Å; T152-L156 WeakPolarHBondContact O-CG 3.32Å; T152-L156 PolarHBondContact O-N 3.35Å; T152-F227 HydrophobicContact CG2-CE2 4.01Å
153	V	96.3	Very high	95.8	Very high	84 Å²	84	44.9 Å²	44.9	51%	0.509	24%	0.238	S	C	.	.	H	α-helix	trans	-61.8	-42	174.8	170.8	0	0	0	0	110.9	M149 L150 L155 L156 A157	M149-V153 WeakPolarHBondContact O-CG2 3.15Å; M149-V153 PolarHBondContact O-N 3.43Å; L150-V153 PolarHBondContact O-N 3.08Å; V153-L155 VanDerWaalsContact C-N 3.33Å; V153-L155 PolarHBondContact O-N 3.36Å; V153-L156 PolarHBondContact O-N 3.34Å; V153-A157 WeakPolarHBondContact O-CB 3.39Å; V153-A157 PolarHBondContact O-N 3.34Å
154	M	97.1	Very high	96.1	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-61.4	-40.8	174.8	-73.9	-179.1	66.5	0	0	112	L150 S151 T152 A157 A158 L167 I170 V171 M201 I205 C208	L150-M154 WeakPolarHBondContact O-CB 3.28Å; L150-M154 VanDerWaalsContact O-CG 3.31Å; L150-M154 WeakPolarHBondContact O-CG 3.19Å; L150-M154 PolarHBondContact O-N 3.43Å; S151-M154 PolarHBondContact O-N 3.14Å; T152-M154 VanDerWaalsContact C-N 3.33Å; T152-M154 PolarHBondContact O-N 2.96Å; M154-A157 PolarHBondContact O-N 3.42Å; M154-A158 WeakPolarHBondContact O-CB 3.23Å; M154-A158 PolarHBondContact O-N 2.89Å; M154-L167 HydrophobicContact CB-CD2 4.43Å; M154-I170 HydrophobicContact CG-CG2 4.16Å; M154-V171 HydrophobicContact CE-CG2 3.31Å; M154-V171 HydrophobicContact SD-CG2 4.01Å; M154-M201 HydrophobicContact SD-SD 4.15Å; M154-I205 HydrophobicContact CE-CB 3.95Å; M154-I205 HydrophobicContact CE-CG1 4.47Å; M154-C208 VanDerWaalsContact C-SG 3.59Å
155	L	97.8	Very high	96.1	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.6	-43.6	175.7	179.3	60.8	0	0	0	111.7	S151 T152 V153 A158 R159 Y207 V211 F223 D226 F227 M230	S151-L155 PolarHBondContact O-N 2.96Å; T152-L155 WeakPolarHBondContact O-CB 3.47Å; T152-L155 PolarHBondContact O-N 3.42Å; V153-L155 VanDerWaalsContact C-N 3.33Å; V153-L155 PolarHBondContact O-N 3.36Å; L155-A158 WeakPolarHBondContact O-CB 3.41Å; L155-A158 PolarHBondContact O-N 3.33Å; L155-R159 HydrophobicContact CD1-CG 4.4Å; L155-R159 WeakPolarHBondContact O-CG 3.47Å; L155-R159 PolarHBondContact O-N 2.82Å; L155-Y207 HydrophobicContact CD1-CD1 4.29Å; L155-Y207 HydrophobicContact CD1-CE1 3.91Å; L155-V211 HydrophobicContact CD1-CG1 4.48Å; L155-V211 HydrophobicContact CD1-CG2 4.03Å; L155-F223 HydrophobicContact CD2-CE2 4.07Å; L155-F223 HydrophobicContact CG-CE2 4.49Å; L155-D226 HydrophobicContact CD1-CB 4.23Å; L155-D226 HydrophobicContact CD2-CB 4.41Å; L155-F227 HydrophobicContact CD2-CB 4.24Å; L155-F227 HydrophobicContact CD2-CD2 4.03Å; L155-M230 HydrophobicContact CB-CE 4.39Å; L155-M230 HydrophobicContact CB-SD 3.85Å; L155-M230 HydrophobicContact CD2-CE 4.07Å; L155-M230 HydrophobicContact CD2-SD 4.03Å; L155-M230 HydrophobicContact CG-SD 4.4Å
156	L	97.4	Very high	96.2	Very high	68 Å²	68	54.4 Å²	54.4	36%	0.356	28%	0.279	S	S	.	.	H	α-helix	trans	-61.6	-46.3	174.9	-67.7	172.6	0	0	0	110.9	T152 V153 A158 R159 H160 F223	T152-L156 WeakPolarHBondContact O-CG 3.32Å; T152-L156 PolarHBondContact O-N 3.35Å; V153-L156 PolarHBondContact O-N 3.34Å; L156-A158 VanDerWaalsContact C-N 3.32Å; L156-A158 PolarHBondContact O-N 3.48Å; L156-R159 PolarHBondContact O-N 3.24Å; L156-H160 WeakPolarHBondContact O-CB 3.29Å; L156-H160 PolarHBondContact O-CD2 2.9Å; L156-H160 PolarHBondContact O-N 3.11Å; L156-F223 HydrophobicContact CD2-CD2 4.4Å; L156-F223 HydrophobicContact CD2-CE2 3.72Å; L156-F223 HydrophobicContact CD2-CZ 4.36Å
157	A	96.6	Very high	96.4	Very high	16 Å²	16	51.4 Å²	51.4	13%	0.132	26%	0.261	C	S	.	.	H	α-helix	trans	-58.9	-42.5	175.6	0	0	0	0	0	111.8	V153 M154 R159 L161 L167 I170	V153-A157 WeakPolarHBondContact O-CB 3.39Å; V153-A157 PolarHBondContact O-N 3.34Å; M154-A157 PolarHBondContact O-N 3.42Å; A157-R159 VanDerWaalsContact C-N 3.32Å; A157-R159 PolarHBondContact O-N 3.43Å; A157-L161 HydrophobicContact CB-CD1 4.05Å; A157-L161 WeakPolarHBondContact O-CA 3.48Å; A157-L161 WeakPolarHBondContact O-CB 3.34Å; A157-L161 WeakPolarHBondContact O-CG 3.46Å; A157-L161 PolarHBondContact O-N 2.95Å; A157-L167 HydrophobicContact CB-CD2 4.21Å; A157-I170 HydrophobicContact CB-CD1 4.46Å
158	A	97.7	Very high	96.5	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.008	27%	0.269	C	S	.	.	H	α-helix	trans	-61.4	-40.8	177.1	0	0	0	0	0	112.3	M154 L155 L156 H162 L167 C208 I212	M154-A158 WeakPolarHBondContact O-CB 3.23Å; M154-A158 PolarHBondContact O-N 2.89Å; L155-A158 WeakPolarHBondContact O-CB 3.41Å; L155-A158 PolarHBondContact O-N 3.33Å; L156-A158 VanDerWaalsContact C-N 3.32Å; L156-A158 PolarHBondContact O-N 3.48Å; A158-H162 PolarHBondContact O-N 3.35Å; A158-L167 HydrophobicContact CB-CD1 4.08Å; A158-L167 HydrophobicContact CB-CD2 4.31Å; A158-C208 HydrophobicContact CB-CB 3.76Å; A158-I212 HydrophobicContact CB-CD1 4.29Å; A158-I212 HydrophobicContact CB-CG1 4.13Å; A158-I212 WeakPolarHBondContact O-CG1 3.34Å
159	R	96.6	Very high	96.5	Very high	49 Å²	49	58 Å²	58	19%	0.185	29%	0.285	C	S	.	.	H	α-helix	trans	-77.7	-31.5	-178.6	-72.6	-177	62.6	88.7	3.3	114.3	L155 L156 A157 H162 V211 R221 D226	L155-R159 HydrophobicContact CD1-CG 4.4Å; L155-R159 WeakPolarHBondContact O-CG 3.47Å; L155-R159 PolarHBondContact O-N 2.82Å; L156-R159 PolarHBondContact O-N 3.24Å; A157-R159 VanDerWaalsContact C-N 3.32Å; A157-R159 PolarHBondContact O-N 3.43Å; R159-H162 PolarHBondContact O-CE1 2.99Å; R159-H162 PolarHBondContact O-NE2 2.96Å; R159-V211 HydrophobicContact CG-CG1 3.92Å; R159-R221 PolarHBondContact NH1-O 2.99Å; R159-R221 PolarHBondContact NH2-O 3.44Å; R159-D226 IonicContact CZ-OD2 4Å; R159-D226 IonicContact NH1-OD2 3.89Å; R159-D226 PolarHBondContact NH1-OD2 3.47Å
160	H	95.6	Very high	96.4	Very high	138 Å²	138	55 Å²	55	64%	0.639	27%	0.271	S	S	*	.	H	α-helix	trans	-99.4	-36.3	-174.9	-66.9	-63.2	0	0	0	112.9	L156	L156-H160 WeakPolarHBondContact O-CB 3.29Å; L156-H160 PolarHBondContact O-CD2 2.9Å; L156-H160 PolarHBondContact O-N 3.11Å
161	L	95.8	Very high	96.4	Very high	95 Å²	95	52.9 Å²	52.9	50%	0.497	26%	0.26	S	S	.	.	H	α-helix	trans	-94.1	-22.1	-176.5	-52.3	177	0	0	0	112.7	A157 S163 I166	A157-L161 HydrophobicContact CB-CD1 4.05Å; A157-L161 WeakPolarHBondContact O-CA 3.48Å; A157-L161 WeakPolarHBondContact O-CB 3.34Å; A157-L161 WeakPolarHBondContact O-CG 3.46Å; A157-L161 PolarHBondContact O-N 2.95Å; L161-S163 PolarHBondContact O-N 3.4Å; L161-I166 HydrophobicContact CB-CD1 4.28Å; L161-I166 HydrophobicContact CD1-CD1 3.87Å; L161-I166 HydrophobicContact CD1-CG2 3.88Å
162	H	94.4	Very high	96.4	Very high	100 Å²	100	54.7 Å²	54.7	46%	0.463	27%	0.27	S	S	.	.			trans	50.4	22.3	-177.2	-63.8	-76.7	0	0	0	114.9	A158 R159	A158-H162 PolarHBondContact O-N 3.35Å; R159-H162 PolarHBondContact O-CE1 2.99Å; R159-H162 PolarHBondContact O-NE2 2.96Å
163	S	96.8	Very high	96.2	Very high	34 Å²	34	56.3 Å²	56.3	24%	0.238	29%	0.286	C	S	.	.			trans	-111.6	112.4	-173.8	-180	0	0	0	0	111.7	L161 L165 I166 L167	L161-S163 PolarHBondContact O-N 3.4Å; S163-L165 PolarHBondContact O-N 3.43Å; S163-L165 PolarHBondContact OG-N 3.47Å; S163-I166 PolarHBondContact O-N 3.45Å; S163-I166 PolarHBondContact OG-N 3.04Å; S163-L167 PolarHBondContact O-N 2.86Å
164	K	96.6	Very high	96.1	Very high	78 Å²	78	54.5 Å²	54.5	34%	0.339	27%	0.273	S	S	.	.	H	α-helix	trans	-63.6	-31.6	173.7	-57.9	-176.4	-172.2	-173.7	0	112.1	L167 W168 I209 I212 D213	K164-L167 PolarHBondContact O-N 3.2Å; K164-W168 PolarHBondContact O-N 2.92Å; K164-I209 HydrophobicContact CD-CG2 4.36Å; K164-I212 HydrophobicContact CG-CD1 4.05Å; K164-I212 HydrophobicContact CG-CG2 4.36Å; K164-D213 WeakPolarHBondContact CE-OD1 3.49Å; K164-D213 IonicContact NZ-OD1 2.8Å; K164-D213 PolarHBondContact NZ-OD1 3.3Å; K164-D213 IonicContact NZ-OD2 3.26Å; K164-D213 PolarHBondContact NZ-OD2 3.49Å
165	L	95.6	Very high	95.9	Very high	109 Å²	109	54.7 Å²	54.7	57%	0.571	27%	0.274	S	S	*	.	H	α-helix	trans	-64.2	-44.8	-179.9	-169.5	94.1	0	0	0	111.1	S163 L167 W168 Y169	S163-L165 PolarHBondContact O-N 3.43Å; S163-L165 PolarHBondContact OG-N 3.47Å; L165-L167 VanDerWaalsContact C-N 3.34Å; L165-L167 PolarHBondContact O-N 3.45Å; L165-W168 WeakPolarHBondContact O-CB 3.18Å; L165-W168 PolarHBondContact O-N 3.46Å; L165-Y169 HydrophobicContact CD1-CE2 4.33Å; L165-Y169 HydrophobicContact CD2-CD2 4.21Å; L165-Y169 HydrophobicContact CD2-CE2 3.54Å; L165-Y169 HydrophobicContact CG-CD2 4.01Å; L165-Y169 HydrophobicContact CG-CE2 3.58Å; L165-Y169 VanDerWaalsContact O-CD2 3.22Å; L165-Y169 WeakPolarHBondContact O-CD2 3.37Å; L165-Y169 PolarHBondContact O-N 3.22Å
166	I	95.5	Very high	95.8	Very high	65 Å²	65	58.2 Å²	58.2	33%	0.333	29%	0.289	S	S	.	.	H	α-helix	trans	-63.4	-42.3	178.3	-64.6	175.8	0	0	0	110.5	L161 S163 W168 Y169 I170	L161-I166 HydrophobicContact CB-CD1 4.28Å; L161-I166 HydrophobicContact CD1-CD1 3.87Å; L161-I166 HydrophobicContact CD1-CG2 3.88Å; S163-I166 PolarHBondContact O-N 3.45Å; S163-I166 PolarHBondContact OG-N 3.04Å; I166-W168 VanDerWaalsContact C-N 3.31Å; I166-W168 PolarHBondContact O-N 3.49Å; I166-Y169 PolarHBondContact O-N 3.27Å; I166-I170 HydrophobicContact CG2-CD1 3.97Å; I166-I170 HydrophobicContact CG2-CG1 4.49Å; I166-I170 WeakPolarHBondContact O-CG1 3.29Å; I166-I170 PolarHBondContact O-N 2.63Å
167	L	96.8	Very high	95.6	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-59.9	-41.6	175.4	-65.8	175.4	0	0	0	112.2	M154 A157 A158 S163 K164 L165 I170 V171 I205 C208 I212	M154-L167 HydrophobicContact CB-CD2 4.43Å; A157-L167 HydrophobicContact CB-CD2 4.21Å; A158-L167 HydrophobicContact CB-CD1 4.08Å; A158-L167 HydrophobicContact CB-CD2 4.31Å; S163-L167 PolarHBondContact O-N 2.86Å; K164-L167 PolarHBondContact O-N 3.2Å; L165-L167 VanDerWaalsContact C-N 3.34Å; L165-L167 PolarHBondContact O-N 3.45Å; L167-I170 PolarHBondContact O-N 3.21Å; L167-V171 WeakPolarHBondContact O-CB 3.47Å; L167-V171 VanDerWaalsContact O-CG2 3.29Å; L167-V171 WeakPolarHBondContact O-CG2 3.21Å; L167-V171 PolarHBondContact O-N 2.84Å; L167-I205 HydrophobicContact CB-CG1 4.31Å; L167-C208 HydrophobicContact CD1-CB 3.58Å; L167-C208 HydrophobicContact CD2-CB 4.21Å; L167-I212 HydrophobicContact CD1-CD1 3.53Å
168	W	97.2	Very high	95.4	Very high	42 Å²	42	56.3 Å²	56.3	16%	0.159	28%	0.281	C	S	.	.	H	α-helix	trans	-63.1	-43.7	174.4	-85.2	115.3	0	0	0	112.3	K164 L165 I166 I170 V171 L172 I205 F368 I373 F397	K164-W168 PolarHBondContact O-N 2.92Å; L165-W168 WeakPolarHBondContact O-CB 3.18Å; L165-W168 PolarHBondContact O-N 3.46Å; I166-W168 VanDerWaalsContact C-N 3.31Å; I166-W168 PolarHBondContact O-N 3.49Å; W168-I170 PolarHBondContact O-N 3.08Å; W168-V171 PolarHBondContact O-N 3.13Å; W168-L172 HydrophobicContact CE3-CG 4.34Å; W168-L172 VanDerWaalsContact O-CB 3.3Å; W168-L172 WeakPolarHBondContact O-CB 3.32Å; W168-L172 WeakPolarHBondContact O-CG 3.31Å; W168-L172 PolarHBondContact O-N 2.67Å; W168-I205 HydrophobicContact CD2-CD1 3.37Å; W168-I205 HydrophobicContact CE3-CD1 3.54Å; W168-I205 HydrophobicContact CG-CD1 3.85Å; W168-I205 HydrophobicContact CH2-CD1 4.13Å; W168-I205 HydrophobicContact CZ2-CD1 4Å; W168-I205 HydrophobicContact CZ3-CD1 3.91Å; W168-F368 AromaticContact CH2-CE1 3.83Å; W168-F368 HydrophobicContact CH2-CE1 3.83Å; W168-F368 AromaticContact CH2-CZ 3.59Å; W168-F368 HydrophobicContact CH2-CZ 3.59Å; W168-F368 HydrophobicContact CZ2-CZ 4.46Å; W168-F368 HydrophobicContact CZ3-CE1 4.47Å; W168-F368 HydrophobicContact CZ3-CZ 4.2Å; W168-I373 HydrophobicContact CH2-CD1 3.81Å; W168-I373 HydrophobicContact CH2-CG1 3.57Å; W168-I373 HydrophobicContact CZ2-CD1 4.42Å; W168-I373 HydrophobicContact CZ2-CG1 3.67Å; W168-I373 HydrophobicContact CZ3-CD1 4.43Å; W168-F397 HydrophobicContact CH2-CD2 4.41Å; W168-F397 AromaticContact CZ3-CD2 3.73Å; W168-F397 HydrophobicContact CZ3-CD2 3.73Å; W168-F397 AromaticContact CZ3-CE2 3.86Å; W168-F397 HydrophobicContact CZ3-CE2 3.86Å
169	Y	96	Very high	95.1	Very high	154 Å²	154	57.2 Å²	57.2	60%	0.604	29%	0.287	S	S	*	.	H	α-helix	trans	-60	-45.5	175.9	-79.3	-60.9	0	0	0	112.3	L165 I166 V171 L172 A173	L165-Y169 HydrophobicContact CD1-CE2 4.33Å; L165-Y169 HydrophobicContact CD2-CD2 4.21Å; L165-Y169 HydrophobicContact CD2-CE2 3.54Å; L165-Y169 HydrophobicContact CG-CD2 4.01Å; L165-Y169 HydrophobicContact CG-CE2 3.58Å; L165-Y169 VanDerWaalsContact O-CD2 3.22Å; L165-Y169 WeakPolarHBondContact O-CD2 3.37Å; L165-Y169 PolarHBondContact O-N 3.22Å; I166-Y169 PolarHBondContact O-N 3.27Å; Y169-V171 PolarHBondContact O-N 3Å; Y169-L172 PolarHBondContact O-N 3.29Å; Y169-A173 WeakPolarHBondContact O-CB 3.35Å; Y169-A173 PolarHBondContact O-N 3.31Å
170	I	94.4	Very high	94.8	Very high	48 Å²	48	57.9 Å²	57.9	25%	0.246	29%	0.292	C	S	.	.	H	α-helix	trans	-57.7	-50.6	177	-68.3	166.6	0	0	0	110.2	M154 A157 I166 L167 W168 A173 L174	M154-I170 HydrophobicContact CG-CG2 4.16Å; A157-I170 HydrophobicContact CB-CD1 4.46Å; I166-I170 HydrophobicContact CG2-CD1 3.97Å; I166-I170 HydrophobicContact CG2-CG1 4.49Å; I166-I170 WeakPolarHBondContact O-CG1 3.29Å; I166-I170 PolarHBondContact O-N 2.63Å; L167-I170 PolarHBondContact O-N 3.21Å; W168-I170 PolarHBondContact O-N 3.08Å; I170-A173 PolarHBondContact O-N 3.17Å; I170-L174 HydrophobicContact CG2-CD1 3.68Å; I170-L174 HydrophobicContact CG2-CG 4.48Å; I170-L174 WeakPolarHBondContact O-CB 3.5Å; I170-L174 WeakPolarHBondContact O-CD1 3.43Å; I170-L174 WeakPolarHBondContact O-CG 3.46Å; I170-L174 PolarHBondContact O-N 3.29Å
171	V	95.8	Very high	94.5	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65.1	-45.8	-177.2	166.8	0	0	0	0	111.7	M154 L167 W168 Y169 L174 L175 M201 I205	M154-V171 HydrophobicContact CE-CG2 3.31Å; M154-V171 HydrophobicContact SD-CG2 4.01Å; L167-V171 WeakPolarHBondContact O-CB 3.47Å; L167-V171 VanDerWaalsContact O-CG2 3.29Å; L167-V171 WeakPolarHBondContact O-CG2 3.21Å; L167-V171 PolarHBondContact O-N 2.84Å; W168-V171 PolarHBondContact O-N 3.13Å; Y169-V171 PolarHBondContact O-N 3Å; V171-L174 PolarHBondContact O-N 3.05Å; V171-L175 HydrophobicContact CG1-CD1 3.76Å; V171-L175 HydrophobicContact CG1-CG 4.33Å; V171-L175 WeakPolarHBondContact O-CB 3.47Å; V171-L175 VanDerWaalsContact O-CG 3.23Å; V171-L175 WeakPolarHBondContact O-CG 3.35Å; V171-L175 PolarHBondContact O-N 3.39Å; V171-M201 HydrophobicContact CG1-CB 4.27Å; V171-I205 HydrophobicContact CB-CD1 4.31Å; V171-I205 HydrophobicContact CG2-CB 3.92Å; V171-I205 HydrophobicContact CG2-CD1 4.06Å; V171-I205 HydrophobicContact CG2-CG1 4.24Å
172	L	96.2	Very high	94	Very high	39 Å²	39	57.2 Å²	57.2	20%	0.204	29%	0.294	C	S	.	.	H	α-helix	trans	-65.5	-41.9	179.6	-69.9	172.1	0	0	0	111.5	W168 Y169 F176 F396 F397 V400	W168-L172 HydrophobicContact CE3-CG 4.34Å; W168-L172 VanDerWaalsContact O-CB 3.3Å; W168-L172 WeakPolarHBondContact O-CB 3.32Å; W168-L172 WeakPolarHBondContact O-CG 3.31Å; W168-L172 PolarHBondContact O-N 2.67Å; Y169-L172 PolarHBondContact O-N 3.29Å; L172-F176 WeakPolarHBondContact O-CB 3.24Å; L172-F176 PolarHBondContact O-N 3.13Å; L172-F396 HydrophobicContact CD1-CE1 4.46Å; L172-F397 HydrophobicContact CD2-CD2 3.85Å; L172-F397 HydrophobicContact CD2-CE2 4.47Å; L172-V400 HydrophobicContact CD2-CB 4.31Å; L172-V400 HydrophobicContact CD2-CG1 4.11Å; L172-V400 HydrophobicContact CD2-CG2 4.29Å
173	A	94.8	Very high	93.6	Very high	61 Å²	61	55.8 Å²	55.8	50%	0.504	29%	0.293	S	S	.	.	H	α-helix	trans	-63.8	-43.7	177.4	0	0	0	0	0	111.9	Y169 I170 A177	Y169-A173 WeakPolarHBondContact O-CB 3.35Å; Y169-A173 PolarHBondContact O-N 3.31Å; I170-A173 PolarHBondContact O-N 3.17Å; A173-A177 WeakPolarHBondContact O-CB 3.45Å; A173-A177 PolarHBondContact O-N 3.25Å
174	L	92.8	Very high	93.1	Very high	46 Å²	46	63.3 Å²	63.3	24%	0.241	32%	0.324	C	S	.	.	H	α-helix	trans	-66.7	-46.4	178.2	-71.5	168.6	0	0	0	112.2	L150 I170 V171 F176 A177 V178 M201	L150-L174 HydrophobicContact CD1-CD1 4.18Å; L150-L174 HydrophobicContact CD1-CD2 4.31Å; L150-L174 HydrophobicContact CD2-CD1 3.96Å; L150-L174 HydrophobicContact CD2-CD2 4.2Å; I170-L174 HydrophobicContact CG2-CD1 3.68Å; I170-L174 HydrophobicContact CG2-CG 4.48Å; I170-L174 WeakPolarHBondContact O-CB 3.5Å; I170-L174 WeakPolarHBondContact O-CD1 3.43Å; I170-L174 WeakPolarHBondContact O-CG 3.46Å; I170-L174 PolarHBondContact O-N 3.29Å; V171-L174 PolarHBondContact O-N 3.05Å; L174-F176 VanDerWaalsContact C-N 3.34Å; L174-F176 PolarHBondContact O-N 2.93Å; L174-A177 PolarHBondContact O-N 3.19Å; L174-V178 WeakPolarHBondContact O-CG2 3.16Å; L174-V178 PolarHBondContact O-N 3Å; L174-V178 VanDerWaalsContact O-N 3.08Å; L174-M201 HydrophobicContact CD1-SD 3.79Å
175	L	94.2	Very high	92.6	Very high	4 Å²	4	61 Å²	61	2%	0.021	32%	0.315	C	S	.	.	H	α-helix	trans	-60.8	-45.6	176.6	-72.1	175.3	0	0	0	110.7	V171 V178 V179 M201 F397 V400 W401	V171-L175 HydrophobicContact CG1-CD1 3.76Å; V171-L175 HydrophobicContact CG1-CG 4.33Å; V171-L175 WeakPolarHBondContact O-CB 3.47Å; V171-L175 VanDerWaalsContact O-CG 3.23Å; V171-L175 WeakPolarHBondContact O-CG 3.35Å; V171-L175 PolarHBondContact O-N 3.39Å; L175-V178 PolarHBondContact O-N 3.49Å; L175-V179 VanDerWaalsContact O-CB 3.29Å; L175-V179 WeakPolarHBondContact O-CB 3.19Å; L175-V179 WeakPolarHBondContact O-CG2 3.4Å; L175-V179 PolarHBondContact O-N 2.7Å; L175-M201 HydrophobicContact CD2-CB 4.13Å; L175-M201 HydrophobicContact CD2-CG 4.26Å; L175-M201 HydrophobicContact CG-CB 4.38Å; L175-F397 HydrophobicContact CD1-CE2 3.93Å; L175-F397 HydrophobicContact CD1-CZ 4.13Å; L175-V400 HydrophobicContact CB-CG1 3.78Å; L175-W401 HydrophobicContact CD1-CE3 4.36Å; L175-W401 HydrophobicContact CD2-CE3 4.38Å; L175-W401 HydrophobicContact CD2-CZ3 4.38Å
176	F	94.6	Very high	92.1	Very high	74 Å²	74	59.7 Å²	59.7	33%	0.325	31%	0.313	S	S	.	.	H	α-helix	trans	-59.4	-48.5	176.9	-178.8	-99.9	0	0	0	112	L172 L174 V178 V179 E180 Y182 V400 F404	L172-F176 WeakPolarHBondContact O-CB 3.24Å; L172-F176 PolarHBondContact O-N 3.13Å; L174-F176 VanDerWaalsContact C-N 3.34Å; L174-F176 PolarHBondContact O-N 2.93Å; F176-V178 VanDerWaalsContact C-N 3.3Å; F176-V178 PolarHBondContact O-N 2.95Å; F176-V179 PolarHBondContact O-N 3.34Å; F176-E180 HydrophobicContact CD2-CG 3.82Å; F176-E180 HydrophobicContact CE1-CG 4.41Å; F176-E180 HydrophobicContact CE2-CG 3.58Å; F176-E180 HydrophobicContact CG-CG 4.36Å; F176-E180 HydrophobicContact CZ-CG 3.9Å; F176-E180 WeakPolarHBondContact O-CB 3.24Å; F176-E180 WeakPolarHBondContact O-CG 3.13Å; F176-E180 PolarHBondContact O-N 2.87Å; F176-Y182 HydrophobicContact CD1-CD2 4.49Å; F176-Y182 HydrophobicContact CD1-CE2 4.15Å; F176-Y182 HydrophobicContact CE1-CD2 4.24Å; F176-Y182 AromaticContact CE1-CE2 3.49Å; F176-Y182 HydrophobicContact CE1-CE2 3.49Å; F176-Y182 VanDerWaalsContact CE1-CE2 3.49Å; F176-Y182 HydrophobicContact CZ-CE2 4.02Å; F176-V400 HydrophobicContact CB-CG1 4.18Å; F176-F404 HydrophobicContact CD2-CD2 4.04Å; F176-F404 AromaticContact CD2-CE2 3.73Å; F176-F404 HydrophobicContact CD2-CE2 3.73Å; F176-F404 AromaticContact CE2-CD2 3.69Å; F176-F404 HydrophobicContact CE2-CD2 3.69Å; F176-F404 AromaticContact CE2-CE2 3.69Å; F176-F404 HydrophobicContact CE2-CE2 3.69Å
177	A	93.3	Very high	91.6	Very high	28 Å²	28	62.4 Å²	62.4	23%	0.231	33%	0.328	C	S	.	.	H	α-helix	trans	-58.8	-41.3	179.8	0	0	0	0	0	112.6	A173 L174 Y182	A173-A177 WeakPolarHBondContact O-CB 3.45Å; A173-A177 PolarHBondContact O-N 3.25Å; L174-A177 PolarHBondContact O-N 3.19Å; A177-Y182 WeakPolarHBondContact O-CB 3.31Å; A177-Y182 PolarHBondContact O-N 3.37Å
178	V	91.9	Very high	90.9	Very high	16 Å²	16	66.1 Å²	66.1	10%	0.097	36%	0.355	C	S	.	.	H	α-helix	trans	-76.2	-42.9	-178.8	171.3	0	0	0	0	112	L174 L175 F176 G181 V183 I185 V194 I197	L174-V178 WeakPolarHBondContact O-CG2 3.16Å; L174-V178 PolarHBondContact O-N 3Å; L174-V178 VanDerWaalsContact O-N 3.08Å; L175-V178 PolarHBondContact O-N 3.49Å; F176-V178 VanDerWaalsContact C-N 3.3Å; F176-V178 PolarHBondContact O-N 2.95Å; V178-G181 PolarHBondContact O-N 3.19Å; V178-V183 HydrophobicContact CG2-CG2 4.37Å; V178-I185 HydrophobicContact CG1-CD1 4.28Å; V178-V194 HydrophobicContact CG1-CB 4.34Å; V178-V194 HydrophobicContact CG1-CG1 4.37Å; V178-V194 HydrophobicContact CG1-CG2 3.89Å; V178-I197 HydrophobicContact CG1-CD1 4.26Å; V178-I197 HydrophobicContact CG2-CD1 4.07Å; V178-I197 HydrophobicContact CG2-CG2 4.31Å
179	V	91.8	Very high	90.4	Very high	20 Å²	20	66.5 Å²	66.5	12%	0.121	36%	0.36	C	S	.	.	H	α-helix	trans	-75.5	-34.5	-174.2	173.6	0	0	0	0	112.4	L175 F176 G181 V194 G403	L175-V179 VanDerWaalsContact O-CB 3.29Å; L175-V179 WeakPolarHBondContact O-CB 3.19Å; L175-V179 WeakPolarHBondContact O-CG2 3.4Å; L175-V179 PolarHBondContact O-N 2.7Å; F176-V179 PolarHBondContact O-N 3.34Å; V179-G181 VanDerWaalsContact C-N 3.28Å; V179-V194 HydrophobicContact CG2-CG1 4.22Å; V179-G403 VanDerWaalsContact CG1-CA 3.5Å
180	E	91.8	Very high	90.1	Very high	64 Å²	64	61.8 Å²	61.8	30%	0.299	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-4.4	175.4	-65.8	-58.4	124.8	0	0	113.4	F176 Y182 G403 F404	F176-E180 HydrophobicContact CD2-CG 3.82Å; F176-E180 HydrophobicContact CE1-CG 4.41Å; F176-E180 HydrophobicContact CE2-CG 3.58Å; F176-E180 HydrophobicContact CG-CG 4.36Å; F176-E180 HydrophobicContact CZ-CG 3.9Å; F176-E180 WeakPolarHBondContact O-CB 3.24Å; F176-E180 WeakPolarHBondContact O-CG 3.13Å; F176-E180 PolarHBondContact O-N 2.87Å; E180-Y182 HydrophobicContact CB-CD2 3.71Å; E180-Y182 HydrophobicContact CB-CE2 3.55Å; E180-Y182 HydrophobicContact CG-CE2 4.25Å; E180-G403 WeakPolarHBondContact OE1-CA 3.23Å; E180-F404 PolarHBondContact OE1-N 3.19Å
181	G	87.7	Confident	90	Very high	51 Å²	51	60.3 Å²	60.3	53%	0.526	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	25.8	176.6	0	0	0	0	0	114.7	V178 V179 V183	V178-G181 PolarHBondContact O-N 3.19Å; V179-G181 VanDerWaalsContact C-N 3.28Å; G181-V183 PolarHBondContact O-N 3.2Å
182	Y	86.6	Confident	89.8	Confident	167 Å²	167	62.5 Å²	62.5	66%	0.655	35%	0.346	S	S	*	.			trans	-70	-13.7	168.8	-68.2	-78.7	0	0	0	112.7	F176 A177 E180	F176-Y182 HydrophobicContact CD1-CD2 4.49Å; F176-Y182 HydrophobicContact CD1-CE2 4.15Å; F176-Y182 HydrophobicContact CE1-CD2 4.24Å; F176-Y182 AromaticContact CE1-CE2 3.49Å; F176-Y182 HydrophobicContact CE1-CE2 3.49Å; F176-Y182 VanDerWaalsContact CE1-CE2 3.49Å; F176-Y182 HydrophobicContact CZ-CE2 4.02Å; A177-Y182 WeakPolarHBondContact O-CB 3.31Å; A177-Y182 PolarHBondContact O-N 3.37Å; E180-Y182 HydrophobicContact CB-CD2 3.71Å; E180-Y182 HydrophobicContact CB-CE2 3.55Å; E180-Y182 HydrophobicContact CG-CE2 4.25Å
183	V	85.5	Confident	89.5	Confident	71 Å²	71	61 Å²	61	43%	0.43	34%	0.338	S	S	.	.	S	Bend	trans	-105.4	118.6	170.9	-176.1	0	0	0	0	107.7	V178 G181 I185	V178-V183 HydrophobicContact CG2-CG2 4.37Å; G181-V183 PolarHBondContact O-N 3.2Å; V183-I185 HydrophobicContact CG1-CD1 4.47Å; V183-I185 HydrophobicContact CG1-CG1 4.12Å; V183-I185 PolarHBondContact O-N 3.3Å; V183-I185 VanDerWaalsContact O-N 3.16Å
184	E	85.6	Confident	89.4	Confident	192 Å²	192	60 Å²	60	90%	0.897	33%	0.326	S	S	*	.			trans	-64.6	114.2	174.6	-68.1	-179.3	-177.3	0	0	109.8
185	I	86.4	Confident	89.4	Confident	30 Å²	30	59 Å²	59	15%	0.154	32%	0.323	C	S	.	.			trans	-126.5	126.4	178.4	-60.6	161.3	0	0	0	107.2	V178 V183 D187 L190 T193 V194	V178-I185 HydrophobicContact CG1-CD1 4.28Å; V183-I185 HydrophobicContact CG1-CD1 4.47Å; V183-I185 HydrophobicContact CG1-CG1 4.12Å; V183-I185 PolarHBondContact O-N 3.3Å; V183-I185 VanDerWaalsContact O-N 3.16Å; I185-D187 PolarHBondContact O-N 3.44Å; I185-L190 HydrophobicContact CB-CD1 4.11Å; I185-L190 HydrophobicContact CD1-CD1 4.35Å; I185-L190 HydrophobicContact CG2-CB 4.33Å; I185-L190 HydrophobicContact CG2-CD1 4.2Å; I185-T193 HydrophobicContact CD1-CG2 3.6Å; I185-T193 HydrophobicContact CG1-CG2 4.06Å; I185-T193 HydrophobicContact CG2-CG2 4.05Å; I185-V194 HydrophobicContact CD1-CG2 4.44Å
186	P	86.2	Confident	89.5	Confident	81 Å²	81	58.9 Å²	58.9	53%	0.526	32%	0.322	S	S	.	.			trans	-56.7	137.7	175.7	-24.2	33.5	0	0	0	111.8	S188 D189 L190	P186-S188 PolarHBondContact O-N 3.33Å; P186-D189 CarbonylContact O-C 3.49Å; P186-D189 PolarHBondContact O-N 3.23Å; P186-L190 PolarHBondContact O-N 3.02Å
187	D	84.1	Confident	89.5	Confident	122 Å²	122	56.1 Å²	56.1	65%	0.652	31%	0.311	S	S	*	.	H	α-helix	trans	-53.5	-34.5	-178.6	-70.1	-24.7	0	0	0	113.1	I185 D189 L190	I185-D187 PolarHBondContact O-N 3.44Å; D187-D189 VanDerWaalsContact C-N 3.25Å; D187-D189 PolarHBondContact O-N 3.25Å; D187-L190 PolarHBondContact O-N 3.37Å
188	S	82.7	Confident	89.5	Confident	79 Å²	79	55 Å²	55	55%	0.552	30%	0.302	S	S	*	.	H	α-helix	trans	-63.2	-29.7	177.6	56.8	0	0	0	0	113.8	P186	P186-S188 PolarHBondContact O-N 3.33Å
189	D	86.4	Confident	89.7	Confident	50 Å²	50	55.4 Å²	55.4	27%	0.267	30%	0.302	S	S	.	.	H	α-helix	trans	-107.1	-8.4	-178.6	-75.4	-30.5	0	0	0	112.8	P186 D187 F191 K192 T193	P186-D189 CarbonylContact O-C 3.49Å; P186-D189 PolarHBondContact O-N 3.23Å; D187-D189 VanDerWaalsContact C-N 3.25Å; D187-D189 PolarHBondContact O-N 3.25Å; D189-F191 PolarHBondContact O-N 2.8Å; D189-K192 PolarHBondContact O-N 3.25Å; D189-K192 VanDerWaalsContact O-N 3.13Å; D189-T193 WeakPolarHBondContact O-CB 3.26Å; D189-T193 PolarHBondContact O-N 2.95Å; D189-T193 PolarHBondContact O-OG1 3.37Å
190	L	90.5	Very high	89.9	Confident	54 Å²	54	54.5 Å²	54.5	28%	0.283	30%	0.296	S	S	.	.	H	α-helix	trans	-52.7	-51.6	-174.8	-178.7	67	0	0	0	112.4	I185 P186 D187 K192 T193 V194	I185-L190 HydrophobicContact CB-CD1 4.11Å; I185-L190 HydrophobicContact CD1-CD1 4.35Å; I185-L190 HydrophobicContact CG2-CB 4.33Å; I185-L190 HydrophobicContact CG2-CD1 4.2Å; P186-L190 PolarHBondContact O-N 3.02Å; D187-L190 PolarHBondContact O-N 3.37Å; L190-K192 PolarHBondContact O-N 3.23Å; L190-T193 PolarHBondContact O-N 3.5Å; L190-V194 HydrophobicContact CD1-CG2 3.7Å; L190-V194 HydrophobicContact CG-CG2 4.34Å; L190-V194 WeakPolarHBondContact O-CB 3.46Å; L190-V194 WeakPolarHBondContact O-CG2 3.39Å; L190-V194 PolarHBondContact O-N 2.94Å
191	F	90.7	Very high	90.1	Very high	17 Å²	17	51.5 Å²	51.5	8%	0.075	28%	0.282	C	S	.	.	H	α-helix	trans	-55.7	-49.5	178.2	171.2	-105	0	0	0	112.3	Y88 E89 Y92 W93 D189 S195	Y88-F191 HydrophobicContact CE1-CB 4.1Å; Y88-F191 HydrophobicContact CE1-CD2 4.39Å; Y88-F191 PolarHBondContact OH-N 2.95Å; Y88-F191 VanDerWaalsContact OH-N 3.13Å; E89-F191 HydrophobicContact CG-CE2 3.92Å; Y92-F191 HydrophobicContact CG-CB 4.21Å; W93-F191 HydrophobicContact CB-CE1 4.07Å; W93-F191 HydrophobicContact CB-CZ 3.74Å; W93-F191 AromaticContact CD1-CZ 3.99Å; W93-F191 HydrophobicContact CG-CZ 4.31Å; D189-F191 PolarHBondContact O-N 2.8Å; F191-S195 WeakPolarHBondContact O-CB 3.49Å; F191-S195 PolarHBondContact O-N 2.84Å; F191-S195 VanDerWaalsContact O-N 3.17Å; F191-S195 PolarHBondContact O-OG 3.34Å
192	K	91.5	Very high	90.5	Very high	46 Å²	46	49 Å²	49	20%	0.2	26%	0.257	C	S	.	.	H	α-helix	trans	-65	-43	-178.4	-63.9	-177.8	-172.9	-178	0	110.9	F139 D189 L190 F196	F139-K192 HydrophobicContact CD1-CB 4.05Å; F139-K192 HydrophobicContact CE1-CB 4.49Å; D189-K192 PolarHBondContact O-N 3.25Å; D189-K192 VanDerWaalsContact O-N 3.13Å; L190-K192 PolarHBondContact O-N 3.23Å; K192-F196 WeakPolarHBondContact O-CB 3.42Å; K192-F196 PolarHBondContact O-N 3.49Å
193	T	91.7	Very high	91	Very high	7 Å²	7	41.2 Å²	41.2	4%	0.043	23%	0.226	C	C	.	.	H	α-helix	trans	-66.2	-57	-175.5	-52.9	0	0	0	0	111.6	I143 I185 D189 L190 S195 F196 I197	I143-T193 HydrophobicContact CD1-CG2 3.71Å; I143-T193 WeakPolarHBondContact CD1-OG1 3.21Å; I143-T193 HydrophobicContact CG1-CG2 3.99Å; I143-T193 HydrophobicContact CG2-CG2 4.4Å; I185-T193 HydrophobicContact CD1-CG2 3.6Å; I185-T193 HydrophobicContact CG1-CG2 4.06Å; I185-T193 HydrophobicContact CG2-CG2 4.05Å; D189-T193 WeakPolarHBondContact O-CB 3.26Å; D189-T193 PolarHBondContact O-N 2.95Å; D189-T193 PolarHBondContact O-OG1 3.37Å; L190-T193 PolarHBondContact O-N 3.5Å; T193-S195 VanDerWaalsContact C-N 3.31Å; T193-S195 PolarHBondContact O-N 3.24Å; T193-F196 PolarHBondContact O-N 3.32Å; T193-I197 HydrophobicContact CG2-CD1 3.73Å; T193-I197 WeakPolarHBondContact O-CB 3.31Å; T193-I197 WeakPolarHBondContact O-CG1 3.48Å; T193-I197 PolarHBondContact O-N 3.2Å
194	V	92.5	Very high	91.6	Very high	41 Å²	41	37.8 Å²	37.8	25%	0.248	21%	0.206	C	C	.	.	H	α-helix	trans	-61.8	-43.9	-178	177.8	0	0	0	0	110.1	V178 V179 I185 L190 G198	V178-V194 HydrophobicContact CG1-CB 4.34Å; V178-V194 HydrophobicContact CG1-CG1 4.37Å; V178-V194 HydrophobicContact CG1-CG2 3.89Å; V179-V194 HydrophobicContact CG2-CG1 4.22Å; I185-V194 HydrophobicContact CD1-CG2 4.44Å; L190-V194 HydrophobicContact CD1-CG2 3.7Å; L190-V194 HydrophobicContact CG-CG2 4.34Å; L190-V194 WeakPolarHBondContact O-CB 3.46Å; L190-V194 WeakPolarHBondContact O-CG2 3.39Å; L190-V194 PolarHBondContact O-N 2.94Å; V194-G198 PolarHBondContact O-N 3.41Å
195	S	93	Very high	92.2	Very high	26 Å²	26	28.7 Å²	28.7	18%	0.182	16%	0.163	C	C	.	.	H	α-helix	trans	-63	-51.6	178.9	-54.4	0	0	0	0	111	F191 T193 I197 G198 Y199	F191-S195 WeakPolarHBondContact O-CB 3.49Å; F191-S195 PolarHBondContact O-N 2.84Å; F191-S195 VanDerWaalsContact O-N 3.17Å; F191-S195 PolarHBondContact O-OG 3.34Å; T193-S195 VanDerWaalsContact C-N 3.31Å; T193-S195 PolarHBondContact O-N 3.24Å; S195-I197 PolarHBondContact O-N 3.1Å; S195-G198 PolarHBondContact O-N 3.01Å; S195-Y199 WeakPolarHBondContact O-CD2 3.48Å; S195-Y199 PolarHBondContact O-N 3.27Å
196	F	94.8	Very high	92.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.2	-48.2	-177.6	-167.9	-105	0	0	0	111.8	C135 F139 I143 V144 T147 K192 T193 G198 Y199 K200 Y235	C135-F196 HydrophobicContact CB-CZ 4.25Å; F139-F196 HydrophobicContact CD1-CB 3.78Å; F139-F196 AromaticContact CD1-CD2 3.84Å; F139-F196 HydrophobicContact CD1-CD2 3.84Å; F139-F196 AromaticContact CD1-CG 3.93Å; F139-F196 HydrophobicContact CD1-CG 3.93Å; F139-F196 AromaticContact CD2-CD2 3.76Å; F139-F196 HydrophobicContact CD2-CD2 3.76Å; F139-F196 AromaticContact CD2-CE2 3.76Å; F139-F196 HydrophobicContact CD2-CE2 3.76Å; F139-F196 HydrophobicContact CD2-CG 4.42Å; F139-F196 HydrophobicContact CD2-CZ 4.42Å; F139-F196 HydrophobicContact CE1-CB 3.86Å; F139-F196 AromaticContact CE1-CD2 3.67Å; F139-F196 HydrophobicContact CE1-CD2 3.67Å; F139-F196 HydrophobicContact CE1-CG 4.09Å; F139-F196 AromaticContact CE2-CD2 3.58Å; F139-F196 HydrophobicContact CE2-CD2 3.58Å; F139-F196 AromaticContact CE2-CE2 3.67Å; F139-F196 HydrophobicContact CE2-CE2 3.67Å; F139-F196 HydrophobicContact CG-CB 4.44Å; F139-F196 AromaticContact CG-CD2 3.9Å; F139-F196 HydrophobicContact CG-CD2 3.9Å; F139-F196 HydrophobicContact CG-CE2 4.27Å; F139-F196 HydrophobicContact CG-CG 4.12Å; F139-F196 AromaticContact CZ-CD2 3.55Å; F139-F196 HydrophobicContact CZ-CD2 3.55Å; F139-F196 HydrophobicContact CZ-CE2 4.11Å; F139-F196 HydrophobicContact CZ-CG 4.4Å; I143-F196 HydrophobicContact CG2-CD1 3.88Å; V144-F196 HydrophobicContact CG2-CE1 4.19Å; V144-F196 HydrophobicContact CG2-CZ 4.36Å; T147-F196 HydrophobicContact CG2-CD1 3.99Å; T147-F196 HydrophobicContact CG2-CE1 4.18Å; T147-F196 WeakPolarHBondContact OG1-CE1 3.23Å; K192-F196 WeakPolarHBondContact O-CB 3.42Å; K192-F196 PolarHBondContact O-N 3.49Å; T193-F196 PolarHBondContact O-N 3.32Å; F196-G198 PolarHBondContact O-N 3.45Å; F196-Y199 PolarHBondContact O-N 2.84Å; F196-K200 HydrophobicContact CD1-CG 3.96Å; F196-K200 HydrophobicContact CE1-CD 4.22Å; F196-K200 HydrophobicContact CE1-CG 3.78Å; F196-K200 HydrophobicContact CE2-CD 4.26Å; F196-K200 HydrophobicContact CE2-CG 4.47Å; F196-K200 HydrophobicContact CG-CG 4.41Å; F196-K200 HydrophobicContact CZ-CD 3.97Å; F196-K200 HydrophobicContact CZ-CG 4.05Å; F196-K200 WeakPolarHBondContact O-CB 3.48Å; F196-K200 VanDerWaalsContact O-CG 3.27Å; F196-K200 WeakPolarHBondContact O-CG 3.48Å; F196-K200 PolarHBondContact O-N 3.36Å; F196-Y235 HydrophobicContact CZ-CE1 4.35Å
197	I	94.4	Very high	93.4	Very high	16 Å²	16	23.4 Å²	23.4	8%	0.082	13%	0.131	C	C	.	.	H	α-helix	trans	-58.6	-48.3	176.7	-66.1	171.4	0	0	0	110.3	I143 T147 V178 T193 S195 Y199 K200 M201	I143-I197 HydrophobicContact CG2-CD1 4.45Å; I143-I197 HydrophobicContact CG2-CG1 4.1Å; T147-I197 HydrophobicContact CG2-CB 4.43Å; T147-I197 HydrophobicContact CG2-CG1 3.78Å; V178-I197 HydrophobicContact CG1-CD1 4.26Å; V178-I197 HydrophobicContact CG2-CD1 4.07Å; V178-I197 HydrophobicContact CG2-CG2 4.31Å; T193-I197 HydrophobicContact CG2-CD1 3.73Å; T193-I197 WeakPolarHBondContact O-CB 3.31Å; T193-I197 WeakPolarHBondContact O-CG1 3.48Å; T193-I197 PolarHBondContact O-N 3.2Å; S195-I197 PolarHBondContact O-N 3.1Å; I197-Y199 PolarHBondContact O-N 2.6Å; I197-K200 PolarHBondContact O-N 3.36Å; I197-M201 HydrophobicContact CG2-CG 4.05Å; I197-M201 VanDerWaalsContact O-CG 3.29Å; I197-M201 WeakPolarHBondContact O-CG 3.29Å; I197-M201 PolarHBondContact O-N 3.2Å
198	G	94.6	Very high	94.1	Very high	5 Å²	5	17.6 Å²	17.6	5%	0.052	10%	0.1	C	C	.	.	H	α-helix	trans	-52.9	-55.4	179.6	0	0	0	0	0	112.9	V194 S195 F196 K200 M201 I202 W401	V194-G198 PolarHBondContact O-N 3.41Å; S195-G198 PolarHBondContact O-N 3.01Å; F196-G198 PolarHBondContact O-N 3.45Å; G198-K200 PolarHBondContact O-N 2.82Å; G198-M201 PolarHBondContact O-N 3.01Å; G198-I202 PolarHBondContact O-N 3.11Å; G198-I202 VanDerWaalsContact O-N 3.14Å; G198-W401 WeakPolarHBondContact O-CZ3 3.4Å
199	Y	95.9	Very high	94.8	Very high	25 Å²	25	14.1 Å²	14.1	10%	0.098	8%	0.075	C	C	.	.	H	α-helix	trans	-65.7	-38.5	179	-74.7	-81.4	0	0	0	112.2	S195 F196 I197 M201 I202 H203 L241 S242 I244 W401	S195-Y199 WeakPolarHBondContact O-CD2 3.48Å; S195-Y199 PolarHBondContact O-N 3.27Å; F196-Y199 PolarHBondContact O-N 2.84Å; I197-Y199 PolarHBondContact O-N 2.6Å; Y199-M201 VanDerWaalsContact C-N 3.34Å; Y199-M201 PolarHBondContact O-N 3.5Å; Y199-I202 PolarHBondContact O-N 3.01Å; Y199-H203 VanDerWaalsContact O-CG 3.29Å; Y199-H203 PolarHBondContact O-N 3.07Å; Y199-H203 PolarHBondContact O-ND1 2.95Å; Y199-L241 HydrophobicContact CD2-CD1 3.46Å; Y199-L241 VanDerWaalsContact CD2-CD1 3.46Å; Y199-L241 HydrophobicContact CD2-CG 4.32Å; Y199-L241 HydrophobicContact CE2-CD1 3.92Å; Y199-L241 HydrophobicContact CE2-CG 4.49Å; Y199-L241 HydrophobicContact CG-CD1 4.33Å; Y199-S242 VanDerWaalsContact CZ-N 3.3Å; Y199-S242 WeakPolarHBondContact OH-CA 3.34Å; Y199-I244 HydrophobicContact CD1-CD1 4.46Å; Y199-I244 HydrophobicContact CD1-CG1 3.84Å; Y199-I244 HydrophobicContact CE1-CD1 4.08Å; Y199-I244 HydrophobicContact CE1-CG1 3.68Å; Y199-W401 HydrophobicContact CE2-CZ2 4.46Å
200	K	96.3	Very high	95.3	Very high	1 Å²	1	14.2 Å²	14.2	0%	0.004	7%	0.072	C	C	.	.	H	α-helix	trans	-63.7	-38.2	175.8	-68.4	-45.5	112.2	167.2	0	111.9	T147 F196 I197 G198 H203 S204 L234 Q240	T147-K200 HydrophobicContact CG2-CB 4.18Å; T147-K200 HydrophobicContact CG2-CG 4.07Å; F196-K200 HydrophobicContact CD1-CG 3.96Å; F196-K200 HydrophobicContact CE1-CD 4.22Å; F196-K200 HydrophobicContact CE1-CG 3.78Å; F196-K200 HydrophobicContact CE2-CD 4.26Å; F196-K200 HydrophobicContact CE2-CG 4.47Å; F196-K200 HydrophobicContact CG-CG 4.41Å; F196-K200 HydrophobicContact CZ-CD 3.97Å; F196-K200 HydrophobicContact CZ-CG 4.05Å; F196-K200 WeakPolarHBondContact O-CB 3.48Å; F196-K200 VanDerWaalsContact O-CG 3.27Å; F196-K200 WeakPolarHBondContact O-CG 3.48Å; F196-K200 PolarHBondContact O-N 3.36Å; I197-K200 PolarHBondContact O-N 3.36Å; G198-K200 PolarHBondContact O-N 2.82Å; K200-H203 PolarHBondContact O-N 2.92Å; K200-S204 WeakPolarHBondContact O-CB 3.44Å; K200-S204 PolarHBondContact O-N 2.91Å; K200-S204 PolarHBondContact O-OG 2.88Å; K200-L234 PolarHBondContact NZ-O 2.62Å; K200-Q240 VanDerWaalsContact CE-O 3.3Å; K200-Q240 WeakPolarHBondContact CE-O 3.49Å; K200-Q240 PolarHBondContact NZ-O 2.9Å
201	M	95.5	Very high	95.7	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-67.2	-42.3	178.3	-68.3	-54.1	98.5	0	0	111.9	L150 M154 V171 L174 L175 I197 G198 Y199 S204 I205	L150-M201 HydrophobicContact CB-CE 4.06Å; L150-M201 HydrophobicContact CD1-CE 4.28Å; M154-M201 HydrophobicContact SD-SD 4.15Å; V171-M201 HydrophobicContact CG1-CB 4.27Å; L174-M201 HydrophobicContact CD1-SD 3.79Å; L175-M201 HydrophobicContact CD2-CB 4.13Å; L175-M201 HydrophobicContact CD2-CG 4.26Å; L175-M201 HydrophobicContact CG-CB 4.38Å; I197-M201 HydrophobicContact CG2-CG 4.05Å; I197-M201 VanDerWaalsContact O-CG 3.29Å; I197-M201 WeakPolarHBondContact O-CG 3.29Å; I197-M201 PolarHBondContact O-N 3.2Å; G198-M201 PolarHBondContact O-N 3.01Å; Y199-M201 VanDerWaalsContact C-N 3.34Å; Y199-M201 PolarHBondContact O-N 3.5Å; M201-S204 PolarHBondContact O-N 2.85Å; M201-I205 WeakPolarHBondContact O-CG2 3.5Å; M201-I205 PolarHBondContact O-N 3.34Å
202	I	96.4	Very high	96	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60.9	-46.9	174.6	-75.5	-176.1	0	0	0	111.5	G198 Y199 I205 S206 I244 L365 F368 F397 W401	G198-I202 PolarHBondContact O-N 3.11Å; G198-I202 VanDerWaalsContact O-N 3.14Å; Y199-I202 PolarHBondContact O-N 3.01Å; I202-I205 VanDerWaalsContact O-CG2 3.32Å; I202-I205 WeakPolarHBondContact O-CG2 3.37Å; I202-S206 WeakPolarHBondContact O-CB 3.48Å; I202-S206 PolarHBondContact O-N 3.44Å; I202-S206 VanDerWaalsContact O-N 3.11Å; I202-I244 HydrophobicContact CD1-CD1 3.68Å; I202-I244 HydrophobicContact CD1-CG1 4.49Å; I202-I244 HydrophobicContact CG2-CD1 4.31Å; I202-I244 HydrophobicContact CG2-CG1 4.21Å; I202-I244 HydrophobicContact CG2-CG2 3.8Å; I202-L365 HydrophobicContact CD1-CD1 4.23Å; I202-F368 HydrophobicContact CB-CE2 4.42Å; I202-F368 HydrophobicContact CG1-CE2 4.49Å; I202-F368 HydrophobicContact CG1-CZ 4.28Å; I202-F368 HydrophobicContact CG2-CD2 3.71Å; I202-F368 HydrophobicContact CG2-CE2 3.8Å; I202-F368 HydrophobicContact CG2-CG 4.25Å; I202-F368 HydrophobicContact CG2-CZ 4.4Å; I202-F397 HydrophobicContact CD1-CE1 4.46Å; I202-F397 HydrophobicContact CD1-CZ 4.08Å; I202-F397 HydrophobicContact CG1-CZ 4.14Å; I202-W401 HydrophobicContact CD1-CE3 3.81Å; I202-W401 HydrophobicContact CD1-CH2 3.55Å; I202-W401 HydrophobicContact CD1-CZ2 4.42Å; I202-W401 HydrophobicContact CD1-CZ3 3.19Å; I202-W401 HydrophobicContact CG1-CE3 4.44Å; I202-W401 HydrophobicContact CG1-CH2 4.36Å; I202-W401 HydrophobicContact CG1-CZ3 3.73Å
203	H	97.6	Very high	96.3	Very high	2 Å²	2	12.3 Å²	12.3	1%	0.009	7%	0.065	C	C	.	.	H	α-helix	trans	-67.6	-40.6	178	-62.2	149.5	0	0	0	111.1	Y199 K200 I205 S206 Y207 Y233 L234 Y239	Y199-H203 VanDerWaalsContact O-CG 3.29Å; Y199-H203 PolarHBondContact O-N 3.07Å; Y199-H203 PolarHBondContact O-ND1 2.95Å; K200-H203 PolarHBondContact O-N 2.92Å; H203-I205 PolarHBondContact O-N 3.36Å; H203-S206 WeakPolarHBondContact O-CB 3.2Å; H203-S206 PolarHBondContact O-N 2.87Å; H203-Y207 PolarHBondContact O-N 2.72Å; H203-Y233 HydrophobicContact CB-CD1 4.47Å; H203-Y233 HydrophobicContact CB-CE1 3.77Å; H203-Y233 AromaticContact CD2-CZ 3.9Å; H203-Y233 PolarHBondContact CD2-OH 3.1Å; H203-Y233 VanDerWaalsContact CD2-OH 3.29Å; H203-Y233 WeakPolarHBondContact O-CE1 3.29Å; H203-L234 HydrophobicContact CB-CD2 3.49Å; H203-L234 VanDerWaalsContact CB-CD2 3.49Å; H203-Y239 PolarHBondContact CE1-O 3Å
204	S	97.7	Very high	96.5	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61	-46.9	179.2	-59.6	0	0	0	0	112	S151 K200 M201 S206 Y207 C208	S151-S204 WeakPolarHBondContact CB-OG 3.22Å; S151-S204 PolarHBondContact OG-OG 3.16Å; K200-S204 WeakPolarHBondContact O-CB 3.44Å; K200-S204 PolarHBondContact O-N 2.91Å; K200-S204 PolarHBondContact O-OG 2.88Å; M201-S204 PolarHBondContact O-N 2.85Å; S204-S206 VanDerWaalsContact C-N 3.34Å; S204-S206 PolarHBondContact O-N 3.5Å; S204-Y207 PolarHBondContact O-N 3.06Å; S204-C208 WeakPolarHBondContact O-CB 3.21Å; S204-C208 PolarHBondContact O-N 2.99Å; S204-C208 PolarHBondContact O-SG 2.71Å
205	I	97.9	Very high	96.7	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-66.7	-37.6	178.4	-161.4	179.4	0	0	0	111.8	M154 L167 W168 V171 M201 I202 H203 Y207 C208 I209 F368	M154-I205 HydrophobicContact CE-CB 3.95Å; M154-I205 HydrophobicContact CE-CG1 4.47Å; L167-I205 HydrophobicContact CB-CG1 4.31Å; W168-I205 HydrophobicContact CD2-CD1 3.37Å; W168-I205 HydrophobicContact CE3-CD1 3.54Å; W168-I205 HydrophobicContact CG-CD1 3.85Å; W168-I205 HydrophobicContact CH2-CD1 4.13Å; W168-I205 HydrophobicContact CZ2-CD1 4Å; W168-I205 HydrophobicContact CZ3-CD1 3.91Å; V171-I205 HydrophobicContact CB-CD1 4.31Å; V171-I205 HydrophobicContact CG2-CB 3.92Å; V171-I205 HydrophobicContact CG2-CD1 4.06Å; V171-I205 HydrophobicContact CG2-CG1 4.24Å; M201-I205 WeakPolarHBondContact O-CG2 3.5Å; M201-I205 PolarHBondContact O-N 3.34Å; I202-I205 VanDerWaalsContact O-CG2 3.32Å; I202-I205 WeakPolarHBondContact O-CG2 3.37Å; H203-I205 PolarHBondContact O-N 3.36Å; I205-Y207 VanDerWaalsContact C-N 3.32Å; I205-Y207 PolarHBondContact O-N 3.11Å; I205-C208 PolarHBondContact O-N 3.33Å; I205-I209 HydrophobicContact CD1-CD1 4.35Å; I205-I209 HydrophobicContact CG1-CD1 3.96Å; I205-I209 HydrophobicContact CG1-CG1 4.27Å; I205-I209 WeakPolarHBondContact O-CB 3.3Å; I205-I209 VanDerWaalsContact O-CG1 3.31Å; I205-I209 WeakPolarHBondContact O-CG1 3.49Å; I205-I209 PolarHBondContact O-N 2.83Å; I205-F368 HydrophobicContact CG2-CE2 3.66Å; I205-F368 HydrophobicContact CG2-CZ 3.84Å
206	S	98.3	Very high	96.9	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-58.6	-44.6	175.6	178.5	0	0	0	0	111.6	I202 H203 S204 Y210 I246 Y247 Y372	I202-S206 WeakPolarHBondContact O-CB 3.48Å; I202-S206 PolarHBondContact O-N 3.44Å; I202-S206 VanDerWaalsContact O-N 3.11Å; H203-S206 WeakPolarHBondContact O-CB 3.2Å; H203-S206 PolarHBondContact O-N 2.87Å; S204-S206 VanDerWaalsContact C-N 3.34Å; S204-S206 PolarHBondContact O-N 3.5Å; S206-Y210 PolarHBondContact O-N 2.83Å; S206-I246 WeakPolarHBondContact OG-CA 3.34Å; S206-Y247 PolarHBondContact OG-N 3.23Å; S206-Y372 PolarHBondContact O-OH 3.14Å; S206-Y372 WeakPolarHBondContact OG-CE2 3.39Å; S206-Y372 PolarHBondContact OG-OH 3.46Å
207	Y	98.5	Very high	96.9	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-68.6	-45.7	176.4	-171.9	-99.8	0	0	0	112.5	L155 H203 S204 I205 I209 Y210 V211 R221 D226 D229 M230 Y233 Y247	L155-Y207 HydrophobicContact CD1-CD1 4.29Å; L155-Y207 HydrophobicContact CD1-CE1 3.91Å; H203-Y207 PolarHBondContact O-N 2.72Å; S204-Y207 PolarHBondContact O-N 3.06Å; I205-Y207 VanDerWaalsContact C-N 3.32Å; I205-Y207 PolarHBondContact O-N 3.11Å; Y207-I209 VanDerWaalsContact C-N 3.34Å; Y207-I209 PolarHBondContact O-N 3.37Å; Y207-Y210 WeakPolarHBondContact O-CA 3.47Å; Y207-Y210 VanDerWaalsContact O-CB 3.31Å; Y207-Y210 WeakPolarHBondContact O-CB 3.48Å; Y207-Y210 PolarHBondContact O-N 3.1Å; Y207-V211 HydrophobicContact CD1-CG2 3.95Å; Y207-V211 HydrophobicContact CE1-CG2 3.41Å; Y207-V211 VanDerWaalsContact CE1-CG2 3.41Å; Y207-V211 PolarHBondContact O-N 3.33Å; Y207-R221 PolarHBondContact OH-NH2 2.65Å; Y207-D226 HydrophobicContact CE1-CB 4.49Å; Y207-D226 WeakPolarHBondContact CE1-O 3.44Å; Y207-D226 WeakPolarHBondContact OH-CA 3.03Å; Y207-D226 PolarHBondContact OH-O 3.04Å; Y207-D229 HydrophobicContact CE2-CB 3.94Å; Y207-D229 VanDerWaalsContact OH-CB 3.26Å; Y207-D229 WeakPolarHBondContact OH-CB 3.13Å; Y207-M230 HydrophobicContact CD1-CB 3.62Å; Y207-M230 HydrophobicContact CD1-CG 3.63Å; Y207-M230 HydrophobicContact CD1-SD 4.2Å; Y207-M230 HydrophobicContact CE1-CB 3.52Å; Y207-M230 HydrophobicContact CE1-CG 4.06Å; Y207-M230 HydrophobicContact CE2-CB 4.49Å; Y207-M230 HydrophobicContact CG-CB 4.2Å; Y207-M230 HydrophobicContact CG-CG 4.11Å; Y207-Y233 HydrophobicContact CD2-CD1 4.2Å; Y207-Y233 HydrophobicContact CG-CD1 4.44Å; Y207-Y247 HydrophobicContact CD2-CD1 4.04Å; Y207-Y247 AromaticContact CD2-CD2 3.46Å; Y207-Y247 HydrophobicContact CD2-CD2 3.46Å; Y207-Y247 VanDerWaalsContact CD2-CD2 3.46Å; Y207-Y247 HydrophobicContact CD2-CE1 4.15Å; Y207-Y247 AromaticContact CD2-CE2 3.54Å; Y207-Y247 HydrophobicContact CD2-CE2 3.54Å; Y207-Y247 AromaticContact CD2-CG 3.7Å; Y207-Y247 HydrophobicContact CD2-CG 3.7Å; Y207-Y247 AromaticContact CD2-CZ 3.89Å; Y207-Y247 HydrophobicContact CE2-CD1 4.35Å; Y207-Y247 AromaticContact CE2-CD2 3.94Å; Y207-Y247 HydrophobicContact CE2-CD2 3.94Å; Y207-Y247 AromaticContact CE2-CE1 3.99Å; Y207-Y247 HydrophobicContact CE2-CE1 3.99Å; Y207-Y247 AromaticContact CE2-CE2 3.48Å; Y207-Y247 HydrophobicContact CE2-CE2 3.48Å; Y207-Y247 VanDerWaalsContact CE2-CE2 3.48Å; Y207-Y247 HydrophobicContact CE2-CG 4.32Å; Y207-Y247 AromaticContact CE2-CZ 3.52Å
208	C	98.5	Very high	97	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.4	-38.7	-178.3	-69.9	0	0	0	0	112.4	M154 A158 L167 S204 I205 Y210 V211 I212	M154-C208 VanDerWaalsContact C-SG 3.59Å; A158-C208 HydrophobicContact CB-CB 3.76Å; L167-C208 HydrophobicContact CD1-CB 3.58Å; L167-C208 HydrophobicContact CD2-CB 4.21Å; S204-C208 WeakPolarHBondContact O-CB 3.21Å; S204-C208 PolarHBondContact O-N 2.99Å; S204-C208 PolarHBondContact O-SG 2.71Å; I205-C208 PolarHBondContact O-N 3.33Å; C208-Y210 VanDerWaalsContact C-N 3.33Å; C208-V211 PolarHBondContact O-N 3.23Å; C208-I212 WeakPolarHBondContact O-CG1 3.34Å; C208-I212 PolarHBondContact O-N 2.86Å; C208-I212 VanDerWaalsContact O-N 3.07Å
209	I	98.1	Very high	96.9	Very high	7 Å²	7	30.2 Å²	30.2	4%	0.036	17%	0.165	C	C	.	.	H	α-helix	trans	-62.5	-42	172.6	-70.7	171.6	0	0	0	110.6	K164 I205 Y207 V211 I212 D213 Y372	K164-I209 HydrophobicContact CD-CG2 4.36Å; I205-I209 HydrophobicContact CD1-CD1 4.35Å; I205-I209 HydrophobicContact CG1-CD1 3.96Å; I205-I209 HydrophobicContact CG1-CG1 4.27Å; I205-I209 WeakPolarHBondContact O-CB 3.3Å; I205-I209 VanDerWaalsContact O-CG1 3.31Å; I205-I209 WeakPolarHBondContact O-CG1 3.49Å; I205-I209 PolarHBondContact O-N 2.83Å; Y207-I209 VanDerWaalsContact C-N 3.34Å; Y207-I209 PolarHBondContact O-N 3.37Å; I209-V211 VanDerWaalsContact C-N 3.34Å; I209-V211 PolarHBondContact O-N 3.37Å; I209-I212 PolarHBondContact O-N 3.17Å; I209-D213 WeakPolarHBondContact CG2-OD2 3.45Å; I209-D213 WeakPolarHBondContact O-CB 3.31Å; I209-D213 PolarHBondContact O-N 2.94Å; I209-Y372 HydrophobicContact CB-CD1 4.39Å; I209-Y372 HydrophobicContact CB-CE1 4.16Å; I209-Y372 HydrophobicContact CD1-CD1 3.65Å; I209-Y372 HydrophobicContact CD1-CE1 4.22Å; I209-Y372 HydrophobicContact CD1-CG 4.12Å; I209-Y372 HydrophobicContact CG2-CD1 3.98Å; I209-Y372 HydrophobicContact CG2-CE1 3.82Å
210	Y	97.8	Very high	96.8	Very high	52 Å²	52	33.7 Å²	33.7	20%	0.204	19%	0.191	C	C	.	.	H	α-helix	trans	-59.5	-43.3	175	169.1	-89.6	0	0	0	112	S206 Y207 C208 I212 D213 S214 Y247 P248	S206-Y210 PolarHBondContact O-N 2.83Å; Y207-Y210 WeakPolarHBondContact O-CA 3.47Å; Y207-Y210 VanDerWaalsContact O-CB 3.31Å; Y207-Y210 WeakPolarHBondContact O-CB 3.48Å; Y207-Y210 PolarHBondContact O-N 3.1Å; C208-Y210 VanDerWaalsContact C-N 3.33Å; Y210-I212 PolarHBondContact O-N 3.12Å; Y210-D213 PolarHBondContact O-N 2.88Å; Y210-S214 WeakPolarHBondContact O-CB 3.22Å; Y210-S214 PolarHBondContact O-N 2.92Å; Y210-Y247 AromaticContact CD1-CD1 3.69Å; Y210-Y247 HydrophobicContact CD1-CD1 3.69Å; Y210-Y247 AromaticContact CD1-CE1 3.35Å; Y210-Y247 HydrophobicContact CD1-CE1 3.35Å; Y210-Y247 AromaticContact CD2-CD1 3.74Å; Y210-Y247 HydrophobicContact CD2-CD1 3.74Å; Y210-Y247 AromaticContact CD2-CE1 3.79Å; Y210-Y247 HydrophobicContact CD2-CE1 3.79Å; Y210-Y247 HydrophobicContact CE1-CD1 4.23Å; Y210-Y247 AromaticContact CE1-CE1 3.45Å; Y210-Y247 HydrophobicContact CE1-CE1 3.45Å; Y210-Y247 VanDerWaalsContact CE1-CE1 3.45Å; Y210-Y247 HydrophobicContact CE2-CD1 4.24Å; Y210-Y247 AromaticContact CE2-CE1 3.85Å; Y210-Y247 HydrophobicContact CE2-CE1 3.85Å; Y210-Y247 AromaticContact CG-CD1 3.43Å; Y210-Y247 HydrophobicContact CG-CD1 3.43Å; Y210-Y247 VanDerWaalsContact CG-CD1 3.43Å; Y210-Y247 AromaticContact CG-CE1 3.54Å; Y210-Y247 HydrophobicContact CG-CE1 3.54Å; Y210-Y247 AromaticContact CZ-CE1 3.69Å; Y210-P248 HydrophobicContact CD2-CG 4.39Å
211	V	98.1	Very high	96.8	Very high	6 Å²	6	35.8 Å²	35.8	4%	0.036	20%	0.198	C	C	.	.	H	α-helix	trans	-60.6	-45.5	177.2	172.1	0	0	0	0	111.2	L155 R159 Y207 C208 I209 S215	L155-V211 HydrophobicContact CD1-CG1 4.48Å; L155-V211 HydrophobicContact CD1-CG2 4.03Å; R159-V211 HydrophobicContact CG-CG1 3.92Å; Y207-V211 HydrophobicContact CD1-CG2 3.95Å; Y207-V211 HydrophobicContact CE1-CG2 3.41Å; Y207-V211 VanDerWaalsContact CE1-CG2 3.41Å; Y207-V211 PolarHBondContact O-N 3.33Å; C208-V211 PolarHBondContact O-N 3.23Å; I209-V211 VanDerWaalsContact C-N 3.34Å; I209-V211 PolarHBondContact O-N 3.37Å; V211-S215 WeakPolarHBondContact O-CB 3.44Å; V211-S215 PolarHBondContact O-N 3.34Å
212	I	98	Very high	96.8	Very high	11 Å²	11	40.2 Å²	40.2	6%	0.056	23%	0.227	C	C	.	.	H	α-helix	trans	-59.6	-50.6	176.4	-68.2	172.5	0	0	0	110.6	A158 K164 L167 C208 I209 Y210 S215 A216	A158-I212 HydrophobicContact CB-CD1 4.29Å; A158-I212 HydrophobicContact CB-CG1 4.13Å; A158-I212 WeakPolarHBondContact O-CG1 3.34Å; K164-I212 HydrophobicContact CG-CD1 4.05Å; K164-I212 HydrophobicContact CG-CG2 4.36Å; L167-I212 HydrophobicContact CD1-CD1 3.53Å; C208-I212 WeakPolarHBondContact O-CG1 3.34Å; C208-I212 PolarHBondContact O-N 2.86Å; C208-I212 VanDerWaalsContact O-N 3.07Å; I209-I212 PolarHBondContact O-N 3.17Å; Y210-I212 PolarHBondContact O-N 3.12Å; I212-S215 PolarHBondContact O-N 3.39Å; I212-A216 WeakPolarHBondContact O-CB 3.47Å; I212-A216 PolarHBondContact O-N 3.06Å
213	D	96.8	Very high	96.8	Very high	59 Å²	59	43.3 Å²	43.3	32%	0.316	24%	0.241	S	C	.	.	H	α-helix	trans	-67.5	-38.4	-175.9	-77.4	-31	0	0	0	112.9	K164 I209 Y210 K217	K164-D213 WeakPolarHBondContact CE-OD1 3.49Å; K164-D213 IonicContact NZ-OD1 2.8Å; K164-D213 PolarHBondContact NZ-OD1 3.3Å; K164-D213 IonicContact NZ-OD2 3.26Å; K164-D213 PolarHBondContact NZ-OD2 3.49Å; I209-D213 WeakPolarHBondContact CG2-OD2 3.45Å; I209-D213 WeakPolarHBondContact O-CB 3.31Å; I209-D213 PolarHBondContact O-N 2.94Å; Y210-D213 PolarHBondContact O-N 2.88Å; D213-K217 WeakPolarHBondContact O-CG 3.5Å; D213-K217 PolarHBondContact O-N 2.77Å
214	S	96.5	Very high	96.8	Very high	17 Å²	17	49.5 Å²	49.5	12%	0.119	27%	0.271	C	S	.	.	H	α-helix	trans	-70	-43.2	176.5	-170.5	0	0	0	0	111.1	Y210 A216 K217 H218	Y210-S214 WeakPolarHBondContact O-CB 3.22Å; Y210-S214 PolarHBondContact O-N 2.92Å; S214-A216 VanDerWaalsContact C-N 3.31Å; S214-A216 PolarHBondContact O-N 2.65Å; S214-K217 PolarHBondContact O-N 2.92Å; S214-K217 VanDerWaalsContact O-N 3.13Å; S214-H218 PolarHBondContact O-N 3.13Å
215	S	96.5	Very high	96.7	Very high	23 Å²	23	54.9 Å²	54.9	16%	0.161	30%	0.295	C	S	.	.	H	α-helix	trans	-63.2	-37	177	-173.2	0	0	0	0	112.4	V211 I212 K217 G219	V211-S215 WeakPolarHBondContact O-CB 3.44Å; V211-S215 PolarHBondContact O-N 3.34Å; I212-S215 PolarHBondContact O-N 3.39Å; S215-K217 VanDerWaalsContact C-N 3.28Å; S215-K217 PolarHBondContact O-N 3.15Å; S215-G219 WeakPolarHBondContact CA-O 3.29Å; S215-G219 WeakPolarHBondContact O-CA 3.41Å; S215-G219 PolarHBondContact O-N 3.24Å
216	A	95.9	Very high	96.7	Very high	86 Å²	86	55 Å²	55	71%	0.711	30%	0.295	S	S	*	.	H	α-helix	trans	-67.3	-28.6	176.3	0	0	0	0	0	112.9	I212 S214	I212-A216 WeakPolarHBondContact O-CB 3.47Å; I212-A216 PolarHBondContact O-N 3.06Å; S214-A216 VanDerWaalsContact C-N 3.31Å; S214-A216 PolarHBondContact O-N 2.65Å
217	K	95.8	Very high	96.7	Very high	160 Å²	160	56.8 Å²	56.8	70%	0.696	30%	0.303	S	S	*	.	H	α-helix	trans	-94	-37.8	-177.6	-70.4	176.4	-177.2	178.7	0	114.2	D213 S214 S215	D213-K217 WeakPolarHBondContact O-CG 3.5Å; D213-K217 PolarHBondContact O-N 2.77Å; S214-K217 PolarHBondContact O-N 2.92Å; S214-K217 VanDerWaalsContact O-N 3.13Å; S215-K217 VanDerWaalsContact C-N 3.28Å; S215-K217 PolarHBondContact O-N 3.15Å
218	H	95.3	Very high	96.6	Very high	158 Å²	158	59.8 Å²	59.8	73%	0.731	32%	0.321	S	S	*	.	H	α-helix	trans	-125.2	2.3	-168.6	-57.8	-55.7	0	0	0	113.4	S214	S214-H218 PolarHBondContact O-N 3.13Å
219	G	94.2	Very high	96.5	Very high	28 Å²	28	61.7 Å²	61.7	29%	0.289	33%	0.331	S	S	.	.			trans	79.9	167.7	-173.1	0	0	0	0	0	113.2	S215	S215-G219 WeakPolarHBondContact CA-O 3.29Å; S215-G219 WeakPolarHBondContact O-CA 3.41Å; S215-G219 PolarHBondContact O-N 3.24Å
220	P	93.8	Very high	96.5	Very high	98 Å²	98	61.3 Å²	61.3	64%	0.636	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-71	136.7	-174.5	28.6	-34.4	0	0	0	111.9
221	R	95.1	Very high	96.4	Very high	44 Å²	44	60.1 Å²	60.1	17%	0.166	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-81.6	159.8	169.6	-57.7	-167.4	-58.2	162.5	9.6	110.5	R159 Y207 F223 D226 D229	R159-R221 PolarHBondContact NH1-O 2.99Å; R159-R221 PolarHBondContact NH2-O 3.44Å; Y207-R221 PolarHBondContact OH-NH2 2.65Å; R221-F223 PolarHBondContact O-N 2.76Å; R221-D226 IonicContact CZ-OD1 3.84Å; R221-D226 IonicContact NE-OD1 3.77Å; R221-D226 PolarHBondContact NE-OD1 3.37Å; R221-D226 IonicContact NH2-OD1 3.63Å; R221-D226 PolarHBondContact NH2-OD1 2.84Å; R221-D229 IonicContact CZ-OD2 3.76Å; R221-D229 VanDerWaalsContact CZ-OD2 3.26Å; R221-D229 IonicContact NH1-OD2 3.07Å; R221-D229 PolarHBondContact NH1-OD2 3.41Å; R221-D229 IonicContact NH2-OD2 2.6Å; R221-D229 PolarHBondContact NH2-OD2 3.18Å
222	P	96.7	Very high	96.4	Very high	93 Å²	93	60.8 Å²	60.8	60%	0.604	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-55.8	138.6	170.2	-24.6	34.5	0	0	0	111.3	M224 K225 D226	P222-M224 VanDerWaalsContact C-N 3.31Å; P222-M224 PolarHBondContact O-N 3.14Å; P222-K225 WeakPolarHBondContact O-CB 3.33Å; P222-K225 PolarHBondContact O-N 3.5Å; P222-D226 PolarHBondContact O-N 3.46Å
223	F	96.4	Very high	96.4	Very high	66 Å²	66	60.5 Å²	60.5	29%	0.289	33%	0.327	S	S	.	.	H	α-helix	trans	-53.7	-46.3	-176.7	172.7	-98.2	0	0	0	112.4	L155 L156 R221 K225 D226 F227	L155-F223 HydrophobicContact CD2-CE2 4.07Å; L155-F223 HydrophobicContact CG-CE2 4.49Å; L156-F223 HydrophobicContact CD2-CD2 4.4Å; L156-F223 HydrophobicContact CD2-CE2 3.72Å; L156-F223 HydrophobicContact CD2-CZ 4.36Å; R221-F223 PolarHBondContact O-N 2.76Å; F223-K225 PolarHBondContact O-N 3.07Å; F223-D226 PolarHBondContact O-N 2.74Å; F223-D226 VanDerWaalsContact O-N 3.12Å; F223-F227 HydrophobicContact CD1-CB 4.49Å; F223-F227 HydrophobicContact CE1-CB 4.1Å; F223-F227 HydrophobicContact CE1-CD2 4.44Å; F223-F227 HydrophobicContact CE1-CG 4.22Å; F223-F227 HydrophobicContact CZ-CB 4.23Å; F223-F227 HydrophobicContact CZ-CD2 4.04Å; F223-F227 HydrophobicContact CZ-CG 4.26Å; F223-F227 WeakPolarHBondContact O-CB 3.48Å; F223-F227 PolarHBondContact O-N 2.89Å
224	M	96.6	Very high	96.4	Very high	131 Å²	131	57.7 Å²	57.7	65%	0.645	31%	0.312	S	S	*	.	H	α-helix	trans	-62	-29.6	-178.5	-68.5	-59.7	168.8	0	0	113.1	P222 V228	P222-M224 VanDerWaalsContact C-N 3.31Å; P222-M224 PolarHBondContact O-N 3.14Å; M224-V228 WeakPolarHBondContact O-CB 3.04Å; M224-V228 VanDerWaalsContact O-CG2 3.24Å; M224-V228 WeakPolarHBondContact O-CG2 3.19Å; M224-V228 PolarHBondContact O-N 3.34Å
225	K	96.2	Very high	96.4	Very high	113 Å²	113	57.2 Å²	57.2	49%	0.491	31%	0.307	S	S	.	.	H	α-helix	trans	-69.5	-47.3	174.9	-175.9	173.9	-179.1	175.1	0	110.9	P222 F223 F227 D229	P222-K225 WeakPolarHBondContact O-CB 3.33Å; P222-K225 PolarHBondContact O-N 3.5Å; F223-K225 PolarHBondContact O-N 3.07Å; K225-F227 VanDerWaalsContact C-N 3.3Å; K225-F227 PolarHBondContact O-N 3.46Å; K225-D229 WeakPolarHBondContact O-CB 3.4Å; K225-D229 VanDerWaalsContact O-CG 3.27Å; K225-D229 PolarHBondContact O-N 2.93Å
226	D	97.4	Very high	96.4	Very high	3 Å²	3	56.1 Å²	56.1	2%	0.016	30%	0.3	C	S	.	.	H	α-helix	trans	-63	-40.3	176.2	-73.8	-14.9	0	0	0	111.7	L155 R159 Y207 R221 P222 F223 M230	L155-D226 HydrophobicContact CD1-CB 4.23Å; L155-D226 HydrophobicContact CD2-CB 4.41Å; R159-D226 IonicContact CZ-OD2 4Å; R159-D226 IonicContact NH1-OD2 3.89Å; R159-D226 PolarHBondContact NH1-OD2 3.47Å; Y207-D226 HydrophobicContact CE1-CB 4.49Å; Y207-D226 WeakPolarHBondContact CE1-O 3.44Å; Y207-D226 WeakPolarHBondContact OH-CA 3.03Å; Y207-D226 PolarHBondContact OH-O 3.04Å; R221-D226 IonicContact CZ-OD1 3.84Å; R221-D226 IonicContact NE-OD1 3.77Å; R221-D226 PolarHBondContact NE-OD1 3.37Å; R221-D226 IonicContact NH2-OD1 3.63Å; R221-D226 PolarHBondContact NH2-OD1 2.84Å; P222-D226 PolarHBondContact O-N 3.46Å; F223-D226 PolarHBondContact O-N 2.74Å; F223-D226 VanDerWaalsContact O-N 3.12Å; D226-M230 VanDerWaalsContact O-CB 3.28Å; D226-M230 WeakPolarHBondContact O-CB 3.08Å; D226-M230 PolarHBondContact O-N 3.33Å
227	F	97.7	Very high	96.5	Very high	37 Å²	37	52 Å²	52	16%	0.162	27%	0.266	C	S	.	.	H	α-helix	trans	-64	-47.5	-179.9	-171.8	-111.5	0	0	0	112	F148 T152 L155 F223 K225 M230 L231	F148-F227 HydrophobicContact CE2-CZ 4.05Å; F148-F227 AromaticContact CZ-CZ 3.71Å; F148-F227 HydrophobicContact CZ-CZ 3.71Å; T152-F227 HydrophobicContact CG2-CE2 4.01Å; L155-F227 HydrophobicContact CD2-CB 4.24Å; L155-F227 HydrophobicContact CD2-CD2 4.03Å; F223-F227 HydrophobicContact CD1-CB 4.49Å; F223-F227 HydrophobicContact CE1-CB 4.1Å; F223-F227 HydrophobicContact CE1-CD2 4.44Å; F223-F227 HydrophobicContact CE1-CG 4.22Å; F223-F227 HydrophobicContact CZ-CB 4.23Å; F223-F227 HydrophobicContact CZ-CD2 4.04Å; F223-F227 HydrophobicContact CZ-CG 4.26Å; F223-F227 WeakPolarHBondContact O-CB 3.48Å; F223-F227 PolarHBondContact O-N 2.89Å; K225-F227 VanDerWaalsContact C-N 3.3Å; K225-F227 PolarHBondContact O-N 3.46Å; F227-M230 HydrophobicContact CD2-CE 3.92Å; F227-M230 HydrophobicContact CE2-CE 3.98Å; F227-M230 WeakPolarHBondContact O-CB 3.18Å; F227-M230 PolarHBondContact O-N 3.02Å; F227-L231 HydrophobicContact CD1-CD1 4.08Å; F227-L231 HydrophobicContact CE1-CD1 3.6Å; F227-L231 HydrophobicContact CE1-CG 4.35Å; F227-L231 HydrophobicContact CZ-CD1 3.91Å; F227-L231 HydrophobicContact CZ-CD2 4.45Å; F227-L231 HydrophobicContact CZ-CG 4.36Å; F227-L231 WeakPolarHBondContact O-CG 3.27Å; F227-L231 PolarHBondContact O-N 3.12Å
228	V	96.5	Very high	96.6	Very high	63 Å²	63	44.4 Å²	44.4	38%	0.382	23%	0.233	S	C	.	.	H	α-helix	trans	-65.1	-44	177.7	171.1	0	0	0	0	111.6	M128 M224 M230 L231 W232	M128-V228 HydrophobicContact CE-CG1 4.18Å; M128-V228 HydrophobicContact SD-CG1 4.19Å; M224-V228 WeakPolarHBondContact O-CB 3.04Å; M224-V228 VanDerWaalsContact O-CG2 3.24Å; M224-V228 WeakPolarHBondContact O-CG2 3.19Å; M224-V228 PolarHBondContact O-N 3.34Å; V228-M230 VanDerWaalsContact C-N 3.28Å; V228-M230 PolarHBondContact O-N 2.95Å; V228-L231 PolarHBondContact O-N 3Å; V228-W232 WeakPolarHBondContact O-CB 3.44Å; V228-W232 PolarHBondContact O-N 3.15Å
229	D	97.2	Very high	96.6	Very high	40 Å²	40	37 Å²	37	21%	0.214	20%	0.199	C	C	.	.	H	α-helix	trans	-60.2	-39.5	176	-75.8	-7	0	0	0	111.3	Y207 R221 K225 Y233	Y207-D229 HydrophobicContact CE2-CB 3.94Å; Y207-D229 VanDerWaalsContact OH-CB 3.26Å; Y207-D229 WeakPolarHBondContact OH-CB 3.13Å; R221-D229 IonicContact CZ-OD2 3.76Å; R221-D229 VanDerWaalsContact CZ-OD2 3.26Å; R221-D229 IonicContact NH1-OD2 3.07Å; R221-D229 PolarHBondContact NH1-OD2 3.41Å; R221-D229 IonicContact NH2-OD2 2.6Å; R221-D229 PolarHBondContact NH2-OD2 3.18Å; K225-D229 WeakPolarHBondContact O-CB 3.4Å; K225-D229 VanDerWaalsContact O-CG 3.27Å; K225-D229 PolarHBondContact O-N 2.93Å; D229-Y233 WeakPolarHBondContact O-CB 3.32Å; D229-Y233 PolarHBondContact O-N 2.92Å
230	M	97.9	Very high	96.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-50.5	175.2	-172.4	-177.9	67.8	0	0	111.1	L155 Y207 D226 F227 V228 W232 Y233 L234	L155-M230 HydrophobicContact CB-CE 4.39Å; L155-M230 HydrophobicContact CB-SD 3.85Å; L155-M230 HydrophobicContact CD2-CE 4.07Å; L155-M230 HydrophobicContact CD2-SD 4.03Å; L155-M230 HydrophobicContact CG-SD 4.4Å; Y207-M230 HydrophobicContact CD1-CB 3.62Å; Y207-M230 HydrophobicContact CD1-CG 3.63Å; Y207-M230 HydrophobicContact CD1-SD 4.2Å; Y207-M230 HydrophobicContact CE1-CB 3.52Å; Y207-M230 HydrophobicContact CE1-CG 4.06Å; Y207-M230 HydrophobicContact CE2-CB 4.49Å; Y207-M230 HydrophobicContact CG-CB 4.2Å; Y207-M230 HydrophobicContact CG-CG 4.11Å; D226-M230 VanDerWaalsContact O-CB 3.28Å; D226-M230 WeakPolarHBondContact O-CB 3.08Å; D226-M230 PolarHBondContact O-N 3.33Å; F227-M230 HydrophobicContact CD2-CE 3.92Å; F227-M230 HydrophobicContact CE2-CE 3.98Å; F227-M230 WeakPolarHBondContact O-CB 3.18Å; F227-M230 PolarHBondContact O-N 3.02Å; V228-M230 VanDerWaalsContact C-N 3.28Å; V228-M230 PolarHBondContact O-N 2.95Å; M230-W232 VanDerWaalsContact C-N 3.33Å; M230-W232 PolarHBondContact O-N 3.02Å; M230-Y233 PolarHBondContact O-N 3.17Å; M230-L234 HydrophobicContact CE-CD1 4.3Å; M230-L234 HydrophobicContact CG-CD1 3.6Å; M230-L234 HydrophobicContact CG-CG 3.99Å; M230-L234 WeakPolarHBondContact O-CB 3.13Å; M230-L234 VanDerWaalsContact O-CG 3.26Å; M230-L234 WeakPolarHBondContact O-CG 3.41Å; M230-L234 PolarHBondContact O-N 2.79Å; M230-L234 HydrophobicContact SD-CD1 4.09Å
231	L	96.8	Very high	96.5	Very high	27 Å²	27	31.2 Å²	31.2	14%	0.141	16%	0.155	C	C	.	.	H	α-helix	trans	-63.1	-41.5	179.7	-64.8	-177.8	0	0	0	111.6	M128 F148 F227 V228 Y233 L234 Y235	M128-L231 HydrophobicContact SD-CB 4.4Å; F148-L231 HydrophobicContact CD2-CD2 3.86Å; F148-L231 HydrophobicContact CE2-CD1 4.2Å; F148-L231 HydrophobicContact CE2-CD2 3.55Å; F227-L231 HydrophobicContact CD1-CD1 4.08Å; F227-L231 HydrophobicContact CE1-CD1 3.6Å; F227-L231 HydrophobicContact CE1-CG 4.35Å; F227-L231 HydrophobicContact CZ-CD1 3.91Å; F227-L231 HydrophobicContact CZ-CD2 4.45Å; F227-L231 HydrophobicContact CZ-CG 4.36Å; F227-L231 WeakPolarHBondContact O-CG 3.27Å; F227-L231 PolarHBondContact O-N 3.12Å; V228-L231 PolarHBondContact O-N 3Å; L231-Y233 PolarHBondContact O-N 3.33Å; L231-L234 PolarHBondContact O-N 2.98Å; L231-Y235 HydrophobicContact CB-CD2 4.42Å; L231-Y235 HydrophobicContact CD2-CD2 4.08Å; L231-Y235 HydrophobicContact CD2-CE2 3.7Å; L231-Y235 WeakPolarHBondContact O-CB 3.46Å; L231-Y235 WeakPolarHBondContact O-CD2 3.04Å; L231-Y235 PolarHBondContact O-N 3.4Å; L231-Y235 VanDerWaalsContact O-N 3.08Å
232	W	96.8	Very high	96.4	Very high	20 Å²	20	29.5 Å²	29.5	8%	0.076	15%	0.15	C	C	.	.	H	α-helix	trans	-57.5	-39.7	175.6	-172.8	-107.7	0	0	0	112.1	F111 W123 Q124 M127 M128 W131 V228 M230 Y236 F250 M254	F111-W232 HydrophobicContact CE2-CZ2 4.45Å; W123-W232 HydrophobicContact CE3-CH2 4.46Å; W123-W232 AromaticContact CH2-CH2 3.86Å; W123-W232 HydrophobicContact CH2-CH2 3.86Å; W123-W232 AromaticContact CH2-CZ2 3.88Å; W123-W232 HydrophobicContact CH2-CZ2 3.88Å; W123-W232 HydrophobicContact CZ2-CH2 4.4Å; W123-W232 AromaticContact CZ3-CH2 3.88Å; W123-W232 HydrophobicContact CZ3-CH2 3.88Å; W123-W232 AromaticContact CZ3-CZ2 3.99Å; W123-W232 HydrophobicContact CZ3-CZ2 3.99Å; Q124-W232 HydrophobicContact CB-CE3 4.45Å; Q124-W232 HydrophobicContact CB-CH2 4.36Å; Q124-W232 HydrophobicContact CB-CZ3 3.94Å; Q124-W232 HydrophobicContact CG-CE3 4.44Å; Q124-W232 HydrophobicContact CG-CH2 3.89Å; Q124-W232 HydrophobicContact CG-CZ2 4.37Å; Q124-W232 HydrophobicContact CG-CZ3 3.93Å; M127-W232 HydrophobicContact CB-CH2 4.02Å; M127-W232 HydrophobicContact CB-CZ3 3.81Å; M127-W232 HydrophobicContact CG-CH2 4.37Å; M128-W232 HydrophobicContact CG-CE3 3.62Å; M128-W232 HydrophobicContact CG-CZ3 4.04Å; M128-W232 HydrophobicContact SD-CE3 4.18Å; W131-W232 HydrophobicContact CE3-CE3 4.47Å; W131-W232 HydrophobicContact CH2-CD2 4.08Å; W131-W232 AromaticContact CH2-CE3 3.85Å; W131-W232 HydrophobicContact CH2-CE3 3.85Å; W131-W232 AromaticContact CH2-CH2 3.53Å; W131-W232 HydrophobicContact CH2-CH2 3.53Å; W131-W232 AromaticContact CH2-CZ2 3.79Å; W131-W232 HydrophobicContact CH2-CZ2 3.79Å; W131-W232 AromaticContact CH2-CZ3 3.56Å; W131-W232 HydrophobicContact CH2-CZ3 3.56Å; W131-W232 HydrophobicContact CZ2-CH2 4.38Å; W131-W232 AromaticContact CZ3-CD2 3.85Å; W131-W232 HydrophobicContact CZ3-CD2 3.85Å; W131-W232 AromaticContact CZ3-CE3 3.46Å; W131-W232 HydrophobicContact CZ3-CE3 3.46Å; W131-W232 VanDerWaalsContact CZ3-CE3 3.46Å; W131-W232 HydrophobicContact CZ3-CH2 4.04Å; W131-W232 HydrophobicContact CZ3-CZ2 4.38Å; W131-W232 AromaticContact CZ3-CZ3 3.56Å; W131-W232 HydrophobicContact CZ3-CZ3 3.56Å; V228-W232 WeakPolarHBondContact O-CB 3.44Å; V228-W232 PolarHBondContact O-N 3.15Å; M230-W232 VanDerWaalsContact C-N 3.33Å; M230-W232 PolarHBondContact O-N 3.02Å; W232-Y236 WeakPolarHBondContact O-CB 3.41Å; W232-Y236 PolarHBondContact O-N 2.72Å; W232-F250 AromaticContact CD1-CE1 3.78Å; W232-F250 AromaticContact CD1-CZ 3.76Å; W232-F250 AromaticContact NE1-CZ 3.94Å; W232-M254 HydrophobicContact CZ2-CE 4.34Å; W232-M254 HydrophobicContact CZ2-SD 3.99Å
233	Y	97.8	Very high	96.4	Very high	4 Å²	4	25.3 Å²	25.3	2%	0.016	12%	0.123	C	C	.	.	H	α-helix	trans	-75.7	-50.6	177.2	171	-131.9	0	0	0	113.4	H203 Y207 D229 M230 L231 Y235 V245 Y247 F250	H203-Y233 HydrophobicContact CB-CD1 4.47Å; H203-Y233 HydrophobicContact CB-CE1 3.77Å; H203-Y233 AromaticContact CD2-CZ 3.9Å; H203-Y233 PolarHBondContact CD2-OH 3.1Å; H203-Y233 VanDerWaalsContact CD2-OH 3.29Å; H203-Y233 WeakPolarHBondContact O-CE1 3.29Å; Y207-Y233 HydrophobicContact CD2-CD1 4.2Å; Y207-Y233 HydrophobicContact CG-CD1 4.44Å; D229-Y233 WeakPolarHBondContact O-CB 3.32Å; D229-Y233 PolarHBondContact O-N 2.92Å; M230-Y233 PolarHBondContact O-N 3.17Å; L231-Y233 PolarHBondContact O-N 3.33Å; Y233-Y235 VanDerWaalsContact C-N 3.28Å; Y233-Y235 PolarHBondContact O-N 3.1Å; Y233-V245 VanDerWaalsContact CE2-O 3.24Å; Y233-V245 WeakPolarHBondContact CE2-O 3.37Å; Y233-V245 PolarHBondContact OH-O 3.19Å; Y233-Y247 AromaticContact CD1-CD2 3.7Å; Y233-Y247 HydrophobicContact CD1-CD2 3.7Å; Y233-Y247 HydrophobicContact CD1-CG 4.33Å; Y233-Y247 HydrophobicContact CD2-CD2 4.11Å; Y233-Y247 HydrophobicContact CE1-CD2 4.2Å; Y233-Y247 HydrophobicContact CE1-CG 4.42Å; Y233-Y247 AromaticContact CG-CD2 3.64Å; Y233-Y247 HydrophobicContact CG-CD2 3.64Å; Y233-Y247 HydrophobicContact CG-CE2 4.39Å; Y233-Y247 PolarHBondContact OH-N 2.85Å; Y233-F250 HydrophobicContact CD2-CB 3.91Å; Y233-F250 AromaticContact CD2-CD1 3.43Å; Y233-F250 HydrophobicContact CD2-CD1 3.43Å; Y233-F250 VanDerWaalsContact CD2-CD1 3.43Å; Y233-F250 HydrophobicContact CD2-CD2 4.14Å; Y233-F250 AromaticContact CD2-CE1 3.91Å; Y233-F250 HydrophobicContact CD2-CE1 3.91Å; Y233-F250 AromaticContact CD2-CG 3.54Å; Y233-F250 HydrophobicContact CD2-CG 3.54Å; Y233-F250 HydrophobicContact CD2-CZ 4.44Å; Y233-F250 HydrophobicContact CE2-CB 3.89Å; Y233-F250 HydrophobicContact CE2-CD1 4.28Å; Y233-F250 HydrophobicContact CE2-CG 4.02Å; Y233-F250 HydrophobicContact CG-CD1 4.05Å; Y233-F250 HydrophobicContact CG-CE1 4.3Å
234	L	97	Very high	96.4	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-62.6	-35.8	-174.7	-72.4	179.1	0	0	0	112.6	S151 K200 H203 M230 L231	S151-L234 WeakPolarHBondContact OG-CD1 3.31Å; K200-L234 PolarHBondContact NZ-O 2.62Å; H203-L234 HydrophobicContact CB-CD2 3.49Å; H203-L234 VanDerWaalsContact CB-CD2 3.49Å; M230-L234 HydrophobicContact CE-CD1 4.3Å; M230-L234 HydrophobicContact CG-CD1 3.6Å; M230-L234 HydrophobicContact CG-CG 3.99Å; M230-L234 WeakPolarHBondContact O-CB 3.13Å; M230-L234 VanDerWaalsContact O-CG 3.26Å; M230-L234 WeakPolarHBondContact O-CG 3.41Å; M230-L234 PolarHBondContact O-N 2.79Å; M230-L234 HydrophobicContact SD-CD1 4.09Å; L231-L234 PolarHBondContact O-N 2.98Å
235	Y	96.4	Very high	96.5	Very high	6 Å²	6	16.3 Å²	16.3	2%	0.024	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	1.4	-171.9	-65.5	-78	0	0	0	114.1	W131 F132 V144 F148 F196 L231 Y233 F237	W131-Y235 VanDerWaalsContact CB-O 3.28Å; W131-Y235 WeakPolarHBondContact CB-O 3.33Å; F132-Y235 HydrophobicContact CD2-CE1 4.06Å; F132-Y235 HydrophobicContact CD2-CE2 4.38Å; F132-Y235 AromaticContact CD2-CZ 3.99Å; F132-Y235 HydrophobicContact CE2-CE1 4.48Å; V144-Y235 HydrophobicContact CG1-CE1 4.37Å; F148-Y235 WeakPolarHBondContact CB-OH 3.46Å; F148-Y235 HydrophobicContact CD2-CE2 4.35Å; F196-Y235 HydrophobicContact CZ-CE1 4.35Å; L231-Y235 HydrophobicContact CB-CD2 4.42Å; L231-Y235 HydrophobicContact CD2-CD2 4.08Å; L231-Y235 HydrophobicContact CD2-CE2 3.7Å; L231-Y235 WeakPolarHBondContact O-CB 3.46Å; L231-Y235 WeakPolarHBondContact O-CD2 3.04Å; L231-Y235 PolarHBondContact O-N 3.4Å; L231-Y235 VanDerWaalsContact O-N 3.08Å; Y233-Y235 VanDerWaalsContact C-N 3.28Å; Y233-Y235 PolarHBondContact O-N 3.1Å; Y235-F237 PolarHBondContact O-N 2.86Å
236	Y	97.4	Very high	96.5	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.061	C	C	.	.			trans	-53	110.3	170.9	172.4	-109	0	0	0	110.1	F111 W131 W232 P238 Y239 Q240 F250 M254 D337 M339	F111-Y236 HydrophobicContact CE2-CD2 4.47Å; F111-Y236 HydrophobicContact CE2-CE2 4.06Å; F111-Y236 HydrophobicContact CZ-CE2 4.33Å; W131-Y236 AromaticContact CH2-CD2 3.67Å; W131-Y236 HydrophobicContact CH2-CD2 3.67Å; W131-Y236 HydrophobicContact CH2-CG 4.37Å; W131-Y236 AromaticContact CZ2-CD2 3.62Å; W131-Y236 HydrophobicContact CZ2-CD2 3.62Å; W131-Y236 HydrophobicContact CZ2-CE2 4.38Å; W232-Y236 WeakPolarHBondContact O-CB 3.41Å; W232-Y236 PolarHBondContact O-N 2.72Å; Y236-P238 HydrophobicContact CE1-CB 3.79Å; Y236-P238 HydrophobicContact CE1-CG 3.92Å; Y236-P238 HydrophobicContact CE2-CG 4.09Å; Y236-P238 VanDerWaalsContact CZ-CD 3.45Å; Y236-P238 WeakPolarHBondContact OH-CG 3.5Å; Y236-Y239 HydrophobicContact CD1-CD1 4.31Å; Y236-Y239 AromaticContact CD1-CD2 3.5Å; Y236-Y239 HydrophobicContact CD1-CD2 3.5Å; Y236-Y239 VanDerWaalsContact CD1-CD2 3.5Å; Y236-Y239 HydrophobicContact CD1-CE2 4.15Å; Y236-Y239 AromaticContact CD1-CG 3.58Å; Y236-Y239 HydrophobicContact CD1-CG 3.58Å; Y236-Y239 AromaticContact CE1-CD1 3.92Å; Y236-Y239 HydrophobicContact CE1-CD1 3.92Å; Y236-Y239 AromaticContact CE1-CD2 3.54Å; Y236-Y239 HydrophobicContact CE1-CD2 3.54Å; Y236-Y239 HydrophobicContact CE1-CE1 4.11Å; Y236-Y239 AromaticContact CE1-CE2 3.75Å; Y236-Y239 HydrophobicContact CE1-CE2 3.75Å; Y236-Y239 AromaticContact CE1-CG 3.61Å; Y236-Y239 HydrophobicContact CE1-CG 3.61Å; Y236-Y239 CarbonylContact O-C 3.59Å; Y236-Y239 PolarHBondContact O-N 2.76Å; Y236-Q240 PolarHBondContact O-N 3.39Å; Y236-F250 HydrophobicContact CD1-CD2 4.39Å; Y236-F250 AromaticContact CD1-CE2 3.76Å; Y236-F250 HydrophobicContact CD1-CE2 3.76Å; Y236-F250 HydrophobicContact CD2-CE2 4.35Å; Y236-F250 HydrophobicContact CE1-CE2 4.49Å; Y236-F250 AromaticContact CG-CE2 3.67Å; Y236-F250 HydrophobicContact CG-CE2 3.67Å; Y236-F250 HydrophobicContact CG-CZ 4.3Å; Y236-M254 HydrophobicContact CD2-CE 3.95Å; Y236-M254 HydrophobicContact CE2-CE 4.05Å; Y236-M254 HydrophobicContact CG-CE 4.48Å; Y236-D337 PolarHBondContact OH-OD2 3.31Å; Y236-M339 HydrophobicContact CE1-CE 4.46Å; Y236-M339 VanDerWaalsContact OH-CG 3.31Å; Y236-M339 WeakPolarHBondContact OH-CG 3.26Å
237	F	97.2	Very high	96.6	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.061	C	C	.	.	G	3₁₀ helix	trans	-59.5	-42.1	-158.6	-161.5	-111	0	0	0	114.2	F103 Y104 H107 W131 A134 L138 Y235 Y239 Q240	F103-F237 HydrophobicContact CB-CE1 3.97Å; F103-F237 HydrophobicContact CB-CZ 3.58Å; Y104-F237 AromaticContact CD1-CD1 3.81Å; Y104-F237 HydrophobicContact CD1-CD1 3.81Å; Y104-F237 AromaticContact CD1-CE1 3.92Å; Y104-F237 HydrophobicContact CD1-CE1 3.92Å; Y104-F237 HydrophobicContact CD2-CD1 4.07Å; Y104-F237 AromaticContact CD2-CE1 3.33Å; Y104-F237 HydrophobicContact CD2-CE1 3.33Å; Y104-F237 HydrophobicContact CD2-CZ 4.12Å; Y104-F237 AromaticContact CE1-CD1 3.88Å; Y104-F237 HydrophobicContact CE1-CD1 3.88Å; Y104-F237 HydrophobicContact CE1-CE1 4.12Å; Y104-F237 HydrophobicContact CE2-CD1 4.07Å; Y104-F237 AromaticContact CE2-CE1 3.51Å; Y104-F237 HydrophobicContact CE2-CE1 3.51Å; Y104-F237 HydrophobicContact CE2-CZ 4.08Å; Y104-F237 AromaticContact CG-CD1 3.94Å; Y104-F237 HydrophobicContact CG-CD1 3.94Å; Y104-F237 AromaticContact CG-CE1 3.55Å; Y104-F237 HydrophobicContact CG-CE1 3.55Å; Y104-F237 AromaticContact CZ-CD1 3.99Å; Y104-F237 AromaticContact CZ-CE1 3.92Å; Y104-F237 PolarHBondContact OH-O 3.18Å; H107-F237 HydrophobicContact CB-CD1 3.85Å; H107-F237 HydrophobicContact CB-CE1 4.42Å; H107-F237 HydrophobicContact CB-CG 4.45Å; H107-F237 AromaticContact CG-CD1 3.98Å; W131-F237 HydrophobicContact CG-CB 4.25Å; A134-F237 HydrophobicContact CB-CD2 4.26Å; A134-F237 HydrophobicContact CB-CE2 3.52Å; A134-F237 HydrophobicContact CB-CZ 4.06Å; L138-F237 HydrophobicContact CD1-CE2 4.09Å; L138-F237 HydrophobicContact CD1-CZ 3.65Å; Y235-F237 PolarHBondContact O-N 2.86Å; F237-Y239 VanDerWaalsContact C-N 3.3Å; F237-Y239 PolarHBondContact O-N 3.44Å; F237-Q240 VanDerWaalsContact CD2-CD 3.5Å; F237-Q240 VanDerWaalsContact CZ-NE2 3.33Å; F237-Q240 WeakPolarHBondContact O-CB 3.46Å; F237-Q240 VanDerWaalsContact O-CD 3.31Å; F237-Q240 WeakPolarHBondContact O-CG 3.43Å; F237-Q240 PolarHBondContact O-N 3.36Å; F237-Q240 PolarHBondContact O-NE2 3.4Å
238	P	97.6	Very high	96.6	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.071	C	C	.	.	G	3₁₀ helix	trans	-68.1	-22.6	177	-22.9	36.7	0	0	0	115	H107 Y236 P330 F333 A334	H107-P238 VanDerWaalsContact NE2-CD 3.28Å; H107-P238 WeakPolarHBondContact NE2-CD 3.34Å; H107-P238 VanDerWaalsContact NE2-CG 3.28Å; H107-P238 WeakPolarHBondContact NE2-CG 3.29Å; Y236-P238 HydrophobicContact CE1-CB 3.79Å; Y236-P238 HydrophobicContact CE1-CG 3.92Å; Y236-P238 HydrophobicContact CE2-CG 4.09Å; Y236-P238 VanDerWaalsContact CZ-CD 3.45Å; Y236-P238 WeakPolarHBondContact OH-CG 3.5Å; P238-P330 WeakPolarHBondContact O-CB 3.11Å; P238-F333 HydrophobicContact CB-CB 4.38Å; P238-F333 HydrophobicContact CG-CB 4.17Å; P238-A334 HydrophobicContact CB-CB 3.84Å
239	Y	97	Very high	96.7	Very high	4 Å²	4	13.9 Å²	13.9	2%	0.016	7%	0.071	C	C	.	.	G	3₁₀ helix	trans	-104.3	11.4	174	-56.5	-22.3	0	0	0	112.3	H203 Y236 F237 L241 L243 V245 F250 Q253 A334 M339 P341	H203-Y239 PolarHBondContact CE1-O 3Å; Y236-Y239 HydrophobicContact CD1-CD1 4.31Å; Y236-Y239 AromaticContact CD1-CD2 3.5Å; Y236-Y239 HydrophobicContact CD1-CD2 3.5Å; Y236-Y239 VanDerWaalsContact CD1-CD2 3.5Å; Y236-Y239 HydrophobicContact CD1-CE2 4.15Å; Y236-Y239 AromaticContact CD1-CG 3.58Å; Y236-Y239 HydrophobicContact CD1-CG 3.58Å; Y236-Y239 AromaticContact CE1-CD1 3.92Å; Y236-Y239 HydrophobicContact CE1-CD1 3.92Å; Y236-Y239 AromaticContact CE1-CD2 3.54Å; Y236-Y239 HydrophobicContact CE1-CD2 3.54Å; Y236-Y239 HydrophobicContact CE1-CE1 4.11Å; Y236-Y239 AromaticContact CE1-CE2 3.75Å; Y236-Y239 HydrophobicContact CE1-CE2 3.75Å; Y236-Y239 AromaticContact CE1-CG 3.61Å; Y236-Y239 HydrophobicContact CE1-CG 3.61Å; Y236-Y239 CarbonylContact O-C 3.59Å; Y236-Y239 PolarHBondContact O-N 2.76Å; F237-Y239 VanDerWaalsContact C-N 3.3Å; F237-Y239 PolarHBondContact O-N 3.44Å; Y239-L241 PolarHBondContact O-N 2.97Å; Y239-L243 HydrophobicContact CD1-CB 4Å; Y239-L243 HydrophobicContact CD1-CD1 3.76Å; Y239-L243 HydrophobicContact CE1-CD1 3.85Å; Y239-V245 HydrophobicContact CD1-CG2 4.28Å; Y239-V245 HydrophobicContact CD2-CB 3.87Å; Y239-V245 HydrophobicContact CD2-CG1 4.44Å; Y239-V245 HydrophobicContact CD2-CG2 3.69Å; Y239-V245 HydrophobicContact CE1-CG2 4.22Å; Y239-V245 HydrophobicContact CE2-CB 4.01Å; Y239-V245 HydrophobicContact CE2-CG1 4.2Å; Y239-V245 HydrophobicContact CE2-CG2 3.6Å; Y239-V245 HydrophobicContact CG-CG2 4.05Å; Y239-F250 AromaticContact CD2-CD2 3.95Å; Y239-F250 HydrophobicContact CD2-CD2 3.95Å; Y239-F250 HydrophobicContact CE2-CD2 4.19Å; Y239-Q253 PolarHBondContact OH-OE1 3.25Å; Y239-A334 HydrophobicContact CD1-CB 4.39Å; Y239-A334 HydrophobicContact CE1-CB 3.5Å; Y239-M339 HydrophobicContact CE2-CE 3.89Å; Y239-P341 HydrophobicContact CE1-CB 4.01Å; Y239-P341 VanDerWaalsContact OH-CA 3.27Å; Y239-P341 WeakPolarHBondContact OH-CA 3.39Å; Y239-P341 VanDerWaalsContact OH-N 3.15Å
240	Q	92.2	Very high	96.7	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.061	C	C	.	.	S	Bend	trans	-67	-28.4	-176.7	79.9	-171.9	-50	0	0	112.8	Y104 C135 K200 Y236 F237	Y104-Q240 PolarHBondContact OH-NE2 3.1Å; C135-Q240 PolarHBondContact SG-OE1 3.38Å; C135-Q240 VanDerWaalsContact SG-OE1 3.33Å; K200-Q240 VanDerWaalsContact CE-O 3.3Å; K200-Q240 WeakPolarHBondContact CE-O 3.49Å; K200-Q240 PolarHBondContact NZ-O 2.9Å; Y236-Q240 PolarHBondContact O-N 3.39Å; F237-Q240 VanDerWaalsContact CD2-CD 3.5Å; F237-Q240 VanDerWaalsContact CZ-NE2 3.33Å; F237-Q240 WeakPolarHBondContact O-CB 3.46Å; F237-Q240 VanDerWaalsContact O-CD 3.31Å; F237-Q240 WeakPolarHBondContact O-CG 3.43Å; F237-Q240 PolarHBondContact O-N 3.36Å; F237-Q240 PolarHBondContact O-NE2 3.4Å
241	L	91.8	Very high	96.7	Very high	3 Å²	3	14.2 Å²	14.2	2%	0.016	7%	0.071	C	C	.	.	S	Bend	trans	-148.1	149.3	-173.5	-168.7	71.4	0	0	0	109.7	W96 F139 Y199 Y239 L243	W96-L241 HydrophobicContact CE3-CD2 4.36Å; W96-L241 HydrophobicContact CH2-CD2 3.54Å; W96-L241 HydrophobicContact CZ2-CD2 3.78Å; W96-L241 HydrophobicContact CZ3-CD2 3.86Å; F139-L241 HydrophobicContact CZ-CD2 4.4Å; Y199-L241 HydrophobicContact CD2-CD1 3.46Å; Y199-L241 VanDerWaalsContact CD2-CD1 3.46Å; Y199-L241 HydrophobicContact CD2-CG 4.32Å; Y199-L241 HydrophobicContact CE2-CD1 3.92Å; Y199-L241 HydrophobicContact CE2-CG 4.49Å; Y199-L241 HydrophobicContact CG-CD1 4.33Å; Y239-L241 PolarHBondContact O-N 2.97Å; L241-L243 PolarHBondContact O-N 3.33Å
242	S	93.1	Very high	96.7	Very high	8 Å²	8	15.5 Å²	15.5	6%	0.056	9%	0.086	C	C	.	.	S	Bend	trans	69.6	-28.4	172.8	-54.7	0	0	0	0	116.3	Y199 I326 F327	Y199-S242 VanDerWaalsContact CZ-N 3.3Å; Y199-S242 WeakPolarHBondContact OH-CA 3.34Å; S242-I326 WeakPolarHBondContact OG-CG2 3.26Å; S242-F327 WeakPolarHBondContact O-CD1 3.5Å; S242-F327 WeakPolarHBondContact O-CE1 3.24Å
243	L	96.9	Very high	96.7	Very high	6 Å²	6	15.6 Å²	15.6	3%	0.031	9%	0.087	C	C	.	.			trans	-109	125.5	175.7	-64.2	179.1	0	0	0	110.9	Y239 L241 F327 P330 A331 P341	Y239-L243 HydrophobicContact CD1-CB 4Å; Y239-L243 HydrophobicContact CD1-CD1 3.76Å; Y239-L243 HydrophobicContact CE1-CD1 3.85Å; L241-L243 PolarHBondContact O-N 3.33Å; L243-F327 HydrophobicContact CD2-CB 3.91Å; L243-F327 HydrophobicContact CD2-CD1 4.45Å; L243-F327 HydrophobicContact CD2-CG 4.28Å; L243-P330 HydrophobicContact CD1-CB 3.87Å; L243-P330 HydrophobicContact CD1-CG 3.91Å; L243-P330 HydrophobicContact CG-CB 4.24Å; L243-P330 HydrophobicContact CG-CG 3.84Å; L243-A331 HydrophobicContact CD1-CB 4.03Å; L243-P341 HydrophobicContact CD1-CB 4.07Å
244	I	96.7	Very high	96.6	Very high	2 Å²	2	16.7 Å²	16.7	1%	0.01	9%	0.093	C	C	.	.			trans	-97.6	119.9	172	-65.2	165.2	0	0	0	108.5	Y199 I202 G364 L365 F368	Y199-I244 HydrophobicContact CD1-CD1 4.46Å; Y199-I244 HydrophobicContact CD1-CG1 3.84Å; Y199-I244 HydrophobicContact CE1-CD1 4.08Å; Y199-I244 HydrophobicContact CE1-CG1 3.68Å; I202-I244 HydrophobicContact CD1-CD1 3.68Å; I202-I244 HydrophobicContact CD1-CG1 4.49Å; I202-I244 HydrophobicContact CG2-CD1 4.31Å; I202-I244 HydrophobicContact CG2-CG1 4.21Å; I202-I244 HydrophobicContact CG2-CG2 3.8Å; I244-G364 WeakPolarHBondContact CG2-O 3.42Å; I244-G364 WeakPolarHBondContact O-CA 3.45Å; I244-L365 HydrophobicContact CD1-CB 3.9Å; I244-L365 HydrophobicContact CD1-CD1 3.55Å; I244-L365 HydrophobicContact CD1-CG 4.3Å; I244-F368 HydrophobicContact CG2-CB 4.12Å
245	V	98.1	Very high	96.4	Very high	6 Å²	6	22.8 Å²	22.8	4%	0.036	12%	0.121	C	C	.	.			trans	-129.1	115	170.6	-178.2	0	0	0	0	107.6	Y233 Y239 K249 F250 P342	Y233-V245 VanDerWaalsContact CE2-O 3.24Å; Y233-V245 WeakPolarHBondContact CE2-O 3.37Å; Y233-V245 PolarHBondContact OH-O 3.19Å; Y239-V245 HydrophobicContact CD1-CG2 4.28Å; Y239-V245 HydrophobicContact CD2-CB 3.87Å; Y239-V245 HydrophobicContact CD2-CG1 4.44Å; Y239-V245 HydrophobicContact CD2-CG2 3.69Å; Y239-V245 HydrophobicContact CE1-CG2 4.22Å; Y239-V245 HydrophobicContact CE2-CB 4.01Å; Y239-V245 HydrophobicContact CE2-CG1 4.2Å; Y239-V245 HydrophobicContact CE2-CG2 3.6Å; Y239-V245 HydrophobicContact CG-CG2 4.05Å; V245-K249 HydrophobicContact CG1-CB 3.94Å; V245-F250 HydrophobicContact CG1-CB 4.01Å; V245-P342 HydrophobicContact CG2-CG 3.91Å
246	I	98.1	Very high	96.3	Very high	14 Å²	14	24.2 Å²	24.2	7%	0.072	13%	0.132	C	C	.	.			trans	-61.3	143.6	178.3	66.1	175.1	0	0	0	110.6	S206 K249 F250 F368 E371 Y372	S206-I246 WeakPolarHBondContact OG-CA 3.34Å; I246-K249 HydrophobicContact CD1-CD 4.34Å; I246-K249 HydrophobicContact CD1-CG 4.18Å; I246-K249 HydrophobicContact CG1-CB 4.08Å; I246-K249 HydrophobicContact CG1-CD 4.05Å; I246-K249 HydrophobicContact CG1-CG 3.8Å; I246-K249 PolarHBondContact O-N 2.92Å; I246-F250 PolarHBondContact O-N 3.4Å; I246-F368 HydrophobicContact CG2-CB 4.21Å; I246-E371 HydrophobicContact CD1-CB 4.48Å; I246-Y372 HydrophobicContact CB-CE2 3.87Å; I246-Y372 HydrophobicContact CG2-CD2 4.29Å; I246-Y372 HydrophobicContact CG2-CE2 3.52Å
247	Y	98.4	Very high	96	Very high	7 Å²	7	24.4 Å²	24.4	3%	0.027	13%	0.133	C	C	.	.	H	α-helix	trans	-51	-46.2	-171.6	174.4	-100.8	0	0	0	114.4	S206 Y207 Y210 Y233 K249 F250 Q251	S206-Y247 PolarHBondContact OG-N 3.23Å; Y207-Y247 HydrophobicContact CD2-CD1 4.04Å; Y207-Y247 AromaticContact CD2-CD2 3.46Å; Y207-Y247 HydrophobicContact CD2-CD2 3.46Å; Y207-Y247 VanDerWaalsContact CD2-CD2 3.46Å; Y207-Y247 HydrophobicContact CD2-CE1 4.15Å; Y207-Y247 AromaticContact CD2-CE2 3.54Å; Y207-Y247 HydrophobicContact CD2-CE2 3.54Å; Y207-Y247 AromaticContact CD2-CG 3.7Å; Y207-Y247 HydrophobicContact CD2-CG 3.7Å; Y207-Y247 AromaticContact CD2-CZ 3.89Å; Y207-Y247 HydrophobicContact CE2-CD1 4.35Å; Y207-Y247 AromaticContact CE2-CD2 3.94Å; Y207-Y247 HydrophobicContact CE2-CD2 3.94Å; Y207-Y247 AromaticContact CE2-CE1 3.99Å; Y207-Y247 HydrophobicContact CE2-CE1 3.99Å; Y207-Y247 AromaticContact CE2-CE2 3.48Å; Y207-Y247 HydrophobicContact CE2-CE2 3.48Å; Y207-Y247 VanDerWaalsContact CE2-CE2 3.48Å; Y207-Y247 HydrophobicContact CE2-CG 4.32Å; Y207-Y247 AromaticContact CE2-CZ 3.52Å; Y210-Y247 AromaticContact CD1-CD1 3.69Å; Y210-Y247 HydrophobicContact CD1-CD1 3.69Å; Y210-Y247 AromaticContact CD1-CE1 3.35Å; Y210-Y247 HydrophobicContact CD1-CE1 3.35Å; Y210-Y247 AromaticContact CD2-CD1 3.74Å; Y210-Y247 HydrophobicContact CD2-CD1 3.74Å; Y210-Y247 AromaticContact CD2-CE1 3.79Å; Y210-Y247 HydrophobicContact CD2-CE1 3.79Å; Y210-Y247 HydrophobicContact CE1-CD1 4.23Å; Y210-Y247 AromaticContact CE1-CE1 3.45Å; Y210-Y247 HydrophobicContact CE1-CE1 3.45Å; Y210-Y247 VanDerWaalsContact CE1-CE1 3.45Å; Y210-Y247 HydrophobicContact CE2-CD1 4.24Å; Y210-Y247 AromaticContact CE2-CE1 3.85Å; Y210-Y247 HydrophobicContact CE2-CE1 3.85Å; Y210-Y247 AromaticContact CG-CD1 3.43Å; Y210-Y247 HydrophobicContact CG-CD1 3.43Å; Y210-Y247 VanDerWaalsContact CG-CD1 3.43Å; Y210-Y247 AromaticContact CG-CE1 3.54Å; Y210-Y247 HydrophobicContact CG-CE1 3.54Å; Y210-Y247 AromaticContact CZ-CE1 3.69Å; Y233-Y247 AromaticContact CD1-CD2 3.7Å; Y233-Y247 HydrophobicContact CD1-CD2 3.7Å; Y233-Y247 HydrophobicContact CD1-CG 4.33Å; Y233-Y247 HydrophobicContact CD2-CD2 4.11Å; Y233-Y247 HydrophobicContact CE1-CD2 4.2Å; Y233-Y247 HydrophobicContact CE1-CG 4.42Å; Y233-Y247 AromaticContact CG-CD2 3.64Å; Y233-Y247 HydrophobicContact CG-CD2 3.64Å; Y233-Y247 HydrophobicContact CG-CE2 4.39Å; Y233-Y247 PolarHBondContact OH-N 2.85Å; Y247-K249 VanDerWaalsContact C-N 3.26Å; Y247-K249 PolarHBondContact O-N 3.47Å; Y247-F250 HydrophobicContact CD2-CD1 4.22Å; Y247-F250 HydrophobicContact CE2-CD1 4.39Å; Y247-F250 WeakPolarHBondContact O-CB 3.31Å; Y247-F250 PolarHBondContact O-N 2.93Å; Y247-F250 VanDerWaalsContact O-N 3.08Å; Y247-Q251 HydrophobicContact CE1-CB 4.3Å; Y247-Q251 HydrophobicContact CE2-CB 4.38Å; Y247-Q251 VanDerWaalsContact CZ-OE1 3.29Å; Y247-Q251 PolarHBondContact O-N 3.27Å; Y247-Q251 PolarHBondContact OH-OE1 3.22Å
248	P	97.8	Very high	95.5	Very high	58 Å²	58	30.9 Å²	30.9	38%	0.377	16%	0.163	S	C	.	.	H	α-helix	trans	-58.5	-36.2	179.2	-26.1	35.5	0	0	0	113.6	Y210 A252	Y210-P248 HydrophobicContact CD2-CG 4.39Å; P248-A252 WeakPolarHBondContact O-CB 3.46Å; P248-A252 PolarHBondContact O-N 3.04Å; P248-A252 VanDerWaalsContact O-N 3.16Å
249	K	97.7	Very high	95.1	Very high	85 Å²	85	36.7 Å²	36.7	37%	0.37	20%	0.199	S	C	.	.	H	α-helix	trans	-72.1	-42	175.9	-70.5	-169.7	-177.4	-172.6	0	111.1	V245 I246 Y247 Q253 D367	V245-K249 HydrophobicContact CG1-CB 3.94Å; I246-K249 HydrophobicContact CD1-CD 4.34Å; I246-K249 HydrophobicContact CD1-CG 4.18Å; I246-K249 HydrophobicContact CG1-CB 4.08Å; I246-K249 HydrophobicContact CG1-CD 4.05Å; I246-K249 HydrophobicContact CG1-CG 3.8Å; I246-K249 PolarHBondContact O-N 2.92Å; Y247-K249 VanDerWaalsContact C-N 3.26Å; Y247-K249 PolarHBondContact O-N 3.47Å; K249-Q253 WeakPolarHBondContact O-CB 3.34Å; K249-Q253 WeakPolarHBondContact O-CG 3.35Å; K249-Q253 PolarHBondContact O-N 3.49Å; K249-D367 IonicContact NZ-OD1 3.57Å; K249-D367 PolarHBondContact NZ-OD1 3.25Å; K249-D367 VanDerWaalsContact NZ-OD1 3.08Å; K249-D367 IonicContact NZ-OD2 3.79Å; K249-D367 PolarHBondContact NZ-OD2 2.98Å
250	F	98.3	Very high	94.9	Very high	3 Å²	3	39.1 Å²	39.1	1%	0.013	21%	0.208	C	C	.	.	H	α-helix	trans	-58.7	-50.3	175.8	168	-98.5	0	0	0	111.4	W232 Y233 Y236 Y239 V245 I246 Y247 A252 Q253 M254 M339	W232-F250 AromaticContact CD1-CE1 3.78Å; W232-F250 AromaticContact CD1-CZ 3.76Å; W232-F250 AromaticContact NE1-CZ 3.94Å; Y233-F250 HydrophobicContact CD2-CB 3.91Å; Y233-F250 AromaticContact CD2-CD1 3.43Å; Y233-F250 HydrophobicContact CD2-CD1 3.43Å; Y233-F250 VanDerWaalsContact CD2-CD1 3.43Å; Y233-F250 HydrophobicContact CD2-CD2 4.14Å; Y233-F250 AromaticContact CD2-CE1 3.91Å; Y233-F250 HydrophobicContact CD2-CE1 3.91Å; Y233-F250 AromaticContact CD2-CG 3.54Å; Y233-F250 HydrophobicContact CD2-CG 3.54Å; Y233-F250 HydrophobicContact CD2-CZ 4.44Å; Y233-F250 HydrophobicContact CE2-CB 3.89Å; Y233-F250 HydrophobicContact CE2-CD1 4.28Å; Y233-F250 HydrophobicContact CE2-CG 4.02Å; Y233-F250 HydrophobicContact CG-CD1 4.05Å; Y233-F250 HydrophobicContact CG-CE1 4.3Å; Y236-F250 HydrophobicContact CD1-CD2 4.39Å; Y236-F250 AromaticContact CD1-CE2 3.76Å; Y236-F250 HydrophobicContact CD1-CE2 3.76Å; Y236-F250 HydrophobicContact CD2-CE2 4.35Å; Y236-F250 HydrophobicContact CE1-CE2 4.49Å; Y236-F250 AromaticContact CG-CE2 3.67Å; Y236-F250 HydrophobicContact CG-CE2 3.67Å; Y236-F250 HydrophobicContact CG-CZ 4.3Å; Y239-F250 AromaticContact CD2-CD2 3.95Å; Y239-F250 HydrophobicContact CD2-CD2 3.95Å; Y239-F250 HydrophobicContact CE2-CD2 4.19Å; V245-F250 HydrophobicContact CG1-CB 4.01Å; I246-F250 PolarHBondContact O-N 3.4Å; Y247-F250 HydrophobicContact CD2-CD1 4.22Å; Y247-F250 HydrophobicContact CE2-CD1 4.39Å; Y247-F250 WeakPolarHBondContact O-CB 3.31Å; Y247-F250 PolarHBondContact O-N 2.93Å; Y247-F250 VanDerWaalsContact O-N 3.08Å; F250-A252 PolarHBondContact O-N 3.5Å; F250-Q253 PolarHBondContact O-N 2.93Å; F250-M254 HydrophobicContact CE2-CE 3.55Å; F250-M254 HydrophobicContact CZ-CE 3.61Å; F250-M254 WeakPolarHBondContact O-CB 3.44Å; F250-M254 PolarHBondContact O-N 2.75Å; F250-M339 HydrophobicContact CD2-CE 3.87Å; F250-M339 HydrophobicContact CE2-CE 4.06Å
251	Q	97.5	Very high	95	Very high	44 Å²	44	48.5 Å²	48.5	21%	0.206	25%	0.249	C	C	.	.	H	α-helix	trans	-58	-52.3	179.6	-178.4	180	-10.8	0	0	111.1	Y247 Q253 M254 E255	Y247-Q251 HydrophobicContact CE1-CB 4.3Å; Y247-Q251 HydrophobicContact CE2-CB 4.38Å; Y247-Q251 VanDerWaalsContact CZ-OE1 3.29Å; Y247-Q251 PolarHBondContact O-N 3.27Å; Y247-Q251 PolarHBondContact OH-OE1 3.22Å; Q251-Q253 PolarHBondContact O-N 3Å; Q251-M254 PolarHBondContact O-N 2.66Å; Q251-M254 VanDerWaalsContact O-N 3.13Å; Q251-E255 HydrophobicContact CG-CG 4.39Å; Q251-E255 VanDerWaalsContact CG-OE1 3.3Å; Q251-E255 WeakPolarHBondContact CG-OE1 3.32Å; Q251-E255 PolarHBondContact NE2-OE1 3.46Å; Q251-E255 WeakPolarHBondContact O-CG 3.46Å; Q251-E255 PolarHBondContact O-N 3.38Å
252	A	97.1	Very high	94.9	Very high	54 Å²	54	51.5 Å²	51.5	45%	0.446	26%	0.26	S	S	.	.	H	α-helix	trans	-59.4	-36.3	179	0	0	0	0	0	112.5	P248 F250 S256	P248-A252 WeakPolarHBondContact O-CB 3.46Å; P248-A252 PolarHBondContact O-N 3.04Å; P248-A252 VanDerWaalsContact O-N 3.16Å; F250-A252 PolarHBondContact O-N 3.5Å; A252-S256 PolarHBondContact O-N 3.28Å; A252-S256 PolarHBondContact O-OG 2.95Å
253	Q	96.7	Very high	95	Very high	23 Å²	23	55.7 Å²	55.7	11%	0.107	28%	0.281	C	S	.	.	H	α-helix	trans	-68.2	-42.7	176.7	-74.9	179.2	31.3	0	0	112.5	Y239 K249 F250 Q251 S256 I257 R260 M339 I340	Y239-Q253 PolarHBondContact OH-OE1 3.25Å; K249-Q253 WeakPolarHBondContact O-CB 3.34Å; K249-Q253 WeakPolarHBondContact O-CG 3.35Å; K249-Q253 PolarHBondContact O-N 3.49Å; F250-Q253 PolarHBondContact O-N 2.93Å; Q251-Q253 PolarHBondContact O-N 3Å; Q253-S256 PolarHBondContact O-N 3.41Å; Q253-S256 PolarHBondContact O-OG 2.61Å; Q253-I257 VanDerWaalsContact O-CG1 3.31Å; Q253-I257 WeakPolarHBondContact O-CG1 3.39Å; Q253-I257 PolarHBondContact O-N 2.99Å; Q253-R260 PolarHBondContact O-NH2 2.91Å; Q253-M339 HydrophobicContact CB-CE 3.62Å; Q253-M339 HydrophobicContact CB-SD 3.77Å; Q253-I340 HydrophobicContact CG-CB 4.33Å; Q253-I340 PolarHBondContact NE2-O 3.41Å; Q253-I340 PolarHBondContact OE1-O 3.18Å; Q253-I340 VanDerWaalsContact OE1-O 3.14Å
254	M	95.2	Very high	94.9	Very high	27 Å²	27	60.7 Å²	60.7	13%	0.133	30%	0.3	C	S	.	.	H	α-helix	trans	-67	-43.2	-178.3	-171.3	63.6	62.5	0	0	111.6	F111 W232 Y236 F250 Q251 S256 I257 M339	F111-M254 HydrophobicContact CZ-CE 4.42Å; F111-M254 HydrophobicContact CZ-SD 4.19Å; W232-M254 HydrophobicContact CZ2-CE 4.34Å; W232-M254 HydrophobicContact CZ2-SD 3.99Å; Y236-M254 HydrophobicContact CD2-CE 3.95Å; Y236-M254 HydrophobicContact CE2-CE 4.05Å; Y236-M254 HydrophobicContact CG-CE 4.48Å; F250-M254 HydrophobicContact CE2-CE 3.55Å; F250-M254 HydrophobicContact CZ-CE 3.61Å; F250-M254 WeakPolarHBondContact O-CB 3.44Å; F250-M254 PolarHBondContact O-N 2.75Å; Q251-M254 PolarHBondContact O-N 2.66Å; Q251-M254 VanDerWaalsContact O-N 3.13Å; M254-S256 VanDerWaalsContact C-N 3.29Å; M254-S256 PolarHBondContact O-N 3.04Å; M254-I257 HydrophobicContact CE-CD1 4.23Å; M254-I257 HydrophobicContact CG-CD1 4.42Å; M254-I257 WeakPolarHBondContact O-CG1 3.47Å; M254-I257 PolarHBondContact O-N 2.77Å; M254-I257 HydrophobicContact SD-CD1 3.34Å; M254-I257 WeakPolarHBondContact SD-CD1 3.48Å; M254-M339 HydrophobicContact CE-CE 3.87Å; M254-M339 HydrophobicContact CE-SD 4.12Å
255	E	93.8	Very high	95	Very high	128 Å²	128	66.2 Å²	66.2	60%	0.598	33%	0.329	S	S	*	.	H	α-helix	trans	-62.8	-35.2	176.7	-71.9	171.1	175.8	0	0	112.3	Q251	Q251-E255 HydrophobicContact CG-CG 4.39Å; Q251-E255 VanDerWaalsContact CG-OE1 3.3Å; Q251-E255 WeakPolarHBondContact CG-OE1 3.32Å; Q251-E255 PolarHBondContact NE2-OE1 3.46Å; Q251-E255 WeakPolarHBondContact O-CG 3.46Å; Q251-E255 PolarHBondContact O-N 3.38Å
256	S	93.8	Very high	94.9	Very high	36 Å²	36	68.2 Å²	68.2	25%	0.252	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	8.2	-178.1	56.4	0	0	0	0	114.5	A252 Q253 M254 H258 T259 R260	A252-S256 PolarHBondContact O-N 3.28Å; A252-S256 PolarHBondContact O-OG 2.95Å; Q253-S256 PolarHBondContact O-N 3.41Å; Q253-S256 PolarHBondContact O-OG 2.61Å; M254-S256 VanDerWaalsContact C-N 3.29Å; M254-S256 PolarHBondContact O-N 3.04Å; S256-H258 PolarHBondContact O-N 2.75Å; S256-T259 PolarHBondContact O-N 2.79Å; S256-T259 PolarHBondContact O-OG1 3.32Å; S256-R260 WeakPolarHBondContact O-CB 3.46Å; S256-R260 PolarHBondContact O-N 3.43Å; S256-R260 PolarHBondContact OG-NH2 3.05Å
257	I	91.9	Very high	94.9	Very high	4 Å²	4	68.1 Å²	68.1	2%	0.021	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-37.3	177.8	-67.8	179.7	0	0	0	111.6	F111 Q253 M254 N338 M339	F111-I257 HydrophobicContact CE1-CD1 4.29Å; F111-I257 HydrophobicContact CZ-CD1 3.99Å; Q253-I257 VanDerWaalsContact O-CG1 3.31Å; Q253-I257 WeakPolarHBondContact O-CG1 3.39Å; Q253-I257 PolarHBondContact O-N 2.99Å; M254-I257 HydrophobicContact CE-CD1 4.23Å; M254-I257 HydrophobicContact CG-CD1 4.42Å; M254-I257 WeakPolarHBondContact O-CG1 3.47Å; M254-I257 PolarHBondContact O-N 2.77Å; M254-I257 HydrophobicContact SD-CD1 3.34Å; M254-I257 WeakPolarHBondContact SD-CD1 3.48Å; I257-N338 HydrophobicContact CG2-CB 4.26Å; I257-N338 PolarHBondContact O-ND2 3.19Å; I257-M339 HydrophobicContact CD1-CG 4.13Å; I257-M339 HydrophobicContact CD1-SD 3.51Å; I257-M339 VanDerWaalsContact CD1-SD 3.51Å; I257-M339 HydrophobicContact CG1-SD 3.72Å
258	H	85.4	Confident	94.9	Very high	136 Å²	136	72.1 Å²	72.1	63%	0.63	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-34	-176	-64.6	-83.9	0	0	0	113.5	R115 S256	R115-H258 PolarHBondContact NE-CE1 2.85Å; R115-H258 PolarHBondContact NH2-CD2 2.87Å; R115-H258 PolarHBondContact NH2-CE1 3.41Å; R115-H258 VanDerWaalsContact NH2-CG 3.29Å; R115-H258 PolarHBondContact NH2-ND1 2.99Å; R115-H258 PolarHBondContact NH2-NE2 3.14Å; S256-H258 PolarHBondContact O-N 2.75Å
259	T	90.2	Very high	94.9	Very high	123 Å²	123	77.2 Å²	77.2	76%	0.755	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-20.3	-176.9	55.2	0	0	0	0	112	S256	S256-T259 PolarHBondContact O-N 2.79Å; S256-T259 PolarHBondContact O-OG1 3.32Å
260	R	93.2	Very high	94.9	Very high	54 Å²	54	74.1 Å²	74.1	20%	0.204	37%	0.365	C	S	.	.	S	Bend	trans	-75.5	125	-179.7	-174.3	-177.6	-57.3	140	7.2	111.4	Q253 S256 R262 N338 I340	Q253-R260 PolarHBondContact O-NH2 2.91Å; S256-R260 WeakPolarHBondContact O-CB 3.46Å; S256-R260 PolarHBondContact O-N 3.43Å; S256-R260 PolarHBondContact OG-NH2 3.05Å; R260-R262 PolarHBondContact O-N 3.1Å; R260-N338 WeakPolarHBondContact CD-O 3.31Å; R260-N338 PolarHBondContact NH1-O 3.5Å; R260-N338 PolarHBondContact O-ND2 2.85Å; R260-I340 VanDerWaalsContact CZ-CD1 3.45Å
261	K	92.3	Very high	94.9	Very high	198 Å²	198	74.5 Å²	74.5	86%	0.861	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-62.5	121.7	172.4	-175.1	177.7	-178.9	177.7	0	110.6
262	R	91.5	Very high	95	Very high	66 Å²	66	76 Å²	76	25%	0.249	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-79.1	132	176.5	-166.7	179.3	-112.4	156.3	11.1	110.9	N112 R260 W264 L336 D337 N338	N112-R262 VanDerWaalsContact OD1-CZ 3.32Å; N112-R262 PolarHBondContact OD1-NH1 3Å; N112-R262 PolarHBondContact OD1-NH2 3.2Å; R260-R262 PolarHBondContact O-N 3.1Å; R262-W264 VanDerWaalsContact CD-CZ2 3.4Å; R262-W264 HydrophobicContact CG-CD2 4.39Å; R262-W264 VanDerWaalsContact NH1-CZ2 3.31Å; R262-L336 PolarHBondContact NE-O 3.3Å; R262-L336 VanDerWaalsContact NE-O 3.07Å; R262-L336 PolarHBondContact NH2-O 2.99Å; R262-D337 PolarHBondContact NH2-O 3.49Å; R262-N338 WeakPolarHBondContact CA-OD1 3.47Å; R262-N338 HydrophobicContact CG-CB 4.36Å
263	N	94.3	Very high	95	Very high	95 Å²	95	78.9 Å²	78.9	51%	0.508	38%	0.381	S	S	.	.			trans	-111.5	86.4	174.8	-172.3	-17.7	0	0	0	110.8	L265 A266 T267	N263-L265 PolarHBondContact O-N 3.32Å; N263-L265 PolarHBondContact OD1-N 2.99Å; N263-A266 HydrophobicContact CB-CB 4.22Å; N263-A266 VanDerWaalsContact CG-CB 3.46Å; N263-A266 PolarHBondContact O-N 3.25Å; N263-A266 WeakPolarHBondContact OD1-CB 3.41Å; N263-A266 PolarHBondContact OD1-N 3.4Å; N263-T267 PolarHBondContact O-N 3.13Å; N263-T267 VanDerWaalsContact O-N 3.14Å; N263-T267 PolarHBondContact O-OG1 3.38Å; N263-T267 VanDerWaalsContact O-OG1 3.13Å
264	W	95.3	Very high	95.1	Very high	112 Å²	112	78.3 Å²	78.3	42%	0.424	38%	0.379	S	S	.	.	H	α-helix	trans	-59.6	-43.9	-178.7	-73.5	113.6	0	0	0	113.2	F108 R262 A266 T267 I268 L336	F108-W264 HydrophobicContact CE2-CH2 4.05Å; F108-W264 HydrophobicContact CE2-CZ3 4.16Å; F108-W264 HydrophobicContact CZ-CH2 4.1Å; F108-W264 HydrophobicContact CZ-CZ3 4.22Å; R262-W264 VanDerWaalsContact CD-CZ2 3.4Å; R262-W264 HydrophobicContact CG-CD2 4.39Å; R262-W264 VanDerWaalsContact NH1-CZ2 3.31Å; W264-A266 PolarHBondContact O-N 3.22Å; W264-T267 PolarHBondContact O-N 3.32Å; W264-I268 WeakPolarHBondContact O-CG1 3.25Å; W264-I268 PolarHBondContact O-N 2.95Å; W264-L336 HydrophobicContact CE3-CD2 4.32Å; W264-L336 HydrophobicContact CZ3-CD2 3.78Å
265	L	97.4	Very high	95.3	Very high	117 Å²	117	79.6 Å²	79.6	61%	0.613	39%	0.394	S	S	*	.	H	α-helix	trans	-60.6	-48.3	-177.7	-176.9	61.2	0	0	0	111.2	N263 T267 I268 W269	N263-L265 PolarHBondContact O-N 3.32Å; N263-L265 PolarHBondContact OD1-N 2.99Å; L265-T267 VanDerWaalsContact C-N 3.31Å; L265-T267 PolarHBondContact O-N 2.98Å; L265-I268 PolarHBondContact O-N 3.43Å; L265-W269 PolarHBondContact O-N 3.46Å
266	A	97.1	Very high	95.5	Very high	49 Å²	49	79.1 Å²	79.1	41%	0.405	39%	0.39	S	S	.	.	H	α-helix	trans	-63.5	-37	177.3	0	0	0	0	0	112.4	N263 W264 F270	N263-A266 HydrophobicContact CB-CB 4.22Å; N263-A266 VanDerWaalsContact CG-CB 3.46Å; N263-A266 PolarHBondContact O-N 3.25Å; N263-A266 WeakPolarHBondContact OD1-CB 3.41Å; N263-A266 PolarHBondContact OD1-N 3.4Å; W264-A266 PolarHBondContact O-N 3.22Å; A266-F270 WeakPolarHBondContact O-CB 3.4Å; A266-F270 PolarHBondContact O-N 2.9Å
267	T	97.8	Very high	95.7	Very high	11 Å²	11	81 Å²	81	7%	0.067	39%	0.392	C	S	.	.	H	α-helix	trans	-67.7	-43.6	176.7	-63.7	0	0	0	0	112.1	N263 W264 L265 F270 G271 F332 K335 L336	N263-T267 PolarHBondContact O-N 3.13Å; N263-T267 VanDerWaalsContact O-N 3.14Å; N263-T267 PolarHBondContact O-OG1 3.38Å; N263-T267 VanDerWaalsContact O-OG1 3.13Å; W264-T267 PolarHBondContact O-N 3.32Å; L265-T267 VanDerWaalsContact C-N 3.31Å; L265-T267 PolarHBondContact O-N 2.98Å; T267-F270 WeakPolarHBondContact O-CB 3.23Å; T267-F270 PolarHBondContact O-N 3.46Å; T267-G271 PolarHBondContact O-N 2.91Å; T267-F332 HydrophobicContact CG2-CD2 4.1Å; T267-F332 HydrophobicContact CG2-CE2 3.97Å; T267-F332 WeakPolarHBondContact O-CD2 3.28Å; T267-F332 VanDerWaalsContact O-CE2 3.31Å; T267-F332 WeakPolarHBondContact O-CE2 3.49Å; T267-K335 HydrophobicContact CG2-CB 3.66Å; T267-L336 HydrophobicContact CG2-CD2 3.64Å; T267-L336 HydrophobicContact CG2-CG 3.91Å
268	I	98.2	Very high	96	Very high	92 Å²	92	83.4 Å²	83.4	47%	0.472	40%	0.401	S	S	.	.	H	α-helix	trans	-63.7	-47	177.5	-68.4	166	0	0	0	110.2	W264 L265 F270 G271 V272	W264-I268 WeakPolarHBondContact O-CG1 3.25Å; W264-I268 PolarHBondContact O-N 2.95Å; L265-I268 PolarHBondContact O-N 3.43Å; I268-F270 VanDerWaalsContact C-N 3.26Å; I268-F270 PolarHBondContact O-N 3.24Å; I268-G271 WeakPolarHBondContact O-CA 3.47Å; I268-G271 PolarHBondContact O-N 3.08Å; I268-V272 HydrophobicContact CG2-CG2 4.45Å; I268-V272 WeakPolarHBondContact O-CG2 3.06Å; I268-V272 PolarHBondContact O-N 3.5Å
269	W	98.3	Very high	96.5	Very high	165 Å²	165	80.3 Å²	80.3	63%	0.625	40%	0.395	S	S	*	.	H	α-helix	trans	-60.6	-35.6	175.1	-81.1	117.9	0	0	0	112.9	L265 V272 R273	L265-W269 PolarHBondContact O-N 3.46Å; W269-V272 HydrophobicContact CE3-CB 4.42Å; W269-V272 HydrophobicContact CE3-CG1 4.38Å; W269-V272 HydrophobicContact CZ3-CG1 4.39Å; W269-R273 WeakPolarHBondContact O-CB 3.45Å; W269-R273 PolarHBondContact O-N 3.36Å
270	F	98.5	Very high	96.8	Very high	19 Å²	19	77.2 Å²	77.2	8%	0.083	37%	0.371	C	S	.	.	H	α-helix	trans	-60.3	-47.6	171.6	-179.4	-84.7	0	0	0	110.9	A266 T267 I268 R273 I274 G328 A331 F332 K335 L344	A266-F270 WeakPolarHBondContact O-CB 3.4Å; A266-F270 PolarHBondContact O-N 2.9Å; T267-F270 WeakPolarHBondContact O-CB 3.23Å; T267-F270 PolarHBondContact O-N 3.46Å; I268-F270 VanDerWaalsContact C-N 3.26Å; I268-F270 PolarHBondContact O-N 3.24Å; F270-R273 WeakPolarHBondContact O-CB 3.49Å; F270-R273 PolarHBondContact O-N 3.09Å; F270-I274 HydrophobicContact CD1-CG1 4.16Å; F270-I274 HydrophobicContact CE1-CD1 4.3Å; F270-I274 HydrophobicContact CE1-CG1 3.83Å; F270-I274 HydrophobicContact CZ-CD1 4.27Å; F270-I274 HydrophobicContact CZ-CG1 4.31Å; F270-I274 WeakPolarHBondContact O-CG1 3.2Å; F270-I274 PolarHBondContact O-N 2.71Å; F270-I274 VanDerWaalsContact O-N 3.08Å; F270-G328 WeakPolarHBondContact CE1-O 3.48Å; F270-A331 HydrophobicContact CE1-CB 4.03Å; F270-A331 HydrophobicContact CZ-CB 3.85Å; F270-F332 HydrophobicContact CD1-CB 3.93Å; F270-F332 HydrophobicContact CD1-CD2 4.23Å; F270-F332 HydrophobicContact CE1-CB 3.93Å; F270-K335 HydrophobicContact CB-CD 4.34Å; F270-K335 HydrophobicContact CD1-CD 3.96Å; F270-K335 HydrophobicContact CD2-CD 4.07Å; F270-K335 HydrophobicContact CE1-CD 4.26Å; F270-K335 HydrophobicContact CE2-CD 4.37Å; F270-K335 HydrophobicContact CG-CD 3.87Å; F270-K335 HydrophobicContact CZ-CD 4.46Å; F270-L344 HydrophobicContact CE2-CD1 3.7Å; F270-L344 HydrophobicContact CE2-CD2 4.45Å; F270-L344 HydrophobicContact CE2-CG 3.96Å; F270-L344 HydrophobicContact CZ-CD1 3.89Å; F270-L344 HydrophobicContact CZ-CD2 4.02Å; F270-L344 HydrophobicContact CZ-CG 4.04Å
271	G	98.3	Very high	97	Very high	11 Å²	11	74.6 Å²	74.6	11%	0.113	36%	0.361	C	S	.	.	H	α-helix	trans	-60.1	-46.9	176.6	0	0	0	0	0	113.2	T267 I268 R273 I274 A275 F332	T267-G271 PolarHBondContact O-N 2.91Å; I268-G271 WeakPolarHBondContact O-CA 3.47Å; I268-G271 PolarHBondContact O-N 3.08Å; G271-R273 VanDerWaalsContact C-N 3.28Å; G271-R273 PolarHBondContact O-N 3.27Å; G271-I274 PolarHBondContact O-N 3.12Å; G271-I274 VanDerWaalsContact O-N 3.09Å; G271-A275 PolarHBondContact O-N 2.97Å; G271-F332 VanDerWaalsContact CA-CD2 3.44Å
272	V	98.5	Very high	97.1	Very high	75 Å²	75	66.7 Å²	66.7	46%	0.455	33%	0.327	S	S	.	.	H	α-helix	trans	-56.6	-43.5	175.4	171.7	0	0	0	0	111	I268 W269 I274 A275 F276	I268-V272 HydrophobicContact CG2-CG2 4.45Å; I268-V272 WeakPolarHBondContact O-CG2 3.06Å; I268-V272 PolarHBondContact O-N 3.5Å; W269-V272 HydrophobicContact CE3-CB 4.42Å; W269-V272 HydrophobicContact CE3-CG1 4.38Å; W269-V272 HydrophobicContact CZ3-CG1 4.39Å; V272-I274 PolarHBondContact O-N 2.96Å; V272-A275 PolarHBondContact O-N 3.46Å; V272-F276 WeakPolarHBondContact O-CB 3.49Å; V272-F276 PolarHBondContact O-N 3Å
273	R	98.2	Very high	97.2	Very high	115 Å²	115	66.6 Å²	66.6	43%	0.434	33%	0.331	S	S	.	.	H	α-helix	trans	-62.2	-40.8	176.7	-176.6	-179.4	67.2	-171	2.9	112.3	W269 F270 G271 F276 W277	W269-R273 WeakPolarHBondContact O-CB 3.45Å; W269-R273 PolarHBondContact O-N 3.36Å; F270-R273 WeakPolarHBondContact O-CB 3.49Å; F270-R273 PolarHBondContact O-N 3.09Å; G271-R273 VanDerWaalsContact C-N 3.28Å; G271-R273 PolarHBondContact O-N 3.27Å; R273-F276 PolarHBondContact O-N 3.33Å; R273-W277 PolarHBondContact O-N 3.45Å; R273-W277 VanDerWaalsContact O-N 3.11Å
274	I	98.4	Very high	97.2	Very high	11 Å²	11	62.7 Å²	62.7	6%	0.056	31%	0.31	C	S	.	.	H	α-helix	trans	-66.3	-44.1	176.8	-60.1	-45.2	0	0	0	110.8	F270 G271 V272 F276 W277 Y278 V324 V325 L344	F270-I274 HydrophobicContact CD1-CG1 4.16Å; F270-I274 HydrophobicContact CE1-CD1 4.3Å; F270-I274 HydrophobicContact CE1-CG1 3.83Å; F270-I274 HydrophobicContact CZ-CD1 4.27Å; F270-I274 HydrophobicContact CZ-CG1 4.31Å; F270-I274 WeakPolarHBondContact O-CG1 3.2Å; F270-I274 PolarHBondContact O-N 2.71Å; F270-I274 VanDerWaalsContact O-N 3.08Å; G271-I274 PolarHBondContact O-N 3.12Å; G271-I274 VanDerWaalsContact O-N 3.09Å; V272-I274 PolarHBondContact O-N 2.96Å; I274-F276 VanDerWaalsContact C-N 3.32Å; I274-F276 PolarHBondContact O-N 2.94Å; I274-W277 PolarHBondContact O-N 3.35Å; I274-Y278 PolarHBondContact O-N 3.2Å; I274-V324 HydrophobicContact CD1-CG1 4.37Å; I274-V325 HydrophobicContact CG2-CG1 4.31Å; I274-L344 HydrophobicContact CD1-CD1 3.8Å
275	A	98.1	Very high	97.2	Very high	55 Å²	55	57.6 Å²	57.6	46%	0.455	29%	0.291	S	S	.	.	H	α-helix	trans	-61.5	-39.5	177	0	0	0	0	0	112.4	G271 V272 S279	G271-A275 PolarHBondContact O-N 2.97Å; V272-A275 PolarHBondContact O-N 3.46Å; A275-S279 WeakPolarHBondContact O-CB 3.49Å; A275-S279 PolarHBondContact O-N 3.5Å; A275-S279 PolarHBondContact O-OG 3.32Å
276	F	98.3	Very high	97	Very high	117 Å²	117	52.2 Å²	52.2	51%	0.513	26%	0.263	S	S	.	.	H	α-helix	trans	-58.4	-52.2	172.4	170.6	-96.2	0	0	0	111.5	V272 R273 I274 Y278 S279 F280	V272-F276 WeakPolarHBondContact O-CB 3.49Å; V272-F276 PolarHBondContact O-N 3Å; R273-F276 PolarHBondContact O-N 3.33Å; I274-F276 VanDerWaalsContact C-N 3.32Å; I274-F276 PolarHBondContact O-N 2.94Å; F276-Y278 PolarHBondContact O-N 3.01Å; F276-S279 PolarHBondContact O-N 2.88Å; F276-F280 WeakPolarHBondContact O-CB 3.41Å; F276-F280 PolarHBondContact O-N 3.01Å
277	W	98.2	Very high	96.7	Very high	76 Å²	76	52.4 Å²	52.4	29%	0.288	25%	0.253	S	S	.	.	H	α-helix	trans	-66.6	-36.7	-178.5	-72.2	120.6	0	0	0	113.2	R273 I274 S279 F280 I281 L321 V324 V325	R273-W277 PolarHBondContact O-N 3.45Å; R273-W277 VanDerWaalsContact O-N 3.11Å; I274-W277 PolarHBondContact O-N 3.35Å; W277-S279 VanDerWaalsContact C-N 3.34Å; W277-F280 HydrophobicContact CE3-CB 4.23Å; W277-F280 AromaticContact CE3-CD1 3.9Å; W277-F280 HydrophobicContact CE3-CD1 3.9Å; W277-F280 HydrophobicContact CE3-CG 4.18Å; W277-F280 AromaticContact CZ3-CD1 3.94Å; W277-F280 HydrophobicContact CZ3-CD1 3.94Å; W277-F280 HydrophobicContact CZ3-CE1 4.26Å; W277-F280 HydrophobicContact CZ3-CG 4.27Å; W277-F280 PolarHBondContact O-N 2.82Å; W277-I281 VanDerWaalsContact O-CG1 3.29Å; W277-I281 WeakPolarHBondContact O-CG1 3.37Å; W277-I281 PolarHBondContact O-N 2.77Å; W277-L321 HydrophobicContact CD2-CD2 4.16Å; W277-L321 HydrophobicContact CE3-CD2 3.67Å; W277-L321 HydrophobicContact CH2-CD2 4.29Å; W277-L321 HydrophobicContact CZ3-CD2 3.75Å; W277-V324 HydrophobicContact CB-CG1 4.47Å; W277-V324 HydrophobicContact CG-CG1 4.22Å; W277-V325 HydrophobicContact CB-CG2 3.7Å
278	Y	97.8	Very high	96.6	Very high	55 Å²	55	52.5 Å²	52.5	22%	0.216	25%	0.253	C	S	.	.	H	α-helix	trans	-57.9	-48.9	171.2	174.2	-90.7	0	0	0	110.9	W90 W93 K98 I274 F276 F280 I281 E282 V325	W90-Y278 AromaticContact CH2-CD2 3.85Å; W90-Y278 HydrophobicContact CH2-CD2 3.85Å; W90-Y278 HydrophobicContact CH2-CE2 4.33Å; W90-Y278 HydrophobicContact CZ2-CD2 4.04Å; W90-Y278 HydrophobicContact CZ2-CE2 4.18Å; W93-Y278 HydrophobicContact CZ3-CD2 4.21Å; W93-Y278 HydrophobicContact CZ3-CE2 4.27Å; K98-Y278 VanDerWaalsContact CE-OH 3.29Å; K98-Y278 WeakPolarHBondContact CE-OH 3.44Å; I274-Y278 PolarHBondContact O-N 3.2Å; F276-Y278 PolarHBondContact O-N 3.01Å; Y278-F280 VanDerWaalsContact C-N 3.33Å; Y278-F280 PolarHBondContact O-N 3.11Å; Y278-I281 PolarHBondContact O-N 3Å; Y278-E282 HydrophobicContact CD1-CG 4.35Å; Y278-E282 HydrophobicContact CE1-CG 3.89Å; Y278-E282 HydrophobicContact CE2-CG 4.36Å; Y278-E282 WeakPolarHBondContact O-CG 3.5Å; Y278-E282 PolarHBondContact O-N 2.71Å; Y278-V325 HydrophobicContact CD2-CG1 4.01Å; Y278-V325 HydrophobicContact CG-CG1 4.47Å
279	S	96	Very high	96.4	Very high	70 Å²	70	49.1 Å²	49.1	49%	0.49	24%	0.235	S	C	.	.	H	α-helix	trans	-65.6	-38	-179.7	-54.2	0	0	0	0	111.9	A275 F276 W277 E282 L283	A275-S279 WeakPolarHBondContact O-CB 3.49Å; A275-S279 PolarHBondContact O-N 3.5Å; A275-S279 PolarHBondContact O-OG 3.32Å; F276-S279 PolarHBondContact O-N 2.88Å; W277-S279 VanDerWaalsContact C-N 3.34Å; S279-E282 PolarHBondContact O-N 3.44Å; S279-L283 WeakPolarHBondContact O-CB 3.36Å; S279-L283 PolarHBondContact O-N 2.91Å
280	F	96.8	Very high	96.2	Very high	58 Å²	58	41.4 Å²	41.4	25%	0.254	21%	0.205	S	C	.	.	H	α-helix	trans	-62.6	-45.8	175.5	177.9	-96.8	0	0	0	111.7	W50 F276 W277 Y278 L283 M284 L321	W50-F280 HydrophobicContact CH2-CE1 4.08Å; W50-F280 AromaticContact CH2-CZ 3.72Å; W50-F280 HydrophobicContact CH2-CZ 3.72Å; W50-F280 HydrophobicContact CZ3-CZ 4.05Å; F276-F280 WeakPolarHBondContact O-CB 3.41Å; F276-F280 PolarHBondContact O-N 3.01Å; W277-F280 HydrophobicContact CE3-CB 4.23Å; W277-F280 AromaticContact CE3-CD1 3.9Å; W277-F280 HydrophobicContact CE3-CD1 3.9Å; W277-F280 HydrophobicContact CE3-CG 4.18Å; W277-F280 AromaticContact CZ3-CD1 3.94Å; W277-F280 HydrophobicContact CZ3-CD1 3.94Å; W277-F280 HydrophobicContact CZ3-CE1 4.26Å; W277-F280 HydrophobicContact CZ3-CG 4.27Å; W277-F280 PolarHBondContact O-N 2.82Å; Y278-F280 VanDerWaalsContact C-N 3.33Å; Y278-F280 PolarHBondContact O-N 3.11Å; F280-L283 PolarHBondContact O-N 2.98Å; F280-M284 HydrophobicContact CE1-SD 4.14Å; F280-M284 VanDerWaalsContact O-CB 3.28Å; F280-M284 WeakPolarHBondContact O-CB 3.33Å; F280-M284 PolarHBondContact O-N 3.48Å; F280-L321 HydrophobicContact CD1-CD1 4.13Å; F280-L321 HydrophobicContact CE1-CD1 3.81Å
281	I	97	Very high	96	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.2	-48.2	176.6	-69.8	167.5	0	0	0	110.5	W90 W277 Y278 L283 M284 L285 F318 L321 V325	W90-I281 HydrophobicContact CD2-CG2 4.26Å; W90-I281 VanDerWaalsContact CE2-CG2 3.49Å; W90-I281 HydrophobicContact CH2-CB 4.23Å; W90-I281 HydrophobicContact CH2-CD1 3.72Å; W90-I281 HydrophobicContact CH2-CG2 3.99Å; W90-I281 HydrophobicContact CZ2-CB 3.86Å; W90-I281 HydrophobicContact CZ2-CD1 4.2Å; W90-I281 HydrophobicContact CZ2-CG2 3.34Å; W90-I281 HydrophobicContact CZ3-CD1 4.16Å; W277-I281 VanDerWaalsContact O-CG1 3.29Å; W277-I281 WeakPolarHBondContact O-CG1 3.37Å; W277-I281 PolarHBondContact O-N 2.77Å; Y278-I281 PolarHBondContact O-N 3Å; I281-L283 VanDerWaalsContact C-N 3.25Å; I281-L283 PolarHBondContact O-N 3.06Å; I281-M284 PolarHBondContact O-N 2.76Å; I281-M284 VanDerWaalsContact O-N 3.13Å; I281-L285 HydrophobicContact CG2-CD1 3.98Å; I281-L285 HydrophobicContact CG2-CG 4.31Å; I281-L285 WeakPolarHBondContact O-CG 3.49Å; I281-L285 PolarHBondContact O-N 2.82Å; I281-F318 HydrophobicContact CG2-CD2 4.28Å; I281-F318 HydrophobicContact CG2-CE2 3.65Å; I281-L321 HydrophobicContact CD1-CB 3.95Å; I281-L321 WeakPolarHBondContact CD1-O 3.04Å; I281-L321 HydrophobicContact CG1-CB 4.14Å; I281-V325 HydrophobicContact CD1-CG2 3.85Å
282	E	94.1	Very high	95.8	Very high	31 Å²	31	40.6 Å²	40.6	15%	0.145	20%	0.199	C	C	.	.	H	α-helix	trans	-59	-39.6	179.1	-74.9	-66.9	106.6	0	0	111.5	K83 W90 Y278 S279 H286	K83-E282 IonicContact NZ-OE1 2.91Å; K83-E282 PolarHBondContact NZ-OE1 2.84Å; K83-E282 IonicContact NZ-OE2 2.83Å; K83-E282 PolarHBondContact NZ-OE2 2.59Å; W90-E282 PolarHBondContact NE1-OE1 3.44Å; Y278-E282 HydrophobicContact CD1-CG 4.35Å; Y278-E282 HydrophobicContact CE1-CG 3.89Å; Y278-E282 HydrophobicContact CE2-CG 4.36Å; Y278-E282 WeakPolarHBondContact O-CG 3.5Å; Y278-E282 PolarHBondContact O-N 2.71Å; S279-E282 PolarHBondContact O-N 3.44Å; E282-H286 PolarHBondContact O-CE1 3.31Å; E282-H286 PolarHBondContact O-ND1 3.49Å
283	L	93.8	Very high	95.7	Very high	64 Å²	64	37 Å²	37	34%	0.335	18%	0.177	S	C	.	.	H	α-helix	trans	-65.5	-50.8	172.4	-176.7	66.1	0	0	0	111.3	L78 S279 F280 I281 L285 H286 Y287	L78-L283 HydrophobicContact CD1-CD1 4Å; S279-L283 WeakPolarHBondContact O-CB 3.36Å; S279-L283 PolarHBondContact O-N 2.91Å; F280-L283 PolarHBondContact O-N 2.98Å; I281-L283 VanDerWaalsContact C-N 3.25Å; I281-L283 PolarHBondContact O-N 3.06Å; L283-L285 VanDerWaalsContact C-N 3.28Å; L283-L285 PolarHBondContact O-N 2.77Å; L283-H286 WeakPolarHBondContact O-CB 3.38Å; L283-H286 PolarHBondContact O-N 3.36Å; L283-Y287 HydrophobicContact CD1-CD2 4.26Å; L283-Y287 HydrophobicContact CD1-CE2 3.72Å; L283-Y287 HydrophobicContact CG-CD2 4.47Å; L283-Y287 HydrophobicContact CG-CE2 4.36Å; L283-Y287 WeakPolarHBondContact O-CD2 3.34Å
284	M	94.9	Very high	95.6	Very high	14 Å²	14	32 Å²	32	7%	0.069	16%	0.159	C	C	.	.	H	α-helix	trans	-54.4	-42	-177.2	-176.8	-178.2	71.6	0	0	112.4	W50 F280 I281 H286 Y287 M288 F290 F318	W50-M284 HydrophobicContact CH2-SD 3.91Å; W50-M284 HydrophobicContact CZ3-SD 4.26Å; F280-M284 HydrophobicContact CE1-SD 4.14Å; F280-M284 VanDerWaalsContact O-CB 3.28Å; F280-M284 WeakPolarHBondContact O-CB 3.33Å; F280-M284 PolarHBondContact O-N 3.48Å; I281-M284 PolarHBondContact O-N 2.76Å; I281-M284 VanDerWaalsContact O-N 3.13Å; M284-H286 PolarHBondContact O-N 3.4Å; M284-H286 VanDerWaalsContact O-N 3.12Å; M284-Y287 PolarHBondContact O-N 3.47Å; M284-M288 HydrophobicContact CG-CB 4.05Å; M284-M288 HydrophobicContact CG-CG 3.88Å; M284-M288 PolarHBondContact O-N 3.09Å; M284-F290 HydrophobicContact CE-CE1 3.83Å; M284-F290 HydrophobicContact CE-CZ 3.82Å; M284-F290 HydrophobicContact SD-CE1 4.43Å; M284-F318 HydrophobicContact CE-CB 4.11Å; M284-F318 HydrophobicContact CE-CD2 3.5Å; M284-F318 VanDerWaalsContact CE-CD2 3.5Å; M284-F318 HydrophobicContact CE-CE2 4.36Å; M284-F318 HydrophobicContact CE-CG 4.2Å
285	L	95.2	Very high	95.3	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.021	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-14	179	-67.8	172.8	0	0	0	114.1	K83 D84 I281 L283 F290 F318	K83-L285 HydrophobicContact CG-CB 4.04Å; D84-L285 HydrophobicContact CB-CD2 4.32Å; D84-L285 PolarHBondContact N-O 2.85Å; I281-L285 HydrophobicContact CG2-CD1 3.98Å; I281-L285 HydrophobicContact CG2-CG 4.31Å; I281-L285 WeakPolarHBondContact O-CG 3.49Å; I281-L285 PolarHBondContact O-N 2.82Å; L283-L285 VanDerWaalsContact C-N 3.28Å; L283-L285 PolarHBondContact O-N 2.77Å; L285-F290 HydrophobicContact CD2-CE1 4.48Å; L285-F290 HydrophobicContact CD2-CZ 4.01Å; L285-F318 HydrophobicContact CD1-CE2 4.37Å; L285-F318 HydrophobicContact CD2-CE2 4.02Å; L285-F318 HydrophobicContact CD2-CZ 4.27Å; L285-F318 HydrophobicContact CG-CE2 4.44Å
286	H	93.1	Very high	95.2	Very high	5 Å²	5	32.1 Å²	32.1	2%	0.023	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-7.9	171.9	-67.3	83.1	0	0	0	113.8	S73 L75 R81 R82 E282 L283 M284 Y289	S73-H286 PolarHBondContact OG-NE2 3.32Å; L75-H286 HydrophobicContact CD1-CB 3.98Å; R81-H286 WeakPolarHBondContact CD-O 3.47Å; R81-H286 HydrophobicContact CG-CB 4.43Å; R81-H286 PolarHBondContact NE-O 3.05Å; R82-H286 WeakPolarHBondContact O-CA 3.3Å; R82-H286 PolarHBondContact O-CD2 2.8Å; E282-H286 PolarHBondContact O-CE1 3.31Å; E282-H286 PolarHBondContact O-ND1 3.49Å; L283-H286 WeakPolarHBondContact O-CB 3.38Å; L283-H286 PolarHBondContact O-N 3.36Å; M284-H286 PolarHBondContact O-N 3.4Å; M284-H286 VanDerWaalsContact O-N 3.12Å; H286-Y289 WeakPolarHBondContact O-CE1 3.29Å; H286-Y289 PolarHBondContact O-OH 2.69Å
287	Y	92.3	Very high	95	Very high	52 Å²	52	32.6 Å²	32.6	20%	0.204	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.4	-24.7	-174.8	-71.4	-92.3	0	0	0	113.3	F54 S57 L78 R81 L283 M284	F54-Y287 HydrophobicContact CE2-CD1 4.08Å; S57-Y287 VanDerWaalsContact CB-O 3.25Å; S57-Y287 WeakPolarHBondContact CB-O 3.42Å; L78-Y287 HydrophobicContact CD1-CE2 4.3Å; L78-Y287 VanDerWaalsContact CD1-OH 3.24Å; L78-Y287 WeakPolarHBondContact CD1-OH 3.46Å; L78-Y287 WeakPolarHBondContact CD2-OH 3.38Å; R81-Y287 VanDerWaalsContact NH2-CD1 3.27Å; L283-Y287 HydrophobicContact CD1-CD2 4.26Å; L283-Y287 HydrophobicContact CD1-CE2 3.72Å; L283-Y287 HydrophobicContact CG-CD2 4.47Å; L283-Y287 HydrophobicContact CG-CE2 4.36Å; L283-Y287 WeakPolarHBondContact O-CD2 3.34Å; M284-Y287 PolarHBondContact O-N 3.47Å
288	M	94.4	Very high	94.7	Very high	13 Å²	13	33.6 Å²	33.6	6%	0.064	17%	0.168	C	C	.	.			trans	-124.5	100.9	-175.3	-55.7	-66.3	-128.6	0	0	108.7	W50 V53 F54 M284 F290	W50-M288 HydrophobicContact CB-CE 4.18Å; W50-M288 HydrophobicContact CD2-CE 4.18Å; W50-M288 HydrophobicContact CE3-CE 3.53Å; W50-M288 HydrophobicContact CG-CE 4.49Å; W50-M288 HydrophobicContact CZ3-CE 4.19Å; W50-M288 WeakPolarHBondContact O-CE 3.26Å; V53-M288 HydrophobicContact CG1-CB 4.39Å; V53-M288 HydrophobicContact CG1-SD 4.22Å; F54-M288 VanDerWaalsContact CA-SD 3.56Å; F54-M288 HydrophobicContact CB-CE 4.11Å; F54-M288 HydrophobicContact CB-SD 3.63Å; F54-M288 HydrophobicContact CD2-SD 4.24Å; F54-M288 HydrophobicContact CG-SD 4.46Å; M284-M288 HydrophobicContact CG-CB 4.05Å; M284-M288 HydrophobicContact CG-CG 3.88Å; M284-M288 PolarHBondContact O-N 3.09Å; M288-F290 VanDerWaalsContact C-N 3.31Å; M288-F290 HydrophobicContact CB-CD1 3.75Å; M288-F290 HydrophobicContact CB-CE1 3.91Å; M288-F290 WeakPolarHBondContact O-CD1 3.22Å; M288-F290 WeakPolarHBondContact O-CE1 3.45Å; M288-F290 PolarHBondContact O-N 3.19Å
289	Y	94.1	Very high	94.6	Very high	22 Å²	22	31.4 Å²	31.4	9%	0.086	16%	0.16	C	C	.	.			trans	-96.3	48.2	-173.8	-51.8	-35.8	0	0	0	111.3	S57 L62 F70 D84 H286 A293	S57-Y289 VanDerWaalsContact O-CD2 3.29Å; S57-Y289 WeakPolarHBondContact O-CD2 3.37Å; S57-Y289 WeakPolarHBondContact O-CE2 3.4Å; S57-Y289 PolarHBondContact OG-N 3.43Å; L62-Y289 HydrophobicContact CD2-CD2 4.04Å; L62-Y289 HydrophobicContact CD2-CG 4.31Å; F70-Y289 HydrophobicContact CE1-CD1 4.02Å; F70-Y289 HydrophobicContact CE1-CD2 4.08Å; F70-Y289 AromaticContact CE1-CG 3.77Å; F70-Y289 HydrophobicContact CE1-CG 3.77Å; F70-Y289 HydrophobicContact CZ-CG 4.48Å; D84-Y289 HydrophobicContact CB-CD1 4.12Å; D84-Y289 VanDerWaalsContact OD2-CA 3.29Å; D84-Y289 WeakPolarHBondContact OD2-CA 3.43Å; H286-Y289 WeakPolarHBondContact O-CE1 3.29Å; H286-Y289 PolarHBondContact O-OH 2.69Å; Y289-A293 WeakPolarHBondContact O-CB 3.45Å; Y289-A293 PolarHBondContact O-N 2.98Å
290	F	94.4	Very high	94.6	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.009	14%	0.136	C	C	.	.	H	α-helix	trans	-72.4	-32.3	-172.8	50.4	-93.8	0	0	0	113	V53 D84 M284 L285 M288 A293 I294 L311 M314 I315 F318	V53-F290 HydrophobicContact CG1-CB 4.02Å; V53-F290 HydrophobicContact CG1-CD1 4.45Å; D84-F290 PolarHBondContact OD2-N 3.47Å; M284-F290 HydrophobicContact CE-CE1 3.83Å; M284-F290 HydrophobicContact CE-CZ 3.82Å; M284-F290 HydrophobicContact SD-CE1 4.43Å; L285-F290 HydrophobicContact CD2-CE1 4.48Å; L285-F290 HydrophobicContact CD2-CZ 4.01Å; M288-F290 VanDerWaalsContact C-N 3.31Å; M288-F290 HydrophobicContact CB-CD1 3.75Å; M288-F290 HydrophobicContact CB-CE1 3.91Å; M288-F290 WeakPolarHBondContact O-CD1 3.22Å; M288-F290 WeakPolarHBondContact O-CE1 3.45Å; M288-F290 PolarHBondContact O-N 3.19Å; F290-A293 PolarHBondContact O-N 2.93Å; F290-I294 WeakPolarHBondContact O-CG2 3.42Å; F290-I294 PolarHBondContact O-N 3.01Å; F290-I294 VanDerWaalsContact O-N 3.13Å; F290-L311 HydrophobicContact CB-CD2 3.81Å; F290-M314 HydrophobicContact CB-CB 4.32Å; F290-M314 HydrophobicContact CD1-CB 4.35Å; F290-M314 HydrophobicContact CG-CB 4.26Å; F290-I315 HydrophobicContact CD2-CG2 3.97Å; F290-F318 HydrophobicContact CE1-CB 4.41Å; F290-F318 HydrophobicContact CE2-CB 3.52Å; F290-F318 AromaticContact CE2-CD1 3.51Å; F290-F318 HydrophobicContact CE2-CD1 3.51Å; F290-F318 HydrophobicContact CE2-CD2 4.26Å; F290-F318 HydrophobicContact CE2-CE1 4.24Å; F290-F318 AromaticContact CE2-CG 3.49Å; F290-F318 HydrophobicContact CE2-CG 3.49Å; F290-F318 VanDerWaalsContact CE2-CG 3.49Å; F290-F318 HydrophobicContact CZ-CB 3.44Å; F290-F318 VanDerWaalsContact CZ-CB 3.44Å; F290-F318 AromaticContact CZ-CD1 3.86Å; F290-F318 HydrophobicContact CZ-CD1 3.86Å; F290-F318 AromaticContact CZ-CD2 3.73Å; F290-F318 HydrophobicContact CZ-CD2 3.73Å; F290-F318 HydrophobicContact CZ-CE2 4.41Å; F290-F318 AromaticContact CZ-CG 3.38Å; F290-F318 HydrophobicContact CZ-CG 3.38Å
291	E	94.3	Very high	94.5	Very high	14 Å²	14	29.8 Å²	29.8	7%	0.065	15%	0.145	C	C	.	.	H	α-helix	trans	-71.6	-40	177.6	-67.4	-82.3	-163.7	0	0	110.3	D84 N86 N87 A293 I294 A295 F318	D84-E291 WeakPolarHBondContact OD2-CB 3.34Å; D84-E291 PolarHBondContact OD2-N 2.83Å; D84-E291 VanDerWaalsContact OD2-N 3.08Å; N86-E291 HydrophobicContact CB-CB 3.69Å; N87-E291 HydrophobicContact CB-CG 4.08Å; N87-E291 PolarHBondContact ND2-OE1 3.47Å; E291-A293 VanDerWaalsContact C-N 3.3Å; E291-A293 PolarHBondContact O-N 3.4Å; E291-I294 WeakPolarHBondContact O-CG1 3.34Å; E291-I294 PolarHBondContact O-N 3.42Å; E291-I294 WeakPolarHBondContact OE2-CD1 3.4Å; E291-A295 PolarHBondContact O-N 3.21Å; E291-F318 HydrophobicContact CG-CE1 4.46Å
292	A	94.5	Very high	94.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-58.9	-42.4	170.8	0	0	0	0	0	111.9	L62 F70 D84 N86 A295	L62-A292 HydrophobicContact CD1-CB 4.4Å; F70-A292 HydrophobicContact CE1-CB 3.92Å; F70-A292 HydrophobicContact CE2-CB 4.29Å; F70-A292 HydrophobicContact CZ-CB 3.52Å; D84-A292 PolarHBondContact OD2-N 2.82Å; N86-A292 WeakPolarHBondContact ND2-CA 3.42Å; N86-A292 WeakPolarHBondContact ND2-CB 3.42Å; A292-A295 PolarHBondContact O-N 2.91Å
293	A	95.5	Very high	94.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-66.1	-38.9	-178.4	0	0	0	0	0	113	L56 L62 Y289 F290 E291 A295 D296 L299 L311	L56-A293 HydrophobicContact CD2-CB 3.96Å; L62-A293 HydrophobicContact CD1-CB 4.11Å; L62-A293 HydrophobicContact CD2-CB 4.32Å; Y289-A293 WeakPolarHBondContact O-CB 3.45Å; Y289-A293 PolarHBondContact O-N 2.98Å; F290-A293 PolarHBondContact O-N 2.93Å; E291-A293 VanDerWaalsContact C-N 3.3Å; E291-A293 PolarHBondContact O-N 3.4Å; A293-A295 VanDerWaalsContact C-N 3.27Å; A293-A295 PolarHBondContact O-N 3.44Å; A293-D296 PolarHBondContact O-N 3.01Å; A293-L299 HydrophobicContact CB-CD2 3.97Å; A293-L311 HydrophobicContact CB-CD1 4.18Å; A293-L311 HydrophobicContact CB-CD2 4.01Å
294	I	95.5	Very high	94.4	Very high	9 Å²	9	36.4 Å²	36.4	5%	0.046	18%	0.179	C	C	.	.	H	α-helix	trans	-75.7	-15.1	-179.2	65	164.1	0	0	0	113.9	F290 E291 D296 L300 I315 F475	F290-I294 WeakPolarHBondContact O-CG2 3.42Å; F290-I294 PolarHBondContact O-N 3.01Å; F290-I294 VanDerWaalsContact O-N 3.13Å; E291-I294 WeakPolarHBondContact O-CG1 3.34Å; E291-I294 PolarHBondContact O-N 3.42Å; E291-I294 WeakPolarHBondContact OE2-CD1 3.4Å; I294-D296 VanDerWaalsContact C-N 3.29Å; I294-L300 WeakPolarHBondContact O-CD1 3.34Å; I294-I315 HydrophobicContact CD1-CG2 4.16Å; I294-I315 HydrophobicContact CG2-CG2 4.11Å; I294-F475 HydrophobicContact CB-CB 4.14Å; I294-F475 HydrophobicContact CB-CD2 3.81Å; I294-F475 HydrophobicContact CB-CE2 4.43Å; I294-F475 HydrophobicContact CB-CG 4.01Å; I294-F475 HydrophobicContact CG2-CD1 4.37Å; I294-F475 HydrophobicContact CG2-CD2 3.38Å; I294-F475 HydrophobicContact CG2-CE1 4.47Å; I294-F475 HydrophobicContact CG2-CE2 3.51Å; I294-F475 HydrophobicContact CG2-CG 3.83Å; I294-F475 HydrophobicContact CG2-CZ 4.05Å
295	A	93.6	Very high	94.5	Very high	45 Å²	45	37.9 Å²	37.9	37%	0.372	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-16.3	173.6	0	0	0	0	0	112.7	A67 E291 A292 A293	A67-A295 HydrophobicContact CB-CB 4.43Å; E291-A295 PolarHBondContact O-N 3.21Å; A292-A295 PolarHBondContact O-N 2.91Å; A293-A295 VanDerWaalsContact C-N 3.27Å; A293-A295 PolarHBondContact O-N 3.44Å
296	D	94.6	Very high	94.6	Very high	23 Å²	23	40.2 Å²	40.2	12%	0.123	20%	0.199	C	C	.	.			trans	-99.9	103.4	-175.3	-169.6	-30.4	0	0	0	111.9	S65 A67 A293 I294 D298 L299 L300	S65-D296 WeakPolarHBondContact CB-OD2 3.26Å; S65-D296 PolarHBondContact OG-OD2 3.33Å; A67-D296 HydrophobicContact CB-CB 3.74Å; A293-D296 PolarHBondContact O-N 3.01Å; I294-D296 VanDerWaalsContact C-N 3.29Å; D296-D298 PolarHBondContact O-N 3.08Å; D296-D298 PolarHBondContact OD1-N 2.93Å; D296-L299 HydrophobicContact CB-CB 3.7Å; D296-L299 HydrophobicContact CB-CD2 4.33Å; D296-L299 VanDerWaalsContact CG-CB 3.43Å; D296-L299 PolarHBondContact O-N 2.83Å; D296-L299 PolarHBondContact OD1-N 2.76Å; D296-L300 WeakPolarHBondContact O-CB 3.41Å; D296-L300 VanDerWaalsContact O-CG 3.22Å; D296-L300 WeakPolarHBondContact O-CG 3.5Å; D296-L300 PolarHBondContact O-N 2.73Å
297	R	94.4	Very high	94.8	Very high	128 Å²	128	40.3 Å²	40.3	48%	0.483	20%	0.2	S	C	.	.	H	α-helix	trans	-57.3	-49.9	177	175.8	178.7	-71.9	-79.7	3.2	112.3	L299 L300 E301 L474	R297-L299 VanDerWaalsContact C-N 3.26Å; R297-L299 PolarHBondContact O-N 2.81Å; R297-L300 PolarHBondContact O-N 3.25Å; R297-L300 VanDerWaalsContact O-N 3.15Å; R297-E301 WeakPolarHBondContact CD-OE1 3.45Å; R297-E301 HydrophobicContact CG-CG 4.42Å; R297-E301 WeakPolarHBondContact CG-OE1 3.39Å; R297-E301 IonicContact NH1-OE1 2.92Å; R297-E301 PolarHBondContact NH1-OE1 2.97Å; R297-E301 WeakPolarHBondContact O-CG 3.22Å; R297-E301 PolarHBondContact O-N 3.4Å; R297-L474 HydrophobicContact CB-CD1 3.78Å; R297-L474 HydrophobicContact CB-CD2 4.14Å; R297-L474 HydrophobicContact CG-CD1 3.98Å
298	D	93.3	Very high	95	Very high	96 Å²	96	37.9 Å²	37.9	51%	0.513	19%	0.19	S	C	.	.	H	α-helix	trans	-64.5	-37.6	-173.3	-70.6	-19	0	0	0	110.7	D296 K302	D296-D298 PolarHBondContact O-N 3.08Å; D296-D298 PolarHBondContact OD1-N 2.93Å; D298-K302 VanDerWaalsContact O-CD 3.29Å; D298-K302 WeakPolarHBondContact O-CD 3.44Å; D298-K302 VanDerWaalsContact O-CG 3.23Å; D298-K302 WeakPolarHBondContact O-CG 3.41Å; D298-K302 PolarHBondContact O-N 2.74Å
299	L	94.5	Very high	95.1	Very high	10 Å²	10	38.7 Å²	38.7	5%	0.052	20%	0.198	C	C	.	.	H	α-helix	trans	-63.8	-52.2	172.6	-176.7	69.5	0	0	0	110.7	L56 L61 L62 A293 D296 R297 E301 K302 I303	L56-L299 HydrophobicContact CD1-CD1 4.23Å; L56-L299 HydrophobicContact CD1-CD2 4.48Å; L61-L299 HydrophobicContact CB-CD1 3.73Å; L62-L299 HydrophobicContact CB-CD2 4.48Å; L62-L299 HydrophobicContact CD1-CD2 3.64Å; A293-L299 HydrophobicContact CB-CD2 3.97Å; D296-L299 HydrophobicContact CB-CB 3.7Å; D296-L299 HydrophobicContact CB-CD2 4.33Å; D296-L299 VanDerWaalsContact CG-CB 3.43Å; D296-L299 PolarHBondContact O-N 2.83Å; D296-L299 PolarHBondContact OD1-N 2.76Å; R297-L299 VanDerWaalsContact C-N 3.26Å; R297-L299 PolarHBondContact O-N 2.81Å; L299-E301 PolarHBondContact O-N 3.39Å; L299-K302 PolarHBondContact O-N 3.05Å; L299-I303 HydrophobicContact CD1-CG2 3.73Å; L299-I303 HydrophobicContact CG-CG2 3.91Å; L299-I303 WeakPolarHBondContact O-CG1 3.32Å; L299-I303 WeakPolarHBondContact O-CG2 3.34Å; L299-I303 PolarHBondContact O-N 2.85Å
300	L	96	Very high	95.2	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59	-31.7	-177.5	-74.7	177.6	0	0	0	113.2	I294 D296 R297 I303 L308 L311 L474 F475 V478 R482	I294-L300 WeakPolarHBondContact O-CD1 3.34Å; D296-L300 WeakPolarHBondContact O-CB 3.41Å; D296-L300 VanDerWaalsContact O-CG 3.22Å; D296-L300 WeakPolarHBondContact O-CG 3.5Å; D296-L300 PolarHBondContact O-N 2.73Å; R297-L300 PolarHBondContact O-N 3.25Å; R297-L300 VanDerWaalsContact O-N 3.15Å; L300-I303 HydrophobicContact CD2-CD1 4.18Å; L300-L308 HydrophobicContact CD2-CD1 3.79Å; L300-L311 HydrophobicContact CD2-CD1 3.95Å; L300-L474 HydrophobicContact CD1-CG 4.21Å; L300-F475 HydrophobicContact CD1-CB 4.45Å; L300-F475 HydrophobicContact CD1-CD2 3.91Å; L300-F475 HydrophobicContact CD2-CD2 3.76Å; L300-F475 HydrophobicContact CD2-CE2 3.92Å; L300-V478 HydrophobicContact CB-CB 4.46Å; L300-V478 HydrophobicContact CB-CG1 4.06Å; L300-V478 HydrophobicContact CB-CG2 4.24Å; L300-V478 HydrophobicContact CD1-CG2 4.4Å; L300-R482 PolarHBondContact O-NH1 3.42Å
301	E	94.5	Very high	95.4	Very high	94 Å²	94	38 Å²	38	44%	0.439	20%	0.196	S	C	.	.	H	α-helix	trans	-76.4	-27.8	176.9	-72	175.4	-168.4	0	0	112.8	R297 L299 R482	R297-E301 WeakPolarHBondContact CD-OE1 3.45Å; R297-E301 HydrophobicContact CG-CG 4.42Å; R297-E301 WeakPolarHBondContact CG-OE1 3.39Å; R297-E301 IonicContact NH1-OE1 2.92Å; R297-E301 PolarHBondContact NH1-OE1 2.97Å; R297-E301 WeakPolarHBondContact O-CG 3.22Å; R297-E301 PolarHBondContact O-N 3.4Å; L299-E301 PolarHBondContact O-N 3.39Å; E301-R482 PolarHBondContact O-NE 3.27Å; E301-R482 PolarHBondContact O-NH1 2.67Å
302	K	92.6	Very high	95.4	Very high	156 Å²	156	37.5 Å²	37.5	68%	0.678	20%	0.195	S	C	*	.	H	α-helix	trans	-94.5	-30.8	-175.3	-69.2	169.8	-169.3	163.6	0	114.3	D298 L299	D298-K302 VanDerWaalsContact O-CD 3.29Å; D298-K302 WeakPolarHBondContact O-CD 3.44Å; D298-K302 VanDerWaalsContact O-CG 3.23Å; D298-K302 WeakPolarHBondContact O-CG 3.41Å; D298-K302 PolarHBondContact O-N 2.74Å; L299-K302 PolarHBondContact O-N 3.05Å
303	I	95.1	Very high	95.4	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.209	C	C	.	.	S	Bend	trans	-62.7	149.7	-174.5	55.8	173.6	0	0	0	112.2	L56 L299 L300 T307 L308 L311 R482	L56-I303 HydrophobicContact CD1-CG2 3.87Å; L299-I303 HydrophobicContact CD1-CG2 3.73Å; L299-I303 HydrophobicContact CG-CG2 3.91Å; L299-I303 WeakPolarHBondContact O-CG1 3.32Å; L299-I303 WeakPolarHBondContact O-CG2 3.34Å; L299-I303 PolarHBondContact O-N 2.85Å; L300-I303 HydrophobicContact CD2-CD1 4.18Å; I303-T307 HydrophobicContact CD1-CG2 4.34Å; I303-L308 HydrophobicContact CD1-CB 3.97Å; I303-L308 HydrophobicContact CD1-CD1 3.98Å; I303-L308 HydrophobicContact CG1-CB 4.2Å; I303-L308 HydrophobicContact CG1-CD1 4.49Å; I303-L311 HydrophobicContact CD1-CD1 3.59Å; I303-R482 VanDerWaalsContact O-CZ 3.27Å; I303-R482 PolarHBondContact O-NH1 3.08Å; I303-R482 PolarHBondContact O-NH2 3.4Å
304	P	96.5	Very high	95.4	Very high	77 Å²	77	40.4 Å²	40.4	50%	0.5	21%	0.21	S	C	.	.			trans	-55.3	150.4	172.1	-28.7	38.1	0	0	0	113.4	D306 T307 L308	P304-D306 VanDerWaalsContact C-N 3.31Å; P304-D306 WeakPolarHBondContact CB-OD1 3.36Å; P304-D306 PolarHBondContact O-N 3.28Å; P304-T307 PolarHBondContact O-N 3.43Å; P304-L308 PolarHBondContact O-N 2.53Å
305	L	96.5	Very high	95.4	Very high	44 Å²	44	40 Å²	40	23%	0.23	21%	0.208	C	C	.	.	H	α-helix	trans	-65.3	-31.4	-175.4	-67.8	176.4	0	0	0	113.6	L308 S309 R482 I483 E487 P495	L305-L308 HydrophobicContact CD2-CD2 4.38Å; L305-L308 PolarHBondContact O-N 3.14Å; L305-S309 WeakPolarHBondContact O-CB 3.42Å; L305-S309 PolarHBondContact O-N 3.24Å; L305-S309 PolarHBondContact O-OG 3.38Å; L305-R482 HydrophobicContact CD2-CB 4.1Å; L305-I483 HydrophobicContact CD2-CG1 4.33Å; L305-E487 HydrophobicContact CD1-CG 3.72Å; L305-P495 HydrophobicContact CD1-CB 4.43Å; L305-P495 HydrophobicContact CD1-CG 4.18Å
306	D	96.3	Very high	95.5	Very high	54 Å²	54	38.4 Å²	38.4	29%	0.289	20%	0.196	S	C	.	.	H	α-helix	trans	-69.1	-42.2	175.6	62.3	-27.7	0	0	0	111	Y48 K52 P304 S309 S310	Y48-D306 HydrophobicContact CE1-CB 4.28Å; Y48-D306 PolarHBondContact OH-OD2 3.43Å; K52-D306 WeakPolarHBondContact CE-OD2 3.39Å; K52-D306 IonicContact NZ-OD2 3.17Å; P304-D306 VanDerWaalsContact C-N 3.31Å; P304-D306 WeakPolarHBondContact CB-OD1 3.36Å; P304-D306 PolarHBondContact O-N 3.28Å; D306-S309 PolarHBondContact O-N 3.35Å; D306-S310 VanDerWaalsContact O-CB 3.31Å; D306-S310 WeakPolarHBondContact O-CB 3.1Å; D306-S310 PolarHBondContact O-N 3.35Å; D306-S310 PolarHBondContact O-OG 3.07Å
307	T	97.2	Very high	95.5	Very high	7 Å²	7	38.9 Å²	38.9	4%	0.043	20%	0.197	C	C	.	.	H	α-helix	trans	-62.6	-44.5	171	-56.3	0	0	0	0	111.5	L56 I303 P304 S309 S310 L311	L56-T307 HydrophobicContact CB-CG2 4.02Å; L56-T307 HydrophobicContact CD2-CG2 3.88Å; L56-T307 HydrophobicContact CG-CG2 4.36Å; I303-T307 HydrophobicContact CD1-CG2 4.34Å; P304-T307 PolarHBondContact O-N 3.43Å; T307-S309 PolarHBondContact O-N 2.97Å; T307-S310 WeakPolarHBondContact O-CB 3.29Å; T307-S310 PolarHBondContact O-N 3.44Å; T307-S310 VanDerWaalsContact O-N 3.16Å; T307-L311 PolarHBondContact O-N 3.08Å
308	L	97.4	Very high	95.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.7	-44.6	177.6	-179.2	64.5	0	0	0	111.9	L300 I303 P304 L305 S310 L311 G312 F475 V478 L479 R482 I483	L300-L308 HydrophobicContact CD2-CD1 3.79Å; I303-L308 HydrophobicContact CD1-CB 3.97Å; I303-L308 HydrophobicContact CD1-CD1 3.98Å; I303-L308 HydrophobicContact CG1-CB 4.2Å; I303-L308 HydrophobicContact CG1-CD1 4.49Å; P304-L308 PolarHBondContact O-N 2.53Å; L305-L308 HydrophobicContact CD2-CD2 4.38Å; L305-L308 PolarHBondContact O-N 3.14Å; L308-S310 VanDerWaalsContact C-N 3.29Å; L308-S310 PolarHBondContact O-N 2.96Å; L308-L311 WeakPolarHBondContact O-CB 3.47Å; L308-L311 PolarHBondContact O-N 3.5Å; L308-G312 PolarHBondContact O-N 2.81Å; L308-F475 HydrophobicContact CD1-CE2 4.06Å; L308-V478 HydrophobicContact CD1-CG1 4.47Å; L308-V478 HydrophobicContact CD2-CG1 4.33Å; L308-L479 HydrophobicContact CD1-CD2 4.14Å; L308-L479 HydrophobicContact CD1-CG 4.44Å; L308-L479 HydrophobicContact CD2-CD2 3.98Å; L308-L479 HydrophobicContact CG-CD2 3.64Å; L308-L479 HydrophobicContact CG-CG 4.42Å; L308-R482 HydrophobicContact CD2-CB 4.09Å; L308-I483 HydrophobicContact CD2-CD1 4.36Å; L308-I483 HydrophobicContact CD2-CG1 4.31Å
309	S	96	Very high	95.7	Very high	31 Å²	31	29.5 Å²	29.5	22%	0.217	16%	0.155	C	C	.	.	H	α-helix	trans	-63.9	-37.5	175.4	-56.8	0	0	0	0	111.7	L305 D306 T307 G312 L313 I483	L305-S309 WeakPolarHBondContact O-CB 3.42Å; L305-S309 PolarHBondContact O-N 3.24Å; L305-S309 PolarHBondContact O-OG 3.38Å; D306-S309 PolarHBondContact O-N 3.35Å; T307-S309 PolarHBondContact O-N 2.97Å; S309-G312 PolarHBondContact O-N 2.94Å; S309-L313 PolarHBondContact O-N 3Å; S309-I483 WeakPolarHBondContact OG-CD1 3.31Å
310	S	97.1	Very high	95.8	Very high	8 Å²	8	29.9 Å²	29.9	6%	0.056	16%	0.157	C	C	.	.	H	α-helix	trans	-67.1	-36.3	178.5	-59.1	0	0	0	0	112.5	A49 D306 T307 L308 G312 L313 M314	A49-S310 VanDerWaalsContact CA-OG 3.31Å; A49-S310 WeakPolarHBondContact CA-OG 3.47Å; A49-S310 WeakPolarHBondContact CB-OG 3.42Å; A49-S310 WeakPolarHBondContact O-CB 3.46Å; D306-S310 VanDerWaalsContact O-CB 3.31Å; D306-S310 WeakPolarHBondContact O-CB 3.1Å; D306-S310 PolarHBondContact O-N 3.35Å; D306-S310 PolarHBondContact O-OG 3.07Å; T307-S310 WeakPolarHBondContact O-CB 3.29Å; T307-S310 PolarHBondContact O-N 3.44Å; T307-S310 VanDerWaalsContact O-N 3.16Å; L308-S310 VanDerWaalsContact C-N 3.29Å; L308-S310 PolarHBondContact O-N 2.96Å; S310-G312 VanDerWaalsContact C-N 3.29Å; S310-G312 PolarHBondContact O-N 3.3Å; S310-L313 PolarHBondContact O-N 3.07Å; S310-M314 WeakPolarHBondContact O-CG 3.15Å; S310-M314 PolarHBondContact O-N 3.26Å
311	L	97.2	Very high	95.9	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-58	-43.8	170.4	-75	173.8	0	0	0	111.1	V53 L56 F290 A293 L300 I303 T307 L308 L313 M314 I315 F475	V53-L311 HydrophobicContact CG1-CD2 4.26Å; V53-L311 HydrophobicContact CG2-CD2 3.97Å; V53-L311 HydrophobicContact CG2-CG 4.37Å; L56-L311 HydrophobicContact CD2-CD1 3.97Å; L56-L311 HydrophobicContact CD2-CD2 4.04Å; L56-L311 HydrophobicContact CD2-CG 4.25Å; F290-L311 HydrophobicContact CB-CD2 3.81Å; A293-L311 HydrophobicContact CB-CD1 4.18Å; A293-L311 HydrophobicContact CB-CD2 4.01Å; L300-L311 HydrophobicContact CD2-CD1 3.95Å; I303-L311 HydrophobicContact CD1-CD1 3.59Å; T307-L311 PolarHBondContact O-N 3.08Å; L308-L311 WeakPolarHBondContact O-CB 3.47Å; L308-L311 PolarHBondContact O-N 3.5Å; L311-L313 VanDerWaalsContact C-N 3.31Å; L311-L313 PolarHBondContact O-N 3.43Å; L311-M314 PolarHBondContact O-N 3.01Å; L311-M314 VanDerWaalsContact O-N 3.08Å; L311-I315 WeakPolarHBondContact O-CG1 3.41Å; L311-I315 WeakPolarHBondContact O-CG2 3.38Å; L311-I315 PolarHBondContact O-N 2.88Å; L311-F475 HydrophobicContact CB-CE2 4.08Å; L311-F475 HydrophobicContact CB-CZ 4.06Å
312	G	95.7	Very high	96	Very high	4 Å²	4	26.1 Å²	26.1	4%	0.041	14%	0.139	C	C	.	.	H	α-helix	trans	-56.8	-43.1	176.5	0	0	0	0	0	112.8	L308 S309 S310 I315 G316	L308-G312 PolarHBondContact O-N 2.81Å; S309-G312 PolarHBondContact O-N 2.94Å; S310-G312 VanDerWaalsContact C-N 3.29Å; S310-G312 PolarHBondContact O-N 3.3Å; G312-I315 VanDerWaalsContact O-CG1 3.23Å; G312-I315 WeakPolarHBondContact O-CG1 3.41Å; G312-G316 PolarHBondContact O-N 3.47Å
313	L	94.4	Very high	96.3	Very high	57 Å²	57	20.1 Å²	20.1	30%	0.298	11%	0.113	S	C	.	.	H	α-helix	trans	-65.3	-42.4	174.5	-176	70.2	0	0	0	111.9	I46 A49 S309 S310 L311 G316 Q317	I46-L313 HydrophobicContact CG1-CD2 4.35Å; A49-L313 HydrophobicContact CB-CD2 3.61Å; S309-L313 PolarHBondContact O-N 3Å; S310-L313 PolarHBondContact O-N 3.07Å; L311-L313 VanDerWaalsContact C-N 3.31Å; L311-L313 PolarHBondContact O-N 3.43Å; L313-G316 PolarHBondContact O-N 3.31Å; L313-Q317 PolarHBondContact O-N 2.83Å
314	M	95.3	Very high	96.4	Very high	5 Å²	5	20.6 Å²	20.6	3%	0.025	12%	0.116	C	C	.	.	H	α-helix	trans	-69.2	-43.2	-175.6	-73.2	-48.8	98.6	0	0	112.4	A49 W50 V53 F290 S310 L311 G316 Q317 F318	A49-M314 HydrophobicContact CB-CE 4.44Å; W50-M314 HydrophobicContact CD2-CE 4.43Å; W50-M314 HydrophobicContact CD2-SD 3.91Å; W50-M314 HydrophobicContact CG-CE 4Å; W50-M314 HydrophobicContact CG-SD 3.91Å; W50-M314 HydrophobicContact CZ2-SD 4.29Å; W50-M314 VanDerWaalsContact NE1-CE 3.31Å; V53-M314 HydrophobicContact CB-CG 3.82Å; V53-M314 HydrophobicContact CG1-CG 4.03Å; V53-M314 HydrophobicContact CG2-CB 4.18Å; V53-M314 HydrophobicContact CG2-CG 3.43Å; V53-M314 VanDerWaalsContact CG2-CG 3.43Å; F290-M314 HydrophobicContact CB-CB 4.32Å; F290-M314 HydrophobicContact CD1-CB 4.35Å; F290-M314 HydrophobicContact CG-CB 4.26Å; S310-M314 WeakPolarHBondContact O-CG 3.15Å; S310-M314 PolarHBondContact O-N 3.26Å; L311-M314 PolarHBondContact O-N 3.01Å; L311-M314 VanDerWaalsContact O-N 3.08Å; M314-G316 PolarHBondContact O-N 3.15Å; M314-Q317 PolarHBondContact O-N 2.93Å; M314-F318 WeakPolarHBondContact O-CB 3.16Å; M314-F318 PolarHBondContact O-N 2.84Å
315	I	95.5	Very high	96.5	Very high	1 Å²	1	17 Å²	17	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-61.2	-38.3	176.7	63.2	160.7	0	0	0	110.9	F290 I294 L311 G312 F319 F467 I470 F475	F290-I315 HydrophobicContact CD2-CG2 3.97Å; I294-I315 HydrophobicContact CD1-CG2 4.16Å; I294-I315 HydrophobicContact CG2-CG2 4.11Å; L311-I315 WeakPolarHBondContact O-CG1 3.41Å; L311-I315 WeakPolarHBondContact O-CG2 3.38Å; L311-I315 PolarHBondContact O-N 2.88Å; G312-I315 VanDerWaalsContact O-CG1 3.23Å; G312-I315 WeakPolarHBondContact O-CG1 3.41Å; I315-F319 VanDerWaalsContact O-CB 3.32Å; I315-F319 WeakPolarHBondContact O-CB 3.46Å; I315-F319 PolarHBondContact O-N 2.89Å; I315-F467 HydrophobicContact CD1-CD1 4.38Å; I315-I470 HydrophobicContact CB-CG2 4.25Å; I315-I470 HydrophobicContact CD1-CB 4.32Å; I315-I470 HydrophobicContact CD1-CG2 4.27Å; I315-F475 HydrophobicContact CD1-CD1 3.68Å; I315-F475 HydrophobicContact CD1-CE1 3.31Å; I315-F475 HydrophobicContact CD1-CZ 4.24Å; I315-F475 HydrophobicContact CG1-CE1 4.19Å
316	G	94.6	Very high	96.6	Very high	11 Å²	11	15 Å²	15	11%	0.113	8%	0.082	C	C	.	.	H	α-helix	trans	-63.5	-52	174.8	0	0	0	0	0	110.9	G312 L313 M314 F318 F319 H320 I348	G312-G316 PolarHBondContact O-N 3.47Å; L313-G316 PolarHBondContact O-N 3.31Å; M314-G316 PolarHBondContact O-N 3.15Å; G316-F318 VanDerWaalsContact C-N 3.33Å; G316-F318 PolarHBondContact O-N 3.24Å; G316-F319 WeakPolarHBondContact O-CB 3.29Å; G316-F319 PolarHBondContact O-N 2.88Å; G316-F319 VanDerWaalsContact O-N 3.14Å; G316-H320 PolarHBondContact O-N 2.92Å; G316-I348 WeakPolarHBondContact O-CD1 3.3Å
317	Q	94.7	Very high	96.7	Very high	33 Å²	33	12.9 Å²	12.9	15%	0.154	7%	0.07	C	C	.	.	H	α-helix	trans	-62	-41.8	-178.1	-95.6	-62.3	-3.5	0	0	112.7	L313 M314 F319 H320 L321 T349	L313-Q317 PolarHBondContact O-N 2.83Å; M314-Q317 PolarHBondContact O-N 2.93Å; Q317-F319 VanDerWaalsContact C-N 3.35Å; Q317-F319 PolarHBondContact O-N 3.15Å; Q317-H320 PolarHBondContact O-N 3.42Å; Q317-H320 PolarHBondContact OE1-ND1 3.43Å; Q317-L321 WeakPolarHBondContact O-CG 3.16Å; Q317-L321 PolarHBondContact O-N 2.93Å; Q317-T349 PolarHBondContact NE2-OG1 3.41Å
318	F	96.8	Very high	96.8	Very high	2 Å²	2	12.5 Å²	12.5	1%	0.009	7%	0.068	C	C	.	.	H	α-helix	trans	-60	-45.5	173.1	172.2	-112.3	0	0	0	111.7	N87 W90 I281 M284 L285 F290 E291 M314 G316 H320 L321 K322	N87-F318 HydrophobicContact CB-CE1 3.74Å; N87-F318 HydrophobicContact CB-CZ 4.05Å; W90-F318 HydrophobicContact CB-CZ 4.02Å; W90-F318 HydrophobicContact CG-CZ 4.09Å; I281-F318 HydrophobicContact CG2-CD2 4.28Å; I281-F318 HydrophobicContact CG2-CE2 3.65Å; M284-F318 HydrophobicContact CE-CB 4.11Å; M284-F318 HydrophobicContact CE-CD2 3.5Å; M284-F318 VanDerWaalsContact CE-CD2 3.5Å; M284-F318 HydrophobicContact CE-CE2 4.36Å; M284-F318 HydrophobicContact CE-CG 4.2Å; L285-F318 HydrophobicContact CD1-CE2 4.37Å; L285-F318 HydrophobicContact CD2-CE2 4.02Å; L285-F318 HydrophobicContact CD2-CZ 4.27Å; L285-F318 HydrophobicContact CG-CE2 4.44Å; F290-F318 HydrophobicContact CE1-CB 4.41Å; F290-F318 HydrophobicContact CE2-CB 3.52Å; F290-F318 AromaticContact CE2-CD1 3.51Å; F290-F318 HydrophobicContact CE2-CD1 3.51Å; F290-F318 HydrophobicContact CE2-CD2 4.26Å; F290-F318 HydrophobicContact CE2-CE1 4.24Å; F290-F318 AromaticContact CE2-CG 3.49Å; F290-F318 HydrophobicContact CE2-CG 3.49Å; F290-F318 VanDerWaalsContact CE2-CG 3.49Å; F290-F318 HydrophobicContact CZ-CB 3.44Å; F290-F318 VanDerWaalsContact CZ-CB 3.44Å; F290-F318 AromaticContact CZ-CD1 3.86Å; F290-F318 HydrophobicContact CZ-CD1 3.86Å; F290-F318 AromaticContact CZ-CD2 3.73Å; F290-F318 HydrophobicContact CZ-CD2 3.73Å; F290-F318 HydrophobicContact CZ-CE2 4.41Å; F290-F318 AromaticContact CZ-CG 3.38Å; F290-F318 HydrophobicContact CZ-CG 3.38Å; E291-F318 HydrophobicContact CG-CE1 4.46Å; M314-F318 WeakPolarHBondContact O-CB 3.16Å; M314-F318 PolarHBondContact O-N 2.84Å; G316-F318 VanDerWaalsContact C-N 3.33Å; G316-F318 PolarHBondContact O-N 3.24Å; F318-H320 VanDerWaalsContact C-N 3.31Å; F318-H320 PolarHBondContact O-N 2.81Å; F318-L321 PolarHBondContact O-N 3.47Å; F318-K322 VanDerWaalsContact O-CB 3.22Å; F318-K322 WeakPolarHBondContact O-CB 3.37Å; F318-K322 PolarHBondContact O-N 3.47Å
319	F	96.5	Very high	96.8	Very high	25 Å²	25	14 Å²	14	11%	0.11	7%	0.074	C	C	.	.	H	α-helix	trans	-55.3	-46.2	176.3	178.8	-91	0	0	0	111.8	I315 G316 Q317 K322 Y323 F361 F469 I470	I315-F319 VanDerWaalsContact O-CB 3.32Å; I315-F319 WeakPolarHBondContact O-CB 3.46Å; I315-F319 PolarHBondContact O-N 2.89Å; G316-F319 WeakPolarHBondContact O-CB 3.29Å; G316-F319 PolarHBondContact O-N 2.88Å; G316-F319 VanDerWaalsContact O-N 3.14Å; Q317-F319 VanDerWaalsContact C-N 3.35Å; Q317-F319 PolarHBondContact O-N 3.15Å; F319-K322 WeakPolarHBondContact O-CB 3.37Å; F319-Y323 HydrophobicContact CD1-CD2 4.34Å; F319-Y323 HydrophobicContact CD2-CD2 4.36Å; F319-Y323 HydrophobicContact CD2-CE2 4.02Å; F319-Y323 HydrophobicContact CE1-CD2 4.06Å; F319-Y323 HydrophobicContact CE1-CE2 4.15Å; F319-Y323 HydrophobicContact CE2-CD2 4.08Å; F319-Y323 AromaticContact CE2-CE2 3.46Å; F319-Y323 HydrophobicContact CE2-CE2 3.46Å; F319-Y323 VanDerWaalsContact CE2-CE2 3.46Å; F319-Y323 HydrophobicContact CG-CD2 4.48Å; F319-Y323 AromaticContact CZ-CD2 3.9Å; F319-Y323 HydrophobicContact CZ-CD2 3.9Å; F319-Y323 AromaticContact CZ-CE2 3.51Å; F319-Y323 HydrophobicContact CZ-CE2 3.51Å; F319-Y323 WeakPolarHBondContact O-CD2 3.5Å; F319-Y323 PolarHBondContact O-N 3.4Å; F319-F361 HydrophobicContact CD1-CE2 4.17Å; F319-F361 AromaticContact CD1-CZ 3.77Å; F319-F361 HydrophobicContact CD1-CZ 3.77Å; F319-F361 AromaticContact CE1-CE1 3.62Å; F319-F361 HydrophobicContact CE1-CE1 3.62Å; F319-F361 AromaticContact CE1-CE2 3.87Å; F319-F361 HydrophobicContact CE1-CE2 3.87Å; F319-F361 AromaticContact CE1-CZ 3.18Å; F319-F361 HydrophobicContact CE1-CZ 3.18Å; F319-F361 HydrophobicContact CZ-CE1 4.06Å; F319-F361 AromaticContact CZ-CZ 3.98Å; F319-F361 HydrophobicContact CZ-CZ 3.98Å; F319-F469 AromaticContact CE2-CE1 3.94Å; F319-F469 HydrophobicContact CE2-CE1 3.94Å; F319-F469 AromaticContact CZ-CE1 3.81Å; F319-F469 HydrophobicContact CZ-CE1 3.81Å; F319-I470 HydrophobicContact CB-CD1 3.87Å; F319-I470 HydrophobicContact CB-CG1 4.48Å; F319-I470 HydrophobicContact CB-CG2 4.07Å; F319-I470 HydrophobicContact CD1-CD1 3.94Å; F319-I470 HydrophobicContact CD2-CD1 4.02Å; F319-I470 HydrophobicContact CD2-CG1 3.87Å; F319-I470 HydrophobicContact CD2-CG2 4.11Å; F319-I470 HydrophobicContact CE1-CD1 4.49Å; F319-I470 HydrophobicContact CE2-CG1 4.22Å; F319-I470 HydrophobicContact CG-CD1 3.68Å; F319-I470 HydrophobicContact CG-CG1 4.09Å; F319-I470 HydrophobicContact CG-CG2 4.38Å
320	H	96.4	Very high	96.9	Very high	17 Å²	17	12.7 Å²	12.7	8%	0.079	7%	0.065	C	C	.	.	H	α-helix	trans	-62.2	-51.4	175.6	161	-107.8	0	0	0	112.8	G316 Q317 F318 K322 Y323 V324 I346 C347 I348	G316-H320 PolarHBondContact O-N 2.92Å; Q317-H320 PolarHBondContact O-N 3.42Å; Q317-H320 PolarHBondContact OE1-ND1 3.43Å; F318-H320 VanDerWaalsContact C-N 3.31Å; F318-H320 PolarHBondContact O-N 2.81Å; H320-K322 VanDerWaalsContact C-N 3.29Å; H320-K322 PolarHBondContact O-N 3.25Å; H320-Y323 PolarHBondContact O-N 2.83Å; H320-Y323 VanDerWaalsContact O-N 3.14Å; H320-V324 WeakPolarHBondContact O-CG2 3.15Å; H320-V324 PolarHBondContact O-N 3.12Å; H320-I346 PolarHBondContact CD2-O 3.39Å; H320-C347 WeakPolarHBondContact NE2-CA 3.29Å; H320-I348 HydrophobicContact CB-CB 4.38Å; H320-I348 HydrophobicContact CB-CD1 3.9Å; H320-I348 HydrophobicContact CB-CG1 3.7Å; H320-I348 HydrophobicContact CB-CG2 3.88Å
321	L	97	Very high	97	Very high	9 Å²	9	12.3 Å²	12.3	5%	0.047	6%	0.063	C	C	.	.	H	α-helix	trans	-61.4	-39.3	-178.8	-70.7	177.4	0	0	0	111.8	W277 F280 I281 Q317 F318 Y323 V324 V325	W277-L321 HydrophobicContact CD2-CD2 4.16Å; W277-L321 HydrophobicContact CE3-CD2 3.67Å; W277-L321 HydrophobicContact CH2-CD2 4.29Å; W277-L321 HydrophobicContact CZ3-CD2 3.75Å; F280-L321 HydrophobicContact CD1-CD1 4.13Å; F280-L321 HydrophobicContact CE1-CD1 3.81Å; I281-L321 HydrophobicContact CD1-CB 3.95Å; I281-L321 WeakPolarHBondContact CD1-O 3.04Å; I281-L321 HydrophobicContact CG1-CB 4.14Å; Q317-L321 WeakPolarHBondContact O-CG 3.16Å; Q317-L321 PolarHBondContact O-N 2.93Å; F318-L321 PolarHBondContact O-N 3.47Å; L321-Y323 VanDerWaalsContact C-N 3.33Å; L321-Y323 PolarHBondContact O-N 3.12Å; L321-V324 WeakPolarHBondContact O-CB 3.42Å; L321-V324 PolarHBondContact O-N 2.93Å; L321-V325 PolarHBondContact O-N 3.3Å
322	K	97.6	Very high	97	Very high	6 Å²	6	14.7 Å²	14.7	3%	0.026	7%	0.073	C	C	.	.	H	α-helix	trans	-52	-51.8	172.6	172.5	174.3	70.5	169.5	0	110.7	N87 E89 W90 F318 F319 H320 V324 V325 I326	N87-K322 PolarHBondContact OD1-NZ 3.5Å; E89-K322 WeakPolarHBondContact OE2-CE 3.32Å; E89-K322 IonicContact OE2-NZ 3.8Å; E89-K322 PolarHBondContact OE2-NZ 3.13Å; W90-K322 HydrophobicContact CB-CD 4.1Å; W90-K322 HydrophobicContact CE3-CB 4.36Å; W90-K322 HydrophobicContact CE3-CD 4.27Å; W90-K322 HydrophobicContact CE3-CG 3.73Å; W90-K322 HydrophobicContact CZ3-CG 4.22Å; F318-K322 VanDerWaalsContact O-CB 3.22Å; F318-K322 WeakPolarHBondContact O-CB 3.37Å; F318-K322 PolarHBondContact O-N 3.47Å; F319-K322 WeakPolarHBondContact O-CB 3.37Å; H320-K322 VanDerWaalsContact C-N 3.29Å; H320-K322 PolarHBondContact O-N 3.25Å; K322-V324 PolarHBondContact O-N 2.97Å; K322-V325 PolarHBondContact O-N 3.38Å; K322-V325 VanDerWaalsContact O-N 3.1Å; K322-I326 HydrophobicContact CD-CD1 3.97Å; K322-I326 HydrophobicContact CG-CD1 3.52Å; K322-I326 HydrophobicContact CG-CG1 4.13Å; K322-I326 WeakPolarHBondContact O-CG1 3.36Å; K322-I326 PolarHBondContact O-N 3.31Å
323	Y	98	Very high	97.1	Very high	30 Å²	30	15.1 Å²	15.1	12%	0.118	7%	0.074	C	C	.	.	H	α-helix	trans	-73.9	-24.5	-178.9	-80.7	-76.3	0	0	0	114.4	E89 F319 H320 L321 V325 I326 F327 F361	E89-Y323 VanDerWaalsContact CD-OH 3.28Å; E89-Y323 PolarHBondContact OE1-OH 3.12Å; E89-Y323 PolarHBondContact OE2-OH 2.99Å; F319-Y323 HydrophobicContact CD1-CD2 4.34Å; F319-Y323 HydrophobicContact CD2-CD2 4.36Å; F319-Y323 HydrophobicContact CD2-CE2 4.02Å; F319-Y323 HydrophobicContact CE1-CD2 4.06Å; F319-Y323 HydrophobicContact CE1-CE2 4.15Å; F319-Y323 HydrophobicContact CE2-CD2 4.08Å; F319-Y323 AromaticContact CE2-CE2 3.46Å; F319-Y323 HydrophobicContact CE2-CE2 3.46Å; F319-Y323 VanDerWaalsContact CE2-CE2 3.46Å; F319-Y323 HydrophobicContact CG-CD2 4.48Å; F319-Y323 AromaticContact CZ-CD2 3.9Å; F319-Y323 HydrophobicContact CZ-CD2 3.9Å; F319-Y323 AromaticContact CZ-CE2 3.51Å; F319-Y323 HydrophobicContact CZ-CE2 3.51Å; F319-Y323 WeakPolarHBondContact O-CD2 3.5Å; F319-Y323 PolarHBondContact O-N 3.4Å; H320-Y323 PolarHBondContact O-N 2.83Å; H320-Y323 VanDerWaalsContact O-N 3.14Å; L321-Y323 VanDerWaalsContact C-N 3.33Å; L321-Y323 PolarHBondContact O-N 3.12Å; Y323-V325 PolarHBondContact O-N 3.08Å; Y323-I326 HydrophobicContact CD1-CB 4.33Å; Y323-I326 HydrophobicContact CD1-CG2 4.38Å; Y323-I326 HydrophobicContact CE1-CG2 4.47Å; Y323-F327 HydrophobicContact CD1-CD1 4.03Å; Y323-F327 HydrophobicContact CD1-CD2 4.44Å; Y323-F327 AromaticContact CD1-CE1 3.49Å; Y323-F327 HydrophobicContact CD1-CE1 3.49Å; Y323-F327 VanDerWaalsContact CD1-CE1 3.49Å; Y323-F327 AromaticContact CD1-CE2 3.94Å; Y323-F327 HydrophobicContact CD1-CE2 3.94Å; Y323-F327 HydrophobicContact CD1-CG 4.48Å; Y323-F327 AromaticContact CD1-CZ 3.44Å; Y323-F327 HydrophobicContact CD1-CZ 3.44Å; Y323-F327 VanDerWaalsContact CD1-CZ 3.44Å; Y323-F327 AromaticContact CE1-CE1 3.86Å; Y323-F327 HydrophobicContact CE1-CE1 3.86Å; Y323-F327 AromaticContact CE1-CZ 3.91Å; Y323-F327 HydrophobicContact CE1-CZ 3.91Å; Y323-F327 HydrophobicContact CG-CZ 4.37Å; Y323-F327 VanDerWaalsContact O-CB 3.3Å; Y323-F327 WeakPolarHBondContact O-CB 3.17Å; Y323-F327 WeakPolarHBondContact O-CG 3.48Å; Y323-F327 PolarHBondContact O-N 3.28Å; Y323-F361 AromaticContact CD2-CE1 3.97Å; Y323-F361 HydrophobicContact CD2-CE1 3.97Å; Y323-F361 AromaticContact CD2-CZ 3.62Å; Y323-F361 HydrophobicContact CD2-CZ 3.62Å; Y323-F361 HydrophobicContact CE2-CZ 4.46Å; Y323-F361 HydrophobicContact CG-CE1 4.01Å; Y323-F361 AromaticContact CG-CZ 3.79Å; Y323-F361 HydrophobicContact CG-CZ 3.79Å
324	V	98.4	Very high	97.3	Very high	11 Å²	11	12.4 Å²	12.4	7%	0.067	6%	0.06	C	C	.	.	H	α-helix	trans	-55.7	-39.4	166.2	169	0	0	0	0	110.3	I274 W277 H320 L321 K322 G328 L344 P345	I274-V324 HydrophobicContact CD1-CG1 4.37Å; W277-V324 HydrophobicContact CB-CG1 4.47Å; W277-V324 HydrophobicContact CG-CG1 4.22Å; H320-V324 WeakPolarHBondContact O-CG2 3.15Å; H320-V324 PolarHBondContact O-N 3.12Å; L321-V324 WeakPolarHBondContact O-CB 3.42Å; L321-V324 PolarHBondContact O-N 2.93Å; K322-V324 PolarHBondContact O-N 2.97Å; V324-G328 VanDerWaalsContact O-CA 3.26Å; V324-G328 WeakPolarHBondContact O-CA 3.42Å; V324-G328 PolarHBondContact O-N 2.88Å; V324-L344 HydrophobicContact CG1-CD1 4.28Å; V324-P345 HydrophobicContact CG2-CG 3.78Å
325	V	98.5	Very high	97.4	Very high	2 Å²	2	15.2 Å²	15.2	1%	0.012	7%	0.072	C	C	.	.	H	α-helix	trans	-83.7	-47.6	-179.7	179.2	0	0	0	0	112.2	W90 W93 I274 W277 Y278 I281 L321 K322 Y323 F327 G328 F329	W90-V325 HydrophobicContact CH2-CB 4.16Å; W90-V325 HydrophobicContact CH2-CG1 3.93Å; W90-V325 HydrophobicContact CZ3-CB 4.15Å; W90-V325 HydrophobicContact CZ3-CG1 4.14Å; W93-V325 HydrophobicContact CH2-CG1 3.62Å; W93-V325 HydrophobicContact CZ3-CG1 3.89Å; I274-V325 HydrophobicContact CG2-CG1 4.31Å; W277-V325 HydrophobicContact CB-CG2 3.7Å; Y278-V325 HydrophobicContact CD2-CG1 4.01Å; Y278-V325 HydrophobicContact CG-CG1 4.47Å; I281-V325 HydrophobicContact CD1-CG2 3.85Å; L321-V325 PolarHBondContact O-N 3.3Å; K322-V325 PolarHBondContact O-N 3.38Å; K322-V325 VanDerWaalsContact O-N 3.1Å; Y323-V325 PolarHBondContact O-N 3.08Å; V325-F327 VanDerWaalsContact C-N 3.34Å; V325-F327 PolarHBondContact O-N 2.92Å; V325-G328 PolarHBondContact O-N 3.48Å; V325-G328 VanDerWaalsContact O-N 3.12Å; V325-F329 WeakPolarHBondContact O-CB 3.5Å; V325-F329 PolarHBondContact O-N 3.45Å
326	I	98.1	Very high	97.5	Very high	2 Å²	2	15.8 Å²	15.8	1%	0.01	8%	0.075	C	C	.	.	H	α-helix	trans	-59	-43.8	-179.8	-68.4	-178.8	0	0	0	111.3	E89 W90 W93 S242 K322 Y323 P330	E89-I326 HydrophobicContact CG-CD1 4.34Å; W90-I326 HydrophobicContact CZ3-CG1 4.44Å; W93-I326 HydrophobicContact CD2-CD1 4.31Å; W93-I326 HydrophobicContact CD2-CG1 3.72Å; W93-I326 HydrophobicContact CE3-CG1 4.09Å; W93-I326 HydrophobicContact CG-CD1 4.18Å; W93-I326 HydrophobicContact CG-CG1 4.06Å; W93-I326 HydrophobicContact CZ2-CB 4.45Å; W93-I326 HydrophobicContact CZ2-CG1 4.18Å; W93-I326 HydrophobicContact CZ3-CG1 4.48Å; S242-I326 WeakPolarHBondContact OG-CG2 3.26Å; K322-I326 HydrophobicContact CD-CD1 3.97Å; K322-I326 HydrophobicContact CG-CD1 3.52Å; K322-I326 HydrophobicContact CG-CG1 4.13Å; K322-I326 WeakPolarHBondContact O-CG1 3.36Å; K322-I326 PolarHBondContact O-N 3.31Å; Y323-I326 HydrophobicContact CD1-CB 4.33Å; Y323-I326 HydrophobicContact CD1-CG2 4.38Å; Y323-I326 HydrophobicContact CE1-CG2 4.47Å; I326-P330 WeakPolarHBondContact O-CD 3.29Å; I326-P330 WeakPolarHBondContact O-CG 3.35Å
327	F	98.5	Very high	97.6	Very high	9 Å²	9	15.3 Å²	15.3	4%	0.039	7%	0.07	C	C	.	.	H	α-helix	trans	-79.1	-32.5	174.5	-62.4	-15.7	0	0	0	111.9	S242 L243 Y323 V325 P330 A331 L344 D362	S242-F327 WeakPolarHBondContact O-CD1 3.5Å; S242-F327 WeakPolarHBondContact O-CE1 3.24Å; L243-F327 HydrophobicContact CD2-CB 3.91Å; L243-F327 HydrophobicContact CD2-CD1 4.45Å; L243-F327 HydrophobicContact CD2-CG 4.28Å; Y323-F327 HydrophobicContact CD1-CD1 4.03Å; Y323-F327 HydrophobicContact CD1-CD2 4.44Å; Y323-F327 AromaticContact CD1-CE1 3.49Å; Y323-F327 HydrophobicContact CD1-CE1 3.49Å; Y323-F327 VanDerWaalsContact CD1-CE1 3.49Å; Y323-F327 AromaticContact CD1-CE2 3.94Å; Y323-F327 HydrophobicContact CD1-CE2 3.94Å; Y323-F327 HydrophobicContact CD1-CG 4.48Å; Y323-F327 AromaticContact CD1-CZ 3.44Å; Y323-F327 HydrophobicContact CD1-CZ 3.44Å; Y323-F327 VanDerWaalsContact CD1-CZ 3.44Å; Y323-F327 AromaticContact CE1-CE1 3.86Å; Y323-F327 HydrophobicContact CE1-CE1 3.86Å; Y323-F327 AromaticContact CE1-CZ 3.91Å; Y323-F327 HydrophobicContact CE1-CZ 3.91Å; Y323-F327 HydrophobicContact CG-CZ 4.37Å; Y323-F327 VanDerWaalsContact O-CB 3.3Å; Y323-F327 WeakPolarHBondContact O-CB 3.17Å; Y323-F327 WeakPolarHBondContact O-CG 3.48Å; Y323-F327 PolarHBondContact O-N 3.28Å; V325-F327 VanDerWaalsContact C-N 3.34Å; V325-F327 PolarHBondContact O-N 2.92Å; F327-P330 WeakPolarHBondContact O-CD 3.46Å; F327-P330 WeakPolarHBondContact O-CG 3.21Å; F327-A331 WeakPolarHBondContact O-CB 3.3Å; F327-A331 PolarHBondContact O-N 3.43Å; F327-L344 HydrophobicContact CB-CD2 4.16Å; F327-D362 HydrophobicContact CE2-CB 4.02Å; F327-D362 HydrophobicContact CZ-CB 4.15Å; F327-D362 WeakPolarHBondContact CZ-OD2 3.42Å
328	G	98.4	Very high	97.6	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-66.2	-39.6	-178.1	0	0	0	0	0	114.5	F270 V324 V325 A331 F332	F270-G328 WeakPolarHBondContact CE1-O 3.48Å; V324-G328 VanDerWaalsContact O-CA 3.26Å; V324-G328 WeakPolarHBondContact O-CA 3.42Å; V324-G328 PolarHBondContact O-N 2.88Å; V325-G328 PolarHBondContact O-N 3.48Å; V325-G328 VanDerWaalsContact O-N 3.12Å; G328-A331 PolarHBondContact O-N 3Å; G328-F332 WeakPolarHBondContact O-CB 3.37Å; G328-F332 PolarHBondContact O-N 3.42Å
329	F	98.4	Very high	97.6	Very high	31 Å²	31	14.7 Å²	14.7	14%	0.136	7%	0.067	C	C	.	.	H	α-helix	trans	-57.9	-59.9	-179.9	176.3	-96.8	0	0	0	112.6	W93 V97 A101 Y104 V325 A331 F332 F333	W93-F329 HydrophobicContact CH2-CB 4.34Å; W93-F329 HydrophobicContact CZ2-CB 4.06Å; W93-F329 HydrophobicContact CZ2-CG 4.44Å; V97-F329 HydrophobicContact CG2-CD1 3.64Å; V97-F329 HydrophobicContact CG2-CD2 3.86Å; V97-F329 HydrophobicContact CG2-CE1 3.56Å; V97-F329 HydrophobicContact CG2-CE2 3.77Å; V97-F329 HydrophobicContact CG2-CG 3.8Å; V97-F329 HydrophobicContact CG2-CZ 3.63Å; A101-F329 HydrophobicContact CB-CE2 4.49Å; A101-F329 HydrophobicContact CB-CZ 4.29Å; Y104-F329 HydrophobicContact CD1-CE1 4.19Å; Y104-F329 AromaticContact CD2-CE1 3.51Å; Y104-F329 HydrophobicContact CD2-CE1 3.51Å; Y104-F329 AromaticContact CD2-CZ 3.83Å; Y104-F329 HydrophobicContact CD2-CZ 3.83Å; Y104-F329 HydrophobicContact CE1-CE1 4.19Å; Y104-F329 AromaticContact CE2-CE1 3.59Å; Y104-F329 HydrophobicContact CE2-CE1 3.59Å; Y104-F329 HydrophobicContact CE2-CZ 4.37Å; Y104-F329 AromaticContact CG-CE1 3.84Å; Y104-F329 HydrophobicContact CG-CE1 3.84Å; Y104-F329 AromaticContact CG-CZ 3.95Å; Y104-F329 HydrophobicContact CG-CZ 3.95Å; Y104-F329 AromaticContact CZ-CE1 3.93Å; V325-F329 WeakPolarHBondContact O-CB 3.5Å; V325-F329 PolarHBondContact O-N 3.45Å; F329-A331 VanDerWaalsContact C-N 3.3Å; F329-A331 PolarHBondContact O-N 2.91Å; F329-F332 WeakPolarHBondContact O-CB 3.29Å; F329-F332 PolarHBondContact O-N 2.71Å; F329-F333 HydrophobicContact CD2-CE2 4.29Å; F329-F333 HydrophobicContact CE1-CE2 4.42Å; F329-F333 AromaticContact CE2-CE2 3.71Å; F329-F333 HydrophobicContact CE2-CE2 3.71Å; F329-F333 HydrophobicContact CZ-CD2 4.38Å; F329-F333 AromaticContact CZ-CE2 3.77Å; F329-F333 HydrophobicContact CZ-CE2 3.77Å; F329-F333 WeakPolarHBondContact O-CD2 3.42Å
330	P	98.1	Very high	97.6	Very high	3 Å²	3	17.7 Å²	17.7	2%	0.019	8%	0.083	C	C	.	.	H	α-helix	trans	-64.2	-34.1	175.8	23.3	-30.8	0	0	0	112.7	Y104 P238 L243 I326 F327 F332 F333 A334	Y104-P330 HydrophobicContact CE1-CB 4.43Å; P238-P330 WeakPolarHBondContact O-CB 3.11Å; L243-P330 HydrophobicContact CD1-CB 3.87Å; L243-P330 HydrophobicContact CD1-CG 3.91Å; L243-P330 HydrophobicContact CG-CB 4.24Å; L243-P330 HydrophobicContact CG-CG 3.84Å; I326-P330 WeakPolarHBondContact O-CD 3.29Å; I326-P330 WeakPolarHBondContact O-CG 3.35Å; F327-P330 WeakPolarHBondContact O-CD 3.46Å; F327-P330 WeakPolarHBondContact O-CG 3.21Å; P330-F332 VanDerWaalsContact C-N 3.25Å; P330-F332 PolarHBondContact O-N 2.94Å; P330-F333 PolarHBondContact O-N 3.11Å; P330-A334 PolarHBondContact O-N 2.84Å
331	A	98.4	Very high	97.7	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.008	8%	0.082	C	C	.	.	H	α-helix	trans	-63.1	-32.4	177.8	0	0	0	0	0	112.4	L243 F270 F327 G328 F329 A334 K335 P341	L243-A331 HydrophobicContact CD1-CB 4.03Å; F270-A331 HydrophobicContact CE1-CB 4.03Å; F270-A331 HydrophobicContact CZ-CB 3.85Å; F327-A331 WeakPolarHBondContact O-CB 3.3Å; F327-A331 PolarHBondContact O-N 3.43Å; G328-A331 PolarHBondContact O-N 3Å; F329-A331 VanDerWaalsContact C-N 3.3Å; F329-A331 PolarHBondContact O-N 2.91Å; A331-A334 PolarHBondContact O-N 2.76Å; A331-K335 WeakPolarHBondContact O-CB 3.45Å; A331-K335 WeakPolarHBondContact O-CG 3.36Å; A331-K335 PolarHBondContact O-N 3.08Å; A331-P341 HydrophobicContact CB-CB 3.72Å; A331-P341 HydrophobicContact CB-CG 3.75Å
332	F	98.4	Very high	97.7	Very high	49 Å²	49	18.1 Å²	18.1	22%	0.215	9%	0.088	C	C	.	.	H	α-helix	trans	-63	-48.5	175.3	171	-119.9	0	0	0	110.9	T267 F270 G271 G328 F329 P330 A334 K335 L336	T267-F332 HydrophobicContact CG2-CD2 4.1Å; T267-F332 HydrophobicContact CG2-CE2 3.97Å; T267-F332 WeakPolarHBondContact O-CD2 3.28Å; T267-F332 VanDerWaalsContact O-CE2 3.31Å; T267-F332 WeakPolarHBondContact O-CE2 3.49Å; F270-F332 HydrophobicContact CD1-CB 3.93Å; F270-F332 HydrophobicContact CD1-CD2 4.23Å; F270-F332 HydrophobicContact CE1-CB 3.93Å; G271-F332 VanDerWaalsContact CA-CD2 3.44Å; G328-F332 WeakPolarHBondContact O-CB 3.37Å; G328-F332 PolarHBondContact O-N 3.42Å; F329-F332 WeakPolarHBondContact O-CB 3.29Å; F329-F332 PolarHBondContact O-N 2.71Å; P330-F332 VanDerWaalsContact C-N 3.25Å; P330-F332 PolarHBondContact O-N 2.94Å; F332-A334 PolarHBondContact O-N 3.14Å; F332-K335 WeakPolarHBondContact O-CB 3.19Å; F332-K335 PolarHBondContact O-N 3.24Å; F332-K335 VanDerWaalsContact O-N 3.15Å; F332-L336 HydrophobicContact CD1-CD1 4.13Å; F332-L336 HydrophobicContact CD2-CG 4.34Å; F332-L336 HydrophobicContact CE1-CD1 3.62Å; F332-L336 HydrophobicContact CE1-CG 4.33Å; F332-L336 HydrophobicContact CE2-CD1 4.13Å; F332-L336 HydrophobicContact CE2-CD2 4.02Å; F332-L336 HydrophobicContact CE2-CG 3.95Å; F332-L336 HydrophobicContact CZ-CD1 3.63Å; F332-L336 HydrophobicContact CZ-CD2 4.05Å; F332-L336 HydrophobicContact CZ-CG 3.96Å; F332-L336 WeakPolarHBondContact O-CG 3.05Å; F332-L336 PolarHBondContact O-N 2.99Å
333	F	98.1	Very high	97.6	Very high	14 Å²	14	20.5 Å²	20.5	6%	0.061	11%	0.109	C	C	.	.	H	α-helix	trans	-65.7	-38.8	177.2	-72	-85.7	0	0	0	112.4	Y104 F108 P238 F329 P330 K335 L336 D337	Y104-F333 VanDerWaalsContact C-CE1 3.47Å; Y104-F333 HydrophobicContact CD1-CB 3.79Å; Y104-F333 HydrophobicContact CD1-CD1 4.14Å; Y104-F333 AromaticContact CD1-CD2 3.47Å; Y104-F333 HydrophobicContact CD1-CD2 3.47Å; Y104-F333 VanDerWaalsContact CD1-CD2 3.47Å; Y104-F333 HydrophobicContact CD1-CE2 4.07Å; Y104-F333 AromaticContact CD1-CG 3.52Å; Y104-F333 HydrophobicContact CD1-CG 3.52Å; Y104-F333 HydrophobicContact CE1-CB 4.32Å; Y104-F333 HydrophobicContact CE1-CD2 4.27Å; Y104-F333 HydrophobicContact CE1-CG 4.42Å; Y104-F333 AromaticContact CG-CD2 3.98Å; Y104-F333 HydrophobicContact CG-CD2 3.98Å; Y104-F333 HydrophobicContact CG-CE2 4.11Å; Y104-F333 HydrophobicContact CG-CG 4.23Å; Y104-F333 HydrophobicContact CG-CZ 4.46Å; Y104-F333 WeakPolarHBondContact O-CD1 3.28Å; Y104-F333 VanDerWaalsContact O-CE1 3.31Å; Y104-F333 WeakPolarHBondContact O-CE1 3.47Å; F108-F333 HydrophobicContact CB-CD1 4.22Å; F108-F333 HydrophobicContact CB-CE1 4.4Å; P238-F333 HydrophobicContact CB-CB 4.38Å; P238-F333 HydrophobicContact CG-CB 4.17Å; F329-F333 HydrophobicContact CD2-CE2 4.29Å; F329-F333 HydrophobicContact CE1-CE2 4.42Å; F329-F333 AromaticContact CE2-CE2 3.71Å; F329-F333 HydrophobicContact CE2-CE2 3.71Å; F329-F333 HydrophobicContact CZ-CD2 4.38Å; F329-F333 AromaticContact CZ-CE2 3.77Å; F329-F333 HydrophobicContact CZ-CE2 3.77Å; F329-F333 WeakPolarHBondContact O-CD2 3.42Å; P330-F333 PolarHBondContact O-N 3.11Å; F333-K335 VanDerWaalsContact C-N 3.31Å; F333-K335 PolarHBondContact O-N 2.88Å; F333-L336 HydrophobicContact CD1-CD1 3.92Å; F333-L336 HydrophobicContact CE1-CD1 4.2Å; F333-L336 HydrophobicContact CG-CD1 4.49Å; F333-L336 WeakPolarHBondContact O-CA 3.24Å; F333-L336 WeakPolarHBondContact O-CB 3.35Å; F333-L336 PolarHBondContact O-N 2.8Å; F333-L336 VanDerWaalsContact O-N 3.1Å; F333-D337 PolarHBondContact O-N 3.44Å
334	A	98	Very high	97.5	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-59.9	-41	171.6	0	0	0	0	0	112.3	P238 Y239 P330 A331 F332 L336 D337 N338 M339 P341	P238-A334 HydrophobicContact CB-CB 3.84Å; Y239-A334 HydrophobicContact CD1-CB 4.39Å; Y239-A334 HydrophobicContact CE1-CB 3.5Å; P330-A334 PolarHBondContact O-N 2.84Å; A331-A334 PolarHBondContact O-N 2.76Å; F332-A334 PolarHBondContact O-N 3.14Å; A334-L336 VanDerWaalsContact C-N 3.35Å; A334-D337 CarbonylContact O-C 3.56Å; A334-D337 WeakPolarHBondContact O-CB 3.4Å; A334-D337 PolarHBondContact O-N 3.36Å; A334-N338 PolarHBondContact O-N 3.23Å; A334-M339 HydrophobicContact CB-CB 4.19Å; A334-M339 WeakPolarHBondContact O-CA 3.5Å; A334-M339 VanDerWaalsContact O-CB 3.26Å; A334-M339 WeakPolarHBondContact O-CB 3.38Å; A334-M339 PolarHBondContact O-N 2.71Å; A334-P341 HydrophobicContact CB-CB 4.15Å; A334-P341 HydrophobicContact CB-CG 4.17Å
335	K	97.6	Very high	97.4	Very high	64 Å²	64	20.3 Å²	20.3	28%	0.278	11%	0.11	S	C	.	.	H	α-helix	trans	-67	-36.4	174.3	-77	178	178.2	-63.7	0	112.3	T267 F270 A331 F332 F333 D337 N338 P341	T267-K335 HydrophobicContact CG2-CB 3.66Å; F270-K335 HydrophobicContact CB-CD 4.34Å; F270-K335 HydrophobicContact CD1-CD 3.96Å; F270-K335 HydrophobicContact CD2-CD 4.07Å; F270-K335 HydrophobicContact CE1-CD 4.26Å; F270-K335 HydrophobicContact CE2-CD 4.37Å; F270-K335 HydrophobicContact CG-CD 3.87Å; F270-K335 HydrophobicContact CZ-CD 4.46Å; A331-K335 WeakPolarHBondContact O-CB 3.45Å; A331-K335 WeakPolarHBondContact O-CG 3.36Å; A331-K335 PolarHBondContact O-N 3.08Å; F332-K335 WeakPolarHBondContact O-CB 3.19Å; F332-K335 PolarHBondContact O-N 3.24Å; F332-K335 VanDerWaalsContact O-N 3.15Å; F333-K335 VanDerWaalsContact C-N 3.31Å; F333-K335 PolarHBondContact O-N 2.88Å; K335-D337 PolarHBondContact O-N 2.96Å; K335-N338 WeakPolarHBondContact O-CA 3.34Å; K335-N338 PolarHBondContact O-N 3.33Å; K335-P341 HydrophobicContact CD-CG 4.46Å; K335-P341 HydrophobicContact CG-CG 3.83Å
336	L	97	Very high	97.2	Very high	13 Å²	13	20.6 Å²	20.6	7%	0.068	11%	0.112	C	C	.	.	H	α-helix	trans	-59.4	-37.8	172.2	-72.8	174.8	0	0	0	110.2	F108 R262 W264 T267 F332 F333 A334 N338	F108-L336 HydrophobicContact CD2-CB 3.63Å; F108-L336 HydrophobicContact CD2-CD1 3.83Å; F108-L336 HydrophobicContact CD2-CG 4.22Å; F108-L336 HydrophobicContact CE2-CB 3.74Å; F108-L336 HydrophobicContact CE2-CD1 4.14Å; F108-L336 HydrophobicContact CE2-CD2 4.05Å; F108-L336 HydrophobicContact CE2-CG 4.21Å; F108-L336 HydrophobicContact CG-CD1 4.25Å; R262-L336 PolarHBondContact NE-O 3.3Å; R262-L336 VanDerWaalsContact NE-O 3.07Å; R262-L336 PolarHBondContact NH2-O 2.99Å; W264-L336 HydrophobicContact CE3-CD2 4.32Å; W264-L336 HydrophobicContact CZ3-CD2 3.78Å; T267-L336 HydrophobicContact CG2-CD2 3.64Å; T267-L336 HydrophobicContact CG2-CG 3.91Å; F332-L336 HydrophobicContact CD1-CD1 4.13Å; F332-L336 HydrophobicContact CD2-CG 4.34Å; F332-L336 HydrophobicContact CE1-CD1 3.62Å; F332-L336 HydrophobicContact CE1-CG 4.33Å; F332-L336 HydrophobicContact CE2-CD1 4.13Å; F332-L336 HydrophobicContact CE2-CD2 4.02Å; F332-L336 HydrophobicContact CE2-CG 3.95Å; F332-L336 HydrophobicContact CZ-CD1 3.63Å; F332-L336 HydrophobicContact CZ-CD2 4.05Å; F332-L336 HydrophobicContact CZ-CG 3.96Å; F332-L336 WeakPolarHBondContact O-CG 3.05Å; F332-L336 PolarHBondContact O-N 2.99Å; F333-L336 HydrophobicContact CD1-CD1 3.92Å; F333-L336 HydrophobicContact CE1-CD1 4.2Å; F333-L336 HydrophobicContact CG-CD1 4.49Å; F333-L336 WeakPolarHBondContact O-CA 3.24Å; F333-L336 WeakPolarHBondContact O-CB 3.35Å; F333-L336 PolarHBondContact O-N 2.8Å; F333-L336 VanDerWaalsContact O-N 3.1Å; A334-L336 VanDerWaalsContact C-N 3.35Å; L336-N338 PolarHBondContact O-N 3.16Å
337	D	96.1	Very high	96.9	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.005	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	5.1	174.5	-63.5	-24.4	0	0	0	114.6	H107 F111 N112 Y236 R262 F333 A334 K335 M339	H107-D337 IonicContact CD2-OD2 2.77Å; H107-D337 IonicContact CE1-OD2 2.79Å; H107-D337 IonicContact NE2-OD2 2.66Å; H107-D337 PolarHBondContact NE2-OD2 2.84Å; F111-D337 HydrophobicContact CD1-CB 3.71Å; F111-D337 VanDerWaalsContact CD1-CG 3.42Å; F111-D337 VanDerWaalsContact CD1-OD1 3.23Å; F111-D337 WeakPolarHBondContact CD1-OD1 3.38Å; F111-D337 HydrophobicContact CE1-CB 3.57Å; F111-D337 HydrophobicContact CZ-CB 4.33Å; N112-D337 PolarHBondContact ND2-OD1 2.85Å; Y236-D337 PolarHBondContact OH-OD2 3.31Å; R262-D337 PolarHBondContact NH2-O 3.49Å; F333-D337 PolarHBondContact O-N 3.44Å; A334-D337 CarbonylContact O-C 3.56Å; A334-D337 WeakPolarHBondContact O-CB 3.4Å; A334-D337 PolarHBondContact O-N 3.36Å; K335-D337 PolarHBondContact O-N 2.96Å; D337-M339 HydrophobicContact CB-CG 4.29Å; D337-M339 PolarHBondContact O-N 3.28Å
338	N	96.4	Very high	96.3	Very high	16 Å²	16	24 Å²	24	9%	0.086	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.4	20.2	-174.3	-158.2	34.9	0	0	0	113.4	I257 R260 R262 A334 K335 L336	I257-N338 HydrophobicContact CG2-CB 4.26Å; I257-N338 PolarHBondContact O-ND2 3.19Å; R260-N338 WeakPolarHBondContact CD-O 3.31Å; R260-N338 PolarHBondContact NH1-O 3.5Å; R260-N338 PolarHBondContact O-ND2 2.85Å; R262-N338 WeakPolarHBondContact CA-OD1 3.47Å; R262-N338 HydrophobicContact CG-CB 4.36Å; A334-N338 PolarHBondContact O-N 3.23Å; K335-N338 WeakPolarHBondContact O-CA 3.34Å; K335-N338 PolarHBondContact O-N 3.33Å; L336-N338 PolarHBondContact O-N 3.16Å
339	M	96.6	Very high	95.8	Very high	6 Å²	6	25.4 Å²	25.4	3%	0.03	14%	0.142	C	C	.	.			trans	-80.8	168.6	170.8	-66.6	-72.3	-81.6	0	0	111.7	Y236 Y239 F250 Q253 M254 I257 A334 D337 P341	Y236-M339 HydrophobicContact CE1-CE 4.46Å; Y236-M339 VanDerWaalsContact OH-CG 3.31Å; Y236-M339 WeakPolarHBondContact OH-CG 3.26Å; Y239-M339 HydrophobicContact CE2-CE 3.89Å; F250-M339 HydrophobicContact CD2-CE 3.87Å; F250-M339 HydrophobicContact CE2-CE 4.06Å; Q253-M339 HydrophobicContact CB-CE 3.62Å; Q253-M339 HydrophobicContact CB-SD 3.77Å; M254-M339 HydrophobicContact CE-CE 3.87Å; M254-M339 HydrophobicContact CE-SD 4.12Å; I257-M339 HydrophobicContact CD1-CG 4.13Å; I257-M339 HydrophobicContact CD1-SD 3.51Å; I257-M339 VanDerWaalsContact CD1-SD 3.51Å; I257-M339 HydrophobicContact CG1-SD 3.72Å; A334-M339 HydrophobicContact CB-CB 4.19Å; A334-M339 WeakPolarHBondContact O-CA 3.5Å; A334-M339 VanDerWaalsContact O-CB 3.26Å; A334-M339 WeakPolarHBondContact O-CB 3.38Å; A334-M339 PolarHBondContact O-N 2.71Å; D337-M339 HydrophobicContact CB-CG 4.29Å; D337-M339 PolarHBondContact O-N 3.28Å; M339-P341 VanDerWaalsContact O-CD 3.24Å; M339-P341 WeakPolarHBondContact O-CD 3.26Å
340	I	96.5	Very high	95.3	Very high	87 Å²	87	27.6 Å²	27.6	45%	0.446	15%	0.149	S	C	.	.			trans	-116.2	79.9	-178.5	-54.9	170.2	0	0	0	107.9	Q253 R260	Q253-I340 HydrophobicContact CG-CB 4.33Å; Q253-I340 PolarHBondContact NE2-O 3.41Å; Q253-I340 PolarHBondContact OE1-O 3.18Å; Q253-I340 VanDerWaalsContact OE1-O 3.14Å; R260-I340 VanDerWaalsContact CZ-CD1 3.45Å
341	P	97.3	Very high	94.7	Very high	8 Å²	8	27.7 Å²	27.7	5%	0.052	15%	0.149	C	C	.	.	P	Polyproline II helix	trans	-59.9	153.7	174.6	28	-36.1	0	0	0	110.6	Y239 L243 A331 A334 K335 M339 A343	Y239-P341 HydrophobicContact CE1-CB 4.01Å; Y239-P341 VanDerWaalsContact OH-CA 3.27Å; Y239-P341 WeakPolarHBondContact OH-CA 3.39Å; Y239-P341 VanDerWaalsContact OH-N 3.15Å; L243-P341 HydrophobicContact CD1-CB 4.07Å; A331-P341 HydrophobicContact CB-CB 3.72Å; A331-P341 HydrophobicContact CB-CG 3.75Å; A334-P341 HydrophobicContact CB-CB 4.15Å; A334-P341 HydrophobicContact CB-CG 4.17Å; K335-P341 HydrophobicContact CD-CG 4.46Å; K335-P341 HydrophobicContact CG-CG 3.83Å; M339-P341 VanDerWaalsContact O-CD 3.24Å; M339-P341 WeakPolarHBondContact O-CD 3.26Å; P341-A343 PolarHBondContact O-N 2.9Å
342	P	96.8	Very high	94.2	Very high	27 Å²	27	28.2 Å²	28.2	18%	0.175	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-50.2	141.4	167.7	-23.5	33.3	0	0	0	110.3	V245 R363	V245-P342 HydrophobicContact CG2-CG 3.91Å; P342-R363 HydrophobicContact CB-CB 4.22Å
343	A	96	Very high	93.7	Very high	56 Å²	56	26.6 Å²	26.6	46%	0.463	15%	0.147	S	C	.	.	P	Polyproline II helix	trans	-65.4	152.2	176.8	0	0	0	0	0	110.6	P341 R363	P341-A343 PolarHBondContact O-N 2.9Å; A343-R363 PolarHBondContact O-NH1 3.05Å
344	L	96.7	Very high	93.1	Very high	26 Å²	26	26.2 Å²	26.2	14%	0.136	15%	0.145	C	C	.	.	P	Polyproline II helix	trans	-60	157.7	180	-64.4	-175.2	0	0	0	113.2	F270 I274 V324 F327 R363	F270-L344 HydrophobicContact CE2-CD1 3.7Å; F270-L344 HydrophobicContact CE2-CD2 4.45Å; F270-L344 HydrophobicContact CE2-CG 3.96Å; F270-L344 HydrophobicContact CZ-CD1 3.89Å; F270-L344 HydrophobicContact CZ-CD2 4.02Å; F270-L344 HydrophobicContact CZ-CG 4.04Å; I274-L344 HydrophobicContact CD1-CD1 3.8Å; V324-L344 HydrophobicContact CG1-CD1 4.28Å; F327-L344 HydrophobicContact CB-CD2 4.16Å; L344-R363 PolarHBondContact O-NH1 3.28Å
345	P	96.3	Very high	92.8	Very high	11 Å²	11	26.6 Å²	26.6	7%	0.071	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-55	144.7	-175.7	23.2	-35.3	0	0	0	112	V324 F361	V324-P345 HydrophobicContact CG2-CG 3.78Å; P345-F361 VanDerWaalsContact CA-O 3.26Å; P345-F361 WeakPolarHBondContact CA-O 3.24Å; P345-F361 HydrophobicContact CB-CD2 3.63Å; P345-F361 HydrophobicContact CB-CE2 3.76Å; P345-F361 HydrophobicContact CB-CG 4.18Å; P345-F361 HydrophobicContact CB-CZ 4.39Å; P345-F361 WeakPolarHBondContact CB-O 3.35Å
346	I	92.9	Very high	92.5	Very high	9 Å²	9	25.5 Å²	25.5	5%	0.046	15%	0.145	C	C	.	.	P	Polyproline II helix	trans	-59.3	141.1	166	-173.1	163.8	0	0	0	109.9	H320 I348 R350 V351 Y360	H320-I346 PolarHBondContact CD2-O 3.39Å; I346-I348 PolarHBondContact O-N 3.02Å; I346-I348 VanDerWaalsContact O-N 3.13Å; I346-R350 VanDerWaalsContact CG1-NH2 3.29Å; I346-V351 HydrophobicContact CD1-CG2 3.77Å; I346-V351 HydrophobicContact CG1-CG2 4.01Å; I346-V351 HydrophobicContact CG2-CG2 4.04Å; I346-Y360 HydrophobicContact CD1-CD2 4.42Å; I346-Y360 PolarHBondContact N-O 3.46Å
347	C	91.8	Very high	92.2	Very high	47 Å²	47	26 Å²	26	32%	0.318	15%	0.148	S	C	.	.	P	Polyproline II helix	trans	-57.8	119.7	169.5	179.8	0	0	0	0	109.1	H320 T349 R350	H320-C347 WeakPolarHBondContact NE2-CA 3.29Å; C347-T349 PolarHBondContact O-N 3.49Å; C347-R350 HydrophobicContact CB-CB 4.11Å; C347-R350 WeakPolarHBondContact O-CA 3.37Å; C347-R350 WeakPolarHBondContact O-CB 3.45Å; C347-R350 PolarHBondContact O-N 2.94Å
348	I	87.5	Confident	92	Very high	34 Å²	34	28.1 Å²	28.1	17%	0.174	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-66.8	-24.8	-177.1	61.3	163.3	0	0	0	112.6	G316 H320 I346 R350 V351 F361 Y506	G316-I348 WeakPolarHBondContact O-CD1 3.3Å; H320-I348 HydrophobicContact CB-CB 4.38Å; H320-I348 HydrophobicContact CB-CD1 3.9Å; H320-I348 HydrophobicContact CB-CG1 3.7Å; H320-I348 HydrophobicContact CB-CG2 3.88Å; I346-I348 PolarHBondContact O-N 3.02Å; I346-I348 VanDerWaalsContact O-N 3.13Å; I348-R350 PolarHBondContact O-N 2.99Å; I348-V351 PolarHBondContact O-N 3.46Å; I348-F361 HydrophobicContact CG2-CD2 4.11Å; I348-F361 HydrophobicContact CG2-CE2 4.11Å; I348-Y506 PolarHBondContact O-OH 3.32Å
349	T	87.1	Confident	91.9	Very high	30 Å²	30	30.4 Å²	30.4	18%	0.184	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-71.1	-4.7	170.9	-52.6	0	0	0	0	111.3	I46 Q317 C347 Y506 N510	I46-T349 HydrophobicContact CD1-CG2 4.19Å; Q317-T349 PolarHBondContact NE2-OG1 3.41Å; C347-T349 PolarHBondContact O-N 3.49Å; T349-Y506 HydrophobicContact CG2-CE2 4.02Å; T349-Y506 WeakPolarHBondContact O-CE2 3.29Å; T349-Y506 PolarHBondContact O-OH 2.85Å; T349-N510 PolarHBondContact O-OD1 3.38Å
350	R	87.7	Confident	91.8	Very high	78 Å²	78	33.5 Å²	33.5	29%	0.294	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-103	23	178.1	-156.9	179.8	57.2	82.5	-18	113.8	I346 C347 I348 N510 T513	I346-R350 VanDerWaalsContact CG1-NH2 3.29Å; C347-R350 HydrophobicContact CB-CB 4.11Å; C347-R350 WeakPolarHBondContact O-CA 3.37Å; C347-R350 WeakPolarHBondContact O-CB 3.45Å; C347-R350 PolarHBondContact O-N 2.94Å; I348-R350 PolarHBondContact O-N 2.99Å; R350-N510 WeakPolarHBondContact CA-OD1 3.4Å; R350-N510 PolarHBondContact O-OD1 3.34Å; R350-T513 HydrophobicContact CG-CG2 3.9Å
351	V	86.6	Confident	91.7	Very high	4 Å²	4	30.5 Å²	30.5	2%	0.024	16%	0.159	C	C	.	.			trans	-138.2	119.1	-169.5	-168.6	0	0	0	0	113.3	I346 I348 V353 D356 V357 Y506	I346-V351 HydrophobicContact CD1-CG2 3.77Å; I346-V351 HydrophobicContact CG1-CG2 4.01Å; I346-V351 HydrophobicContact CG2-CG2 4.04Å; I348-V351 PolarHBondContact O-N 3.46Å; V351-V353 WeakPolarHBondContact CG1-O 3.35Å; V351-D356 HydrophobicContact CG1-CB 3.96Å; V351-V357 HydrophobicContact CB-CG2 3.91Å; V351-V357 HydrophobicContact CG1-CG2 3.49Å; V351-V357 VanDerWaalsContact CG1-CG2 3.49Å; V351-V357 HydrophobicContact CG2-CG2 4.17Å; V351-Y506 PolarHBondContact N-OH 3.39Å; V351-Y506 PolarHBondContact O-OH 3.41Å
352	T	87.4	Confident	91.7	Very high	12 Å²	12	31.2 Å²	31.2	7%	0.074	16%	0.163	C	C	.	.	S	Bend	trans	-103.5	-17.5	177.8	63	0	0	0	0	113.5	Q455 V459 Y506 N507 N510	T352-Q455 PolarHBondContact OG1-OE1 3.13Å; T352-V459 WeakPolarHBondContact O-CG2 3.3Å; T352-Y506 HydrophobicContact CG2-CD1 4.17Å; T352-Y506 HydrophobicContact CG2-CE1 3.87Å; T352-N507 WeakPolarHBondContact CB-OD1 3.47Å; T352-N507 HydrophobicContact CG2-CB 4.27Å; T352-N507 WeakPolarHBondContact CG2-OD1 3.41Å; T352-N510 HydrophobicContact CG2-CB 3.34Å
353	V	87.8	Confident	91.7	Very high	15 Å²	15	33.3 Å²	33.3	9%	0.091	17%	0.167	C	C	.	.	S	Bend	trans	-122.7	121.7	178.3	-64.9	0	0	0	0	108.7	V351 S355 D356 L458	V351-V353 WeakPolarHBondContact CG1-O 3.35Å; V353-S355 PolarHBondContact O-N 3.41Å; V353-D356 HydrophobicContact CG2-CB 4.11Å; V353-D356 WeakPolarHBondContact CG2-OD2 3.33Å; V353-D356 WeakPolarHBondContact O-CB 3.49Å; V353-D356 PolarHBondContact O-N 2.96Å; V353-L458 HydrophobicContact CG1-CD1 3.89Å
354	F	85.5	Confident	91.7	Very high	6 Å²	6	30.7 Å²	30.7	3%	0.026	15%	0.145	C	C	.	.	H	α-helix	trans	-76.6	-12.1	-171.3	-82.7	-135.5	0	0	0	112.7	D356 V357 W358 E418 G462 F463 N466	F354-D356 PolarHBondContact O-N 3.33Å; F354-V357 HydrophobicContact CB-CB 4.4Å; F354-V357 HydrophobicContact CB-CG2 4.33Å; F354-V357 HydrophobicContact CD1-CB 4.46Å; F354-V357 HydrophobicContact CD1-CG2 4.16Å; F354-V357 HydrophobicContact CD2-CG2 4.26Å; F354-V357 HydrophobicContact CG-CB 4.44Å; F354-V357 HydrophobicContact CG-CG2 3.98Å; F354-V357 WeakPolarHBondContact O-CA 3.42Å; F354-V357 WeakPolarHBondContact O-CB 3.24Å; F354-V357 PolarHBondContact O-N 3.13Å; F354-W358 PolarHBondContact O-N 2.91Å; F354-E418 WeakPolarHBondContact CB-OE1 3.21Å; F354-E418 WeakPolarHBondContact CB-OE2 3.3Å; F354-E418 PolarHBondContact N-OE1 3.29Å; F354-G462 VanDerWaalsContact CE1-C 3.5Å; F354-G462 VanDerWaalsContact CE1-O 3.24Å; F354-G462 WeakPolarHBondContact CE1-O 3.28Å; F354-G462 WeakPolarHBondContact CZ-O 3.43Å; F354-F463 HydrophobicContact CZ-CD1 4.48Å; F354-N466 WeakPolarHBondContact CE1-ND2 3.35Å
355	S	90.9	Very high	91.6	Very high	8 Å²	8	30.4 Å²	30.4	6%	0.056	14%	0.144	C	C	.	.	H	α-helix	trans	-57.1	-28.2	164.1	68.2	0	0	0	0	113.5	V353 R359 E422	V353-S355 PolarHBondContact O-N 3.41Å; S355-R359 WeakPolarHBondContact O-CB 3.26Å; S355-R359 PolarHBondContact O-N 2.87Å; S355-R359 VanDerWaalsContact O-N 3.14Å; S355-E422 WeakPolarHBondContact CB-OE2 3.29Å; S355-E422 PolarHBondContact OG-OE1 3.2Å; S355-E422 PolarHBondContact OG-OE2 3.41Å
356	D	91.1	Very high	91.7	Very high	42 Å²	42	32.8 Å²	32.8	23%	0.225	15%	0.152	C	C	.	.	H	α-helix	trans	-78.2	-31.3	171.9	-77.4	-18.7	0	0	0	112.1	V351 V353 F354 R359 Y360	V351-D356 HydrophobicContact CG1-CB 3.96Å; V353-D356 HydrophobicContact CG2-CB 4.11Å; V353-D356 WeakPolarHBondContact CG2-OD2 3.33Å; V353-D356 WeakPolarHBondContact O-CB 3.49Å; V353-D356 PolarHBondContact O-N 2.96Å; F354-D356 PolarHBondContact O-N 3.33Å; D356-R359 PolarHBondContact O-N 3.24Å; D356-R359 IonicContact OD1-NH1 2.62Å; D356-R359 PolarHBondContact OD1-NH1 3.38Å; D356-Y360 HydrophobicContact CB-CD2 3.92Å; D356-Y360 HydrophobicContact CB-CE2 4.19Å; D356-Y360 WeakPolarHBondContact O-CB 3.4Å; D356-Y360 VanDerWaalsContact O-CD2 3.24Å; D356-Y360 WeakPolarHBondContact O-CD2 3.19Å; D356-Y360 PolarHBondContact O-N 3.13Å; D356-Y360 WeakPolarHBondContact OD1-CE2 3.44Å
357	V	91.3	Very high	91.9	Very high	22 Å²	22	34.2 Å²	34.2	13%	0.133	16%	0.16	C	C	.	.	H	α-helix	trans	-60.4	-53.5	168.9	180	0	0	0	0	109.3	V351 F354 R359 Y360 F361	V351-V357 HydrophobicContact CB-CG2 3.91Å; V351-V357 HydrophobicContact CG1-CG2 3.49Å; V351-V357 VanDerWaalsContact CG1-CG2 3.49Å; V351-V357 HydrophobicContact CG2-CG2 4.17Å; F354-V357 HydrophobicContact CB-CB 4.4Å; F354-V357 HydrophobicContact CB-CG2 4.33Å; F354-V357 HydrophobicContact CD1-CB 4.46Å; F354-V357 HydrophobicContact CD1-CG2 4.16Å; F354-V357 HydrophobicContact CD2-CG2 4.26Å; F354-V357 HydrophobicContact CG-CB 4.44Å; F354-V357 HydrophobicContact CG-CG2 3.98Å; F354-V357 WeakPolarHBondContact O-CA 3.42Å; F354-V357 WeakPolarHBondContact O-CB 3.24Å; F354-V357 PolarHBondContact O-N 3.13Å; V357-R359 PolarHBondContact O-N 3.4Å; V357-Y360 PolarHBondContact O-N 3.22Å; V357-F361 HydrophobicContact CG1-CB 4Å; V357-F361 HydrophobicContact CG1-CG 4.5Å; V357-F361 WeakPolarHBondContact O-CB 3.4Å; V357-F361 PolarHBondContact O-N 3.48Å
358	W	92.8	Very high	92.2	Very high	47 Å²	47	32 Å²	32	18%	0.178	15%	0.145	C	C	.	.	H	α-helix	trans	-57.1	-33.7	178.7	-76.4	106.8	0	0	0	113.3	F354 F369 F395 V398 W411 N415	F354-W358 PolarHBondContact O-N 2.91Å; W358-F369 HydrophobicContact CZ3-CE2 4.36Å; W358-F395 HydrophobicContact CD2-CE1 4.43Å; W358-F395 HydrophobicContact CD2-CZ 4.47Å; W358-F395 AromaticContact CE2-CE1 3.64Å; W358-F395 AromaticContact CE2-CZ 3.86Å; W358-F395 HydrophobicContact CH2-CE1 4.01Å; W358-F395 HydrophobicContact CZ2-CD1 4.35Å; W358-F395 AromaticContact CZ2-CE1 3.42Å; W358-F395 HydrophobicContact CZ2-CE1 3.42Å; W358-F395 VanDerWaalsContact CZ2-CE1 3.42Å; W358-F395 HydrophobicContact CZ2-CZ 4.13Å; W358-F395 AromaticContact NE1-CE1 3.96Å; W358-F395 AromaticContact NE1-CZ 3.78Å; W358-V398 HydrophobicContact CH2-CG1 3.9Å; W358-V398 HydrophobicContact CH2-CG2 4.13Å; W358-V398 HydrophobicContact CZ3-CG1 4.42Å; W358-V398 HydrophobicContact CZ3-CG2 3.93Å; W358-W411 AromaticContact CH2-CH2 3.68Å; W358-W411 HydrophobicContact CH2-CH2 3.68Å; W358-W411 AromaticContact CH2-CZ2 3.52Å; W358-W411 HydrophobicContact CH2-CZ2 3.52Å; W358-W411 HydrophobicContact CZ2-CH2 4.33Å; W358-W411 AromaticContact CZ2-CZ2 3.77Å; W358-W411 HydrophobicContact CZ2-CZ2 3.77Å; W358-N415 HydrophobicContact CZ2-CB 4.3Å; W358-N415 PolarHBondContact NE1-OD1 3.43Å
359	R	93.9	Very high	92.6	Very high	63 Å²	63	31.1 Å²	31.1	24%	0.238	14%	0.14	C	C	.	.	H	α-helix	trans	-81.4	-38.5	-179.6	-175.5	179.7	-66.6	138.6	4.4	113.8	S355 D356 V357 Y366	S355-R359 WeakPolarHBondContact O-CB 3.26Å; S355-R359 PolarHBondContact O-N 2.87Å; S355-R359 VanDerWaalsContact O-N 3.14Å; D356-R359 PolarHBondContact O-N 3.24Å; D356-R359 IonicContact OD1-NH1 2.62Å; D356-R359 PolarHBondContact OD1-NH1 3.38Å; V357-R359 PolarHBondContact O-N 3.4Å; R359-Y366 HydrophobicContact CB-CD2 4.15Å; R359-Y366 HydrophobicContact CB-CE2 4.03Å; R359-Y366 HydrophobicContact CB-CG 4.45Å; R359-Y366 HydrophobicContact CG-CD1 4.02Å; R359-Y366 HydrophobicContact CG-CD2 4.3Å; R359-Y366 HydrophobicContact CG-CE1 3.74Å; R359-Y366 HydrophobicContact CG-CE2 4.03Å; R359-Y366 HydrophobicContact CG-CG 4.28Å; R359-Y366 PolarHBondContact NE-OH 3.08Å
360	Y	94.8	Very high	93.1	Very high	71 Å²	71	33.8 Å²	33.8	28%	0.278	15%	0.149	S	C	.	.	H	α-helix	trans	-117.7	-7	-164.4	-57.7	-63.2	0	0	0	114.5	I346 D356 V357	I346-Y360 HydrophobicContact CD1-CD2 4.42Å; I346-Y360 PolarHBondContact N-O 3.46Å; D356-Y360 HydrophobicContact CB-CD2 3.92Å; D356-Y360 HydrophobicContact CB-CE2 4.19Å; D356-Y360 WeakPolarHBondContact O-CB 3.4Å; D356-Y360 VanDerWaalsContact O-CD2 3.24Å; D356-Y360 WeakPolarHBondContact O-CD2 3.19Å; D356-Y360 PolarHBondContact O-N 3.13Å; D356-Y360 WeakPolarHBondContact OD1-CE2 3.44Å; V357-Y360 PolarHBondContact O-N 3.22Å
361	F	94.4	Very high	93.5	Very high	24 Å²	24	33.5 Å²	33.5	11%	0.105	15%	0.151	C	C	.	.	S	Bend	trans	-73.6	-62.7	173	-171.7	-96.6	0	0	0	110.6	F319 Y323 P345 I348 V357	F319-F361 HydrophobicContact CD1-CE2 4.17Å; F319-F361 AromaticContact CD1-CZ 3.77Å; F319-F361 HydrophobicContact CD1-CZ 3.77Å; F319-F361 AromaticContact CE1-CE1 3.62Å; F319-F361 HydrophobicContact CE1-CE1 3.62Å; F319-F361 AromaticContact CE1-CE2 3.87Å; F319-F361 HydrophobicContact CE1-CE2 3.87Å; F319-F361 AromaticContact CE1-CZ 3.18Å; F319-F361 HydrophobicContact CE1-CZ 3.18Å; F319-F361 HydrophobicContact CZ-CE1 4.06Å; F319-F361 AromaticContact CZ-CZ 3.98Å; F319-F361 HydrophobicContact CZ-CZ 3.98Å; Y323-F361 AromaticContact CD2-CE1 3.97Å; Y323-F361 HydrophobicContact CD2-CE1 3.97Å; Y323-F361 AromaticContact CD2-CZ 3.62Å; Y323-F361 HydrophobicContact CD2-CZ 3.62Å; Y323-F361 HydrophobicContact CE2-CZ 4.46Å; Y323-F361 HydrophobicContact CG-CE1 4.01Å; Y323-F361 AromaticContact CG-CZ 3.79Å; Y323-F361 HydrophobicContact CG-CZ 3.79Å; P345-F361 VanDerWaalsContact CA-O 3.26Å; P345-F361 WeakPolarHBondContact CA-O 3.24Å; P345-F361 HydrophobicContact CB-CD2 3.63Å; P345-F361 HydrophobicContact CB-CE2 3.76Å; P345-F361 HydrophobicContact CB-CG 4.18Å; P345-F361 HydrophobicContact CB-CZ 4.39Å; P345-F361 WeakPolarHBondContact CB-O 3.35Å; I348-F361 HydrophobicContact CG2-CD2 4.11Å; I348-F361 HydrophobicContact CG2-CE2 4.11Å; V357-F361 HydrophobicContact CG1-CB 4Å; V357-F361 HydrophobicContact CG1-CG 4.5Å; V357-F361 WeakPolarHBondContact O-CB 3.4Å; V357-F361 PolarHBondContact O-N 3.48Å
362	D	95.6	Very high	94.1	Very high	23 Å²	23	34.2 Å²	34.2	12%	0.123	15%	0.153	C	C	.	.	S	Bend	trans	-114.2	94.7	168.6	-171.4	-19.8	0	0	0	109.8	F327 G364 L365 Y366	F327-D362 HydrophobicContact CE2-CB 4.02Å; F327-D362 HydrophobicContact CZ-CB 4.15Å; F327-D362 WeakPolarHBondContact CZ-OD2 3.42Å; D362-G364 VanDerWaalsContact C-N 3.27Å; D362-G364 PolarHBondContact O-N 2.67Å; D362-G364 PolarHBondContact OD1-N 3.31Å; D362-L365 HydrophobicContact CB-CB 3.9Å; D362-L365 PolarHBondContact OD1-N 2.66Å; D362-L365 WeakPolarHBondContact OD2-CB 3.22Å; D362-Y366 WeakPolarHBondContact O-CB 3.42Å; D362-Y366 PolarHBondContact O-N 2.9Å
363	R	96.9	Very high	94.5	Very high	71 Å²	71	34.1 Å²	34.1	27%	0.268	15%	0.152	S	C	.	.	H	α-helix	trans	-66.1	-31.2	-179.6	-67.2	-176.2	178.7	87.8	-1.8	112.5	P342 A343 L344 D367	P342-R363 HydrophobicContact CB-CB 4.22Å; A343-R363 PolarHBondContact O-NH1 3.05Å; L344-R363 PolarHBondContact O-NH1 3.28Å; R363-D367 WeakPolarHBondContact O-CB 3.42Å; R363-D367 VanDerWaalsContact O-CG 3.29Å; R363-D367 PolarHBondContact O-N 3.15Å
364	G	96.6	Very high	95	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-69.8	-48.8	-179.4	0	0	0	0	0	111.2	I244 D362 Y366 D367 F368	I244-G364 WeakPolarHBondContact CG2-O 3.42Å; I244-G364 WeakPolarHBondContact O-CA 3.45Å; D362-G364 VanDerWaalsContact C-N 3.27Å; D362-G364 PolarHBondContact O-N 2.67Å; D362-G364 PolarHBondContact OD1-N 3.31Å; G364-Y366 VanDerWaalsContact C-N 3.32Å; G364-Y366 PolarHBondContact O-N 3.49Å; G364-D367 PolarHBondContact O-N 3.02Å; G364-F368 PolarHBondContact O-N 3.33Å
365	L	95.7	Very high	95.5	Very high	20 Å²	20	36.9 Å²	36.9	11%	0.105	16%	0.164	C	C	.	.	H	α-helix	trans	-62.1	-40.7	173.9	-172.5	63	0	0	0	111.6	I202 I244 D362 D367 F368 F369	I202-L365 HydrophobicContact CD1-CD1 4.23Å; I244-L365 HydrophobicContact CD1-CB 3.9Å; I244-L365 HydrophobicContact CD1-CD1 3.55Å; I244-L365 HydrophobicContact CD1-CG 4.3Å; D362-L365 HydrophobicContact CB-CB 3.9Å; D362-L365 PolarHBondContact OD1-N 2.66Å; D362-L365 WeakPolarHBondContact OD2-CB 3.22Å; L365-D367 PolarHBondContact O-N 3.4Å; L365-F368 WeakPolarHBondContact O-CB 3.21Å; L365-F368 PolarHBondContact O-N 2.9Å; L365-F369 HydrophobicContact CD1-CD1 4.38Å; L365-F369 HydrophobicContact CD1-CE1 3.53Å; L365-F369 HydrophobicContact CD1-CE2 4.2Å; L365-F369 HydrophobicContact CD1-CZ 3.45Å; L365-F369 VanDerWaalsContact CD1-CZ 3.45Å; L365-F369 HydrophobicContact CD2-CE2 3.89Å; L365-F369 HydrophobicContact CD2-CZ 3.66Å; L365-F369 HydrophobicContact CG-CD2 4.3Å; L365-F369 HydrophobicContact CG-CE1 3.88Å; L365-F369 HydrophobicContact CG-CE2 3.59Å; L365-F369 HydrophobicContact CG-CZ 3.35Å; L365-F369 WeakPolarHBondContact O-CG 3.23Å; L365-F369 PolarHBondContact O-N 3.49Å
366	Y	96.9	Very high	95.7	Very high	62 Å²	62	39.5 Å²	39.5	24%	0.243	19%	0.186	C	C	.	.	H	α-helix	trans	-60.2	-45.6	174	174.4	-99.5	0	0	0	112.7	R359 D362 G364 F368 F369 K370	R359-Y366 HydrophobicContact CB-CD2 4.15Å; R359-Y366 HydrophobicContact CB-CE2 4.03Å; R359-Y366 HydrophobicContact CB-CG 4.45Å; R359-Y366 HydrophobicContact CG-CD1 4.02Å; R359-Y366 HydrophobicContact CG-CD2 4.3Å; R359-Y366 HydrophobicContact CG-CE1 3.74Å; R359-Y366 HydrophobicContact CG-CE2 4.03Å; R359-Y366 HydrophobicContact CG-CG 4.28Å; R359-Y366 PolarHBondContact NE-OH 3.08Å; D362-Y366 WeakPolarHBondContact O-CB 3.42Å; D362-Y366 PolarHBondContact O-N 2.9Å; G364-Y366 VanDerWaalsContact C-N 3.32Å; G364-Y366 PolarHBondContact O-N 3.49Å; Y366-F368 PolarHBondContact O-N 3Å; Y366-F369 PolarHBondContact O-N 3Å; Y366-K370 HydrophobicContact CE1-CB 4.44Å; Y366-K370 HydrophobicContact CE1-CD 3.93Å; Y366-K370 WeakPolarHBondContact O-CB 3.47Å; Y366-K370 PolarHBondContact O-N 3.29Å
367	D	97.5	Very high	96	Very high	39 Å²	39	39.4 Å²	39.4	21%	0.209	19%	0.185	C	C	.	.	H	α-helix	trans	-59.6	-39.3	176.2	-78.4	-42.2	0	0	0	111.4	K249 R363 G364 L365 E371	K249-D367 IonicContact NZ-OD1 3.57Å; K249-D367 PolarHBondContact NZ-OD1 3.25Å; K249-D367 VanDerWaalsContact NZ-OD1 3.08Å; K249-D367 IonicContact NZ-OD2 3.79Å; K249-D367 PolarHBondContact NZ-OD2 2.98Å; R363-D367 WeakPolarHBondContact O-CB 3.42Å; R363-D367 VanDerWaalsContact O-CG 3.29Å; R363-D367 PolarHBondContact O-N 3.15Å; G364-D367 PolarHBondContact O-N 3.02Å; L365-D367 PolarHBondContact O-N 3.4Å; D367-E371 WeakPolarHBondContact O-CB 2.96Å; D367-E371 PolarHBondContact O-N 3.43Å
368	F	97.9	Very high	96.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.9	-52.5	174.8	175.9	-92	0	0	0	111.8	W168 I202 I205 I244 I246 G364 L365 Y366 K370 E371 Y372 F397	W168-F368 AromaticContact CH2-CE1 3.83Å; W168-F368 HydrophobicContact CH2-CE1 3.83Å; W168-F368 AromaticContact CH2-CZ 3.59Å; W168-F368 HydrophobicContact CH2-CZ 3.59Å; W168-F368 HydrophobicContact CZ2-CZ 4.46Å; W168-F368 HydrophobicContact CZ3-CE1 4.47Å; W168-F368 HydrophobicContact CZ3-CZ 4.2Å; I202-F368 HydrophobicContact CB-CE2 4.42Å; I202-F368 HydrophobicContact CG1-CE2 4.49Å; I202-F368 HydrophobicContact CG1-CZ 4.28Å; I202-F368 HydrophobicContact CG2-CD2 3.71Å; I202-F368 HydrophobicContact CG2-CE2 3.8Å; I202-F368 HydrophobicContact CG2-CG 4.25Å; I202-F368 HydrophobicContact CG2-CZ 4.4Å; I205-F368 HydrophobicContact CG2-CE2 3.66Å; I205-F368 HydrophobicContact CG2-CZ 3.84Å; I244-F368 HydrophobicContact CG2-CB 4.12Å; I246-F368 HydrophobicContact CG2-CB 4.21Å; G364-F368 PolarHBondContact O-N 3.33Å; L365-F368 WeakPolarHBondContact O-CB 3.21Å; L365-F368 PolarHBondContact O-N 2.9Å; Y366-F368 PolarHBondContact O-N 3Å; F368-K370 VanDerWaalsContact C-N 3.31Å; F368-K370 PolarHBondContact O-N 2.88Å; F368-E371 PolarHBondContact O-N 3.42Å; F368-Y372 AromaticContact CD2-CD2 3.4Å; F368-Y372 HydrophobicContact CD2-CD2 3.4Å; F368-Y372 VanDerWaalsContact CD2-CD2 3.4Å; F368-Y372 AromaticContact CD2-CE2 3.88Å; F368-Y372 HydrophobicContact CD2-CE2 3.88Å; F368-Y372 AromaticContact CE2-CD2 3.71Å; F368-Y372 HydrophobicContact CE2-CD2 3.71Å; F368-Y372 HydrophobicContact CE2-CE2 4.31Å; F368-Y372 HydrophobicContact CG-CD2 4.1Å; F368-Y372 WeakPolarHBondContact O-CB 3.45Å; F368-Y372 PolarHBondContact O-N 2.9Å; F368-F397 HydrophobicContact CE1-CE1 4.16Å; F368-F397 HydrophobicContact CE1-CE2 4.06Å; F368-F397 AromaticContact CE1-CZ 3.81Å; F368-F397 HydrophobicContact CE1-CZ 3.81Å; F368-F397 HydrophobicContact CZ-CE2 4.45Å; F368-F397 HydrophobicContact CZ-CZ 4.39Å
369	F	96.2	Very high	96.4	Very high	16 Å²	16	41.8 Å²	41.8	7%	0.07	19%	0.191	C	C	.	.	I	π-helix	trans	-58.4	-45.3	176.3	-63.7	-21.8	0	0	0	111.8	W358 L365 Y366 I373 F374 F397 V398	W358-F369 HydrophobicContact CZ3-CE2 4.36Å; L365-F369 HydrophobicContact CD1-CD1 4.38Å; L365-F369 HydrophobicContact CD1-CE1 3.53Å; L365-F369 HydrophobicContact CD1-CE2 4.2Å; L365-F369 HydrophobicContact CD1-CZ 3.45Å; L365-F369 VanDerWaalsContact CD1-CZ 3.45Å; L365-F369 HydrophobicContact CD2-CE2 3.89Å; L365-F369 HydrophobicContact CD2-CZ 3.66Å; L365-F369 HydrophobicContact CG-CD2 4.3Å; L365-F369 HydrophobicContact CG-CE1 3.88Å; L365-F369 HydrophobicContact CG-CE2 3.59Å; L365-F369 HydrophobicContact CG-CZ 3.35Å; L365-F369 WeakPolarHBondContact O-CG 3.23Å; L365-F369 PolarHBondContact O-N 3.49Å; Y366-F369 PolarHBondContact O-N 3Å; F369-I373 HydrophobicContact CD1-CD1 4.03Å; F369-I373 CarbonylContact O-C 3.58Å; F369-I373 WeakPolarHBondContact O-CA 3.48Å; F369-I373 WeakPolarHBondContact O-CB 3.46Å; F369-I373 PolarHBondContact O-N 3.47Å; F369-I373 VanDerWaalsContact O-N 3.1Å; F369-F374 PolarHBondContact O-N 3.42Å; F369-F397 HydrophobicContact CD1-CD1 4.21Å; F369-F397 AromaticContact CE1-CD1 3.3Å; F369-F397 HydrophobicContact CE1-CD1 3.3Å; F369-F397 AromaticContact CE1-CE1 3.57Å; F369-F397 HydrophobicContact CE1-CE1 3.57Å; F369-F397 HydrophobicContact CE1-CG 4.27Å; F369-F397 AromaticContact CZ-CD1 3.95Å; F369-F397 HydrophobicContact CZ-CD1 3.95Å; F369-F397 HydrophobicContact CZ-CE1 4.26Å; F369-V398 HydrophobicContact CE1-CG2 4.5Å; F369-V398 HydrophobicContact CE2-CG2 3.78Å; F369-V398 HydrophobicContact CZ-CG2 3.56Å
370	K	96.8	Very high	96.3	Very high	86 Å²	86	44 Å²	44	37%	0.374	21%	0.214	S	C	.	.	I	π-helix	trans	-60.6	-54.2	-178.4	179.8	-174.6	170.3	-166.8	0	110.7	Y366 F368 L375	Y366-K370 HydrophobicContact CE1-CB 4.44Å; Y366-K370 HydrophobicContact CE1-CD 3.93Å; Y366-K370 WeakPolarHBondContact O-CB 3.47Å; Y366-K370 PolarHBondContact O-N 3.29Å; F368-K370 VanDerWaalsContact C-N 3.31Å; F368-K370 PolarHBondContact O-N 2.88Å; K370-L375 HydrophobicContact CD-CD1 4.48Å; K370-L375 HydrophobicContact CG-CD1 3.81Å; K370-L375 HydrophobicContact CG-CG 4.12Å; K370-L375 WeakPolarHBondContact O-CB 3.31Å; K370-L375 WeakPolarHBondContact O-CG 3.25Å; K370-L375 PolarHBondContact O-N 3.19Å
371	E	97.6	Very high	96.2	Very high	72 Å²	72	45.1 Å²	45.1	34%	0.336	23%	0.228	S	C	.	.	I	π-helix	trans	-76.2	-45.2	-172.4	-164.5	60.2	-147.1	0	0	112.2	I246 D367 F368 R379	I246-E371 HydrophobicContact CD1-CB 4.48Å; D367-E371 WeakPolarHBondContact O-CB 2.96Å; D367-E371 PolarHBondContact O-N 3.43Å; F368-E371 PolarHBondContact O-N 3.42Å; E371-R379 IonicContact OE1-NH1 3.8Å; E371-R379 PolarHBondContact OE1-NH1 2.82Å
372	Y	97.7	Very high	96.2	Very high	18 Å²	18	47.2 Å²	47.2	7%	0.071	24%	0.238	C	C	.	.	I	π-helix	trans	-95.5	-17.1	-168.1	-59.3	-57.1	0	0	0	114.9	S206 I209 I246 F368 A376	S206-Y372 PolarHBondContact O-OH 3.14Å; S206-Y372 WeakPolarHBondContact OG-CE2 3.39Å; S206-Y372 PolarHBondContact OG-OH 3.46Å; I209-Y372 HydrophobicContact CB-CD1 4.39Å; I209-Y372 HydrophobicContact CB-CE1 4.16Å; I209-Y372 HydrophobicContact CD1-CD1 3.65Å; I209-Y372 HydrophobicContact CD1-CE1 4.22Å; I209-Y372 HydrophobicContact CD1-CG 4.12Å; I209-Y372 HydrophobicContact CG2-CD1 3.98Å; I209-Y372 HydrophobicContact CG2-CE1 3.82Å; I246-Y372 HydrophobicContact CB-CE2 3.87Å; I246-Y372 HydrophobicContact CG2-CD2 4.29Å; I246-Y372 HydrophobicContact CG2-CE2 3.52Å; F368-Y372 AromaticContact CD2-CD2 3.4Å; F368-Y372 HydrophobicContact CD2-CD2 3.4Å; F368-Y372 VanDerWaalsContact CD2-CD2 3.4Å; F368-Y372 AromaticContact CD2-CE2 3.88Å; F368-Y372 HydrophobicContact CD2-CE2 3.88Å; F368-Y372 AromaticContact CE2-CD2 3.71Å; F368-Y372 HydrophobicContact CE2-CD2 3.71Å; F368-Y372 HydrophobicContact CE2-CE2 4.31Å; F368-Y372 HydrophobicContact CG-CD2 4.1Å; F368-Y372 WeakPolarHBondContact O-CB 3.45Å; F368-Y372 PolarHBondContact O-N 2.9Å; Y372-A376 WeakPolarHBondContact O-CB 3.46Å
373	I	97.3	Very high	96.1	Very high	10 Å²	10	48.8 Å²	48.8	5%	0.051	25%	0.25	C	C	.	.	I	π-helix	trans	-115	-70	177.5	-53.5	176.8	0	0	0	109.6	W168 F369 A376 I377 L393 F397	W168-I373 HydrophobicContact CH2-CD1 3.81Å; W168-I373 HydrophobicContact CH2-CG1 3.57Å; W168-I373 HydrophobicContact CZ2-CD1 4.42Å; W168-I373 HydrophobicContact CZ2-CG1 3.67Å; W168-I373 HydrophobicContact CZ3-CD1 4.43Å; F369-I373 HydrophobicContact CD1-CD1 4.03Å; F369-I373 CarbonylContact O-C 3.58Å; F369-I373 WeakPolarHBondContact O-CA 3.48Å; F369-I373 WeakPolarHBondContact O-CB 3.46Å; F369-I373 PolarHBondContact O-N 3.47Å; F369-I373 VanDerWaalsContact O-N 3.1Å; I373-A376 PolarHBondContact O-N 2.95Å; I373-I377 HydrophobicContact CG2-CD1 3.96Å; I373-I377 WeakPolarHBondContact O-CD1 3.04Å; I373-I377 WeakPolarHBondContact O-CG1 3.21Å; I373-I377 PolarHBondContact O-N 2.98Å; I373-L393 HydrophobicContact CG2-CB 3.91Å; I373-F397 HydrophobicContact CD1-CB 3.85Å; I373-F397 HydrophobicContact CD1-CD2 4.39Å; I373-F397 HydrophobicContact CD1-CG 4.05Å
374	F	96.9	Very high	96	Very high	63 Å²	63	50.2 Å²	50.2	28%	0.276	27%	0.267	S	S	.	.	I	π-helix	trans	-63	-52.9	-169.6	-177	-93.7	0	0	0	112.6	F369 I377 A378 K387	F369-F374 PolarHBondContact O-N 3.42Å; F374-I377 PolarHBondContact O-N 2.94Å; F374-A378 HydrophobicContact CD1-CB 4.39Å; F374-A378 HydrophobicContact CE1-CB 4.14Å; F374-A378 HydrophobicContact CZ-CB 4.39Å; F374-A378 WeakPolarHBondContact O-CB 3.34Å; F374-A378 PolarHBondContact O-N 2.89Å; F374-K387 HydrophobicContact CZ-CB 4.49Å; F374-K387 HydrophobicContact CZ-CG 4.23Å
375	L	96.8	Very high	95.9	Very high	17 Å²	17	52.5 Å²	52.5	9%	0.089	29%	0.291	C	S	.	.	H	α-helix	trans	-71.9	-34	-179.5	-69.7	176.5	0	0	0	112.3	K370 I377 A378 R379 F382	K370-L375 HydrophobicContact CD-CD1 4.48Å; K370-L375 HydrophobicContact CG-CD1 3.81Å; K370-L375 HydrophobicContact CG-CG 4.12Å; K370-L375 WeakPolarHBondContact O-CB 3.31Å; K370-L375 WeakPolarHBondContact O-CG 3.25Å; K370-L375 PolarHBondContact O-N 3.19Å; L375-I377 PolarHBondContact O-N 3.47Å; L375-A378 PolarHBondContact O-N 3.35Å; L375-R379 VanDerWaalsContact O-CB 3.22Å; L375-R379 WeakPolarHBondContact O-CB 3.39Å; L375-R379 VanDerWaalsContact O-CG 3.29Å; L375-R379 WeakPolarHBondContact O-CG 3.3Å; L375-R379 PolarHBondContact O-N 2.67Å; L375-F382 HydrophobicContact CD2-CE1 3.87Å; L375-F382 HydrophobicContact CD2-CZ 3.99Å
376	A	96	Very high	96	Very high	63 Å²	63	56.1 Å²	56.1	52%	0.521	30%	0.303	S	S	.	.	H	α-helix	trans	-58.3	-38	174.5	0	0	0	0	0	111.8	Y372 I373	Y372-A376 WeakPolarHBondContact O-CB 3.46Å; I373-A376 PolarHBondContact O-N 2.95Å
377	I	96.4	Very high	95.9	Very high	39 Å²	39	57.7 Å²	57.7	20%	0.2	31%	0.311	C	S	.	.	H	α-helix	trans	-86.6	-43	177.5	-62.7	157.7	0	0	0	111.4	I373 F374 L375 R386 A389 L393	I373-I377 HydrophobicContact CG2-CD1 3.96Å; I373-I377 WeakPolarHBondContact O-CD1 3.04Å; I373-I377 WeakPolarHBondContact O-CG1 3.21Å; I373-I377 PolarHBondContact O-N 2.98Å; F374-I377 PolarHBondContact O-N 2.94Å; L375-I377 PolarHBondContact O-N 3.47Å; I377-R386 WeakPolarHBondContact CG2-O 3.36Å; I377-R386 PolarHBondContact O-NE 3Å; I377-R386 PolarHBondContact O-NH2 2.69Å; I377-A389 HydrophobicContact CG2-CB 4.01Å; I377-L393 HydrophobicContact CD1-CB 4.08Å; I377-L393 HydrophobicContact CD1-CD1 3.41Å; I377-L393 VanDerWaalsContact CD1-CD1 3.41Å; I377-L393 HydrophobicContact CD1-CG 4.37Å
378	A	96.3	Very high	95.8	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-72.2	-34.8	-173	0	0	0	0	0	113.2	F374 L375 F382	F374-A378 HydrophobicContact CD1-CB 4.39Å; F374-A378 HydrophobicContact CE1-CB 4.14Å; F374-A378 HydrophobicContact CZ-CB 4.39Å; F374-A378 WeakPolarHBondContact O-CB 3.34Å; F374-A378 PolarHBondContact O-N 2.89Å; L375-A378 PolarHBondContact O-N 3.35Å; A378-F382 HydrophobicContact CB-CD1 3.73Å; A378-F382 HydrophobicContact CB-CE1 3.85Å; A378-F382 WeakPolarHBondContact O-CA 3.22Å; A378-F382 PolarHBondContact O-N 3.18Å
379	R	95.2	Very high	95.8	Very high	119 Å²	119	60.8 Å²	60.8	45%	0.449	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	151	177.9	-72.2	175	173.1	154.7	-1.3	111.3	E371 L375 F382 R386	E371-R379 IonicContact OE1-NH1 3.8Å; E371-R379 PolarHBondContact OE1-NH1 2.82Å; L375-R379 VanDerWaalsContact O-CB 3.22Å; L375-R379 WeakPolarHBondContact O-CB 3.39Å; L375-R379 VanDerWaalsContact O-CG 3.29Å; L375-R379 WeakPolarHBondContact O-CG 3.3Å; L375-R379 PolarHBondContact O-N 2.67Å; R379-F382 HydrophobicContact CG-CE2 3.85Å; R379-F382 HydrophobicContact CG-CZ 3.64Å; R379-R386 PolarHBondContact O-NH2 3.36Å
380	P	93.5	Very high	95.8	Very high	109 Å²	109	60 Å²	60	71%	0.708	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	cis	-87.3	-18.1	-5.4	33.4	-33.5	0	0	0	113.6	F382	P380-F382 VanDerWaalsContact O-CD2 3.31Å; P380-F382 WeakPolarHBondContact O-CD2 3.24Å
381	T	93	Very high	95.8	Very high	95 Å²	95	56.9 Å²	56.9	58%	0.583	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-23.9	-165	60.9	0	0	0	0	114.8	S383 R386	T381-S383 PolarHBondContact O-N 3.27Å; T381-S383 VanDerWaalsContact O-N 3.12Å; T381-R386 WeakPolarHBondContact OG1-CD 3.41Å
382	F	93	Very high	95.8	Very high	69 Å²	69	58.3 Å²	58.3	30%	0.303	32%	0.322	S	S	.	.			trans	52.5	31.3	-176.8	-68	-88.2	0	0	0	113.8	L375 A378 R379 P380 K387	L375-F382 HydrophobicContact CD2-CE1 3.87Å; L375-F382 HydrophobicContact CD2-CZ 3.99Å; A378-F382 HydrophobicContact CB-CD1 3.73Å; A378-F382 HydrophobicContact CB-CE1 3.85Å; A378-F382 WeakPolarHBondContact O-CA 3.22Å; A378-F382 PolarHBondContact O-N 3.18Å; R379-F382 HydrophobicContact CG-CE2 3.85Å; R379-F382 HydrophobicContact CG-CZ 3.64Å; P380-F382 VanDerWaalsContact O-CD2 3.31Å; P380-F382 WeakPolarHBondContact O-CD2 3.24Å; F382-K387 WeakPolarHBondContact O-CE 3.21Å; F382-K387 PolarHBondContact O-NZ 2.88Å
383	S	94.9	Very high	95.7	Very high	55 Å²	55	61.3 Å²	61.3	39%	0.385	34%	0.339	S	S	.	.			trans	-61.2	155	175	70.8	0	0	0	0	111.1	T381 G385 R386 K387	T381-S383 PolarHBondContact O-N 3.27Å; T381-S383 VanDerWaalsContact O-N 3.12Å; S383-G385 VanDerWaalsContact C-N 3.3Å; S383-G385 PolarHBondContact O-N 2.89Å; S383-R386 PolarHBondContact O-N 3.4Å; S383-R386 VanDerWaalsContact O-N 3.13Å; S383-R386 WeakPolarHBondContact OG-CG 3.33Å; S383-R386 PolarHBondContact OG-N 2.94Å; S383-K387 PolarHBondContact O-N 2.88Å
384	T	93.2	Very high	95.7	Very high	101 Å²	101	61.6 Å²	61.6	62%	0.62	34%	0.341	S	S	*	.	H	α-helix	trans	-55	-46.2	-179.3	-54.4	0	0	0	0	111.6	R386 K387 L388	T384-R386 PolarHBondContact O-N 3Å; T384-K387 PolarHBondContact O-N 3.09Å; T384-L388 HydrophobicContact CG2-CD1 4.09Å; T384-L388 HydrophobicContact CG2-CG 4.44Å; T384-L388 WeakPolarHBondContact O-CG 3.07Å; T384-L388 PolarHBondContact O-N 3.31Å
385	G	95.3	Very high	95.7	Very high	50 Å²	50	59.1 Å²	59.1	52%	0.515	33%	0.331	S	S	.	.	H	α-helix	trans	-59	-41.9	177.3	0	0	0	0	0	113.4	S383 L388 A389	S383-G385 VanDerWaalsContact C-N 3.3Å; S383-G385 PolarHBondContact O-N 2.89Å; G385-L388 PolarHBondContact O-N 3.49Å; G385-A389 WeakPolarHBondContact O-CB 3.44Å; G385-A389 PolarHBondContact O-N 3.39Å
386	R	96.9	Very high	95.8	Very high	96 Å²	96	62.6 Å²	62.6	36%	0.362	35%	0.345	S	S	.	.	H	α-helix	trans	-70.2	-36.7	178	-66.8	176.1	80	97.1	1.5	112.5	I377 R379 T381 S383 T384 A389 G390	I377-R386 WeakPolarHBondContact CG2-O 3.36Å; I377-R386 PolarHBondContact O-NE 3Å; I377-R386 PolarHBondContact O-NH2 2.69Å; R379-R386 PolarHBondContact O-NH2 3.36Å; T381-R386 WeakPolarHBondContact OG1-CD 3.41Å; S383-R386 PolarHBondContact O-N 3.4Å; S383-R386 VanDerWaalsContact O-N 3.13Å; S383-R386 WeakPolarHBondContact OG-CG 3.33Å; S383-R386 PolarHBondContact OG-N 2.94Å; T384-R386 PolarHBondContact O-N 3Å; R386-A389 PolarHBondContact O-N 3.13Å; R386-G390 PolarHBondContact O-N 2.83Å
387	K	95.3	Very high	95.8	Very high	95 Å²	95	59.7 Å²	59.7	41%	0.413	32%	0.321	S	S	.	.	H	α-helix	trans	-63.6	-44	173.9	-73.5	172.5	174.8	149.7	0	111.5	F374 F382 S383 T384 G390 L391	F374-K387 HydrophobicContact CZ-CB 4.49Å; F374-K387 HydrophobicContact CZ-CG 4.23Å; F382-K387 WeakPolarHBondContact O-CE 3.21Å; F382-K387 PolarHBondContact O-NZ 2.88Å; S383-K387 PolarHBondContact O-N 2.88Å; T384-K387 PolarHBondContact O-N 3.09Å; K387-G390 PolarHBondContact O-N 3.03Å; K387-L391 WeakPolarHBondContact O-CB 3.02Å; K387-L391 PolarHBondContact O-N 3.02Å
388	L	96.3	Very high	95.8	Very high	64 Å²	64	58 Å²	58	34%	0.335	31%	0.312	S	S	.	.	H	α-helix	trans	-63.6	-46.3	175.9	-70.7	174.6	0	0	0	111	T384 G385 G390 L391 F392 L420	T384-L388 HydrophobicContact CG2-CD1 4.09Å; T384-L388 HydrophobicContact CG2-CG 4.44Å; T384-L388 WeakPolarHBondContact O-CG 3.07Å; T384-L388 PolarHBondContact O-N 3.31Å; G385-L388 PolarHBondContact O-N 3.49Å; L388-G390 VanDerWaalsContact C-N 3.35Å; L388-G390 PolarHBondContact O-N 3.06Å; L388-L391 WeakPolarHBondContact O-CB 3.35Å; L388-L391 PolarHBondContact O-N 3.4Å; L388-L391 VanDerWaalsContact O-N 3.15Å; L388-F392 HydrophobicContact CB-CD2 4.31Å; L388-F392 HydrophobicContact CB-CE2 4.14Å; L388-F392 HydrophobicContact CD2-CE2 4.44Å; L388-F392 WeakPolarHBondContact O-CD2 3.19Å; L388-F392 PolarHBondContact O-N 3.06Å; L388-L420 HydrophobicContact CD2-CD2 3.7Å
389	A	97.2	Very high	95.8	Very high	39 Å²	39	59 Å²	59	32%	0.322	32%	0.317	S	S	.	.	H	α-helix	trans	-58.4	-45.1	175.5	0	0	0	0	0	112.2	I377 G385 R386 L391 F392 L393	I377-A389 HydrophobicContact CG2-CB 4.01Å; G385-A389 WeakPolarHBondContact O-CB 3.44Å; G385-A389 PolarHBondContact O-N 3.39Å; R386-A389 PolarHBondContact O-N 3.13Å; A389-L391 VanDerWaalsContact C-N 3.32Å; A389-L391 PolarHBondContact O-N 2.95Å; A389-F392 PolarHBondContact O-N 3.05Å; A389-L393 VanDerWaalsContact O-CB 3.32Å; A389-L393 WeakPolarHBondContact O-CB 3.32Å; A389-L393 WeakPolarHBondContact O-CG 3.07Å; A389-L393 PolarHBondContact O-N 3.32Å
390	G	96.7	Very high	95.9	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62.4	-37.7	175.6	0	0	0	0	0	113.2	R386 K387 L388 S394	R386-G390 PolarHBondContact O-N 2.83Å; K387-G390 PolarHBondContact O-N 3.03Å; L388-G390 VanDerWaalsContact C-N 3.35Å; L388-G390 PolarHBondContact O-N 3.06Å; G390-S394 WeakPolarHBondContact O-CB 3.37Å; G390-S394 PolarHBondContact O-N 2.68Å; G390-S394 VanDerWaalsContact O-N 3.09Å; G390-S394 PolarHBondContact O-OG 3.38Å
391	L	95.7	Very high	95.9	Very high	21 Å²	21	50.5 Å²	50.5	11%	0.11	27%	0.272	C	S	.	.	H	α-helix	trans	-63.9	-54.7	174.7	176.4	66	0	0	0	111.3	K387 L388 A389 L393 S394 F395 M419 L420	K387-L391 WeakPolarHBondContact O-CB 3.02Å; K387-L391 PolarHBondContact O-N 3.02Å; L388-L391 WeakPolarHBondContact O-CB 3.35Å; L388-L391 PolarHBondContact O-N 3.4Å; L388-L391 VanDerWaalsContact O-N 3.15Å; A389-L391 VanDerWaalsContact C-N 3.32Å; A389-L391 PolarHBondContact O-N 2.95Å; L391-L393 VanDerWaalsContact C-N 3.34Å; L391-L393 PolarHBondContact O-N 3.15Å; L391-S394 WeakPolarHBondContact O-CB 3.36Å; L391-S394 PolarHBondContact O-N 3.15Å; L391-F395 HydrophobicContact CD1-CD2 3.85Å; L391-F395 HydrophobicContact CD1-CE2 3.64Å; L391-F395 HydrophobicContact CG-CD2 4.29Å; L391-F395 HydrophobicContact CG-CE2 4.44Å; L391-F395 WeakPolarHBondContact O-CD2 3.42Å; L391-F395 PolarHBondContact O-N 2.97Å; L391-F395 VanDerWaalsContact O-N 3.12Å; L391-M419 HydrophobicContact CD1-CG 3.79Å; L391-M419 HydrophobicContact CD2-CG 4.2Å; L391-L420 HydrophobicContact CD2-CD2 3.91Å; L391-L420 HydrophobicContact CD2-CG 4.44Å
392	F	97.6	Very high	96	Very high	101 Å²	101	48.2 Å²	48.2	44%	0.443	26%	0.255	S	S	.	.	H	α-helix	trans	-62.3	-40.6	-178.7	-72.7	-62.7	0	0	0	112	L388 A389 S394 F395 F396 V416 L420	L388-F392 HydrophobicContact CB-CD2 4.31Å; L388-F392 HydrophobicContact CB-CE2 4.14Å; L388-F392 HydrophobicContact CD2-CE2 4.44Å; L388-F392 WeakPolarHBondContact O-CD2 3.19Å; L388-F392 PolarHBondContact O-N 3.06Å; A389-F392 PolarHBondContact O-N 3.05Å; F392-S394 VanDerWaalsContact C-N 3.33Å; F392-S394 PolarHBondContact O-N 3.22Å; F392-F395 PolarHBondContact O-N 3.36Å; F392-F396 WeakPolarHBondContact O-CB 3.44Å; F392-F396 PolarHBondContact O-N 3.18Å; F392-V416 HydrophobicContact CD1-CG1 4.26Å; F392-V416 HydrophobicContact CE1-CG1 3.67Å; F392-L420 HydrophobicContact CZ-CD1 4.49Å
393	L	97.1	Very high	96	Very high	81 Å²	81	45 Å²	45	42%	0.424	24%	0.24	S	C	.	.	H	α-helix	trans	-69.1	-30.7	177.4	-76.6	168.5	0	0	0	112.9	I373 I377 A389 L391 F396 F397	I373-L393 HydrophobicContact CG2-CB 3.91Å; I377-L393 HydrophobicContact CD1-CB 4.08Å; I377-L393 HydrophobicContact CD1-CD1 3.41Å; I377-L393 VanDerWaalsContact CD1-CD1 3.41Å; I377-L393 HydrophobicContact CD1-CG 4.37Å; A389-L393 VanDerWaalsContact O-CB 3.32Å; A389-L393 WeakPolarHBondContact O-CB 3.32Å; A389-L393 WeakPolarHBondContact O-CG 3.07Å; A389-L393 PolarHBondContact O-N 3.32Å; L391-L393 VanDerWaalsContact C-N 3.34Å; L391-L393 PolarHBondContact O-N 3.15Å; L393-F396 PolarHBondContact O-N 3.48Å; L393-F397 PolarHBondContact O-N 3.29Å
394	S	97.1	Very high	96.1	Very high	16 Å²	16	45.6 Å²	45.6	11%	0.112	24%	0.236	C	C	.	.	H	α-helix	trans	-65	-45.7	172.5	-58.2	0	0	0	0	110.8	G390 L391 F392 F397 V398	G390-S394 WeakPolarHBondContact O-CB 3.37Å; G390-S394 PolarHBondContact O-N 2.68Å; G390-S394 VanDerWaalsContact O-N 3.09Å; G390-S394 PolarHBondContact O-OG 3.38Å; L391-S394 WeakPolarHBondContact O-CB 3.36Å; L391-S394 PolarHBondContact O-N 3.15Å; F392-S394 VanDerWaalsContact C-N 3.33Å; F392-S394 PolarHBondContact O-N 3.22Å; S394-F397 WeakPolarHBondContact O-CB 3.24Å; S394-F397 PolarHBondContact O-N 2.95Å; S394-V398 WeakPolarHBondContact O-CG2 3.47Å; S394-V398 PolarHBondContact O-N 3.36Å; S394-V398 VanDerWaalsContact O-N 3.1Å
395	F	97.1	Very high	96.2	Very high	11 Å²	11	47.1 Å²	47.1	5%	0.048	23%	0.231	C	C	.	.	H	α-helix	trans	-70.4	-31.2	176.7	-84.3	-69.1	0	0	0	113.6	W358 L391 F392 V398 L399 V412 N415 V416	W358-F395 HydrophobicContact CD2-CE1 4.43Å; W358-F395 HydrophobicContact CD2-CZ 4.47Å; W358-F395 AromaticContact CE2-CE1 3.64Å; W358-F395 AromaticContact CE2-CZ 3.86Å; W358-F395 HydrophobicContact CH2-CE1 4.01Å; W358-F395 HydrophobicContact CZ2-CD1 4.35Å; W358-F395 AromaticContact CZ2-CE1 3.42Å; W358-F395 HydrophobicContact CZ2-CE1 3.42Å; W358-F395 VanDerWaalsContact CZ2-CE1 3.42Å; W358-F395 HydrophobicContact CZ2-CZ 4.13Å; W358-F395 AromaticContact NE1-CE1 3.96Å; W358-F395 AromaticContact NE1-CZ 3.78Å; L391-F395 HydrophobicContact CD1-CD2 3.85Å; L391-F395 HydrophobicContact CD1-CE2 3.64Å; L391-F395 HydrophobicContact CG-CD2 4.29Å; L391-F395 HydrophobicContact CG-CE2 4.44Å; L391-F395 WeakPolarHBondContact O-CD2 3.42Å; L391-F395 PolarHBondContact O-N 2.97Å; L391-F395 VanDerWaalsContact O-N 3.12Å; F392-F395 PolarHBondContact O-N 3.36Å; F395-V398 WeakPolarHBondContact O-CB 3.01Å; F395-V398 PolarHBondContact O-N 3.36Å; F395-L399 PolarHBondContact O-N 2.94Å; F395-V412 HydrophobicContact CB-CG1 3.89Å; F395-V412 HydrophobicContact CD1-CG1 3.84Å; F395-V412 HydrophobicContact CG-CG1 4.2Å; F395-N415 HydrophobicContact CE1-CB 3.62Å; F395-N415 HydrophobicContact CZ-CB 3.82Å; F395-V416 HydrophobicContact CB-CG2 3.91Å; F395-V416 HydrophobicContact CD1-CG2 4.11Å; F395-V416 HydrophobicContact CD2-CG2 3.53Å; F395-V416 HydrophobicContact CE2-CG2 4.01Å; F395-V416 HydrophobicContact CG-CG2 3.58Å; F395-V416 HydrophobicContact CZ-CG2 4.49Å
396	F	97.3	Very high	96.3	Very high	90 Å²	90	50.2 Å²	50.2	40%	0.395	23%	0.231	S	C	.	.	H	α-helix	trans	-63.2	-43.7	171.1	178.2	-104	0	0	0	111.3	L172 F392 L393 V398 L399 V400 F404	L172-F396 HydrophobicContact CD1-CE1 4.46Å; F392-F396 WeakPolarHBondContact O-CB 3.44Å; F392-F396 PolarHBondContact O-N 3.18Å; L393-F396 PolarHBondContact O-N 3.48Å; F396-V398 VanDerWaalsContact C-N 3.29Å; F396-V398 PolarHBondContact O-N 3.22Å; F396-L399 WeakPolarHBondContact O-CB 3.33Å; F396-L399 PolarHBondContact O-N 3.38Å; F396-L399 VanDerWaalsContact O-N 3.15Å; F396-V400 HydrophobicContact CD1-CG2 4.45Å; F396-V400 HydrophobicContact CE1-CG2 3.97Å; F396-V400 HydrophobicContact CE2-CG2 4.45Å; F396-V400 HydrophobicContact CZ-CG2 3.98Å; F396-V400 PolarHBondContact O-N 2.83Å; F396-F404 HydrophobicContact CE2-CE1 4.48Å; F396-F404 AromaticContact CE2-CZ 4Å; F396-F404 HydrophobicContact CE2-CZ 4Å
397	F	97.1	Very high	96.4	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.009	22%	0.22	C	C	.	.	H	α-helix	trans	-59.1	-41.7	172.8	177.5	-82.9	0	0	0	111.6	W168 L172 L175 I202 F368 F369 I373 L393 S394 L399 V400 W401	W168-F397 HydrophobicContact CH2-CD2 4.41Å; W168-F397 AromaticContact CZ3-CD2 3.73Å; W168-F397 HydrophobicContact CZ3-CD2 3.73Å; W168-F397 AromaticContact CZ3-CE2 3.86Å; W168-F397 HydrophobicContact CZ3-CE2 3.86Å; L172-F397 HydrophobicContact CD2-CD2 3.85Å; L172-F397 HydrophobicContact CD2-CE2 4.47Å; L175-F397 HydrophobicContact CD1-CE2 3.93Å; L175-F397 HydrophobicContact CD1-CZ 4.13Å; I202-F397 HydrophobicContact CD1-CE1 4.46Å; I202-F397 HydrophobicContact CD1-CZ 4.08Å; I202-F397 HydrophobicContact CG1-CZ 4.14Å; F368-F397 HydrophobicContact CE1-CE1 4.16Å; F368-F397 HydrophobicContact CE1-CE2 4.06Å; F368-F397 AromaticContact CE1-CZ 3.81Å; F368-F397 HydrophobicContact CE1-CZ 3.81Å; F368-F397 HydrophobicContact CZ-CE2 4.45Å; F368-F397 HydrophobicContact CZ-CZ 4.39Å; F369-F397 HydrophobicContact CD1-CD1 4.21Å; F369-F397 AromaticContact CE1-CD1 3.3Å; F369-F397 HydrophobicContact CE1-CD1 3.3Å; F369-F397 AromaticContact CE1-CE1 3.57Å; F369-F397 HydrophobicContact CE1-CE1 3.57Å; F369-F397 HydrophobicContact CE1-CG 4.27Å; F369-F397 AromaticContact CZ-CD1 3.95Å; F369-F397 HydrophobicContact CZ-CD1 3.95Å; F369-F397 HydrophobicContact CZ-CE1 4.26Å; I373-F397 HydrophobicContact CD1-CB 3.85Å; I373-F397 HydrophobicContact CD1-CD2 4.39Å; I373-F397 HydrophobicContact CD1-CG 4.05Å; L393-F397 PolarHBondContact O-N 3.29Å; S394-F397 WeakPolarHBondContact O-CB 3.24Å; S394-F397 PolarHBondContact O-N 2.95Å; F397-L399 VanDerWaalsContact C-N 3.3Å; F397-L399 PolarHBondContact O-N 3.45Å; F397-V400 PolarHBondContact O-N 2.97Å; F397-W401 HydrophobicContact CE1-CB 4.21Å; F397-W401 HydrophobicContact CE1-CE3 4.23Å; F397-W401 HydrophobicContact CZ-CE3 4.1Å; F397-W401 WeakPolarHBondContact O-CB 3.49Å; F397-W401 PolarHBondContact O-N 3.36Å
398	V	96.4	Very high	96.5	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.018	20%	0.201	C	C	.	.	H	α-helix	trans	-58.6	-40.9	175.5	170.4	0	0	0	0	111.5	W358 F369 S394 F395 F396 W401 H402 W411 V412	W358-V398 HydrophobicContact CH2-CG1 3.9Å; W358-V398 HydrophobicContact CH2-CG2 4.13Å; W358-V398 HydrophobicContact CZ3-CG1 4.42Å; W358-V398 HydrophobicContact CZ3-CG2 3.93Å; F369-V398 HydrophobicContact CE1-CG2 4.5Å; F369-V398 HydrophobicContact CE2-CG2 3.78Å; F369-V398 HydrophobicContact CZ-CG2 3.56Å; S394-V398 WeakPolarHBondContact O-CG2 3.47Å; S394-V398 PolarHBondContact O-N 3.36Å; S394-V398 VanDerWaalsContact O-N 3.1Å; F395-V398 WeakPolarHBondContact O-CB 3.01Å; F395-V398 PolarHBondContact O-N 3.36Å; F396-V398 VanDerWaalsContact C-N 3.29Å; F396-V398 PolarHBondContact O-N 3.22Å; V398-W401 PolarHBondContact O-N 3.24Å; V398-H402 PolarHBondContact O-CD2 3.16Å; V398-H402 PolarHBondContact O-N 3.47Å; V398-W411 HydrophobicContact CG1-CE3 4.49Å; V398-W411 HydrophobicContact CG1-CH2 3.63Å; V398-W411 HydrophobicContact CG1-CZ3 3.5Å; V398-W411 VanDerWaalsContact CG1-CZ3 3.5Å; V398-V412 HydrophobicContact CG1-CG2 3.97Å
399	L	96.7	Very high	96.6	Very high	21 Å²	21	42.8 Å²	42.8	11%	0.11	20%	0.204	C	C	.	.	H	α-helix	trans	-63.8	-43.6	174.2	-76	174	0	0	0	112.3	F395 F396 F397 W401 H402 G403 F404 C408 L409 V412	F395-L399 PolarHBondContact O-N 2.94Å; F396-L399 WeakPolarHBondContact O-CB 3.33Å; F396-L399 PolarHBondContact O-N 3.38Å; F396-L399 VanDerWaalsContact O-N 3.15Å; F397-L399 VanDerWaalsContact C-N 3.3Å; F397-L399 PolarHBondContact O-N 3.45Å; L399-W401 VanDerWaalsContact C-N 3.26Å; L399-W401 PolarHBondContact O-N 3.21Å; L399-H402 PolarHBondContact O-N 3.08Å; L399-G403 CarbonylContact O-C 3.46Å; L399-G403 VanDerWaalsContact O-CA 3.25Å; L399-G403 WeakPolarHBondContact O-CA 3.29Å; L399-G403 PolarHBondContact O-N 3.45Å; L399-F404 HydrophobicContact CB-CE1 4.13Å; L399-F404 HydrophobicContact CB-CE2 4.45Å; L399-F404 HydrophobicContact CB-CZ 4.04Å; L399-F404 HydrophobicContact CD1-CE1 4.27Å; L399-C408 HydrophobicContact CD2-CB 4.45Å; L399-L409 HydrophobicContact CD1-CD2 4.18Å; L399-L409 HydrophobicContact CD2-CD2 4.01Å; L399-V412 HydrophobicContact CD1-CB 4.47Å; L399-V412 HydrophobicContact CD1-CG1 4.08Å; L399-V412 HydrophobicContact CD2-CB 3.82Å; L399-V412 HydrophobicContact CD2-CG1 4.29Å; L399-V412 HydrophobicContact CD2-CG2 3.59Å; L399-V412 HydrophobicContact CG-CB 4.05Å; L399-V412 HydrophobicContact CG-CG1 3.97Å; L399-V412 HydrophobicContact CG-CG2 3.86Å
400	V	96.3	Very high	96.6	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.03	20%	0.198	C	C	.	.	H	α-helix	trans	-63.3	-35.4	175.7	173.9	0	0	0	0	111.5	L172 L175 F176 F396 F397 F404	L172-V400 HydrophobicContact CD2-CB 4.31Å; L172-V400 HydrophobicContact CD2-CG1 4.11Å; L172-V400 HydrophobicContact CD2-CG2 4.29Å; L175-V400 HydrophobicContact CB-CG1 3.78Å; F176-V400 HydrophobicContact CB-CG1 4.18Å; F396-V400 HydrophobicContact CD1-CG2 4.45Å; F396-V400 HydrophobicContact CE1-CG2 3.97Å; F396-V400 HydrophobicContact CE2-CG2 4.45Å; F396-V400 HydrophobicContact CZ-CG2 3.98Å; F396-V400 PolarHBondContact O-N 2.83Å; F397-V400 PolarHBondContact O-N 2.97Å; V400-F404 HydrophobicContact CG2-CE2 3.95Å; V400-F404 HydrophobicContact CG2-CZ 4.07Å
401	W	94.7	Very high	96.7	Very high	45 Å²	45	43.4 Å²	43.4	17%	0.17	20%	0.2	C	C	.	.	H	α-helix	trans	-70.7	-39.5	179.2	179.5	-89.9	0	0	0	113.4	L175 G198 Y199 I202 F397 V398 L399	L175-W401 HydrophobicContact CD1-CE3 4.36Å; L175-W401 HydrophobicContact CD2-CE3 4.38Å; L175-W401 HydrophobicContact CD2-CZ3 4.38Å; G198-W401 WeakPolarHBondContact O-CZ3 3.4Å; Y199-W401 HydrophobicContact CE2-CZ2 4.46Å; I202-W401 HydrophobicContact CD1-CE3 3.81Å; I202-W401 HydrophobicContact CD1-CH2 3.55Å; I202-W401 HydrophobicContact CD1-CZ2 4.42Å; I202-W401 HydrophobicContact CD1-CZ3 3.19Å; I202-W401 HydrophobicContact CG1-CE3 4.44Å; I202-W401 HydrophobicContact CG1-CH2 4.36Å; I202-W401 HydrophobicContact CG1-CZ3 3.73Å; F397-W401 HydrophobicContact CE1-CB 4.21Å; F397-W401 HydrophobicContact CE1-CE3 4.23Å; F397-W401 HydrophobicContact CZ-CE3 4.1Å; F397-W401 WeakPolarHBondContact O-CB 3.49Å; F397-W401 PolarHBondContact O-N 3.36Å; V398-W401 PolarHBondContact O-N 3.24Å; L399-W401 VanDerWaalsContact C-N 3.26Å; L399-W401 PolarHBondContact O-N 3.21Å
402	H	93.9	Very high	96.8	Very high	48 Å²	48	42.8 Å²	42.8	22%	0.222	20%	0.197	C	C	.	.	H	α-helix	trans	-96.4	-24.2	-177	-74.5	-70.4	0	0	0	114.4	V398 L399 R405 W411 F469	V398-H402 PolarHBondContact O-CD2 3.16Å; V398-H402 PolarHBondContact O-N 3.47Å; L399-H402 PolarHBondContact O-N 3.08Å; H402-R405 PolarHBondContact O-NH2 3.24Å; H402-W411 AromaticContact CD2-CH2 3.72Å; H402-W411 AromaticContact CD2-CZ3 3.49Å; H402-W411 VanDerWaalsContact CD2-CZ3 3.49Å; H402-W411 WeakPolarHBondContact CD2-CZ3 3.46Å; H402-W411 AromaticContact NE2-CH2 3.69Å; H402-W411 AromaticContact NE2-CZ3 3.95Å; H402-F469 AromaticContact CE1-CE2 3.94Å; H402-F469 AromaticContact CE1-CZ 3.65Å; H402-F469 AromaticContact ND1-CE2 3.83Å; H402-F469 AromaticContact ND1-CZ 3.99Å
403	G	94.5	Very high	96.8	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.197	C	C	.	.			trans	104	157.6	-176.7	0	0	0	0	0	113.5	V179 E180 L399 R405 C408	V179-G403 VanDerWaalsContact CG1-CA 3.5Å; E180-G403 WeakPolarHBondContact OE1-CA 3.23Å; L399-G403 CarbonylContact O-C 3.46Å; L399-G403 VanDerWaalsContact O-CA 3.25Å; L399-G403 WeakPolarHBondContact O-CA 3.29Å; L399-G403 PolarHBondContact O-N 3.45Å; G403-R405 PolarHBondContact O-N 2.82Å; G403-R405 VanDerWaalsContact O-N 3.1Å; G403-C408 VanDerWaalsContact O-CB 3.23Å; G403-C408 WeakPolarHBondContact O-CB 3.16Å
404	F	96.1	Very high	96.8	Very high	68 Å²	68	38.7 Å²	38.7	30%	0.298	19%	0.187	S	C	.	.	S	Bend	trans	-85.7	37	-178.4	-71	-98	0	0	0	112.3	F176 E180 F396 L399 V400 L409	F176-F404 HydrophobicContact CD2-CD2 4.04Å; F176-F404 AromaticContact CD2-CE2 3.73Å; F176-F404 HydrophobicContact CD2-CE2 3.73Å; F176-F404 AromaticContact CE2-CD2 3.69Å; F176-F404 HydrophobicContact CE2-CD2 3.69Å; F176-F404 AromaticContact CE2-CE2 3.69Å; F176-F404 HydrophobicContact CE2-CE2 3.69Å; E180-F404 PolarHBondContact OE1-N 3.19Å; F396-F404 HydrophobicContact CE2-CE1 4.48Å; F396-F404 AromaticContact CE2-CZ 4Å; F396-F404 HydrophobicContact CE2-CZ 4Å; L399-F404 HydrophobicContact CB-CE1 4.13Å; L399-F404 HydrophobicContact CB-CE2 4.45Å; L399-F404 HydrophobicContact CB-CZ 4.04Å; L399-F404 HydrophobicContact CD1-CE1 4.27Å; V400-F404 HydrophobicContact CG2-CE2 3.95Å; V400-F404 HydrophobicContact CG2-CZ 4.07Å; F404-L409 HydrophobicContact CD1-CD2 4.18Å
405	R	95.6	Very high	96.8	Very high	134 Å²	134	38 Å²	38	51%	0.506	18%	0.183	S	C	.	.			trans	-77.1	152.3	175.6	-57.6	-177.4	-144.9	119.5	11.3	110.5	H402 G403 N407 C408 L409	H402-R405 PolarHBondContact O-NH2 3.24Å; G403-R405 PolarHBondContact O-N 2.82Å; G403-R405 VanDerWaalsContact O-N 3.1Å; R405-N407 VanDerWaalsContact C-N 3.3Å; R405-N407 WeakPolarHBondContact CB-OD1 3.34Å; R405-N407 PolarHBondContact O-N 2.97Å; R405-C408 PolarHBondContact O-N 2.96Å; R405-L409 WeakPolarHBondContact O-CG 3.44Å; R405-L409 PolarHBondContact O-N 3.18Å
406	H	97.7	Very high	96.8	Very high	114 Å²	114	38.3 Å²	38.3	53%	0.528	19%	0.185	S	C	.	.	H	α-helix	trans	-53.5	-43.7	-175.8	-178.6	63.3	0	0	0	113.5	L409 I410 S473	H406-L409 PolarHBondContact O-N 3.47Å; H406-I410 WeakPolarHBondContact CE1-CD1 3.49Å; H406-I410 VanDerWaalsContact NE2-CD1 3.26Å; H406-I410 WeakPolarHBondContact NE2-CD1 3.44Å; H406-I410 PolarHBondContact O-N 3.49Å; H406-I410 VanDerWaalsContact O-N 3.08Å; H406-S473 PolarHBondContact CD2-OG 3.05Å; H406-S473 VanDerWaalsContact CD2-OG 3.3Å
407	N	97.5	Very high	96.8	Very high	25 Å²	25	37.4 Å²	37.4	13%	0.134	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-42.2	176.3	61.9	-36.7	0	0	0	113.4	R405 W411 Y468 S473	R405-N407 VanDerWaalsContact C-N 3.3Å; R405-N407 WeakPolarHBondContact CB-OD1 3.34Å; R405-N407 PolarHBondContact O-N 2.97Å; N407-W411 VanDerWaalsContact O-CB 3.3Å; N407-W411 WeakPolarHBondContact O-CB 3.5Å; N407-W411 PolarHBondContact O-N 3.46Å; N407-Y468 VanDerWaalsContact CB-O 3.29Å; N407-Y468 WeakPolarHBondContact CB-O 3.38Å; N407-S473 WeakPolarHBondContact CB-OG 3.25Å; N407-S473 PolarHBondContact N-OG 3.29Å
408	C	97.7	Very high	96.7	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.014	19%	0.187	C	C	.	.	H	α-helix	trans	-68.1	-38.3	177.9	-66.4	0	0	0	0	111.7	L399 G403 R405 W411 V412	L399-C408 HydrophobicContact CD2-CB 4.45Å; G403-C408 VanDerWaalsContact O-CB 3.23Å; G403-C408 WeakPolarHBondContact O-CB 3.16Å; R405-C408 PolarHBondContact O-N 2.96Å; C408-W411 PolarHBondContact O-N 3.35Å; C408-V412 WeakPolarHBondContact O-CB 3.48Å; C408-V412 WeakPolarHBondContact O-CG2 3.45Å; C408-V412 PolarHBondContact O-N 3.12Å
409	L	98.1	Very high	96.6	Very high	73 Å²	73	38.2 Å²	38.2	38%	0.382	19%	0.191	S	C	.	.	H	α-helix	trans	-61.7	-48.1	175.5	-70.9	170.3	0	0	0	111.8	L399 F404 R405 H406 V412 A413	L399-L409 HydrophobicContact CD1-CD2 4.18Å; L399-L409 HydrophobicContact CD2-CD2 4.01Å; F404-L409 HydrophobicContact CD1-CD2 4.18Å; R405-L409 WeakPolarHBondContact O-CG 3.44Å; R405-L409 PolarHBondContact O-N 3.18Å; H406-L409 PolarHBondContact O-N 3.47Å; L409-V412 PolarHBondContact O-N 3.3Å; L409-A413 VanDerWaalsContact O-CB 3.26Å; L409-A413 WeakPolarHBondContact O-CB 3.41Å; L409-A413 PolarHBondContact O-N 3.17Å
410	I	98.3	Very high	96.6	Very high	38 Å²	38	39.8 Å²	39.8	20%	0.195	20%	0.199	C	C	.	.	H	α-helix	trans	-63.2	-46.5	177.1	-69.3	175	0	0	0	110.7	H406 V412 A413 L414 Y468	H406-I410 WeakPolarHBondContact CE1-CD1 3.49Å; H406-I410 VanDerWaalsContact NE2-CD1 3.26Å; H406-I410 WeakPolarHBondContact NE2-CD1 3.44Å; H406-I410 PolarHBondContact O-N 3.49Å; H406-I410 VanDerWaalsContact O-N 3.08Å; I410-V412 PolarHBondContact O-N 2.83Å; I410-A413 PolarHBondContact O-N 3.37Å; I410-L414 HydrophobicContact CG2-CD1 3.74Å; I410-L414 HydrophobicContact CG2-CG 4.2Å; I410-L414 WeakPolarHBondContact O-CB 3.43Å; I410-L414 WeakPolarHBondContact O-CG 3.43Å; I410-L414 PolarHBondContact O-N 2.97Å; I410-Y468 HydrophobicContact CB-CD1 4.13Å; I410-Y468 HydrophobicContact CB-CG 4.09Å; I410-Y468 HydrophobicContact CD1-CD1 3.63Å; I410-Y468 HydrophobicContact CD1-CE1 3.32Å; I410-Y468 HydrophobicContact CD1-CE2 4.47Å; I410-Y468 HydrophobicContact CD1-CG 4.32Å; I410-Y468 HydrophobicContact CG1-CD1 4.46Å; I410-Y468 HydrophobicContact CG2-CD1 4.06Å; I410-Y468 HydrophobicContact CG2-CD2 3.6Å; I410-Y468 HydrophobicContact CG2-CE1 4.38Å; I410-Y468 HydrophobicContact CG2-CE2 3.97Å; I410-Y468 HydrophobicContact CG2-CG 3.66Å
411	W	98	Very high	96.6	Very high	13 Å²	13	42.3 Å²	42.3	5%	0.049	22%	0.215	C	C	.	.	H	α-helix	trans	-56.3	-49.8	177.9	168.5	66.5	0	0	0	112.1	W358 V398 H402 N407 C408 L414 N415 S465 F469	W358-W411 AromaticContact CH2-CH2 3.68Å; W358-W411 HydrophobicContact CH2-CH2 3.68Å; W358-W411 AromaticContact CH2-CZ2 3.52Å; W358-W411 HydrophobicContact CH2-CZ2 3.52Å; W358-W411 HydrophobicContact CZ2-CH2 4.33Å; W358-W411 AromaticContact CZ2-CZ2 3.77Å; W358-W411 HydrophobicContact CZ2-CZ2 3.77Å; V398-W411 HydrophobicContact CG1-CE3 4.49Å; V398-W411 HydrophobicContact CG1-CH2 3.63Å; V398-W411 HydrophobicContact CG1-CZ3 3.5Å; V398-W411 VanDerWaalsContact CG1-CZ3 3.5Å; H402-W411 AromaticContact CD2-CH2 3.72Å; H402-W411 AromaticContact CD2-CZ3 3.49Å; H402-W411 VanDerWaalsContact CD2-CZ3 3.49Å; H402-W411 WeakPolarHBondContact CD2-CZ3 3.46Å; H402-W411 AromaticContact NE2-CH2 3.69Å; H402-W411 AromaticContact NE2-CZ3 3.95Å; N407-W411 VanDerWaalsContact O-CB 3.3Å; N407-W411 WeakPolarHBondContact O-CB 3.5Å; N407-W411 PolarHBondContact O-N 3.46Å; C408-W411 PolarHBondContact O-N 3.35Å; W411-L414 PolarHBondContact O-N 2.85Å; W411-N415 PolarHBondContact NE1-ND2 3.35Å; W411-N415 VanDerWaalsContact NE1-ND2 3.11Å; W411-N415 WeakPolarHBondContact O-CB 3.43Å; W411-N415 PolarHBondContact O-N 3.46Å; W411-N415 PolarHBondContact O-ND2 3.36Å; W411-S465 WeakPolarHBondContact CA-OG 3.48Å; W411-S465 PolarHBondContact O-OG 3.01Å; W411-F469 HydrophobicContact CB-CB 3.83Å; W411-F469 VanDerWaalsContact CD1-CB 3.44Å; W411-F469 AromaticContact CD1-CG 3.93Å; W411-F469 HydrophobicContact CD2-CB 3.84Å; W411-F469 HydrophobicContact CD2-CD1 4.24Å; W411-F469 AromaticContact CD2-CD2 3.61Å; W411-F469 HydrophobicContact CD2-CD2 3.61Å; W411-F469 HydrophobicContact CD2-CE2 4.22Å; W411-F469 AromaticContact CD2-CG 3.63Å; W411-F469 HydrophobicContact CD2-CG 3.63Å; W411-F469 AromaticContact CE2-CD1 3.78Å; W411-F469 AromaticContact CE2-CD2 3.97Å; W411-F469 AromaticContact CE2-CG 3.67Å; W411-F469 AromaticContact CE3-CD2 3.51Å; W411-F469 HydrophobicContact CE3-CD2 3.51Å; W411-F469 AromaticContact CE3-CE2 3.82Å; W411-F469 HydrophobicContact CE3-CE2 3.82Å; W411-F469 HydrophobicContact CE3-CG 4.04Å; W411-F469 HydrophobicContact CG-CB 3.47Å; W411-F469 VanDerWaalsContact CG-CB 3.47Å; W411-F469 HydrophobicContact CG-CD2 4.13Å; W411-F469 AromaticContact CG-CG 3.85Å; W411-F469 HydrophobicContact CG-CG 3.85Å; W411-F469 HydrophobicContact CH2-CD1 4.48Å; W411-F469 HydrophobicContact CH2-CD2 4.16Å; W411-F469 HydrophobicContact CH2-CE1 4.12Å; W411-F469 AromaticContact CH2-CE2 3.78Å; W411-F469 HydrophobicContact CH2-CE2 3.78Å; W411-F469 AromaticContact CH2-CZ 3.76Å; W411-F469 HydrophobicContact CH2-CZ 3.76Å; W411-F469 AromaticContact CZ2-CD1 3.94Å; W411-F469 HydrophobicContact CZ2-CD1 3.94Å; W411-F469 HydrophobicContact CZ2-CD2 4.26Å; W411-F469 AromaticContact CZ2-CE1 3.87Å; W411-F469 HydrophobicContact CZ2-CE1 3.87Å; W411-F469 HydrophobicContact CZ2-CE2 4.19Å; W411-F469 HydrophobicContact CZ2-CG 4.15Å; W411-F469 AromaticContact CZ2-CZ 4Å; W411-F469 HydrophobicContact CZ2-CZ 4Å; W411-F469 AromaticContact CZ3-CD2 3.8Å; W411-F469 HydrophobicContact CZ3-CD2 3.8Å; W411-F469 AromaticContact CZ3-CE2 3.58Å; W411-F469 HydrophobicContact CZ3-CE2 3.58Å; W411-F469 HydrophobicContact CZ3-CG 4.46Å; W411-F469 HydrophobicContact CZ3-CZ 4.07Å; W411-F469 AromaticContact NE1-CD1 3.89Å; W411-F469 AromaticContact NE1-CG 3.84Å
412	V	97.8	Very high	96.6	Very high	8 Å²	8	40.7 Å²	40.7	5%	0.048	21%	0.209	C	C	.	.	H	α-helix	trans	-66	-43.2	179.2	168.7	0	0	0	0	111.1	F395 V398 L399 C408 L409 I410 L414 N415 V416	F395-V412 HydrophobicContact CB-CG1 3.89Å; F395-V412 HydrophobicContact CD1-CG1 3.84Å; F395-V412 HydrophobicContact CG-CG1 4.2Å; V398-V412 HydrophobicContact CG1-CG2 3.97Å; L399-V412 HydrophobicContact CD1-CB 4.47Å; L399-V412 HydrophobicContact CD1-CG1 4.08Å; L399-V412 HydrophobicContact CD2-CB 3.82Å; L399-V412 HydrophobicContact CD2-CG1 4.29Å; L399-V412 HydrophobicContact CD2-CG2 3.59Å; L399-V412 HydrophobicContact CG-CB 4.05Å; L399-V412 HydrophobicContact CG-CG1 3.97Å; L399-V412 HydrophobicContact CG-CG2 3.86Å; C408-V412 WeakPolarHBondContact O-CB 3.48Å; C408-V412 WeakPolarHBondContact O-CG2 3.45Å; C408-V412 PolarHBondContact O-N 3.12Å; L409-V412 PolarHBondContact O-N 3.3Å; I410-V412 PolarHBondContact O-N 2.83Å; V412-L414 PolarHBondContact O-N 3.22Å; V412-N415 PolarHBondContact O-N 3.02Å; V412-V416 HydrophobicContact CG1-CG2 4.22Å; V412-V416 VanDerWaalsContact O-CG2 3.29Å; V412-V416 WeakPolarHBondContact O-CG2 3.4Å; V412-V416 PolarHBondContact O-N 2.89Å
413	A	97.9	Very high	96.6	Very high	54 Å²	54	41.8 Å²	41.8	45%	0.446	22%	0.216	S	C	.	.	H	α-helix	trans	-58.8	-47.1	178.2	0	0	0	0	0	112	L409 I410 V416 V417	L409-A413 VanDerWaalsContact O-CB 3.26Å; L409-A413 WeakPolarHBondContact O-CB 3.41Å; L409-A413 PolarHBondContact O-N 3.17Å; I410-A413 PolarHBondContact O-N 3.37Å; A413-V416 PolarHBondContact O-N 3.2Å; A413-V417 WeakPolarHBondContact O-CG2 3.37Å; A413-V417 PolarHBondContact O-N 2.99Å
414	L	97.5	Very high	96.6	Very high	42 Å²	42	45.8 Å²	45.8	22%	0.22	24%	0.24	C	C	.	.	H	α-helix	trans	-66	-38.9	178.4	-69.7	177.2	0	0	0	112.2	I410 W411 V412 V417 E418 L461	I410-L414 HydrophobicContact CG2-CD1 3.74Å; I410-L414 HydrophobicContact CG2-CG 4.2Å; I410-L414 WeakPolarHBondContact O-CB 3.43Å; I410-L414 WeakPolarHBondContact O-CG 3.43Å; I410-L414 PolarHBondContact O-N 2.97Å; W411-L414 PolarHBondContact O-N 2.85Å; V412-L414 PolarHBondContact O-N 3.22Å; L414-V417 PolarHBondContact O-N 3.43Å; L414-E418 WeakPolarHBondContact O-CB 3.27Å; L414-E418 PolarHBondContact O-N 3.26Å; L414-L461 HydrophobicContact CD2-CD2 3.95Å
415	N	96.7	Very high	96.5	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.011	25%	0.247	C	C	.	.	H	α-helix	trans	-64.9	-38.4	173.7	-85.2	-84.6	0	0	0	112.6	W358 F395 W411 V412 E418 M419 S465	W358-N415 HydrophobicContact CZ2-CB 4.3Å; W358-N415 PolarHBondContact NE1-OD1 3.43Å; F395-N415 HydrophobicContact CE1-CB 3.62Å; F395-N415 HydrophobicContact CZ-CB 3.82Å; W411-N415 PolarHBondContact NE1-ND2 3.35Å; W411-N415 VanDerWaalsContact NE1-ND2 3.11Å; W411-N415 WeakPolarHBondContact O-CB 3.43Å; W411-N415 PolarHBondContact O-N 3.46Å; W411-N415 PolarHBondContact O-ND2 3.36Å; V412-N415 PolarHBondContact O-N 3.02Å; N415-E418 PolarHBondContact O-N 2.9Å; N415-M419 VanDerWaalsContact O-CB 3.24Å; N415-M419 WeakPolarHBondContact O-CB 3.41Å; N415-M419 PolarHBondContact O-N 3Å; N415-S465 PolarHBondContact ND2-OG 2.89Å
416	V	96.9	Very high	96.4	Very high	18 Å²	18	42.5 Å²	42.5	11%	0.109	24%	0.24	C	C	.	.	H	α-helix	trans	-63.5	-47.5	175.9	167.6	0	0	0	0	110	F392 F395 V412 A413 M419 L420	F392-V416 HydrophobicContact CD1-CG1 4.26Å; F392-V416 HydrophobicContact CE1-CG1 3.67Å; F395-V416 HydrophobicContact CB-CG2 3.91Å; F395-V416 HydrophobicContact CD1-CG2 4.11Å; F395-V416 HydrophobicContact CD2-CG2 3.53Å; F395-V416 HydrophobicContact CE2-CG2 4.01Å; F395-V416 HydrophobicContact CG-CG2 3.58Å; F395-V416 HydrophobicContact CZ-CG2 4.49Å; V412-V416 HydrophobicContact CG1-CG2 4.22Å; V412-V416 VanDerWaalsContact O-CG2 3.29Å; V412-V416 WeakPolarHBondContact O-CG2 3.4Å; V412-V416 PolarHBondContact O-N 2.89Å; A413-V416 PolarHBondContact O-N 3.2Å; V416-M419 PolarHBondContact O-N 3.45Å; V416-L420 HydrophobicContact CG1-CD1 3.97Å; V416-L420 HydrophobicContact CG1-CG 4.48Å; V416-L420 WeakPolarHBondContact O-CB 3.31Å; V416-L420 VanDerWaalsContact O-CG 3.22Å; V416-L420 WeakPolarHBondContact O-CG 3.42Å; V416-L420 PolarHBondContact O-N 2.88Å
417	V	97.3	Very high	96.1	Very high	71 Å²	71	45.1 Å²	45.1	43%	0.43	25%	0.246	S	C	.	.	H	α-helix	trans	-59.7	-48.2	176.5	172.4	0	0	0	0	110.7	A413 L414 M419 L420 V421 L461	A413-V417 WeakPolarHBondContact O-CG2 3.37Å; A413-V417 PolarHBondContact O-N 2.99Å; L414-V417 PolarHBondContact O-N 3.43Å; V417-M419 PolarHBondContact O-N 3.4Å; V417-L420 PolarHBondContact O-N 3.43Å; V417-V421 HydrophobicContact CG1-CG2 4.31Å; V417-V421 VanDerWaalsContact O-CG2 3.3Å; V417-V421 WeakPolarHBondContact O-CG2 3.36Å; V417-V421 PolarHBondContact O-N 3.47Å; V417-L461 HydrophobicContact CG1-CD1 4.2Å
418	E	95.4	Very high	96	Very high	1 Å²	1	48 Å²	48	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-58.4	-47.4	179.2	-178.8	-88.9	161.1	0	0	111.9	F354 L414 N415 L420 V421 E422 L458 L461	F354-E418 WeakPolarHBondContact CB-OE1 3.21Å; F354-E418 WeakPolarHBondContact CB-OE2 3.3Å; F354-E418 PolarHBondContact N-OE1 3.29Å; L414-E418 WeakPolarHBondContact O-CB 3.27Å; L414-E418 PolarHBondContact O-N 3.26Å; N415-E418 PolarHBondContact O-N 2.9Å; E418-L420 VanDerWaalsContact C-N 3.35Å; E418-L420 PolarHBondContact O-N 3.06Å; E418-V421 PolarHBondContact O-N 2.8Å; E418-E422 WeakPolarHBondContact O-CB 3.48Å; E418-E422 PolarHBondContact O-N 3.16Å; E418-L458 HydrophobicContact CG-CB 4.22Å; E418-L458 HydrophobicContact CG-CD2 3.94Å; E418-L461 HydrophobicContact CB-CB 4.13Å; E418-L461 HydrophobicContact CB-CD1 4.17Å; E418-L461 HydrophobicContact CG-CB 4.32Å
419	M	94.6	Very high	95.9	Very high	21 Å²	21	49 Å²	49	10%	0.103	27%	0.265	C	S	.	.	H	α-helix	trans	-63.2	-37.8	176.1	-175.9	68.7	63.5	0	0	112.7	L391 N415 V416 V417 N423	L391-M419 HydrophobicContact CD1-CG 3.79Å; L391-M419 HydrophobicContact CD2-CG 4.2Å; N415-M419 VanDerWaalsContact O-CB 3.24Å; N415-M419 WeakPolarHBondContact O-CB 3.41Å; N415-M419 PolarHBondContact O-N 3Å; V416-M419 PolarHBondContact O-N 3.45Å; V417-M419 PolarHBondContact O-N 3.4Å; M419-N423 WeakPolarHBondContact O-CB 3.48Å; M419-N423 VanDerWaalsContact O-CG 3.23Å; M419-N423 PolarHBondContact O-N 3.36Å; M419-N423 PolarHBondContact O-ND2 2.86Å
420	L	95.8	Very high	95.6	Very high	53 Å²	53	47.3 Å²	47.3	28%	0.277	26%	0.261	S	S	.	.	H	α-helix	trans	-67.2	-45.4	175.8	-71.7	173	0	0	0	111.1	L388 L391 F392 V416 V417 E418 E422 N423 V424	L388-L420 HydrophobicContact CD2-CD2 3.7Å; L391-L420 HydrophobicContact CD2-CD2 3.91Å; L391-L420 HydrophobicContact CD2-CG 4.44Å; F392-L420 HydrophobicContact CZ-CD1 4.49Å; V416-L420 HydrophobicContact CG1-CD1 3.97Å; V416-L420 HydrophobicContact CG1-CG 4.48Å; V416-L420 WeakPolarHBondContact O-CB 3.31Å; V416-L420 VanDerWaalsContact O-CG 3.22Å; V416-L420 WeakPolarHBondContact O-CG 3.42Å; V416-L420 PolarHBondContact O-N 2.88Å; V417-L420 PolarHBondContact O-N 3.43Å; E418-L420 VanDerWaalsContact C-N 3.35Å; E418-L420 PolarHBondContact O-N 3.06Å; L420-E422 VanDerWaalsContact C-N 3.34Å; L420-E422 PolarHBondContact O-N 3.49Å; L420-N423 PolarHBondContact O-N 2.58Å; L420-V424 WeakPolarHBondContact O-CB 3.18Å; L420-V424 VanDerWaalsContact O-CG2 3.27Å; L420-V424 WeakPolarHBondContact O-CG2 3.44Å; L420-V424 PolarHBondContact O-N 3.28Å
421	V	96.4	Very high	95.5	Very high	59 Å²	59	48.9 Å²	48.9	36%	0.358	27%	0.269	S	S	.	.	H	α-helix	trans	-59.1	-46.1	175.8	173.6	0	0	0	0	110.4	V417 E418 N423 V424 A425 L458	V417-V421 HydrophobicContact CG1-CG2 4.31Å; V417-V421 VanDerWaalsContact O-CG2 3.3Å; V417-V421 WeakPolarHBondContact O-CG2 3.36Å; V417-V421 PolarHBondContact O-N 3.47Å; E418-V421 PolarHBondContact O-N 2.8Å; V421-N423 PolarHBondContact O-N 2.92Å; V421-V424 PolarHBondContact O-N 2.85Å; V421-A425 WeakPolarHBondContact O-CB 3.31Å; V421-A425 PolarHBondContact O-N 3.04Å; V421-L458 HydrophobicContact CB-CD2 4Å; V421-L458 HydrophobicContact CG1-CD2 3.79Å
422	E	95.1	Very high	95.4	Very high	10 Å²	10	52.6 Å²	52.6	5%	0.047	29%	0.287	C	S	.	.	H	α-helix	trans	-60.3	-45.9	177.1	-171.9	-173.8	176.8	0	0	111.7	S355 E418 L420 A425 K426 L458	S355-E422 WeakPolarHBondContact CB-OE2 3.29Å; S355-E422 PolarHBondContact OG-OE1 3.2Å; S355-E422 PolarHBondContact OG-OE2 3.41Å; E418-E422 WeakPolarHBondContact O-CB 3.48Å; E418-E422 PolarHBondContact O-N 3.16Å; L420-E422 VanDerWaalsContact C-N 3.34Å; L420-E422 PolarHBondContact O-N 3.49Å; E422-A425 PolarHBondContact O-N 2.87Å; E422-K426 VanDerWaalsContact CD-NZ 3.26Å; E422-K426 HydrophobicContact CG-CD 4.33Å; E422-K426 VanDerWaalsContact O-CG 3.31Å; E422-K426 WeakPolarHBondContact O-CG 3.36Å; E422-K426 PolarHBondContact O-N 2.9Å; E422-K426 WeakPolarHBondContact OE1-CE 3.44Å; E422-K426 IonicContact OE1-NZ 2.65Å; E422-K426 PolarHBondContact OE1-NZ 3.49Å; E422-K426 IonicContact OE2-NZ 2.65Å; E422-L458 HydrophobicContact CB-CD1 4.17Å; E422-L458 HydrophobicContact CB-CD2 4.27Å; E422-L458 HydrophobicContact CG-CD1 4.24Å
423	N	92.8	Very high	95.4	Very high	71 Å²	71	56.1 Å²	56.1	38%	0.38	31%	0.312	S	S	.	.	H	α-helix	trans	-68.1	-39.4	-179.5	-75.6	-39.3	0	0	0	112.7	M419 L420 V421 K426 Y427	M419-N423 WeakPolarHBondContact O-CB 3.48Å; M419-N423 VanDerWaalsContact O-CG 3.23Å; M419-N423 PolarHBondContact O-N 3.36Å; M419-N423 PolarHBondContact O-ND2 2.86Å; L420-N423 PolarHBondContact O-N 2.58Å; V421-N423 PolarHBondContact O-N 2.92Å; N423-K426 PolarHBondContact O-N 3.02Å; N423-Y427 WeakPolarHBondContact O-CB 3.48Å; N423-Y427 PolarHBondContact O-N 3.32Å
424	V	95	Very high	95.3	Very high	84 Å²	84	55.9 Å²	55.9	51%	0.509	31%	0.305	S	S	.	.	H	α-helix	trans	-63.9	-45.7	174.9	169.2	0	0	0	0	110.3	L420 V421 K426 Y427 I428	L420-V424 WeakPolarHBondContact O-CB 3.18Å; L420-V424 VanDerWaalsContact O-CG2 3.27Å; L420-V424 WeakPolarHBondContact O-CG2 3.44Å; L420-V424 PolarHBondContact O-N 3.28Å; V421-V424 PolarHBondContact O-N 2.85Å; V424-K426 VanDerWaalsContact C-N 3.34Å; V424-K426 PolarHBondContact O-N 3.4Å; V424-Y427 WeakPolarHBondContact O-CB 3.29Å; V424-Y427 PolarHBondContact O-N 2.94Å; V424-Y427 VanDerWaalsContact O-N 3.12Å; V424-I428 HydrophobicContact CG1-CD1 3.8Å; V424-I428 HydrophobicContact CG1-CG1 4.37Å; V424-I428 WeakPolarHBondContact O-CG1 3.13Å; V424-I428 PolarHBondContact O-N 2.81Å
425	A	94.7	Very high	95.2	Very high	54 Å²	54	57 Å²	57	45%	0.446	31%	0.308	S	S	.	.	H	α-helix	trans	-59.7	-44.1	176.8	0	0	0	0	0	112	V421 E422 Y427 I428 Y429	V421-A425 WeakPolarHBondContact O-CB 3.31Å; V421-A425 PolarHBondContact O-N 3.04Å; E422-A425 PolarHBondContact O-N 2.87Å; A425-Y427 VanDerWaalsContact C-N 3.33Å; A425-Y427 PolarHBondContact O-N 2.82Å; A425-I428 PolarHBondContact O-N 3.43Å; A425-Y429 WeakPolarHBondContact O-CB 3.25Å; A425-Y429 PolarHBondContact O-N 3.28Å
426	K	92.6	Very high	95.2	Very high	80 Å²	80	63 Å²	63	35%	0.348	33%	0.334	S	S	.	.	H	α-helix	trans	-62.1	-39.6	174.1	-73.8	172.9	-176.8	167.3	0	112.3	L24 E422 N423 V424 A430	L24-K426 HydrophobicContact CD1-CB 3.76Å; L24-K426 HydrophobicContact CD1-CG 3.9Å; E422-K426 VanDerWaalsContact CD-NZ 3.26Å; E422-K426 HydrophobicContact CG-CD 4.33Å; E422-K426 VanDerWaalsContact O-CG 3.31Å; E422-K426 WeakPolarHBondContact O-CG 3.36Å; E422-K426 PolarHBondContact O-N 2.9Å; E422-K426 WeakPolarHBondContact OE1-CE 3.44Å; E422-K426 IonicContact OE1-NZ 2.65Å; E422-K426 PolarHBondContact OE1-NZ 3.49Å; E422-K426 IonicContact OE2-NZ 2.65Å; N423-K426 PolarHBondContact O-N 3.02Å; V424-K426 VanDerWaalsContact C-N 3.34Å; V424-K426 PolarHBondContact O-N 3.4Å; K426-A430 VanDerWaalsContact O-CB 3.3Å; K426-A430 WeakPolarHBondContact O-CB 3.4Å; K426-A430 PolarHBondContact O-N 2.91Å
427	Y	92.7	Very high	95.2	Very high	169 Å²	169	69.3 Å²	69.3	66%	0.663	36%	0.356	S	S	*	.	H	α-helix	trans	-66.1	-47.5	178.5	-176.3	-96.4	0	0	0	111.6	N423 V424 A425 Y429 A430 I431	N423-Y427 WeakPolarHBondContact O-CB 3.48Å; N423-Y427 PolarHBondContact O-N 3.32Å; V424-Y427 WeakPolarHBondContact O-CB 3.29Å; V424-Y427 PolarHBondContact O-N 2.94Å; V424-Y427 VanDerWaalsContact O-N 3.12Å; A425-Y427 VanDerWaalsContact C-N 3.33Å; A425-Y427 PolarHBondContact O-N 2.82Å; Y427-Y429 VanDerWaalsContact C-N 3.31Å; Y427-Y429 PolarHBondContact O-N 2.77Å; Y427-A430 WeakPolarHBondContact O-CB 3.35Å; Y427-A430 PolarHBondContact O-N 2.76Å; Y427-A430 VanDerWaalsContact O-N 3.1Å; Y427-I431 PolarHBondContact O-N 3.26Å
428	I	95.4	Very high	95.1	Very high	85 Å²	85	66.4 Å²	66.4	44%	0.436	34%	0.337	S	S	.	.	H	α-helix	trans	-56.2	-48.1	175.9	-69	167.6	0	0	0	110.2	V424 A425 A430 I431 V434	V424-I428 HydrophobicContact CG1-CD1 3.8Å; V424-I428 HydrophobicContact CG1-CG1 4.37Å; V424-I428 WeakPolarHBondContact O-CG1 3.13Å; V424-I428 PolarHBondContact O-N 2.81Å; A425-I428 PolarHBondContact O-N 3.43Å; I428-A430 VanDerWaalsContact C-N 3.27Å; I428-A430 PolarHBondContact O-N 2.92Å; I428-I431 WeakPolarHBondContact O-CB 3.41Å; I428-I431 WeakPolarHBondContact O-CG1 3.36Å; I428-I431 PolarHBondContact O-N 3.39Å; I428-V434 HydrophobicContact CG2-CG1 4.3Å; I428-V434 HydrophobicContact CG2-CG2 4.48Å
429	Y	94.7	Very high	95.1	Very high	24 Å²	24	71 Å²	71	9%	0.094	36%	0.359	C	S	.	.	H	α-helix	trans	-70.2	-23	-179.2	-175.4	-93.4	0	0	0	113.4	L24 F25 A425 Y427 I431 R438 F447	L24-Y429 HydrophobicContact CB-CD1 3.88Å; L24-Y429 HydrophobicContact CB-CE1 3.96Å; L24-Y429 VanDerWaalsContact O-CE1 3.28Å; L24-Y429 WeakPolarHBondContact O-CE1 3.32Å; F25-Y429 HydrophobicContact CB-CE1 4.15Å; A425-Y429 WeakPolarHBondContact O-CB 3.25Å; A425-Y429 PolarHBondContact O-N 3.28Å; Y427-Y429 VanDerWaalsContact C-N 3.31Å; Y427-Y429 PolarHBondContact O-N 2.77Å; Y429-I431 VanDerWaalsContact C-N 3.26Å; Y429-I431 PolarHBondContact O-N 3.47Å; Y429-R438 HydrophobicContact CE2-CG 4.35Å; Y429-R438 PolarHBondContact OH-NE 2.84Å; Y429-R438 PolarHBondContact OH-NH2 3.27Å; Y429-F447 HydrophobicContact CD2-CE1 4.1Å; Y429-F447 AromaticContact CD2-CZ 3.65Å; Y429-F447 HydrophobicContact CD2-CZ 3.65Å; Y429-F447 AromaticContact CE2-CE1 3.49Å; Y429-F447 HydrophobicContact CE2-CE1 3.49Å; Y429-F447 VanDerWaalsContact CE2-CE1 3.49Å; Y429-F447 HydrophobicContact CE2-CE2 4.44Å; Y429-F447 AromaticContact CE2-CZ 3.45Å; Y429-F447 HydrophobicContact CE2-CZ 3.45Å; Y429-F447 VanDerWaalsContact CE2-CZ 3.45Å
430	A	92.8	Very high	95.3	Very high	37 Å²	37	78.6 Å²	78.6	31%	0.306	39%	0.391	S	S	.	.	H	α-helix	trans	-75.9	-10.7	174.2	0	0	0	0	0	113.7	L24 K426 Y427 I428 E432	L24-A430 HydrophobicContact CD2-CB 4.03Å; K426-A430 VanDerWaalsContact O-CB 3.3Å; K426-A430 WeakPolarHBondContact O-CB 3.4Å; K426-A430 PolarHBondContact O-N 2.91Å; Y427-A430 WeakPolarHBondContact O-CB 3.35Å; Y427-A430 PolarHBondContact O-N 2.76Å; Y427-A430 VanDerWaalsContact O-N 3.1Å; I428-A430 VanDerWaalsContact C-N 3.27Å; I428-A430 PolarHBondContact O-N 2.92Å; A430-E432 PolarHBondContact O-N 3.38Å
431	I	96	Very high	95.3	Very high	70 Å²	70	80.6 Å²	80.6	36%	0.359	40%	0.402	S	S	.	.	S	Bend	trans	-69.6	123.9	173.1	-58.6	172	0	0	0	108.7	Y427 I428 Y429 S433 V434 K435	Y427-I431 PolarHBondContact O-N 3.26Å; I428-I431 WeakPolarHBondContact O-CB 3.41Å; I428-I431 WeakPolarHBondContact O-CG1 3.36Å; I428-I431 PolarHBondContact O-N 3.39Å; Y429-I431 VanDerWaalsContact C-N 3.26Å; Y429-I431 PolarHBondContact O-N 3.47Å; I431-S433 VanDerWaalsContact C-N 3.3Å; I431-S433 WeakPolarHBondContact CG2-OG 3.48Å; I431-S433 PolarHBondContact O-N 3Å; I431-V434 HydrophobicContact CB-CB 4.27Å; I431-V434 HydrophobicContact CB-CG2 3.94Å; I431-V434 HydrophobicContact CG2-CG2 4.15Å; I431-V434 WeakPolarHBondContact O-CB 3.47Å; I431-V434 PolarHBondContact O-N 3.43Å; I431-V434 VanDerWaalsContact O-N 3.09Å; I431-K435 PolarHBondContact O-N 3Å
432	E	95.3	Very high	95.4	Very high	92 Å²	92	79.5 Å²	79.5	43%	0.43	39%	0.394	S	S	.	.	H	α-helix	trans	-59.3	-37.8	-172.4	-170.2	61.4	-153.5	0	0	113.1	A430 K435 K436	A430-E432 PolarHBondContact O-N 3.38Å; E432-K435 PolarHBondContact O-N 3.41Å; E432-K436 HydrophobicContact CG-CD 4.23Å; E432-K436 HydrophobicContact CG-CG 4.49Å; E432-K436 WeakPolarHBondContact O-CB 3.47Å; E432-K436 WeakPolarHBondContact O-CG 3.38Å; E432-K436 PolarHBondContact O-N 2.72Å; E432-K436 WeakPolarHBondContact OE1-CE 3.4Å
433	S	97.5	Very high	95.4	Very high	82 Å²	82	82.6 Å²	82.6	57%	0.573	42%	0.417	S	S	*	.	H	α-helix	trans	-65.1	-41.3	176.9	56	0	0	0	0	112.4	I431 W437	I431-S433 VanDerWaalsContact C-N 3.3Å; I431-S433 WeakPolarHBondContact CG2-OG 3.48Å; I431-S433 PolarHBondContact O-N 3Å; S433-W437 VanDerWaalsContact O-CB 3.26Å; S433-W437 WeakPolarHBondContact O-CB 3.19Å; S433-W437 PolarHBondContact O-N 3.5Å
434	V	96.3	Very high	95.6	Very high	49 Å²	49	83.1 Å²	83.1	30%	0.297	42%	0.419	S	S	.	.	H	α-helix	trans	-64.5	-46.4	176.3	177.3	0	0	0	0	110	I428 I431 W437 R438	I428-V434 HydrophobicContact CG2-CG1 4.3Å; I428-V434 HydrophobicContact CG2-CG2 4.48Å; I431-V434 HydrophobicContact CB-CB 4.27Å; I431-V434 HydrophobicContact CB-CG2 3.94Å; I431-V434 HydrophobicContact CG2-CG2 4.15Å; I431-V434 WeakPolarHBondContact O-CB 3.47Å; I431-V434 PolarHBondContact O-N 3.43Å; I431-V434 VanDerWaalsContact O-N 3.09Å; V434-W437 PolarHBondContact O-N 3.37Å; V434-R438 WeakPolarHBondContact O-CB 3.01Å; V434-R438 PolarHBondContact O-N 2.65Å
435	K	95	Very high	95.6	Very high	65 Å²	65	84.7 Å²	84.7	28%	0.283	42%	0.416	S	S	.	.	H	α-helix	trans	-60.2	-50.5	178	-174.8	-176.6	167.6	-168.1	0	111.7	I431 E432 W437 R438 E439	I431-K435 PolarHBondContact O-N 3Å; E432-K435 PolarHBondContact O-N 3.41Å; K435-W437 PolarHBondContact O-N 3.47Å; K435-R438 WeakPolarHBondContact O-CB 3.26Å; K435-R438 PolarHBondContact O-N 2.94Å; K435-E439 WeakPolarHBondContact CE-OE1 3.12Å; K435-E439 IonicContact NZ-OE1 2.77Å; K435-E439 WeakPolarHBondContact O-CG 3.41Å; K435-E439 PolarHBondContact O-N 3.04Å
436	K	96.2	Very high	95.7	Very high	128 Å²	128	83.7 Å²	83.7	56%	0.557	41%	0.408	S	S	*	.	H	α-helix	trans	-61.7	-41.8	178	-75.6	-178.9	177.8	179.9	0	112.5	E432 R438 E439 K440	E432-K436 HydrophobicContact CG-CD 4.23Å; E432-K436 HydrophobicContact CG-CG 4.49Å; E432-K436 WeakPolarHBondContact O-CB 3.47Å; E432-K436 WeakPolarHBondContact O-CG 3.38Å; E432-K436 PolarHBondContact O-N 2.72Å; E432-K436 WeakPolarHBondContact OE1-CE 3.4Å; K436-R438 VanDerWaalsContact C-N 3.33Å; K436-E439 PolarHBondContact O-N 2.91Å; K436-K440 WeakPolarHBondContact O-CB 3.39Å; K436-K440 PolarHBondContact O-N 3.24Å
437	W	97.6	Very high	95.9	Very high	151 Å²	151	81.1 Å²	81.1	57%	0.572	40%	0.396	S	S	*	.	H	α-helix	trans	-61.2	-45.2	175.7	177	90.8	0	0	0	110.9	S433 V434 K435 K440 N441 I442	S433-W437 VanDerWaalsContact O-CB 3.26Å; S433-W437 WeakPolarHBondContact O-CB 3.19Å; S433-W437 PolarHBondContact O-N 3.5Å; V434-W437 PolarHBondContact O-N 3.37Å; K435-W437 PolarHBondContact O-N 3.47Å; W437-K440 PolarHBondContact O-N 2.89Å; W437-N441 HydrophobicContact CZ2-CB 4.49Å; W437-N441 PolarHBondContact NE1-ND2 3.17Å; W437-N441 WeakPolarHBondContact O-CB 3.13Å; W437-N441 PolarHBondContact O-N 3.48Å; W437-N441 VanDerWaalsContact O-N 3.09Å; W437-N441 PolarHBondContact O-ND2 2.93Å; W437-I442 HydrophobicContact CH2-CD1 4.05Å; W437-I442 HydrophobicContact CZ3-CD1 3.87Å
438	R	96.1	Very high	96.1	Very high	9 Å²	9	73 Å²	73	3%	0.034	37%	0.365	C	S	.	.	H	α-helix	trans	-60.1	-50.7	177.9	-169.8	-77.7	-67.2	-170.8	5.9	110.6	Y429 V434 K435 K436 K440 N441 I442 D444 F447	Y429-R438 HydrophobicContact CE2-CG 4.35Å; Y429-R438 PolarHBondContact OH-NE 2.84Å; Y429-R438 PolarHBondContact OH-NH2 3.27Å; V434-R438 WeakPolarHBondContact O-CB 3.01Å; V434-R438 PolarHBondContact O-N 2.65Å; K435-R438 WeakPolarHBondContact O-CB 3.26Å; K435-R438 PolarHBondContact O-N 2.94Å; K436-R438 VanDerWaalsContact C-N 3.33Å; R438-K440 VanDerWaalsContact C-N 3.25Å; R438-K440 PolarHBondContact O-N 2.83Å; R438-N441 PolarHBondContact O-N 2.93Å; R438-I442 PolarHBondContact O-N 2.96Å; R438-I442 VanDerWaalsContact O-O 3.12Å; R438-D444 IonicContact CZ-OD1 3.24Å; R438-D444 IonicContact NH1-OD1 3.99Å; R438-D444 PolarHBondContact NH1-OD1 3.41Å; R438-D444 IonicContact NH2-OD1 3.19Å; R438-F447 HydrophobicContact CG-CD1 4.4Å; R438-F447 HydrophobicContact CG-CD2 3.63Å; R438-F447 HydrophobicContact CG-CE1 4.48Å; R438-F447 HydrophobicContact CG-CE2 3.74Å; R438-F447 HydrophobicContact CG-CG 4Å; R438-F447 HydrophobicContact CG-CZ 4.18Å
439	E	95.6	Very high	96.2	Very high	99 Å²	99	72.9 Å²	72.9	46%	0.463	36%	0.359	S	S	.	.	H	α-helix	trans	-61.8	-31.5	-179.3	-72.2	172	172.9	0	0	112.9	K435 K436	K435-E439 WeakPolarHBondContact CE-OE1 3.12Å; K435-E439 IonicContact NZ-OE1 2.77Å; K435-E439 WeakPolarHBondContact O-CG 3.41Å; K435-E439 PolarHBondContact O-N 3.04Å; K436-E439 PolarHBondContact O-N 2.91Å
440	K	96.9	Very high	96.3	Very high	180 Å²	180	75.1 Å²	75.1	78%	0.783	37%	0.372	S	S	*	.	H	α-helix	trans	-75.7	-34.4	176.4	-175.3	177.9	178	-177.6	0	113.7	K436 W437 R438	K436-K440 WeakPolarHBondContact O-CB 3.39Å; K436-K440 PolarHBondContact O-N 3.24Å; W437-K440 PolarHBondContact O-N 2.89Å; R438-K440 VanDerWaalsContact C-N 3.25Å; R438-K440 PolarHBondContact O-N 2.83Å
441	N	97.7	Very high	96.4	Very high	95 Å²	95	74.3 Å²	74.3	51%	0.508	36%	0.363	S	S	.	.	H	α-helix	trans	-111.4	-23.5	-167.3	-63.8	-78.9	0	0	0	114.5	W437 R438	W437-N441 HydrophobicContact CZ2-CB 4.49Å; W437-N441 PolarHBondContact NE1-ND2 3.17Å; W437-N441 WeakPolarHBondContact O-CB 3.13Å; W437-N441 PolarHBondContact O-N 3.48Å; W437-N441 VanDerWaalsContact O-N 3.09Å; W437-N441 PolarHBondContact O-ND2 2.93Å; R438-N441 PolarHBondContact O-N 2.93Å
442	I	96.7	Very high	96.5	Very high	36 Å²	36	71 Å²	71	19%	0.185	35%	0.346	C	S	.	.	S	Bend	trans	-130.1	116.1	-172.3	-52.3	179.4	0	0	0	109.4	W437 R438 A446 F447 I450	W437-I442 HydrophobicContact CH2-CD1 4.05Å; W437-I442 HydrophobicContact CZ3-CD1 3.87Å; R438-I442 PolarHBondContact O-N 2.96Å; R438-I442 VanDerWaalsContact O-O 3.12Å; I442-A446 HydrophobicContact CG2-CB 3.78Å; I442-F447 HydrophobicContact CG2-CB 3.82Å; I442-I450 HydrophobicContact CD1-CD1 4.1Å; I442-I450 HydrophobicContact CG2-CD1 4.06Å
443	S	96.1	Very high	96.6	Very high	75 Å²	75	70.3 Å²	70.3	52%	0.524	35%	0.348	S	S	.	.			trans	-56.1	149.5	174.2	70.3	0	0	0	0	111.5	R445 A446 F447	S443-R445 PolarHBondContact O-N 2.7Å; S443-R445 VanDerWaalsContact O-N 3.12Å; S443-A446 PolarHBondContact O-N 3.06Å; S443-A446 WeakPolarHBondContact OG-CB 3.03Å; S443-A446 PolarHBondContact OG-N 3.29Å; S443-F447 PolarHBondContact O-N 3.49Å
444	D	96	Very high	96.5	Very high	81 Å²	81	71.2 Å²	71.2	43%	0.433	35%	0.346	S	S	.	.	H	α-helix	trans	-53.7	-38.1	179	-71.3	-22.5	0	0	0	112.2	F25 P28 R438 F447 R448	F25-D444 HydrophobicContact CE2-CB 4.16Å; F25-D444 HydrophobicContact CZ-CB 4.29Å; F25-D444 WeakPolarHBondContact CZ-O 3.5Å; P28-D444 HydrophobicContact CB-CB 4.23Å; P28-D444 HydrophobicContact CG-CB 3.82Å; P28-D444 WeakPolarHBondContact CG-O 3.31Å; R438-D444 IonicContact CZ-OD1 3.24Å; R438-D444 IonicContact NH1-OD1 3.99Å; R438-D444 PolarHBondContact NH1-OD1 3.41Å; R438-D444 IonicContact NH2-OD1 3.19Å; D444-F447 PolarHBondContact O-N 3.17Å; D444-R448 WeakPolarHBondContact O-CB 3.36Å; D444-R448 PolarHBondContact O-N 3.47Å
445	R	96.1	Very high	96.5	Very high	118 Å²	118	69.4 Å²	69.4	45%	0.445	33%	0.334	S	S	.	.	H	α-helix	trans	-67.3	-45	178.2	-73.1	-177.1	174.4	160.6	3.7	112.1	P28 S29 L30 S443 F447 R448 R449	P28-R445 HydrophobicContact CB-CG 4.2Å; P28-R445 HydrophobicContact CG-CG 4.05Å; S29-R445 PolarHBondContact O-NE 3.28Å; L30-R445 HydrophobicContact CD2-CB 4.45Å; L30-R445 HydrophobicContact CD2-CG 4.49Å; S443-R445 PolarHBondContact O-N 2.7Å; S443-R445 VanDerWaalsContact O-N 3.12Å; R445-F447 VanDerWaalsContact C-N 3.32Å; R445-R448 WeakPolarHBondContact O-CB 3.49Å; R445-R448 PolarHBondContact O-N 3.28Å; R445-R449 WeakPolarHBondContact O-CG 3.3Å; R445-R449 PolarHBondContact O-N 3.32Å
446	A	96.5	Very high	96.6	Very high	33 Å²	33	67.4 Å²	67.4	27%	0.273	33%	0.326	S	S	.	.	H	α-helix	trans	-63.4	-41.6	175.8	0	0	0	0	0	111	I442 S443 R448 R449 I450	I442-A446 HydrophobicContact CG2-CB 3.78Å; S443-A446 PolarHBondContact O-N 3.06Å; S443-A446 WeakPolarHBondContact OG-CB 3.03Å; S443-A446 PolarHBondContact OG-N 3.29Å; A446-R448 PolarHBondContact O-N 2.93Å; A446-R449 PolarHBondContact O-N 2.8Å; A446-I450 WeakPolarHBondContact O-CG1 3.47Å; A446-I450 PolarHBondContact O-N 2.96Å
447	F	97.2	Very high	96.5	Very high	25 Å²	25	65.8 Å²	65.8	11%	0.11	32%	0.323	C	S	.	.	H	α-helix	trans	-64.3	-39.9	176.6	-171.7	-117.4	0	0	0	112.3	F25 Y429 R438 I442 S443 D444 R445 R449 I450 V451	F25-F447 AromaticContact CD1-CD1 4Å; F25-F447 HydrophobicContact CD1-CD1 4Å; F25-F447 HydrophobicContact CD1-CE1 4.06Å; F25-F447 AromaticContact CD2-CD1 4Å; F25-F447 HydrophobicContact CD2-CD1 4Å; F25-F447 HydrophobicContact CD2-CE1 4.23Å; F25-F447 AromaticContact CE1-CD1 3.76Å; F25-F447 HydrophobicContact CE1-CD1 3.76Å; F25-F447 HydrophobicContact CE1-CE1 4.29Å; F25-F447 AromaticContact CE2-CD1 3.79Å; F25-F447 HydrophobicContact CE2-CD1 3.79Å; F25-F447 HydrophobicContact CE2-CE1 4.47Å; F25-F447 HydrophobicContact CG-CD1 4.11Å; F25-F447 HydrophobicContact CG-CE1 4.03Å; F25-F447 HydrophobicContact CZ-CB 4.46Å; F25-F447 AromaticContact CZ-CD1 3.67Å; F25-F447 HydrophobicContact CZ-CD1 3.67Å; Y429-F447 HydrophobicContact CD2-CE1 4.1Å; Y429-F447 AromaticContact CD2-CZ 3.65Å; Y429-F447 HydrophobicContact CD2-CZ 3.65Å; Y429-F447 AromaticContact CE2-CE1 3.49Å; Y429-F447 HydrophobicContact CE2-CE1 3.49Å; Y429-F447 VanDerWaalsContact CE2-CE1 3.49Å; Y429-F447 HydrophobicContact CE2-CE2 4.44Å; Y429-F447 AromaticContact CE2-CZ 3.45Å; Y429-F447 HydrophobicContact CE2-CZ 3.45Å; Y429-F447 VanDerWaalsContact CE2-CZ 3.45Å; R438-F447 HydrophobicContact CG-CD1 4.4Å; R438-F447 HydrophobicContact CG-CD2 3.63Å; R438-F447 HydrophobicContact CG-CE1 4.48Å; R438-F447 HydrophobicContact CG-CE2 3.74Å; R438-F447 HydrophobicContact CG-CG 4Å; R438-F447 HydrophobicContact CG-CZ 4.18Å; I442-F447 HydrophobicContact CG2-CB 3.82Å; S443-F447 PolarHBondContact O-N 3.49Å; D444-F447 PolarHBondContact O-N 3.17Å; R445-F447 VanDerWaalsContact C-N 3.32Å; F447-R449 VanDerWaalsContact C-N 3.3Å; F447-R449 PolarHBondContact O-N 2.94Å; F447-I450 WeakPolarHBondContact O-CB 3.49Å; F447-I450 PolarHBondContact O-N 3.37Å; F447-I450 VanDerWaalsContact O-N 3.17Å; F447-V451 HydrophobicContact CD1-CG2 4.04Å; F447-V451 HydrophobicContact CD2-CG2 4.48Å; F447-V451 HydrophobicContact CE1-CG2 3.71Å; F447-V451 HydrophobicContact CE2-CG2 4.18Å; F447-V451 HydrophobicContact CG-CG2 4.41Å; F447-V451 HydrophobicContact CZ-CG2 3.78Å; F447-V451 VanDerWaalsContact O-CG2 3.31Å; F447-V451 WeakPolarHBondContact O-CG2 3.31Å; F447-V451 PolarHBondContact O-N 2.88Å
448	R	96	Very high	96.4	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-56.3	-42.9	172.5	-176.3	-175.9	171.3	-74.2	10.8	111.9	F25 Y27 P28 D444 R445 A446 V451 A452 N508 M511 D512	F25-R448 HydrophobicContact CE1-CB 4.25Å; F25-R448 HydrophobicContact CZ-CB 4.43Å; Y27-R448 HydrophobicContact CD1-CG 4.3Å; P28-R448 HydrophobicContact CG-CB 4.06Å; P28-R448 WeakPolarHBondContact O-CD 3.19Å; P28-R448 PolarHBondContact O-NE 3.49Å; P28-R448 VanDerWaalsContact O-NE 3.08Å; D444-R448 WeakPolarHBondContact O-CB 3.36Å; D444-R448 PolarHBondContact O-N 3.47Å; R445-R448 WeakPolarHBondContact O-CB 3.49Å; R445-R448 PolarHBondContact O-N 3.28Å; A446-R448 PolarHBondContact O-N 2.93Å; R448-V451 PolarHBondContact O-N 3.47Å; R448-A452 WeakPolarHBondContact O-CB 3.31Å; R448-A452 PolarHBondContact O-N 3.12Å; R448-N508 PolarHBondContact NH1-OD1 3.42Å; R448-N508 PolarHBondContact NH2-O 3.49Å; R448-N508 VanDerWaalsContact NH2-O 3.15Å; R448-M511 HydrophobicContact CG-SD 3.61Å; R448-D512 IonicContact CZ-OD1 3.08Å; R448-D512 IonicContact NH2-OD1 3.82Å; R448-D512 PolarHBondContact NH2-OD1 2.93Å; R448-D512 IonicContact NH2-OD2 3.39Å; R448-D512 PolarHBondContact NH2-OD2 3.41Å
449	R	97.4	Very high	96.3	Very high	81 Å²	81	59 Å²	59	31%	0.306	30%	0.298	S	S	.	.	H	α-helix	trans	-65.4	-42.1	176.2	-63.8	-175.9	-173.3	111.5	-5.7	111.7	E34 R445 A446 F447 A452 V453 Y504	E34-R449 VanDerWaalsContact CD-NH2 3.35Å; E34-R449 IonicContact OE1-CZ 2.58Å; E34-R449 IonicContact OE1-NE 3.29Å; E34-R449 PolarHBondContact OE1-NE 2.9Å; E34-R449 IonicContact OE1-NH2 2.68Å; E34-R449 PolarHBondContact OE1-NH2 2.91Å; E34-R449 VanDerWaalsContact OE1-NH2 3.17Å; E34-R449 IonicContact OE2-CZ 3.4Å; E34-R449 IonicContact OE2-NE 2.8Å; E34-R449 IonicContact OE2-NH2 2.81Å; E34-R449 PolarHBondContact OE2-NH2 3.36Å; R445-R449 WeakPolarHBondContact O-CG 3.3Å; R445-R449 PolarHBondContact O-N 3.32Å; A446-R449 PolarHBondContact O-N 2.8Å; F447-R449 VanDerWaalsContact C-N 3.3Å; F447-R449 PolarHBondContact O-N 2.94Å; R449-A452 WeakPolarHBondContact O-CB 2.89Å; R449-A452 PolarHBondContact O-N 3.41Å; R449-V453 PolarHBondContact O-N 3.1Å; R449-V453 VanDerWaalsContact O-N 3.07Å; R449-Y504 WeakPolarHBondContact CG-OH 3.49Å
450	I	96.8	Very high	96.3	Very high	71 Å²	71	56.4 Å²	56.4	36%	0.364	29%	0.289	S	S	.	.	H	α-helix	trans	-59.7	-47	173.2	-68.3	160.8	0	0	0	110.7	I442 A446 F447 A452 V453 L454	I442-I450 HydrophobicContact CD1-CD1 4.1Å; I442-I450 HydrophobicContact CG2-CD1 4.06Å; A446-I450 WeakPolarHBondContact O-CG1 3.47Å; A446-I450 PolarHBondContact O-N 2.96Å; F447-I450 WeakPolarHBondContact O-CB 3.49Å; F447-I450 PolarHBondContact O-N 3.37Å; F447-I450 VanDerWaalsContact O-N 3.17Å; I450-A452 VanDerWaalsContact C-N 3.28Å; I450-A452 PolarHBondContact O-N 3.4Å; I450-V453 WeakPolarHBondContact O-CB 3.4Å; I450-V453 PolarHBondContact O-N 3.4Å; I450-V453 VanDerWaalsContact O-N 3.11Å; I450-L454 HydrophobicContact CG2-CD1 3.92Å; I450-L454 HydrophobicContact CG2-CG 4.25Å; I450-L454 WeakPolarHBondContact O-CG 3.28Å; I450-L454 PolarHBondContact O-N 2.94Å
451	V	96	Very high	96.2	Very high	21 Å²	21	49.6 Å²	49.6	13%	0.127	26%	0.261	C	S	.	.	H	α-helix	trans	-60.9	-38.3	176.8	174.4	0	0	0	0	111	Y27 F447 R448 V453 L454 Q455 M511	Y27-V451 HydrophobicContact CE1-CG1 4.18Å; F447-V451 HydrophobicContact CD1-CG2 4.04Å; F447-V451 HydrophobicContact CD2-CG2 4.48Å; F447-V451 HydrophobicContact CE1-CG2 3.71Å; F447-V451 HydrophobicContact CE2-CG2 4.18Å; F447-V451 HydrophobicContact CG-CG2 4.41Å; F447-V451 HydrophobicContact CZ-CG2 3.78Å; F447-V451 VanDerWaalsContact O-CG2 3.31Å; F447-V451 WeakPolarHBondContact O-CG2 3.31Å; F447-V451 PolarHBondContact O-N 2.88Å; R448-V451 PolarHBondContact O-N 3.47Å; V451-V453 VanDerWaalsContact C-N 3.3Å; V451-V453 PolarHBondContact O-N 3.44Å; V451-L454 PolarHBondContact O-N 3.47Å; V451-Q455 HydrophobicContact CG1-CG 4.17Å; V451-Q455 WeakPolarHBondContact O-CB 3.45Å; V451-Q455 WeakPolarHBondContact O-CG 3.34Å; V451-Q455 PolarHBondContact O-N 2.98Å; V451-M511 HydrophobicContact CB-CE 4.31Å; V451-M511 HydrophobicContact CG1-CE 3.81Å
452	A	96.8	Very high	96.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.1	-34.9	176.3	0	0	0	0	0	112.3	R448 R449 I450 Y504 N507 N508 M511	R448-A452 WeakPolarHBondContact O-CB 3.31Å; R448-A452 PolarHBondContact O-N 3.12Å; R449-A452 WeakPolarHBondContact O-CB 2.89Å; R449-A452 PolarHBondContact O-N 3.41Å; I450-A452 VanDerWaalsContact C-N 3.28Å; I450-A452 PolarHBondContact O-N 3.4Å; A452-Y504 HydrophobicContact CB-CD2 3.91Å; A452-Y504 HydrophobicContact CB-CE2 3.76Å; A452-N507 HydrophobicContact CB-CB 4.04Å; A452-N507 PolarHBondContact O-ND2 3.44Å; A452-N508 WeakPolarHBondContact CB-ND2 3.41Å; A452-M511 HydrophobicContact CB-CE 3.82Å; A452-M511 HydrophobicContact CB-SD 4.39Å
453	V	97.4	Very high	96	Very high	78 Å²	78	47.2 Å²	47.2	47%	0.473	25%	0.245	S	C	.	.	H	α-helix	trans	-70.2	-46.4	171.3	175.7	0	0	0	0	111	R449 I450 V451 Q455 L456 Y504	R449-V453 PolarHBondContact O-N 3.1Å; R449-V453 VanDerWaalsContact O-N 3.07Å; I450-V453 WeakPolarHBondContact O-CB 3.4Å; I450-V453 PolarHBondContact O-N 3.4Å; I450-V453 VanDerWaalsContact O-N 3.11Å; V451-V453 VanDerWaalsContact C-N 3.3Å; V451-V453 PolarHBondContact O-N 3.44Å; V453-Q455 VanDerWaalsContact C-N 3.29Å; V453-Q455 PolarHBondContact O-N 2.86Å; V453-L456 HydrophobicContact CG1-CD1 4.42Å; V453-L456 WeakPolarHBondContact O-CB 3.35Å; V453-L456 WeakPolarHBondContact O-CG 3.48Å; V453-L456 PolarHBondContact O-N 3.09Å; V453-Y504 HydrophobicContact CG2-CD2 3.82Å; V453-Y504 HydrophobicContact CG2-CE2 3.93Å
454	L	96.2	Very high	96	Very high	100 Å²	100	45 Å²	45	52%	0.524	23%	0.226	S	C	.	.	H	α-helix	trans	-62.3	-36.3	179.4	-67.6	174.5	0	0	0	112.5	I450 V451 L456 I457	I450-L454 HydrophobicContact CG2-CD1 3.92Å; I450-L454 HydrophobicContact CG2-CG 4.25Å; I450-L454 WeakPolarHBondContact O-CG 3.28Å; I450-L454 PolarHBondContact O-N 2.94Å; V451-L454 PolarHBondContact O-N 3.47Å; L454-L456 PolarHBondContact O-N 3.04Å; L454-I457 WeakPolarHBondContact O-CB 3.35Å; L454-I457 PolarHBondContact O-N 3.45Å
455	Q	95.9	Very high	96	Very high	12 Å²	12	41.1 Å²	41.1	6%	0.056	21%	0.205	C	C	.	.	H	α-helix	trans	-65.8	-14.9	175.1	-77.8	-176	-8.9	0	0	113.1	Y27 T352 V451 V453 I457 L458 V459 N507	Y27-Q455 PolarHBondContact OH-NE2 2.81Å; T352-Q455 PolarHBondContact OG1-OE1 3.13Å; V451-Q455 HydrophobicContact CG1-CG 4.17Å; V451-Q455 WeakPolarHBondContact O-CB 3.45Å; V451-Q455 WeakPolarHBondContact O-CG 3.34Å; V451-Q455 PolarHBondContact O-N 2.98Å; V453-Q455 VanDerWaalsContact C-N 3.29Å; V453-Q455 PolarHBondContact O-N 2.86Å; Q455-I457 PolarHBondContact O-N 3.2Å; Q455-L458 PolarHBondContact O-N 3.18Å; Q455-V459 WeakPolarHBondContact O-CG2 3.36Å; Q455-V459 PolarHBondContact O-N 3.1Å; Q455-N507 WeakPolarHBondContact CB-ND2 3.38Å
456	L	96.5	Very high	96	Very high	23 Å²	23	37.1 Å²	37.1	12%	0.12	19%	0.192	C	C	.	.	H	α-helix	trans	-59.2	-35.2	171.1	-67.6	171.3	0	0	0	111.6	V453 L454 L458 V459 V460 L500 N507	V453-L456 HydrophobicContact CG1-CD1 4.42Å; V453-L456 WeakPolarHBondContact O-CB 3.35Å; V453-L456 WeakPolarHBondContact O-CG 3.48Å; V453-L456 PolarHBondContact O-N 3.09Å; L454-L456 PolarHBondContact O-N 3.04Å; L456-L458 VanDerWaalsContact C-N 3.32Å; L456-L458 PolarHBondContact O-N 3.33Å; L456-V459 PolarHBondContact O-N 2.93Å; L456-V460 VanDerWaalsContact O-CB 3.29Å; L456-V460 WeakPolarHBondContact O-CB 3.32Å; L456-V460 WeakPolarHBondContact O-CG2 3.42Å; L456-V460 PolarHBondContact O-N 2.93Å; L456-L500 HydrophobicContact CB-CD2 4.47Å; L456-L500 HydrophobicContact CD1-CB 4.5Å; L456-L500 HydrophobicContact CD1-CD2 4.28Å; L456-L500 HydrophobicContact CD2-CD2 4.47Å; L456-N507 PolarHBondContact N-ND2 3.08Å
457	I	95.5	Very high	96	Very high	94 Å²	94	36.9 Å²	36.9	48%	0.482	19%	0.185	S	C	.	.	H	α-helix	trans	-60.2	-46.9	177.4	-60.2	171.5	0	0	0	109.9	L454 Q455 L461	L454-I457 WeakPolarHBondContact O-CB 3.35Å; L454-I457 PolarHBondContact O-N 3.45Å; Q455-I457 PolarHBondContact O-N 3.2Å; I457-L461 HydrophobicContact CG2-CD1 4.16Å; I457-L461 WeakPolarHBondContact O-CB 3.28Å; I457-L461 VanDerWaalsContact O-CG 3.29Å; I457-L461 WeakPolarHBondContact O-CG 3.48Å; I457-L461 PolarHBondContact O-N 3.43Å
458	L	95.5	Very high	96.1	Very high	13 Å²	13	36.9 Å²	36.9	7%	0.068	19%	0.185	C	C	.	.	H	α-helix	trans	-67.4	-44.1	179.8	-56.8	178.2	0	0	0	111.4	V353 E418 V421 E422 Q455 L456 V460 L461 G462	V353-L458 HydrophobicContact CG1-CD1 3.89Å; E418-L458 HydrophobicContact CG-CB 4.22Å; E418-L458 HydrophobicContact CG-CD2 3.94Å; V421-L458 HydrophobicContact CB-CD2 4Å; V421-L458 HydrophobicContact CG1-CD2 3.79Å; E422-L458 HydrophobicContact CB-CD1 4.17Å; E422-L458 HydrophobicContact CB-CD2 4.27Å; E422-L458 HydrophobicContact CG-CD1 4.24Å; Q455-L458 PolarHBondContact O-N 3.18Å; L456-L458 VanDerWaalsContact C-N 3.32Å; L456-L458 PolarHBondContact O-N 3.33Å; L458-V460 PolarHBondContact O-N 3.22Å; L458-L461 PolarHBondContact O-N 2.81Å; L458-G462 PolarHBondContact O-N 3Å
459	V	94.3	Very high	96.1	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.018	19%	0.192	C	C	.	.	H	α-helix	trans	-62.2	-44.3	178	169.2	0	0	0	0	111.5	T352 Q455 L456 G462 F463 Y506 N507	T352-V459 WeakPolarHBondContact O-CG2 3.3Å; Q455-V459 WeakPolarHBondContact O-CG2 3.36Å; Q455-V459 PolarHBondContact O-N 3.1Å; L456-V459 PolarHBondContact O-N 2.93Å; V459-G462 PolarHBondContact O-N 2.83Å; V459-F463 HydrophobicContact CG1-CD1 4.45Å; V459-F463 HydrophobicContact CG1-CD2 3.84Å; V459-F463 HydrophobicContact CG1-CE1 4.17Å; V459-F463 HydrophobicContact CG1-CE2 3.5Å; V459-F463 HydrophobicContact CG1-CG 4.31Å; V459-F463 HydrophobicContact CG1-CZ 3.69Å; V459-F463 WeakPolarHBondContact O-CB 3.42Å; V459-F463 WeakPolarHBondContact O-CG 3.48Å; V459-F463 PolarHBondContact O-N 3.23Å; V459-Y506 HydrophobicContact CG2-CD1 4.48Å; V459-Y506 HydrophobicContact CG2-CE1 4.3Å; V459-N507 WeakPolarHBondContact CG2-OD1 3.43Å
460	V	94.9	Very high	96	Very high	45 Å²	45	36 Å²	36	27%	0.273	18%	0.184	S	C	.	.	H	α-helix	trans	-63.3	-49	178.7	168.8	0	0	0	0	110.5	L456 L458 G462 F463 Y464 L500	L456-V460 VanDerWaalsContact O-CB 3.29Å; L456-V460 WeakPolarHBondContact O-CB 3.32Å; L456-V460 WeakPolarHBondContact O-CG2 3.42Å; L456-V460 PolarHBondContact O-N 2.93Å; L458-V460 PolarHBondContact O-N 3.22Å; V460-G462 VanDerWaalsContact C-N 3.31Å; V460-G462 PolarHBondContact O-N 3.34Å; V460-F463 PolarHBondContact O-N 2.84Å; V460-Y464 HydrophobicContact CG1-CD2 3.77Å; V460-Y464 HydrophobicContact CG1-CE2 3.8Å; V460-Y464 VanDerWaalsContact O-CD2 3.29Å; V460-Y464 WeakPolarHBondContact O-CD2 3.18Å; V460-Y464 PolarHBondContact O-N 3.3Å; V460-L500 HydrophobicContact CG2-CD2 4.22Å
461	L	95.5	Very high	95.9	Very high	37 Å²	37	33.1 Å²	33.1	19%	0.194	17%	0.172	C	C	.	.	H	α-helix	trans	-57.6	-45.7	175.8	-72.7	171.3	0	0	0	111.3	L414 V417 E418 I457 L458 S465	L414-L461 HydrophobicContact CD2-CD2 3.95Å; V417-L461 HydrophobicContact CG1-CD1 4.2Å; E418-L461 HydrophobicContact CB-CB 4.13Å; E418-L461 HydrophobicContact CB-CD1 4.17Å; E418-L461 HydrophobicContact CG-CB 4.32Å; I457-L461 HydrophobicContact CG2-CD1 4.16Å; I457-L461 WeakPolarHBondContact O-CB 3.28Å; I457-L461 VanDerWaalsContact O-CG 3.29Å; I457-L461 WeakPolarHBondContact O-CG 3.48Å; I457-L461 PolarHBondContact O-N 3.43Å; L458-L461 PolarHBondContact O-N 2.81Å; L461-S465 WeakPolarHBondContact O-CB 3.29Å; L461-S465 PolarHBondContact O-N 2.88Å
462	G	94.4	Very high	95.9	Very high	1 Å²	1	33 Å²	33	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-64.6	-40.2	179.3	0	0	0	0	0	113.8	F354 L458 V459 V460 S465 N466	F354-G462 VanDerWaalsContact CE1-C 3.5Å; F354-G462 VanDerWaalsContact CE1-O 3.24Å; F354-G462 WeakPolarHBondContact CE1-O 3.28Å; F354-G462 WeakPolarHBondContact CZ-O 3.43Å; L458-G462 PolarHBondContact O-N 3Å; V459-G462 PolarHBondContact O-N 2.83Å; V460-G462 VanDerWaalsContact C-N 3.31Å; V460-G462 PolarHBondContact O-N 3.34Å; G462-S465 WeakPolarHBondContact O-CB 3.44Å; G462-N466 WeakPolarHBondContact O-CB 3.14Å; G462-N466 PolarHBondContact O-N 3.34Å
463	F	94.8	Very high	96	Very high	81 Å²	81	35 Å²	35	36%	0.355	19%	0.189	S	C	.	.	H	α-helix	trans	-65	-52.6	175.9	-76.3	-8.5	0	0	0	111.9	F354 V459 V460 S465 N466 F467	F354-F463 HydrophobicContact CZ-CD1 4.48Å; V459-F463 HydrophobicContact CG1-CD1 4.45Å; V459-F463 HydrophobicContact CG1-CD2 3.84Å; V459-F463 HydrophobicContact CG1-CE1 4.17Å; V459-F463 HydrophobicContact CG1-CE2 3.5Å; V459-F463 HydrophobicContact CG1-CG 4.31Å; V459-F463 HydrophobicContact CG1-CZ 3.69Å; V459-F463 WeakPolarHBondContact O-CB 3.42Å; V459-F463 WeakPolarHBondContact O-CG 3.48Å; V459-F463 PolarHBondContact O-N 3.23Å; V460-F463 PolarHBondContact O-N 2.84Å; F463-S465 VanDerWaalsContact C-N 3.27Å; F463-S465 PolarHBondContact O-N 3.44Å; F463-N466 PolarHBondContact O-N 2.98Å; F463-N466 VanDerWaalsContact O-N 3.13Å; F463-F467 HydrophobicContact CB-CE2 3.87Å; F463-F467 HydrophobicContact CB-CZ 3.86Å; F463-F467 HydrophobicContact CG-CZ 4.41Å; F463-F467 WeakPolarHBondContact O-CD1 3.47Å; F463-F467 WeakPolarHBondContact O-CD2 3.31Å; F463-F467 WeakPolarHBondContact O-CG 3.46Å; F463-F467 PolarHBondContact O-N 3.25Å
464	Y	96.5	Very high	96	Very high	27 Å²	27	33.4 Å²	33.4	11%	0.106	18%	0.178	C	C	.	.	H	α-helix	trans	-59.6	-41.7	176.5	-78.1	-71.4	0	0	0	111.8	V460 N466 F467 Y468 L479 V480 F484	V460-Y464 HydrophobicContact CG1-CD2 3.77Å; V460-Y464 HydrophobicContact CG1-CE2 3.8Å; V460-Y464 VanDerWaalsContact O-CD2 3.29Å; V460-Y464 WeakPolarHBondContact O-CD2 3.18Å; V460-Y464 PolarHBondContact O-N 3.3Å; Y464-N466 VanDerWaalsContact C-N 3.34Å; Y464-N466 PolarHBondContact O-N 3.39Å; Y464-F467 AromaticContact CD1-CD2 3.99Å; Y464-F467 HydrophobicContact CD1-CD2 3.99Å; Y464-F467 HydrophobicContact CE1-CD2 4.44Å; Y464-F467 HydrophobicContact CG-CD2 4.4Å; Y464-F467 PolarHBondContact O-N 3.42Å; Y464-Y468 WeakPolarHBondContact O-CD2 3.44Å; Y464-Y468 PolarHBondContact O-N 3.02Å; Y464-Y468 VanDerWaalsContact O-N 3.16Å; Y464-L479 HydrophobicContact CE1-CB 4.21Å; Y464-V480 HydrophobicContact CD1-CG2 3.57Å; Y464-V480 HydrophobicContact CE1-CG2 3.82Å; Y464-V480 HydrophobicContact CG-CG2 4.48Å; Y464-F484 HydrophobicContact CE1-CB 4.19Å; Y464-F484 HydrophobicContact CE2-CB 4.35Å; Y464-F484 AromaticContact CE2-CD2 3.88Å; Y464-F484 HydrophobicContact CE2-CD2 3.88Å; Y464-F484 WeakPolarHBondContact OH-CB 3.41Å; Y464-F484 PolarHBondContact OH-N 3.45Å
465	S	96.5	Very high	96	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-53.1	-50.7	173.4	-172.2	0	0	0	0	112.3	W411 N415 L461 G462 F463 Y468 F469	W411-S465 WeakPolarHBondContact CA-OG 3.48Å; W411-S465 PolarHBondContact O-OG 3.01Å; N415-S465 PolarHBondContact ND2-OG 2.89Å; L461-S465 WeakPolarHBondContact O-CB 3.29Å; L461-S465 PolarHBondContact O-N 2.88Å; G462-S465 WeakPolarHBondContact O-CB 3.44Å; F463-S465 VanDerWaalsContact C-N 3.27Å; F463-S465 PolarHBondContact O-N 3.44Å; S465-Y468 PolarHBondContact O-N 3.09Å; S465-F469 PolarHBondContact O-N 3.24Å; S465-F469 VanDerWaalsContact O-N 3.08Å
466	N	95.4	Very high	96.1	Very high	34 Å²	34	28.1 Å²	28.1	18%	0.182	15%	0.15	C	C	.	.	H	α-helix	trans	-71.1	-29.5	179.2	-78.9	-8.9	0	0	0	113.5	F354 G462 F463 Y464 Y468 F469 I470	F354-N466 WeakPolarHBondContact CE1-ND2 3.35Å; G462-N466 WeakPolarHBondContact O-CB 3.14Å; G462-N466 PolarHBondContact O-N 3.34Å; F463-N466 PolarHBondContact O-N 2.98Å; F463-N466 VanDerWaalsContact O-N 3.13Å; Y464-N466 VanDerWaalsContact C-N 3.34Å; Y464-N466 PolarHBondContact O-N 3.39Å; N466-Y468 VanDerWaalsContact C-N 3.32Å; N466-F469 PolarHBondContact O-N 3.4Å; N466-I470 HydrophobicContact CB-CD1 4.1Å; N466-I470 WeakPolarHBondContact O-CB 3.32Å; N466-I470 WeakPolarHBondContact O-CG1 3.36Å; N466-I470 PolarHBondContact O-N 3.28Å
467	F	97	Very high	96.2	Very high	28 Å²	28	27.7 Å²	27.7	12%	0.123	15%	0.152	C	C	.	.	H	α-helix	trans	-63	-40.9	175	-61.1	-31.5	0	0	0	111.5	I315 F463 Y464 G471 F475 L479	I315-F467 HydrophobicContact CD1-CD1 4.38Å; F463-F467 HydrophobicContact CB-CE2 3.87Å; F463-F467 HydrophobicContact CB-CZ 3.86Å; F463-F467 HydrophobicContact CG-CZ 4.41Å; F463-F467 WeakPolarHBondContact O-CD1 3.47Å; F463-F467 WeakPolarHBondContact O-CD2 3.31Å; F463-F467 WeakPolarHBondContact O-CG 3.46Å; F463-F467 PolarHBondContact O-N 3.25Å; Y464-F467 AromaticContact CD1-CD2 3.99Å; Y464-F467 HydrophobicContact CD1-CD2 3.99Å; Y464-F467 HydrophobicContact CE1-CD2 4.44Å; Y464-F467 HydrophobicContact CG-CD2 4.4Å; Y464-F467 PolarHBondContact O-N 3.42Å; F467-G471 VanDerWaalsContact O-CA 3.26Å; F467-G471 WeakPolarHBondContact O-CA 3.41Å; F467-G471 PolarHBondContact O-N 3.28Å; F467-F475 HydrophobicContact CB-CD1 4.29Å; F467-F475 HydrophobicContact CB-CE1 4.29Å; F467-F475 HydrophobicContact CD1-CE1 4.14Å; F467-F475 HydrophobicContact CG-CE1 4.36Å; F467-L479 HydrophobicContact CB-CD1 3.84Å; F467-L479 HydrophobicContact CD1-CD1 3.99Å; F467-L479 HydrophobicContact CD2-CB 4.43Å; F467-L479 HydrophobicContact CD2-CD1 3.39Å; F467-L479 HydrophobicContact CD2-CG 4.49Å; F467-L479 HydrophobicContact CE1-CD1 4.39Å; F467-L479 HydrophobicContact CE2-CD1 3.83Å; F467-L479 HydrophobicContact CG-CD1 3.47Å; F467-L479 VanDerWaalsContact CG-CD1 3.47Å; F467-L479 HydrophobicContact CZ-CD1 4.31Å
468	Y	98	Very high	96.3	Very high	25 Å²	25	23.5 Å²	23.5	10%	0.098	13%	0.13	C	C	.	.	H	α-helix	trans	-65.5	-50.7	171.1	-83.3	-88	0	0	0	111.4	N407 I410 Y464 S465 N466 I470 G472 G476 G477 V480	N407-Y468 VanDerWaalsContact CB-O 3.29Å; N407-Y468 WeakPolarHBondContact CB-O 3.38Å; I410-Y468 HydrophobicContact CB-CD1 4.13Å; I410-Y468 HydrophobicContact CB-CG 4.09Å; I410-Y468 HydrophobicContact CD1-CD1 3.63Å; I410-Y468 HydrophobicContact CD1-CE1 3.32Å; I410-Y468 HydrophobicContact CD1-CE2 4.47Å; I410-Y468 HydrophobicContact CD1-CG 4.32Å; I410-Y468 HydrophobicContact CG1-CD1 4.46Å; I410-Y468 HydrophobicContact CG2-CD1 4.06Å; I410-Y468 HydrophobicContact CG2-CD2 3.6Å; I410-Y468 HydrophobicContact CG2-CE1 4.38Å; I410-Y468 HydrophobicContact CG2-CE2 3.97Å; I410-Y468 HydrophobicContact CG2-CG 3.66Å; Y464-Y468 WeakPolarHBondContact O-CD2 3.44Å; Y464-Y468 PolarHBondContact O-N 3.02Å; Y464-Y468 VanDerWaalsContact O-N 3.16Å; S465-Y468 PolarHBondContact O-N 3.09Å; N466-Y468 VanDerWaalsContact C-N 3.32Å; Y468-I470 PolarHBondContact O-N 2.81Å; Y468-G472 CarbonylContact O-C 3.48Å; Y468-G472 WeakPolarHBondContact O-CA 3.41Å; Y468-G472 PolarHBondContact O-N 3.4Å; Y468-G476 VanDerWaalsContact CZ-C 3.45Å; Y468-G477 WeakPolarHBondContact OH-CA 3.34Å; Y468-G477 PolarHBondContact OH-N 3.39Å; Y468-V480 HydrophobicContact CE2-CG2 3.83Å
469	F	96.4	Very high	96.4	Very high	36 Å²	36	22.9 Å²	22.9	16%	0.158	13%	0.127	C	C	.	.	H	α-helix	trans	-59.7	-52.2	-175.8	-179	-129.2	0	0	0	113.4	F319 H402 W411 S465 N466	F319-F469 AromaticContact CE2-CE1 3.94Å; F319-F469 HydrophobicContact CE2-CE1 3.94Å; F319-F469 AromaticContact CZ-CE1 3.81Å; F319-F469 HydrophobicContact CZ-CE1 3.81Å; H402-F469 AromaticContact CE1-CE2 3.94Å; H402-F469 AromaticContact CE1-CZ 3.65Å; H402-F469 AromaticContact ND1-CE2 3.83Å; H402-F469 AromaticContact ND1-CZ 3.99Å; W411-F469 HydrophobicContact CB-CB 3.83Å; W411-F469 VanDerWaalsContact CD1-CB 3.44Å; W411-F469 AromaticContact CD1-CG 3.93Å; W411-F469 HydrophobicContact CD2-CB 3.84Å; W411-F469 HydrophobicContact CD2-CD1 4.24Å; W411-F469 AromaticContact CD2-CD2 3.61Å; W411-F469 HydrophobicContact CD2-CD2 3.61Å; W411-F469 HydrophobicContact CD2-CE2 4.22Å; W411-F469 AromaticContact CD2-CG 3.63Å; W411-F469 HydrophobicContact CD2-CG 3.63Å; W411-F469 AromaticContact CE2-CD1 3.78Å; W411-F469 AromaticContact CE2-CD2 3.97Å; W411-F469 AromaticContact CE2-CG 3.67Å; W411-F469 AromaticContact CE3-CD2 3.51Å; W411-F469 HydrophobicContact CE3-CD2 3.51Å; W411-F469 AromaticContact CE3-CE2 3.82Å; W411-F469 HydrophobicContact CE3-CE2 3.82Å; W411-F469 HydrophobicContact CE3-CG 4.04Å; W411-F469 HydrophobicContact CG-CB 3.47Å; W411-F469 VanDerWaalsContact CG-CB 3.47Å; W411-F469 HydrophobicContact CG-CD2 4.13Å; W411-F469 AromaticContact CG-CG 3.85Å; W411-F469 HydrophobicContact CG-CG 3.85Å; W411-F469 HydrophobicContact CH2-CD1 4.48Å; W411-F469 HydrophobicContact CH2-CD2 4.16Å; W411-F469 HydrophobicContact CH2-CE1 4.12Å; W411-F469 AromaticContact CH2-CE2 3.78Å; W411-F469 HydrophobicContact CH2-CE2 3.78Å; W411-F469 AromaticContact CH2-CZ 3.76Å; W411-F469 HydrophobicContact CH2-CZ 3.76Å; W411-F469 AromaticContact CZ2-CD1 3.94Å; W411-F469 HydrophobicContact CZ2-CD1 3.94Å; W411-F469 HydrophobicContact CZ2-CD2 4.26Å; W411-F469 AromaticContact CZ2-CE1 3.87Å; W411-F469 HydrophobicContact CZ2-CE1 3.87Å; W411-F469 HydrophobicContact CZ2-CE2 4.19Å; W411-F469 HydrophobicContact CZ2-CG 4.15Å; W411-F469 AromaticContact CZ2-CZ 4Å; W411-F469 HydrophobicContact CZ2-CZ 4Å; W411-F469 AromaticContact CZ3-CD2 3.8Å; W411-F469 HydrophobicContact CZ3-CD2 3.8Å; W411-F469 AromaticContact CZ3-CE2 3.58Å; W411-F469 HydrophobicContact CZ3-CE2 3.58Å; W411-F469 HydrophobicContact CZ3-CG 4.46Å; W411-F469 HydrophobicContact CZ3-CZ 4.07Å; W411-F469 AromaticContact NE1-CD1 3.89Å; W411-F469 AromaticContact NE1-CG 3.84Å; S465-F469 PolarHBondContact O-N 3.24Å; S465-F469 VanDerWaalsContact O-N 3.08Å; N466-F469 PolarHBondContact O-N 3.4Å
470	I	95.1	Very high	96.5	Very high	26 Å²	26	24 Å²	24	13%	0.133	13%	0.134	C	C	.	.	H	α-helix	trans	-85.9	-45.2	-171.3	-55.8	170.8	0	0	0	110.2	I315 F319 N466 Y468	I315-I470 HydrophobicContact CB-CG2 4.25Å; I315-I470 HydrophobicContact CD1-CB 4.32Å; I315-I470 HydrophobicContact CD1-CG2 4.27Å; F319-I470 HydrophobicContact CB-CD1 3.87Å; F319-I470 HydrophobicContact CB-CG1 4.48Å; F319-I470 HydrophobicContact CB-CG2 4.07Å; F319-I470 HydrophobicContact CD1-CD1 3.94Å; F319-I470 HydrophobicContact CD2-CD1 4.02Å; F319-I470 HydrophobicContact CD2-CG1 3.87Å; F319-I470 HydrophobicContact CD2-CG2 4.11Å; F319-I470 HydrophobicContact CE1-CD1 4.49Å; F319-I470 HydrophobicContact CE2-CG1 4.22Å; F319-I470 HydrophobicContact CG-CD1 3.68Å; F319-I470 HydrophobicContact CG-CG1 4.09Å; F319-I470 HydrophobicContact CG-CG2 4.38Å; N466-I470 HydrophobicContact CB-CD1 4.1Å; N466-I470 WeakPolarHBondContact O-CB 3.32Å; N466-I470 WeakPolarHBondContact O-CG1 3.36Å; N466-I470 PolarHBondContact O-N 3.28Å; Y468-I470 PolarHBondContact O-N 2.81Å
471	G	95.7	Very high	96.6	Very high	11 Å²	11	26.6 Å²	26.6	11%	0.113	15%	0.146	C	C	.	.	H	α-helix	trans	-89.2	-6.4	-176.3	0	0	0	0	0	114.9	F467 F475	F467-G471 VanDerWaalsContact O-CA 3.26Å; F467-G471 WeakPolarHBondContact O-CA 3.41Å; F467-G471 PolarHBondContact O-N 3.28Å; G471-F475 VanDerWaalsContact O-CB 3.24Å; G471-F475 WeakPolarHBondContact O-CB 3.26Å
472	G	96.3	Very high	96.7	Very high	18 Å²	18	27.6 Å²	27.6	19%	0.186	15%	0.148	C	C	.	.	H	α-helix	trans	79.1	173.9	-177.2	0	0	0	0	0	113.7	Y468 L474 F475 G476	Y468-G472 CarbonylContact O-C 3.48Å; Y468-G472 WeakPolarHBondContact O-CA 3.41Å; Y468-G472 PolarHBondContact O-N 3.4Å; G472-L474 VanDerWaalsContact C-N 3.3Å; G472-L474 PolarHBondContact O-N 2.63Å; G472-F475 PolarHBondContact O-N 3.03Å; G472-G476 PolarHBondContact O-N 3.15Å
473	S	97.9	Very high	96.8	Very high	42 Å²	42	28 Å²	28	29%	0.294	15%	0.149	S	C	.	.	H	α-helix	trans	-63.8	-34.1	-175	-61.1	0	0	0	0	113.5	H406 N407 G477	H406-S473 PolarHBondContact CD2-OG 3.05Å; H406-S473 VanDerWaalsContact CD2-OG 3.3Å; N407-S473 WeakPolarHBondContact CB-OG 3.25Å; N407-S473 PolarHBondContact N-OG 3.29Å; S473-G477 PolarHBondContact O-N 2.97Å
474	L	97.1	Very high	96.9	Very high	46 Å²	46	26.4 Å²	26.4	24%	0.241	14%	0.142	C	C	.	.	H	α-helix	trans	-61.5	-58.1	176.8	171.8	60.3	0	0	0	110.6	R297 L300 G472 G477 V478	R297-L474 HydrophobicContact CB-CD1 3.78Å; R297-L474 HydrophobicContact CB-CD2 4.14Å; R297-L474 HydrophobicContact CG-CD1 3.98Å; L300-L474 HydrophobicContact CD1-CG 4.21Å; G472-L474 VanDerWaalsContact C-N 3.3Å; G472-L474 PolarHBondContact O-N 2.63Å; L474-G477 PolarHBondContact O-N 2.81Å; L474-V478 HydrophobicContact CD1-CG2 4.23Å; L474-V478 WeakPolarHBondContact O-CG2 3.35Å; L474-V478 PolarHBondContact O-N 3.38Å
475	F	97.6	Very high	96.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.7	-46.2	-177.1	-177.5	-111.6	0	0	0	112.4	I294 L300 L308 L311 I315 F467 G471 G472 G477 V478 L479	I294-F475 HydrophobicContact CB-CB 4.14Å; I294-F475 HydrophobicContact CB-CD2 3.81Å; I294-F475 HydrophobicContact CB-CE2 4.43Å; I294-F475 HydrophobicContact CB-CG 4.01Å; I294-F475 HydrophobicContact CG2-CD1 4.37Å; I294-F475 HydrophobicContact CG2-CD2 3.38Å; I294-F475 HydrophobicContact CG2-CE1 4.47Å; I294-F475 HydrophobicContact CG2-CE2 3.51Å; I294-F475 HydrophobicContact CG2-CG 3.83Å; I294-F475 HydrophobicContact CG2-CZ 4.05Å; L300-F475 HydrophobicContact CD1-CB 4.45Å; L300-F475 HydrophobicContact CD1-CD2 3.91Å; L300-F475 HydrophobicContact CD2-CD2 3.76Å; L300-F475 HydrophobicContact CD2-CE2 3.92Å; L308-F475 HydrophobicContact CD1-CE2 4.06Å; L311-F475 HydrophobicContact CB-CE2 4.08Å; L311-F475 HydrophobicContact CB-CZ 4.06Å; I315-F475 HydrophobicContact CD1-CD1 3.68Å; I315-F475 HydrophobicContact CD1-CE1 3.31Å; I315-F475 HydrophobicContact CD1-CZ 4.24Å; I315-F475 HydrophobicContact CG1-CE1 4.19Å; F467-F475 HydrophobicContact CB-CD1 4.29Å; F467-F475 HydrophobicContact CB-CE1 4.29Å; F467-F475 HydrophobicContact CD1-CE1 4.14Å; F467-F475 HydrophobicContact CG-CE1 4.36Å; G471-F475 VanDerWaalsContact O-CB 3.24Å; G471-F475 WeakPolarHBondContact O-CB 3.26Å; G472-F475 PolarHBondContact O-N 3.03Å; F475-G477 VanDerWaalsContact C-N 3.3Å; F475-G477 PolarHBondContact O-N 3.45Å; F475-V478 PolarHBondContact O-N 3.32Å; F475-L479 HydrophobicContact CD1-CD1 3.86Å; F475-L479 HydrophobicContact CE1-CD1 3.25Å; F475-L479 HydrophobicContact CE1-CG 4.33Å; F475-L479 HydrophobicContact CE2-CD1 4.01Å; F475-L479 HydrophobicContact CE2-CG 4.31Å; F475-L479 HydrophobicContact CG-CD1 4.46Å; F475-L479 HydrophobicContact CZ-CD1 3.37Å; F475-L479 HydrophobicContact CZ-CG 4.11Å; F475-L479 PolarHBondContact O-N 3.08Å
476	G	97.8	Very high	96.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-57.8	-43.1	175.8	0	0	0	0	0	112.3	Y468 G472 L479 V480	Y468-G476 VanDerWaalsContact CZ-C 3.45Å; G472-G476 PolarHBondContact O-N 3.15Å; G476-L479 PolarHBondContact O-N 3.37Å; G476-V480 WeakPolarHBondContact O-CG2 3.48Å; G476-V480 PolarHBondContact O-N 2.7Å
477	G	98	Very high	96.8	Very high	15 Å²	15	32.5 Å²	32.5	16%	0.155	17%	0.17	C	C	.	.	H	α-helix	trans	-61.3	-51.2	176.3	0	0	0	0	0	112.8	Y468 S473 L474 F475 L479 V480 D481	Y468-G477 WeakPolarHBondContact OH-CA 3.34Å; Y468-G477 PolarHBondContact OH-N 3.39Å; S473-G477 PolarHBondContact O-N 2.97Å; L474-G477 PolarHBondContact O-N 2.81Å; F475-G477 VanDerWaalsContact C-N 3.3Å; F475-G477 PolarHBondContact O-N 3.45Å; G477-L479 VanDerWaalsContact C-N 3.29Å; G477-L479 PolarHBondContact O-N 2.94Å; G477-V480 WeakPolarHBondContact O-CB 3.43Å; G477-V480 PolarHBondContact O-N 2.94Å; G477-V480 VanDerWaalsContact O-N 3.09Å; G477-D481 PolarHBondContact O-N 3.28Å
478	V	98.1	Very high	96.7	Very high	5 Å²	5	32.4 Å²	32.4	3%	0.03	17%	0.172	C	C	.	.	H	α-helix	trans	-60.2	-39.9	179.8	175.9	0	0	0	0	111.8	L300 L308 L474 F475 D481 R482	L300-V478 HydrophobicContact CB-CB 4.46Å; L300-V478 HydrophobicContact CB-CG1 4.06Å; L300-V478 HydrophobicContact CB-CG2 4.24Å; L300-V478 HydrophobicContact CD1-CG2 4.4Å; L308-V478 HydrophobicContact CD1-CG1 4.47Å; L308-V478 HydrophobicContact CD2-CG1 4.33Å; L474-V478 HydrophobicContact CD1-CG2 4.23Å; L474-V478 WeakPolarHBondContact O-CG2 3.35Å; L474-V478 PolarHBondContact O-N 3.38Å; F475-V478 PolarHBondContact O-N 3.32Å; V478-D481 PolarHBondContact O-N 2.95Å; V478-R482 HydrophobicContact CG1-CG 4.03Å; V478-R482 VanDerWaalsContact O-CB 3.31Å; V478-R482 WeakPolarHBondContact O-CB 3.34Å; V478-R482 WeakPolarHBondContact O-CG 3.33Å; V478-R482 PolarHBondContact O-N 3.25Å
479	L	96.9	Very high	96.5	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-64.4	-41.8	175.7	-81.9	172.1	0	0	0	112.1	L308 Y464 F467 F475 G476 G477 I483 F484	L308-L479 HydrophobicContact CD1-CD2 4.14Å; L308-L479 HydrophobicContact CD1-CG 4.44Å; L308-L479 HydrophobicContact CD2-CD2 3.98Å; L308-L479 HydrophobicContact CG-CD2 3.64Å; L308-L479 HydrophobicContact CG-CG 4.42Å; Y464-L479 HydrophobicContact CE1-CB 4.21Å; F467-L479 HydrophobicContact CB-CD1 3.84Å; F467-L479 HydrophobicContact CD1-CD1 3.99Å; F467-L479 HydrophobicContact CD2-CB 4.43Å; F467-L479 HydrophobicContact CD2-CD1 3.39Å; F467-L479 HydrophobicContact CD2-CG 4.49Å; F467-L479 HydrophobicContact CE1-CD1 4.39Å; F467-L479 HydrophobicContact CE2-CD1 3.83Å; F467-L479 HydrophobicContact CG-CD1 3.47Å; F467-L479 VanDerWaalsContact CG-CD1 3.47Å; F467-L479 HydrophobicContact CZ-CD1 4.31Å; F475-L479 HydrophobicContact CD1-CD1 3.86Å; F475-L479 HydrophobicContact CE1-CD1 3.25Å; F475-L479 HydrophobicContact CE1-CG 4.33Å; F475-L479 HydrophobicContact CE2-CD1 4.01Å; F475-L479 HydrophobicContact CE2-CG 4.31Å; F475-L479 HydrophobicContact CG-CD1 4.46Å; F475-L479 HydrophobicContact CZ-CD1 3.37Å; F475-L479 HydrophobicContact CZ-CG 4.11Å; F475-L479 PolarHBondContact O-N 3.08Å; G476-L479 PolarHBondContact O-N 3.37Å; G477-L479 VanDerWaalsContact C-N 3.29Å; G477-L479 PolarHBondContact O-N 2.94Å; L479-I483 HydrophobicContact CD2-CD1 3.4Å; L479-I483 VanDerWaalsContact CD2-CD1 3.4Å; L479-I483 HydrophobicContact CD2-CG1 4.14Å; L479-I483 WeakPolarHBondContact O-CA 3.38Å; L479-I483 VanDerWaalsContact O-CB 3.25Å; L479-I483 WeakPolarHBondContact O-CB 2.88Å; L479-I483 PolarHBondContact O-N 3.32Å; L479-F484 PolarHBondContact O-N 3.45Å
480	V	97.4	Very high	96.3	Very high	25 Å²	25	38.9 Å²	38.9	15%	0.152	22%	0.216	C	C	.	.	I	π-helix	trans	-61.2	-49	174.5	168	0	0	0	0	110.2	Y464 Y468 G476 G477 F484 W485	Y464-V480 HydrophobicContact CD1-CG2 3.57Å; Y464-V480 HydrophobicContact CE1-CG2 3.82Å; Y464-V480 HydrophobicContact CG-CG2 4.48Å; Y468-V480 HydrophobicContact CE2-CG2 3.83Å; G476-V480 WeakPolarHBondContact O-CG2 3.48Å; G476-V480 PolarHBondContact O-N 2.7Å; G477-V480 WeakPolarHBondContact O-CB 3.43Å; G477-V480 PolarHBondContact O-N 2.94Å; G477-V480 VanDerWaalsContact O-N 3.09Å; V480-F484 HydrophobicContact CG1-CB 4.36Å; V480-F484 CarbonylContact O-C 3.57Å; V480-F484 WeakPolarHBondContact O-CA 3.26Å; V480-F484 WeakPolarHBondContact O-CB 2.97Å; V480-F484 PolarHBondContact O-N 2.97Å; V480-W485 PolarHBondContact O-N 3.18Å
481	D	97.2	Very high	96	Very high	100 Å²	100	44.3 Å²	44.3	54%	0.535	24%	0.238	S	C	.	.	I	π-helix	trans	-66.8	-48.7	-176.1	-66.7	-22.5	0	0	0	112	G477 V478 G486	G477-D481 PolarHBondContact O-N 3.28Å; V478-D481 PolarHBondContact O-N 2.95Å; D481-G486 PolarHBondContact O-N 3.34Å
482	R	97.1	Very high	95.9	Very high	59 Å²	59	49.6 Å²	49.6	22%	0.223	26%	0.258	C	S	.	.	I	π-helix	trans	-80.6	-33.6	-173.8	-63.9	-172.1	67.8	-155.9	-1.3	113.5	L300 E301 I303 L305 L308 V478 E487	L300-R482 PolarHBondContact O-NH1 3.42Å; E301-R482 PolarHBondContact O-NE 3.27Å; E301-R482 PolarHBondContact O-NH1 2.67Å; I303-R482 VanDerWaalsContact O-CZ 3.27Å; I303-R482 PolarHBondContact O-NH1 3.08Å; I303-R482 PolarHBondContact O-NH2 3.4Å; L305-R482 HydrophobicContact CD2-CB 4.1Å; L308-R482 HydrophobicContact CD2-CB 4.09Å; V478-R482 HydrophobicContact CG1-CG 4.03Å; V478-R482 VanDerWaalsContact O-CB 3.31Å; V478-R482 WeakPolarHBondContact O-CB 3.34Å; V478-R482 WeakPolarHBondContact O-CG 3.33Å; V478-R482 PolarHBondContact O-N 3.25Å; R482-E487 WeakPolarHBondContact O-CG 3.45Å
483	I	96.2	Very high	95.9	Very high	9 Å²	9	52.5 Å²	52.5	5%	0.046	27%	0.266	C	S	.	.	I	π-helix	trans	-104.5	-52.6	-176.3	-54.4	-171.5	0	0	0	111.5	L305 L308 S309 L479 E487 T488 L499	L305-I483 HydrophobicContact CD2-CG1 4.33Å; L308-I483 HydrophobicContact CD2-CD1 4.36Å; L308-I483 HydrophobicContact CD2-CG1 4.31Å; S309-I483 WeakPolarHBondContact OG-CD1 3.31Å; L479-I483 HydrophobicContact CD2-CD1 3.4Å; L479-I483 VanDerWaalsContact CD2-CD1 3.4Å; L479-I483 HydrophobicContact CD2-CG1 4.14Å; L479-I483 WeakPolarHBondContact O-CA 3.38Å; L479-I483 VanDerWaalsContact O-CB 3.25Å; L479-I483 WeakPolarHBondContact O-CB 2.88Å; L479-I483 PolarHBondContact O-N 3.32Å; I483-E487 CarbonylContact O-C 3.55Å; I483-E487 WeakPolarHBondContact O-CA 3.38Å; I483-E487 WeakPolarHBondContact O-CB 3.28Å; I483-E487 PolarHBondContact O-N 3.46Å; I483-E487 VanDerWaalsContact O-N 3.1Å; I483-T488 PolarHBondContact O-N 2.96Å; I483-T488 PolarHBondContact O-OG1 3.09Å; I483-L499 HydrophobicContact CG2-CD1 3.71Å
484	F	96.3	Very high	95.8	Very high	48 Å²	48	57.1 Å²	57.1	21%	0.211	28%	0.284	C	S	.	.	I	π-helix	trans	-67.2	-59.2	-177.1	-169.1	-101.5	0	0	0	110.8	Y464 L479 V480 T488 L489	Y464-F484 HydrophobicContact CE1-CB 4.19Å; Y464-F484 HydrophobicContact CE2-CB 4.35Å; Y464-F484 AromaticContact CE2-CD2 3.88Å; Y464-F484 HydrophobicContact CE2-CD2 3.88Å; Y464-F484 WeakPolarHBondContact OH-CB 3.41Å; Y464-F484 PolarHBondContact OH-N 3.45Å; L479-F484 PolarHBondContact O-N 3.45Å; V480-F484 HydrophobicContact CG1-CB 4.36Å; V480-F484 CarbonylContact O-C 3.57Å; V480-F484 WeakPolarHBondContact O-CA 3.26Å; V480-F484 WeakPolarHBondContact O-CB 2.97Å; V480-F484 PolarHBondContact O-N 2.97Å; F484-T488 CarbonylContact O-C 3.5Å; F484-T488 WeakPolarHBondContact O-CA 3.25Å; F484-T488 VanDerWaalsContact O-CB 3.28Å; F484-T488 WeakPolarHBondContact O-CB 3.34Å; F484-T488 PolarHBondContact O-N 2.98Å; F484-T488 VanDerWaalsContact O-N 3.09Å; F484-L489 HydrophobicContact CE1-CD1 4.19Å; F484-L489 HydrophobicContact CE2-CD1 4.22Å; F484-L489 HydrophobicContact CZ-CD1 3.65Å; F484-L489 HydrophobicContact CZ-CG 4.41Å; F484-L489 PolarHBondContact O-N 3.25Å
485	W	96.4	Very high	95.7	Very high	140 Å²	140	57 Å²	57	53%	0.53	29%	0.286	S	S	.	.	I	π-helix	trans	-78.9	-36	-179.9	-61.7	130.5	0	0	0	113.3	V480 L489	V480-W485 PolarHBondContact O-N 3.18Å; W485-L489 CarbonylContact C-O 3.57Å; W485-L489 VanDerWaalsContact CA-O 3.32Å; W485-L489 WeakPolarHBondContact CA-O 3.41Å; W485-L489 HydrophobicContact CE3-CB 4.49Å; W485-L489 HydrophobicContact CZ3-CB 4.38Å
486	G	95.3	Very high	95.5	Very high	20 Å²	20	57 Å²	57	21%	0.206	29%	0.287	C	S	.	.	I	π-helix	trans	-68.7	-42.3	-179.4	0	0	0	0	0	113.4	D481 K493	D481-G486 PolarHBondContact O-N 3.34Å; G486-K493 WeakPolarHBondContact O-CE 3.48Å; G486-K493 PolarHBondContact O-NZ 2.81Å
487	E	95.2	Very high	95.4	Very high	29 Å²	29	58.3 Å²	58.3	14%	0.136	30%	0.297	C	S	.	.	I	π-helix	trans	-123.8	-29.9	-166.5	-55	-58.9	123.5	0	0	114.7	L305 R482 I483 K493 P495 A496	L305-E487 HydrophobicContact CD1-CG 3.72Å; R482-E487 WeakPolarHBondContact O-CG 3.45Å; I483-E487 CarbonylContact O-C 3.55Å; I483-E487 WeakPolarHBondContact O-CA 3.38Å; I483-E487 WeakPolarHBondContact O-CB 3.28Å; I483-E487 PolarHBondContact O-N 3.46Å; I483-E487 VanDerWaalsContact O-N 3.1Å; E487-K493 PolarHBondContact O-N 2.73Å; E487-K493 IonicContact OE1-NZ 2.66Å; E487-K493 PolarHBondContact OE1-NZ 3.39Å; E487-K493 WeakPolarHBondContact OE2-CB 3.49Å; E487-K493 WeakPolarHBondContact OE2-CD 3.31Å; E487-K493 IonicContact OE2-NZ 2.61Å; E487-P495 HydrophobicContact CB-CB 4.27Å; E487-P495 HydrophobicContact CG-CB 4.26Å; E487-P495 HydrophobicContact CG-CG 4.31Å; E487-P495 WeakPolarHBondContact OE2-CD 3.49Å; E487-P495 WeakPolarHBondContact OE2-CG 3.46Å; E487-A496 WeakPolarHBondContact O-CB 3.32Å
488	T	94.8	Very high	95.3	Very high	25 Å²	25	60.8 Å²	60.8	15%	0.153	31%	0.309	C	S	.	.	I	π-helix	trans	-94.1	-61.7	-172.1	-48.7	0	0	0	0	112.3	I483 F484 F492 A496	I483-T488 PolarHBondContact O-N 2.96Å; I483-T488 PolarHBondContact O-OG1 3.09Å; F484-T488 CarbonylContact O-C 3.5Å; F484-T488 WeakPolarHBondContact O-CA 3.25Å; F484-T488 VanDerWaalsContact O-CB 3.28Å; F484-T488 WeakPolarHBondContact O-CB 3.34Å; F484-T488 PolarHBondContact O-N 2.98Å; F484-T488 VanDerWaalsContact O-N 3.09Å; T488-F492 VanDerWaalsContact O-CA 3.25Å; T488-F492 WeakPolarHBondContact O-CA 3.48Å; T488-F492 PolarHBondContact O-N 3.36Å; T488-A496 HydrophobicContact CG2-CB 4.18Å
489	L	93.5	Very high	95.2	Very high	84 Å²	84	63.7 Å²	63.7	44%	0.44	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	138.9	-180	-69.2	-178.5	0	0	0	110.7	F484 W485	F484-L489 HydrophobicContact CE1-CD1 4.19Å; F484-L489 HydrophobicContact CE2-CD1 4.22Å; F484-L489 HydrophobicContact CZ-CD1 3.65Å; F484-L489 HydrophobicContact CZ-CG 4.41Å; F484-L489 PolarHBondContact O-N 3.25Å; W485-L489 CarbonylContact C-O 3.57Å; W485-L489 VanDerWaalsContact CA-O 3.32Å; W485-L489 WeakPolarHBondContact CA-O 3.41Å; W485-L489 HydrophobicContact CE3-CB 4.49Å; W485-L489 HydrophobicContact CZ3-CB 4.38Å
490	P	91.9	Very high	95.2	Very high	114 Å²	114	65.8 Å²	65.8	74%	0.74	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	cis	-84.5	-4.7	-2.6	33.8	-35.4	0	0	0	113.6
491	K	89.8	Confident	95.2	Very high	140 Å²	140	68 Å²	68	61%	0.609	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-20.8	-161.3	-63.7	179	-178.4	173.5	0	115.8	K493	K491-K493 HydrophobicContact CB-CG 4.07Å; K491-K493 PolarHBondContact O-N 3.4Å
492	F	94.1	Very high	95.1	Very high	121 Å²	121	65.5 Å²	65.5	53%	0.531	34%	0.338	S	S	.	.			trans	42.3	61.8	-176.9	-160.1	-96.8	0	0	0	114.3	T488 A497 L500	T488-F492 VanDerWaalsContact O-CA 3.25Å; T488-F492 WeakPolarHBondContact O-CA 3.48Å; T488-F492 PolarHBondContact O-N 3.36Å; F492-A497 HydrophobicContact CE1-CB 4.13Å; F492-A497 HydrophobicContact CZ-CB 4.41Å; F492-L500 HydrophobicContact CD2-CD1 4.49Å; F492-L500 HydrophobicContact CE2-CD1 3.43Å; F492-L500 VanDerWaalsContact CE2-CD1 3.43Å; F492-L500 HydrophobicContact CZ-CD1 3.95Å
493	K	95.8	Very high	95.1	Very high	80 Å²	80	63.1 Å²	63.1	35%	0.348	33%	0.332	S	S	.	.			trans	-80	172.1	-179.6	-66.2	173.9	179.3	163.7	0	112	G486 E487 K491 A496 A497	G486-K493 WeakPolarHBondContact O-CE 3.48Å; G486-K493 PolarHBondContact O-NZ 2.81Å; E487-K493 PolarHBondContact O-N 2.73Å; E487-K493 IonicContact OE1-NZ 2.66Å; E487-K493 PolarHBondContact OE1-NZ 3.39Å; E487-K493 WeakPolarHBondContact OE2-CB 3.49Å; E487-K493 WeakPolarHBondContact OE2-CD 3.31Å; E487-K493 IonicContact OE2-NZ 2.61Å; K491-K493 HydrophobicContact CB-CG 4.07Å; K491-K493 PolarHBondContact O-N 3.4Å; K493-A496 WeakPolarHBondContact O-CB 3.36Å; K493-A496 PolarHBondContact O-N 2.81Å; K493-A497 PolarHBondContact O-N 2.79Å
494	M	95.3	Very high	95.2	Very high	138 Å²	138	64.8 Å²	64.8	68%	0.68	34%	0.338	S	S	*	.	H	α-helix	trans	-52.6	-43	-177.7	-169	61.6	-171.2	0	0	114.4	A496 A497 V498	M494-A496 VanDerWaalsContact C-N 3.28Å; M494-A496 PolarHBondContact O-N 2.95Å; M494-A497 WeakPolarHBondContact O-CB 3.43Å; M494-A497 PolarHBondContact O-N 2.87Å; M494-A497 VanDerWaalsContact O-N 3.13Å; M494-A497 HydrophobicContact SD-CB 4.46Å; M494-V498 HydrophobicContact CE-CG2 3.87Å; M494-V498 HydrophobicContact CG-CG2 4.46Å; M494-V498 WeakPolarHBondContact O-CG2 3.4Å; M494-V498 PolarHBondContact O-N 3.43Å
495	P	94.2	Very high	95.2	Very high	44 Å²	44	63 Å²	63	29%	0.286	33%	0.332	S	S	.	.	H	α-helix	trans	-58.7	-37.9	177	-26.9	37.7	0	0	0	113.4	L305 E487 V498 L499	L305-P495 HydrophobicContact CD1-CB 4.43Å; L305-P495 HydrophobicContact CD1-CG 4.18Å; E487-P495 HydrophobicContact CB-CB 4.27Å; E487-P495 HydrophobicContact CG-CB 4.26Å; E487-P495 HydrophobicContact CG-CG 4.31Å; E487-P495 WeakPolarHBondContact OE2-CD 3.49Å; E487-P495 WeakPolarHBondContact OE2-CG 3.46Å; P495-V498 PolarHBondContact O-N 3.11Å; P495-L499 WeakPolarHBondContact O-CG 3.41Å; P495-L499 PolarHBondContact O-N 3.36Å
496	A	95	Very high	95.2	Very high	1 Å²	1	57 Å²	57	1%	0.008	31%	0.309	C	S	.	.	H	α-helix	trans	-66.5	-42.1	175.8	0	0	0	0	0	111.8	E487 T488 K493 M494 V498 L499 L500	E487-A496 WeakPolarHBondContact O-CB 3.32Å; T488-A496 HydrophobicContact CG2-CB 4.18Å; K493-A496 WeakPolarHBondContact O-CB 3.36Å; K493-A496 PolarHBondContact O-N 2.81Å; M494-A496 VanDerWaalsContact C-N 3.28Å; M494-A496 PolarHBondContact O-N 2.95Å; A496-V498 VanDerWaalsContact C-N 3.31Å; A496-V498 PolarHBondContact O-N 3.07Å; A496-L499 PolarHBondContact O-N 3.2Å; A496-L500 WeakPolarHBondContact O-CB 3.39Å; A496-L500 VanDerWaalsContact O-CG 3.28Å; A496-L500 WeakPolarHBondContact O-CG 3.28Å; A496-L500 PolarHBondContact O-N 3.26Å
497	A	96.1	Very high	95.3	Very high	26 Å²	26	56.1 Å²	56.1	22%	0.215	30%	0.299	C	S	.	.	H	α-helix	trans	-60.3	-40.9	175.3	0	0	0	0	0	111.8	F492 K493 M494 S501	F492-A497 HydrophobicContact CE1-CB 4.13Å; F492-A497 HydrophobicContact CZ-CB 4.41Å; K493-A497 PolarHBondContact O-N 2.79Å; M494-A497 WeakPolarHBondContact O-CB 3.43Å; M494-A497 PolarHBondContact O-N 2.87Å; M494-A497 VanDerWaalsContact O-N 3.13Å; M494-A497 HydrophobicContact SD-CB 4.46Å; A497-S501 VanDerWaalsContact O-CB 3.28Å; A497-S501 WeakPolarHBondContact O-CB 3.48Å; A497-S501 PolarHBondContact O-N 3.48Å; A497-S501 PolarHBondContact O-OG 2.85Å
498	V	95.8	Very high	95.4	Very high	68 Å²	68	54.7 Å²	54.7	41%	0.412	29%	0.293	S	S	.	.	H	α-helix	trans	-64.3	-50.8	175.6	174.4	0	0	0	0	111.1	M494 P495 A496 L500 S501 L502	M494-V498 HydrophobicContact CE-CG2 3.87Å; M494-V498 HydrophobicContact CG-CG2 4.46Å; M494-V498 WeakPolarHBondContact O-CG2 3.4Å; M494-V498 PolarHBondContact O-N 3.43Å; P495-V498 PolarHBondContact O-N 3.11Å; A496-V498 VanDerWaalsContact C-N 3.31Å; A496-V498 PolarHBondContact O-N 3.07Å; V498-L500 VanDerWaalsContact C-N 3.35Å; V498-L500 PolarHBondContact O-N 3.37Å; V498-S501 WeakPolarHBondContact O-CB 3.36Å; V498-S501 PolarHBondContact O-N 3.36Å; V498-L502 HydrophobicContact CG1-CD1 4.24Å; V498-L502 WeakPolarHBondContact O-CG 3.39Å; V498-L502 PolarHBondContact O-N 3.37Å
499	L	95.4	Very high	95.4	Very high	65 Å²	65	54.9 Å²	54.9	34%	0.34	29%	0.294	S	S	.	.	H	α-helix	trans	-61.5	-41.2	-179.1	-72.7	173.4	0	0	0	112.4	I483 P495 A496 L502 G503	I483-L499 HydrophobicContact CG2-CD1 3.71Å; P495-L499 WeakPolarHBondContact O-CG 3.41Å; P495-L499 PolarHBondContact O-N 3.36Å; A496-L499 PolarHBondContact O-N 3.2Å; L499-L502 PolarHBondContact O-N 2.9Å; L499-G503 PolarHBondContact O-N 3.2Å
500	L	96.2	Very high	95.5	Very high	45 Å²	45	51.1 Å²	51.1	24%	0.236	27%	0.274	C	S	.	.	H	α-helix	trans	-70.1	-34.4	176.9	-68	170.1	0	0	0	112.1	L456 V460 F492 A496 V498 G503 Y504	L456-L500 HydrophobicContact CB-CD2 4.47Å; L456-L500 HydrophobicContact CD1-CB 4.5Å; L456-L500 HydrophobicContact CD1-CD2 4.28Å; L456-L500 HydrophobicContact CD2-CD2 4.47Å; V460-L500 HydrophobicContact CG2-CD2 4.22Å; F492-L500 HydrophobicContact CD2-CD1 4.49Å; F492-L500 HydrophobicContact CE2-CD1 3.43Å; F492-L500 VanDerWaalsContact CE2-CD1 3.43Å; F492-L500 HydrophobicContact CZ-CD1 3.95Å; A496-L500 WeakPolarHBondContact O-CB 3.39Å; A496-L500 VanDerWaalsContact O-CG 3.28Å; A496-L500 WeakPolarHBondContact O-CG 3.28Å; A496-L500 PolarHBondContact O-N 3.26Å; V498-L500 VanDerWaalsContact C-N 3.35Å; V498-L500 PolarHBondContact O-N 3.37Å; L500-G503 PolarHBondContact O-N 3.02Å; L500-Y504 WeakPolarHBondContact O-CB 3.47Å; L500-Y504 PolarHBondContact O-N 2.8Å
501	S	97.1	Very high	95.6	Very high	72 Å²	72	45.8 Å²	45.8	50%	0.503	24%	0.24	S	C	.	.	H	α-helix	trans	-65.1	-41.8	173.1	-61	0	0	0	0	111.5	A497 V498 Y504 C505	A497-S501 VanDerWaalsContact O-CB 3.28Å; A497-S501 WeakPolarHBondContact O-CB 3.48Å; A497-S501 PolarHBondContact O-N 3.48Å; A497-S501 PolarHBondContact O-OG 2.85Å; V498-S501 WeakPolarHBondContact O-CB 3.36Å; V498-S501 PolarHBondContact O-N 3.36Å; S501-Y504 PolarHBondContact O-N 3.41Å; S501-C505 PolarHBondContact O-N 2.93Å; S501-C505 PolarHBondContact O-SG 3.3Å
502	L	96.7	Very high	95.8	Very high	47 Å²	47	40.3 Å²	40.3	25%	0.246	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-42.6	172	-69.7	176.5	0	0	0	111.4	I41 A45 V498 L499 Y504 C505 Y506	I41-L502 HydrophobicContact CG2-CD2 3.67Å; A45-L502 HydrophobicContact CB-CD1 4.31Å; A45-L502 HydrophobicContact CB-CD2 3.86Å; V498-L502 HydrophobicContact CG1-CD1 4.24Å; V498-L502 WeakPolarHBondContact O-CG 3.39Å; V498-L502 PolarHBondContact O-N 3.37Å; L499-L502 PolarHBondContact O-N 2.9Å; L502-Y504 VanDerWaalsContact C-N 3.29Å; L502-Y504 PolarHBondContact O-N 3.38Å; L502-C505 PolarHBondContact O-N 3.17Å; L502-Y506 VanDerWaalsContact O-CB 3.25Å; L502-Y506 WeakPolarHBondContact O-CB 3.47Å; L502-Y506 PolarHBondContact O-N 2.69Å
503	G	96.4	Very high	95.7	Very high	10 Å²	10	36.5 Å²	36.5	10%	0.103	20%	0.204	C	C	.	.	H	α-helix	trans	-60.2	-37.3	174.5	0	0	0	0	0	112.7	L499 L500 Y506 N507	L499-G503 PolarHBondContact O-N 3.2Å; L500-G503 PolarHBondContact O-N 3.02Å; G503-Y506 WeakPolarHBondContact O-CB 3.49Å; G503-Y506 PolarHBondContact O-N 3.34Å; G503-N507 WeakPolarHBondContact O-CB 3.34Å; G503-N507 VanDerWaalsContact O-CG 3.23Å; G503-N507 PolarHBondContact O-N 2.95Å
504	Y	97.7	Very high	95.4	Very high	43 Å²	43	34.9 Å²	34.9	17%	0.169	20%	0.202	C	C	.	.	H	α-helix	trans	-68.3	-45.9	176.2	173.2	-96.7	0	0	0	110.8	Y38 R449 A452 V453 L500 S501 L502 Y506 N507 N508	Y38-Y504 HydrophobicContact CE1-CD1 4.41Å; Y38-Y504 AromaticContact CE1-CE1 3.93Å; Y38-Y504 HydrophobicContact CE1-CE1 3.93Å; Y38-Y504 HydrophobicContact CE2-CE1 4.25Å; Y38-Y504 AromaticContact CZ-CE1 3.59Å; Y38-Y504 WeakPolarHBondContact OH-CE1 3.1Å; Y38-Y504 PolarHBondContact OH-OH 3.13Å; R449-Y504 WeakPolarHBondContact CG-OH 3.49Å; A452-Y504 HydrophobicContact CB-CD2 3.91Å; A452-Y504 HydrophobicContact CB-CE2 3.76Å; V453-Y504 HydrophobicContact CG2-CD2 3.82Å; V453-Y504 HydrophobicContact CG2-CE2 3.93Å; L500-Y504 WeakPolarHBondContact O-CB 3.47Å; L500-Y504 PolarHBondContact O-N 2.8Å; S501-Y504 PolarHBondContact O-N 3.41Å; L502-Y504 VanDerWaalsContact C-N 3.29Å; L502-Y504 PolarHBondContact O-N 3.38Å; Y504-Y506 VanDerWaalsContact C-N 3.31Å; Y504-Y506 PolarHBondContact O-N 2.97Å; Y504-N507 PolarHBondContact O-N 3.31Å; Y504-N508 WeakPolarHBondContact CE1-ND2 3.26Å; Y504-N508 WeakPolarHBondContact CE2-ND2 3.33Å; Y504-N508 PolarHBondContact O-N 2.9Å; Y504-N508 VanDerWaalsContact O-N 3.09Å; Y504-N508 PolarHBondContact O-ND2 3.48Å
505	C	97.4	Very high	95.1	Very high	11 Å²	11	33.1 Å²	33.1	7%	0.074	19%	0.188	C	C	.	.	H	α-helix	trans	-57.9	-46.8	173.6	-63	0	0	0	0	110.8	Y38 S501 L502 N507 N508 V509	Y38-C505 HydrophobicContact CD1-CB 4.19Å; Y38-C505 VanDerWaalsContact CD1-SG 3.55Å; Y38-C505 HydrophobicContact CG-CB 4.35Å; S501-C505 PolarHBondContact O-N 2.93Å; S501-C505 PolarHBondContact O-SG 3.3Å; L502-C505 PolarHBondContact O-N 3.17Å; C505-N507 PolarHBondContact O-N 3.4Å; C505-N508 PolarHBondContact O-N 3.22Å; C505-V509 WeakPolarHBondContact O-CG2 3.38Å; C505-V509 PolarHBondContact O-N 3.12Å
506	Y	96.5	Very high	94.9	Very high	15 Å²	15	37.6 Å²	37.6	6%	0.059	20%	0.199	C	C	.	.	H	α-helix	trans	-54.7	-47.6	175.5	174.3	-96.8	0	0	0	112.1	L42 I348 T349 V351 T352 V459 L502 G503 Y504 N508 V509 N510	L42-Y506 HydrophobicContact CD1-CD2 4.22Å; L42-Y506 HydrophobicContact CD2-CD2 4.17Å; I348-Y506 PolarHBondContact O-OH 3.32Å; T349-Y506 HydrophobicContact CG2-CE2 4.02Å; T349-Y506 WeakPolarHBondContact O-CE2 3.29Å; T349-Y506 PolarHBondContact O-OH 2.85Å; V351-Y506 PolarHBondContact N-OH 3.39Å; V351-Y506 PolarHBondContact O-OH 3.41Å; T352-Y506 HydrophobicContact CG2-CD1 4.17Å; T352-Y506 HydrophobicContact CG2-CE1 3.87Å; V459-Y506 HydrophobicContact CG2-CD1 4.48Å; V459-Y506 HydrophobicContact CG2-CE1 4.3Å; L502-Y506 VanDerWaalsContact O-CB 3.25Å; L502-Y506 WeakPolarHBondContact O-CB 3.47Å; L502-Y506 PolarHBondContact O-N 2.69Å; G503-Y506 WeakPolarHBondContact O-CB 3.49Å; G503-Y506 PolarHBondContact O-N 3.34Å; Y504-Y506 VanDerWaalsContact C-N 3.31Å; Y504-Y506 PolarHBondContact O-N 2.97Å; Y506-N508 PolarHBondContact O-N 3.03Å; Y506-V509 PolarHBondContact O-N 2.98Å; Y506-N510 WeakPolarHBondContact CD1-ND2 3.37Å; Y506-N510 WeakPolarHBondContact CE1-ND2 3.39Å; Y506-N510 VanDerWaalsContact CE2-ND2 3.26Å; Y506-N510 WeakPolarHBondContact CE2-ND2 3.37Å; Y506-N510 WeakPolarHBondContact O-CB 3.14Å; Y506-N510 PolarHBondContact O-N 3.19Å; Y506-N510 PolarHBondContact O-ND2 2.82Å
507	N	96.8	Very high	94.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.8	-43.9	179.2	-74.1	-14.4	0	0	0	111.9	T352 A452 Q455 L456 V459 G503 Y504 C505 N510 M511	T352-N507 WeakPolarHBondContact CB-OD1 3.47Å; T352-N507 HydrophobicContact CG2-CB 4.27Å; T352-N507 WeakPolarHBondContact CG2-OD1 3.41Å; A452-N507 HydrophobicContact CB-CB 4.04Å; A452-N507 PolarHBondContact O-ND2 3.44Å; Q455-N507 WeakPolarHBondContact CB-ND2 3.38Å; L456-N507 PolarHBondContact N-ND2 3.08Å; V459-N507 WeakPolarHBondContact CG2-OD1 3.43Å; G503-N507 WeakPolarHBondContact O-CB 3.34Å; G503-N507 VanDerWaalsContact O-CG 3.23Å; G503-N507 PolarHBondContact O-N 2.95Å; Y504-N507 PolarHBondContact O-N 3.31Å; C505-N507 PolarHBondContact O-N 3.4Å; N507-N510 PolarHBondContact O-N 2.59Å; N507-M511 VanDerWaalsContact O-CG 3.31Å; N507-M511 WeakPolarHBondContact O-CG 3.44Å; N507-M511 PolarHBondContact O-N 2.77Å
508	N	96.8	Very high	93.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64.6	-44.1	178.5	-76.9	-85.6	0	0	0	112.5	Y38 R448 A452 Y504 C505 Y506 N510 M511 D512	Y38-N508 HydrophobicContact CD2-CB 3.48Å; Y38-N508 VanDerWaalsContact CD2-CB 3.48Å; Y38-N508 HydrophobicContact CE2-CB 3.81Å; Y38-N508 HydrophobicContact CG-CB 4.33Å; R448-N508 PolarHBondContact NH1-OD1 3.42Å; R448-N508 PolarHBondContact NH2-O 3.49Å; R448-N508 VanDerWaalsContact NH2-O 3.15Å; A452-N508 WeakPolarHBondContact CB-ND2 3.41Å; Y504-N508 WeakPolarHBondContact CE1-ND2 3.26Å; Y504-N508 WeakPolarHBondContact CE2-ND2 3.33Å; Y504-N508 PolarHBondContact O-N 2.9Å; Y504-N508 VanDerWaalsContact O-N 3.09Å; Y504-N508 PolarHBondContact O-ND2 3.48Å; C505-N508 PolarHBondContact O-N 3.22Å; Y506-N508 PolarHBondContact O-N 3.03Å; N508-N510 VanDerWaalsContact C-N 3.28Å; N508-N510 PolarHBondContact O-N 3.35Å; N508-M511 PolarHBondContact O-N 2.98Å; N508-D512 PolarHBondContact O-N 2.9Å
509	V	95.7	Very high	93.2	Very high	29 Å²	29	40.8 Å²	40.8	18%	0.176	22%	0.219	C	C	.	.	H	α-helix	trans	-61.6	-38.5	176.9	171.5	0	0	0	0	111.1	A39 L42 C505 Y506 D512 T513	A39-V509 HydrophobicContact CB-CG2 4.28Å; L42-V509 HydrophobicContact CD2-CB 4.26Å; L42-V509 HydrophobicContact CD2-CG1 4.16Å; L42-V509 HydrophobicContact CD2-CG2 4.35Å; C505-V509 WeakPolarHBondContact O-CG2 3.38Å; C505-V509 PolarHBondContact O-N 3.12Å; Y506-V509 PolarHBondContact O-N 2.98Å; V509-D512 PolarHBondContact O-N 3.43Å; V509-T513 WeakPolarHBondContact O-CB 3.43Å; V509-T513 PolarHBondContact O-N 3.47Å; V509-T513 PolarHBondContact O-OG1 3Å
510	N	94.8	Very high	92.5	Very high	5 Å²	5	42.4 Å²	42.4	3%	0.027	22%	0.223	C	C	.	.	H	α-helix	trans	-68.6	-38.7	176.4	-83.8	-54.6	0	0	0	113.9	T349 R350 T352 Y506 N507 N508 D512 T513 S514	T349-N510 PolarHBondContact O-OD1 3.38Å; R350-N510 WeakPolarHBondContact CA-OD1 3.4Å; R350-N510 PolarHBondContact O-OD1 3.34Å; T352-N510 HydrophobicContact CG2-CB 3.34Å; Y506-N510 WeakPolarHBondContact CD1-ND2 3.37Å; Y506-N510 WeakPolarHBondContact CE1-ND2 3.39Å; Y506-N510 VanDerWaalsContact CE2-ND2 3.26Å; Y506-N510 WeakPolarHBondContact CE2-ND2 3.37Å; Y506-N510 WeakPolarHBondContact O-CB 3.14Å; Y506-N510 PolarHBondContact O-N 3.19Å; Y506-N510 PolarHBondContact O-ND2 2.82Å; N507-N510 PolarHBondContact O-N 2.59Å; N508-N510 VanDerWaalsContact C-N 3.28Å; N508-N510 PolarHBondContact O-N 3.35Å; N510-D512 VanDerWaalsContact C-N 3.33Å; N510-T513 PolarHBondContact O-N 2.87Å; N510-S514 WeakPolarHBondContact O-CB 3.36Å; N510-S514 PolarHBondContact O-N 3.42Å; N510-S514 PolarHBondContact O-OG 2.84Å
511	M	94.3	Very high	91.5	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-61.6	-42.8	172.4	-70.4	176.4	-170.1	0	0	111.2	Y27 R448 V451 A452 N507 N508 S514 R515	Y27-M511 HydrophobicContact CD1-CB 4.45Å; Y27-M511 HydrophobicContact CD1-CE 4.49Å; Y27-M511 HydrophobicContact CD1-CG 3.99Å; Y27-M511 HydrophobicContact CD1-SD 3.79Å; Y27-M511 HydrophobicContact CD2-CB 3.92Å; Y27-M511 HydrophobicContact CD2-CG 3.88Å; Y27-M511 HydrophobicContact CE1-CE 4.03Å; Y27-M511 HydrophobicContact CE1-CG 4.05Å; Y27-M511 HydrophobicContact CE1-SD 3.92Å; Y27-M511 HydrophobicContact CE2-CB 4.43Å; Y27-M511 HydrophobicContact CE2-CG 3.94Å; Y27-M511 HydrophobicContact CG-CB 3.94Å; Y27-M511 HydrophobicContact CG-CG 3.91Å; Y27-M511 HydrophobicContact CG-SD 4.22Å; R448-M511 HydrophobicContact CG-SD 3.61Å; V451-M511 HydrophobicContact CB-CE 4.31Å; V451-M511 HydrophobicContact CG1-CE 3.81Å; A452-M511 HydrophobicContact CB-CE 3.82Å; A452-M511 HydrophobicContact CB-SD 4.39Å; N507-M511 VanDerWaalsContact O-CG 3.31Å; N507-M511 WeakPolarHBondContact O-CG 3.44Å; N507-M511 PolarHBondContact O-N 2.77Å; N508-M511 PolarHBondContact O-N 2.98Å; M511-S514 PolarHBondContact O-N 2.92Å; M511-R515 WeakPolarHBondContact O-CB 3.47Å; M511-R515 PolarHBondContact O-N 3.23Å
512	D	94	Very high	90.3	Very high	24 Å²	24	45.9 Å²	45.9	13%	0.128	24%	0.242	C	C	.	.	H	α-helix	trans	-65.1	-41.2	177	-74.4	-24.1	0	0	0	112.2	S35 R448 N508 V509 N510 R515 W516	S35-D512 WeakPolarHBondContact CB-OD2 3.5Å; S35-D512 PolarHBondContact OG-OD2 3.22Å; R448-D512 IonicContact CZ-OD1 3.08Å; R448-D512 IonicContact NH2-OD1 3.82Å; R448-D512 PolarHBondContact NH2-OD1 2.93Å; R448-D512 IonicContact NH2-OD2 3.39Å; R448-D512 PolarHBondContact NH2-OD2 3.41Å; N508-D512 PolarHBondContact O-N 2.9Å; V509-D512 PolarHBondContact O-N 3.43Å; N510-D512 VanDerWaalsContact C-N 3.33Å; D512-R515 PolarHBondContact O-N 3.31Å; D512-R515 IonicContact OD1-NH2 2.77Å; D512-W516 WeakPolarHBondContact O-CB 3.38Å; D512-W516 PolarHBondContact O-N 3.19Å
513	T	91.2	Very high	88.7	Confident	42 Å²	42	52 Å²	52	26%	0.258	27%	0.266	S	S	.	.	H	α-helix	trans	-64.1	-43.5	176.6	-55.4	0	0	0	0	111.4	R350 V509 N510 R515 W516 L517	R350-T513 HydrophobicContact CG-CG2 3.9Å; V509-T513 WeakPolarHBondContact O-CB 3.43Å; V509-T513 PolarHBondContact O-N 3.47Å; V509-T513 PolarHBondContact O-OG1 3Å; N510-T513 PolarHBondContact O-N 2.87Å; T513-R515 VanDerWaalsContact C-N 3.34Å; T513-R515 PolarHBondContact O-N 3.02Å; T513-W516 PolarHBondContact O-N 3.19Å; T513-L517 HydrophobicContact CG2-CD1 4.35Å; T513-L517 WeakPolarHBondContact O-CG 3.41Å; T513-L517 PolarHBondContact O-N 3.45Å
514	S	89	Confident	86.8	Confident	45 Å²	45	59 Å²	59	32%	0.315	30%	0.3	S	S	.	.	H	α-helix	trans	-62.2	-42.4	177.9	-60.7	0	0	0	0	111.7	N510 M511 L517 S518	N510-S514 WeakPolarHBondContact O-CB 3.36Å; N510-S514 PolarHBondContact O-N 3.42Å; N510-S514 PolarHBondContact O-OG 2.84Å; M511-S514 PolarHBondContact O-N 2.92Å; S514-L517 PolarHBondContact O-N 3.44Å; S514-S518 PolarHBondContact O-N 2.94Å; S514-S518 PolarHBondContact O-OG 2.65Å
515	R	89.9	Confident	84.3	Confident	102 Å²	102	67.3 Å²	67.3	39%	0.385	34%	0.341	S	S	.	.	H	α-helix	trans	-60.7	-48.3	173.6	-176.6	178.4	68	106.5	-3.3	111.4	Y27 M511 D512 T513 L517 S518 S519	Y27-R515 VanDerWaalsContact O-CD 3.26Å; Y27-R515 WeakPolarHBondContact O-CD 3.35Å; M511-R515 WeakPolarHBondContact O-CB 3.47Å; M511-R515 PolarHBondContact O-N 3.23Å; D512-R515 PolarHBondContact O-N 3.31Å; D512-R515 IonicContact OD1-NH2 2.77Å; T513-R515 VanDerWaalsContact C-N 3.34Å; T513-R515 PolarHBondContact O-N 3.02Å; R515-L517 VanDerWaalsContact C-N 3.34Å; R515-L517 PolarHBondContact O-N 2.85Å; R515-S518 PolarHBondContact O-N 3.12Å; R515-S518 PolarHBondContact O-OG 3.07Å; R515-S519 PolarHBondContact O-N 3.17Å
516	W	89.2	Confident	83.7	Confident	137 Å²	137	70.2 Å²	70.2	52%	0.519	35%	0.354	S	S	.	.	H	α-helix	trans	-59.1	-44.4	178.5	177.6	82.5	0	0	0	112.1	D512 T513 S519 K520	D512-W516 WeakPolarHBondContact O-CB 3.38Å; D512-W516 PolarHBondContact O-N 3.19Å; T513-W516 PolarHBondContact O-N 3.19Å; W516-S519 PolarHBondContact O-N 2.68Å; W516-S519 PolarHBondContact O-OG 2.88Å; W516-K520 HydrophobicContact CD2-CD 4.33Å; W516-K520 HydrophobicContact CE3-CD 4.39Å; W516-K520 HydrophobicContact CH2-CD 3.93Å; W516-K520 HydrophobicContact CZ2-CD 3.84Å; W516-K520 HydrophobicContact CZ3-CD 4.19Å; W516-K520 PolarHBondContact O-N 2.95Å; W516-K520 VanDerWaalsContact O-N 3.17Å
517	L	85.4	Confident	83	Confident	47 Å²	47	73.1 Å²	73.1	25%	0.246	37%	0.37	C	S	.	.	H	α-helix	trans	-62.3	-46.8	176.5	-71.5	172.4	0	0	0	112.3	T513 S514 R515 S519 K520 E521	T513-L517 HydrophobicContact CG2-CD1 4.35Å; T513-L517 WeakPolarHBondContact O-CG 3.41Å; T513-L517 PolarHBondContact O-N 3.45Å; S514-L517 PolarHBondContact O-N 3.44Å; R515-L517 VanDerWaalsContact C-N 3.34Å; R515-L517 PolarHBondContact O-N 2.85Å; L517-S519 PolarHBondContact O-N 3.23Å; L517-K520 WeakPolarHBondContact O-CA 3.43Å; L517-K520 WeakPolarHBondContact O-CB 3.36Å; L517-K520 PolarHBondContact O-N 3.06Å; L517-E521 PolarHBondContact O-N 3.1Å
518	S	83.7	Confident	82.3	Confident	62 Å²	62	77.1 Å²	77.1	43%	0.434	39%	0.39	S	S	.	.	H	α-helix	trans	-59.3	-34	177.7	66.2	0	0	0	0	112.8	S514 R515 K520 E521 A522	S514-S518 PolarHBondContact O-N 2.94Å; S514-S518 PolarHBondContact O-OG 2.65Å; R515-S518 PolarHBondContact O-N 3.12Å; R515-S518 PolarHBondContact O-OG 3.07Å; S518-K520 VanDerWaalsContact C-N 3.33Å; S518-E521 PolarHBondContact O-N 3.41Å; S518-A522 WeakPolarHBondContact O-CB 3.5Å; S518-A522 PolarHBondContact O-N 2.77Å
519	S	82.9	Confident	81.4	Confident	53 Å²	53	81.6 Å²	81.6	37%	0.371	41%	0.413	S	S	.	.	H	α-helix	trans	-75.8	-19.5	176.1	69.1	0	0	0	0	113.9	R515 W516 L517 K523	R515-S519 PolarHBondContact O-N 3.17Å; W516-S519 PolarHBondContact O-N 2.68Å; W516-S519 PolarHBondContact O-OG 2.88Å; L517-S519 PolarHBondContact O-N 3.23Å; S519-K523 VanDerWaalsContact O-CG 3.31Å; S519-K523 WeakPolarHBondContact O-CG 3.5Å
520	K	80.3	Confident	80.5	Confident	100 Å²	100	84.9 Å²	84.9	44%	0.435	43%	0.428	S	S	.	.	H	α-helix	trans	-80.5	-41.7	170	-78.5	-170.6	161.7	-170.7	0	111.7	W516 L517 S518 A522 K523 L524	W516-K520 HydrophobicContact CD2-CD 4.33Å; W516-K520 HydrophobicContact CE3-CD 4.39Å; W516-K520 HydrophobicContact CH2-CD 3.93Å; W516-K520 HydrophobicContact CZ2-CD 3.84Å; W516-K520 HydrophobicContact CZ3-CD 4.19Å; W516-K520 PolarHBondContact O-N 2.95Å; W516-K520 VanDerWaalsContact O-N 3.17Å; L517-K520 WeakPolarHBondContact O-CA 3.43Å; L517-K520 WeakPolarHBondContact O-CB 3.36Å; L517-K520 PolarHBondContact O-N 3.06Å; S518-K520 VanDerWaalsContact C-N 3.33Å; K520-A522 VanDerWaalsContact C-N 3.34Å; K520-K523 PolarHBondContact O-N 3.24Å; K520-L524 WeakPolarHBondContact O-CG 3.35Å; K520-L524 PolarHBondContact O-N 2.77Å
521	E	75.7	Confident	79.5	Confident	125 Å²	125	90.3 Å²	90.3	58%	0.584	46%	0.455	S	S	*	.	H	α-helix	trans	-60.4	-45.3	175.7	-70.5	173.7	172.9	0	0	110.5	L517 S518 K523 L524 E525	L517-E521 PolarHBondContact O-N 3.1Å; S518-E521 PolarHBondContact O-N 3.41Å; E521-K523 PolarHBondContact O-N 3.34Å; E521-K523 VanDerWaalsContact O-N 3.12Å; E521-L524 PolarHBondContact O-N 3.09Å; E521-E525 PolarHBondContact O-N 3.32Å
522	A	71.1	Confident	78.5	Confident	65 Å²	65	96.6 Å²	96.6	54%	0.537	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-8.5	176.9	0	0	0	0	0	115.5	S518 K520	S518-A522 WeakPolarHBondContact O-CB 3.5Å; S518-A522 PolarHBondContact O-N 2.77Å; K520-A522 VanDerWaalsContact C-N 3.34Å
523	K	64.5	Low	77.3	Confident	175 Å²	175	102.2 Å²	102.2	76%	0.761	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	-13.8	173	-75.3	179.1	-177.6	-169.3	0	112.9	S519 K520 E521	S519-K523 VanDerWaalsContact O-CG 3.31Å; S519-K523 WeakPolarHBondContact O-CG 3.5Å; K520-K523 PolarHBondContact O-N 3.24Å; E521-K523 PolarHBondContact O-N 3.34Å; E521-K523 VanDerWaalsContact O-N 3.12Å
524	L	55.4	Low	76.1	Confident	156 Å²	156	107.2 Å²	107.2	82%	0.817	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-25.8	179.4	-71.5	167.4	0	0	0	111.7	K520 E521	K520-L524 WeakPolarHBondContact O-CG 3.35Å; K520-L524 PolarHBondContact O-N 2.77Å; E521-L524 PolarHBondContact O-N 3.09Å
525	E	46.7	Very low	75	Confident	219 Å²	219	112.8 Å²	112.8	100%	1.023	56%	0.556	S	S	*	*			trans	-73.4	0	159.3	-65.6	178.7	-176.2	0	0	110.4	E521	E521-E525 PolarHBondContact O-N 3.32Å

Retrieved 525 of 525 residues in 2052 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).