A0A3Q0KF27_SCHMA Loading...

Putative biogenic amine (Dopamine) receptor AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KF27, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 519 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	36.6	Very low	41.6	Very low	220 Å²	220	131.2 Å²	131.2	100%	1.084	73%	0.734	S	S	*	*				0	-19.7	0	-80.9	179.6	-154.5	0	0	112.9	A3	M1-A3 VanDerWaalsContact C-N 3.35Å; M1-A3 PolarHBondContact O-N 3.11Å
2	E	40.5	Very low	41.8	Very low	185 Å²	185	127.7 Å²	127.7	86%	0.864	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-71.6	-21.8	-178.6	-68.3	175.6	158.1	0	0	114.8	C4	E2-C4 PolarHBondContact O-N 2.92Å
3	A	42.3	Very low	42.2	Very low	88 Å²	88	133.2 Å²	133.2	73%	0.727	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-75.9	-15.6	179.4	0	0	0	0	0	114.9	M1	M1-A3 VanDerWaalsContact C-N 3.35Å; M1-A3 PolarHBondContact O-N 3.11Å
4	C	42.6	Very low	42.7	Very low	103 Å²	103	135.2 Å²	135.2	70%	0.696	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-83.5	-15	179	-77.8	0	0	0	0	113.7	E2	E2-C4 PolarHBondContact O-N 2.92Å
5	H	40.9	Very low	43.3	Very low	157 Å²	157	130.3 Å²	130.3	73%	0.727	71%	0.711	S	S	*	*	S	Bend	trans	-82.4	-20.2	-178.5	-85.1	-81.7	0	0	0	113.9
6	A	43.2	Very low	44.3	Very low	62 Å²	62	129.6 Å²	129.6	51%	0.512	71%	0.706	S	S	.	*	S	Bend	trans	-82.5	-22.1	-172.9	0	0	0	0	0	114.7	S9	A6-S9 PolarHBondContact O-OG 3.28Å; A6-S9 VanDerWaalsContact O-OG 3.13Å
7	N	39.2	Very low	45.7	Very low	151 Å²	151	126.9 Å²	126.9	81%	0.807	70%	0.699	S	S	*	*	S	Bend	trans	-92.5	-4	-174.4	-87.3	-5.2	0	0	0	115.1
8	I	42.5	Very low	47.2	Very low	117 Å²	117	125.7 Å²	125.7	60%	0.6	69%	0.692	S	S	*	*	S	Bend	trans	-89.1	-17.1	178	-61	177.7	0	0	0	111.5	Y10 L12	I8-Y10 PolarHBondContact O-N 3.19Å; I8-L12 HydrophobicContact CG2-CD1 4.49Å
9	S	44.1	Very low	48.9	Very low	74 Å²	74	124.9 Å²	124.9	52%	0.517	68%	0.681	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.2	-12.8	-172.8	49.1	0	0	0	0	115.7	A6	A6-S9 PolarHBondContact O-OG 3.28Å; A6-S9 VanDerWaalsContact O-OG 3.13Å
10	Y	43.8	Very low	50.4	Low	220 Å²	220	123.4 Å²	123.4	86%	0.863	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	1.9	-175.9	-79.3	-78.4	0	0	0	115.9	I8	I8-Y10 PolarHBondContact O-N 3.19Å
11	G	42.4	Very low	51.7	Low	66 Å²	66	121.9 Å²	121.9	68%	0.68	66%	0.662	S	S	*	*	S	Bend	trans	-111.9	-9.9	-174.2	0	0	0	0	0	117.9
12	L	44	Very low	53.6	Low	89 Å²	89	116.3 Å²	116.3	47%	0.466	64%	0.637	S	S	.	*			trans	-122.4	33.8	-165.6	-75	160.3	0	0	0	114.6	I8 N14 T15	I8-L12 HydrophobicContact CG2-CD1 4.49Å; L12-N14 PolarHBondContact O-N 3.43Å; L12-T15 HydrophobicContact CD2-CG2 3.73Å; L12-T15 VanDerWaalsContact CD2-OG1 3.27Å; L12-T15 WeakPolarHBondContact CD2-OG1 3.29Å
13	F	46.2	Very low	55.5	Low	199 Å²	199	111.9 Å²	111.9	87%	0.873	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	69.9	167.3	-102	-87	0	0	0	110.9
14	N	49.7	Very low	57.3	Low	162 Å²	162	111.5 Å²	111.5	87%	0.866	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	168.1	10.5	149.7	-102.5	-14.3	0	0	0	114.1	L12 N16	L12-N14 PolarHBondContact O-N 3.43Å; N14-N16 PolarHBondContact O-N 3.38Å
15	T	51.5	Low	58.8	Low	62 Å²	62	111 Å²	111	38%	0.38	60%	0.598	S	S	.	*	S	Bend	trans	-89.5	108.5	174.5	50.2	0	0	0	0	110.5	L12	L12-T15 HydrophobicContact CD2-CG2 3.73Å; L12-T15 VanDerWaalsContact CD2-OG1 3.27Å; L12-T15 WeakPolarHBondContact CD2-OG1 3.29Å
16	N	60.1	Low	60.5	Low	119 Å²	119	108.1 Å²	108.1	64%	0.636	59%	0.587	S	S	*	*			trans	1.2	123.5	163.5	-67.5	-22.3	0	0	0	116.2	N14 N18 F19	N14-N16 PolarHBondContact O-N 3.38Å; N16-N18 PolarHBondContact O-N 3.4Å; N16-F19 WeakPolarHBondContact O-CB 3.28Å; N16-F19 PolarHBondContact O-N 3.05Å
17	S	67.3	Low	62.1	Low	84 Å²	84	108.5 Å²	108.5	59%	0.587	58%	0.583	S	S	*	*	H	α-helix	trans	-44.2	-32.9	168.2	50.1	0	0	0	0	114	F19 I20 N21	S17-F19 PolarHBondContact O-N 3.44Å; S17-I20 PolarHBondContact O-N 3.39Å; S17-N21 PolarHBondContact O-N 3.44Å; S17-N21 VanDerWaalsContact O-N 3.09Å; S17-N21 PolarHBondContact O-ND2 3.28Å
18	N	73.5	Confident	64	Low	105 Å²	105	106.9 Å²	106.9	56%	0.561	57%	0.569	S	S	*	*	H	α-helix	trans	-59.1	-42	174.9	-65.5	-10.3	0	0	0	112.7	N16 I20 N21 D22	N16-N18 PolarHBondContact O-N 3.4Å; N18-I20 PolarHBondContact O-N 2.82Å; N18-N21 PolarHBondContact O-N 3.4Å; N18-D22 WeakPolarHBondContact O-CB 3.35Å; N18-D22 VanDerWaalsContact O-CG 3.25Å; N18-D22 PolarHBondContact O-N 3.01Å
19	F	78.5	Confident	65.4	Low	111 Å²	111	105.3 Å²	105.3	49%	0.487	57%	0.565	S	S	.	*	H	α-helix	trans	-65.9	-39.5	-179.8	-178.3	-98.8	0	0	0	112.1	N16 S17 D22 L23	N16-F19 WeakPolarHBondContact O-CB 3.28Å; N16-F19 PolarHBondContact O-N 3.05Å; S17-F19 PolarHBondContact O-N 3.44Å; F19-D22 PolarHBondContact O-N 3.28Å; F19-L23 WeakPolarHBondContact O-CB 3.48Å; F19-L23 PolarHBondContact O-N 3.18Å
20	I	79.4	Confident	66.7	Low	93 Å²	93	107 Å²	107	48%	0.477	56%	0.564	S	S	.	*	H	α-helix	trans	-65.6	-43.7	176.4	-62.2	-179.8	0	0	0	110.1	S17 N18 D22 L23 V24	S17-I20 PolarHBondContact O-N 3.39Å; N18-I20 PolarHBondContact O-N 2.82Å; I20-D22 VanDerWaalsContact C-N 3.35Å; I20-D22 PolarHBondContact O-N 3.1Å; I20-L23 PolarHBondContact O-N 3.27Å; I20-V24 HydrophobicContact CG2-CG2 4.41Å; I20-V24 VanDerWaalsContact O-CG2 3.3Å; I20-V24 WeakPolarHBondContact O-CG2 3.11Å; I20-V24 PolarHBondContact O-N 2.91Å
21	N	77.1	Confident	68.2	Low	92 Å²	92	99.8 Å²	99.8	49%	0.492	55%	0.546	S	S	.	.	H	α-helix	trans	-63	-40.4	177.2	-71.6	-21.1	0	0	0	112.2	S17 N18 V24 N25	S17-N21 PolarHBondContact O-N 3.44Å; S17-N21 VanDerWaalsContact O-N 3.09Å; S17-N21 PolarHBondContact O-ND2 3.28Å; N18-N21 PolarHBondContact O-N 3.4Å; N21-V24 PolarHBondContact O-N 2.93Å; N21-N25 WeakPolarHBondContact O-CB 3.42Å; N21-N25 VanDerWaalsContact O-CG 3.26Å; N21-N25 PolarHBondContact O-N 3.2Å; N21-N25 PolarHBondContact O-ND2 2.93Å
22	D	77.5	Confident	70	Confident	104 Å²	104	101.5 Å²	101.5	56%	0.556	54%	0.537	S	S	*	.	H	α-helix	trans	-65.4	-40.9	177	-70.6	-21.7	0	0	0	111.8	N18 F19 I20 N25 L26	N18-D22 WeakPolarHBondContact O-CB 3.35Å; N18-D22 VanDerWaalsContact O-CG 3.25Å; N18-D22 PolarHBondContact O-N 3.01Å; F19-D22 PolarHBondContact O-N 3.28Å; I20-D22 VanDerWaalsContact C-N 3.35Å; I20-D22 PolarHBondContact O-N 3.1Å; D22-N25 PolarHBondContact O-N 3.49Å; D22-L26 WeakPolarHBondContact O-CB 3.45Å; D22-L26 PolarHBondContact O-N 3.42Å
23	L	79.5	Confident	71.4	Confident	91 Å²	91	102 Å²	102	48%	0.476	54%	0.537	S	S	.	.	H	α-helix	trans	-66.9	-40	175.8	-174.3	67.7	0	0	0	112.2	F19 I20 L26 T27	F19-L23 WeakPolarHBondContact O-CB 3.48Å; F19-L23 PolarHBondContact O-N 3.18Å; I20-L23 PolarHBondContact O-N 3.27Å; L23-L26 PolarHBondContact O-N 2.91Å; L23-T27 WeakPolarHBondContact O-CB 3.41Å; L23-T27 WeakPolarHBondContact O-CG2 3.43Å; L23-T27 PolarHBondContact O-N 3.28Å; L23-T27 PolarHBondContact O-OG1 3.4Å
24	V	80	Confident	73.1	Confident	80 Å²	80	97.9 Å²	97.9	49%	0.485	52%	0.519	S	S	.	.	H	α-helix	trans	-65.3	-41.7	174.9	171.7	0	0	0	0	110.8	I20 N21 T27 K28	I20-V24 HydrophobicContact CG2-CG2 4.41Å; I20-V24 VanDerWaalsContact O-CG2 3.3Å; I20-V24 WeakPolarHBondContact O-CG2 3.11Å; I20-V24 PolarHBondContact O-N 2.91Å; N21-V24 PolarHBondContact O-N 2.93Å; V24-T27 WeakPolarHBondContact CA-OG1 3.49Å; V24-T27 PolarHBondContact O-OG1 2.88Å; V24-K28 VanDerWaalsContact O-CB 3.3Å; V24-K28 WeakPolarHBondContact O-CB 3.49Å; V24-K28 PolarHBondContact O-N 3.46Å
25	N	75.4	Confident	74.8	Confident	94 Å²	94	93.8 Å²	93.8	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-64.4	-42.6	175.3	-75.5	-23.5	0	0	0	111.5	N21 D22 K28 V29	N21-N25 WeakPolarHBondContact O-CB 3.42Å; N21-N25 VanDerWaalsContact O-CG 3.26Å; N21-N25 PolarHBondContact O-N 3.2Å; N21-N25 PolarHBondContact O-ND2 2.93Å; D22-N25 PolarHBondContact O-N 3.49Å; N25-K28 PolarHBondContact O-N 3.43Å; N25-V29 WeakPolarHBondContact O-CB 3.4Å; N25-V29 WeakPolarHBondContact O-CG2 3.25Å; N25-V29 PolarHBondContact O-N 2.94Å
26	L	75.1	Confident	76.5	Confident	95 Å²	95	97.4 Å²	97.4	50%	0.497	52%	0.516	S	S	.	.	H	α-helix	trans	-63.3	-47.2	177.5	-171.3	68.7	0	0	0	111.7	D22 L23 K28 V29 E30	D22-L26 WeakPolarHBondContact O-CB 3.45Å; D22-L26 PolarHBondContact O-N 3.42Å; L23-L26 PolarHBondContact O-N 2.91Å; L26-K28 VanDerWaalsContact C-N 3.32Å; L26-K28 PolarHBondContact O-N 3.34Å; L26-V29 PolarHBondContact O-N 3.18Å; L26-E30 WeakPolarHBondContact O-CB 3.47Å; L26-E30 WeakPolarHBondContact O-CG 3.17Å; L26-E30 PolarHBondContact O-N 3.34Å
27	T	77.3	Confident	77.9	Confident	71 Å²	71	99.7 Å²	99.7	44%	0.436	52%	0.516	S	S	.	.	H	α-helix	trans	-64.2	-36.3	177.5	50.2	0	0	0	0	112.3	L23 V24 S31	L23-T27 WeakPolarHBondContact O-CB 3.41Å; L23-T27 WeakPolarHBondContact O-CG2 3.43Å; L23-T27 PolarHBondContact O-N 3.28Å; L23-T27 PolarHBondContact O-OG1 3.4Å; V24-T27 WeakPolarHBondContact CA-OG1 3.49Å; V24-T27 PolarHBondContact O-OG1 2.88Å; T27-S31 WeakPolarHBondContact O-CB 3.46Å; T27-S31 PolarHBondContact O-N 3.3Å; T27-S31 PolarHBondContact O-OG 2.76Å
28	K	78.3	Confident	78.9	Confident	116 Å²	116	102.6 Å²	102.6	50%	0.504	51%	0.514	S	S	.	.	H	α-helix	trans	-64.8	-48.4	173.4	-171.8	178.1	176.3	-174.3	0	111.3	V24 N25 L26 E30 S31 E32	V24-K28 VanDerWaalsContact O-CB 3.3Å; V24-K28 WeakPolarHBondContact O-CB 3.49Å; V24-K28 PolarHBondContact O-N 3.46Å; N25-K28 PolarHBondContact O-N 3.43Å; L26-K28 VanDerWaalsContact C-N 3.32Å; L26-K28 PolarHBondContact O-N 3.34Å; K28-E30 VanDerWaalsContact C-N 3.33Å; K28-E30 PolarHBondContact O-N 3.22Å; K28-S31 PolarHBondContact O-N 3.47Å; K28-S31 VanDerWaalsContact O-N 3.13Å; K28-S31 PolarHBondContact O-OG 3.08Å; K28-E32 WeakPolarHBondContact CE-OE1 3.42Å; K28-E32 WeakPolarHBondContact O-CG 3.33Å; K28-E32 PolarHBondContact O-N 3.06Å
29	V	73.9	Confident	79.6	Confident	85 Å²	85	104.2 Å²	104.2	52%	0.515	52%	0.517	S	S	.	.	H	α-helix	trans	-59.8	-43	176.2	170.1	0	0	0	0	111.1	N25 L26 S31 E32 M33	N25-V29 WeakPolarHBondContact O-CB 3.4Å; N25-V29 WeakPolarHBondContact O-CG2 3.25Å; N25-V29 PolarHBondContact O-N 2.94Å; L26-V29 PolarHBondContact O-N 3.18Å; V29-S31 VanDerWaalsContact C-N 3.34Å; V29-S31 PolarHBondContact O-N 3.13Å; V29-E32 PolarHBondContact O-N 3.43Å; V29-M33 WeakPolarHBondContact O-CB 3.42Å; V29-M33 PolarHBondContact O-N 3.48Å
30	E	71.2	Confident	80.3	Confident	108 Å²	108	100.9 Å²	100.9	51%	0.505	51%	0.509	S	S	.	.	H	α-helix	trans	-61.9	-40.9	174.5	-76.6	-177.8	171.3	0	0	112	L26 K28 F34	L26-E30 WeakPolarHBondContact O-CB 3.47Å; L26-E30 WeakPolarHBondContact O-CG 3.17Å; L26-E30 PolarHBondContact O-N 3.34Å; K28-E30 VanDerWaalsContact C-N 3.33Å; K28-E30 PolarHBondContact O-N 3.22Å; E30-F34 WeakPolarHBondContact O-CB 3.49Å; E30-F34 PolarHBondContact O-N 3.13Å
31	S	74.8	Confident	80.9	Confident	70 Å²	70	101 Å²	101	49%	0.49	51%	0.51	S	S	.	.	H	α-helix	trans	-68.2	-40.4	178.5	76.5	0	0	0	0	113	T27 K28 V29 S35	T27-S31 WeakPolarHBondContact O-CB 3.46Å; T27-S31 PolarHBondContact O-N 3.3Å; T27-S31 PolarHBondContact O-OG 2.76Å; K28-S31 PolarHBondContact O-N 3.47Å; K28-S31 VanDerWaalsContact O-N 3.13Å; K28-S31 PolarHBondContact O-OG 3.08Å; V29-S31 VanDerWaalsContact C-N 3.34Å; V29-S31 PolarHBondContact O-N 3.13Å; S31-S35 WeakPolarHBondContact O-CB 3.27Å; S31-S35 PolarHBondContact O-N 3.09Å
32	E	79.8	Confident	81.6	Confident	102 Å²	102	100.6 Å²	100.6	48%	0.477	51%	0.508	S	S	.	.	H	α-helix	trans	-67.1	-49.4	176.2	-74.5	177.7	-178.9	0	0	110.1	K28 V29 F34 S35 E36	K28-E32 WeakPolarHBondContact CE-OE1 3.42Å; K28-E32 WeakPolarHBondContact O-CG 3.33Å; K28-E32 PolarHBondContact O-N 3.06Å; V29-E32 PolarHBondContact O-N 3.43Å; E32-F34 VanDerWaalsContact C-N 3.3Å; E32-F34 PolarHBondContact O-N 3.36Å; E32-S35 WeakPolarHBondContact O-CB 3.41Å; E32-S35 PolarHBondContact O-N 3.05Å; E32-S35 VanDerWaalsContact O-N 3.08Å; E32-E36 PolarHBondContact O-N 3.4Å
33	M	73.6	Confident	82.4	Confident	98 Å²	98	99.6 Å²	99.6	48%	0.483	50%	0.502	S	S	.	.	H	α-helix	trans	-57.8	-43.3	175.9	-175.2	178.8	64.8	0	0	111.2	V29 S35 E36 W37	V29-M33 WeakPolarHBondContact O-CB 3.42Å; V29-M33 PolarHBondContact O-N 3.48Å; M33-S35 VanDerWaalsContact C-N 3.33Å; M33-S35 PolarHBondContact O-N 3.28Å; M33-E36 PolarHBondContact O-N 3.39Å; M33-W37 PolarHBondContact O-N 3.2Å
34	F	80.9	Confident	83.1	Confident	113 Å²	113	99.7 Å²	99.7	50%	0.496	50%	0.502	S	S	.	.	H	α-helix	trans	-64.9	-36.6	177.1	-174.7	-116.3	0	0	0	112.9	E30 E32 R38	E30-F34 WeakPolarHBondContact O-CB 3.49Å; E30-F34 PolarHBondContact O-N 3.13Å; E32-F34 VanDerWaalsContact C-N 3.3Å; E32-F34 PolarHBondContact O-N 3.36Å; F34-R38 WeakPolarHBondContact O-CB 3.47Å; F34-R38 VanDerWaalsContact O-CG 3.31Å; F34-R38 WeakPolarHBondContact O-CG 3.37Å; F34-R38 PolarHBondContact O-N 3.36Å
35	S	85.4	Confident	83.8	Confident	76 Å²	76	99.2 Å²	99.2	53%	0.531	50%	0.496	S	S	.	.	H	α-helix	trans	-64	-45.6	173.6	-171.3	0	0	0	0	111.5	S31 E32 M33 R38 F39	S31-S35 WeakPolarHBondContact O-CB 3.27Å; S31-S35 PolarHBondContact O-N 3.09Å; E32-S35 WeakPolarHBondContact O-CB 3.41Å; E32-S35 PolarHBondContact O-N 3.05Å; E32-S35 VanDerWaalsContact O-N 3.08Å; M33-S35 VanDerWaalsContact C-N 3.33Å; M33-S35 PolarHBondContact O-N 3.28Å; S35-R38 PolarHBondContact O-N 3.29Å; S35-F39 WeakPolarHBondContact O-CB 3.29Å; S35-F39 PolarHBondContact O-N 2.95Å
36	E	88.1	Confident	84.7	Confident	138 Å²	138	95.9 Å²	95.9	65%	0.645	48%	0.478	S	S	*	.	H	α-helix	trans	-61.8	-45.1	177.6	-70.8	-172.8	170.8	0	0	112.2	E32 M33 R38 F39 A40	E32-E36 PolarHBondContact O-N 3.4Å; M33-E36 PolarHBondContact O-N 3.39Å; E36-R38 PolarHBondContact O-N 3.18Å; E36-F39 PolarHBondContact O-N 2.81Å; E36-A40 WeakPolarHBondContact O-CB 3.33Å; E36-A40 PolarHBondContact O-N 3.37Å
37	W	89.3	Confident	85.7	Confident	167 Å²	167	94.5 Å²	94.5	63%	0.633	48%	0.476	S	S	*	.	H	α-helix	trans	-62.1	-42.4	175.9	-76.9	115.3	0	0	0	112.2	M33 F39 A40 L41	M33-W37 PolarHBondContact O-N 3.2Å; W37-F39 VanDerWaalsContact C-N 3.34Å; W37-A40 PolarHBondContact O-N 3.03Å; W37-L41 VanDerWaalsContact O-CB 3.32Å; W37-L41 WeakPolarHBondContact O-CB 3.25Å; W37-L41 VanDerWaalsContact O-CG 3.22Å; W37-L41 WeakPolarHBondContact O-CG 3.36Å; W37-L41 PolarHBondContact O-N 3.1Å
38	R	88.2	Confident	86.6	Confident	146 Å²	146	96.2 Å²	96.2	55%	0.551	48%	0.482	S	S	*	.	H	α-helix	trans	-62.5	-42.3	175.6	-78.2	178.7	168.6	-156	-1.6	111.7	F34 S35 E36 N42	F34-R38 WeakPolarHBondContact O-CB 3.47Å; F34-R38 VanDerWaalsContact O-CG 3.31Å; F34-R38 WeakPolarHBondContact O-CG 3.37Å; F34-R38 PolarHBondContact O-N 3.36Å; S35-R38 PolarHBondContact O-N 3.29Å; E36-R38 PolarHBondContact O-N 3.18Å; R38-N42 WeakPolarHBondContact O-CB 3.17Å; R38-N42 VanDerWaalsContact O-CG 3.22Å; R38-N42 PolarHBondContact O-N 2.75Å; R38-N42 PolarHBondContact O-ND2 3.02Å
39	F	89.2	Confident	87.5	Confident	139 Å²	139	91.6 Å²	91.6	61%	0.61	46%	0.462	S	S	*	.	H	α-helix	trans	-62	-50.8	176.2	-177.8	-98.8	0	0	0	111.2	S35 E36 W37 L41 N42 I43	S35-F39 WeakPolarHBondContact O-CB 3.29Å; S35-F39 PolarHBondContact O-N 2.95Å; E36-F39 PolarHBondContact O-N 2.81Å; W37-F39 VanDerWaalsContact C-N 3.34Å; F39-L41 PolarHBondContact O-N 3.11Å; F39-N42 PolarHBondContact O-N 2.86Å; F39-I43 HydrophobicContact CD1-CG1 4.35Å; F39-I43 HydrophobicContact CE1-CG1 3.99Å; F39-I43 HydrophobicContact CZ-CD1 4.15Å; F39-I43 HydrophobicContact CZ-CG1 4.1Å; F39-I43 WeakPolarHBondContact O-CG1 3.45Å; F39-I43 PolarHBondContact O-N 2.7Å
40	A	92.8	Very high	88.6	Confident	40 Å²	40	91.3 Å²	91.3	33%	0.331	46%	0.457	S	S	.	.	H	α-helix	trans	-59.5	-44.3	178.1	0	0	0	0	0	112.3	E36 W37 N42 I43 I44	E36-A40 WeakPolarHBondContact O-CB 3.33Å; E36-A40 PolarHBondContact O-N 3.37Å; W37-A40 PolarHBondContact O-N 3.03Å; A40-N42 PolarHBondContact O-N 3.45Å; A40-I43 PolarHBondContact O-N 3.38Å; A40-I44 VanDerWaalsContact O-CG1 3.32Å; A40-I44 WeakPolarHBondContact O-CG1 3.44Å; A40-I44 PolarHBondContact O-N 3.3Å
41	L	91.6	Very high	89.8	Confident	95 Å²	95	90.1 Å²	90.1	50%	0.497	45%	0.454	S	S	.	.	H	α-helix	trans	-61.6	-43.3	175.7	-74.5	173.3	0	0	0	112	W37 F39 I43 I44 I45	W37-L41 VanDerWaalsContact O-CB 3.32Å; W37-L41 WeakPolarHBondContact O-CB 3.25Å; W37-L41 VanDerWaalsContact O-CG 3.22Å; W37-L41 WeakPolarHBondContact O-CG 3.36Å; W37-L41 PolarHBondContact O-N 3.1Å; F39-L41 PolarHBondContact O-N 3.11Å; L41-I43 VanDerWaalsContact C-N 3.34Å; L41-I43 PolarHBondContact O-N 3.23Å; L41-I44 PolarHBondContact O-N 3.01Å; L41-I45 WeakPolarHBondContact O-CB 3.38Å; L41-I45 VanDerWaalsContact O-CG1 3.23Å; L41-I45 WeakPolarHBondContact O-CG1 3.47Å; L41-I45 PolarHBondContact O-N 3.44Å
42	N	91.2	Very high	90.9	Very high	84 Å²	84	87.3 Å²	87.3	45%	0.449	43%	0.434	S	S	.	.	H	α-helix	trans	-61.3	-42.4	176.7	-76.8	-23.5	0	0	0	111.7	R38 F39 A40 I45 I46	R38-N42 WeakPolarHBondContact O-CB 3.17Å; R38-N42 VanDerWaalsContact O-CG 3.22Å; R38-N42 PolarHBondContact O-N 2.75Å; R38-N42 PolarHBondContact O-ND2 3.02Å; F39-N42 PolarHBondContact O-N 2.86Å; A40-N42 PolarHBondContact O-N 3.45Å; N42-I45 PolarHBondContact O-N 3.47Å; N42-I46 WeakPolarHBondContact O-CB 3.31Å; N42-I46 WeakPolarHBondContact O-CD1 3.45Å; N42-I46 VanDerWaalsContact O-CG1 3.27Å; N42-I46 WeakPolarHBondContact O-CG1 3.31Å; N42-I46 PolarHBondContact O-N 2.86Å
43	I	94	Very high	91.8	Very high	83 Å²	83	83 Å²	83	43%	0.426	42%	0.417	S	S	.	.	H	α-helix	trans	-62.1	-43.5	175.6	-65.2	-62.4	0	0	0	111.4	F39 A40 L41 S47	F39-I43 HydrophobicContact CD1-CG1 4.35Å; F39-I43 HydrophobicContact CE1-CG1 3.99Å; F39-I43 HydrophobicContact CZ-CD1 4.15Å; F39-I43 HydrophobicContact CZ-CG1 4.1Å; F39-I43 WeakPolarHBondContact O-CG1 3.45Å; F39-I43 PolarHBondContact O-N 2.7Å; A40-I43 PolarHBondContact O-N 3.38Å; L41-I43 VanDerWaalsContact C-N 3.34Å; L41-I43 PolarHBondContact O-N 3.23Å; I43-S47 WeakPolarHBondContact O-CB 3.49Å; I43-S47 PolarHBondContact O-N 3.08Å; I43-S47 PolarHBondContact O-OG 3.38Å
44	I	95.2	Very high	92.9	Very high	94 Å²	94	82.9 Å²	82.9	48%	0.482	42%	0.417	S	S	.	.	H	α-helix	trans	-62.2	-46.9	176.6	-68.3	165.3	0	0	0	110.5	A40 L41 S47 L48	A40-I44 VanDerWaalsContact O-CG1 3.32Å; A40-I44 WeakPolarHBondContact O-CG1 3.44Å; A40-I44 PolarHBondContact O-N 3.3Å; L41-I44 PolarHBondContact O-N 3.01Å; I44-S47 PolarHBondContact O-N 2.97Å; I44-L48 HydrophobicContact CG2-CD1 4.11Å; I44-L48 WeakPolarHBondContact O-CG 3.23Å; I44-L48 PolarHBondContact O-N 2.93Å
45	I	94.3	Very high	93.7	Very high	70 Å²	70	82.3 Å²	82.3	36%	0.359	42%	0.415	S	S	.	.	H	α-helix	trans	-60.1	-50	179.7	-71.6	165.5	0	0	0	110.4	L41 N42 S47 L48 Q49	L41-I45 WeakPolarHBondContact O-CB 3.38Å; L41-I45 VanDerWaalsContact O-CG1 3.23Å; L41-I45 WeakPolarHBondContact O-CG1 3.47Å; L41-I45 PolarHBondContact O-N 3.44Å; N42-I45 PolarHBondContact O-N 3.47Å; I45-S47 VanDerWaalsContact C-N 3.3Å; I45-S47 PolarHBondContact O-N 3.37Å; I45-L48 PolarHBondContact O-N 3.36Å; I45-Q49 HydrophobicContact CG2-CG 4.4Å; I45-Q49 WeakPolarHBondContact O-CB 3.16Å; I45-Q49 WeakPolarHBondContact O-CG 3.02Å; I45-Q49 PolarHBondContact O-N 3.18Å
46	I	95.5	Very high	94.3	Very high	23 Å²	23	78.8 Å²	78.8	12%	0.118	39%	0.39	C	S	.	.	H	α-helix	trans	-61.7	-39.9	179.1	-69.8	162.8	0	0	0	110.8	N42 L48 Q49 I50 I100 Q103 V104	N42-I46 WeakPolarHBondContact O-CB 3.31Å; N42-I46 WeakPolarHBondContact O-CD1 3.45Å; N42-I46 VanDerWaalsContact O-CG1 3.27Å; N42-I46 WeakPolarHBondContact O-CG1 3.31Å; N42-I46 PolarHBondContact O-N 2.86Å; I46-L48 PolarHBondContact O-N 3.48Å; I46-Q49 WeakPolarHBondContact O-CB 3.34Å; I46-Q49 PolarHBondContact O-N 3.02Å; I46-I50 HydrophobicContact CG2-CD1 3.87Å; I46-I50 HydrophobicContact CG2-CG1 4.43Å; I46-I50 WeakPolarHBondContact O-CG1 3.45Å; I46-I50 PolarHBondContact O-N 3.3Å; I46-I100 HydrophobicContact CG2-CG2 4.14Å; I46-Q103 HydrophobicContact CG1-CG 4.42Å; I46-V104 HydrophobicContact CD1-CG2 3.92Å; I46-V104 HydrophobicContact CG2-CG2 4.1Å
47	S	96.2	Very high	94.8	Very high	66 Å²	66	76 Å²	76	46%	0.462	38%	0.376	S	S	.	.	H	α-helix	trans	-62.6	-43.9	176.7	-59.9	0	0	0	0	112.1	I43 I44 I45 Q49 I50 L51	I43-S47 WeakPolarHBondContact O-CB 3.49Å; I43-S47 PolarHBondContact O-N 3.08Å; I43-S47 PolarHBondContact O-OG 3.38Å; I44-S47 PolarHBondContact O-N 2.97Å; I45-S47 VanDerWaalsContact C-N 3.3Å; I45-S47 PolarHBondContact O-N 3.37Å; S47-Q49 VanDerWaalsContact C-N 3.31Å; S47-Q49 PolarHBondContact O-N 3.47Å; S47-I50 PolarHBondContact O-N 3.47Å; S47-L51 WeakPolarHBondContact O-CB 3.33Å; S47-L51 PolarHBondContact O-N 2.93Å
48	L	96	Very high	95.3	Very high	108 Å²	108	71.3 Å²	71.3	57%	0.565	37%	0.368	S	S	*	.	H	α-helix	trans	-64.8	-36.3	175.5	-70.5	173.3	0	0	0	112	I44 I45 I46 L51 S52	I44-L48 HydrophobicContact CG2-CD1 4.11Å; I44-L48 WeakPolarHBondContact O-CG 3.23Å; I44-L48 PolarHBondContact O-N 2.93Å; I45-L48 PolarHBondContact O-N 3.36Å; I46-L48 PolarHBondContact O-N 3.48Å; L48-L51 PolarHBondContact O-N 2.99Å; L48-S52 WeakPolarHBondContact O-CB 3.48Å; L48-S52 PolarHBondContact O-N 3.47Å
49	Q	96.5	Very high	95.7	Very high	18 Å²	18	65 Å²	65	8%	0.084	35%	0.348	C	S	.	.	H	α-helix	trans	-67.3	-45	176.7	-75.8	170.1	-4.6	0	0	112.2	I45 I46 S47 L51 S52 G53 Q103 W485	I45-Q49 HydrophobicContact CG2-CG 4.4Å; I45-Q49 WeakPolarHBondContact O-CB 3.16Å; I45-Q49 WeakPolarHBondContact O-CG 3.02Å; I45-Q49 PolarHBondContact O-N 3.18Å; I46-Q49 WeakPolarHBondContact O-CB 3.34Å; I46-Q49 PolarHBondContact O-N 3.02Å; S47-Q49 VanDerWaalsContact C-N 3.31Å; S47-Q49 PolarHBondContact O-N 3.47Å; Q49-L51 VanDerWaalsContact C-N 3.32Å; Q49-L51 PolarHBondContact O-N 3.02Å; Q49-S52 PolarHBondContact O-N 3.2Å; Q49-S52 PolarHBondContact O-OG 2.91Å; Q49-G53 PolarHBondContact O-N 2.97Å; Q49-Q103 VanDerWaalsContact OE1-CD 3.26Å; Q49-W485 HydrophobicContact CB-CD2 4.39Å; Q49-W485 HydrophobicContact CB-CE3 4.29Å; Q49-W485 HydrophobicContact CB-CH2 3.47Å; Q49-W485 VanDerWaalsContact CB-CH2 3.47Å; Q49-W485 HydrophobicContact CB-CZ2 3.56Å; Q49-W485 HydrophobicContact CB-CZ3 3.85Å; Q49-W485 VanDerWaalsContact CD-CZ2 3.46Å; Q49-W485 HydrophobicContact CG-CD2 3.64Å; Q49-W485 VanDerWaalsContact CG-CE2 3.47Å; Q49-W485 HydrophobicContact CG-CE3 3.86Å; Q49-W485 HydrophobicContact CG-CG 4.28Å; Q49-W485 HydrophobicContact CG-CH2 3.83Å; Q49-W485 HydrophobicContact CG-CZ2 3.58Å; Q49-W485 HydrophobicContact CG-CZ3 3.94Å; Q49-W485 VanDerWaalsContact NE2-CE2 3.33Å
50	I	97.4	Very high	96.1	Very high	80 Å²	80	58.4 Å²	58.4	41%	0.41	32%	0.319	S	S	.	.	H	α-helix	trans	-58.7	-46.9	172.9	-68.5	164.4	0	0	0	110	I46 S47 S52 G53 I54 I100	I46-I50 HydrophobicContact CG2-CD1 3.87Å; I46-I50 HydrophobicContact CG2-CG1 4.43Å; I46-I50 WeakPolarHBondContact O-CG1 3.45Å; I46-I50 PolarHBondContact O-N 3.3Å; S47-I50 PolarHBondContact O-N 3.47Å; I50-S52 VanDerWaalsContact C-N 3.32Å; I50-S52 PolarHBondContact O-N 3.38Å; I50-G53 PolarHBondContact O-N 3.34Å; I50-G53 VanDerWaalsContact O-N 3.13Å; I50-I54 HydrophobicContact CG2-CD1 4.3Å; I50-I54 WeakPolarHBondContact O-CG1 3.13Å; I50-I54 PolarHBondContact O-N 3.11Å; I50-I100 HydrophobicContact CG1-CD1 3.92Å; I50-I100 HydrophobicContact CG1-CG2 4.23Å
51	L	97	Very high	96.4	Very high	82 Å²	82	60 Å²	60	43%	0.429	32%	0.322	S	S	.	.	H	α-helix	trans	-60.1	-42.3	176.9	-177.7	62.8	0	0	0	111.7	S47 L48 Q49 G53 I54 F55	S47-L51 WeakPolarHBondContact O-CB 3.33Å; S47-L51 PolarHBondContact O-N 2.93Å; L48-L51 PolarHBondContact O-N 2.99Å; Q49-L51 VanDerWaalsContact C-N 3.32Å; Q49-L51 PolarHBondContact O-N 3.02Å; L51-G53 VanDerWaalsContact C-N 3.32Å; L51-G53 PolarHBondContact O-N 3.31Å; L51-I54 PolarHBondContact O-N 2.94Å; L51-F55 HydrophobicContact CD1-CD2 4.06Å; L51-F55 HydrophobicContact CD1-CE2 3.65Å; L51-F55 HydrophobicContact CD2-CE2 4.06Å; L51-F55 HydrophobicContact CG-CD2 3.86Å; L51-F55 HydrophobicContact CG-CE2 3.61Å; L51-F55 VanDerWaalsContact O-CD2 3.23Å; L51-F55 WeakPolarHBondContact O-CD2 3.49Å; L51-F55 PolarHBondContact O-N 3.3Å
52	S	96.8	Very high	96.6	Very high	12 Å²	12	57.2 Å²	57.2	8%	0.084	31%	0.307	C	S	.	.	H	α-helix	trans	-61.2	-40.3	175.3	80.5	0	0	0	0	111.8	L48 Q49 I50 I54 F55 I56	L48-S52 WeakPolarHBondContact O-CB 3.48Å; L48-S52 PolarHBondContact O-N 3.47Å; Q49-S52 PolarHBondContact O-N 3.2Å; Q49-S52 PolarHBondContact O-OG 2.91Å; I50-S52 VanDerWaalsContact C-N 3.32Å; I50-S52 PolarHBondContact O-N 3.38Å; S52-I54 VanDerWaalsContact C-N 3.34Å; S52-I54 PolarHBondContact O-N 3.28Å; S52-F55 PolarHBondContact O-N 2.98Å; S52-I56 WeakPolarHBondContact O-CG1 3.36Å; S52-I56 PolarHBondContact O-N 3.25Å
53	G	97.9	Very high	96.9	Very high	11 Å²	11	53.3 Å²	53.3	11%	0.113	29%	0.286	C	S	.	.	H	α-helix	trans	-60.3	-42.1	175	0	0	0	0	0	112.6	Q49 I50 L51 I56 F57	Q49-G53 PolarHBondContact O-N 2.97Å; I50-G53 PolarHBondContact O-N 3.34Å; I50-G53 VanDerWaalsContact O-N 3.13Å; L51-G53 VanDerWaalsContact C-N 3.32Å; L51-G53 PolarHBondContact O-N 3.31Å; G53-I56 PolarHBondContact O-N 3.46Å; G53-F57 PolarHBondContact O-N 2.95Å
54	I	97.9	Very high	97.1	Very high	95 Å²	95	51.1 Å²	51.1	49%	0.487	28%	0.275	S	S	.	.	H	α-helix	trans	-63.2	-43.9	174.4	-63.4	167.3	0	0	0	110.7	I50 L51 S52 I56 F57 C58	I50-I54 HydrophobicContact CG2-CD1 4.3Å; I50-I54 WeakPolarHBondContact O-CG1 3.13Å; I50-I54 PolarHBondContact O-N 3.11Å; L51-I54 PolarHBondContact O-N 2.94Å; S52-I54 VanDerWaalsContact C-N 3.34Å; S52-I54 PolarHBondContact O-N 3.28Å; I54-I56 PolarHBondContact O-N 3.27Å; I54-F57 PolarHBondContact O-N 3.45Å; I54-C58 WeakPolarHBondContact O-CB 3.28Å; I54-C58 PolarHBondContact O-N 3.15Å; I54-C58 PolarHBondContact O-SG 2.99Å
55	F	97.7	Very high	97.1	Very high	102 Å²	102	48.6 Å²	48.6	45%	0.447	27%	0.266	S	S	.	.	H	α-helix	trans	-63.5	-39.7	176.3	-83.8	-66.6	0	0	0	112.8	L51 S52 G59 M492	L51-F55 HydrophobicContact CD1-CD2 4.06Å; L51-F55 HydrophobicContact CD1-CE2 3.65Å; L51-F55 HydrophobicContact CD2-CE2 4.06Å; L51-F55 HydrophobicContact CG-CD2 3.86Å; L51-F55 HydrophobicContact CG-CE2 3.61Å; L51-F55 VanDerWaalsContact O-CD2 3.23Å; L51-F55 WeakPolarHBondContact O-CD2 3.49Å; L51-F55 PolarHBondContact O-N 3.3Å; S52-F55 PolarHBondContact O-N 2.98Å; F55-G59 WeakPolarHBondContact O-CA 3.24Å; F55-G59 PolarHBondContact O-N 3.36Å; F55-M492 HydrophobicContact CB-CG 4.2Å; F55-M492 HydrophobicContact CB-SD 4.05Å
56	I	98.4	Very high	97.1	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-61.9	-49.1	175.6	-66.2	162.9	0	0	0	109.6	S52 G53 I54 N60 D88 A92 L96 M492	S52-I56 WeakPolarHBondContact O-CG1 3.36Å; S52-I56 PolarHBondContact O-N 3.25Å; G53-I56 PolarHBondContact O-N 3.46Å; I54-I56 PolarHBondContact O-N 3.27Å; I56-N60 WeakPolarHBondContact O-CB 3.49Å; I56-N60 PolarHBondContact O-N 3.48Å; I56-N60 VanDerWaalsContact O-N 3.1Å; I56-N60 PolarHBondContact O-ND2 3.34Å; I56-D88 WeakPolarHBondContact CG2-O 3.19Å; I56-A92 HydrophobicContact CB-CB 4.07Å; I56-A92 HydrophobicContact CG2-CB 3.75Å; I56-L96 HydrophobicContact CD1-CD1 3.64Å; I56-M492 HydrophobicContact CD1-CB 4.2Å; I56-M492 HydrophobicContact CG1-CB 3.54Å; I56-M492 HydrophobicContact CG1-CG 4.07Å
57	F	98.6	Very high	97.1	Very high	81 Å²	81	44.5 Å²	44.5	36%	0.355	25%	0.245	S	C	.	.	H	α-helix	trans	-59.5	-57.8	178.6	178.3	-94.7	0	0	0	111.6	G53 I54 G59 L61 L89 A92 V93	G53-F57 PolarHBondContact O-N 2.95Å; I54-F57 PolarHBondContact O-N 3.45Å; F57-G59 PolarHBondContact O-N 3.43Å; F57-L61 HydrophobicContact CE1-CD2 4.03Å; F57-L61 HydrophobicContact CZ-CD2 4.29Å; F57-L61 VanDerWaalsContact O-CB 3.23Å; F57-L61 WeakPolarHBondContact O-CB 3.36Å; F57-L61 PolarHBondContact O-N 3.42Å; F57-L89 HydrophobicContact CD2-CD2 4.41Å; F57-L89 HydrophobicContact CD2-CG 4.1Å; F57-L89 HydrophobicContact CE2-CD1 4.47Å; F57-L89 HydrophobicContact CE2-CD2 4.27Å; F57-L89 HydrophobicContact CE2-CG 4.3Å; F57-A92 HydrophobicContact CB-CB 4.05Å; F57-V93 HydrophobicContact CD2-CG2 3.8Å; F57-V93 HydrophobicContact CE2-CG2 3.89Å
58	C	98.1	Very high	97	Very high	67 Å²	67	44.1 Å²	44.1	45%	0.453	25%	0.246	S	C	.	.	H	α-helix	trans	-64.5	-42.1	-176.4	-70.8	0	0	0	0	112.2	I54 L62	I54-C58 WeakPolarHBondContact O-CB 3.28Å; I54-C58 PolarHBondContact O-N 3.15Å; I54-C58 PolarHBondContact O-SG 2.99Å; C58-L62 VanDerWaalsContact O-CB 3.24Å; C58-L62 WeakPolarHBondContact O-CB 3.32Å; C58-L62 PolarHBondContact O-N 3.46Å
59	G	97.7	Very high	96.8	Very high	14 Å²	14	42.7 Å²	42.7	14%	0.144	24%	0.242	C	C	.	.	H	α-helix	trans	-65	-43.5	-178.7	0	0	0	0	0	112.6	F55 F57 L62 A63 P495	F55-G59 WeakPolarHBondContact O-CA 3.24Å; F55-G59 PolarHBondContact O-N 3.36Å; F57-G59 PolarHBondContact O-N 3.43Å; G59-L62 PolarHBondContact O-N 3.14Å; G59-A63 PolarHBondContact O-N 3.06Å; G59-P495 WeakPolarHBondContact O-CG 3.44Å
60	N	98.2	Very high	96.6	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-75.3	-36	178.2	-72.5	-66.6	0	0	0	112.1	I56 L62 A63 I64 A85 L89 S491	I56-N60 WeakPolarHBondContact O-CB 3.49Å; I56-N60 PolarHBondContact O-N 3.48Å; I56-N60 VanDerWaalsContact O-N 3.1Å; I56-N60 PolarHBondContact O-ND2 3.34Å; N60-L62 VanDerWaalsContact C-N 3.27Å; N60-L62 PolarHBondContact O-N 3.09Å; N60-A63 WeakPolarHBondContact O-CB 3.26Å; N60-A63 PolarHBondContact O-N 2.98Å; N60-I64 WeakPolarHBondContact O-CG1 3.44Å; N60-I64 PolarHBondContact O-N 2.93Å; N60-A85 HydrophobicContact CB-CB 4.16Å; N60-A85 WeakPolarHBondContact CB-O 3.45Å; N60-L89 HydrophobicContact CB-CB 4.09Å; N60-S491 PolarHBondContact ND2-O 2.89Å
61	L	98.1	Very high	96.1	Very high	73 Å²	73	48.4 Å²	48.4	38%	0.382	27%	0.267	S	S	.	.	H	α-helix	trans	-59.5	-41.2	170.5	-177.2	62.4	0	0	0	111.3	F57 I64 S65 L89	F57-L61 HydrophobicContact CE1-CD2 4.03Å; F57-L61 HydrophobicContact CZ-CD2 4.29Å; F57-L61 VanDerWaalsContact O-CB 3.23Å; F57-L61 WeakPolarHBondContact O-CB 3.36Å; F57-L61 PolarHBondContact O-N 3.42Å; L61-I64 PolarHBondContact O-N 3.41Å; L61-S65 VanDerWaalsContact O-CB 3.27Å; L61-S65 WeakPolarHBondContact O-CB 3.43Å; L61-S65 PolarHBondContact O-N 2.86Å; L61-S65 PolarHBondContact O-OG 3.49Å; L61-L89 HydrophobicContact CB-CD1 3.94Å; L61-L89 HydrophobicContact CD1-CD1 4.19Å
62	L	96.8	Very high	95.5	Very high	37 Å²	37	46.8 Å²	46.8	19%	0.194	27%	0.27	C	S	.	.	H	α-helix	trans	-63.9	-42.6	175.2	-175.1	71.1	0	0	0	111.6	C58 G59 N60 I64 S65 V66 F509 L512 L513	C58-L62 VanDerWaalsContact O-CB 3.24Å; C58-L62 WeakPolarHBondContact O-CB 3.32Å; C58-L62 PolarHBondContact O-N 3.46Å; G59-L62 PolarHBondContact O-N 3.14Å; N60-L62 VanDerWaalsContact C-N 3.27Å; N60-L62 PolarHBondContact O-N 3.09Å; L62-I64 VanDerWaalsContact C-N 3.34Å; L62-I64 PolarHBondContact O-N 3.44Å; L62-S65 PolarHBondContact O-N 3.36Å; L62-V66 WeakPolarHBondContact O-CB 3.41Å; L62-V66 PolarHBondContact O-N 3.49Å; L62-F509 HydrophobicContact CB-CE1 4.39Å; L62-F509 HydrophobicContact CD1-CD1 4.27Å; L62-F509 HydrophobicContact CD2-CB 4.28Å; L62-F509 HydrophobicContact CD2-CD1 3.47Å; L62-F509 VanDerWaalsContact CD2-CD1 3.47Å; L62-F509 HydrophobicContact CD2-CD2 4.38Å; L62-F509 HydrophobicContact CD2-CE1 3.82Å; L62-F509 HydrophobicContact CD2-CG 3.82Å; L62-F509 HydrophobicContact CD2-CZ 4.38Å; L62-F509 HydrophobicContact CG-CD1 3.5Å; L62-F509 HydrophobicContact CG-CE1 3.63Å; L62-F509 HydrophobicContact CG-CG 4.36Å; L62-L512 HydrophobicContact CD1-CD2 3.7Å; L62-L512 HydrophobicContact CD1-CG 4.32Å; L62-L513 HydrophobicContact CD1-CD2 4.05Å; L62-L513 HydrophobicContact CD1-CG 4.21Å; L62-L513 HydrophobicContact CD2-CD1 4.01Å; L62-L513 HydrophobicContact CD2-CG 4.44Å
63	A	96.4	Very high	94.9	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.008	27%	0.268	C	S	.	.	H	α-helix	trans	-58.4	-45.1	175.9	0	0	0	0	0	111.8	G59 N60 V67 A85 F509	G59-A63 PolarHBondContact O-N 3.06Å; N60-A63 WeakPolarHBondContact O-CB 3.26Å; N60-A63 PolarHBondContact O-N 2.98Å; A63-V67 PolarHBondContact O-N 2.78Å; A63-A85 HydrophobicContact CB-CB 4.15Å; A63-F509 HydrophobicContact CB-CZ 4.42Å
64	I	97.7	Very high	94.4	Very high	38 Å²	38	51.4 Å²	51.4	20%	0.195	28%	0.283	C	S	.	.	H	α-helix	trans	-63.9	-49.8	175.4	-63.7	168.6	0	0	0	110.6	N60 L61 L62 V66 V67 A68 V82 A85 L86 L89	N60-I64 WeakPolarHBondContact O-CG1 3.44Å; N60-I64 PolarHBondContact O-N 2.93Å; L61-I64 PolarHBondContact O-N 3.41Å; L62-I64 VanDerWaalsContact C-N 3.34Å; L62-I64 PolarHBondContact O-N 3.44Å; I64-V66 VanDerWaalsContact C-N 3.32Å; I64-V66 PolarHBondContact O-N 3.23Å; I64-V67 PolarHBondContact O-N 3.07Å; I64-A68 WeakPolarHBondContact O-CB 3.49Å; I64-A68 PolarHBondContact O-N 3.4Å; I64-V82 HydrophobicContact CG1-CG1 4.33Å; I64-V82 HydrophobicContact CG2-CG1 4.37Å; I64-A85 HydrophobicContact CD1-CB 4.24Å; I64-A85 HydrophobicContact CG1-CB 3.8Å; I64-L86 HydrophobicContact CD1-CB 4.43Å; I64-L89 HydrophobicContact CD1-CD1 4.26Å
65	S	96.1	Very high	93.9	Very high	40 Å²	40	52.9 Å²	52.9	28%	0.28	28%	0.282	S	S	.	.	H	α-helix	trans	-61.2	-39.2	-176.4	-61.5	0	0	0	0	112.3	L61 L62 A68 T69	L61-S65 VanDerWaalsContact O-CB 3.27Å; L61-S65 WeakPolarHBondContact O-CB 3.43Å; L61-S65 PolarHBondContact O-N 2.86Å; L61-S65 PolarHBondContact O-OG 3.49Å; L62-S65 PolarHBondContact O-N 3.36Å; S65-A68 PolarHBondContact O-N 2.83Å; S65-T69 WeakPolarHBondContact O-CB 3.33Å; S65-T69 VanDerWaalsContact O-CG2 3.28Å; S65-T69 WeakPolarHBondContact O-CG2 3.4Å; S65-T69 PolarHBondContact O-N 3.21Å; S65-T69 PolarHBondContact O-OG1 2.94Å
66	V	94.9	Very high	93.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.3	-42.3	177.6	153.5	0	0	0	0	112.2	L62 I64 A68 T69 T70 L73 Y505 A508 F509 L512	L62-V66 WeakPolarHBondContact O-CB 3.41Å; L62-V66 PolarHBondContact O-N 3.49Å; I64-V66 VanDerWaalsContact C-N 3.32Å; I64-V66 PolarHBondContact O-N 3.23Å; V66-A68 VanDerWaalsContact C-N 3.33Å; V66-T69 PolarHBondContact O-N 3.08Å; V66-T69 PolarHBondContact O-OG1 3.03Å; V66-T70 WeakPolarHBondContact O-CB 3.38Å; V66-T70 PolarHBondContact O-N 3.04Å; V66-T70 PolarHBondContact O-OG1 3.44Å; V66-L73 HydrophobicContact CG1-CD1 3.29Å; V66-Y505 HydrophobicContact CG1-CD1 4.47Å; V66-A508 HydrophobicContact CB-CB 4.46Å; V66-A508 HydrophobicContact CG1-CB 3.41Å; V66-A508 VanDerWaalsContact CG1-CB 3.41Å; V66-A508 HydrophobicContact CG2-CB 4.21Å; V66-F509 HydrophobicContact CB-CD1 4.15Å; V66-F509 HydrophobicContact CB-CE1 4.03Å; V66-F509 HydrophobicContact CG1-CE1 4.43Å; V66-F509 HydrophobicContact CG2-CD1 3.42Å; V66-F509 VanDerWaalsContact CG2-CD1 3.42Å; V66-F509 HydrophobicContact CG2-CE1 3.78Å; V66-L512 HydrophobicContact CG2-CB 4.17Å; V66-L512 HydrophobicContact CG2-CD2 3.62Å
67	V	94.7	Very high	93.1	Very high	8 Å²	8	50 Å²	50	5%	0.048	27%	0.272	C	S	.	.	H	α-helix	trans	-66.4	-40.8	176	172.1	0	0	0	0	110.3	A63 I64 T69 L73 R74 D78 V82 Y505	A63-V67 PolarHBondContact O-N 2.78Å; I64-V67 PolarHBondContact O-N 3.07Å; V67-T69 PolarHBondContact O-N 3.42Å; V67-L73 WeakPolarHBondContact CG1-O 3.1Å; V67-R74 VanDerWaalsContact O-CG 3.27Å; V67-R74 WeakPolarHBondContact O-CG 3.28Å; V67-D78 HydrophobicContact CG1-CB 4.08Å; V67-D78 HydrophobicContact CG2-CB 4.1Å; V67-V82 HydrophobicContact CB-CG2 3.62Å; V67-V82 HydrophobicContact CG1-CG2 3.53Å; V67-V82 HydrophobicContact CG2-CG2 3.9Å; V67-Y505 HydrophobicContact CG2-CE1 4.04Å; V67-Y505 VanDerWaalsContact CG2-OH 3.3Å; V67-Y505 WeakPolarHBondContact CG2-OH 3.44Å
68	A	93.4	Very high	92.9	Very high	58 Å²	58	46.6 Å²	46.6	48%	0.479	26%	0.257	S	S	.	.	H	α-helix	trans	-63.1	-40.4	177	0	0	0	0	0	112.3	I64 S65 V66 R74	I64-A68 WeakPolarHBondContact O-CB 3.49Å; I64-A68 PolarHBondContact O-N 3.4Å; S65-A68 PolarHBondContact O-N 2.83Å; V66-A68 VanDerWaalsContact C-N 3.33Å; A68-R74 VanDerWaalsContact O-CZ 3.26Å; A68-R74 PolarHBondContact O-NE 3.47Å; A68-R74 PolarHBondContact O-NH2 3.03Å
69	T	92.3	Very high	92.8	Very high	78 Å²	78	45 Å²	45	48%	0.479	24%	0.244	S	C	.	.	H	α-helix	trans	-89.8	-31.9	-174.5	54.2	0	0	0	0	113.7	S65 V66 V67	S65-T69 WeakPolarHBondContact O-CB 3.33Å; S65-T69 VanDerWaalsContact O-CG2 3.28Å; S65-T69 WeakPolarHBondContact O-CG2 3.4Å; S65-T69 PolarHBondContact O-N 3.21Å; S65-T69 PolarHBondContact O-OG1 2.94Å; V66-T69 PolarHBondContact O-N 3.08Å; V66-T69 PolarHBondContact O-OG1 3.03Å; V67-T69 PolarHBondContact O-N 3.42Å
70	T	92.8	Very high	92.7	Very high	38 Å²	38	44.3 Å²	44.3	23%	0.233	24%	0.237	C	C	.	.			trans	-95.8	105.9	-172	-58.1	0	0	0	0	112.1	V66 G72 L73 A508	V66-T70 WeakPolarHBondContact O-CB 3.38Å; V66-T70 PolarHBondContact O-N 3.04Å; V66-T70 PolarHBondContact O-OG1 3.44Å; T70-G72 PolarHBondContact O-N 3.46Å; T70-L73 HydrophobicContact CG2-CB 4.34Å; T70-L73 HydrophobicContact CG2-CD1 4.1Å; T70-L73 HydrophobicContact CG2-CG 4.03Å; T70-L73 PolarHBondContact O-N 3.42Å; T70-A508 HydrophobicContact CG2-CB 4.44Å
71	K	86.3	Confident	92.6	Very high	179 Å²	179	44.7 Å²	44.7	78%	0.778	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-50	-37.7	179	-67.9	-177.8	-178.4	176.9	0	113.6	L73 R74	K71-L73 PolarHBondContact O-N 3.28Å; K71-R74 PolarHBondContact O-N 3.42Å
72	G	84.1	Confident	92.6	Very high	49 Å²	49	43 Å²	43	51%	0.505	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-68.6	-15.3	-179.8	0	0	0	0	0	115.8	T70 R75	T70-G72 PolarHBondContact O-N 3.46Å; G72-R75 PolarHBondContact O-NE 2.96Å
73	L	84.3	Confident	92.6	Very high	5 Å²	5	41.7 Å²	41.7	3%	0.026	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-109.1	13.1	179.7	-66.8	176.7	0	0	0	112.7	V66 V67 T70 K71 R75 D78 K504 Y505 A508	V66-L73 HydrophobicContact CG1-CD1 3.29Å; V67-L73 WeakPolarHBondContact CG1-O 3.1Å; T70-L73 HydrophobicContact CG2-CB 4.34Å; T70-L73 HydrophobicContact CG2-CD1 4.1Å; T70-L73 HydrophobicContact CG2-CG 4.03Å; T70-L73 PolarHBondContact O-N 3.42Å; K71-L73 PolarHBondContact O-N 3.28Å; L73-R75 PolarHBondContact O-N 3.42Å; L73-D78 VanDerWaalsContact C-OD2 3.31Å; L73-D78 WeakPolarHBondContact O-CB 3.49Å; L73-K504 HydrophobicContact CD2-CB 3.87Å; L73-Y505 HydrophobicContact CD1-CD2 4.4Å; L73-Y505 HydrophobicContact CD1-CE2 4.48Å; L73-Y505 HydrophobicContact CD2-CD2 3.97Å; L73-Y505 HydrophobicContact CD2-CE2 3.8Å; L73-A508 HydrophobicContact CD1-CB 3.6Å
74	R	87.4	Confident	92.7	Very high	114 Å²	114	41.7 Å²	41.7	43%	0.43	23%	0.225	S	C	.	.			trans	-90.6	37	174.6	-63.1	-178.2	-174.5	174.1	2.2	112.2	V67 A68 K71 R157	V67-R74 VanDerWaalsContact O-CG 3.27Å; V67-R74 WeakPolarHBondContact O-CG 3.28Å; A68-R74 VanDerWaalsContact O-CZ 3.26Å; A68-R74 PolarHBondContact O-NE 3.47Å; A68-R74 PolarHBondContact O-NH2 3.03Å; K71-R74 PolarHBondContact O-N 3.42Å; R74-R157 PolarHBondContact O-NH2 3.4Å
75	R	88	Confident	92.7	Very high	126 Å²	126	39.9 Å²	39.9	48%	0.475	22%	0.216	S	C	.	.	S	Bend	trans	-82.4	168.5	178.5	-49.7	174.7	179.4	-149.3	-11.8	109.6	G72 L73 T77 D78 L79 K504	G72-R75 PolarHBondContact O-NE 2.96Å; L73-R75 PolarHBondContact O-N 3.42Å; R75-T77 VanDerWaalsContact C-N 3.34Å; R75-T77 PolarHBondContact O-N 2.89Å; R75-D78 WeakPolarHBondContact CB-OD2 3.35Å; R75-D78 WeakPolarHBondContact CG-OD2 3.43Å; R75-D78 PolarHBondContact N-OD2 3.24Å; R75-D78 PolarHBondContact O-N 2.99Å; R75-L79 PolarHBondContact O-N 2.88Å; R75-K504 VanDerWaalsContact NH1-NZ 3.14Å
76	I	89.6	Confident	92.9	Very high	30 Å²	30	41.5 Å²	41.5	15%	0.154	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-43.9	-178.2	-57.2	177.8	0	0	0	111	D78 L79 Y80 Q155 A160	I76-D78 PolarHBondContact O-N 2.8Å; I76-L79 WeakPolarHBondContact O-CB 3.31Å; I76-L79 PolarHBondContact O-N 3.24Å; I76-L79 VanDerWaalsContact O-N 3.09Å; I76-Y80 HydrophobicContact CG2-CE2 4.17Å; I76-Q155 HydrophobicContact CB-CG 4.48Å; I76-Q155 HydrophobicContact CD1-CB 4.04Å; I76-Q155 HydrophobicContact CD1-CG 3.64Å; I76-Q155 WeakPolarHBondContact CD1-O 3.07Å; I76-Q155 HydrophobicContact CG2-CG 3.95Å; I76-A160 HydrophobicContact CG2-CB 3.62Å
77	T	90.8	Very high	93	Very high	13 Å²	13	41.5 Å²	41.5	8%	0.08	22%	0.221	C	C	.	.	H	α-helix	trans	-57.8	-36.9	177.7	-49	0	0	0	0	113	R75 L79 Y80 I81 D140 R141	R75-T77 VanDerWaalsContact C-N 3.34Å; R75-T77 PolarHBondContact O-N 2.89Å; T77-L79 PolarHBondContact O-N 2.78Å; T77-Y80 PolarHBondContact O-N 2.93Å; T77-I81 PolarHBondContact O-N 3.47Å; T77-D140 PolarHBondContact OG1-OD2 3.33Å; T77-R141 VanDerWaalsContact OG1-CZ 3.28Å; T77-R141 PolarHBondContact OG1-NH2 3.2Å
78	D	93.1	Very high	93.2	Very high	10 Å²	10	41.1 Å²	41.1	5%	0.053	22%	0.219	C	C	.	.	H	α-helix	trans	-69.5	-23.8	-178.5	-58.1	-58.9	0	0	0	111.8	V67 L73 R75 I76 I81 V82 Y505	V67-D78 HydrophobicContact CG1-CB 4.08Å; V67-D78 HydrophobicContact CG2-CB 4.1Å; L73-D78 VanDerWaalsContact C-OD2 3.31Å; L73-D78 WeakPolarHBondContact O-CB 3.49Å; R75-D78 WeakPolarHBondContact CB-OD2 3.35Å; R75-D78 WeakPolarHBondContact CG-OD2 3.43Å; R75-D78 PolarHBondContact N-OD2 3.24Å; R75-D78 PolarHBondContact O-N 2.99Å; I76-D78 PolarHBondContact O-N 2.8Å; D78-I81 PolarHBondContact O-N 3.44Å; D78-V82 WeakPolarHBondContact O-CG2 3.36Å; D78-V82 PolarHBondContact O-N 3.04Å; D78-Y505 VanDerWaalsContact OD1-CE2 3.31Å; D78-Y505 WeakPolarHBondContact OD1-CE2 3.26Å; D78-Y505 PolarHBondContact OD1-OH 3.29Å
79	L	95.6	Very high	93.4	Very high	32 Å²	32	39.3 Å²	39.3	17%	0.168	20%	0.201	C	C	.	.	H	α-helix	trans	-64.5	-39.8	173.2	-60.6	177	0	0	0	112.1	R75 I76 T77 I81 V82 S83 R157 A160 F161 I164	R75-L79 PolarHBondContact O-N 2.88Å; I76-L79 WeakPolarHBondContact O-CB 3.31Å; I76-L79 PolarHBondContact O-N 3.24Å; I76-L79 VanDerWaalsContact O-N 3.09Å; T77-L79 PolarHBondContact O-N 2.78Å; L79-I81 VanDerWaalsContact C-N 3.33Å; L79-V82 PolarHBondContact O-N 3.32Å; L79-S83 PolarHBondContact O-N 3.29Å; L79-R157 HydrophobicContact CD1-CB 4.45Å; L79-R157 HydrophobicContact CD1-CG 4.17Å; L79-A160 HydrophobicContact CD1-CB 4.26Å; L79-F161 HydrophobicContact CD1-CE2 4.4Å; L79-F161 HydrophobicContact CD1-CZ 4.38Å; L79-I164 HydrophobicContact CB-CD1 4.22Å
80	Y	96.4	Very high	93.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-68.1	-35.6	175.6	-57.3	-70.4	0	0	0	111.6	I76 T77 S83 L84 C136 I137 D140 Q155 A160 M163 I164	I76-Y80 HydrophobicContact CG2-CE2 4.17Å; T77-Y80 PolarHBondContact O-N 2.93Å; Y80-S83 PolarHBondContact O-N 3.43Å; Y80-L84 PolarHBondContact O-N 3.14Å; Y80-C136 HydrophobicContact CD1-CB 3.59Å; Y80-C136 HydrophobicContact CE1-CB 3.79Å; Y80-C136 HydrophobicContact CG-CB 4.39Å; Y80-I137 VanDerWaalsContact CB-CG1 3.46Å; Y80-I137 HydrophobicContact CG-CG1 4.37Å; Y80-D140 HydrophobicContact CD2-CB 4.15Å; Y80-D140 HydrophobicContact CE2-CB 3.65Å; Y80-Q155 PolarHBondContact OH-NE2 3.4Å; Y80-A160 HydrophobicContact CE1-CB 4.12Å; Y80-A160 HydrophobicContact CE2-CB 4.22Å; Y80-A160 WeakPolarHBondContact OH-CA 3.45Å; Y80-M163 HydrophobicContact CE1-CB 4.03Å; Y80-M163 HydrophobicContact CE1-CE 4.31Å; Y80-M163 HydrophobicContact CE1-SD 4.36Å; Y80-M163 PolarHBondContact OH-SD 3.06Å; Y80-I164 HydrophobicContact CD1-CD1 3.9Å; Y80-I164 HydrophobicContact CD1-CG1 3.64Å; Y80-I164 HydrophobicContact CE1-CD1 4.33Å; Y80-I164 HydrophobicContact CE1-CG1 4Å
81	I	95.8	Very high	94	Very high	9 Å²	9	36.3 Å²	36.3	5%	0.046	18%	0.181	C	C	.	.	H	α-helix	trans	-64.7	-42	174.8	-65.2	172.5	0	0	0	110.6	T77 D78 L79 S83 L84 A85 I137 Y498 Y505	T77-I81 PolarHBondContact O-N 3.47Å; D78-I81 PolarHBondContact O-N 3.44Å; L79-I81 VanDerWaalsContact C-N 3.33Å; I81-S83 VanDerWaalsContact C-N 3.35Å; I81-L84 PolarHBondContact O-N 2.91Å; I81-A85 WeakPolarHBondContact O-CB 3.4Å; I81-A85 PolarHBondContact O-N 3.49Å; I81-I137 HydrophobicContact CG1-CD1 4.4Å; I81-Y498 HydrophobicContact CD1-CE1 4.3Å; I81-Y498 HydrophobicContact CG2-CD2 4.36Å; I81-Y498 HydrophobicContact CG2-CE1 4.42Å; I81-Y498 HydrophobicContact CG2-CE2 3.66Å; I81-Y505 HydrophobicContact CD1-CE2 4.3Å; I81-Y505 WeakPolarHBondContact CD1-OH 3.29Å; I81-Y505 HydrophobicContact CG2-CE1 4.31Å
82	V	97.4	Very high	94.6	Very high	39 Å²	39	28.4 Å²	28.4	24%	0.236	15%	0.148	C	C	.	.	H	α-helix	trans	-61	-43.6	174.1	168.1	0	0	0	0	111.4	I64 V67 D78 L79 A85 L86	I64-V82 HydrophobicContact CG1-CG1 4.33Å; I64-V82 HydrophobicContact CG2-CG1 4.37Å; V67-V82 HydrophobicContact CB-CG2 3.62Å; V67-V82 HydrophobicContact CG1-CG2 3.53Å; V67-V82 HydrophobicContact CG2-CG2 3.9Å; D78-V82 WeakPolarHBondContact O-CG2 3.36Å; D78-V82 PolarHBondContact O-N 3.04Å; L79-V82 PolarHBondContact O-N 3.32Å; V82-A85 PolarHBondContact O-N 3.29Å; V82-L86 WeakPolarHBondContact O-CB 3.47Å; V82-L86 PolarHBondContact O-N 2.94Å
83	S	98.1	Very high	95.3	Very high	8 Å²	8	29.4 Å²	29.4	6%	0.056	15%	0.145	C	C	.	.	H	α-helix	trans	-62.8	-42.2	177.5	-176.3	0	0	0	0	112.3	L79 Y80 I81 L86 A87 N133 I164 W168	L79-S83 PolarHBondContact O-N 3.29Å; Y80-S83 PolarHBondContact O-N 3.43Å; I81-S83 VanDerWaalsContact C-N 3.35Å; S83-L86 PolarHBondContact O-N 3.42Å; S83-A87 PolarHBondContact O-N 3.16Å; S83-N133 WeakPolarHBondContact CB-OD1 3.28Å; S83-N133 VanDerWaalsContact OG-CG 3.27Å; S83-N133 PolarHBondContact OG-ND2 3.12Å; S83-N133 PolarHBondContact OG-OD1 2.83Å; S83-I164 WeakPolarHBondContact OG-CG2 3.41Å; S83-W168 PolarHBondContact OG-NE1 2.83Å
84	L	98.1	Very high	95.9	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-62	-47.3	173.1	178.4	59.1	0	0	0	111.8	Y80 I81 L86 A87 D88 S130 N133 I134 I137 V450	Y80-L84 PolarHBondContact O-N 3.14Å; I81-L84 PolarHBondContact O-N 2.91Å; L84-L86 VanDerWaalsContact C-N 3.26Å; L84-L86 PolarHBondContact O-N 3.07Å; L84-A87 PolarHBondContact O-N 3.17Å; L84-A87 VanDerWaalsContact O-N 3.16Å; L84-D88 PolarHBondContact O-N 2.98Å; L84-S130 WeakPolarHBondContact CD1-O 2.97Å; L84-N133 HydrophobicContact CB-CB 4.1Å; L84-N133 HydrophobicContact CD1-CB 4.35Å; L84-I134 HydrophobicContact CD1-CG1 4.25Å; L84-I134 HydrophobicContact CD2-CG1 4.04Å; L84-I137 HydrophobicContact CD2-CD1 3.99Å; L84-V450 HydrophobicContact CD2-CG1 4.23Å
85	A	98.4	Very high	96.4	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.008	14%	0.139	C	C	.	.	H	α-helix	trans	-62.6	-32.9	178.2	0	0	0	0	0	112.3	N60 A63 I64 I81 V82 L89	N60-A85 HydrophobicContact CB-CB 4.16Å; N60-A85 WeakPolarHBondContact CB-O 3.45Å; A63-A85 HydrophobicContact CB-CB 4.15Å; I64-A85 HydrophobicContact CD1-CB 4.24Å; I64-A85 HydrophobicContact CG1-CB 3.8Å; I81-A85 WeakPolarHBondContact O-CB 3.4Å; I81-A85 PolarHBondContact O-N 3.49Å; V82-A85 PolarHBondContact O-N 3.29Å; A85-L89 VanDerWaalsContact O-CB 3.22Å; A85-L89 WeakPolarHBondContact O-CB 3.27Å; A85-L89 PolarHBondContact O-N 3.18Å
86	L	98.5	Very high	96.9	Very high	73 Å²	73	20.8 Å²	20.8	38%	0.382	12%	0.116	S	C	.	.	H	α-helix	trans	-65.3	-44.3	174.1	179.6	62.1	0	0	0	111.6	I64 V82 S83 L84 L89 L90 W168	I64-L86 HydrophobicContact CD1-CB 4.43Å; V82-L86 WeakPolarHBondContact O-CB 3.47Å; V82-L86 PolarHBondContact O-N 2.94Å; S83-L86 PolarHBondContact O-N 3.42Å; L84-L86 VanDerWaalsContact C-N 3.26Å; L84-L86 PolarHBondContact O-N 3.07Å; L86-L89 PolarHBondContact O-N 2.69Å; L86-L90 HydrophobicContact CD1-CD1 4.41Å; L86-L90 HydrophobicContact CD1-CG 4.38Å; L86-L90 HydrophobicContact CG-CD1 4.3Å; L86-L90 VanDerWaalsContact O-CG 3.28Å; L86-L90 WeakPolarHBondContact O-CG 3.4Å; L86-L90 PolarHBondContact O-N 3.39Å; L86-W168 HydrophobicContact CB-CZ2 4.48Å; L86-W168 HydrophobicContact CD2-CZ2 4.19Å; L86-W168 HydrophobicContact CG-CH2 4.49Å; L86-W168 HydrophobicContact CG-CZ2 4.33Å
87	A	98.5	Very high	97.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.4	-46.9	175.4	0	0	0	0	0	111.3	S83 L84 L89 L90 V91 A129 S130 W168	S83-A87 PolarHBondContact O-N 3.16Å; L84-A87 PolarHBondContact O-N 3.17Å; L84-A87 VanDerWaalsContact O-N 3.16Å; A87-L89 PolarHBondContact O-N 3.29Å; A87-L90 PolarHBondContact O-N 3.12Å; A87-V91 WeakPolarHBondContact O-CG2 3.21Å; A87-V91 PolarHBondContact O-N 3.36Å; A87-A129 HydrophobicContact CB-CB 4.08Å; A87-S130 WeakPolarHBondContact CB-OG 3.27Å; A87-W168 HydrophobicContact CB-CH2 3.85Å; A87-W168 HydrophobicContact CB-CZ2 4.17Å
88	D	98.5	Very high	97.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-65.2	-36.2	178.6	-71.8	-26.4	0	0	0	113	I56 L84 V91 A92 S130 S491 N494	I56-D88 WeakPolarHBondContact CG2-O 3.19Å; L84-D88 PolarHBondContact O-N 2.98Å; D88-V91 WeakPolarHBondContact O-CB 3.27Å; D88-V91 PolarHBondContact O-N 3.15Å; D88-A92 PolarHBondContact O-N 2.95Å; D88-S130 PolarHBondContact OD1-OG 3.15Å; D88-S491 WeakPolarHBondContact OD1-CB 3.42Å; D88-S491 PolarHBondContact OD1-OG 3.45Å; D88-N494 PolarHBondContact OD2-ND2 3.4Å
89	L	98.5	Very high	97.6	Very high	21 Å²	21	23.9 Å²	23.9	11%	0.11	13%	0.134	C	C	.	.	H	α-helix	trans	-65.2	-43	173.2	-176.7	153.4	0	0	0	111.1	F57 N60 L61 I64 A85 L86 A87 V91 A92 V93	F57-L89 HydrophobicContact CD2-CD2 4.41Å; F57-L89 HydrophobicContact CD2-CG 4.1Å; F57-L89 HydrophobicContact CE2-CD1 4.47Å; F57-L89 HydrophobicContact CE2-CD2 4.27Å; F57-L89 HydrophobicContact CE2-CG 4.3Å; N60-L89 HydrophobicContact CB-CB 4.09Å; L61-L89 HydrophobicContact CB-CD1 3.94Å; L61-L89 HydrophobicContact CD1-CD1 4.19Å; I64-L89 HydrophobicContact CD1-CD1 4.26Å; A85-L89 VanDerWaalsContact O-CB 3.22Å; A85-L89 WeakPolarHBondContact O-CB 3.27Å; A85-L89 PolarHBondContact O-N 3.18Å; L86-L89 PolarHBondContact O-N 2.69Å; A87-L89 PolarHBondContact O-N 3.29Å; L89-V91 VanDerWaalsContact C-N 3.28Å; L89-V91 PolarHBondContact O-N 3.2Å; L89-A92 WeakPolarHBondContact O-CB 3.32Å; L89-A92 PolarHBondContact O-N 3.45Å; L89-A92 VanDerWaalsContact O-N 3.14Å; L89-V93 HydrophobicContact CD2-CG2 4.08Å; L89-V93 WeakPolarHBondContact O-CG2 3.33Å; L89-V93 PolarHBondContact O-N 3.09Å; L89-V93 VanDerWaalsContact O-N 3.16Å
90	L	98.5	Very high	97.6	Very high	46 Å²	46	23.3 Å²	23.3	24%	0.241	13%	0.131	C	C	.	.	H	α-helix	trans	-65.5	-30.7	177	-70.6	173.4	0	0	0	112.1	L86 A87 A92 V93 L94 L126 W168	L86-L90 HydrophobicContact CD1-CD1 4.41Å; L86-L90 HydrophobicContact CD1-CG 4.38Å; L86-L90 HydrophobicContact CG-CD1 4.3Å; L86-L90 VanDerWaalsContact O-CG 3.28Å; L86-L90 WeakPolarHBondContact O-CG 3.4Å; L86-L90 PolarHBondContact O-N 3.39Å; A87-L90 PolarHBondContact O-N 3.12Å; L90-A92 VanDerWaalsContact C-N 3.33Å; L90-A92 PolarHBondContact O-N 3.37Å; L90-V93 PolarHBondContact O-N 3.42Å; L90-L94 HydrophobicContact CB-CD1 4.37Å; L90-L94 HydrophobicContact CD2-CD1 4.17Å; L90-L94 VanDerWaalsContact O-CB 3.31Å; L90-L94 WeakPolarHBondContact O-CB 3.48Å; L90-L94 PolarHBondContact O-N 2.74Å; L90-L126 HydrophobicContact CB-CD1 3.92Å; L90-L126 HydrophobicContact CB-CD2 3.62Å; L90-L126 HydrophobicContact CB-CG 4.45Å; L90-L126 HydrophobicContact CD1-CD2 3.92Å; L90-L126 HydrophobicContact CG-CD2 4.45Å; L90-W168 HydrophobicContact CD1-CH2 4.21Å
91	V	98.5	Very high	97.5	Very high	7 Å²	7	26.3 Å²	26.3	4%	0.042	15%	0.145	C	C	.	.	I	π-helix	trans	-59.3	-45.9	170.7	170.1	0	0	0	0	110.3	A87 D88 L89 V93 I95 L96 L126 Y488	A87-V91 WeakPolarHBondContact O-CG2 3.21Å; A87-V91 PolarHBondContact O-N 3.36Å; D88-V91 WeakPolarHBondContact O-CB 3.27Å; D88-V91 PolarHBondContact O-N 3.15Å; L89-V91 VanDerWaalsContact C-N 3.28Å; L89-V91 PolarHBondContact O-N 3.2Å; V91-V93 VanDerWaalsContact C-N 3.3Å; V91-V93 PolarHBondContact O-N 3.23Å; V91-I95 HydrophobicContact CG1-CB 4.27Å; V91-I95 WeakPolarHBondContact O-CA 3.38Å; V91-I95 WeakPolarHBondContact O-CB 3.28Å; V91-I95 PolarHBondContact O-N 2.99Å; V91-L96 HydrophobicContact CG1-CD2 4.39Å; V91-L96 HydrophobicContact CG1-CG 4.26Å; V91-L96 PolarHBondContact O-N 3.14Å; V91-L126 HydrophobicContact CG2-CB 3.77Å; V91-L126 HydrophobicContact CG2-CD1 4.03Å; V91-L126 HydrophobicContact CG2-CG 4.48Å; V91-Y488 HydrophobicContact CG1-CD1 3.74Å; V91-Y488 HydrophobicContact CG1-CE1 4.22Å
92	A	98.4	Very high	97.4	Very high	12 Å²	12	28.2 Å²	28.2	10%	0.099	15%	0.152	C	C	.	.	I	π-helix	trans	-64.3	-33.6	178.8	0	0	0	0	0	113.6	I56 F57 D88 L89 L90 L96 P97	I56-A92 HydrophobicContact CB-CB 4.07Å; I56-A92 HydrophobicContact CG2-CB 3.75Å; F57-A92 HydrophobicContact CB-CB 4.05Å; D88-A92 PolarHBondContact O-N 2.95Å; L89-A92 WeakPolarHBondContact O-CB 3.32Å; L89-A92 PolarHBondContact O-N 3.45Å; L89-A92 VanDerWaalsContact O-N 3.14Å; L90-A92 VanDerWaalsContact C-N 3.33Å; L90-A92 PolarHBondContact O-N 3.37Å; A92-L96 HydrophobicContact CB-CD1 4.23Å; A92-P97 WeakPolarHBondContact O-CD 3.44Å
93	V	98.2	Very high	97.2	Very high	71 Å²	71	27.9 Å²	27.9	43%	0.43	15%	0.148	S	C	.	.	I	π-helix	trans	-83.5	-43.4	-178.5	177.2	0	0	0	0	112.2	F57 L89 L90 V91	F57-V93 HydrophobicContact CD2-CG2 3.8Å; F57-V93 HydrophobicContact CE2-CG2 3.89Å; L89-V93 HydrophobicContact CD2-CG2 4.08Å; L89-V93 WeakPolarHBondContact O-CG2 3.33Å; L89-V93 PolarHBondContact O-N 3.09Å; L89-V93 VanDerWaalsContact O-N 3.16Å; L90-V93 PolarHBondContact O-N 3.42Å; V91-V93 VanDerWaalsContact C-N 3.3Å; V91-V93 PolarHBondContact O-N 3.23Å
94	L	97.6	Very high	96.9	Very high	61 Å²	61	31.1 Å²	31.1	32%	0.319	17%	0.167	S	C	.	.	I	π-helix	trans	-102.6	-27.3	-167.4	-58.6	177	0	0	0	113.7	L90 H98 L122	L90-L94 HydrophobicContact CB-CD1 4.37Å; L90-L94 HydrophobicContact CD2-CD1 4.17Å; L90-L94 VanDerWaalsContact O-CB 3.31Å; L90-L94 WeakPolarHBondContact O-CB 3.48Å; L90-L94 PolarHBondContact O-N 2.74Å; L94-H98 PolarHBondContact O-CD2 2.93Å; L94-L122 HydrophobicContact CB-CD1 4.4Å; L94-L122 HydrophobicContact CD1-CD1 4.31Å; L94-L122 HydrophobicContact CD1-CD2 4.42Å
95	I	97.9	Very high	96.6	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	19%	0.191	C	C	.	.	I	π-helix	trans	-105.9	-50.2	-171.6	-52.6	-56.6	0	0	0	111.5	V91 H98 F99 W119 L122 N123 L126 Y488	V91-I95 HydrophobicContact CG1-CB 4.27Å; V91-I95 WeakPolarHBondContact O-CA 3.38Å; V91-I95 WeakPolarHBondContact O-CB 3.28Å; V91-I95 PolarHBondContact O-N 2.99Å; I95-H98 PolarHBondContact O-N 3.49Å; I95-F99 WeakPolarHBondContact O-CB 3.45Å; I95-F99 PolarHBondContact O-N 3.4Å; I95-W119 HydrophobicContact CG2-CZ2 4.47Å; I95-W119 PolarHBondContact O-NE1 3.47Å; I95-L122 HydrophobicContact CD1-CB 3.69Å; I95-N123 HydrophobicContact CD1-CB 4.14Å; I95-L126 HydrophobicContact CD1-CD1 4.24Å; I95-L126 HydrophobicContact CG1-CD1 3.82Å; I95-Y488 HydrophobicContact CG2-CE1 3.76Å; I95-Y488 HydrophobicContact CG2-CE2 4.44Å; I95-Y488 VanDerWaalsContact CG2-OH 3.28Å; I95-Y488 WeakPolarHBondContact CG2-OH 3.33Å
96	L	97.8	Very high	96.2	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-62.3	-41.3	-172.8	-63.6	-174.5	0	0	0	114.6	I56 V91 A92 H98 F99 I100 W485 Y488	I56-L96 HydrophobicContact CD1-CD1 3.64Å; V91-L96 HydrophobicContact CG1-CD2 4.39Å; V91-L96 HydrophobicContact CG1-CG 4.26Å; V91-L96 PolarHBondContact O-N 3.14Å; A92-L96 HydrophobicContact CB-CD1 4.23Å; L96-H98 PolarHBondContact O-N 3.44Å; L96-F99 PolarHBondContact O-N 3.41Å; L96-I100 VanDerWaalsContact O-CG1 3.27Å; L96-I100 WeakPolarHBondContact O-CG1 3.25Å; L96-I100 PolarHBondContact O-N 2.95Å; L96-W485 HydrophobicContact CD2-CH2 4.05Å; L96-W485 HydrophobicContact CD2-CZ3 3.92Å; L96-Y488 HydrophobicContact CD2-CD1 4.26Å; L96-Y488 HydrophobicContact CD2-CD2 3.66Å; L96-Y488 HydrophobicContact CD2-CE2 4.28Å; L96-Y488 HydrophobicContact CD2-CG 3.67Å
97	P	97	Very high	95.8	Very high	58 Å²	58	39.3 Å²	39.3	38%	0.377	21%	0.21	S	C	.	.	H	α-helix	trans	-61	-45	-179	-25.5	36.6	0	0	0	112.1	A92 I100 M101	A92-P97 WeakPolarHBondContact O-CD 3.44Å; P97-I100 PolarHBondContact O-N 3.4Å; P97-M101 VanDerWaalsContact O-CG 3.24Å; P97-M101 WeakPolarHBondContact O-CG 3.47Å; P97-M101 PolarHBondContact O-N 2.93Å
98	H	95.6	Very high	95.6	Very high	45 Å²	45	39.3 Å²	39.3	21%	0.208	21%	0.211	C	C	.	.	H	α-helix	trans	-70.7	-32.3	177.4	-64.9	-58.1	0	0	0	112.5	L94 I95 L96 M101 R102 W108 Y110 W119	L94-H98 PolarHBondContact O-CD2 2.93Å; I95-H98 PolarHBondContact O-N 3.49Å; L96-H98 PolarHBondContact O-N 3.44Å; H98-M101 PolarHBondContact O-N 2.91Å; H98-R102 PolarHBondContact O-N 3.5Å; H98-W108 HydrophobicContact CB-CH2 4.32Å; H98-W108 HydrophobicContact CB-CZ3 4.24Å; H98-Y110 AromaticContact ND1-CE2 3.52Å; H98-Y110 AromaticContact ND1-CZ 3.46Å; H98-Y110 PolarHBondContact ND1-OH 2.97Å; H98-Y110 VanDerWaalsContact ND1-OH 3.12Å; H98-W119 HydrophobicContact CB-CG 4.16Å; H98-W119 AromaticContact CD2-CD1 3.97Å
99	F	95.9	Very high	95.4	Very high	15 Å²	15	40.8 Å²	40.8	7%	0.066	22%	0.22	C	C	.	.	H	α-helix	trans	-66.1	-43.3	174.1	-164.5	-128.7	0	0	0	111.9	I95 L96 R102 Q103 W119 M481 W485 Y488	I95-F99 WeakPolarHBondContact O-CB 3.45Å; I95-F99 PolarHBondContact O-N 3.4Å; L96-F99 PolarHBondContact O-N 3.41Å; F99-R102 PolarHBondContact O-N 3.34Å; F99-Q103 PolarHBondContact O-N 2.87Å; F99-Q103 VanDerWaalsContact O-N 3.09Å; F99-W119 HydrophobicContact CB-CZ2 3.92Å; F99-W119 AromaticContact CD2-CH2 3.82Å; F99-W119 HydrophobicContact CD2-CH2 3.82Å; F99-W119 AromaticContact CD2-CZ2 3.62Å; F99-W119 HydrophobicContact CD2-CZ2 3.62Å; F99-W119 HydrophobicContact CE2-CH2 4.44Å; F99-W119 HydrophobicContact CG-CZ2 4.18Å; F99-M481 HydrophobicContact CD2-SD 4.44Å; F99-M481 HydrophobicContact CE1-SD 3.82Å; F99-M481 HydrophobicContact CE2-SD 3.72Å; F99-M481 HydrophobicContact CZ-SD 3.36Å; F99-M481 WeakPolarHBondContact CZ-SD 2.9Å; F99-W485 HydrophobicContact CD1-CD2 4.18Å; F99-W485 AromaticContact CD1-CE2 3.52Å; F99-W485 HydrophobicContact CD1-CH2 4.42Å; F99-W485 AromaticContact CD1-CZ2 3.68Å; F99-W485 HydrophobicContact CD1-CZ2 3.68Å; F99-W485 AromaticContact CD1-NE1 3.57Å; F99-W485 AromaticContact CE1-CD1 3.47Å; F99-W485 VanDerWaalsContact CE1-CD1 3.47Å; F99-W485 AromaticContact CE1-CD2 3.97Å; F99-W485 HydrophobicContact CE1-CD2 3.97Å; F99-W485 AromaticContact CE1-CE2 3.58Å; F99-W485 AromaticContact CE1-CG 3.91Å; F99-W485 HydrophobicContact CE1-CG 3.91Å; F99-W485 HydrophobicContact CE1-CZ2 4.22Å; F99-W485 AromaticContact CE1-NE1 3.24Å; F99-Y488 AromaticContact CD1-CD2 3.82Å; F99-Y488 HydrophobicContact CD1-CD2 3.82Å; F99-Y488 AromaticContact CD1-CE2 3.43Å; F99-Y488 HydrophobicContact CD1-CE2 3.43Å; F99-Y488 VanDerWaalsContact CD1-CE2 3.43Å; F99-Y488 HydrophobicContact CD2-CE2 4.4Å; F99-Y488 AromaticContact CE1-CD2 3.83Å; F99-Y488 HydrophobicContact CE1-CD2 3.83Å; F99-Y488 AromaticContact CE1-CE2 3.5Å; F99-Y488 HydrophobicContact CE1-CE2 3.5Å; F99-Y488 VanDerWaalsContact CE1-CE2 3.5Å; F99-Y488 HydrophobicContact CE2-CE2 4.47Å; F99-Y488 AromaticContact CG-CE2 3.91Å; F99-Y488 HydrophobicContact CG-CE2 3.91Å; F99-Y488 HydrophobicContact CZ-CE2 4.04Å
100	I	96.4	Very high	95.2	Very high	20 Å²	20	42.6 Å²	42.6	10%	0.103	23%	0.226	C	C	.	.	H	α-helix	trans	-62.9	-45.5	174.1	-67.4	162.3	0	0	0	110.3	I46 I50 L96 P97 R102 Q103 V104 W485	I46-I100 HydrophobicContact CG2-CG2 4.14Å; I50-I100 HydrophobicContact CG1-CD1 3.92Å; I50-I100 HydrophobicContact CG1-CG2 4.23Å; L96-I100 VanDerWaalsContact O-CG1 3.27Å; L96-I100 WeakPolarHBondContact O-CG1 3.25Å; L96-I100 PolarHBondContact O-N 2.95Å; P97-I100 PolarHBondContact O-N 3.4Å; I100-R102 VanDerWaalsContact C-N 3.34Å; I100-R102 PolarHBondContact O-N 3.31Å; I100-Q103 CarbonylContact O-C 3.6Å; I100-Q103 WeakPolarHBondContact O-CA 3.31Å; I100-Q103 WeakPolarHBondContact O-CB 3.48Å; I100-Q103 PolarHBondContact O-N 3.44Å; I100-V104 HydrophobicContact CG2-CG2 4.11Å; I100-V104 VanDerWaalsContact O-CG2 3.31Å; I100-V104 WeakPolarHBondContact O-CG2 3.24Å; I100-V104 PolarHBondContact O-N 3.27Å; I100-W485 HydrophobicContact CD1-CH2 3.97Å; I100-W485 HydrophobicContact CD1-CZ2 4.4Å; I100-W485 HydrophobicContact CG1-CH2 3.61Å; I100-W485 HydrophobicContact CG1-CZ2 3.54Å
101	M	95	Very high	94.8	Very high	63 Å²	63	48.2 Å²	48.2	31%	0.31	25%	0.251	S	S	.	.	H	α-helix	trans	-60.7	-42.9	178.3	-72.2	-66.2	-73.4	0	0	111.8	P97 H98 Q103 V104 Y105 Y110	P97-M101 VanDerWaalsContact O-CG 3.24Å; P97-M101 WeakPolarHBondContact O-CG 3.47Å; P97-M101 PolarHBondContact O-N 2.93Å; H98-M101 PolarHBondContact O-N 2.91Å; M101-Q103 VanDerWaalsContact C-N 3.27Å; M101-Q103 PolarHBondContact O-N 3.49Å; M101-V104 PolarHBondContact O-N 2.92Å; M101-Y105 HydrophobicContact CE-CD2 4.25Å; M101-Y105 HydrophobicContact CE-CE2 3.48Å; M101-Y105 VanDerWaalsContact CE-CE2 3.48Å; M101-Y105 VanDerWaalsContact O-CD2 3.31Å; M101-Y105 WeakPolarHBondContact O-CD2 3.47Å; M101-Y105 PolarHBondContact O-N 2.97Å; M101-Y105 VanDerWaalsContact O-N 3.08Å; M101-Y105 HydrophobicContact SD-CE2 4.34Å; M101-Y110 HydrophobicContact CB-CE2 4.38Å; M101-Y110 WeakPolarHBondContact CB-OH 3.36Å; M101-Y110 WeakPolarHBondContact CG-OH 3.48Å
102	R	92.7	Very high	94.5	Very high	48 Å²	48	50.6 Å²	50.6	18%	0.181	27%	0.268	C	S	.	.	H	α-helix	trans	-58	-40.8	172.8	179.6	-178.6	171.6	172.1	2.1	112.1	H98 F99 I100 G106 H107 C191	H98-R102 PolarHBondContact O-N 3.5Å; F99-R102 PolarHBondContact O-N 3.34Å; I100-R102 VanDerWaalsContact C-N 3.34Å; I100-R102 PolarHBondContact O-N 3.31Å; R102-G106 CarbonylContact O-C 3.16Å; R102-G106 WeakPolarHBondContact O-CA 3.19Å; R102-G106 PolarHBondContact O-N 3.35Å; R102-H107 WeakPolarHBondContact CA-O 3.23Å; R102-H107 PolarHBondContact O-N 3.36Å; R102-C191 PolarHBondContact NH1-O 3.49Å
103	Q	92.5	Very high	94.1	Very high	33 Å²	33	54.5 Å²	54.5	15%	0.154	28%	0.284	C	S	.	.	H	α-helix	trans	-68.8	-39.9	178.1	-173.8	173.5	-27.4	0	0	112.6	I46 Q49 F99 I100 M101 G106 M481	I46-Q103 HydrophobicContact CG1-CG 4.42Å; Q49-Q103 VanDerWaalsContact OE1-CD 3.26Å; F99-Q103 PolarHBondContact O-N 2.87Å; F99-Q103 VanDerWaalsContact O-N 3.09Å; I100-Q103 CarbonylContact O-C 3.6Å; I100-Q103 WeakPolarHBondContact O-CA 3.31Å; I100-Q103 WeakPolarHBondContact O-CB 3.48Å; I100-Q103 PolarHBondContact O-N 3.44Å; M101-Q103 VanDerWaalsContact C-N 3.27Å; M101-Q103 PolarHBondContact O-N 3.49Å; Q103-G106 PolarHBondContact O-N 3.19Å; Q103-M481 HydrophobicContact CB-CE 3.68Å; Q103-M481 HydrophobicContact CB-SD 4.08Å; Q103-M481 HydrophobicContact CG-CE 3.94Å; Q103-M481 HydrophobicContact CG-CG 4.4Å; Q103-M481 HydrophobicContact CG-SD 4.22Å; Q103-M481 PolarHBondContact OE1-SD 2.84Å; Q103-M481 VanDerWaalsContact OE1-SD 3.38Å
104	V	93	Very high	93.8	Very high	76 Å²	76	56.2 Å²	56.2	46%	0.461	29%	0.287	S	S	.	.	H	α-helix	trans	-62.3	-44.7	178.6	169	0	0	0	0	111.4	I46 I100 M101	I46-V104 HydrophobicContact CD1-CG2 3.92Å; I46-V104 HydrophobicContact CG2-CG2 4.1Å; I100-V104 HydrophobicContact CG2-CG2 4.11Å; I100-V104 VanDerWaalsContact O-CG2 3.31Å; I100-V104 WeakPolarHBondContact O-CG2 3.24Å; I100-V104 PolarHBondContact O-N 3.27Å; M101-V104 PolarHBondContact O-N 2.92Å
105	Y	92.4	Very high	93.6	Very high	130 Å²	130	55.6 Å²	55.6	51%	0.51	28%	0.284	S	S	.	.	H	α-helix	trans	-83.7	-13.2	-179.9	-75.1	-96.5	0	0	0	113.1	M101 H107 P109	M101-Y105 HydrophobicContact CE-CD2 4.25Å; M101-Y105 HydrophobicContact CE-CE2 3.48Å; M101-Y105 VanDerWaalsContact CE-CE2 3.48Å; M101-Y105 VanDerWaalsContact O-CD2 3.31Å; M101-Y105 WeakPolarHBondContact O-CD2 3.47Å; M101-Y105 PolarHBondContact O-N 2.97Å; M101-Y105 VanDerWaalsContact O-N 3.08Å; M101-Y105 HydrophobicContact SD-CE2 4.34Å; Y105-H107 PolarHBondContact O-CD2 3.2Å; Y105-H107 PolarHBondContact O-N 3.13Å; Y105-P109 HydrophobicContact CD1-CB 3.95Å; Y105-P109 HydrophobicContact CD2-CB 3.93Å; Y105-P109 HydrophobicContact CD2-CG 3.99Å; Y105-P109 HydrophobicContact CE1-CB 4.35Å; Y105-P109 HydrophobicContact CE2-CB 4.35Å; Y105-P109 HydrophobicContact CE2-CG 4.45Å; Y105-P109 HydrophobicContact CG-CB 3.71Å; Y105-P109 HydrophobicContact CG-CG 4.2Å
106	G	89.4	Confident	93.4	Very high	45 Å²	45	55.5 Å²	55.5	46%	0.464	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	3.3	-172.6	0	0	0	0	0	114	R102 Q103	R102-G106 CarbonylContact O-C 3.16Å; R102-G106 WeakPolarHBondContact O-CA 3.19Å; R102-G106 PolarHBondContact O-N 3.35Å; Q103-G106 PolarHBondContact O-N 3.19Å
107	H	90.6	Very high	93.2	Very high	71 Å²	71	56 Å²	56	33%	0.329	29%	0.286	S	S	.	.	S	Bend	trans	-157.3	172.3	179.1	71.2	78.5	0	0	0	110	R102 Y105 P109	R102-H107 WeakPolarHBondContact CA-O 3.23Å; R102-H107 PolarHBondContact O-N 3.36Å; Y105-H107 PolarHBondContact O-CD2 3.2Å; Y105-H107 PolarHBondContact O-N 3.13Å; H107-P109 WeakPolarHBondContact O-CD 3.15Å
108	W	93.5	Very high	93.1	Very high	1 Å²	1	59.3 Å²	59.3	0%	0.004	29%	0.292	C	S	.	.			trans	-71.1	114.6	172.9	-175.9	-105.8	0	0	0	109.9	H98 Y110 L115 C116 W119 G189 C191	H98-W108 HydrophobicContact CB-CH2 4.32Å; H98-W108 HydrophobicContact CB-CZ3 4.24Å; W108-Y110 AromaticContact CD2-CD2 3.94Å; W108-Y110 HydrophobicContact CD2-CD2 3.94Å; W108-Y110 AromaticContact CE2-CD2 3.56Å; W108-Y110 HydrophobicContact CE3-CD2 4.18Å; W108-Y110 AromaticContact CH2-CD2 3.76Å; W108-Y110 HydrophobicContact CH2-CD2 3.76Å; W108-Y110 HydrophobicContact CH2-CE2 4.08Å; W108-Y110 AromaticContact CZ2-CD2 3.47Å; W108-Y110 HydrophobicContact CZ2-CD2 3.47Å; W108-Y110 VanDerWaalsContact CZ2-CD2 3.47Å; W108-Y110 HydrophobicContact CZ2-CE2 4.25Å; W108-Y110 HydrophobicContact CZ2-CG 4.21Å; W108-Y110 HydrophobicContact CZ3-CD2 4.1Å; W108-Y110 HydrophobicContact CZ3-CE2 4.24Å; W108-Y110 PolarHBondContact NE1-O 3.05Å; W108-L115 HydrophobicContact CH2-CG 4.24Å; W108-L115 HydrophobicContact CZ2-CB 4.21Å; W108-L115 HydrophobicContact CZ2-CD2 4.08Å; W108-L115 HydrophobicContact CZ2-CG 3.86Å; W108-C116 HydrophobicContact CZ2-CB 3.88Å; W108-W119 HydrophobicContact CH2-CB 4.01Å; W108-W119 HydrophobicContact CH2-CD2 4.32Å; W108-W119 HydrophobicContact CH2-CE3 4.45Å; W108-W119 HydrophobicContact CH2-CG 4.13Å; W108-W119 HydrophobicContact CZ3-CD2 4.03Å; W108-W119 AromaticContact CZ3-CE3 3.99Å; W108-W119 HydrophobicContact CZ3-CE3 3.99Å; W108-W119 HydrophobicContact CZ3-CG 4.29Å; W108-G189 PolarHBondContact O-N 3.49Å; W108-C191 HydrophobicContact CB-CB 3.66Å; W108-C191 HydrophobicContact CD2-CB 3.42Å; W108-C191 VanDerWaalsContact CD2-CB 3.42Å; W108-C191 HydrophobicContact CE3-CB 3.71Å; W108-C191 HydrophobicContact CG-CB 3.42Å; W108-C191 VanDerWaalsContact CG-CB 3.42Å; W108-C191 HydrophobicContact CZ3-CB 4.5Å
109	P	93.9	Very high	93.1	Very high	31 Å²	31	57.7 Å²	57.7	20%	0.201	28%	0.284	C	S	.	.			trans	-89.9	-6.8	-170.4	35.8	-35.1	0	0	0	113.5	Y105 H107	Y105-P109 HydrophobicContact CD1-CB 3.95Å; Y105-P109 HydrophobicContact CD2-CB 3.93Å; Y105-P109 HydrophobicContact CD2-CG 3.99Å; Y105-P109 HydrophobicContact CE1-CB 4.35Å; Y105-P109 HydrophobicContact CE2-CB 4.35Å; Y105-P109 HydrophobicContact CE2-CG 4.45Å; Y105-P109 HydrophobicContact CG-CB 3.71Å; Y105-P109 HydrophobicContact CG-CG 4.2Å; H107-P109 WeakPolarHBondContact O-CD 3.15Å
110	Y	94	Very high	93	Very high	58 Å²	58	57.4 Å²	57.4	23%	0.227	28%	0.283	C	S	.	.			trans	-93.9	132.3	-172.8	-51.1	-80.6	0	0	0	111.4	H98 M101 W108 S112 L115	H98-Y110 AromaticContact ND1-CE2 3.52Å; H98-Y110 AromaticContact ND1-CZ 3.46Å; H98-Y110 PolarHBondContact ND1-OH 2.97Å; H98-Y110 VanDerWaalsContact ND1-OH 3.12Å; M101-Y110 HydrophobicContact CB-CE2 4.38Å; M101-Y110 WeakPolarHBondContact CB-OH 3.36Å; M101-Y110 WeakPolarHBondContact CG-OH 3.48Å; W108-Y110 AromaticContact CD2-CD2 3.94Å; W108-Y110 HydrophobicContact CD2-CD2 3.94Å; W108-Y110 AromaticContact CE2-CD2 3.56Å; W108-Y110 HydrophobicContact CE3-CD2 4.18Å; W108-Y110 AromaticContact CH2-CD2 3.76Å; W108-Y110 HydrophobicContact CH2-CD2 3.76Å; W108-Y110 HydrophobicContact CH2-CE2 4.08Å; W108-Y110 AromaticContact CZ2-CD2 3.47Å; W108-Y110 HydrophobicContact CZ2-CD2 3.47Å; W108-Y110 VanDerWaalsContact CZ2-CD2 3.47Å; W108-Y110 HydrophobicContact CZ2-CE2 4.25Å; W108-Y110 HydrophobicContact CZ2-CG 4.21Å; W108-Y110 HydrophobicContact CZ3-CD2 4.1Å; W108-Y110 HydrophobicContact CZ3-CE2 4.24Å; W108-Y110 PolarHBondContact NE1-O 3.05Å; Y110-S112 VanDerWaalsContact C-N 3.27Å; Y110-S112 PolarHBondContact O-N 3.36Å; Y110-L115 HydrophobicContact CD1-CD2 3.78Å; Y110-L115 HydrophobicContact CD2-CD2 3.8Å; Y110-L115 HydrophobicContact CE1-CD2 4.21Å; Y110-L115 HydrophobicContact CE2-CD2 4.22Å; Y110-L115 HydrophobicContact CG-CD2 3.55Å
111	E	90.4	Very high	93	Very high	165 Å²	165	56.4 Å²	56.4	77%	0.771	28%	0.278	S	S	*	.			trans	-70	-25.9	174.4	-64.2	178	-178.4	0	0	112.5	H113 V188	E111-H113 PolarHBondContact O-CD2 3.06Å; E111-H113 PolarHBondContact O-N 3.22Å; E111-H113 VanDerWaalsContact O-N 3.1Å; E111-V188 HydrophobicContact CB-CG2 4.32Å; E111-V188 HydrophobicContact CG-CG2 3.8Å
112	S	92.5	Very high	93	Very high	57 Å²	57	55.5 Å²	55.5	40%	0.399	27%	0.274	S	S	.	.			trans	-66.8	111	-179.9	-179.2	0	0	0	0	111.5	Y110 E114 L115	Y110-S112 VanDerWaalsContact C-N 3.27Å; Y110-S112 PolarHBondContact O-N 3.36Å; S112-E114 VanDerWaalsContact C-N 3.3Å; S112-L115 PolarHBondContact O-N 3.26Å; S112-L115 PolarHBondContact OG-N 2.96Å
113	H	90.3	Very high	93.2	Very high	94 Å²	94	54.3 Å²	54.3	44%	0.435	27%	0.271	S	S	.	.	H	α-helix	trans	-62.9	-39.6	172.2	-62.7	172.7	0	0	0	111.5	E111 L115 C116 I117 N186	E111-H113 PolarHBondContact O-CD2 3.06Å; E111-H113 PolarHBondContact O-N 3.22Å; E111-H113 VanDerWaalsContact O-N 3.1Å; H113-L115 VanDerWaalsContact C-N 3.32Å; H113-L115 PolarHBondContact O-N 3.17Å; H113-C116 WeakPolarHBondContact O-CB 3.42Å; H113-C116 PolarHBondContact O-N 3.41Å; H113-C116 VanDerWaalsContact O-N 3.15Å; H113-I117 WeakPolarHBondContact O-CG1 3.28Å; H113-I117 PolarHBondContact O-N 3.36Å; H113-I117 VanDerWaalsContact O-N 3.07Å; H113-N186 HydrophobicContact CB-CB 4.24Å
114	E	91.4	Very high	93.3	Very high	106 Å²	106	53.5 Å²	53.5	50%	0.495	27%	0.268	S	S	.	.	H	α-helix	trans	-60.6	-42	178.9	-58.4	-53.4	151.7	0	0	111.6	S112 C116 I117 Y118	S112-E114 VanDerWaalsContact C-N 3.3Å; E114-C116 VanDerWaalsContact C-N 3.27Å; E114-C116 PolarHBondContact O-N 3Å; E114-I117 PolarHBondContact O-N 3.49Å; E114-I117 VanDerWaalsContact O-N 3.16Å; E114-Y118 HydrophobicContact CB-CD2 4.18Å; E114-Y118 HydrophobicContact CB-CE2 3.99Å; E114-Y118 WeakPolarHBondContact O-CB 3.1Å; E114-Y118 WeakPolarHBondContact O-CD2 3.36Å; E114-Y118 PolarHBondContact O-N 3.25Å
115	L	93.6	Very high	93.4	Very high	48 Å²	48	51.3 Å²	51.3	25%	0.251	25%	0.252	S	S	.	.	H	α-helix	trans	-60	-39.5	177.8	-175	64.4	0	0	0	111.7	W108 Y110 S112 H113 W119	W108-L115 HydrophobicContact CH2-CG 4.24Å; W108-L115 HydrophobicContact CZ2-CB 4.21Å; W108-L115 HydrophobicContact CZ2-CD2 4.08Å; W108-L115 HydrophobicContact CZ2-CG 3.86Å; Y110-L115 HydrophobicContact CD1-CD2 3.78Å; Y110-L115 HydrophobicContact CD2-CD2 3.8Å; Y110-L115 HydrophobicContact CE1-CD2 4.21Å; Y110-L115 HydrophobicContact CE2-CD2 4.22Å; Y110-L115 HydrophobicContact CG-CD2 3.55Å; S112-L115 PolarHBondContact O-N 3.26Å; S112-L115 PolarHBondContact OG-N 2.96Å; H113-L115 VanDerWaalsContact C-N 3.32Å; H113-L115 PolarHBondContact O-N 3.17Å; L115-W119 WeakPolarHBondContact O-CB 3.37Å; L115-W119 PolarHBondContact O-N 3.16Å
116	C	94.5	Very high	93.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.4	-48.7	174.9	172.6	0	0	0	0	111.3	W108 H113 E114 Y118 W119 L120 N186 C191	W108-C116 HydrophobicContact CZ2-CB 3.88Å; H113-C116 WeakPolarHBondContact O-CB 3.42Å; H113-C116 PolarHBondContact O-N 3.41Å; H113-C116 VanDerWaalsContact O-N 3.15Å; E114-C116 VanDerWaalsContact C-N 3.27Å; E114-C116 PolarHBondContact O-N 3Å; C116-Y118 PolarHBondContact O-N 3.4Å; C116-W119 PolarHBondContact O-N 3.27Å; C116-L120 WeakPolarHBondContact O-CG 3.4Å; C116-L120 PolarHBondContact O-N 2.82Å; C116-N186 HydrophobicContact CB-CB 4.45Å; C116-C191 WeakPolarHBondContact CA-SG 3.48Å; C116-C191 HydrophobicContact CB-CB 3.91Å; C116-C191 WeakPolarHBondContact CB-SG 3.37Å; C116-C191 WeakPolarHBondContact SG-CA 3.16Å; C116-C191 WeakPolarHBondContact SG-CB 3.43Å; C116-C191 CovalentContact SG-SG 2.03Å; C116-C191 PolarHBondContact SG-SG 3.33Å
117	I	93.8	Very high	94	Very high	12 Å²	12	43.5 Å²	43.5	6%	0.062	21%	0.209	C	C	.	.	H	α-helix	trans	-59.2	-48.5	-179.9	-65.4	168.2	0	0	0	110.1	H113 E114 W119 L120 S121 P178 I179 H184	H113-I117 WeakPolarHBondContact O-CG1 3.28Å; H113-I117 PolarHBondContact O-N 3.36Å; H113-I117 VanDerWaalsContact O-N 3.07Å; E114-I117 PolarHBondContact O-N 3.49Å; E114-I117 VanDerWaalsContact O-N 3.16Å; I117-W119 PolarHBondContact O-N 2.91Å; I117-L120 PolarHBondContact O-N 2.94Å; I117-S121 WeakPolarHBondContact O-CB 3.13Å; I117-S121 PolarHBondContact O-N 3.43Å; I117-S121 PolarHBondContact O-OG 3.45Å; I117-P178 WeakPolarHBondContact CG2-O 3.45Å; I117-I179 HydrophobicContact CG2-CG1 4.31Å; I117-H184 WeakPolarHBondContact CD1-NE2 3.24Å
118	Y	94.1	Very high	94.2	Very high	127 Å²	127	40.3 Å²	40.3	50%	0.498	20%	0.195	S	C	.	.	H	α-helix	trans	-62.3	-42.2	176.9	-73.4	-56.8	0	0	0	112.3	E114 C116 S121 L122	E114-Y118 HydrophobicContact CB-CD2 4.18Å; E114-Y118 HydrophobicContact CB-CE2 3.99Å; E114-Y118 WeakPolarHBondContact O-CB 3.1Å; E114-Y118 WeakPolarHBondContact O-CD2 3.36Å; E114-Y118 PolarHBondContact O-N 3.25Å; C116-Y118 PolarHBondContact O-N 3.4Å; Y118-S121 PolarHBondContact O-N 2.85Å; Y118-L122 VanDerWaalsContact O-CB 3.24Å; Y118-L122 WeakPolarHBondContact O-CB 3.48Å; Y118-L122 WeakPolarHBondContact O-CG 3.31Å; Y118-L122 PolarHBondContact O-N 3.39Å
119	W	95.5	Very high	94.4	Very high	11 Å²	11	40.2 Å²	40.2	4%	0.042	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-45.7	179.4	179.7	74.7	0	0	0	112.3	I95 H98 F99 W108 L115 C116 I117 S121 N123	I95-W119 HydrophobicContact CG2-CZ2 4.47Å; I95-W119 PolarHBondContact O-NE1 3.47Å; H98-W119 HydrophobicContact CB-CG 4.16Å; H98-W119 AromaticContact CD2-CD1 3.97Å; F99-W119 HydrophobicContact CB-CZ2 3.92Å; F99-W119 AromaticContact CD2-CH2 3.82Å; F99-W119 HydrophobicContact CD2-CH2 3.82Å; F99-W119 AromaticContact CD2-CZ2 3.62Å; F99-W119 HydrophobicContact CD2-CZ2 3.62Å; F99-W119 HydrophobicContact CE2-CH2 4.44Å; F99-W119 HydrophobicContact CG-CZ2 4.18Å; W108-W119 HydrophobicContact CH2-CB 4.01Å; W108-W119 HydrophobicContact CH2-CD2 4.32Å; W108-W119 HydrophobicContact CH2-CE3 4.45Å; W108-W119 HydrophobicContact CH2-CG 4.13Å; W108-W119 HydrophobicContact CZ3-CD2 4.03Å; W108-W119 AromaticContact CZ3-CE3 3.99Å; W108-W119 HydrophobicContact CZ3-CE3 3.99Å; W108-W119 HydrophobicContact CZ3-CG 4.29Å; L115-W119 WeakPolarHBondContact O-CB 3.37Å; L115-W119 PolarHBondContact O-N 3.16Å; C116-W119 PolarHBondContact O-N 3.27Å; I117-W119 PolarHBondContact O-N 2.91Å; W119-S121 VanDerWaalsContact C-N 3.33Å; W119-S121 PolarHBondContact O-N 2.74Å; W119-N123 WeakPolarHBondContact O-CB 3.41Å; W119-N123 PolarHBondContact O-N 2.91Å
120	L	94.7	Very high	94.5	Very high	9 Å²	9	38.9 Å²	38.9	5%	0.047	19%	0.186	C	C	.	.	H	α-helix	trans	-62.4	-41.7	174.9	-66.9	176.5	0	0	0	111.8	C116 I117 N123 L124 H184 I193	C116-L120 WeakPolarHBondContact O-CG 3.4Å; C116-L120 PolarHBondContact O-N 2.82Å; I117-L120 PolarHBondContact O-N 2.94Å; L120-N123 WeakPolarHBondContact O-CB 3.31Å; L120-N123 PolarHBondContact O-N 3.43Å; L120-L124 PolarHBondContact O-N 2.92Å; L120-H184 HydrophobicContact CD1-CB 3.9Å; L120-I193 HydrophobicContact CD1-CG1 4.45Å; L120-I193 HydrophobicContact CD2-CG1 4.24Å
121	S	95.2	Very high	94.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-65.1	-50.3	179.4	-63.3	0	0	0	0	111.7	I117 Y118 W119 N123 L124 F125 M175 P178 I179	I117-S121 WeakPolarHBondContact O-CB 3.13Å; I117-S121 PolarHBondContact O-N 3.43Å; I117-S121 PolarHBondContact O-OG 3.45Å; Y118-S121 PolarHBondContact O-N 2.85Å; W119-S121 VanDerWaalsContact C-N 3.33Å; W119-S121 PolarHBondContact O-N 2.74Å; S121-N123 VanDerWaalsContact C-N 3.26Å; S121-N123 PolarHBondContact O-N 3.42Å; S121-L124 PolarHBondContact O-N 2.92Å; S121-F125 WeakPolarHBondContact O-CB 3.33Å; S121-F125 PolarHBondContact O-N 2.76Å; S121-M175 VanDerWaalsContact CB-CG 3.43Å; S121-M175 WeakPolarHBondContact O-CG 3.22Å; S121-P178 WeakPolarHBondContact OG-CB 3.28Å; S121-I179 WeakPolarHBondContact OG-CG1 3.45Å
122	L	96.2	Very high	94.9	Very high	43 Å²	43	30.5 Å²	30.5	23%	0.225	15%	0.15	C	C	.	.	H	α-helix	trans	-63	-33.4	178.6	-73.8	169.7	0	0	0	111.8	L94 I95 Y118 F125 L126 M175	L94-L122 HydrophobicContact CB-CD1 4.4Å; L94-L122 HydrophobicContact CD1-CD1 4.31Å; L94-L122 HydrophobicContact CD1-CD2 4.42Å; I95-L122 HydrophobicContact CD1-CB 3.69Å; Y118-L122 VanDerWaalsContact O-CB 3.24Å; Y118-L122 WeakPolarHBondContact O-CB 3.48Å; Y118-L122 WeakPolarHBondContact O-CG 3.31Å; Y118-L122 PolarHBondContact O-N 3.39Å; L122-F125 HydrophobicContact CD2-CD1 4.13Å; L122-F125 PolarHBondContact O-N 3.49Å; L122-L126 WeakPolarHBondContact O-CB 3.38Å; L122-L126 VanDerWaalsContact O-CG 3.28Å; L122-L126 WeakPolarHBondContact O-CG 3.41Å; L122-L126 PolarHBondContact O-N 2.67Å; L122-M175 HydrophobicContact CD2-SD 4.34Å
123	N	95.5	Very high	95.2	Very high	23 Å²	23	27.8 Å²	27.8	12%	0.123	13%	0.131	C	C	.	.	H	α-helix	trans	-60.2	-52.4	173.8	-173.6	-14.6	0	0	0	110.9	I95 W119 L120 S121 F125 L126 C127 Y488	I95-N123 HydrophobicContact CD1-CB 4.14Å; W119-N123 WeakPolarHBondContact O-CB 3.41Å; W119-N123 PolarHBondContact O-N 2.91Å; L120-N123 WeakPolarHBondContact O-CB 3.31Å; L120-N123 PolarHBondContact O-N 3.43Å; S121-N123 VanDerWaalsContact C-N 3.26Å; S121-N123 PolarHBondContact O-N 3.42Å; N123-F125 VanDerWaalsContact C-N 3.31Å; N123-F125 PolarHBondContact O-N 2.91Å; N123-L126 PolarHBondContact O-N 3.44Å; N123-C127 WeakPolarHBondContact O-CB 3.5Å; N123-C127 PolarHBondContact O-N 3.36Å; N123-C127 PolarHBondContact O-SG 2.96Å; N123-Y488 PolarHBondContact ND2-OH 3.18Å
124	L	94.4	Very high	95.5	Very high	16 Å²	16	23.3 Å²	23.3	8%	0.084	11%	0.111	C	C	.	.	H	α-helix	trans	-60.6	-40.3	176.5	-69.2	175.5	0	0	0	112.5	L120 S121 C127 S128 V174 P178 I193 Y199 I207	L120-L124 PolarHBondContact O-N 2.92Å; S121-L124 PolarHBondContact O-N 2.92Å; L124-C127 PolarHBondContact O-SG 3.36Å; L124-S128 WeakPolarHBondContact O-CB 3.31Å; L124-S128 PolarHBondContact O-N 3.17Å; L124-S128 VanDerWaalsContact O-N 3.12Å; L124-V174 HydrophobicContact CB-CG1 4.28Å; L124-P178 HydrophobicContact CD1-CG 3.66Å; L124-I193 HydrophobicContact CD1-CD1 4.11Å; L124-I193 HydrophobicContact CD2-CD1 4.28Å; L124-I193 HydrophobicContact CG-CD1 4.35Å; L124-Y199 WeakPolarHBondContact CD1-OH 3.42Å; L124-I207 HydrophobicContact CD2-CD1 4.04Å
125	F	96.8	Very high	95.7	Very high	30 Å²	30	18.7 Å²	18.7	13%	0.132	9%	0.09	C	C	.	.	H	α-helix	trans	-60.7	-52.4	176.8	171.3	-128.2	0	0	0	112.1	S121 L122 N123 S128 A129 W168 S171 F172 M175	S121-F125 WeakPolarHBondContact O-CB 3.33Å; S121-F125 PolarHBondContact O-N 2.76Å; L122-F125 HydrophobicContact CD2-CD1 4.13Å; L122-F125 PolarHBondContact O-N 3.49Å; N123-F125 VanDerWaalsContact C-N 3.31Å; N123-F125 PolarHBondContact O-N 2.91Å; F125-S128 PolarHBondContact O-N 3.36Å; F125-A129 WeakPolarHBondContact O-CB 3.36Å; F125-A129 PolarHBondContact O-N 3.31Å; F125-W168 HydrophobicContact CE1-CE3 4.23Å; F125-W168 AromaticContact CE1-CZ3 3.87Å; F125-W168 HydrophobicContact CE1-CZ3 3.87Å; F125-W168 AromaticContact CE2-CE3 3.73Å; F125-W168 HydrophobicContact CE2-CE3 3.73Å; F125-W168 HydrophobicContact CE2-CZ3 4.14Å; F125-W168 AromaticContact CZ-CE3 3.36Å; F125-W168 HydrophobicContact CZ-CE3 3.36Å; F125-W168 AromaticContact CZ-CZ3 3.48Å; F125-W168 HydrophobicContact CZ-CZ3 3.48Å; F125-W168 VanDerWaalsContact CZ-CZ3 3.48Å; F125-S171 WeakPolarHBondContact O-CB 3.41Å; F125-F172 HydrophobicContact CD2-CB 4.31Å; F125-F172 HydrophobicContact CE2-CB 4.01Å; F125-M175 HydrophobicContact CB-CB 4.12Å; F125-M175 HydrophobicContact CB-CG 4.18Å; F125-M175 HydrophobicContact CB-SD 3.91Å; F125-M175 HydrophobicContact CG-SD 4.28Å
126	L	97.5	Very high	95.9	Very high	1 Å²	1	17 Å²	17	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-73.7	-36.3	-173.5	-68	171.9	0	0	0	112.2	L90 V91 I95 L122 N123 A129 S130 W168	L90-L126 HydrophobicContact CB-CD1 3.92Å; L90-L126 HydrophobicContact CB-CD2 3.62Å; L90-L126 HydrophobicContact CB-CG 4.45Å; L90-L126 HydrophobicContact CD1-CD2 3.92Å; L90-L126 HydrophobicContact CG-CD2 4.45Å; V91-L126 HydrophobicContact CG2-CB 3.77Å; V91-L126 HydrophobicContact CG2-CD1 4.03Å; V91-L126 HydrophobicContact CG2-CG 4.48Å; I95-L126 HydrophobicContact CD1-CD1 4.24Å; I95-L126 HydrophobicContact CG1-CD1 3.82Å; L122-L126 WeakPolarHBondContact O-CB 3.38Å; L122-L126 VanDerWaalsContact O-CG 3.28Å; L122-L126 WeakPolarHBondContact O-CG 3.41Å; L122-L126 PolarHBondContact O-N 2.67Å; N123-L126 PolarHBondContact O-N 3.44Å; L126-A129 PolarHBondContact O-N 3.25Å; L126-S130 PolarHBondContact O-N 3.35Å; L126-S130 PolarHBondContact O-OG 3.42Å; L126-W168 HydrophobicContact CD2-CZ3 4.33Å
127	C	95.1	Very high	95.9	Very high	10 Å²	10	17.1 Å²	17.1	7%	0.068	8%	0.082	C	C	.	.	H	α-helix	trans	-66.5	-41.1	174.8	75.4	0	0	0	0	111.6	N123 L124 S130 I131 W458	N123-C127 WeakPolarHBondContact O-CB 3.5Å; N123-C127 PolarHBondContact O-N 3.36Å; N123-C127 PolarHBondContact O-SG 2.96Å; L124-C127 PolarHBondContact O-SG 3.36Å; C127-S130 PolarHBondContact O-N 2.92Å; C127-I131 PolarHBondContact O-N 2.88Å; C127-I131 VanDerWaalsContact O-N 3.14Å; C127-W458 HydrophobicContact CB-CH2 3.3Å; C127-W458 HydrophobicContact CB-CZ2 3.53Å; C127-W458 HydrophobicContact CB-CZ3 4Å
128	S	95.9	Very high	96	Very high	4 Å²	4	16.5 Å²	16.5	3%	0.028	8%	0.08	C	C	.	.	H	α-helix	trans	-62.1	-42.7	172.2	178.5	0	0	0	0	111.3	L124 F125 S130 I131 L132 S171	L124-S128 WeakPolarHBondContact O-CB 3.31Å; L124-S128 PolarHBondContact O-N 3.17Å; L124-S128 VanDerWaalsContact O-N 3.12Å; F125-S128 PolarHBondContact O-N 3.36Å; S128-S130 VanDerWaalsContact C-N 3.34Å; S128-S130 PolarHBondContact O-N 3.23Å; S128-I131 WeakPolarHBondContact O-CG2 3.09Å; S128-I131 PolarHBondContact O-N 3.24Å; S128-L132 WeakPolarHBondContact O-CB 3.25Å; S128-L132 WeakPolarHBondContact O-CG 3.32Å; S128-L132 PolarHBondContact O-N 3.4Å; S128-S171 PolarHBondContact O-OG 3.43Å; S128-S171 WeakPolarHBondContact OG-CA 3.4Å; S128-S171 WeakPolarHBondContact OG-CB 3.46Å; S128-S171 PolarHBondContact OG-OG 2.84Å
129	A	97.7	Very high	96.1	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-61.5	-43.9	178	0	0	0	0	0	111	A87 F125 L126 N133 W168 S171	A87-A129 HydrophobicContact CB-CB 4.08Å; F125-A129 WeakPolarHBondContact O-CB 3.36Å; F125-A129 PolarHBondContact O-N 3.31Å; L126-A129 PolarHBondContact O-N 3.25Å; A129-N133 WeakPolarHBondContact O-CB 3.42Å; A129-N133 PolarHBondContact O-N 3.17Å; A129-N133 PolarHBondContact O-ND2 3.06Å; A129-W168 HydrophobicContact CB-CD2 4.36Å; A129-W168 HydrophobicContact CB-CE3 3.89Å; A129-W168 HydrophobicContact CB-CH2 4.1Å; A129-W168 HydrophobicContact CB-CZ3 3.76Å; A129-S171 VanDerWaalsContact CA-OG 3.22Å; A129-S171 WeakPolarHBondContact CA-OG 3.38Å; A129-S171 PolarHBondContact N-OG 3.06Å
130	S	96.6	Very high	96	Very high	3 Å²	3	12.5 Å²	12.5	2%	0.021	7%	0.069	C	C	.	.	H	α-helix	trans	-61.5	-49	178.2	-69.5	0	0	0	0	112.2	L84 A87 D88 L126 C127 S128 N133 I134	L84-S130 WeakPolarHBondContact CD1-O 2.97Å; A87-S130 WeakPolarHBondContact CB-OG 3.27Å; D88-S130 PolarHBondContact OD1-OG 3.15Å; L126-S130 PolarHBondContact O-N 3.35Å; L126-S130 PolarHBondContact O-OG 3.42Å; C127-S130 PolarHBondContact O-N 2.92Å; S128-S130 VanDerWaalsContact C-N 3.34Å; S128-S130 PolarHBondContact O-N 3.23Å; S130-N133 PolarHBondContact O-N 3.44Å; S130-I134 WeakPolarHBondContact O-CG1 3.35Å; S130-I134 PolarHBondContact O-N 2.86Å
131	I	95.9	Very high	95.9	Very high	5 Å²	5	12.5 Å²	12.5	3%	0.026	7%	0.069	C	C	.	.	H	α-helix	trans	-69.7	-36.6	-178.7	-168.3	49.5	0	0	0	113.5	C127 S128 N133 I134 C135 I207 P211 F454	C127-I131 PolarHBondContact O-N 2.88Å; C127-I131 VanDerWaalsContact O-N 3.14Å; S128-I131 WeakPolarHBondContact O-CG2 3.09Å; S128-I131 PolarHBondContact O-N 3.24Å; I131-N133 VanDerWaalsContact C-N 3.35Å; I131-I134 HydrophobicContact CD1-CB 4.24Å; I131-I134 HydrophobicContact CD1-CD1 4.37Å; I131-I134 HydrophobicContact CD1-CG2 4.33Å; I131-I134 WeakPolarHBondContact O-CB 3.44Å; I131-I134 PolarHBondContact O-N 3.06Å; I131-C135 PolarHBondContact O-N 3.06Å; I131-C135 PolarHBondContact O-SG 3.24Å; I131-I207 WeakPolarHBondContact CG2-O 3.49Å; I131-P211 HydrophobicContact CD1-CB 4.34Å; I131-P211 HydrophobicContact CG1-CB 3.54Å; I131-P211 HydrophobicContact CG1-CG 4.34Å; I131-P211 HydrophobicContact CG2-CG 4.49Å; I131-F454 HydrophobicContact CB-CE1 3.88Å; I131-F454 HydrophobicContact CB-CE2 3.94Å; I131-F454 HydrophobicContact CB-CZ 3.48Å; I131-F454 VanDerWaalsContact CB-CZ 3.48Å; I131-F454 HydrophobicContact CD1-CD1 3.51Å; I131-F454 HydrophobicContact CD1-CD2 4.43Å; I131-F454 HydrophobicContact CD1-CE1 3.43Å; I131-F454 VanDerWaalsContact CD1-CE1 3.43Å; I131-F454 HydrophobicContact CD1-CE2 4.36Å; I131-F454 HydrophobicContact CD1-CG 4.06Å; I131-F454 HydrophobicContact CD1-CZ 3.91Å; I131-F454 HydrophobicContact CG1-CD1 4.32Å; I131-F454 HydrophobicContact CG1-CE1 3.71Å; I131-F454 HydrophobicContact CG1-CZ 3.89Å; I131-F454 HydrophobicContact CG2-CZ 4.42Å
132	L	96.7	Very high	95.8	Very high	41 Å²	41	15.2 Å²	15.2	22%	0.215	8%	0.079	C	C	.	.	H	α-helix	trans	-69.6	-33.7	176.2	-68.2	-176.5	0	0	0	111.8	S128 I134 C135 C136 A167 A170 P211	S128-L132 WeakPolarHBondContact O-CB 3.25Å; S128-L132 WeakPolarHBondContact O-CG 3.32Å; S128-L132 PolarHBondContact O-N 3.4Å; L132-I134 VanDerWaalsContact C-N 3.35Å; L132-C135 VanDerWaalsContact O-CB 3.31Å; L132-C135 WeakPolarHBondContact O-CB 3.1Å; L132-C135 PolarHBondContact O-N 3.23Å; L132-C136 PolarHBondContact O-N 2.93Å; L132-C136 PolarHBondContact O-SG 3.06Å; L132-C136 VanDerWaalsContact O-SG 3.33Å; L132-A167 HydrophobicContact CB-CB 3.75Å; L132-A170 HydrophobicContact CD1-CB 3.77Å; L132-P211 HydrophobicContact CD2-CG 4.43Å
133	N	97.4	Very high	95.6	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-64.5	-39	169.8	-81.7	-68.6	0	0	0	111.8	S83 L84 A129 S130 I131 C135 C136 I137	S83-N133 WeakPolarHBondContact CB-OD1 3.28Å; S83-N133 VanDerWaalsContact OG-CG 3.27Å; S83-N133 PolarHBondContact OG-ND2 3.12Å; S83-N133 PolarHBondContact OG-OD1 2.83Å; L84-N133 HydrophobicContact CB-CB 4.1Å; L84-N133 HydrophobicContact CD1-CB 4.35Å; A129-N133 WeakPolarHBondContact O-CB 3.42Å; A129-N133 PolarHBondContact O-N 3.17Å; A129-N133 PolarHBondContact O-ND2 3.06Å; S130-N133 PolarHBondContact O-N 3.44Å; I131-N133 VanDerWaalsContact C-N 3.35Å; N133-C135 VanDerWaalsContact C-N 3.3Å; N133-C135 PolarHBondContact O-N 3.08Å; N133-C136 WeakPolarHBondContact O-CB 3.3Å; N133-C136 PolarHBondContact O-N 3.27Å; N133-C136 VanDerWaalsContact O-N 3.16Å; N133-I137 VanDerWaalsContact O-CG1 3.31Å; N133-I137 WeakPolarHBondContact O-CG1 3.2Å; N133-I137 PolarHBondContact O-N 3.39Å
134	I	96.5	Very high	95.3	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.005	8%	0.078	C	C	.	.	H	α-helix	trans	-60.8	-39.4	171.6	-69.9	170.3	0	0	0	111.2	L84 S130 I131 L132 I137 S138 V450 V451 F454	L84-I134 HydrophobicContact CD1-CG1 4.25Å; L84-I134 HydrophobicContact CD2-CG1 4.04Å; S130-I134 WeakPolarHBondContact O-CG1 3.35Å; S130-I134 PolarHBondContact O-N 2.86Å; I131-I134 HydrophobicContact CD1-CB 4.24Å; I131-I134 HydrophobicContact CD1-CD1 4.37Å; I131-I134 HydrophobicContact CD1-CG2 4.33Å; I131-I134 WeakPolarHBondContact O-CB 3.44Å; I131-I134 PolarHBondContact O-N 3.06Å; L132-I134 VanDerWaalsContact C-N 3.35Å; I134-I137 PolarHBondContact O-N 2.82Å; I134-S138 WeakPolarHBondContact O-CB 3.13Å; I134-S138 PolarHBondContact O-N 3.26Å; I134-S138 PolarHBondContact O-OG 2.88Å; I134-V450 HydrophobicContact CD1-CG1 4.14Å; I134-V450 HydrophobicContact CG1-CG1 4.18Å; I134-V451 HydrophobicContact CG2-CB 4.49Å; I134-V451 HydrophobicContact CG2-CG2 3.48Å; I134-V451 VanDerWaalsContact CG2-CG2 3.48Å; I134-F454 HydrophobicContact CD1-CB 3.71Å; I134-F454 HydrophobicContact CD1-CD2 3.5Å; I134-F454 HydrophobicContact CD1-CE2 4.37Å; I134-F454 HydrophobicContact CD1-CG 3.7Å
135	C	96.9	Very high	95	Very high	9 Å²	9	14 Å²	14	6%	0.061	8%	0.076	C	C	.	.	H	α-helix	trans	-60.6	-45.9	172.9	-64.7	0	0	0	0	111.2	I131 L132 N133 I137 S138 V139 V215	I131-C135 PolarHBondContact O-N 3.06Å; I131-C135 PolarHBondContact O-SG 3.24Å; L132-C135 VanDerWaalsContact O-CB 3.31Å; L132-C135 WeakPolarHBondContact O-CB 3.1Å; L132-C135 PolarHBondContact O-N 3.23Å; N133-C135 VanDerWaalsContact C-N 3.3Å; N133-C135 PolarHBondContact O-N 3.08Å; C135-I137 PolarHBondContact O-N 3.09Å; C135-S138 WeakPolarHBondContact O-CB 3.29Å; C135-S138 PolarHBondContact O-N 3.49Å; C135-V139 WeakPolarHBondContact O-CG2 3.46Å; C135-V139 PolarHBondContact O-N 3.46Å; C135-V215 HydrophobicContact CB-CG2 4.35Å; C135-V215 WeakPolarHBondContact SG-CG2 3.45Å
136	C	96.9	Very high	94.5	Very high	12 Å²	12	14 Å²	14	8%	0.081	8%	0.077	C	C	.	.	H	α-helix	trans	-58.9	-46.2	176.1	-66.6	0	0	0	0	112.3	Y80 L132 N133 S138 V139 D140 M163	Y80-C136 HydrophobicContact CD1-CB 3.59Å; Y80-C136 HydrophobicContact CE1-CB 3.79Å; Y80-C136 HydrophobicContact CG-CB 4.39Å; L132-C136 PolarHBondContact O-N 2.93Å; L132-C136 PolarHBondContact O-SG 3.06Å; L132-C136 VanDerWaalsContact O-SG 3.33Å; N133-C136 WeakPolarHBondContact O-CB 3.3Å; N133-C136 PolarHBondContact O-N 3.27Å; N133-C136 VanDerWaalsContact O-N 3.16Å; C136-S138 VanDerWaalsContact C-N 3.3Å; C136-S138 PolarHBondContact O-N 3.43Å; C136-V139 PolarHBondContact O-N 3.42Å; C136-D140 WeakPolarHBondContact O-CB 3.35Å; C136-D140 PolarHBondContact O-N 3.21Å; C136-M163 HydrophobicContact CB-CE 4.03Å
137	I	95.4	Very high	94	Very high	2 Å²	2	19 Å²	19	1%	0.01	10%	0.097	C	C	.	.	H	α-helix	trans	-59.9	-45.1	176.2	-58.1	163.6	0	0	0	109.6	Y80 I81 L84 N133 I134 C135 V139 D140 R141 V447	Y80-I137 VanDerWaalsContact CB-CG1 3.46Å; Y80-I137 HydrophobicContact CG-CG1 4.37Å; I81-I137 HydrophobicContact CG1-CD1 4.4Å; L84-I137 HydrophobicContact CD2-CD1 3.99Å; N133-I137 VanDerWaalsContact O-CG1 3.31Å; N133-I137 WeakPolarHBondContact O-CG1 3.2Å; N133-I137 PolarHBondContact O-N 3.39Å; I134-I137 PolarHBondContact O-N 2.82Å; C135-I137 PolarHBondContact O-N 3.09Å; I137-V139 PolarHBondContact O-N 3.33Å; I137-D140 PolarHBondContact O-N 3.43Å; I137-R141 HydrophobicContact CG2-CG 4.28Å; I137-R141 VanDerWaalsContact O-CG 3.28Å; I137-R141 WeakPolarHBondContact O-CG 3.46Å; I137-R141 PolarHBondContact O-N 3.24Å; I137-V447 HydrophobicContact CB-CG1 4.12Å; I137-V447 HydrophobicContact CG2-CB 4.23Å; I137-V447 HydrophobicContact CG2-CG1 3.38Å; I137-V447 HydrophobicContact CG2-CG2 3.7Å
138	S	95.7	Very high	93.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61.8	-43.6	-178.7	-57.1	0	0	0	0	112.3	I134 C135 C136 R141 Y142 Y219	I134-S138 WeakPolarHBondContact O-CB 3.13Å; I134-S138 PolarHBondContact O-N 3.26Å; I134-S138 PolarHBondContact O-OG 2.88Å; C135-S138 WeakPolarHBondContact O-CB 3.29Å; C135-S138 PolarHBondContact O-N 3.49Å; C136-S138 VanDerWaalsContact C-N 3.3Å; C136-S138 PolarHBondContact O-N 3.43Å; S138-R141 PolarHBondContact O-N 2.92Å; S138-Y142 WeakPolarHBondContact O-CB 3.18Å; S138-Y142 PolarHBondContact O-N 3.47Å; S138-Y219 WeakPolarHBondContact OG-CE2 3.31Å
139	V	94.8	Very high	92.8	Very high	52 Å²	52	28.8 Å²	28.8	32%	0.315	15%	0.148	S	C	.	.	H	α-helix	trans	-63.6	-45.4	174.3	172.2	0	0	0	0	111.3	C135 C136 I137 R141 Y142 V143 M163 I218	C135-V139 WeakPolarHBondContact O-CG2 3.46Å; C135-V139 PolarHBondContact O-N 3.46Å; C136-V139 PolarHBondContact O-N 3.42Å; I137-V139 PolarHBondContact O-N 3.33Å; V139-R141 VanDerWaalsContact C-N 3.33Å; V139-R141 PolarHBondContact O-N 3.2Å; V139-Y142 WeakPolarHBondContact O-CB 3.35Å; V139-Y142 PolarHBondContact O-N 3.26Å; V139-Y142 VanDerWaalsContact O-N 3.16Å; V139-V143 HydrophobicContact CG1-CG2 4.37Å; V139-V143 WeakPolarHBondContact O-CG2 3.34Å; V139-V143 PolarHBondContact O-N 3.16Å; V139-M163 HydrophobicContact CB-CE 4.2Å; V139-M163 HydrophobicContact CG1-CE 4.07Å; V139-I218 HydrophobicContact CG2-CD1 3.72Å
140	D	93.9	Very high	92.1	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.011	17%	0.173	C	C	.	.	H	α-helix	trans	-57	-46.6	176.6	171.4	79.8	0	0	0	111.3	T77 Y80 C136 I137 Y142 V143 A144 Y151 Q155	T77-D140 PolarHBondContact OG1-OD2 3.33Å; Y80-D140 HydrophobicContact CD2-CB 4.15Å; Y80-D140 HydrophobicContact CE2-CB 3.65Å; C136-D140 WeakPolarHBondContact O-CB 3.35Å; C136-D140 PolarHBondContact O-N 3.21Å; I137-D140 PolarHBondContact O-N 3.43Å; D140-Y142 PolarHBondContact O-N 3.37Å; D140-V143 PolarHBondContact O-N 2.92Å; D140-A144 WeakPolarHBondContact O-CB 3.36Å; D140-A144 PolarHBondContact O-N 3.26Å; D140-Y151 WeakPolarHBondContact OD1-CE2 3.48Å; D140-Y151 PolarHBondContact OD1-OH 2.89Å; D140-Y151 PolarHBondContact OD2-OH 2.85Å; D140-Q155 PolarHBondContact OD1-NE2 3.4Å
141	R	93.1	Very high	91.6	Very high	8 Å²	8	36.1 Å²	36.1	3%	0.03	18%	0.179	C	C	.	.	H	α-helix	trans	-63.3	-41.6	175.8	-62.3	-58.5	77.5	-158.4	-11.3	111.9	T77 I137 S138 V139 V143 A144 I145 Y151 I222 E440 V447	T77-R141 VanDerWaalsContact OG1-CZ 3.28Å; T77-R141 PolarHBondContact OG1-NH2 3.2Å; I137-R141 HydrophobicContact CG2-CG 4.28Å; I137-R141 VanDerWaalsContact O-CG 3.28Å; I137-R141 WeakPolarHBondContact O-CG 3.46Å; I137-R141 PolarHBondContact O-N 3.24Å; S138-R141 PolarHBondContact O-N 2.92Å; V139-R141 VanDerWaalsContact C-N 3.33Å; V139-R141 PolarHBondContact O-N 3.2Å; R141-V143 PolarHBondContact O-N 3.21Å; R141-A144 PolarHBondContact O-N 3.09Å; R141-I145 VanDerWaalsContact O-CD1 3.28Å; R141-I145 WeakPolarHBondContact O-CD1 3.45Å; R141-I145 VanDerWaalsContact O-CG1 3.24Å; R141-I145 WeakPolarHBondContact O-CG1 3.28Å; R141-I145 PolarHBondContact O-N 3.26Å; R141-Y151 PolarHBondContact NH2-OH 3.43Å; R141-I222 HydrophobicContact CB-CD1 4.25Å; R141-E440 IonicContact CZ-OE2 2.97Å; R141-E440 IonicContact NH1-OE2 3.9Å; R141-E440 PolarHBondContact NH1-OE2 3.34Å; R141-V447 HydrophobicContact CG-CG2 4.09Å
142	Y	92.9	Very high	91	Very high	57 Å²	57	41.1 Å²	41.1	22%	0.224	21%	0.21	C	C	.	.	H	α-helix	trans	-58.7	-48.1	176.7	177.6	-95.7	0	0	0	112	S138 V139 D140 I145 N146 Y147 I218 R221 I222	S138-Y142 WeakPolarHBondContact O-CB 3.18Å; S138-Y142 PolarHBondContact O-N 3.47Å; V139-Y142 WeakPolarHBondContact O-CB 3.35Å; V139-Y142 PolarHBondContact O-N 3.26Å; V139-Y142 VanDerWaalsContact O-N 3.16Å; D140-Y142 PolarHBondContact O-N 3.37Å; Y142-I145 PolarHBondContact O-N 2.93Å; Y142-N146 WeakPolarHBondContact CD2-ND2 3.47Å; Y142-N146 WeakPolarHBondContact CE2-ND2 3.18Å; Y142-N146 WeakPolarHBondContact O-CB 3.45Å; Y142-N146 PolarHBondContact O-N 3.23Å; Y142-N146 PolarHBondContact O-ND2 3.27Å; Y142-Y147 HydrophobicContact CE1-CE2 4.3Å; Y142-I218 HydrophobicContact CD2-CG2 4.21Å; Y142-I218 HydrophobicContact CG-CG2 4.28Å; Y142-R221 HydrophobicContact CD2-CB 4.3Å; Y142-R221 HydrophobicContact CE2-CB 3.7Å; Y142-R221 HydrophobicContact CE2-CG 4.48Å; Y142-I222 HydrophobicContact CD2-CG1 3.94Å
143	V	91.7	Very high	90.2	Very high	40 Å²	40	43.7 Å²	43.7	24%	0.242	23%	0.231	C	C	.	.	H	α-helix	trans	-67	-42.6	-179.8	179.6	0	0	0	0	110.8	V139 D140 R141 I145 Y147 Y151	V139-V143 HydrophobicContact CG1-CG2 4.37Å; V139-V143 WeakPolarHBondContact O-CG2 3.34Å; V139-V143 PolarHBondContact O-N 3.16Å; D140-V143 PolarHBondContact O-N 2.92Å; R141-V143 PolarHBondContact O-N 3.21Å; V143-I145 VanDerWaalsContact C-N 3.29Å; V143-I145 PolarHBondContact O-N 3.03Å; V143-Y147 CarbonylContact O-C 3.54Å; V143-Y147 WeakPolarHBondContact O-CA 3.19Å; V143-Y147 PolarHBondContact O-N 3.05Å; V143-Y151 HydrophobicContact CB-CD2 4.32Å; V143-Y151 HydrophobicContact CG1-CD2 4Å
144	A	90.4	Very high	89.4	Confident	9 Å²	9	50.6 Å²	50.6	7%	0.074	26%	0.261	C	S	.	.	H	α-helix	trans	-57.9	-40.7	177.9	0	0	0	0	0	112.4	D140 R141 Y151	D140-A144 WeakPolarHBondContact O-CB 3.36Å; D140-A144 PolarHBondContact O-N 3.26Å; R141-A144 PolarHBondContact O-N 3.09Å; A144-Y151 HydrophobicContact CB-CD1 4.25Å; A144-Y151 HydrophobicContact CB-CD2 3.83Å; A144-Y151 HydrophobicContact CB-CE1 4.26Å; A144-Y151 HydrophobicContact CB-CE2 3.83Å; A144-Y151 HydrophobicContact CB-CG 4.04Å
145	I	88	Confident	88.9	Confident	8 Å²	8	52.1 Å²	52.1	4%	0.041	27%	0.268	C	S	.	.	H	α-helix	trans	-78.4	-48.1	-178.6	-64.5	160.2	0	0	0	111.2	R141 Y142 V143 I222 V225 I226 R229 V444	R141-I145 VanDerWaalsContact O-CD1 3.28Å; R141-I145 WeakPolarHBondContact O-CD1 3.45Å; R141-I145 VanDerWaalsContact O-CG1 3.24Å; R141-I145 WeakPolarHBondContact O-CG1 3.28Å; R141-I145 PolarHBondContact O-N 3.26Å; Y142-I145 PolarHBondContact O-N 2.93Å; V143-I145 VanDerWaalsContact C-N 3.29Å; V143-I145 PolarHBondContact O-N 3.03Å; I145-I222 HydrophobicContact CD1-CB 4.36Å; I145-I222 HydrophobicContact CD1-CD1 4.37Å; I145-I222 HydrophobicContact CD1-CG1 4.15Å; I145-I222 HydrophobicContact CD1-CG2 3.41Å; I145-I222 VanDerWaalsContact CD1-CG2 3.41Å; I145-V225 HydrophobicContact CG2-CG1 3.94Å; I145-I226 HydrophobicContact CD1-CD1 4.42Å; I145-I226 HydrophobicContact CG2-CG1 4.4Å; I145-R229 PolarHBondContact O-NH1 3.5Å; I145-R229 PolarHBondContact O-NH2 2.9Å; I145-V444 HydrophobicContact CD1-CG2 3.25Å; I145-V444 HydrophobicContact CG1-CG2 4.23Å
146	N	86.6	Confident	88.6	Confident	30 Å²	30	54.5 Å²	54.5	16%	0.16	28%	0.283	C	S	.	.	H	α-helix	trans	-74.4	-35.7	-173.5	-76.1	-69.7	0	0	0	112.6	Y142 V225	Y142-N146 WeakPolarHBondContact CD2-ND2 3.47Å; Y142-N146 WeakPolarHBondContact CE2-ND2 3.18Å; Y142-N146 WeakPolarHBondContact O-CB 3.45Å; Y142-N146 PolarHBondContact O-N 3.23Å; Y142-N146 PolarHBondContact O-ND2 3.27Å; N146-V225 WeakPolarHBondContact OD1-CG2 3.41Å
147	Y	86.7	Confident	88.4	Confident	107 Å²	107	60.8 Å²	60.8	42%	0.42	31%	0.305	S	S	.	.			trans	-132.7	62.6	-171.4	-49.6	-70.7	0	0	0	112.1	Y142 V143 M149 K150 Y151	Y142-Y147 HydrophobicContact CE1-CE2 4.3Å; V143-Y147 CarbonylContact O-C 3.54Å; V143-Y147 WeakPolarHBondContact O-CA 3.19Å; V143-Y147 PolarHBondContact O-N 3.05Å; Y147-M149 VanDerWaalsContact C-N 3.34Å; Y147-M149 PolarHBondContact O-N 3.26Å; Y147-K150 HydrophobicContact CD1-CD 4.5Å; Y147-K150 HydrophobicContact CG-CD 4.45Å; Y147-K150 CarbonylContact O-C 3.59Å; Y147-K150 PolarHBondContact O-N 3.28Å; Y147-Y151 WeakPolarHBondContact O-CB 3.13Å; Y147-Y151 PolarHBondContact O-N 3.4Å
148	P	84.4	Confident	88.3	Confident	65 Å²	65	71 Å²	71	42%	0.422	34%	0.343	S	S	.	.	H	α-helix	trans	-58	-42.2	-172.4	22.6	-34	0	0	0	113.2	K150 Y151 T152	P148-K150 VanDerWaalsContact C-N 3.35Å; P148-K150 PolarHBondContact O-N 3.34Å; P148-Y151 PolarHBondContact O-N 3.38Å; P148-T152 PolarHBondContact O-N 3.28Å; P148-T152 PolarHBondContact O-OG1 3.37Å
149	M	81.7	Confident	88.2	Confident	154 Å²	154	73.3 Å²	73.3	76%	0.759	36%	0.358	S	S	*	.	H	α-helix	trans	-67	-35	178.4	-61.1	-56.9	-66	0	0	112.5	Y147 T152 S153	Y147-M149 VanDerWaalsContact C-N 3.34Å; Y147-M149 PolarHBondContact O-N 3.26Å; M149-T152 PolarHBondContact O-OG1 2.73Å; M149-S153 WeakPolarHBondContact O-CB 3.32Å; M149-S153 PolarHBondContact O-N 2.93Å
150	K	81.9	Confident	88.2	Confident	119 Å²	119	70.9 Å²	70.9	52%	0.517	34%	0.343	S	S	.	.	H	α-helix	trans	-74.5	-37.2	174.9	-64.2	-176	179.6	176.8	0	110.6	Y147 P148 S153 K154	Y147-K150 HydrophobicContact CD1-CD 4.5Å; Y147-K150 HydrophobicContact CG-CD 4.45Å; Y147-K150 CarbonylContact O-C 3.59Å; Y147-K150 PolarHBondContact O-N 3.28Å; P148-K150 VanDerWaalsContact C-N 3.35Å; P148-K150 PolarHBondContact O-N 3.34Å; K150-S153 PolarHBondContact O-N 3.28Å; K150-K154 WeakPolarHBondContact O-CA 3.35Å; K150-K154 VanDerWaalsContact O-CB 3.26Å; K150-K154 WeakPolarHBondContact O-CB 3.33Å; K150-K154 PolarHBondContact O-N 3.34Å
151	Y	87.1	Confident	88.4	Confident	37 Å²	37	76.6 Å²	76.6	15%	0.145	37%	0.368	C	S	.	.	H	α-helix	trans	-59.7	-48.5	177.1	-172.5	-95.6	0	0	0	110.9	D140 R141 V143 A144 Y147 P148 S153 Q155	D140-Y151 WeakPolarHBondContact OD1-CE2 3.48Å; D140-Y151 PolarHBondContact OD1-OH 2.89Å; D140-Y151 PolarHBondContact OD2-OH 2.85Å; R141-Y151 PolarHBondContact NH2-OH 3.43Å; V143-Y151 HydrophobicContact CB-CD2 4.32Å; V143-Y151 HydrophobicContact CG1-CD2 4Å; A144-Y151 HydrophobicContact CB-CD1 4.25Å; A144-Y151 HydrophobicContact CB-CD2 3.83Å; A144-Y151 HydrophobicContact CB-CE1 4.26Å; A144-Y151 HydrophobicContact CB-CE2 3.83Å; A144-Y151 HydrophobicContact CB-CG 4.04Å; Y147-Y151 WeakPolarHBondContact O-CB 3.13Å; Y147-Y151 PolarHBondContact O-N 3.4Å; P148-Y151 PolarHBondContact O-N 3.38Å; Y151-S153 PolarHBondContact O-N 3.5Å; Y151-Q155 HydrophobicContact CD1-CB 4.37Å; Y151-Q155 HydrophobicContact CD2-CB 3.77Å; Y151-Q155 HydrophobicContact CD2-CG 3.97Å; Y151-Q155 HydrophobicContact CE1-CB 4.37Å; Y151-Q155 HydrophobicContact CE1-CG 4.47Å; Y151-Q155 HydrophobicContact CE2-CB 3.79Å; Y151-Q155 HydrophobicContact CE2-CG 3.48Å; Y151-Q155 VanDerWaalsContact CE2-CG 3.48Å; Y151-Q155 HydrophobicContact CG-CB 4.08Å; Y151-Q155 WeakPolarHBondContact O-CB 3.41Å; Y151-Q155 PolarHBondContact O-N 2.91Å
152	T	82.1	Confident	88.6	Confident	110 Å²	110	81.8 Å²	81.8	68%	0.675	40%	0.396	S	S	*	.	H	α-helix	trans	-64.1	-25.2	177.9	51.1	0	0	0	0	114	P148 M149	P148-T152 PolarHBondContact O-N 3.28Å; P148-T152 PolarHBondContact O-OG1 3.37Å; M149-T152 PolarHBondContact O-OG1 2.73Å
153	S	80.1	Confident	88.8	Confident	95 Å²	95	81.6 Å²	81.6	66%	0.664	40%	0.397	S	S	*	.	H	α-helix	trans	-95.9	-35.8	-177.7	169	0	0	0	0	113.5	M149 K150 Y151	M149-S153 WeakPolarHBondContact O-CB 3.32Å; M149-S153 PolarHBondContact O-N 2.93Å; K150-S153 PolarHBondContact O-N 3.28Å; Y151-S153 PolarHBondContact O-N 3.5Å
154	K	80.7	Confident	89.1	Confident	145 Å²	145	80.6 Å²	80.6	63%	0.63	39%	0.39	S	S	*	.	H	α-helix	trans	-108.3	-27.6	-170.4	-62.6	-168.1	174.3	-161.7	0	113.7	K150 T156	K150-K154 WeakPolarHBondContact O-CA 3.35Å; K150-K154 VanDerWaalsContact O-CB 3.26Å; K150-K154 WeakPolarHBondContact O-CB 3.33Å; K150-K154 PolarHBondContact O-N 3.34Å; K154-T156 PolarHBondContact O-N 2.97Å
155	Q	85.2	Confident	89.5	Confident	33 Å²	33	81.7 Å²	81.7	15%	0.154	40%	0.403	C	S	.	.			trans	-74	114.5	-178.5	-162.9	72.5	2.1	0	0	108.6	I76 Y80 D140 Y151	I76-Q155 HydrophobicContact CB-CG 4.48Å; I76-Q155 HydrophobicContact CD1-CB 4.04Å; I76-Q155 HydrophobicContact CD1-CG 3.64Å; I76-Q155 WeakPolarHBondContact CD1-O 3.07Å; I76-Q155 HydrophobicContact CG2-CG 3.95Å; Y80-Q155 PolarHBondContact OH-NE2 3.4Å; D140-Q155 PolarHBondContact OD1-NE2 3.4Å; Y151-Q155 HydrophobicContact CD1-CB 4.37Å; Y151-Q155 HydrophobicContact CD2-CB 3.77Å; Y151-Q155 HydrophobicContact CD2-CG 3.97Å; Y151-Q155 HydrophobicContact CE1-CB 4.37Å; Y151-Q155 HydrophobicContact CE1-CG 4.47Å; Y151-Q155 HydrophobicContact CE2-CB 3.79Å; Y151-Q155 HydrophobicContact CE2-CG 3.48Å; Y151-Q155 VanDerWaalsContact CE2-CG 3.48Å; Y151-Q155 HydrophobicContact CG-CB 4.08Å; Y151-Q155 WeakPolarHBondContact O-CB 3.41Å; Y151-Q155 PolarHBondContact O-N 2.91Å
156	T	91.7	Very high	90	Very high	60 Å²	60	84.8 Å²	84.8	37%	0.368	43%	0.425	S	S	.	.			trans	-123.3	166.5	-179.3	66	0	0	0	0	110.6	K154 R158 T159 A160	K154-T156 PolarHBondContact O-N 2.97Å; T156-R158 PolarHBondContact O-N 3.4Å; T156-T159 PolarHBondContact N-OG1 2.86Å; T156-T159 VanDerWaalsContact N-OG1 3.09Å; T156-T159 PolarHBondContact O-N 2.94Å; T156-T159 PolarHBondContact O-OG1 2.97Å; T156-T159 PolarHBondContact OG1-N 3.37Å; T156-T159 PolarHBondContact OG1-OG1 3.32Å; T156-A160 PolarHBondContact O-N 3.3Å
157	R	91.9	Very high	90.5	Very high	143 Å²	143	83.7 Å²	83.7	54%	0.54	42%	0.419	S	S	.	.	H	α-helix	trans	-62.4	-35.5	171.6	-68.7	-174.9	174.8	171.9	-1.9	111.7	R74 L79 T159 A160 F161	R74-R157 PolarHBondContact O-NH2 3.4Å; L79-R157 HydrophobicContact CD1-CB 4.45Å; L79-R157 HydrophobicContact CD1-CG 4.17Å; R157-T159 PolarHBondContact O-N 3.37Å; R157-A160 PolarHBondContact O-N 3.15Å; R157-F161 HydrophobicContact CB-CD2 4.37Å; R157-F161 HydrophobicContact CB-CE2 4.24Å; R157-F161 WeakPolarHBondContact O-CD2 3.49Å; R157-F161 PolarHBondContact O-N 2.85Å
158	R	93.5	Very high	91.1	Very high	216 Å²	216	80.8 Å²	80.8	82%	0.815	41%	0.408	S	S	*	.	H	α-helix	trans	-61.1	-45.1	178.1	-66.8	-176.7	180	172.5	-0.6	111.7	T156 A160 F161 L162	T156-R158 PolarHBondContact O-N 3.4Å; R158-A160 VanDerWaalsContact C-N 3.3Å; R158-A160 PolarHBondContact O-N 3.46Å; R158-F161 PolarHBondContact O-N 2.95Å; R158-L162 WeakPolarHBondContact O-CB 3.34Å; R158-L162 PolarHBondContact O-N 3.14Å
159	T	93.7	Very high	91.7	Very high	50 Å²	50	82 Å²	82	31%	0.307	41%	0.414	S	S	.	.	H	α-helix	trans	-65	-35.4	176.9	54.2	0	0	0	0	112	T156 R157 M163	T156-T159 PolarHBondContact N-OG1 2.86Å; T156-T159 VanDerWaalsContact N-OG1 3.09Å; T156-T159 PolarHBondContact O-N 2.94Å; T156-T159 PolarHBondContact O-OG1 2.97Å; T156-T159 PolarHBondContact OG1-N 3.37Å; T156-T159 PolarHBondContact OG1-OG1 3.32Å; R157-T159 PolarHBondContact O-N 3.37Å; T159-M163 WeakPolarHBondContact O-CG 3.12Å; T159-M163 PolarHBondContact O-N 2.93Å
160	A	95.7	Very high	92.4	Very high	0 Å²	0	76.7 Å²	76.7	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-68.3	-45.9	175.8	0	0	0	0	0	112.8	I76 L79 Y80 T156 R157 R158 L162 M163 I164	I76-A160 HydrophobicContact CG2-CB 3.62Å; L79-A160 HydrophobicContact CD1-CB 4.26Å; Y80-A160 HydrophobicContact CE1-CB 4.12Å; Y80-A160 HydrophobicContact CE2-CB 4.22Å; Y80-A160 WeakPolarHBondContact OH-CA 3.45Å; T156-A160 PolarHBondContact O-N 3.3Å; R157-A160 PolarHBondContact O-N 3.15Å; R158-A160 VanDerWaalsContact C-N 3.3Å; R158-A160 PolarHBondContact O-N 3.46Å; A160-L162 VanDerWaalsContact C-N 3.28Å; A160-L162 PolarHBondContact O-N 2.86Å; A160-M163 PolarHBondContact O-N 3.01Å; A160-I164 WeakPolarHBondContact O-CB 3.39Å; A160-I164 WeakPolarHBondContact O-CG1 3.36Å; A160-I164 PolarHBondContact O-N 2.92Å
161	F	97.4	Very high	93.1	Very high	123 Å²	123	71 Å²	71	54%	0.539	37%	0.37	S	S	.	.	H	α-helix	trans	-61.4	-37.2	174.6	-76.3	-61.3	0	0	0	112.4	L79 R157 R158 G165	L79-F161 HydrophobicContact CD1-CE2 4.4Å; L79-F161 HydrophobicContact CD1-CZ 4.38Å; R157-F161 HydrophobicContact CB-CD2 4.37Å; R157-F161 HydrophobicContact CB-CE2 4.24Å; R157-F161 WeakPolarHBondContact O-CD2 3.49Å; R157-F161 PolarHBondContact O-N 2.85Å; R158-F161 PolarHBondContact O-N 2.95Å; F161-G165 PolarHBondContact O-N 3.27Å
162	L	97.3	Very high	93.5	Very high	117 Å²	117	74.5 Å²	74.5	61%	0.613	39%	0.386	S	S	*	.	H	α-helix	trans	-61.6	-49.5	173.8	-178.5	65.9	0	0	0	111.5	R158 A160 I164 G165 C166	R158-L162 WeakPolarHBondContact O-CB 3.34Å; R158-L162 PolarHBondContact O-N 3.14Å; A160-L162 VanDerWaalsContact C-N 3.28Å; A160-L162 PolarHBondContact O-N 2.86Å; L162-I164 PolarHBondContact O-N 3.13Å; L162-G165 PolarHBondContact O-N 2.77Å; L162-C166 PolarHBondContact O-N 3.29Å; L162-C166 PolarHBondContact O-SG 3.32Å
163	M	97.2	Very high	94.1	Very high	52 Å²	52	74.3 Å²	74.3	26%	0.256	38%	0.38	S	S	.	.	H	α-helix	trans	-61	-43.8	178.2	-73.4	175.2	66.6	0	0	112.4	Y80 C136 V139 T159 A160 C166 A167	Y80-M163 HydrophobicContact CE1-CB 4.03Å; Y80-M163 HydrophobicContact CE1-CE 4.31Å; Y80-M163 HydrophobicContact CE1-SD 4.36Å; Y80-M163 PolarHBondContact OH-SD 3.06Å; C136-M163 HydrophobicContact CB-CE 4.03Å; V139-M163 HydrophobicContact CB-CE 4.2Å; V139-M163 HydrophobicContact CG1-CE 4.07Å; T159-M163 WeakPolarHBondContact O-CG 3.12Å; T159-M163 PolarHBondContact O-N 2.93Å; A160-M163 PolarHBondContact O-N 3.01Å; M163-C166 PolarHBondContact O-N 3.29Å; M163-A167 PolarHBondContact O-N 3.07Å
164	I	98.5	Very high	94.6	Very high	19 Å²	19	71.4 Å²	71.4	10%	0.097	36%	0.358	C	S	.	.	H	α-helix	trans	-60.8	-48.9	175.2	-71.5	166.3	0	0	0	109.8	L79 Y80 S83 A160 L162 C166 A167 W168	L79-I164 HydrophobicContact CB-CD1 4.22Å; Y80-I164 HydrophobicContact CD1-CD1 3.9Å; Y80-I164 HydrophobicContact CD1-CG1 3.64Å; Y80-I164 HydrophobicContact CE1-CD1 4.33Å; Y80-I164 HydrophobicContact CE1-CG1 4Å; S83-I164 WeakPolarHBondContact OG-CG2 3.41Å; A160-I164 WeakPolarHBondContact O-CB 3.39Å; A160-I164 WeakPolarHBondContact O-CG1 3.36Å; A160-I164 PolarHBondContact O-N 2.92Å; L162-I164 PolarHBondContact O-N 3.13Å; I164-C166 VanDerWaalsContact C-N 3.33Å; I164-C166 PolarHBondContact O-N 3.38Å; I164-A167 WeakPolarHBondContact O-CB 3.18Å; I164-A167 PolarHBondContact O-N 2.93Å; I164-W168 PolarHBondContact O-N 3.25Å
165	G	98.3	Very high	95	Very high	33 Å²	33	65.5 Å²	65.5	34%	0.34	33%	0.333	S	S	.	.	H	α-helix	trans	-56.2	-45.4	176.8	0	0	0	0	0	112.3	F161 L162 A167 W168 V169	F161-G165 PolarHBondContact O-N 3.27Å; L162-G165 PolarHBondContact O-N 2.77Å; G165-A167 VanDerWaalsContact C-N 3.34Å; G165-A167 PolarHBondContact O-N 2.85Å; G165-W168 PolarHBondContact O-N 3.12Å; G165-V169 WeakPolarHBondContact O-CB 3.36Å; G165-V169 VanDerWaalsContact O-CG2 3.28Å; G165-V169 WeakPolarHBondContact O-CG2 3.33Å; G165-V169 PolarHBondContact O-N 3.26Å
166	C	98.1	Very high	95.2	Very high	73 Å²	73	66.1 Å²	66.1	49%	0.493	34%	0.339	S	S	.	.	H	α-helix	trans	-60.7	-41	174.5	-67.4	0	0	0	0	112.5	L162 M163 I164 A170	L162-C166 PolarHBondContact O-N 3.29Å; L162-C166 PolarHBondContact O-SG 3.32Å; M163-C166 PolarHBondContact O-N 3.29Å; I164-C166 VanDerWaalsContact C-N 3.33Å; I164-C166 PolarHBondContact O-N 3.38Å; C166-A170 WeakPolarHBondContact O-CB 3.33Å; C166-A170 PolarHBondContact O-N 3.26Å
167	A	97.9	Very high	95	Very high	6 Å²	6	65.3 Å²	65.3	5%	0.05	34%	0.335	C	S	.	.	H	α-helix	trans	-63.1	-43.9	177.4	0	0	0	0	0	112	L132 M163 I164 G165 S171	L132-A167 HydrophobicContact CB-CB 3.75Å; M163-A167 PolarHBondContact O-N 3.07Å; I164-A167 WeakPolarHBondContact O-CB 3.18Å; I164-A167 PolarHBondContact O-N 2.93Å; G165-A167 VanDerWaalsContact C-N 3.34Å; G165-A167 PolarHBondContact O-N 2.85Å; A167-S171 WeakPolarHBondContact O-CB 3.48Å; A167-S171 PolarHBondContact O-N 2.97Å; A167-S171 PolarHBondContact O-OG 3.06Å
168	W	98.6	Very high	94.7	Very high	47 Å²	47	58.5 Å²	58.5	18%	0.178	31%	0.309	C	S	.	.	H	α-helix	trans	-68.1	-43.5	177.1	-76.2	102	0	0	0	112.4	S83 L86 A87 L90 F125 L126 A129 I164 G165 S171 F172	S83-W168 PolarHBondContact OG-NE1 2.83Å; L86-W168 HydrophobicContact CB-CZ2 4.48Å; L86-W168 HydrophobicContact CD2-CZ2 4.19Å; L86-W168 HydrophobicContact CG-CH2 4.49Å; L86-W168 HydrophobicContact CG-CZ2 4.33Å; A87-W168 HydrophobicContact CB-CH2 3.85Å; A87-W168 HydrophobicContact CB-CZ2 4.17Å; L90-W168 HydrophobicContact CD1-CH2 4.21Å; F125-W168 HydrophobicContact CE1-CE3 4.23Å; F125-W168 AromaticContact CE1-CZ3 3.87Å; F125-W168 HydrophobicContact CE1-CZ3 3.87Å; F125-W168 AromaticContact CE2-CE3 3.73Å; F125-W168 HydrophobicContact CE2-CE3 3.73Å; F125-W168 HydrophobicContact CE2-CZ3 4.14Å; F125-W168 AromaticContact CZ-CE3 3.36Å; F125-W168 HydrophobicContact CZ-CE3 3.36Å; F125-W168 AromaticContact CZ-CZ3 3.48Å; F125-W168 HydrophobicContact CZ-CZ3 3.48Å; F125-W168 VanDerWaalsContact CZ-CZ3 3.48Å; L126-W168 HydrophobicContact CD2-CZ3 4.33Å; A129-W168 HydrophobicContact CB-CD2 4.36Å; A129-W168 HydrophobicContact CB-CE3 3.89Å; A129-W168 HydrophobicContact CB-CH2 4.1Å; A129-W168 HydrophobicContact CB-CZ3 3.76Å; I164-W168 PolarHBondContact O-N 3.25Å; G165-W168 PolarHBondContact O-N 3.12Å; W168-S171 PolarHBondContact O-N 3.4Å; W168-F172 WeakPolarHBondContact O-CB 3.31Å; W168-F172 PolarHBondContact O-N 3.37Å
169	V	98	Very high	94.4	Very high	91 Å²	91	50.4 Å²	50.4	55%	0.552	28%	0.282	S	S	*	.	H	α-helix	trans	-63	-46.6	176.8	171.1	0	0	0	0	111	G165 S171 F172 L173	G165-V169 WeakPolarHBondContact O-CB 3.36Å; G165-V169 VanDerWaalsContact O-CG2 3.28Å; G165-V169 WeakPolarHBondContact O-CG2 3.33Å; G165-V169 PolarHBondContact O-N 3.26Å; V169-S171 VanDerWaalsContact C-N 3.28Å; V169-S171 PolarHBondContact O-N 3.42Å; V169-F172 WeakPolarHBondContact O-CB 3.33Å; V169-F172 PolarHBondContact O-N 3.12Å; V169-L173 WeakPolarHBondContact O-CG 3.12Å; V169-L173 PolarHBondContact O-N 3.41Å
170	A	96.2	Very high	94.1	Very high	42 Å²	42	56.6 Å²	56.6	35%	0.347	31%	0.305	S	S	.	.	H	α-helix	trans	-60.2	-40	176.7	0	0	0	0	0	111.8	L132 C166 L173 V174	L132-A170 HydrophobicContact CD1-CB 3.77Å; C166-A170 WeakPolarHBondContact O-CB 3.33Å; C166-A170 PolarHBondContact O-N 3.26Å; A170-L173 PolarHBondContact O-N 3.46Å; A170-V174 PolarHBondContact O-N 2.88Å
171	S	96.9	Very high	93.4	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-67.8	-37.2	176.1	-55.7	0	0	0	0	112.6	F125 S128 A129 A167 W168 V169 L173 V174 M175	F125-S171 WeakPolarHBondContact O-CB 3.41Å; S128-S171 PolarHBondContact O-OG 3.43Å; S128-S171 WeakPolarHBondContact OG-CA 3.4Å; S128-S171 WeakPolarHBondContact OG-CB 3.46Å; S128-S171 PolarHBondContact OG-OG 2.84Å; A129-S171 VanDerWaalsContact CA-OG 3.22Å; A129-S171 WeakPolarHBondContact CA-OG 3.38Å; A129-S171 PolarHBondContact N-OG 3.06Å; A167-S171 WeakPolarHBondContact O-CB 3.48Å; A167-S171 PolarHBondContact O-N 2.97Å; A167-S171 PolarHBondContact O-OG 3.06Å; W168-S171 PolarHBondContact O-N 3.4Å; V169-S171 VanDerWaalsContact C-N 3.28Å; V169-S171 PolarHBondContact O-N 3.42Å; S171-L173 VanDerWaalsContact C-N 3.3Å; S171-L173 PolarHBondContact O-N 2.91Å; S171-V174 WeakPolarHBondContact O-CB 3.45Å; S171-V174 PolarHBondContact O-N 3.44Å; S171-M175 PolarHBondContact O-N 3.24Å
172	F	95.3	Very high	92.6	Very high	109 Å²	109	55.7 Å²	55.7	48%	0.478	32%	0.318	S	S	.	.	H	α-helix	trans	-64.2	-36.8	174.9	-177.9	-90.1	0	0	0	111.3	F125 W168 V169 V174 M175	F125-F172 HydrophobicContact CD2-CB 4.31Å; F125-F172 HydrophobicContact CE2-CB 4.01Å; W168-F172 WeakPolarHBondContact O-CB 3.31Å; W168-F172 PolarHBondContact O-N 3.37Å; V169-F172 WeakPolarHBondContact O-CB 3.33Å; V169-F172 PolarHBondContact O-N 3.12Å; F172-V174 VanDerWaalsContact C-N 3.29Å; F172-V174 PolarHBondContact O-N 3.07Å; F172-M175 HydrophobicContact CD2-CE 3.7Å; F172-M175 HydrophobicContact CE2-CE 3.38Å; F172-M175 HydrophobicContact CZ-CE 4.03Å; F172-M175 WeakPolarHBondContact O-CB 3.2Å; F172-M175 PolarHBondContact O-N 2.82Å; F172-M175 VanDerWaalsContact O-N 3.08Å
173	L	93.4	Very high	92	Very high	106 Å²	106	51.6 Å²	51.6	56%	0.555	30%	0.296	S	S	*	.	H	α-helix	trans	-63.6	-35.8	174.8	-67	174.6	0	0	0	112.3	V169 A170 S171 M175 T176	V169-L173 WeakPolarHBondContact O-CG 3.12Å; V169-L173 PolarHBondContact O-N 3.41Å; A170-L173 PolarHBondContact O-N 3.46Å; S171-L173 VanDerWaalsContact C-N 3.3Å; S171-L173 PolarHBondContact O-N 2.91Å; L173-M175 PolarHBondContact O-N 2.92Å; L173-T176 WeakPolarHBondContact O-CB 3.28Å; L173-T176 WeakPolarHBondContact O-CG2 3.37Å; L173-T176 PolarHBondContact O-N 2.99Å; L173-T176 VanDerWaalsContact O-N 3.17Å; L173-T176 PolarHBondContact O-OG1 3.42Å
174	V	91.1	Very high	91.4	Very high	35 Å²	35	50.7 Å²	50.7	21%	0.212	29%	0.291	C	S	.	.	H	α-helix	trans	-62.5	-27.5	173.8	172.3	0	0	0	0	112.1	L124 A170 S171 F172 T176 P177 I207	L124-V174 HydrophobicContact CB-CG1 4.28Å; A170-V174 PolarHBondContact O-N 2.88Å; S171-V174 WeakPolarHBondContact O-CB 3.45Å; S171-V174 PolarHBondContact O-N 3.44Å; F172-V174 VanDerWaalsContact C-N 3.29Å; F172-V174 PolarHBondContact O-N 3.07Å; V174-T176 VanDerWaalsContact C-N 3.27Å; V174-T176 PolarHBondContact O-N 2.92Å; V174-P177 WeakPolarHBondContact O-CD 3.46Å; V174-I207 HydrophobicContact CG1-CD1 3.34Å; V174-I207 HydrophobicContact CG1-CG1 3.77Å; V174-I207 HydrophobicContact CG2-CG1 4.36Å
175	M	90	Very high	90.7	Very high	20 Å²	20	53.2 Å²	53.2	10%	0.099	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-17.8	177.4	-167.5	176.7	70.6	0	0	113.7	S121 L122 F125 S171 F172 L173 P178 I179	S121-M175 VanDerWaalsContact CB-CG 3.43Å; S121-M175 WeakPolarHBondContact O-CG 3.22Å; L122-M175 HydrophobicContact CD2-SD 4.34Å; F125-M175 HydrophobicContact CB-CB 4.12Å; F125-M175 HydrophobicContact CB-CG 4.18Å; F125-M175 HydrophobicContact CB-SD 3.91Å; F125-M175 HydrophobicContact CG-SD 4.28Å; S171-M175 PolarHBondContact O-N 3.24Å; F172-M175 HydrophobicContact CD2-CE 3.7Å; F172-M175 HydrophobicContact CE2-CE 3.38Å; F172-M175 HydrophobicContact CZ-CE 4.03Å; F172-M175 WeakPolarHBondContact O-CB 3.2Å; F172-M175 PolarHBondContact O-N 2.82Å; F172-M175 VanDerWaalsContact O-N 3.08Å; L173-M175 PolarHBondContact O-N 2.92Å; M175-P178 WeakPolarHBondContact O-CD 3.37Å; M175-I179 HydrophobicContact CE-CD1 3.59Å; M175-I179 HydrophobicContact CG-CD1 3.88Å; M175-I179 HydrophobicContact SD-CD1 4.14Å
176	T	88.3	Confident	90.1	Very high	46 Å²	46	54.5 Å²	54.5	28%	0.282	30%	0.301	S	S	.	.	H	α-helix	trans	-66.2	-39.2	-170.4	60.3	0	0	0	0	115.3	L173 V174 I179 F180	L173-T176 WeakPolarHBondContact O-CB 3.28Å; L173-T176 WeakPolarHBondContact O-CG2 3.37Å; L173-T176 PolarHBondContact O-N 2.99Å; L173-T176 VanDerWaalsContact O-N 3.17Å; L173-T176 PolarHBondContact O-OG1 3.42Å; V174-T176 VanDerWaalsContact C-N 3.27Å; V174-T176 PolarHBondContact O-N 2.92Å; T176-I179 PolarHBondContact O-N 3.14Å; T176-F180 WeakPolarHBondContact O-CD2 3.27Å; T176-F180 PolarHBondContact O-N 2.98Å
177	P	87.3	Confident	89.3	Confident	43 Å²	43	51.5 Å²	51.5	28%	0.279	28%	0.283	S	S	.	.	H	α-helix	trans	-67.8	-36.6	-172.2	-22.4	36.3	0	0	0	115.7	V174 I179 G181 Q183 Y199	V174-P177 WeakPolarHBondContact O-CD 3.46Å; P177-I179 VanDerWaalsContact C-N 3.32Å; P177-G181 CarbonylContact O-C 3.59Å; P177-G181 WeakPolarHBondContact O-CA 3.31Å; P177-G181 PolarHBondContact O-N 3.14Å; P177-Q183 HydrophobicContact CB-CG 4.43Å; P177-Y199 HydrophobicContact CB-CD2 4.29Å; P177-Y199 HydrophobicContact CB-CE2 3.46Å; P177-Y199 VanDerWaalsContact CB-CE2 3.46Å; P177-Y199 HydrophobicContact CG-CE2 3.9Å
178	P	85.8	Confident	88.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-68.6	-29.1	172.3	-14.6	24.2	0	0	0	113.5	I117 S121 L124 M175 H184 Y199	I117-P178 WeakPolarHBondContact CG2-O 3.45Å; S121-P178 WeakPolarHBondContact OG-CB 3.28Å; L124-P178 HydrophobicContact CD1-CG 3.66Å; M175-P178 WeakPolarHBondContact O-CD 3.37Å; P178-H184 PolarHBondContact O-CE1 2.75Å; P178-H184 VanDerWaalsContact O-CE1 3.23Å; P178-H184 PolarHBondContact O-ND1 2.65Å; P178-Y199 WeakPolarHBondContact CD-OH 3.27Å; P178-Y199 WeakPolarHBondContact CG-OH 3.35Å
179	I	87.7	Confident	87.9	Confident	47 Å²	47	55 Å²	55	24%	0.241	32%	0.315	C	S	.	.	H	α-helix	trans	-74.9	-50.8	-180	-61.8	-179.9	0	0	0	111.2	I117 S121 M175 T176 P177	I117-I179 HydrophobicContact CG2-CG1 4.31Å; S121-I179 WeakPolarHBondContact OG-CG1 3.45Å; M175-I179 HydrophobicContact CE-CD1 3.59Å; M175-I179 HydrophobicContact CG-CD1 3.88Å; M175-I179 HydrophobicContact SD-CD1 4.14Å; T176-I179 PolarHBondContact O-N 3.14Å; P177-I179 VanDerWaalsContact C-N 3.32Å
180	F	86.5	Confident	87.3	Confident	179 Å²	179	52.5 Å²	52.5	79%	0.785	30%	0.302	S	S	*	.	H	α-helix	trans	-99.1	-11	-172.9	-61	-72.3	0	0	0	113.7	T176	T176-F180 WeakPolarHBondContact O-CD2 3.27Å; T176-F180 PolarHBondContact O-N 2.98Å
181	G	81.5	Confident	87.1	Confident	27 Å²	27	50.5 Å²	50.5	28%	0.278	29%	0.286	S	S	.	.	S	Bend	trans	-113.1	164.2	-179	0	0	0	0	0	112.7	P177 Q183 H184	P177-G181 CarbonylContact O-C 3.59Å; P177-G181 WeakPolarHBondContact O-CA 3.31Å; P177-G181 PolarHBondContact O-N 3.14Å; G181-Q183 PolarHBondContact O-N 2.94Å; G181-H184 PolarHBondContact O-CE1 2.99Å; G181-H184 VanDerWaalsContact O-CE1 3.24Å; G181-H184 PolarHBondContact O-ND1 3.3Å
182	S	80.2	Confident	86.8	Confident	77 Å²	77	54.8 Å²	54.8	54%	0.538	30%	0.302	S	S	.	.	S	Bend	trans	-78.6	30.6	175.9	50.9	0	0	0	0	113.4	H184 R194	S182-H184 PolarHBondContact O-N 3.36Å; S182-H184 VanDerWaalsContact O-N 3.16Å; S182-R194 WeakPolarHBondContact O-CD 3.37Å; S182-R194 PolarHBondContact O-NE 3.33Å; S182-R194 VanDerWaalsContact O-NE 3.12Å; S182-R194 PolarHBondContact O-NH1 3.17Å; S182-R194 PolarHBondContact OG-NH1 3.43Å; S182-R194 PolarHBondContact OG-NH2 3.47Å
183	Q	84.4	Confident	86.5	Confident	31 Å²	31	50.7 Å²	50.7	15%	0.145	29%	0.285	C	S	.	.			trans	-85.3	26.4	-173.3	-58.1	-63.2	0.1	0	0	113.7	P177 G181 R194 Y199	P177-Q183 HydrophobicContact CB-CG 4.43Å; G181-Q183 PolarHBondContact O-N 2.94Å; Q183-R194 PolarHBondContact O-N 2.96Å; Q183-Y199 HydrophobicContact CB-CD1 4.02Å; Q183-Y199 HydrophobicContact CB-CE1 3.88Å; Q183-Y199 HydrophobicContact CB-CG 4.42Å; Q183-Y199 HydrophobicContact CG-CD1 4.14Å; Q183-Y199 HydrophobicContact CG-CD2 4.08Å; Q183-Y199 HydrophobicContact CG-CE1 4.3Å; Q183-Y199 HydrophobicContact CG-CE2 4.26Å; Q183-Y199 HydrophobicContact CG-CG 4.02Å
184	H	85.6	Confident	86.1	Confident	34 Å²	34	48.9 Å²	48.9	16%	0.157	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	149.5	-177.9	54.9	-99	0	0	0	110.4	I117 L120 P178 G181 S182 N186 Y192	I117-H184 WeakPolarHBondContact CD1-NE2 3.24Å; L120-H184 HydrophobicContact CD1-CB 3.9Å; P178-H184 PolarHBondContact O-CE1 2.75Å; P178-H184 VanDerWaalsContact O-CE1 3.23Å; P178-H184 PolarHBondContact O-ND1 2.65Å; G181-H184 PolarHBondContact O-CE1 2.99Å; G181-H184 VanDerWaalsContact O-CE1 3.24Å; G181-H184 PolarHBondContact O-ND1 3.3Å; S182-H184 PolarHBondContact O-N 3.36Å; S182-H184 VanDerWaalsContact O-N 3.16Å; H184-N186 PolarHBondContact NE2-ND2 3.02Å; H184-Y192 WeakPolarHBondContact CA-O 3.4Å
185	H	83.4	Confident	85.5	Confident	72 Å²	72	50.5 Å²	50.5	33%	0.333	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	128	158.2	-67.1	-89.9	0	0	0	107.4	C191 Y192	H185-C191 WeakPolarHBondContact O-CA 3.44Å; H185-Y192 HydrophobicContact CB-CD1 4.27Å; H185-Y192 HydrophobicContact CB-CD2 3.89Å; H185-Y192 HydrophobicContact CB-CE1 3.88Å; H185-Y192 HydrophobicContact CB-CE2 3.49Å; H185-Y192 VanDerWaalsContact CB-CE2 3.49Å; H185-Y192 HydrophobicContact CB-CG 4.26Å; H185-Y192 VanDerWaalsContact CB-CZ 3.44Å; H185-Y192 AromaticContact CD2-CD2 3.54Å; H185-Y192 AromaticContact CD2-CE2 3.06Å; H185-Y192 WeakPolarHBondContact CD2-CE2 3.08Å; H185-Y192 AromaticContact CD2-CZ 3.85Å; H185-Y192 AromaticContact CG-CD2 3.97Å; H185-Y192 AromaticContact CG-CE2 3.3Å; H185-Y192 AromaticContact CG-CZ 3.58Å; H185-Y192 PolarHBondContact N-O 3.38Å; H185-Y192 AromaticContact NE2-CE2 3.86Å; H185-Y192 PolarHBondContact O-N 3.36Å
186	N	85.6	Confident	85.3	Confident	59 Å²	59	52.6 Å²	52.6	32%	0.316	30%	0.296	S	S	.	.			trans	-124.5	167.5	-179.2	59.7	13.5	0	0	0	110.5	H113 C116 H184 S190	H113-N186 HydrophobicContact CB-CB 4.24Å; C116-N186 HydrophobicContact CB-CB 4.45Å; H184-N186 PolarHBondContact NE2-ND2 3.02Å; N186-S190 CarbonylContact C-O 3.56Å; N186-S190 WeakPolarHBondContact CA-O 3.23Å
187	G	82	Confident	85.3	Confident	11 Å²	11	52.3 Å²	52.3	11%	0.113	30%	0.298	C	S	.	.	S	Bend	trans	118.4	165.2	-178.1	0	0	0	0	0	112.6	G189 S190	G187-G189 PolarHBondContact O-N 3.44Å; G187-S190 PolarHBondContact N-O 2.89Å; G187-S190 CarbonylContact O-C 3.55Å; G187-S190 PolarHBondContact O-N 2.93Å
188	V	81.2	Confident	85.4	Confident	89 Å²	89	52.6 Å²	52.6	54%	0.539	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	129.2	173.5	-179.2	0	0	0	0	108.5	E111 S190	E111-V188 HydrophobicContact CB-CG2 4.32Å; E111-V188 HydrophobicContact CG-CG2 3.8Å; V188-S190 VanDerWaalsContact C-N 3.29Å; V188-S190 PolarHBondContact O-N 2.77Å
189	G	86	Confident	85.6	Confident	36 Å²	36	53.2 Å²	53.2	37%	0.371	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.8	-22	-176.8	0	0	0	0	0	115.1	W108 G187	W108-G189 PolarHBondContact O-N 3.49Å; G187-G189 PolarHBondContact O-N 3.44Å
190	S	85.7	Confident	85.8	Confident	39 Å²	39	51.3 Å²	51.3	27%	0.273	30%	0.301	S	S	.	.			trans	-129	107.9	-172	-69.4	0	0	0	0	112.2	N186 G187 V188	N186-S190 CarbonylContact C-O 3.56Å; N186-S190 WeakPolarHBondContact CA-O 3.23Å; G187-S190 PolarHBondContact N-O 2.89Å; G187-S190 CarbonylContact O-C 3.55Å; G187-S190 PolarHBondContact O-N 2.93Å; V188-S190 VanDerWaalsContact C-N 3.29Å; V188-S190 PolarHBondContact O-N 2.77Å
191	C	92.3	Very high	86	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.007	28%	0.28	C	S	.	.			trans	-141.7	93.2	167.8	-172.7	0	0	0	0	111.2	R102 W108 C116 H185	R102-C191 PolarHBondContact NH1-O 3.49Å; W108-C191 HydrophobicContact CB-CB 3.66Å; W108-C191 HydrophobicContact CD2-CB 3.42Å; W108-C191 VanDerWaalsContact CD2-CB 3.42Å; W108-C191 HydrophobicContact CE3-CB 3.71Å; W108-C191 HydrophobicContact CG-CB 3.42Å; W108-C191 VanDerWaalsContact CG-CB 3.42Å; W108-C191 HydrophobicContact CZ3-CB 4.5Å; C116-C191 WeakPolarHBondContact CA-SG 3.48Å; C116-C191 HydrophobicContact CB-CB 3.91Å; C116-C191 WeakPolarHBondContact CB-SG 3.37Å; C116-C191 WeakPolarHBondContact SG-CA 3.16Å; C116-C191 WeakPolarHBondContact SG-CB 3.43Å; C116-C191 CovalentContact SG-SG 2.03Å; C116-C191 PolarHBondContact SG-SG 3.33Å; H185-C191 WeakPolarHBondContact O-CA 3.44Å
192	Y	89.6	Confident	86.5	Confident	89 Å²	89	50.5 Å²	50.5	35%	0.349	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	155.6	-178.7	48.8	-87.7	0	0	0	111.5	H184 H185	H184-Y192 WeakPolarHBondContact CA-O 3.4Å; H185-Y192 HydrophobicContact CB-CD1 4.27Å; H185-Y192 HydrophobicContact CB-CD2 3.89Å; H185-Y192 HydrophobicContact CB-CE1 3.88Å; H185-Y192 HydrophobicContact CB-CE2 3.49Å; H185-Y192 VanDerWaalsContact CB-CE2 3.49Å; H185-Y192 HydrophobicContact CB-CG 4.26Å; H185-Y192 VanDerWaalsContact CB-CZ 3.44Å; H185-Y192 AromaticContact CD2-CD2 3.54Å; H185-Y192 AromaticContact CD2-CE2 3.06Å; H185-Y192 WeakPolarHBondContact CD2-CE2 3.08Å; H185-Y192 AromaticContact CD2-CZ 3.85Å; H185-Y192 AromaticContact CG-CD2 3.97Å; H185-Y192 AromaticContact CG-CE2 3.3Å; H185-Y192 AromaticContact CG-CZ 3.58Å; H185-Y192 PolarHBondContact N-O 3.38Å; H185-Y192 AromaticContact NE2-CE2 3.86Å; H185-Y192 PolarHBondContact O-N 3.36Å
193	I	88.9	Confident	87	Confident	23 Å²	23	47.4 Å²	47.4	12%	0.118	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	134.9	173.6	-66.1	173.9	0	0	0	108.8	L120 L124 Y199 R200 Y465	L120-I193 HydrophobicContact CD1-CG1 4.45Å; L120-I193 HydrophobicContact CD2-CG1 4.24Å; L124-I193 HydrophobicContact CD1-CD1 4.11Å; L124-I193 HydrophobicContact CD2-CD1 4.28Å; L124-I193 HydrophobicContact CG-CD1 4.35Å; I193-Y199 HydrophobicContact CG2-CD1 3.94Å; I193-Y199 HydrophobicContact CG2-CE1 3.6Å; I193-R200 PolarHBondContact O-NH2 3.46Å; I193-R200 VanDerWaalsContact O-NH2 3.17Å; I193-Y465 HydrophobicContact CB-CE2 4.42Å; I193-Y465 HydrophobicContact CD1-CE2 4.16Å; I193-Y465 HydrophobicContact CG2-CE2 4.13Å
194	R	85.2	Confident	87.3	Confident	69 Å²	69	46.2 Å²	46.2	26%	0.26	27%	0.268	S	S	.	.			trans	-54.7	146.1	178.2	-175.1	168.6	65.5	-177.1	-1.2	111.7	S182 Q183 D196 R200	S182-R194 WeakPolarHBondContact O-CD 3.37Å; S182-R194 PolarHBondContact O-NE 3.33Å; S182-R194 VanDerWaalsContact O-NE 3.12Å; S182-R194 PolarHBondContact O-NH1 3.17Å; S182-R194 PolarHBondContact OG-NH1 3.43Å; S182-R194 PolarHBondContact OG-NH2 3.47Å; Q183-R194 PolarHBondContact O-N 2.96Å; R194-D196 HydrophobicContact CG-CB 4.35Å; R194-D196 PolarHBondContact O-N 2.98Å; R194-R200 PolarHBondContact O-NE 3.4Å
195	S	78.4	Confident	87.6	Confident	69 Å²	69	48.1 Å²	48.1	48%	0.483	28%	0.279	S	S	.	.			trans	-75.4	24.6	177.6	-55.4	0	0	0	0	114.2	A197	S195-A197 PolarHBondContact O-N 3.28Å; S195-A197 VanDerWaalsContact O-N 3.1Å
196	D	86.3	Confident	87.9	Confident	64 Å²	64	47.9 Å²	47.9	34%	0.342	28%	0.284	S	S	.	.			trans	-65.4	112.4	176.3	-179.9	-103	0	0	0	109.5	R194 G198 Y199 R200	R194-D196 HydrophobicContact CG-CB 4.35Å; R194-D196 PolarHBondContact O-N 2.98Å; D196-G198 VanDerWaalsContact C-N 3.34Å; D196-G198 PolarHBondContact O-N 2.77Å; D196-Y199 PolarHBondContact O-N 3.32Å; D196-Y199 WeakPolarHBondContact OD1-CB 3.21Å; D196-Y199 PolarHBondContact OD1-N 3.03Å; D196-R200 WeakPolarHBondContact O-CG 3.36Å; D196-R200 PolarHBondContact O-N 3.4Å
197	A	87.7	Confident	88.2	Confident	40 Å²	40	46.1 Å²	46.1	33%	0.331	27%	0.274	S	S	.	.	H	α-helix	trans	-57.2	-48.8	-175.7	0	0	0	0	0	111	S195 Y199 R200 F201 G469	S195-A197 PolarHBondContact O-N 3.28Å; S195-A197 VanDerWaalsContact O-N 3.1Å; A197-Y199 PolarHBondContact O-N 3.15Å; A197-R200 PolarHBondContact O-N 3.25Å; A197-F201 HydrophobicContact CB-CD2 4.32Å; A197-F201 HydrophobicContact CB-CE2 4.31Å; A197-F201 WeakPolarHBondContact O-CD2 3.48Å; A197-F201 PolarHBondContact O-N 3Å; A197-G469 WeakPolarHBondContact CB-O 3.39Å
198	G	89.5	Confident	88.7	Confident	49 Å²	49	46 Å²	46	51%	0.505	27%	0.271	S	S	.	.	H	α-helix	trans	-57	-48	-178	0	0	0	0	0	112.5	D196 L202	D196-G198 VanDerWaalsContact C-N 3.34Å; D196-G198 PolarHBondContact O-N 2.77Å; G198-L202 VanDerWaalsContact O-CB 3.23Å; G198-L202 WeakPolarHBondContact O-CB 3.45Å; G198-L202 PolarHBondContact O-N 3.45Å
199	Y	89.8	Confident	89.3	Confident	12 Å²	12	44.9 Å²	44.9	5%	0.047	26%	0.259	C	S	.	.	H	α-helix	trans	-62.5	-48	176.7	179.2	-113	0	0	0	112	L124 P177 P178 Q183 I193 D196 A197 F201 L202 T203	L124-Y199 WeakPolarHBondContact CD1-OH 3.42Å; P177-Y199 HydrophobicContact CB-CD2 4.29Å; P177-Y199 HydrophobicContact CB-CE2 3.46Å; P177-Y199 VanDerWaalsContact CB-CE2 3.46Å; P177-Y199 HydrophobicContact CG-CE2 3.9Å; P178-Y199 WeakPolarHBondContact CD-OH 3.27Å; P178-Y199 WeakPolarHBondContact CG-OH 3.35Å; Q183-Y199 HydrophobicContact CB-CD1 4.02Å; Q183-Y199 HydrophobicContact CB-CE1 3.88Å; Q183-Y199 HydrophobicContact CB-CG 4.42Å; Q183-Y199 HydrophobicContact CG-CD1 4.14Å; Q183-Y199 HydrophobicContact CG-CD2 4.08Å; Q183-Y199 HydrophobicContact CG-CE1 4.3Å; Q183-Y199 HydrophobicContact CG-CE2 4.26Å; Q183-Y199 HydrophobicContact CG-CG 4.02Å; I193-Y199 HydrophobicContact CG2-CD1 3.94Å; I193-Y199 HydrophobicContact CG2-CE1 3.6Å; D196-Y199 PolarHBondContact O-N 3.32Å; D196-Y199 WeakPolarHBondContact OD1-CB 3.21Å; D196-Y199 PolarHBondContact OD1-N 3.03Å; A197-Y199 PolarHBondContact O-N 3.15Å; Y199-F201 PolarHBondContact O-N 3.4Å; Y199-L202 PolarHBondContact O-N 2.86Å; Y199-T203 HydrophobicContact CD2-CG2 3.86Å; Y199-T203 HydrophobicContact CE1-CG2 4.22Å; Y199-T203 HydrophobicContact CE2-CG2 3.32Å; Y199-T203 HydrophobicContact CG-CG2 4.48Å; Y199-T203 PolarHBondContact O-N 3.34Å; Y199-T203 PolarHBondContact O-OG1 3.35Å
200	R	91.3	Very high	89.6	Confident	8 Å²	8	47 Å²	47	3%	0.03	27%	0.265	C	S	.	.	H	α-helix	trans	-63	-41.6	-179.3	-70	-179.1	162.9	-127.5	15	112.6	I193 R194 D196 A197 T203 G204 Y465 L466 E468	I193-R200 PolarHBondContact O-NH2 3.46Å; I193-R200 VanDerWaalsContact O-NH2 3.17Å; R194-R200 PolarHBondContact O-NE 3.4Å; D196-R200 WeakPolarHBondContact O-CG 3.36Å; D196-R200 PolarHBondContact O-N 3.4Å; A197-R200 PolarHBondContact O-N 3.25Å; R200-T203 PolarHBondContact O-OG1 2.94Å; R200-G204 WeakPolarHBondContact O-CA 3.43Å; R200-G204 PolarHBondContact O-N 3.21Å; R200-Y465 HydrophobicContact CB-CD1 4.44Å; R200-Y465 HydrophobicContact CB-CE1 3.85Å; R200-Y465 HydrophobicContact CB-CE2 4.47Å; R200-Y465 HydrophobicContact CG-CE1 4.1Å; R200-Y465 HydrophobicContact CG-CE2 3.83Å; R200-Y465 PolarHBondContact NH1-O 3.19Å; R200-Y465 VanDerWaalsContact O-CE1 3.27Å; R200-Y465 WeakPolarHBondContact O-CE1 3.15Å; R200-L466 WeakPolarHBondContact O-CD2 3.27Å; R200-E468 IonicContact CZ-OE2 3.3Å; R200-E468 VanDerWaalsContact CZ-OE2 3.3Å; R200-E468 IonicContact NH1-OE2 2.69Å; R200-E468 PolarHBondContact NH1-OE2 2.93Å; R200-E468 IonicContact NH2-OE2 3.03Å; R200-E468 PolarHBondContact NH2-OE2 3.47Å
201	F	92.1	Very high	90	Very high	77 Å²	77	45.5 Å²	45.5	34%	0.338	25%	0.253	S	S	.	.	H	α-helix	trans	-65.3	-46.4	173.6	-78.7	-67.4	0	0	0	111.5	A197 Y199 T203 I205 L466 A470	A197-F201 HydrophobicContact CB-CD2 4.32Å; A197-F201 HydrophobicContact CB-CE2 4.31Å; A197-F201 WeakPolarHBondContact O-CD2 3.48Å; A197-F201 PolarHBondContact O-N 3Å; Y199-F201 PolarHBondContact O-N 3.4Å; F201-T203 PolarHBondContact O-N 3.48Å; F201-I205 HydrophobicContact CB-CD1 4.37Å; F201-I205 HydrophobicContact CD1-CD1 4.38Å; F201-I205 WeakPolarHBondContact O-CB 3.18Å; F201-I205 WeakPolarHBondContact O-CD1 3.34Å; F201-I205 WeakPolarHBondContact O-CG1 3.36Å; F201-I205 PolarHBondContact O-N 3.38Å; F201-L466 HydrophobicContact CD1-CD2 3.75Å; F201-L466 HydrophobicContact CE1-CD2 4.22Å; F201-L466 HydrophobicContact CG-CD2 4.39Å; F201-A470 HydrophobicContact CE2-CB 4.35Å; F201-A470 HydrophobicContact CZ-CB 3.61Å
202	L	90.5	Very high	90	Very high	112 Å²	112	49.3 Å²	49.3	59%	0.586	27%	0.27	S	S	*	.	H	α-helix	trans	-59.2	-50.2	-179.6	-179.4	66.4	0	0	0	111.6	G198 Y199 C206	G198-L202 VanDerWaalsContact O-CB 3.23Å; G198-L202 WeakPolarHBondContact O-CB 3.45Å; G198-L202 PolarHBondContact O-N 3.45Å; Y199-L202 PolarHBondContact O-N 2.86Å; L202-C206 WeakPolarHBondContact O-CB 3.48Å; L202-C206 PolarHBondContact O-N 2.66Å; L202-C206 PolarHBondContact O-SG 3.32Å
203	T	90.6	Very high	90.3	Very high	12 Å²	12	50.5 Å²	50.5	7%	0.074	28%	0.282	C	S	.	.	H	α-helix	trans	-71.8	-46.1	-179.5	55.7	0	0	0	0	111.7	Y199 R200 F201 I205 C206 I207 Y465	Y199-T203 HydrophobicContact CD2-CG2 3.86Å; Y199-T203 HydrophobicContact CE1-CG2 4.22Å; Y199-T203 HydrophobicContact CE2-CG2 3.32Å; Y199-T203 HydrophobicContact CG-CG2 4.48Å; Y199-T203 PolarHBondContact O-N 3.34Å; Y199-T203 PolarHBondContact O-OG1 3.35Å; R200-T203 PolarHBondContact O-OG1 2.94Å; F201-T203 PolarHBondContact O-N 3.48Å; T203-I205 PolarHBondContact O-N 3.15Å; T203-C206 PolarHBondContact O-N 3.16Å; T203-I207 WeakPolarHBondContact O-CB 3.17Å; T203-I207 WeakPolarHBondContact O-CD1 3.22Å; T203-I207 WeakPolarHBondContact O-CG1 3.21Å; T203-I207 PolarHBondContact O-N 3.44Å; T203-Y465 WeakPolarHBondContact OG1-CE1 3.46Å; T203-Y465 PolarHBondContact OG1-OH 2.86Å
204	G	91.8	Very high	90.5	Very high	5 Å²	5	53.3 Å²	53.3	5%	0.052	30%	0.297	C	S	.	.	H	α-helix	trans	-61.7	-41.4	-179.8	0	0	0	0	0	112.6	R200 F208	R200-G204 WeakPolarHBondContact O-CA 3.43Å; R200-G204 PolarHBondContact O-N 3.21Å; G204-F208 WeakPolarHBondContact O-CB 3.23Å; G204-F208 PolarHBondContact O-N 3.27Å; G204-F208 VanDerWaalsContact O-N 3.14Å
205	I	91.3	Very high	91	Very high	75 Å²	75	50.2 Å²	50.2	39%	0.385	29%	0.285	S	S	.	.	I	π-helix	trans	-70.1	-47.3	176.9	-66.1	169.2	0	0	0	111	F201 T203 F209 V210	F201-I205 HydrophobicContact CB-CD1 4.37Å; F201-I205 HydrophobicContact CD1-CD1 4.38Å; F201-I205 WeakPolarHBondContact O-CB 3.18Å; F201-I205 WeakPolarHBondContact O-CD1 3.34Å; F201-I205 WeakPolarHBondContact O-CG1 3.36Å; F201-I205 PolarHBondContact O-N 3.38Å; T203-I205 PolarHBondContact O-N 3.15Å; I205-F209 HydrophobicContact CG2-CB 4.46Å; I205-F209 PolarHBondContact O-N 2.73Å; I205-F209 VanDerWaalsContact O-N 3.12Å; I205-V210 HydrophobicContact CG2-CG2 4.13Å; I205-V210 PolarHBondContact O-N 3.28Å
206	C	91.2	Very high	91.8	Very high	66 Å²	66	48.2 Å²	48.2	45%	0.446	28%	0.276	S	S	.	.	I	π-helix	trans	-69.8	-38.4	-176.2	-69.6	0	0	0	0	113.3	L202 T203 P211	L202-C206 WeakPolarHBondContact O-CB 3.48Å; L202-C206 PolarHBondContact O-N 2.66Å; L202-C206 PolarHBondContact O-SG 3.32Å; T203-C206 PolarHBondContact O-N 3.16Å; C206-P211 WeakPolarHBondContact O-CD 3.47Å
207	I	91.8	Very high	92.2	Very high	22 Å²	22	50.6 Å²	50.6	11%	0.113	28%	0.283	C	S	.	.	I	π-helix	trans	-82.1	-38.1	-176.2	-60.9	166.3	0	0	0	111	L124 I131 V174 T203 P211	L124-I207 HydrophobicContact CD2-CD1 4.04Å; I131-I207 WeakPolarHBondContact CG2-O 3.49Å; V174-I207 HydrophobicContact CG1-CD1 3.34Å; V174-I207 HydrophobicContact CG1-CG1 3.77Å; V174-I207 HydrophobicContact CG2-CG1 4.36Å; T203-I207 WeakPolarHBondContact O-CB 3.17Å; T203-I207 WeakPolarHBondContact O-CD1 3.22Å; T203-I207 WeakPolarHBondContact O-CG1 3.21Å; T203-I207 PolarHBondContact O-N 3.44Å; I207-P211 VanDerWaalsContact O-CG 3.32Å; I207-P211 WeakPolarHBondContact O-CG 3.45Å
208	F	92.5	Very high	92.6	Very high	9 Å²	9	49.3 Å²	49.3	4%	0.039	27%	0.271	C	S	.	.	I	π-helix	trans	-106.9	-60.5	-174.2	-174.9	-99.2	0	0	0	113.1	G204 F212 F454 V455 W458 L459 T462	G204-F208 WeakPolarHBondContact O-CB 3.23Å; G204-F208 PolarHBondContact O-N 3.27Å; G204-F208 VanDerWaalsContact O-N 3.14Å; F208-F212 WeakPolarHBondContact O-CB 3.28Å; F208-F212 PolarHBondContact O-N 3.04Å; F208-F454 HydrophobicContact CD2-CE1 4.09Å; F208-F454 HydrophobicContact CE2-CE1 4.1Å; F208-V455 HydrophobicContact CZ-CG1 4.29Å; F208-W458 HydrophobicContact CD2-CB 4.01Å; F208-W458 HydrophobicContact CE2-CB 3.6Å; F208-L459 HydrophobicContact CE1-CD1 3.8Å; F208-L459 HydrophobicContact CZ-CB 4.13Å; F208-L459 HydrophobicContact CZ-CD1 4.03Å; F208-T462 HydrophobicContact CB-CG2 3.88Å; F208-T462 HydrophobicContact CD1-CG2 3.68Å; F208-T462 HydrophobicContact CE1-CG2 4.37Å; F208-T462 HydrophobicContact CG-CG2 3.83Å
209	F	92.6	Very high	92.8	Very high	66 Å²	66	47.6 Å²	47.6	29%	0.289	25%	0.249	S	C	.	.	I	π-helix	trans	-69.8	-42.4	-169.4	-76.1	-83.9	0	0	0	113.8	I205 F212 L213 T462 L466	I205-F209 HydrophobicContact CG2-CB 4.46Å; I205-F209 PolarHBondContact O-N 2.73Å; I205-F209 VanDerWaalsContact O-N 3.12Å; F209-F212 PolarHBondContact O-N 2.95Å; F209-L213 WeakPolarHBondContact O-CB 3.49Å; F209-L213 VanDerWaalsContact O-CG 3.29Å; F209-L213 WeakPolarHBondContact O-CG 3.38Å; F209-L213 PolarHBondContact O-N 3.01Å; F209-T462 HydrophobicContact CD2-CG2 4.41Å; F209-T462 HydrophobicContact CE2-CG2 3.76Å; F209-L466 HydrophobicContact CD2-CD1 4.16Å; F209-L466 HydrophobicContact CE2-CD1 3.4Å; F209-L466 HydrophobicContact CZ-CD1 4.22Å
210	V	93.5	Very high	93	Very high	81 Å²	81	52.7 Å²	52.7	49%	0.491	28%	0.276	S	S	.	.	H	α-helix	trans	-62	-51.1	177.8	167.6	0	0	0	0	110.7	I205 F212 L213 L214	I205-V210 HydrophobicContact CG2-CG2 4.13Å; I205-V210 PolarHBondContact O-N 3.28Å; V210-F212 PolarHBondContact O-N 2.88Å; V210-L213 PolarHBondContact O-N 3.44Å; V210-L214 WeakPolarHBondContact O-CB 3.36Å; V210-L214 PolarHBondContact O-N 3.36Å
211	P	93.4	Very high	93.2	Very high	6 Å²	6	57.1 Å²	57.1	4%	0.039	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-39.3	172.8	-30.3	40.1	0	0	0	113.8	I131 L132 C206 I207 L214 V215	I131-P211 HydrophobicContact CD1-CB 4.34Å; I131-P211 HydrophobicContact CG1-CB 3.54Å; I131-P211 HydrophobicContact CG1-CG 4.34Å; I131-P211 HydrophobicContact CG2-CG 4.49Å; L132-P211 HydrophobicContact CD2-CG 4.43Å; C206-P211 WeakPolarHBondContact O-CD 3.47Å; I207-P211 VanDerWaalsContact O-CG 3.32Å; I207-P211 WeakPolarHBondContact O-CG 3.45Å; P211-L214 PolarHBondContact O-N 3.21Å; P211-V215 VanDerWaalsContact O-CB 3.32Å; P211-V215 WeakPolarHBondContact O-CB 3.35Å; P211-V215 VanDerWaalsContact O-CG2 3.22Å; P211-V215 WeakPolarHBondContact O-CG2 3.44Å; P211-V215 PolarHBondContact O-N 3.38Å
212	F	92.5	Very high	93.2	Very high	81 Å²	81	53.5 Å²	53.5	36%	0.355	28%	0.277	S	S	.	.	H	α-helix	trans	-58.6	-50.1	176.4	168.5	-108.8	0	0	0	112	F208 F209 V210 V215 G216 V455	F208-F212 WeakPolarHBondContact O-CB 3.28Å; F208-F212 PolarHBondContact O-N 3.04Å; F209-F212 PolarHBondContact O-N 2.95Å; V210-F212 PolarHBondContact O-N 2.88Å; F212-V215 PolarHBondContact O-N 3.38Å; F212-G216 PolarHBondContact O-N 3.25Å; F212-V455 HydrophobicContact CD2-CB 4.39Å; F212-V455 HydrophobicContact CD2-CG1 3.95Å; F212-V455 HydrophobicContact CD2-CG2 3.47Å; F212-V455 VanDerWaalsContact CD2-CG2 3.47Å; F212-V455 HydrophobicContact CE2-CB 4.38Å; F212-V455 HydrophobicContact CE2-CG1 3.67Å; F212-V455 HydrophobicContact CE2-CG2 3.79Å
213	L	94.6	Very high	93.3	Very high	114 Å²	114	52.9 Å²	52.9	60%	0.597	27%	0.269	S	S	*	.	H	α-helix	trans	-64.8	-41.3	178.8	-69	176.2	0	0	0	111.6	F209 V210 G216 F217	F209-L213 WeakPolarHBondContact O-CB 3.49Å; F209-L213 VanDerWaalsContact O-CG 3.29Å; F209-L213 WeakPolarHBondContact O-CG 3.38Å; F209-L213 PolarHBondContact O-N 3.01Å; V210-L213 PolarHBondContact O-N 3.44Å; L213-G216 PolarHBondContact O-N 2.89Å; L213-F217 WeakPolarHBondContact O-CB 3.22Å; L213-F217 PolarHBondContact O-N 3.42Å
214	L	94.5	Very high	93.4	Very high	83 Å²	83	59 Å²	59	44%	0.435	29%	0.292	S	S	.	.	H	α-helix	trans	-59.3	-51.9	175.7	174.6	63.3	0	0	0	111.3	V210 P211 F217 I218	V210-L214 WeakPolarHBondContact O-CB 3.36Å; V210-L214 PolarHBondContact O-N 3.36Å; P211-L214 PolarHBondContact O-N 3.21Å; L214-F217 PolarHBondContact O-N 3.1Å; L214-I218 HydrophobicContact CD1-CD1 3.99Å; L214-I218 HydrophobicContact CD1-CG1 4.48Å; L214-I218 HydrophobicContact CG-CD1 4.01Å; L214-I218 VanDerWaalsContact O-CG1 3.27Å; L214-I218 WeakPolarHBondContact O-CG1 3.41Å; L214-I218 PolarHBondContact O-N 3.37Å
215	V	95.1	Very high	93.2	Very high	3 Å²	3	59.7 Å²	59.7	2%	0.018	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-46.1	-179.7	172.5	0	0	0	0	110.3	C135 P211 F212 F217 I218 Y219 V451	C135-V215 HydrophobicContact CB-CG2 4.35Å; C135-V215 WeakPolarHBondContact SG-CG2 3.45Å; P211-V215 VanDerWaalsContact O-CB 3.32Å; P211-V215 WeakPolarHBondContact O-CB 3.35Å; P211-V215 VanDerWaalsContact O-CG2 3.22Å; P211-V215 WeakPolarHBondContact O-CG2 3.44Å; P211-V215 PolarHBondContact O-N 3.38Å; F212-V215 PolarHBondContact O-N 3.38Å; V215-F217 VanDerWaalsContact C-N 3.35Å; V215-F217 PolarHBondContact O-N 3.49Å; V215-I218 WeakPolarHBondContact O-CB 3.36Å; V215-I218 PolarHBondContact O-N 3.3Å; V215-I218 VanDerWaalsContact O-N 3.14Å; V215-Y219 HydrophobicContact CG1-CD2 3.64Å; V215-Y219 HydrophobicContact CG1-CE2 3.65Å; V215-Y219 VanDerWaalsContact O-CD2 3.27Å; V215-Y219 WeakPolarHBondContact O-CD2 3.46Å; V215-Y219 PolarHBondContact O-N 3.31Å; V215-V451 HydrophobicContact CG1-CB 4.26Å; V215-V451 HydrophobicContact CG1-CG1 3.38Å; V215-V451 HydrophobicContact CG1-CG2 3.83Å
216	G	94.5	Very high	93.1	Very high	27 Å²	27	56.7 Å²	56.7	28%	0.278	28%	0.279	S	S	.	.	H	α-helix	trans	-55.2	-48.3	176.1	0	0	0	0	0	112.2	F212 L213 I218 Y219 I220	F212-G216 PolarHBondContact O-N 3.25Å; L213-G216 PolarHBondContact O-N 2.89Å; G216-I218 PolarHBondContact O-N 3.03Å; G216-Y219 PolarHBondContact O-N 2.94Å; G216-I220 VanDerWaalsContact O-CG1 3.28Å; G216-I220 WeakPolarHBondContact O-CG1 3.31Å; G216-I220 PolarHBondContact O-N 3.27Å
217	F	95.6	Very high	93	Very high	115 Å²	115	58 Å²	58	50%	0.504	28%	0.278	S	S	.	.	H	α-helix	trans	-58.7	-46.2	175.2	174	-101	0	0	0	112.2	L213 L214 V215 Y219 I220 R221	L213-F217 WeakPolarHBondContact O-CB 3.22Å; L213-F217 PolarHBondContact O-N 3.42Å; L214-F217 PolarHBondContact O-N 3.1Å; V215-F217 VanDerWaalsContact C-N 3.35Å; V215-F217 PolarHBondContact O-N 3.49Å; F217-Y219 VanDerWaalsContact C-N 3.33Å; F217-Y219 PolarHBondContact O-N 3.47Å; F217-I220 PolarHBondContact O-N 2.88Å; F217-R221 HydrophobicContact CE1-CG 4.13Å; F217-R221 HydrophobicContact CE2-CG 4.15Å; F217-R221 HydrophobicContact CZ-CG 3.94Å; F217-R221 WeakPolarHBondContact O-CG 3.09Å; F217-R221 PolarHBondContact O-N 2.89Å; F217-R221 VanDerWaalsContact O-N 3.09Å
218	I	95.7	Very high	92.7	Very high	12 Å²	12	63.2 Å²	63.2	6%	0.062	30%	0.297	C	S	.	.	H	α-helix	trans	-57.8	-46.7	177.8	-71.8	166.3	0	0	0	110.6	V139 Y142 L214 V215 G216 R221 I222	V139-I218 HydrophobicContact CG2-CD1 3.72Å; Y142-I218 HydrophobicContact CD2-CG2 4.21Å; Y142-I218 HydrophobicContact CG-CG2 4.28Å; L214-I218 HydrophobicContact CD1-CD1 3.99Å; L214-I218 HydrophobicContact CD1-CG1 4.48Å; L214-I218 HydrophobicContact CG-CD1 4.01Å; L214-I218 VanDerWaalsContact O-CG1 3.27Å; L214-I218 WeakPolarHBondContact O-CG1 3.41Å; L214-I218 PolarHBondContact O-N 3.37Å; V215-I218 WeakPolarHBondContact O-CB 3.36Å; V215-I218 PolarHBondContact O-N 3.3Å; V215-I218 VanDerWaalsContact O-N 3.14Å; G216-I218 PolarHBondContact O-N 3.03Å; I218-R221 PolarHBondContact O-N 3.33Å; I218-I222 HydrophobicContact CG2-CD1 3.77Å; I218-I222 HydrophobicContact CG2-CG1 4.34Å; I218-I222 VanDerWaalsContact O-CG1 3.31Å; I218-I222 WeakPolarHBondContact O-CG1 3.38Å; I218-I222 PolarHBondContact O-N 2.7Å
219	Y	94.3	Very high	92.2	Very high	13 Å²	13	66 Å²	66	5%	0.051	31%	0.307	C	S	.	.	H	α-helix	trans	-67.7	-40.5	-179.7	-85.7	-77.8	0	0	0	113.3	S138 V215 G216 F217 R221 I222 F223 V444 V447 A448 V451	S138-Y219 WeakPolarHBondContact OG-CE2 3.31Å; V215-Y219 HydrophobicContact CG1-CD2 3.64Å; V215-Y219 HydrophobicContact CG1-CE2 3.65Å; V215-Y219 VanDerWaalsContact O-CD2 3.27Å; V215-Y219 WeakPolarHBondContact O-CD2 3.46Å; V215-Y219 PolarHBondContact O-N 3.31Å; G216-Y219 PolarHBondContact O-N 2.94Å; F217-Y219 VanDerWaalsContact C-N 3.33Å; F217-Y219 PolarHBondContact O-N 3.47Å; Y219-R221 PolarHBondContact O-N 2.99Å; Y219-I222 HydrophobicContact CD1-CD1 4.37Å; Y219-I222 HydrophobicContact CE1-CD1 4.42Å; Y219-I222 PolarHBondContact O-N 3.02Å; Y219-I222 VanDerWaalsContact O-N 3.14Å; Y219-F223 HydrophobicContact CD1-CD2 4.46Å; Y219-F223 AromaticContact CD1-CE2 3.79Å; Y219-F223 HydrophobicContact CD1-CE2 3.79Å; Y219-F223 HydrophobicContact CD1-CZ 4.31Å; Y219-F223 HydrophobicContact CG-CE2 4.36Å; Y219-F223 WeakPolarHBondContact O-CB 3.36Å; Y219-F223 WeakPolarHBondContact O-CD2 3.37Å; Y219-F223 PolarHBondContact O-N 3.22Å; Y219-V444 HydrophobicContact CE1-CG1 4.35Å; Y219-V447 VanDerWaalsContact OH-CB 3.24Å; Y219-V447 WeakPolarHBondContact OH-CB 3.42Å; Y219-V447 WeakPolarHBondContact OH-CG1 3.37Å; Y219-A448 HydrophobicContact CD1-CB 4.08Å; Y219-A448 HydrophobicContact CE1-CB 3.73Å; Y219-V451 HydrophobicContact CD2-CG1 4.49Å; Y219-V451 HydrophobicContact CD2-CG2 4.44Å; Y219-V451 HydrophobicContact CE2-CB 4.28Å; Y219-V451 HydrophobicContact CE2-CG1 4.35Å; Y219-V451 HydrophobicContact CE2-CG2 3.54Å
220	I	94.3	Very high	91.7	Very high	120 Å²	120	68.6 Å²	68.6	62%	0.615	32%	0.315	S	S	*	.	H	α-helix	trans	-55	-45.7	173.9	-70.3	164.6	0	0	0	109.8	G216 F217 F223 W224	G216-I220 VanDerWaalsContact O-CG1 3.28Å; G216-I220 WeakPolarHBondContact O-CG1 3.31Å; G216-I220 PolarHBondContact O-N 3.27Å; F217-I220 PolarHBondContact O-N 2.88Å; I220-F223 PolarHBondContact O-N 2.89Å; I220-W224 VanDerWaalsContact O-CB 3.31Å; I220-W224 WeakPolarHBondContact O-CB 3.27Å; I220-W224 PolarHBondContact O-N 2.9Å
221	R	94.7	Very high	91.1	Very high	101 Å²	101	69.4 Å²	69.4	38%	0.381	31%	0.312	S	S	.	.	H	α-helix	trans	-65.9	-42.2	177.3	-64.7	-68.4	-125.4	-179.6	-1.6	112.6	Y142 F217 I218 Y219 W224 V225	Y142-R221 HydrophobicContact CD2-CB 4.3Å; Y142-R221 HydrophobicContact CE2-CB 3.7Å; Y142-R221 HydrophobicContact CE2-CG 4.48Å; F217-R221 HydrophobicContact CE1-CG 4.13Å; F217-R221 HydrophobicContact CE2-CG 4.15Å; F217-R221 HydrophobicContact CZ-CG 3.94Å; F217-R221 WeakPolarHBondContact O-CG 3.09Å; F217-R221 PolarHBondContact O-N 2.89Å; F217-R221 VanDerWaalsContact O-N 3.09Å; I218-R221 PolarHBondContact O-N 3.33Å; Y219-R221 PolarHBondContact O-N 2.99Å; R221-W224 PolarHBondContact O-N 3.49Å; R221-V225 VanDerWaalsContact O-CG2 3.23Å; R221-V225 WeakPolarHBondContact O-CG2 3.35Å; R221-V225 PolarHBondContact O-N 3.03Å
222	I	92.6	Very high	90.4	Very high	0 Å²	0	72.4 Å²	72.4	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-58	-51.9	175.4	-72.1	171.6	0	0	0	110.4	R141 Y142 I145 I218 Y219 W224 V225 I226 V444	R141-I222 HydrophobicContact CB-CD1 4.25Å; Y142-I222 HydrophobicContact CD2-CG1 3.94Å; I145-I222 HydrophobicContact CD1-CB 4.36Å; I145-I222 HydrophobicContact CD1-CD1 4.37Å; I145-I222 HydrophobicContact CD1-CG1 4.15Å; I145-I222 HydrophobicContact CD1-CG2 3.41Å; I145-I222 VanDerWaalsContact CD1-CG2 3.41Å; I218-I222 HydrophobicContact CG2-CD1 3.77Å; I218-I222 HydrophobicContact CG2-CG1 4.34Å; I218-I222 VanDerWaalsContact O-CG1 3.31Å; I218-I222 WeakPolarHBondContact O-CG1 3.38Å; I218-I222 PolarHBondContact O-N 2.7Å; Y219-I222 HydrophobicContact CD1-CD1 4.37Å; Y219-I222 HydrophobicContact CE1-CD1 4.42Å; Y219-I222 PolarHBondContact O-N 3.02Å; Y219-I222 VanDerWaalsContact O-N 3.14Å; I222-W224 VanDerWaalsContact C-N 3.33Å; I222-W224 PolarHBondContact O-N 3.37Å; I222-V225 PolarHBondContact O-N 2.94Å; I222-I226 HydrophobicContact CG2-CD1 3.68Å; I222-I226 HydrophobicContact CG2-CG1 4.39Å; I222-I226 WeakPolarHBondContact O-CG1 3.21Å; I222-I226 PolarHBondContact O-N 3.3Å; I222-V444 HydrophobicContact CG2-CG1 3.64Å; I222-V444 HydrophobicContact CG2-CG2 4.38Å
223	F	91.7	Very high	89.6	Confident	99 Å²	99	72.1 Å²	72.1	43%	0.434	33%	0.327	S	S	.	.	H	α-helix	trans	-64.6	-38.5	-178.4	-74.6	-60.2	0	0	0	112	Y219 I220 V225 I226 H227 A448	Y219-F223 HydrophobicContact CD1-CD2 4.46Å; Y219-F223 AromaticContact CD1-CE2 3.79Å; Y219-F223 HydrophobicContact CD1-CE2 3.79Å; Y219-F223 HydrophobicContact CD1-CZ 4.31Å; Y219-F223 HydrophobicContact CG-CE2 4.36Å; Y219-F223 WeakPolarHBondContact O-CB 3.36Å; Y219-F223 WeakPolarHBondContact O-CD2 3.37Å; Y219-F223 PolarHBondContact O-N 3.22Å; I220-F223 PolarHBondContact O-N 2.89Å; F223-V225 VanDerWaalsContact C-N 3.33Å; F223-V225 PolarHBondContact O-N 3.36Å; F223-I226 PolarHBondContact O-N 2.86Å; F223-H227 VanDerWaalsContact O-CB 3.31Å; F223-H227 WeakPolarHBondContact O-CB 3.23Å; F223-H227 PolarHBondContact O-N 3.08Å; F223-A448 HydrophobicContact CZ-CB 4.1Å
224	W	92.5	Very high	88.5	Confident	142 Å²	142	72.9 Å²	72.9	54%	0.538	33%	0.326	S	S	.	.	H	α-helix	trans	-58.7	-44.6	174.1	-178.2	60.8	0	0	0	112.1	I220 R221 I222 H227 R228	I220-W224 VanDerWaalsContact O-CB 3.31Å; I220-W224 WeakPolarHBondContact O-CB 3.27Å; I220-W224 PolarHBondContact O-N 2.9Å; R221-W224 PolarHBondContact O-N 3.49Å; I222-W224 VanDerWaalsContact C-N 3.33Å; I222-W224 PolarHBondContact O-N 3.37Å; W224-H227 PolarHBondContact O-N 2.88Å; W224-R228 WeakPolarHBondContact O-CB 3.42Å; W224-R228 PolarHBondContact O-N 3.12Å
225	V	89.2	Confident	87.4	Confident	18 Å²	18	75.8 Å²	75.8	11%	0.109	34%	0.335	C	S	.	.	H	α-helix	trans	-68.6	-41.7	178.9	172.5	0	0	0	0	111.5	I145 N146 R221 I222 F223 H227 R228 R229	I145-V225 HydrophobicContact CG2-CG1 3.94Å; N146-V225 WeakPolarHBondContact OD1-CG2 3.41Å; R221-V225 VanDerWaalsContact O-CG2 3.23Å; R221-V225 WeakPolarHBondContact O-CG2 3.35Å; R221-V225 PolarHBondContact O-N 3.03Å; I222-V225 PolarHBondContact O-N 2.94Å; F223-V225 VanDerWaalsContact C-N 3.33Å; F223-V225 PolarHBondContact O-N 3.36Å; V225-H227 VanDerWaalsContact C-N 3.33Å; V225-H227 PolarHBondContact O-N 2.87Å; V225-R228 PolarHBondContact O-N 2.94Å; V225-R229 WeakPolarHBondContact O-CG 3.41Å; V225-R229 PolarHBondContact O-N 3.35Å
226	I	88.9	Confident	85.8	Confident	13 Å²	13	76.3 Å²	76.3	7%	0.067	34%	0.341	C	S	.	.	H	α-helix	trans	-61.2	-43.9	175.1	-71	172.3	0	0	0	110.6	I145 I222 F223 R229 W230 Y437 K441 V444	I145-I226 HydrophobicContact CD1-CD1 4.42Å; I145-I226 HydrophobicContact CG2-CG1 4.4Å; I222-I226 HydrophobicContact CG2-CD1 3.68Å; I222-I226 HydrophobicContact CG2-CG1 4.39Å; I222-I226 WeakPolarHBondContact O-CG1 3.21Å; I222-I226 PolarHBondContact O-N 3.3Å; F223-I226 PolarHBondContact O-N 2.86Å; I226-R229 PolarHBondContact O-N 3.08Å; I226-W230 WeakPolarHBondContact O-CB 3.39Å; I226-W230 PolarHBondContact O-N 3.37Å; I226-Y437 WeakPolarHBondContact CA-OH 3.37Å; I226-Y437 PolarHBondContact O-OH 3.13Å; I226-K441 HydrophobicContact CG2-CD 4.3Å; I226-V444 HydrophobicContact CD1-CG1 4.11Å
227	H	87.8	Confident	84.1	Confident	92 Å²	92	80.9 Å²	80.9	43%	0.426	35%	0.353	S	S	.	.	H	α-helix	trans	-64.4	-44.8	179	-172.7	50.3	0	0	0	111.7	F223 W224 V225 W230 K231	F223-H227 VanDerWaalsContact O-CB 3.31Å; F223-H227 WeakPolarHBondContact O-CB 3.23Å; F223-H227 PolarHBondContact O-N 3.08Å; W224-H227 PolarHBondContact O-N 2.88Å; V225-H227 VanDerWaalsContact C-N 3.33Å; V225-H227 PolarHBondContact O-N 2.87Å; H227-W230 AromaticContact ND1-CE3 3.92Å; H227-W230 PolarHBondContact O-N 3.44Å; H227-K231 VanDerWaalsContact NE2-CE 3.29Å; H227-K231 WeakPolarHBondContact NE2-CE 3.2Å; H227-K231 PolarHBondContact O-N 3.48Å
228	R	86.5	Confident	81.5	Confident	133 Å²	133	81.5 Å²	81.5	50%	0.502	36%	0.356	S	S	.	.	H	α-helix	trans	-57.8	-50.6	175.5	-179.5	178.3	172.9	169.9	4	111.6	W224 V225 W230 K231 E232	W224-R228 WeakPolarHBondContact O-CB 3.42Å; W224-R228 PolarHBondContact O-N 3.12Å; V225-R228 PolarHBondContact O-N 2.94Å; R228-W230 VanDerWaalsContact C-N 3.29Å; R228-W230 PolarHBondContact O-N 3.23Å; R228-K231 WeakPolarHBondContact O-CB 3.37Å; R228-K231 PolarHBondContact O-N 2.87Å; R228-E232 WeakPolarHBondContact CG-OE1 3.28Å; R228-E232 IonicContact CZ-OE1 3.99Å; R228-E232 IonicContact NE-OE1 3.11Å; R228-E232 PolarHBondContact NE-OE1 3.3Å; R228-E232 VanDerWaalsContact NE-OE1 3.11Å; R228-E232 IonicContact NH2-OE1 3.99Å; R228-E232 WeakPolarHBondContact O-CG 3.39Å; R228-E232 PolarHBondContact O-N 3.11Å
229	R	82.4	Confident	78.9	Confident	67 Å²	67	86.1 Å²	86.1	25%	0.253	38%	0.38	S	S	.	.	H	α-helix	trans	-63.9	-34.5	178.2	-74.2	-179.1	179.5	168.3	7.4	112.6	I145 V225 I226 E232 L233 Y437	I145-R229 PolarHBondContact O-NH1 3.5Å; I145-R229 PolarHBondContact O-NH2 2.9Å; V225-R229 WeakPolarHBondContact O-CG 3.41Å; V225-R229 PolarHBondContact O-N 3.35Å; I226-R229 PolarHBondContact O-N 3.08Å; R229-E232 PolarHBondContact O-N 3.25Å; R229-L233 WeakPolarHBondContact O-CB 3.1Å; R229-L233 VanDerWaalsContact O-CG 3.27Å; R229-L233 WeakPolarHBondContact O-CG 3.33Å; R229-L233 PolarHBondContact O-N 3.01Å; R229-Y437 HydrophobicContact CB-CE2 4.19Å; R229-Y437 WeakPolarHBondContact CB-OH 3.2Å
230	W	80.8	Confident	76.4	Confident	120 Å²	120	91.9 Å²	91.9	46%	0.455	41%	0.406	S	S	.	.	H	α-helix	trans	-64.6	-43	174.7	176.1	79	0	0	0	111.8	I226 H227 R228 L233 K234	I226-W230 WeakPolarHBondContact O-CB 3.39Å; I226-W230 PolarHBondContact O-N 3.37Å; H227-W230 AromaticContact ND1-CE3 3.92Å; H227-W230 PolarHBondContact O-N 3.44Å; R228-W230 VanDerWaalsContact C-N 3.29Å; R228-W230 PolarHBondContact O-N 3.23Å; W230-L233 PolarHBondContact O-N 3.06Å; W230-K234 HydrophobicContact CH2-CD 4.21Å; W230-K234 HydrophobicContact CZ2-CD 4.23Å; W230-K234 WeakPolarHBondContact O-CB 3.47Å; W230-K234 PolarHBondContact O-N 3.31Å
231	K	81.1	Confident	73.7	Confident	99 Å²	99	90 Å²	90	43%	0.43	40%	0.397	S	S	.	.	H	α-helix	trans	-59.8	-49.1	173.1	-70.2	-175.6	-179	-176.1	0	111.1	H227 R228 L233 K234 F235	H227-K231 VanDerWaalsContact NE2-CE 3.29Å; H227-K231 WeakPolarHBondContact NE2-CE 3.2Å; H227-K231 PolarHBondContact O-N 3.48Å; R228-K231 WeakPolarHBondContact O-CB 3.37Å; R228-K231 PolarHBondContact O-N 2.87Å; K231-L233 VanDerWaalsContact C-N 3.32Å; K231-L233 PolarHBondContact O-N 3.29Å; K231-K234 PolarHBondContact O-N 3.17Å; K231-K234 VanDerWaalsContact O-N 3.08Å; K231-F235 HydrophobicContact CB-CD2 4.35Å; K231-F235 HydrophobicContact CB-CE2 4.39Å; K231-F235 WeakPolarHBondContact O-CD2 3.37Å; K231-F235 PolarHBondContact O-N 3.35Å
232	E	78.7	Confident	71.2	Confident	69 Å²	69	90 Å²	90	32%	0.322	41%	0.41	S	S	.	.	H	α-helix	trans	-58.8	-41.1	178.5	-70.8	168.9	-171.7	0	0	112.3	R228 R229 G236 F254	R228-E232 WeakPolarHBondContact CG-OE1 3.28Å; R228-E232 IonicContact CZ-OE1 3.99Å; R228-E232 IonicContact NE-OE1 3.11Å; R228-E232 PolarHBondContact NE-OE1 3.3Å; R228-E232 VanDerWaalsContact NE-OE1 3.11Å; R228-E232 IonicContact NH2-OE1 3.99Å; R228-E232 WeakPolarHBondContact O-CG 3.39Å; R228-E232 PolarHBondContact O-N 3.11Å; R229-E232 PolarHBondContact O-N 3.25Å; E232-G236 PolarHBondContact O-N 2.96Å; E232-F254 HydrophobicContact CB-CE1 4.16Å; E232-F254 HydrophobicContact CG-CE1 4.29Å
233	L	75.3	Confident	68.9	Low	74 Å²	74	99.2 Å²	99.2	39%	0.387	45%	0.45	S	S	.	.	H	α-helix	trans	-67.8	-33.8	175.1	-73.8	170.1	0	0	0	112.8	R229 W230 K231 K237 Y437	R229-L233 WeakPolarHBondContact O-CB 3.1Å; R229-L233 VanDerWaalsContact O-CG 3.27Å; R229-L233 WeakPolarHBondContact O-CG 3.33Å; R229-L233 PolarHBondContact O-N 3.01Å; W230-L233 PolarHBondContact O-N 3.06Å; K231-L233 VanDerWaalsContact C-N 3.32Å; K231-L233 PolarHBondContact O-N 3.29Å; L233-K237 WeakPolarHBondContact O-CB 3.3Å; L233-K237 WeakPolarHBondContact O-CG 3.15Å; L233-K237 PolarHBondContact O-N 3.22Å; L233-Y437 HydrophobicContact CD1-CD1 4.26Å; L233-Y437 HydrophobicContact CD1-CE1 4.15Å
234	K	73.3	Confident	66.3	Low	131 Å²	131	100.5 Å²	100.5	57%	0.57	46%	0.458	S	S	*	.	H	α-helix	trans	-72.2	-45.1	176.1	-169.4	-178.7	178.7	-175.3	0	111.4	W230 K231 K237 F238	W230-K234 HydrophobicContact CH2-CD 4.21Å; W230-K234 HydrophobicContact CZ2-CD 4.23Å; W230-K234 WeakPolarHBondContact O-CB 3.47Å; W230-K234 PolarHBondContact O-N 3.31Å; K231-K234 PolarHBondContact O-N 3.17Å; K231-K234 VanDerWaalsContact O-N 3.08Å; K234-K237 WeakPolarHBondContact O-CB 3.41Å; K234-K237 PolarHBondContact O-N 3.46Å; K234-F238 PolarHBondContact O-N 3.16Å; K234-F238 VanDerWaalsContact O-N 3.09Å
235	F	69.6	Low	63.4	Low	144 Å²	144	100.5 Å²	100.5	63%	0.632	46%	0.463	S	S	*	.	H	α-helix	trans	-64.2	-42.2	174.6	-79.2	-69.6	0	0	0	111.9	K231 K237 F238 L239	K231-F235 HydrophobicContact CB-CD2 4.35Å; K231-F235 HydrophobicContact CB-CE2 4.39Å; K231-F235 WeakPolarHBondContact O-CD2 3.37Å; K231-F235 PolarHBondContact O-N 3.35Å; F235-K237 VanDerWaalsContact C-N 3.32Å; F235-K237 PolarHBondContact O-N 2.94Å; F235-F238 WeakPolarHBondContact O-CB 3.49Å; F235-F238 PolarHBondContact O-N 2.99Å; F235-L239 PolarHBondContact O-N 3.01Å; F235-L239 VanDerWaalsContact O-N 3.08Å
236	G	62.4	Low	60.8	Low	14 Å²	14	110.4 Å²	110.4	14%	0.144	50%	0.498	C	S	.	.	H	α-helix	trans	-59	-42.6	172.9	0	0	0	0	0	112.1	E232 F238 L239 F240	E232-G236 PolarHBondContact O-N 2.96Å; G236-F238 VanDerWaalsContact C-N 3.27Å; G236-F238 PolarHBondContact O-N 3.2Å; G236-L239 PolarHBondContact O-N 3.39Å; G236-F240 VanDerWaalsContact O-CD2 3.25Å; G236-F240 WeakPolarHBondContact O-CD2 3.47Å; G236-F240 PolarHBondContact O-N 3.03Å
237	K	57.9	Low	58	Low	123 Å²	123	118.6 Å²	118.6	54%	0.535	53%	0.534	S	S	.	.	H	α-helix	trans	-60	-36	173.1	-81.9	-179.7	179.4	-173.4	0	113	L233 K234 F235 F240 N241	L233-K237 WeakPolarHBondContact O-CB 3.3Å; L233-K237 WeakPolarHBondContact O-CG 3.15Å; L233-K237 PolarHBondContact O-N 3.22Å; K234-K237 WeakPolarHBondContact O-CB 3.41Å; K234-K237 PolarHBondContact O-N 3.46Å; F235-K237 VanDerWaalsContact C-N 3.32Å; F235-K237 PolarHBondContact O-N 2.94Å; K237-F240 PolarHBondContact O-N 3.33Å; K237-N241 PolarHBondContact O-N 3.36Å
238	F	41.3	Very low	55.2	Low	127 Å²	127	118.4 Å²	118.4	56%	0.557	56%	0.557	S	S	*	*	H	α-helix	trans	-67.2	-45.3	179.3	-154	-86.7	0	0	0	111	K234 F235 G236 F240 N241 E244	K234-F238 PolarHBondContact O-N 3.16Å; K234-F238 VanDerWaalsContact O-N 3.09Å; F235-F238 WeakPolarHBondContact O-CB 3.49Å; F235-F238 PolarHBondContact O-N 2.99Å; G236-F238 VanDerWaalsContact C-N 3.27Å; G236-F238 PolarHBondContact O-N 3.2Å; F238-F240 VanDerWaalsContact C-N 3.26Å; F238-F240 PolarHBondContact O-N 2.98Å; F238-N241 WeakPolarHBondContact O-CB 3.4Å; F238-N241 PolarHBondContact O-N 2.89Å; F238-E244 WeakPolarHBondContact CE1-OE2 3.36Å
239	L	42.1	Very low	52.5	Low	109 Å²	109	116.5 Å²	116.5	57%	0.571	56%	0.564	S	S	*	*	H	α-helix	trans	-63.4	-27.2	177	-77.2	158.1	0	0	0	114.1	F235 G236	F235-L239 PolarHBondContact O-N 3.01Å; F235-L239 VanDerWaalsContact O-N 3.08Å; G236-L239 PolarHBondContact O-N 3.39Å
240	F	42.3	Very low	50.1	Low	134 Å²	134	123.6 Å²	123.6	59%	0.588	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	2.2	178.4	-80.7	-73.1	0	0	0	113.9	G236 K237 F238 P242	G236-F240 VanDerWaalsContact O-CD2 3.25Å; G236-F240 WeakPolarHBondContact O-CD2 3.47Å; G236-F240 PolarHBondContact O-N 3.03Å; K237-F240 PolarHBondContact O-N 3.33Å; F238-F240 VanDerWaalsContact C-N 3.26Å; F238-F240 PolarHBondContact O-N 2.98Å; F240-P242 WeakPolarHBondContact O-CD 3.28Å; F240-P242 VanDerWaalsContact O-N 3.11Å
241	N	36.9	Very low	47.6	Very low	81 Å²	81	125.9 Å²	125.9	43%	0.433	61%	0.61	S	S	.	*			trans	-69.8	109.3	180	-159.9	-6.6	0	0	0	109.2	K237 F238 K243 E244	K237-N241 PolarHBondContact O-N 3.36Å; F238-N241 WeakPolarHBondContact O-CB 3.4Å; F238-N241 PolarHBondContact O-N 2.89Å; N241-K243 PolarHBondContact O-N 3.06Å; N241-E244 PolarHBondContact O-N 3.17Å
242	P	42.8	Very low	45.3	Very low	102 Å²	102	127.6 Å²	127.6	66%	0.662	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-64.2	-13.2	-167.3	24.4	-33.7	0	0	0	114	F240 E244	F240-P242 WeakPolarHBondContact O-CD 3.28Å; F240-P242 VanDerWaalsContact O-N 3.11Å; P242-E244 VanDerWaalsContact C-N 3.34Å; P242-E244 PolarHBondContact O-N 2.98Å
243	K	43.4	Very low	43.1	Very low	192 Å²	192	131.1 Å²	131.1	84%	0.835	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-72.4	-21.4	179	-68.3	-170.2	176.5	-175.5	0	114	N241	N241-K243 PolarHBondContact O-N 3.06Å
244	E	37	Very low	41.1	Very low	127 Å²	127	134 Å²	134	59%	0.593	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-92.9	-0.2	179.6	-80.4	-176	167.1	0	0	114.2	F238 N241 P242 R246	F238-E244 WeakPolarHBondContact CE1-OE2 3.36Å; N241-E244 PolarHBondContact O-N 3.17Å; P242-E244 VanDerWaalsContact C-N 3.34Å; P242-E244 PolarHBondContact O-N 2.98Å; E244-R246 PolarHBondContact O-N 3.43Å
245	H	32.7	Very low	39	Very low	141 Å²	141	132.8 Å²	132.8	65%	0.653	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	19	-177.7	-90.8	-76.8	0	0	0	116
246	R	34.1	Very low	37.1	Very low	226 Å²	226	130.2 Å²	130.2	85%	0.853	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-12.1	176.7	-140.7	178.4	-154.4	179.2	6.5	114.6	E244	E244-R246 PolarHBondContact O-N 3.43Å
247	F	28.8	Very low	35.4	Very low	186 Å²	186	136.1 Å²	136.1	82%	0.816	69%	0.69	S	S	*	*	S	Bend	trans	-130.1	120.6	174	-79	-87.3	0	0	0	110.6	S249	F247-S249 PolarHBondContact O-N 3.21Å
248	G	30.5	Very low	34	Very low	87 Å²	87	137.9 Å²	137.9	90%	0.897	71%	0.705	S	S	*	*			trans	-65.5	124.7	-171.9	0	0	0	0	0	113.6
249	S	28.9	Very low	33.4	Very low	93 Å²	93	138.2 Å²	138.2	65%	0.65	71%	0.711	S	S	*	*			trans	-178.1	95	152.5	-170.6	0	0	0	0	106.5	F247	F247-S249 PolarHBondContact O-N 3.21Å
250	F	33	Very low	32.7	Very low	217 Å²	217	143.1 Å²	143.1	95%	0.952	72%	0.724	S	S	*	*				26.5	72.8	83.4	-93.3	-82.4	0	0	0	114.3
251	K	28.4	Very low	32	Very low	168 Å²	168	144.8 Å²	144.8	73%	0.73	74%	0.739	S	S	*	*			trans	-131.7	97.2	160.6	-143	171.6	-174.9	176.5	0	111.5
252	L	30.9	Very low	31.6	Very low	135 Å²	135	152.2 Å²	152.2	71%	0.707	76%	0.761	S	S	*	*			trans	37.3	104.3	159.6	-88.3	85.8	0	0	0	118.7	F254 V255	L252-F254 PolarHBondContact O-N 2.68Å; L252-V255 HydrophobicContact CD2-CG2 3.58Å
253	L	32.3	Very low	30.9	Very low	142 Å²	142	152.7 Å²	152.7	74%	0.743	77%	0.766	S	S	*	*	S	Bend	trans	-63.4	115.6	151.6	-108.5	101.1	0	0	0	109.5
254	F	33.7	Very low	30.1	Very low	135 Å²	135	154.2 Å²	154.2	59%	0.592	77%	0.774	S	S	*	*			trans	41.8	82.6	153.3	-61.1	-81.9	0	0	0	116.5	E232 L252 A256	E232-F254 HydrophobicContact CB-CE1 4.16Å; E232-F254 HydrophobicContact CG-CE1 4.29Å; L252-F254 PolarHBondContact O-N 2.68Å; F254-A256 PolarHBondContact O-N 2.86Å; F254-A256 VanDerWaalsContact O-N 3.1Å
255	V	28.9	Very low	29.6	Very low	105 Å²	105	150.4 Å²	150.4	64%	0.636	77%	0.768	S	S	*	*			trans	-53.9	107.6	157	176.4	0	0	0	0	108.7	L252 N257	L252-V255 HydrophobicContact CD2-CG2 3.58Å; V255-N257 PolarHBondContact O-N 3.34Å
256	A	29.9	Very low	29.4	Very low	90 Å²	90	152.9 Å²	152.9	74%	0.744	78%	0.779	S	S	*	*			trans	-64.6	121.9	162.9	0	0	0	0	0	108.1	F254	F254-A256 PolarHBondContact O-N 2.86Å; F254-A256 VanDerWaalsContact O-N 3.1Å
257	N	28.3	Very low	29.1	Very low	138 Å²	138	152.2 Å²	152.2	74%	0.738	78%	0.783	S	S	*	*			trans	37.8	117.3	161.5	-75.6	-11.6	0	0	0	118.6	V255 I259	V255-N257 PolarHBondContact O-N 3.34Å; N257-I259 PolarHBondContact O-N 3.37Å
258	N	28.4	Very low	29.2	Very low	160 Å²	160	152.2 Å²	152.2	86%	0.856	78%	0.782	S	S	*	*	S	Bend	trans	-43.9	90.4	161.2	-69.1	-14.5	0	0	0	113.2
259	I	28.6	Very low	29.1	Very low	135 Å²	135	158.3 Å²	158.3	69%	0.692	78%	0.78	S	S	*	*			trans	-145.6	133.5	150.7	-54.2	-177.4	0	0	0	105.2	N257	N257-I259 PolarHBondContact O-N 3.37Å
260	Y	27	Very low	29.1	Very low	212 Å²	212	159.9 Å²	159.9	83%	0.831	79%	0.789	S	S	*	*			trans	90.4	51.1	-175.6	-58.2	-78.7	0	0	0	117.4	R262	Y260-R262 PolarHBondContact O-N 3.4Å
261	N	27.7	Very low	28.8	Very low	169 Å²	169	159.5 Å²	159.5	90%	0.904	79%	0.788	S	S	*	*			trans	-82	86.3	142.3	-93.3	-10.7	0	0	0	108.8
262	R	27.6	Very low	28.8	Very low	237 Å²	237	157.1 Å²	157.1	89%	0.894	79%	0.792	S	S	*	*	S	Bend	trans	-174.3	134	149.6	-108.4	175.2	-175.1	-166.1	1.5	109	Y260	Y260-R262 PolarHBondContact O-N 3.4Å
263	S	29.1	Very low	28.6	Very low	111 Å²	111	156.1 Å²	156.1	78%	0.776	80%	0.796	S	S	*	*			trans	83.2	51.3	175.3	-164	0	0	0	0	117.4	G265	S263-G265 PolarHBondContact O-N 3.18Å
264	F	26.3	Very low	28.4	Very low	225 Å²	225	156.8 Å²	156.8	99%	0.987	80%	0.796	S	S	*	*			trans	-85.8	69.2	151.1	-132.9	-88.2	0	0	0	108.4
265	G	27	Very low	28.1	Very low	46 Å²	46	157.5 Å²	157.5	47%	0.474	81%	0.806	S	S	.	*			trans	-147.7	122.2	179.1	0	0	0	0	0	109.4	S263	S263-G265 PolarHBondContact O-N 3.18Å
266	H	28.6	Very low	28.1	Very low	193 Å²	193	156.8 Å²	156.8	89%	0.894	81%	0.805	S	S	*	*			trans	67.5	88	168.5	-89.3	-81.6	0	0	0	119.1
267	K	28.1	Very low	28.1	Very low	212 Å²	212	161 Å²	161	92%	0.922	82%	0.815	S	S	*	*			trans	-167.5	77.8	133.1	-109.2	170	-177.7	177.5	0	110.2
268	K	29.6	Very low	28.2	Very low	186 Å²	186	162.2 Å²	162.2	81%	0.809	82%	0.816	S	S	*	*			trans	-81.1	153	152.1	-130.1	171.9	-179.7	177	0	105.9
269	Y	29.4	Very low	28.1	Very low	216 Å²	216	166.1 Å²	166.1	85%	0.847	82%	0.819	S	S	*	*			trans	90.3	77.7	-174.8	-51.5	-74.9	0	0	0	115.8
270	C	28.7	Very low	28	Very low	125 Å²	125	163.8 Å²	163.8	85%	0.845	81%	0.805	S	S	*	*			trans	-165.4	73.6	143.7	-102.9	0	0	0	0	108.2
271	F	26.5	Very low	27.9	Very low	209 Å²	209	159.3 Å²	159.3	92%	0.917	80%	0.795	S	S	*	*			trans	-135.9	90.4	170.6	-71.8	-73.5	0	0	0	108.6
272	S	28.5	Very low	27.9	Very low	119 Å²	119	158.4 Å²	158.4	83%	0.832	78%	0.783	S	S	*	*			trans	-98.5	112.1	161.1	67.8	0	0	0	0	108.4	H274	S272-H274 PolarHBondContact O-N 2.86Å
273	S	26.9	Very low	27.8	Very low	113 Å²	113	151.3 Å²	151.3	79%	0.79	77%	0.766	S	S	*	*			trans	-74.9	110.9	176.5	-173.4	0	0	0	0	108.9
274	H	27.2	Very low	27.7	Very low	157 Å²	157	150.1 Å²	150.1	73%	0.727	75%	0.754	S	S	*	*			trans	-106.8	123	167.2	-145.8	-76.7	0	0	0	109.5	S272 S276	S272-H274 PolarHBondContact O-N 2.86Å; H274-S276 PolarHBondContact O-N 3.31Å
275	N	28.3	Very low	27.9	Very low	150 Å²	150	147.2 Å²	147.2	80%	0.802	75%	0.749	S	S	*	*			trans	-67.9	116.4	179.2	-85.9	-34	0	0	0	110.8
276	S	28.9	Very low	28.1	Very low	89 Å²	89	148.2 Å²	148.2	62%	0.622	75%	0.749	S	S	*	*			trans	-155.8	133.5	149.7	63.7	0	0	0	0	109.2	H274 Q278	H274-S276 PolarHBondContact O-N 3.31Å; S276-Q278 PolarHBondContact O-N 2.82Å
277	N	29.9	Very low	28.4	Very low	178 Å²	178	145.9 Å²	145.9	95%	0.952	75%	0.748	S	S	*	*	S	Bend	trans	-72.7	43.6	-170.2	-77.7	-34.9	0	0	0	114.5
278	Q	29.7	Very low	28.8	Very low	165 Å²	165	145.2 Å²	145.2	77%	0.771	75%	0.748	S	S	*	*	S	Bend	trans	-132.2	110.8	173.7	-77	-175.5	-11.9	0	0	110.5	S276 Q280	S276-Q278 PolarHBondContact O-N 2.82Å; Q278-Q280 PolarHBondContact O-N 3.49Å; Q278-Q280 VanDerWaalsContact O-N 3.1Å
279	R	26.8	Very low	28.7	Very low	241 Å²	241	140 Å²	140	91%	0.909	74%	0.735	S	S	*	*			trans	17.6	82.5	154.7	-59.6	-179.2	-177.2	-177.4	2.7	114.3	L281	R279-L281 PolarHBondContact O-N 3.22Å
280	Q	25.9	Very low	28.7	Very low	87 Å²	87	135.3 Å²	135.3	41%	0.407	73%	0.725	S	S	.	*			trans	-69.4	94.5	170.8	-79.6	176	5.5	0	0	109.2	Q278 F282 Y295	Q278-Q280 PolarHBondContact O-N 3.49Å; Q278-Q280 VanDerWaalsContact O-N 3.1Å; Q280-F282 HydrophobicContact CB-CD2 4.43Å; Q280-F282 HydrophobicContact CB-CE2 3.77Å; Q280-F282 HydrophobicContact CB-CZ 4.18Å; Q280-F282 HydrophobicContact CG-CZ 4.48Å; Q280-Y295 VanDerWaalsContact CB-OH 3.29Å; Q280-Y295 WeakPolarHBondContact CB-OH 3.28Å; Q280-Y295 PolarHBondContact O-OH 3.49Å
281	L	24.6	Very low	28.7	Very low	117 Å²	117	135 Å²	135	61%	0.613	72%	0.715	S	S	*	*			trans	-89.5	106.4	170.1	-129.6	106.4	0	0	0	107.2	R279 V283 F292	R279-L281 PolarHBondContact O-N 3.22Å; L281-V283 HydrophobicContact CD2-CG2 4.31Å; L281-V283 PolarHBondContact O-N 3.42Å; L281-F292 HydrophobicContact CD2-CD1 4.09Å; L281-F292 HydrophobicContact CD2-CE1 4.36Å
282	F	27.5	Very low	28.7	Very low	151 Å²	151	132.2 Å²	132.2	66%	0.662	70%	0.702	S	S	*	*			trans	-84.7	104.4	174.2	-67.4	-82.4	0	0	0	109.1	Q280	Q280-F282 HydrophobicContact CB-CD2 4.43Å; Q280-F282 HydrophobicContact CB-CE2 3.77Å; Q280-F282 HydrophobicContact CB-CZ 4.18Å; Q280-F282 HydrophobicContact CG-CZ 4.48Å
283	V	25.9	Very low	28.7	Very low	88 Å²	88	132.8 Å²	132.8	53%	0.533	70%	0.695	S	S	.	*			trans	-90.3	114.1	174.4	179.7	0	0	0	0	107.7	L281 N285	L281-V283 HydrophobicContact CD2-CG2 4.31Å; L281-V283 PolarHBondContact O-N 3.42Å; V283-N285 PolarHBondContact O-N 3.38Å
284	T	27.6	Very low	28.6	Very low	86 Å²	86	132.2 Å²	132.2	53%	0.528	70%	0.697	S	S	.	*			trans	-81.9	114.4	173.4	71.6	0	0	0	0	108.6	S286	T284-S286 PolarHBondContact O-N 2.93Å
285	N	29.9	Very low	28.6	Very low	164 Å²	164	130.8 Å²	130.8	88%	0.877	69%	0.686	S	S	*	*			trans	-70.5	80.3	168.8	-91.1	-11.3	0	0	0	109.5	V283	V283-N285 PolarHBondContact O-N 3.38Å
286	S	31.9	Very low	28.5	Very low	66 Å²	66	129.9 Å²	129.9	46%	0.462	69%	0.686	S	S	.	*			trans	-121.6	112.9	155.3	88.8	0	0	0	0	107.5	T284 Q288	T284-S286 PolarHBondContact O-N 2.93Å; S286-Q288 VanDerWaalsContact C-N 3.27Å; S286-Q288 PolarHBondContact O-N 3.28Å
287	T	35.1	Very low	28.4	Very low	145 Å²	145	131.2 Å²	131.2	89%	0.89	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	88	178	45	0	0	0	0	109.5
288	Q	35.2	Very low	28.5	Very low	197 Å²	197	128.3 Å²	128.3	92%	0.921	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	163.9	5.1	147.7	-90.2	177.9	13.4	0	0	114.1	S286	S286-Q288 VanDerWaalsContact C-N 3.27Å; S286-Q288 PolarHBondContact O-N 3.28Å
289	S	28.3	Very low	28.5	Very low	77 Å²	77	126.1 Å²	126.1	54%	0.538	68%	0.682	S	S	.	*			trans	-157.3	95.7	170.5	51.2	0	0	0	0	111.8	L291	S289-L291 VanDerWaalsContact C-N 3.34Å; S289-L291 PolarHBondContact O-N 2.97Å
290	N	28.6	Very low	28.5	Very low	117 Å²	117	126.1 Å²	126.1	63%	0.626	68%	0.682	S	S	*	*			trans	-70.2	92	169.4	-68.9	-20.8	0	0	0	108.9	F292	N290-F292 HydrophobicContact CB-CE2 4Å; N290-F292 HydrophobicContact CB-CZ 4.28Å
291	L	29.1	Very low	28.7	Very low	120 Å²	120	133.2 Å²	133.2	63%	0.628	71%	0.705	S	S	*	*			trans	-88	124	173	-179.3	68	0	0	0	109.3	S289 I293	S289-L291 VanDerWaalsContact C-N 3.34Å; S289-L291 PolarHBondContact O-N 2.97Å; L291-I293 HydrophobicContact CD2-CD1 4.27Å; L291-I293 HydrophobicContact CD2-CG1 4.37Å; L291-I293 HydrophobicContact CG-CG1 4.32Å
292	F	27.9	Very low	28.9	Very low	150 Å²	150	137.1 Å²	137.1	66%	0.658	72%	0.717	S	S	*	*			trans	-102.6	119	176.7	-61.7	-90.1	0	0	0	109.7	L281 N290	L281-F292 HydrophobicContact CD2-CD1 4.09Å; L281-F292 HydrophobicContact CD2-CE1 4.36Å; N290-F292 HydrophobicContact CB-CE2 4Å; N290-F292 HydrophobicContact CB-CZ 4.28Å
293	I	26.9	Very low	28.9	Very low	131 Å²	131	137.9 Å²	137.9	67%	0.672	73%	0.728	S	S	*	*			trans	-110.1	112.4	172.8	-58.8	176.5	0	0	0	107.9	L291	L291-I293 HydrophobicContact CD2-CD1 4.27Å; L291-I293 HydrophobicContact CD2-CG1 4.37Å; L291-I293 HydrophobicContact CG-CG1 4.32Å
294	A	25.6	Very low	29	Very low	101 Å²	101	140.2 Å²	140.2	84%	0.835	74%	0.742	S	S	*	*			trans	-97.5	123.1	172	0	0	0	0	0	109.5
295	Y	25.9	Very low	29	Very low	127 Å²	127	138.9 Å²	138.9	50%	0.498	75%	0.745	S	S	.	*			trans	-106.1	142.3	168.5	56.6	-85.7	0	0	0	109.4	Q280	Q280-Y295 VanDerWaalsContact CB-OH 3.29Å; Q280-Y295 WeakPolarHBondContact CB-OH 3.28Å; Q280-Y295 PolarHBondContact O-OH 3.49Å
296	T	28.1	Very low	28.7	Very low	131 Å²	131	140.7 Å²	140.7	80%	0.804	75%	0.745	S	S	*	*			trans	-106.8	127.8	169.9	61.8	0	0	0	0	108.2	S298	T296-S298 PolarHBondContact O-N 3.27Å
297	T	26.3	Very low	28.3	Very low	116 Å²	116	148.1 Å²	148.1	71%	0.712	77%	0.765	S	S	*	*			trans	-70	117	176.3	48.3	0	0	0	0	109.2	T299	T297-T299 PolarHBondContact O-N 2.97Å
298	S	30.7	Very low	27.8	Very low	118 Å²	118	146.9 Å²	146.9	83%	0.825	76%	0.757	S	S	*	*			trans	-65.5	100.1	172.3	176.4	0	0	0	0	109.6	T296 R300	T296-S298 PolarHBondContact O-N 3.27Å; S298-R300 PolarHBondContact O-N 2.91Å
299	T	30	Very low	27.3	Very low	118 Å²	118	144.1 Å²	144.1	72%	0.724	75%	0.753	S	S	*	*			trans	-73.3	110.7	165.9	46.7	0	0	0	0	108	T297 R301	T297-T299 PolarHBondContact O-N 2.97Å; T299-R301 PolarHBondContact O-N 2.91Å
300	R	28.5	Very low	27.1	Very low	241 Å²	241	147.3 Å²	147.3	91%	0.909	77%	0.765	S	S	*	*			trans	-46.3	102.2	171.7	-154.5	177.4	-169.4	-177.9	2.7	108.9	S298 K302	S298-R300 PolarHBondContact O-N 2.91Å; R300-K302 PolarHBondContact O-N 3.35Å; R300-K302 VanDerWaalsContact O-N 3.11Å
301	R	29.4	Very low	26.8	Very low	237 Å²	237	150.4 Å²	150.4	89%	0.894	78%	0.775	S	S	*	*			trans	-62.4	113.9	176.8	-93.5	-178.3	174.4	166.2	-2.9	108.1	T299	T299-R301 PolarHBondContact O-N 2.91Å
302	K	28.4	Very low	26.5	Very low	198 Å²	198	150 Å²	150	86%	0.861	78%	0.783	S	S	*	*			trans	-62.1	134.2	165	-80.7	-177.4	174.3	-179.6	0	108.4	R300 V304	R300-K302 PolarHBondContact O-N 3.35Å; R300-K302 VanDerWaalsContact O-N 3.11Å; K302-V304 PolarHBondContact O-N 3.23Å
303	N	27.7	Very low	26.2	Very low	167 Å²	167	150.3 Å²	150.3	89%	0.893	79%	0.786	S	S	*	*			trans	-49.2	120.6	177.5	-68.1	-29.9	0	0	0	110.9
304	V	27.9	Very low	26.1	Very low	138 Å²	138	151 Å²	151	84%	0.836	80%	0.796	S	S	*	*			trans	-124.1	112.6	164.9	176.9	0	0	0	0	107.5	K302	K302-V304 PolarHBondContact O-N 3.23Å
305	G	27.2	Very low	26	Very low	57 Å²	57	153.6 Å²	153.6	59%	0.588	79%	0.791	S	S	*	*			trans	60	99.2	143.6	0	0	0	0	0	117.7	Y307	G305-Y307 PolarHBondContact O-N 2.82Å
306	K	24.9	Very low	25.7	Very low	203 Å²	203	152.2 Å²	152.2	88%	0.883	80%	0.8	S	S	*	*			trans	-46.8	115.8	157.9	-71.1	171.5	175	175.8	0	110.2
307	Y	23.2	Very low	25.5	Very low	222 Å²	222	150.8 Å²	150.8	87%	0.871	80%	0.795	S	S	*	*			trans	-106.2	102.1	151.4	-84.8	-86	0	0	0	107.2	G305 V309	G305-Y307 PolarHBondContact O-N 2.82Å; Y307-V309 PolarHBondContact O-N 3.36Å
308	T	23.5	Very low	25.5	Very low	119 Å²	119	154 Å²	154	73%	0.73	81%	0.807	S	S	*	*			trans	-68.7	113.1	166.2	37.5	0	0	0	0	108.1
309	V	25.6	Very low	25.2	Very low	138 Å²	138	154.9 Å²	154.9	84%	0.836	81%	0.807	S	S	*	*			trans	-116.5	124.8	161.9	177.2	0	0	0	0	106.8	Y307	Y307-V309 PolarHBondContact O-N 3.36Å
310	N	24.5	Very low	25	Very low	145 Å²	145	155 Å²	155	78%	0.775	80%	0.803	S	S	*	*			trans	-62.7	141	-161.3	-66.3	-29.3	0	0	0	113.2	S312	N310-S312 PolarHBondContact O-N 2.97Å
311	Q	22.5	Very low	25	Very low	181 Å²	181	151.8 Å²	151.8	85%	0.846	80%	0.796	S	S	*	*			trans	-60.4	122.9	165.4	-73.1	165.8	-45.2	0	0	109.7
312	S	23	Very low	24.9	Very low	113 Å²	113	149.9 Å²	149.9	79%	0.79	79%	0.789	S	S	*	*			trans	-113.9	109.7	150.5	49.2	0	0	0	0	108.2	N310 V314	N310-S312 PolarHBondContact O-N 2.97Å; S312-V314 PolarHBondContact O-N 3.1Å
313	H	20.8	Very low	25	Very low	156 Å²	156	145.6 Å²	145.6	72%	0.722	78%	0.783	S	S	*	*			trans	-55.6	119.9	164.1	-93.9	-95.5	0	0	0	109.7
314	V	25.5	Very low	25.1	Very low	145 Å²	145	145.4 Å²	145.4	88%	0.879	78%	0.777	S	S	*	*			trans	-135.5	122.6	144.6	-179	0	0	0	0	107.8	S312	S312-V314 PolarHBondContact O-N 3.1Å
315	Q	22.4	Very low	24.9	Very low	156 Å²	156	146 Å²	146	73%	0.729	77%	0.771	S	S	*	*			trans	-92.4	139.8	-166.6	-171.7	159.1	-27.2	0	0	110.6
316	S	20.5	Very low	25	Very low	98 Å²	98	147.8 Å²	147.8	69%	0.685	77%	0.766	S	S	*	*			trans	52.4	137	150.4	74.6	0	0	0	0	122.6
317	S	23.3	Very low	25.2	Very low	101 Å²	101	145.6 Å²	145.6	71%	0.706	76%	0.759	S	S	*	*			trans	72.7	83.4	140	65	0	0	0	0	118.7
318	L	26.2	Very low	25.2	Very low	183 Å²	183	144.6 Å²	144.6	96%	0.958	75%	0.753	S	S	*	*			trans	-130.3	87.7	143.4	-88.2	163.7	0	0	0	108.4	D320	L318-D320 PolarHBondContact O-N 2.93Å
319	V	24.4	Very low	25.3	Very low	136 Å²	136	144 Å²	144	82%	0.824	75%	0.749	S	S	*	*			trans	-74.1	101.5	158.9	172.9	0	0	0	0	105.8
320	D	26	Very low	25.3	Very low	121 Å²	121	145.3 Å²	145.3	65%	0.647	74%	0.74	S	S	*	*	S	Bend	trans	-175.3	140.3	138.6	-123.5	-20.4	0	0	0	114.5	L318 R322	L318-D320 PolarHBondContact O-N 2.93Å; D320-R322 PolarHBondContact O-N 3.47Å
321	K	29.2	Very low	25.4	Very low	174 Å²	174	142.3 Å²	142.3	76%	0.757	73%	0.731	S	S	*	*			trans	54.7	27.6	146.8	-76	168.2	-173.4	173.1	0	123.1	S323	K321-S323 VanDerWaalsContact C-N 3.28Å; K321-S323 PolarHBondContact O-N 2.82Å
322	R	26.9	Very low	25.6	Very low	197 Å²	197	141.5 Å²	141.5	74%	0.743	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-2.3	170.2	-160.2	166.4	178.9	173.2	1.5	115.8	D320 I326	D320-R322 PolarHBondContact O-N 3.47Å; R322-I326 HydrophobicContact CG-CD1 4.23Å
323	S	29	Very low	25.8	Very low	107 Å²	107	141.1 Å²	141.1	75%	0.748	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-16.8	-176.5	-72.6	0	0	0	0	115.8	K321	K321-S323 VanDerWaalsContact C-N 3.28Å; K321-S323 PolarHBondContact O-N 2.82Å
324	E	30.2	Very low	26.1	Very low	164 Å²	164	137 Å²	137	77%	0.766	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	-21	-178.1	-71.4	-173.3	165.5	0	0	114.4
325	Q	24.7	Very low	26.2	Very low	150 Å²	150	135.6 Å²	135.6	70%	0.701	70%	0.7	S	S	*	*	H	α-helix	trans	-83.2	-22.8	-179.1	-122.6	174.4	-6.2	0	0	113.5	E327	Q325-E327 VanDerWaalsContact C-N 3.3Å; Q325-E327 PolarHBondContact O-N 2.88Å
326	I	29.6	Very low	26.4	Very low	94 Å²	94	136.3 Å²	136.3	48%	0.482	70%	0.704	S	S	.	*	H	α-helix	trans	-73.8	-22.9	178.3	-63.2	176.3	0	0	0	111.5	R322 Y330	R322-I326 HydrophobicContact CG-CD1 4.23Å; I326-Y330 HydrophobicContact CG2-CD2 4.13Å; I326-Y330 HydrophobicContact CG2-CE2 4.31Å
327	E	27.6	Very low	26.5	Very low	157 Å²	157	142.2 Å²	142.2	73%	0.734	71%	0.713	S	S	*	*	H	α-helix	trans	-82.3	-21.1	-178.1	-156.2	158	-161	0	0	113.5	Q325 S331	Q325-E327 VanDerWaalsContact C-N 3.3Å; Q325-E327 PolarHBondContact O-N 2.88Å; E327-S331 PolarHBondContact O-OG 2.89Å
328	R	24.8	Very low	26.6	Very low	202 Å²	202	141.7 Å²	141.7	76%	0.762	71%	0.714	S	S	*	*	H	α-helix	trans	-82.3	-40.3	175.3	-104.3	-170.2	-77.2	-172.8	-3.1	113.8	Y330 S331	R328-Y330 VanDerWaalsContact C-N 3.33Å; R328-Y330 PolarHBondContact O-N 2.73Å; R328-S331 PolarHBondContact O-N 2.67Å
329	V	25.6	Very low	26.4	Very low	106 Å²	106	140.7 Å²	140.7	64%	0.642	71%	0.705	S	S	*	*	H	α-helix	trans	-73.3	-22.4	-174.7	-179.4	0	0	0	0	113.3
330	Y	24.2	Very low	26.3	Very low	165 Å²	165	142.8 Å²	142.8	65%	0.647	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-2.1	179	-83.6	-76.8	0	0	0	115.4	I326 R328 S334	I326-Y330 HydrophobicContact CG2-CD2 4.13Å; I326-Y330 HydrophobicContact CG2-CE2 4.31Å; R328-Y330 VanDerWaalsContact C-N 3.33Å; R328-Y330 PolarHBondContact O-N 2.73Å; Y330-S334 PolarHBondContact O-OG 2.85Å
331	S	27.5	Very low	26.3	Very low	82 Å²	82	145 Å²	145	57%	0.573	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-24.6	-179.9	-63.1	0	0	0	0	113	E327 R328	E327-S331 PolarHBondContact O-OG 2.89Å; R328-S331 PolarHBondContact O-N 2.67Å
332	E	26.9	Very low	25.9	Very low	165 Å²	165	144.8 Å²	144.8	77%	0.771	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-25.1	-172.4	-73.9	178	171.7	0	0	114.6	T335	E332-T335 PolarHBondContact O-OG1 3.44Å
333	T	26.1	Very low	25.7	Very low	105 Å²	105	141.9 Å²	141.9	64%	0.644	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-6.4	178.9	32.8	0	0	0	0	114.5
334	S	27.3	Very low	25.4	Very low	70 Å²	70	142.9 Å²	142.9	49%	0.49	72%	0.716	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.2	-3.7	-176.6	-60.6	0	0	0	0	114.7	Y330	Y330-S334 PolarHBondContact O-OG 2.85Å
335	T	27.4	Very low	25.1	Very low	114 Å²	114	139.7 Å²	139.7	70%	0.699	71%	0.71	S	S	*	*	S	Bend	trans	-94	-13.5	-177	39.6	0	0	0	0	114.9	E332	E332-T335 PolarHBondContact O-OG1 3.44Å
336	Q	25.8	Very low	25	Very low	171 Å²	171	140 Å²	140	80%	0.799	72%	0.715	S	S	*	*	S	Bend	trans	-93.7	-11.8	-178.1	-88.2	179.7	-16.7	0	0	116.1
337	Y	23.5	Very low	24.7	Very low	222 Å²	222	140.5 Å²	140.5	87%	0.871	72%	0.724	S	S	*	*	S	Bend	trans	-112.4	13.5	-177.3	-81.9	-79.6	0	0	0	115.7	Q339	Y337-Q339 VanDerWaalsContact C-N 3.27Å; Y337-Q339 PolarHBondContact O-N 3.17Å
338	A	24.9	Very low	24.6	Very low	90 Å²	90	141.2 Å²	141.2	74%	0.744	73%	0.732	S	S	*	*			trans	-89.6	53.9	175.3	0	0	0	0	0	112
339	Q	22.5	Very low	24.7	Very low	162 Å²	162	137.7 Å²	137.7	76%	0.757	73%	0.733	S	S	*	*			trans	-113.6	118	170.7	-84.2	-176.2	-8.4	0	0	110.2	Y337	Y337-Q339 VanDerWaalsContact C-N 3.27Å; Y337-Q339 PolarHBondContact O-N 3.17Å
340	H	23.3	Very low	24.6	Very low	180 Å²	180	141.6 Å²	141.6	83%	0.833	74%	0.744	S	S	*	*			trans	57.3	80.6	160.3	-61	-81.1	0	0	0	118.8
341	I	24.1	Very low	24.8	Very low	167 Å²	167	144.2 Å²	144.2	86%	0.856	75%	0.752	S	S	*	*			trans	-104.2	106.2	156.1	-60.7	176.8	0	0	0	108
342	Q	21.3	Very low	24.7	Very low	170 Å²	170	150 Å²	150	79%	0.794	77%	0.767	S	S	*	*			trans	-60.4	133.3	174.7	-91.3	176.3	-25.8	0	0	111
343	I	23.9	Very low	24.8	Very low	137 Å²	137	148.4 Å²	148.4	70%	0.703	77%	0.769	S	S	*	*			trans	-88.9	115.1	176.1	-61.5	166	0	0	0	106.4	P345	I343-P345 WeakPolarHBondContact O-CD 3.47Å
344	V	22.1	Very low	24.8	Very low	127 Å²	127	152.9 Å²	152.9	77%	0.77	78%	0.779	S	S	*	*			trans	-95.3	105.2	165.3	-178.1	0	0	0	0	107.4	I346	V344-I346 PolarHBondContact O-N 3.5Å
345	P	24.4	Very low	24.8	Very low	98 Å²	98	154.1 Å²	154.1	64%	0.636	79%	0.788	S	S	*	*			trans	-72.3	123.3	172.1	-3	20.4	0	0	0	108.1	I343 P347	I343-P345 WeakPolarHBondContact O-CD 3.47Å; P345-P347 WeakPolarHBondContact O-CD 3.37Å
346	I	22.4	Very low	24.7	Very low	156 Å²	156	156 Å²	156	80%	0.8	79%	0.794	S	S	*	*			trans	-73.1	111.9	169.6	-59.5	168.9	0	0	0	106.8	V344 L348	V344-I346 PolarHBondContact O-N 3.5Å; I346-L348 PolarHBondContact O-N 3.34Å
347	P	23.8	Very low	24.7	Very low	105 Å²	105	152 Å²	152	68%	0.682	79%	0.79	S	S	*	*			trans	-71.7	123.6	177	-10.6	28	0	0	0	108.9	P345 V349	P345-P347 WeakPolarHBondContact O-CD 3.37Å; P347-V349 PolarHBondContact O-N 2.98Å
348	L	24.8	Very low	24.8	Very low	171 Å²	171	149.2 Å²	149.2	90%	0.895	79%	0.79	S	S	*	*			trans	-64.3	96.3	166.6	-91.5	131	0	0	0	108.5	I346 H350	I346-L348 PolarHBondContact O-N 3.34Å; L348-H350 PolarHBondContact O-N 3.4Å; L348-H350 VanDerWaalsContact O-N 3.09Å
349	V	26.3	Very low	24.7	Very low	128 Å²	128	150.4 Å²	150.4	78%	0.776	79%	0.792	S	S	*	*			trans	-69.9	105	170	176	0	0	0	0	108.1	P347 R351	P347-V349 PolarHBondContact O-N 2.98Å; V349-R351 PolarHBondContact O-N 3.22Å
350	H	24.7	Very low	24.7	Very low	189 Å²	189	153 Å²	153	88%	0.875	80%	0.801	S	S	*	*			trans	-69.6	95.8	166.9	-114.3	-13.4	0	0	0	108.4	L348 K352	L348-H350 PolarHBondContact O-N 3.4Å; L348-H350 VanDerWaalsContact O-N 3.09Å; H350-K352 PolarHBondContact O-N 3.38Å; H350-K352 VanDerWaalsContact O-N 3.14Å
351	R	27.8	Very low	24.8	Very low	220 Å²	220	148.5 Å²	148.5	83%	0.83	79%	0.79	S	S	*	*			trans	-71.7	104.8	174.8	-164.4	174.9	-162.2	166.9	3.7	108.9	V349 T353	V349-R351 PolarHBondContact O-N 3.22Å; R351-T353 PolarHBondContact O-N 3.1Å
352	K	25.6	Very low	24.8	Very low	203 Å²	203	145.5 Å²	145.5	88%	0.883	78%	0.784	S	S	*	*			trans	-64.1	126.2	161.4	-85.8	-177.8	176.9	178.4	0	108	H350 K354	H350-K352 PolarHBondContact O-N 3.38Å; H350-K352 VanDerWaalsContact O-N 3.14Å; K352-K354 PolarHBondContact O-N 2.76Å
353	T	27.6	Very low	24.8	Very low	131 Å²	131	147 Å²	147	80%	0.804	79%	0.788	S	S	*	*			trans	-68.7	118.4	-178.1	42	0	0	0	0	111.1	R351	R351-T353 PolarHBondContact O-N 3.1Å
354	K	26.8	Very low	24.8	Very low	199 Å²	199	145 Å²	145	87%	0.865	79%	0.786	S	S	*	*			trans	-168.6	126.7	139.6	-106	171.7	-178.3	-174.1	0	110	K352	K352-K354 PolarHBondContact O-N 2.76Å
355	S	27.5	Very low	24.7	Very low	97 Å²	97	146.2 Å²	146.2	68%	0.678	79%	0.786	S	S	*	*			trans	30.2	108.9	157.3	63.8	0	0	0	0	118.7
356	D	25.8	Very low	24.6	Very low	153 Å²	153	149.7 Å²	149.7	82%	0.818	79%	0.794	S	S	*	*				179.2	135.8	102.1	-83.4	-25.4	0	0	0	110.5
357	A	26.4	Very low	24.7	Very low	87 Å²	87	149.3 Å²	149.3	72%	0.719	79%	0.793	S	S	*	*			trans	-71	154.3	176.5	0	0	0	0	0	110.4
358	N	25.6	Very low	24.7	Very low	164 Å²	164	149.4 Å²	149.4	88%	0.877	80%	0.797	S	S	*	*			trans	86.1	66.3	171.9	-52.8	-16.6	0	0	0	117.3
359	C	22.3	Very low	24.6	Very low	115 Å²	115	148 Å²	148	78%	0.777	80%	0.795	S	S	*	*			trans	-138.1	91.6	148	-158	0	0	0	0	110.3	S361	C359-S361 PolarHBondContact O-N 2.99Å
360	F	23.1	Very low	24.5	Very low	215 Å²	215	150.2 Å²	150.2	94%	0.943	80%	0.797	S	S	*	*			trans	-94	67.9	170.8	-148.1	-87.5	0	0	0	107.5
361	S	25	Very low	24.5	Very low	87 Å²	87	149 Å²	149	61%	0.608	80%	0.797	S	S	*	*			trans	-95.2	107.4	172.7	56.4	0	0	0	0	109.5	C359 F363	C359-S361 PolarHBondContact O-N 2.99Å; S361-F363 PolarHBondContact O-N 3.38Å
362	S	23.9	Very low	24.3	Very low	104 Å²	104	144.6 Å²	144.6	73%	0.727	80%	0.795	S	S	*	*			trans	-57.2	114.2	169.4	51	0	0	0	0	109.9	S364	S362-S364 PolarHBondContact O-N 2.95Å; S362-S364 VanDerWaalsContact O-N 3.13Å
363	F	21.4	Very low	24.1	Very low	202 Å²	202	142.9 Å²	142.9	89%	0.886	79%	0.79	S	S	*	*			trans	-74.6	100.7	173.7	-127.6	-93.3	0	0	0	109.4	S361	S361-F363 PolarHBondContact O-N 3.38Å
364	S	22.6	Very low	23.8	Very low	93 Å²	93	143.5 Å²	143.5	65%	0.65	79%	0.787	S	S	*	*			trans	-82.2	120.3	169.2	31.6	0	0	0	0	109.8	S362 H366	S362-S364 PolarHBondContact O-N 2.95Å; S362-S364 VanDerWaalsContact O-N 3.13Å; S364-H366 PolarHBondContact O-N 3.3Å; S364-H366 VanDerWaalsContact O-N 3.11Å
365	I	21.9	Very low	23.5	Very low	153 Å²	153	144.3 Å²	144.3	79%	0.785	79%	0.786	S	S	*	*			trans	-68	103.1	178	-60.8	170.7	0	0	0	108.4
366	H	22.4	Very low	23.2	Very low	172 Å²	172	145.8 Å²	145.8	80%	0.796	79%	0.791	S	S	*	*			trans	-86.5	113.3	163.6	-112.6	-83.9	0	0	0	108.5	S364 S368	S364-H366 PolarHBondContact O-N 3.3Å; S364-H366 VanDerWaalsContact O-N 3.11Å; H366-S368 PolarHBondContact O-N 3.08Å
367	N	23.2	Very low	23	Very low	147 Å²	147	143.8 Å²	143.8	79%	0.786	79%	0.789	S	S	*	*			trans	-68.8	104.9	165.9	-87.7	-11.2	0	0	0	108
368	S	24.2	Very low	22.7	Very low	107 Å²	107	148.5 Å²	148.5	75%	0.748	80%	0.796	S	S	*	*			trans	-117.6	88.3	162.5	51.8	0	0	0	0	107.9	H366 E370	H366-S368 PolarHBondContact O-N 3.08Å; S368-E370 PolarHBondContact O-N 3.35Å
369	T	23	Very low	22.5	Very low	142 Å²	142	147.5 Å²	147.5	87%	0.871	80%	0.797	S	S	*	*			trans	-65.5	101.9	156.1	19.7	0	0	0	0	107.4
370	E	24.1	Very low	22.5	Very low	174 Å²	174	147.8 Å²	147.8	81%	0.813	80%	0.795	S	S	*	*			trans	-143.6	128.7	159.1	-130.1	169.9	-168	0	0	109	S368 T372	S368-E370 PolarHBondContact O-N 3.35Å; E370-T372 PolarHBondContact O-N 3.41Å
371	N	23.8	Very low	22.4	Very low	163 Å²	163	144.3 Å²	144.3	87%	0.872	79%	0.786	S	S	*	*			trans	-64.9	127.5	-172.9	-57.4	-40.9	0	0	0	109.1
372	T	23.4	Very low	22.2	Very low	129 Å²	129	146 Å²	146	79%	0.791	79%	0.793	S	S	*	*			trans	-138.5	114.5	167.4	-38.7	0	0	0	0	109.8	E370	E370-T372 PolarHBondContact O-N 3.41Å
373	E	23	Very low	22.2	Very low	167 Å²	167	148.3 Å²	148.3	78%	0.78	80%	0.795	S	S	*	*			trans	-68.8	141.5	-177	-66.3	172.7	153.5	0	0	111.2	Y375	E373-Y375 PolarHBondContact O-N 3.41Å
374	I	21.5	Very low	22.3	Very low	144 Å²	144	145 Å²	145	74%	0.738	79%	0.787	S	S	*	*			trans	-84.1	100.4	-173.4	-62	167.5	0	0	0	108.5	T376	I374-T376 HydrophobicContact CG2-CG2 4.26Å
375	Y	19.7	Very low	22.2	Very low	216 Å²	216	149.5 Å²	149.5	85%	0.847	80%	0.795	S	S	*	*			trans	-87	108.8	159.2	-83.8	-88.1	0	0	0	109.2	E373	E373-Y375 PolarHBondContact O-N 3.41Å
376	T	20.8	Very low	22.4	Very low	127 Å²	127	148.7 Å²	148.7	78%	0.779	80%	0.797	S	S	*	*			trans	-76.2	114.3	164.9	43.1	0	0	0	0	108.9	I374	I374-T376 HydrophobicContact CG2-CG2 4.26Å
377	S	21.2	Very low	22.5	Very low	111 Å²	111	147.3 Å²	147.3	78%	0.776	80%	0.796	S	S	*	*			trans	-146.8	148	158.8	-145.6	0	0	0	0	112.5
378	Q	21	Very low	22.6	Very low	186 Å²	186	147.4 Å²	147.4	87%	0.869	80%	0.796	S	S	*	*			trans	-72.7	137.3	-158.7	-66.6	155.2	-31.7	0	0	111.8
379	T	22.1	Very low	22.5	Very low	144 Å²	144	146.9 Å²	146.9	88%	0.883	80%	0.798	S	S	*	*			trans	-105.4	112.2	177.8	0.2	0	0	0	0	109.1
380	T	20.6	Very low	22.6	Very low	121 Å²	121	145.4 Å²	145.4	74%	0.742	79%	0.794	S	S	*	*			trans	-142.4	128.7	153.6	14.9	0	0	0	0	107.9
381	D	21.7	Very low	22.9	Very low	141 Å²	141	145.2 Å²	145.2	75%	0.754	80%	0.797	S	S	*	*			trans	89.3	85.8	153	-49.2	-23.9	0	0	0	118.8
382	T	20.9	Very low	23	Very low	124 Å²	124	145.1 Å²	145.1	76%	0.761	80%	0.796	S	S	*	*			trans	-2.8	132.4	130.9	32.3	0	0	0	0	117.4
383	I	22.8	Very low	23.2	Very low	151 Å²	151	146.5 Å²	146.5	77%	0.774	80%	0.799	S	S	*	*				-175.3	132.3	128.3	-91.8	150.9	0	0	0	110.1
384	D	24	Very low	23.4	Very low	134 Å²	134	149.7 Å²	149.7	72%	0.717	80%	0.804	S	S	*	*			trans	54.3	112	156.5	-61.6	-22.8	0	0	0	121.6
385	K	21.4	Very low	23.8	Very low	187 Å²	187	154.9 Å²	154.9	81%	0.813	81%	0.814	S	S	*	*				60.8	103.6	78.2	-82.4	-171.3	179.8	175.2	0	115.2
386	T	25.7	Very low	24.3	Very low	136 Å²	136	153.5 Å²	153.5	83%	0.834	81%	0.812	S	S	*	*			trans	175.1	112.8	135.1	39.7	0	0	0	0	106.7
387	N	24	Very low	24.8	Very low	143 Å²	143	154.9 Å²	154.9	77%	0.765	82%	0.815	S	S	*	*				38.4	120.7	90.3	-73.8	16.1	0	0	0	111.9
388	D	25.8	Very low	25.3	Very low	149 Å²	149	159 Å²	159	80%	0.797	82%	0.822	S	S	*	*			cis	-158	146	43.4	-84.7	-49.6	0	0	0	112.5
389	A	21.6	Very low	25.7	Very low	95 Å²	95	159 Å²	159	79%	0.785	82%	0.822	S	S	*	*			trans	-82.9	135.5	164.9	0	0	0	0	0	110.3
390	S	26	Very low	26.2	Very low	111 Å²	111	163.2 Å²	163.2	78%	0.776	82%	0.822	S	S	*	*			trans	177.5	122.1	137.6	49.6	0	0	0	0	110.1
391	I	30.5	Very low	26.7	Very low	170 Å²	170	166.1 Å²	166.1	87%	0.872	83%	0.827	S	S	*	*			trans	-178	78.9	139.7	-85.3	150.2	0	0	0	103.6
392	N	25.3	Very low	27.1	Very low	161 Å²	161	167.1 Å²	167.1	86%	0.861	83%	0.832	S	S	*	*			trans	-129.7	93.2	165.7	-101.7	-19.4	0	0	0	104.7
393	D	26.8	Very low	27.6	Very low	159 Å²	159	169 Å²	169	85%	0.85	83%	0.832	S	S	*	*			trans	-164.6	144.9	148.4	-119.7	-24.2	0	0	0	111.2
394	R	28.1	Very low	27.9	Very low	234 Å²	234	170.1 Å²	170.1	88%	0.883	83%	0.834	S	S	*	*	S	Bend	trans	94	41.7	176.6	-56.8	-169.1	-96.3	-154	-6.9	119.3
395	R	30	Very low	28.2	Very low	253 Å²	253	175.4 Å²	175.4	96%	0.955	84%	0.844	S	S	*	*			trans	-134.6	53	149.3	-88.1	-170.9	174.9	174.5	-1.4	111.9
396	K	29.4	Very low	28.7	Very low	187 Å²	187	173.7 Å²	173.7	81%	0.813	84%	0.842	S	S	*	*			trans	-125.5	108.4	158.4	-79.3	179.4	178.1	172.2	0	104.9
397	D	32.1	Very low	28.8	Very low	155 Å²	155	174.9 Å²	174.9	83%	0.829	84%	0.843	S	S	*	*	S	Bend	trans	172.4	4.5	150	-83.6	-12	0	0	0	114.4
398	Q	31.5	Very low	29.1	Very low	197 Å²	197	173.5 Å²	173.5	92%	0.921	84%	0.844	S	S	*	*	S	Bend	trans	-118.2	16.4	173.6	-75.4	-171.6	-12.3	0	0	116.1
399	Q	30.6	Very low	29.2	Very low	187 Å²	187	174.6 Å²	174.6	87%	0.874	85%	0.845	S	S	*	*	S	Bend	trans	-113.4	17.1	175.9	-90.5	-175.8	-21.2	0	0	114.9
400	R	30.8	Very low	29.6	Very low	233 Å²	233	178.2 Å²	178.2	88%	0.879	85%	0.851	S	S	*	*	S	Bend	trans	-101.8	4.5	179.3	-81.9	-165.1	-176.8	-165	3.4	117.2
401	E	31.1	Very low	29.5	Very low	182 Å²	182	183.5 Å²	183.5	85%	0.85	86%	0.86	S	S	*	*	S	Bend	trans	-105.3	-7.9	177.9	-85.1	-172.5	147.5	0	0	116.6
402	N	31.1	Very low	29.3	Very low	161 Å²	161	178.3 Å²	178.3	86%	0.861	85%	0.848	S	S	*	*	S	Bend	trans	-102.1	-0.2	178.4	-84.1	-14.3	0	0	0	116.1
403	E	30.7	Very low	29.5	Very low	163 Å²	163	177.5 Å²	177.5	76%	0.762	84%	0.842	S	S	*	*	S	Bend	trans	-93.5	-0.5	177.7	-96.1	-171.9	156.8	0	0	115.4
404	H	29.3	Very low	29.7	Very low	176 Å²	176	178.2 Å²	178.2	82%	0.815	85%	0.845	S	S	*	*	S	Bend	trans	-96.8	9.3	-177.8	-99.3	-58.9	0	0	0	116.9
405	R	29.9	Very low	30	Very low	244 Å²	244	173.4 Å²	173.4	92%	0.921	84%	0.837	S	S	*	*	S	Bend	trans	-119.1	9	179.3	-108.7	-174.9	-169.1	-160.2	4.6	118.8
406	I	31.7	Very low	30	Very low	152 Å²	152	166.6 Å²	166.6	78%	0.779	83%	0.828	S	S	*	*	S	Bend	trans	-116.6	-1.2	177.2	-59	-178.5	0	0	0	114.3	S408	I406-S408 PolarHBondContact O-N 3.24Å
407	N	27.7	Very low	30.1	Very low	161 Å²	161	167 Å²	167	86%	0.861	83%	0.83	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	22.7	-173.8	-87.8	-15.7	0	0	0	117.4
408	S	30.1	Very low	30.3	Very low	113 Å²	113	164.8 Å²	164.8	79%	0.79	82%	0.824	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	-14.4	-178.8	-173.3	0	0	0	0	116.1	I406	I406-S408 PolarHBondContact O-N 3.24Å
409	Q	29.2	Very low	30.6	Very low	173 Å²	173	164.9 Å²	164.9	81%	0.808	82%	0.821	S	S	*	*	S	Bend	trans	-131.7	75.9	-174.5	-73.7	-177.3	-10.7	0	0	112.4
410	N	29.2	Very low	31	Very low	170 Å²	170	161.8 Å²	161.8	91%	0.909	81%	0.807	S	S	*	*			trans	-159.8	60.9	153.6	-100.1	-20.4	0	0	0	110.4
411	K	25.3	Very low	31.9	Very low	223 Å²	223	154.3 Å²	154.3	97%	0.97	79%	0.79	S	S	*	*			trans	-97.7	98	162.4	-90.3	-177.8	177.2	173.7	0	108.4
412	G	25.4	Very low	33.1	Very low	60 Å²	60	151.6 Å²	151.6	62%	0.619	78%	0.781	S	S	*	*			trans	160.7	135.8	168.9	0	0	0	0	0	111.4
413	I	29.2	Very low	34.5	Very low	144 Å²	144	147.3 Å²	147.3	74%	0.738	76%	0.761	S	S	*	*			trans	84.7	64.2	178.2	-44.7	160.1	0	0	0	113.9	N415	I413-N415 HydrophobicContact CG2-CB 4.31Å; I413-N415 WeakPolarHBondContact CG2-ND2 3.31Å; I413-N415 VanDerWaalsContact CG2-OD1 3.28Å; I413-N415 WeakPolarHBondContact CG2-OD1 3.49Å; I413-N415 PolarHBondContact O-N 3.48Å
414	L	31.8	Very low	36.1	Very low	175 Å²	175	144.4 Å²	144.4	92%	0.916	75%	0.747	S	S	*	*			trans	-67.4	80.1	153	-172.1	77.3	0	0	0	108.5	S416	L414-S416 PolarHBondContact O-N 3.17Å
415	N	33.1	Very low	38.1	Very low	133 Å²	133	140.9 Å²	140.9	71%	0.711	73%	0.734	S	S	*	*			trans	-67.6	101.2	169.7	-86	-22	0	0	0	108.7	I413 K417	I413-N415 HydrophobicContact CG2-CB 4.31Å; I413-N415 WeakPolarHBondContact CG2-ND2 3.31Å; I413-N415 VanDerWaalsContact CG2-OD1 3.28Å; I413-N415 WeakPolarHBondContact CG2-OD1 3.49Å; I413-N415 PolarHBondContact O-N 3.48Å; N415-K417 PolarHBondContact O-N 2.99Å
416	S	31.6	Very low	40.1	Very low	109 Å²	109	131.8 Å²	131.8	76%	0.762	71%	0.708	S	S	*	*			trans	-60.6	99.1	170	57.1	0	0	0	0	109.4	L414	L414-S416 PolarHBondContact O-N 3.17Å
417	K	30.9	Very low	42	Very low	196 Å²	196	129.2 Å²	129.2	85%	0.852	69%	0.694	S	S	*	*			trans	-56.8	129.6	170.4	-78.1	-178.9	177.5	175.8	0	108.9	N415	N415-K417 PolarHBondContact O-N 2.99Å
418	P	36.2	Very low	44.3	Very low	108 Å²	108	125.9 Å²	125.9	70%	0.701	68%	0.675	S	S	*	*			trans	-69.2	136.5	-172.8	26.5	-31.8	0	0	0	110.4	H420	P418-H420 PolarHBondContact O-N 3.17Å
419	K	37.4	Very low	46.3	Very low	200 Å²	200	128 Å²	128	87%	0.87	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	27.3	177.7	-74.4	-179.9	173.4	175.9	0	114.6
420	H	38.2	Very low	48.4	Very low	122 Å²	122	125.4 Å²	125.4	57%	0.565	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-11.8	-170.4	-143.7	-47.6	0	0	0	114.4	P418 H424	P418-H420 PolarHBondContact O-N 3.17Å; H420-H424 PolarHBondContact O-N 3Å
421	S	51.5	Low	50.7	Low	75 Å²	75	125.7 Å²	125.7	52%	0.524	64%	0.643	S	S	.	*	H	α-helix	trans	-65.8	-42.4	-174.8	57	0	0	0	0	113.7	T423 H424 N425	S421-T423 PolarHBondContact O-N 3.49Å; S421-H424 PolarHBondContact O-N 3.25Å; S421-N425 PolarHBondContact O-N 2.85Å
422	N	56.4	Low	53	Low	126 Å²	126	123.1 Å²	123.1	67%	0.674	63%	0.627	S	S	*	*	H	α-helix	trans	-68.4	-37.4	-176.8	-70.4	-10.2	0	0	0	112.4	S426	N422-S426 PolarHBondContact O-N 3.37Å; N422-S426 VanDerWaalsContact O-N 3.13Å
423	T	60.3	Low	55.3	Low	71 Å²	71	126.8 Å²	126.8	44%	0.436	63%	0.627	S	S	.	*	H	α-helix	trans	-65.6	-41.4	178.3	-40.6	0	0	0	0	110.9	S421 S426 M427	S421-T423 PolarHBondContact O-N 3.49Å; T423-S426 PolarHBondContact O-N 2.9Å; T423-S426 PolarHBondContact O-OG 3.17Å; T423-M427 HydrophobicContact CG2-CE 4.06Å; T423-M427 WeakPolarHBondContact O-CG 3.47Å; T423-M427 PolarHBondContact O-N 2.9Å
424	H	62.7	Low	57.5	Low	102 Å²	102	125 Å²	125	47%	0.472	61%	0.61	S	S	.	*	H	α-helix	trans	-61.9	-47.5	179.3	-174.7	-103.4	0	0	0	112.4	H420 S421 S426 M427 I428	H420-H424 PolarHBondContact O-N 3Å; S421-H424 PolarHBondContact O-N 3.25Å; H424-S426 VanDerWaalsContact C-N 3.31Å; H424-S426 PolarHBondContact O-N 3.39Å; H424-M427 PolarHBondContact O-N 3.03Å; H424-I428 WeakPolarHBondContact CE1-CD1 3.2Å; H424-I428 PolarHBondContact O-N 2.83Å
425	N	72	Confident	59.6	Low	101 Å²	101	121.8 Å²	121.8	54%	0.54	59%	0.594	S	S	.	*	H	α-helix	trans	-61.8	-39.5	177.1	-70.5	-14	0	0	0	112	S421 M427 I428 Y429	S421-N425 PolarHBondContact O-N 2.85Å; N425-M427 VanDerWaalsContact C-N 3.34Å; N425-M427 PolarHBondContact O-N 2.89Å; N425-I428 PolarHBondContact O-N 3.36Å; N425-Y429 WeakPolarHBondContact O-CB 3.2Å; N425-Y429 PolarHBondContact O-N 3.4Å
426	S	71.6	Confident	61.6	Low	53 Å²	53	119.2 Å²	119.2	37%	0.371	58%	0.583	S	S	.	*	H	α-helix	trans	-63.8	-38.4	176.4	79.7	0	0	0	0	112.6	N422 T423 H424 Y429 Q430	N422-S426 PolarHBondContact O-N 3.37Å; N422-S426 VanDerWaalsContact O-N 3.13Å; T423-S426 PolarHBondContact O-N 2.9Å; T423-S426 PolarHBondContact O-OG 3.17Å; H424-S426 VanDerWaalsContact C-N 3.31Å; H424-S426 PolarHBondContact O-N 3.39Å; S426-Y429 PolarHBondContact O-N 3.36Å; S426-Q430 WeakPolarHBondContact O-CG 3.41Å; S426-Q430 PolarHBondContact O-N 2.97Å
427	M	73.2	Confident	63.8	Low	99 Å²	99	115.8 Å²	115.8	49%	0.488	55%	0.553	S	S	.	*	H	α-helix	trans	-68.9	-43.2	178.1	-75.3	-168.8	-81.1	0	0	111.6	T423 H424 N425 Y429 Q430 R431	T423-M427 HydrophobicContact CG2-CE 4.06Å; T423-M427 WeakPolarHBondContact O-CG 3.47Å; T423-M427 PolarHBondContact O-N 2.9Å; H424-M427 PolarHBondContact O-N 3.03Å; N425-M427 VanDerWaalsContact C-N 3.34Å; N425-M427 PolarHBondContact O-N 2.89Å; M427-Y429 VanDerWaalsContact C-N 3.34Å; M427-Y429 PolarHBondContact O-N 2.69Å; M427-Q430 PolarHBondContact O-N 3.17Å; M427-R431 WeakPolarHBondContact O-CB 3.36Å; M427-R431 PolarHBondContact O-N 3.27Å
428	I	75.6	Confident	66	Low	90 Å²	90	109.6 Å²	109.6	46%	0.462	53%	0.529	S	S	.	.	H	α-helix	trans	-60	-45.9	174.9	-69.5	175.1	0	0	0	110.6	H424 N425 Q430 R431 R432	H424-I428 WeakPolarHBondContact CE1-CD1 3.2Å; H424-I428 PolarHBondContact O-N 2.83Å; N425-I428 PolarHBondContact O-N 3.36Å; I428-Q430 PolarHBondContact O-N 2.97Å; I428-R431 PolarHBondContact O-N 3.3Å; I428-R432 PolarHBondContact O-N 3.42Å
429	Y	72.2	Confident	68.1	Low	157 Å²	157	106.4 Å²	106.4	62%	0.616	51%	0.51	S	S	*	.	H	α-helix	trans	-59.4	-47	177.8	175.1	-97.1	0	0	0	112	N425 S426 M427 R431 R432 K433	N425-Y429 WeakPolarHBondContact O-CB 3.2Å; N425-Y429 PolarHBondContact O-N 3.4Å; S426-Y429 PolarHBondContact O-N 3.36Å; M427-Y429 VanDerWaalsContact C-N 3.34Å; M427-Y429 PolarHBondContact O-N 2.69Å; Y429-R431 PolarHBondContact O-N 3.16Å; Y429-R432 PolarHBondContact O-N 2.83Å; Y429-K433 PolarHBondContact O-N 2.78Å
430	Q	73.6	Confident	70.3	Confident	120 Å²	120	99.1 Å²	99.1	56%	0.561	48%	0.479	S	S	*	.	H	α-helix	trans	-62.9	-40.4	176.9	-74	-174.3	7.6	0	0	112.3	S426 M427 I428 K433 R434	S426-Q430 WeakPolarHBondContact O-CG 3.41Å; S426-Q430 PolarHBondContact O-N 2.97Å; M427-Q430 PolarHBondContact O-N 3.17Å; I428-Q430 PolarHBondContact O-N 2.97Å; Q430-K433 PolarHBondContact O-N 3.06Å; Q430-R434 PolarHBondContact O-N 3.39Å
431	R	75.9	Confident	72.5	Confident	175 Å²	175	96.8 Å²	96.8	66%	0.66	47%	0.467	S	S	*	.	H	α-helix	trans	-61.5	-45.1	176.2	-168.7	174.3	-176.7	173.7	-0.6	110.9	M427 I428 Y429 R434 L435	M427-R431 WeakPolarHBondContact O-CB 3.36Å; M427-R431 PolarHBondContact O-N 3.27Å; I428-R431 PolarHBondContact O-N 3.3Å; Y429-R431 PolarHBondContact O-N 3.16Å; R431-R434 PolarHBondContact O-N 3.49Å; R431-L435 WeakPolarHBondContact O-CG 3.43Å; R431-L435 PolarHBondContact O-N 3.14Å
432	R	74.4	Confident	74.2	Confident	169 Å²	169	99.9 Å²	99.9	64%	0.638	47%	0.471	S	S	*	.	H	α-helix	trans	-62.7	-42.6	176.4	-167.5	173.8	-176.1	169.5	0.9	112	I428 Y429 R434 L435 V436	I428-R432 PolarHBondContact O-N 3.42Å; Y429-R432 PolarHBondContact O-N 2.83Å; R432-R434 VanDerWaalsContact C-N 3.34Å; R432-R434 PolarHBondContact O-N 3.22Å; R432-L435 PolarHBondContact O-N 3.24Å; R432-V436 WeakPolarHBondContact O-CG2 3.48Å; R432-V436 PolarHBondContact O-N 3.04Å
433	K	73.8	Confident	75.7	Confident	138 Å²	138	95.4 Å²	95.4	60%	0.6	45%	0.448	S	S	*	.	H	α-helix	trans	-60.9	-41.8	176.1	-171.2	177.3	-179.5	179.1	0	112	Y429 Q430 Y437	Y429-K433 PolarHBondContact O-N 2.78Å; Q430-K433 PolarHBondContact O-N 3.06Å; K433-Y437 WeakPolarHBondContact O-CB 3.44Å; K433-Y437 PolarHBondContact O-N 2.82Å; K433-Y437 VanDerWaalsContact O-N 3.08Å
434	R	76.2	Confident	77.2	Confident	106 Å²	106	92 Å²	92	40%	0.4	43%	0.428	S	S	.	.	H	α-helix	trans	-64.2	-45	175.1	-176.7	179.6	-73.8	166.7	6.6	111.6	Q430 R431 R432 V436 Y437 D438	Q430-R434 PolarHBondContact O-N 3.39Å; R431-R434 PolarHBondContact O-N 3.49Å; R432-R434 VanDerWaalsContact C-N 3.34Å; R432-R434 PolarHBondContact O-N 3.22Å; R434-V436 PolarHBondContact O-N 2.96Å; R434-Y437 PolarHBondContact O-N 3.35Å; R434-D438 WeakPolarHBondContact CG-OD2 3.23Å; R434-D438 WeakPolarHBondContact O-CB 3.23Å; R434-D438 PolarHBondContact O-N 2.94Å
435	L	75.9	Confident	78.6	Confident	108 Å²	108	92.9 Å²	92.9	57%	0.565	43%	0.43	S	S	*	.	H	α-helix	trans	-60.5	-42.2	178.6	-71.7	171.5	0	0	0	112.7	R431 R432 S439	R431-L435 WeakPolarHBondContact O-CG 3.43Å; R431-L435 PolarHBondContact O-N 3.14Å; R432-L435 PolarHBondContact O-N 3.24Å; L435-S439 VanDerWaalsContact O-CB 3.32Å; L435-S439 WeakPolarHBondContact O-CB 3.32Å; L435-S439 PolarHBondContact O-N 3.41Å; L435-S439 PolarHBondContact O-OG 3.06Å
436	V	74.1	Confident	79.6	Confident	79 Å²	79	88.4 Å²	88.4	48%	0.479	41%	0.406	S	S	.	.	H	α-helix	trans	-62.4	-48.6	174.9	174.3	0	0	0	0	110.2	R432 R434 D438 S439 E440	R432-V436 WeakPolarHBondContact O-CG2 3.48Å; R432-V436 PolarHBondContact O-N 3.04Å; R434-V436 PolarHBondContact O-N 2.96Å; V436-D438 PolarHBondContact O-N 3.45Å; V436-S439 PolarHBondContact O-N 2.94Å; V436-S439 VanDerWaalsContact O-N 3.16Å; V436-S439 PolarHBondContact O-OG 3.45Å; V436-E440 WeakPolarHBondContact O-CG 3.41Å; V436-E440 PolarHBondContact O-N 2.89Å
437	Y	77.6	Confident	80.6	Confident	36 Å²	36	86.2 Å²	86.2	14%	0.141	39%	0.391	C	S	.	.	H	α-helix	trans	-59	-46.1	178.5	179.5	-102.6	0	0	0	113.1	I226 R229 L233 K433 R434 S439 E440 K441	I226-Y437 WeakPolarHBondContact CA-OH 3.37Å; I226-Y437 PolarHBondContact O-OH 3.13Å; R229-Y437 HydrophobicContact CB-CE2 4.19Å; R229-Y437 WeakPolarHBondContact CB-OH 3.2Å; L233-Y437 HydrophobicContact CD1-CD1 4.26Å; L233-Y437 HydrophobicContact CD1-CE1 4.15Å; K433-Y437 WeakPolarHBondContact O-CB 3.44Å; K433-Y437 PolarHBondContact O-N 2.82Å; K433-Y437 VanDerWaalsContact O-N 3.08Å; R434-Y437 PolarHBondContact O-N 3.35Å; Y437-S439 VanDerWaalsContact C-N 3.28Å; Y437-S439 PolarHBondContact O-N 3.42Å; Y437-E440 PolarHBondContact O-N 3.47Å; Y437-K441 PolarHBondContact O-N 2.87Å
438	D	78	Confident	81.6	Confident	66 Å²	66	82.2 Å²	82.2	35%	0.353	37%	0.373	S	S	.	.	H	α-helix	trans	-65.7	-34.2	178.2	-69.7	-22.8	0	0	0	111.2	R434 V436 K441 K442	R434-D438 WeakPolarHBondContact CG-OD2 3.23Å; R434-D438 WeakPolarHBondContact O-CB 3.23Å; R434-D438 PolarHBondContact O-N 2.94Å; V436-D438 PolarHBondContact O-N 3.45Å; D438-K441 PolarHBondContact O-N 3.24Å; D438-K442 WeakPolarHBondContact O-CG 3.22Å; D438-K442 PolarHBondContact O-N 3.47Å; D438-K442 VanDerWaalsContact O-N 3.12Å
439	S	78.8	Confident	82.5	Confident	41 Å²	41	82 Å²	82	29%	0.287	37%	0.372	S	S	.	.	H	α-helix	trans	-67.6	-41	174.5	77.2	0	0	0	0	112.6	L435 V436 Y437 K442 T443	L435-S439 VanDerWaalsContact O-CB 3.32Å; L435-S439 WeakPolarHBondContact O-CB 3.32Å; L435-S439 PolarHBondContact O-N 3.41Å; L435-S439 PolarHBondContact O-OG 3.06Å; V436-S439 PolarHBondContact O-N 2.94Å; V436-S439 VanDerWaalsContact O-N 3.16Å; V436-S439 PolarHBondContact O-OG 3.45Å; Y437-S439 VanDerWaalsContact C-N 3.28Å; Y437-S439 PolarHBondContact O-N 3.42Å; S439-K442 PolarHBondContact O-N 3.5Å; S439-T443 PolarHBondContact O-N 3.21Å; S439-T443 VanDerWaalsContact O-N 3.15Å; S439-T443 PolarHBondContact O-OG1 2.84Å
440	E	83.6	Confident	83.6	Confident	48 Å²	48	74.6 Å²	74.6	22%	0.224	34%	0.343	C	S	.	.	H	α-helix	trans	-65.3	-40.6	175.2	-67.3	-56.8	148.1	0	0	110.9	R141 V436 Y437 K442 T443 V444	R141-E440 IonicContact CZ-OE2 2.97Å; R141-E440 IonicContact NH1-OE2 3.9Å; R141-E440 PolarHBondContact NH1-OE2 3.34Å; V436-E440 WeakPolarHBondContact O-CG 3.41Å; V436-E440 PolarHBondContact O-N 2.89Å; Y437-E440 PolarHBondContact O-N 3.47Å; E440-K442 VanDerWaalsContact C-N 3.3Å; E440-K442 PolarHBondContact O-N 3.44Å; E440-T443 PolarHBondContact O-N 3.24Å; E440-V444 VanDerWaalsContact O-CG2 3.26Å; E440-V444 WeakPolarHBondContact O-CG2 3.32Å; E440-V444 PolarHBondContact O-N 3.4Å
441	K	84.8	Confident	84.6	Confident	72 Å²	72	69.6 Å²	69.6	31%	0.313	32%	0.321	S	S	.	.	H	α-helix	trans	-58.9	-40.7	175.4	-176.2	179.3	179.2	-179.5	0	112	I226 Y437 D438 V444 K445	I226-K441 HydrophobicContact CG2-CD 4.3Å; Y437-K441 PolarHBondContact O-N 2.87Å; D438-K441 PolarHBondContact O-N 3.24Å; K441-V444 PolarHBondContact O-N 3.28Å; K441-K445 WeakPolarHBondContact O-CG 3.11Å; K441-K445 PolarHBondContact O-N 2.94Å
442	K	88.1	Confident	85.5	Confident	141 Å²	141	64.6 Å²	64.6	61%	0.613	31%	0.312	S	S	*	.	H	α-helix	trans	-62.8	-46.7	176.1	-73.2	177.5	-177.9	-175.5	0	111	D438 S439 E440 V444 K445 T446	D438-K442 WeakPolarHBondContact O-CG 3.22Å; D438-K442 PolarHBondContact O-N 3.47Å; D438-K442 VanDerWaalsContact O-N 3.12Å; S439-K442 PolarHBondContact O-N 3.5Å; E440-K442 VanDerWaalsContact C-N 3.3Å; E440-K442 PolarHBondContact O-N 3.44Å; K442-V444 PolarHBondContact O-N 2.93Å; K442-K445 WeakPolarHBondContact O-CB 3.46Å; K442-K445 PolarHBondContact O-N 3.26Å; K442-T446 PolarHBondContact O-N 3.41Å; K442-T446 PolarHBondContact O-OG1 3.24Å
443	T	87.4	Confident	86.5	Confident	31 Å²	31	57.6 Å²	57.6	19%	0.19	29%	0.289	C	S	.	.	H	α-helix	trans	-61.1	-42.5	177.6	-60.1	0	0	0	0	112.3	S439 E440 K445 T446 V447	S439-T443 PolarHBondContact O-N 3.21Å; S439-T443 VanDerWaalsContact O-N 3.15Å; S439-T443 PolarHBondContact O-OG1 2.84Å; E440-T443 PolarHBondContact O-N 3.24Å; T443-K445 VanDerWaalsContact C-N 3.29Å; T443-K445 PolarHBondContact O-N 3Å; T443-T446 WeakPolarHBondContact O-CB 3.32Å; T443-T446 PolarHBondContact O-N 2.89Å; T443-T446 VanDerWaalsContact O-N 3.13Å; T443-V447 WeakPolarHBondContact O-CG2 3.48Å; T443-V447 PolarHBondContact O-N 2.97Å
444	V	91.6	Very high	87.5	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-58.9	-40.9	176.4	170.7	0	0	0	0	112.2	I145 Y219 I222 I226 E440 K441 K442 T446 V447 A448	I145-V444 HydrophobicContact CD1-CG2 3.25Å; I145-V444 HydrophobicContact CG1-CG2 4.23Å; Y219-V444 HydrophobicContact CE1-CG1 4.35Å; I222-V444 HydrophobicContact CG2-CG1 3.64Å; I222-V444 HydrophobicContact CG2-CG2 4.38Å; I226-V444 HydrophobicContact CD1-CG1 4.11Å; E440-V444 VanDerWaalsContact O-CG2 3.26Å; E440-V444 WeakPolarHBondContact O-CG2 3.32Å; E440-V444 PolarHBondContact O-N 3.4Å; K441-V444 PolarHBondContact O-N 3.28Å; K442-V444 PolarHBondContact O-N 2.93Å; V444-T446 VanDerWaalsContact C-N 3.33Å; V444-T446 PolarHBondContact O-N 2.9Å; V444-V447 PolarHBondContact O-N 3.45Å; V444-A448 WeakPolarHBondContact O-CB 3.32Å; V444-A448 PolarHBondContact O-N 3Å
445	K	91.7	Very high	88.4	Confident	120 Å²	120	47.3 Å²	47.3	52%	0.522	25%	0.249	S	C	.	.	H	α-helix	trans	-61.3	-43.3	175.9	-72.7	-179.5	171.9	-162.8	0	111.5	K441 K442 T443 A448 L449	K441-K445 WeakPolarHBondContact O-CG 3.11Å; K441-K445 PolarHBondContact O-N 2.94Å; K442-K445 WeakPolarHBondContact O-CB 3.46Å; K442-K445 PolarHBondContact O-N 3.26Å; T443-K445 VanDerWaalsContact C-N 3.29Å; T443-K445 PolarHBondContact O-N 3Å; K445-A448 PolarHBondContact O-N 3.01Å; K445-L449 WeakPolarHBondContact O-CG 3.45Å; K445-L449 PolarHBondContact O-N 3.46Å
446	T	93.2	Very high	89.4	Confident	6 Å²	6	48 Å²	48	4%	0.037	25%	0.253	C	S	.	.	H	α-helix	trans	-59.2	-47.7	176.4	-49.2	0	0	0	0	111.3	K442 T443 V444 L449 V450 I497 Y498 C501 N502	K442-T446 PolarHBondContact O-N 3.41Å; K442-T446 PolarHBondContact O-OG1 3.24Å; T443-T446 WeakPolarHBondContact O-CB 3.32Å; T443-T446 PolarHBondContact O-N 2.89Å; T443-T446 VanDerWaalsContact O-N 3.13Å; V444-T446 VanDerWaalsContact C-N 3.33Å; V444-T446 PolarHBondContact O-N 2.9Å; T446-L449 WeakPolarHBondContact O-CB 3.39Å; T446-L449 PolarHBondContact O-N 2.99Å; T446-V450 PolarHBondContact O-N 3.34Å; T446-V450 VanDerWaalsContact O-N 3.15Å; T446-I497 HydrophobicContact CG2-CG2 3.8Å; T446-Y498 HydrophobicContact CG2-CD1 4.07Å; T446-Y498 HydrophobicContact CG2-CE1 4.39Å; T446-C501 HydrophobicContact CG2-CB 4.24Å; T446-C501 PolarHBondContact OG1-O 2.71Å; T446-N502 HydrophobicContact CG2-CB 4.16Å
447	V	92.1	Very high	90.5	Very high	8 Å²	8	45 Å²	45	5%	0.048	24%	0.235	C	C	.	.	H	α-helix	trans	-69.1	-35.5	-179.8	-168.1	0	0	0	0	111.6	I137 R141 Y219 T443 V444 L449 V450 V451	I137-V447 HydrophobicContact CB-CG1 4.12Å; I137-V447 HydrophobicContact CG2-CB 4.23Å; I137-V447 HydrophobicContact CG2-CG1 3.38Å; I137-V447 HydrophobicContact CG2-CG2 3.7Å; R141-V447 HydrophobicContact CG-CG2 4.09Å; Y219-V447 VanDerWaalsContact OH-CB 3.24Å; Y219-V447 WeakPolarHBondContact OH-CB 3.42Å; Y219-V447 WeakPolarHBondContact OH-CG1 3.37Å; T443-V447 WeakPolarHBondContact O-CG2 3.48Å; T443-V447 PolarHBondContact O-N 2.97Å; V444-V447 PolarHBondContact O-N 3.45Å; V447-L449 VanDerWaalsContact C-N 3.27Å; V447-L449 PolarHBondContact O-N 3.43Å; V447-V450 WeakPolarHBondContact O-CB 3.37Å; V447-V450 PolarHBondContact O-N 3.12Å; V447-V450 VanDerWaalsContact O-N 3.17Å; V447-V451 HydrophobicContact CG1-CG2 4.49Å; V447-V451 VanDerWaalsContact O-CG2 3.25Å; V447-V451 WeakPolarHBondContact O-CG2 3.2Å; V447-V451 PolarHBondContact O-N 2.86Å
448	A	94.3	Very high	91.3	Very high	15 Å²	15	44.2 Å²	44.2	12%	0.124	23%	0.232	C	C	.	.	H	α-helix	trans	-60.5	-37.3	173.6	0	0	0	0	0	111.9	Y219 F223 V444 K445 V451 C452	Y219-A448 HydrophobicContact CD1-CB 4.08Å; Y219-A448 HydrophobicContact CE1-CB 3.73Å; F223-A448 HydrophobicContact CZ-CB 4.1Å; V444-A448 WeakPolarHBondContact O-CB 3.32Å; V444-A448 PolarHBondContact O-N 3Å; K445-A448 PolarHBondContact O-N 3.01Å; A448-V451 PolarHBondContact O-N 3.2Å; A448-C452 PolarHBondContact O-N 3.34Å; A448-C452 PolarHBondContact O-SG 3.48Å
449	L	95.4	Very high	92.1	Very high	85 Å²	85	44 Å²	44	45%	0.445	23%	0.23	S	C	.	.	H	α-helix	trans	-65.8	-42.3	173.8	-70.5	171.9	0	0	0	112.1	K445 T446 V447 V451 C452 C453 I497 C501	K445-L449 WeakPolarHBondContact O-CG 3.45Å; K445-L449 PolarHBondContact O-N 3.46Å; T446-L449 WeakPolarHBondContact O-CB 3.39Å; T446-L449 PolarHBondContact O-N 2.99Å; V447-L449 VanDerWaalsContact C-N 3.27Å; V447-L449 PolarHBondContact O-N 3.43Å; L449-V451 VanDerWaalsContact C-N 3.29Å; L449-V451 PolarHBondContact O-N 3.04Å; L449-C452 PolarHBondContact O-N 2.78Å; L449-C453 VanDerWaalsContact O-CB 3.31Å; L449-C453 WeakPolarHBondContact O-CB 3.13Å; L449-C453 PolarHBondContact O-N 2.62Å; L449-I497 HydrophobicContact CB-CG2 4.13Å; L449-C501 HydrophobicContact CD1-CB 4.2Å
450	V	94.9	Very high	92.9	Very high	1 Å²	1	44 Å²	44	1%	0.006	23%	0.229	C	C	.	.	H	α-helix	trans	-56.9	-45.7	174	168.2	0	0	0	0	110.7	L84 I134 T446 V447 C453 F454 N494 I497 Y498	L84-V450 HydrophobicContact CD2-CG1 4.23Å; I134-V450 HydrophobicContact CD1-CG1 4.14Å; I134-V450 HydrophobicContact CG1-CG1 4.18Å; T446-V450 PolarHBondContact O-N 3.34Å; T446-V450 VanDerWaalsContact O-N 3.15Å; V447-V450 WeakPolarHBondContact O-CB 3.37Å; V447-V450 PolarHBondContact O-N 3.12Å; V447-V450 VanDerWaalsContact O-N 3.17Å; V450-C453 PolarHBondContact O-N 3.04Å; V450-F454 PolarHBondContact O-N 3.03Å; V450-N494 WeakPolarHBondContact CG1-OD1 3.36Å; V450-I497 HydrophobicContact CG2-CB 4.38Å; V450-I497 HydrophobicContact CG2-CD1 4.07Å; V450-I497 HydrophobicContact CG2-CG2 3.89Å; V450-Y498 HydrophobicContact CG2-CE1 4.06Å
451	V	94.6	Very high	93.4	Very high	16 Å²	16	44.7 Å²	44.7	10%	0.097	23%	0.232	C	C	.	.	H	α-helix	trans	-63.5	-48.9	178.4	169.5	0	0	0	0	111.7	I134 V215 Y219 V447 A448 L449 C453 F454 V455	I134-V451 HydrophobicContact CG2-CB 4.49Å; I134-V451 HydrophobicContact CG2-CG2 3.48Å; I134-V451 VanDerWaalsContact CG2-CG2 3.48Å; V215-V451 HydrophobicContact CG1-CB 4.26Å; V215-V451 HydrophobicContact CG1-CG1 3.38Å; V215-V451 HydrophobicContact CG1-CG2 3.83Å; Y219-V451 HydrophobicContact CD2-CG1 4.49Å; Y219-V451 HydrophobicContact CD2-CG2 4.44Å; Y219-V451 HydrophobicContact CE2-CB 4.28Å; Y219-V451 HydrophobicContact CE2-CG1 4.35Å; Y219-V451 HydrophobicContact CE2-CG2 3.54Å; V447-V451 HydrophobicContact CG1-CG2 4.49Å; V447-V451 VanDerWaalsContact O-CG2 3.25Å; V447-V451 WeakPolarHBondContact O-CG2 3.2Å; V447-V451 PolarHBondContact O-N 2.86Å; A448-V451 PolarHBondContact O-N 3.2Å; L449-V451 VanDerWaalsContact C-N 3.29Å; L449-V451 PolarHBondContact O-N 3.04Å; V451-C453 VanDerWaalsContact C-N 3.28Å; V451-C453 PolarHBondContact O-N 3.21Å; V451-F454 PolarHBondContact O-N 2.93Å; V451-V455 WeakPolarHBondContact O-CG2 3.27Å; V451-V455 PolarHBondContact O-N 3.48Å
452	C	94.8	Very high	93.8	Very high	69 Å²	69	41.7 Å²	41.7	47%	0.466	22%	0.219	S	C	.	.	H	α-helix	trans	-60	-41.8	177.9	-70.4	0	0	0	0	111.2	A448 L449 V455 L456	A448-C452 PolarHBondContact O-N 3.34Å; A448-C452 PolarHBondContact O-SG 3.48Å; L449-C452 PolarHBondContact O-N 2.78Å; C452-V455 PolarHBondContact O-N 3.02Å; C452-L456 WeakPolarHBondContact O-CB 3.44Å; C452-L456 VanDerWaalsContact O-CG 3.25Å; C452-L456 WeakPolarHBondContact O-CG 3.31Å; C452-L456 PolarHBondContact O-N 3.09Å
453	C	96.1	Very high	94	Very high	23 Å²	23	38.5 Å²	38.5	16%	0.155	21%	0.208	C	C	.	.	H	α-helix	trans	-60.5	-47.6	176.6	-166.9	0	0	0	0	111.4	L449 V450 V451 V455 L456 C457 C493 I497	L449-C453 VanDerWaalsContact O-CB 3.31Å; L449-C453 WeakPolarHBondContact O-CB 3.13Å; L449-C453 PolarHBondContact O-N 2.62Å; V450-C453 PolarHBondContact O-N 3.04Å; V451-C453 VanDerWaalsContact C-N 3.28Å; V451-C453 PolarHBondContact O-N 3.21Å; C453-V455 VanDerWaalsContact C-N 3.35Å; C453-V455 PolarHBondContact O-N 3.47Å; C453-L456 PolarHBondContact O-N 3.42Å; C453-C457 VanDerWaalsContact O-CB 3.28Å; C453-C457 WeakPolarHBondContact O-CB 3.24Å; C453-C457 PolarHBondContact O-N 2.95Å; C453-C457 PolarHBondContact O-SG 2.81Å; C453-C457 VanDerWaalsContact O-SG 3.37Å; C453-C493 WeakPolarHBondContact SG-CB 3.49Å; C453-I497 HydrophobicContact CB-CD1 4.06Å
454	F	95.2	Very high	94.2	Very high	7 Å²	7	37.1 Å²	37.1	3%	0.031	20%	0.2	C	C	.	.	H	α-helix	trans	-55.1	-51	176.9	-176.6	-81.2	0	0	0	111.6	I131 I134 F208 V450 V451 L456 C457 W458 N490	I131-F454 HydrophobicContact CB-CE1 3.88Å; I131-F454 HydrophobicContact CB-CE2 3.94Å; I131-F454 HydrophobicContact CB-CZ 3.48Å; I131-F454 VanDerWaalsContact CB-CZ 3.48Å; I131-F454 HydrophobicContact CD1-CD1 3.51Å; I131-F454 HydrophobicContact CD1-CD2 4.43Å; I131-F454 HydrophobicContact CD1-CE1 3.43Å; I131-F454 VanDerWaalsContact CD1-CE1 3.43Å; I131-F454 HydrophobicContact CD1-CE2 4.36Å; I131-F454 HydrophobicContact CD1-CG 4.06Å; I131-F454 HydrophobicContact CD1-CZ 3.91Å; I131-F454 HydrophobicContact CG1-CD1 4.32Å; I131-F454 HydrophobicContact CG1-CE1 3.71Å; I131-F454 HydrophobicContact CG1-CZ 3.89Å; I131-F454 HydrophobicContact CG2-CZ 4.42Å; I134-F454 HydrophobicContact CD1-CB 3.71Å; I134-F454 HydrophobicContact CD1-CD2 3.5Å; I134-F454 HydrophobicContact CD1-CE2 4.37Å; I134-F454 HydrophobicContact CD1-CG 3.7Å; F208-F454 HydrophobicContact CD2-CE1 4.09Å; F208-F454 HydrophobicContact CE2-CE1 4.1Å; V450-F454 PolarHBondContact O-N 3.03Å; V451-F454 PolarHBondContact O-N 2.93Å; F454-L456 PolarHBondContact O-N 2.87Å; F454-C457 PolarHBondContact O-N 3.41Å; F454-W458 AromaticContact CD2-CD1 3.74Å; F454-W458 AromaticContact CD2-NE1 3.98Å; F454-W458 HydrophobicContact CE1-CB 4.18Å; F454-W458 AromaticContact CE1-CD1 3.83Å; F454-W458 HydrophobicContact CE1-CG 4.03Å; F454-W458 AromaticContact CE2-CD1 3.46Å; F454-W458 VanDerWaalsContact CE2-CD1 3.46Å; F454-W458 HydrophobicContact CE2-CG 4.26Å; F454-W458 AromaticContact CE2-NE1 3.46Å; F454-W458 HydrophobicContact CZ-CB 4.45Å; F454-W458 AromaticContact CZ-CD1 3.47Å; F454-W458 VanDerWaalsContact CZ-CD1 3.47Å; F454-W458 HydrophobicContact CZ-CD2 4.32Å; F454-W458 AromaticContact CZ-CG 3.83Å; F454-W458 HydrophobicContact CZ-CG 3.83Å; F454-W458 AromaticContact CZ-NE1 3.76Å; F454-W458 WeakPolarHBondContact O-CB 3.41Å; F454-W458 PolarHBondContact O-N 3.4Å; F454-N490 WeakPolarHBondContact CA-OD1 3.45Å; F454-N490 WeakPolarHBondContact CD2-ND2 3.36Å; F454-N490 PolarHBondContact N-OD1 3.46Å
455	V	94.7	Very high	94.2	Very high	21 Å²	21	38 Å²	38	13%	0.127	20%	0.203	C	C	.	.	H	α-helix	trans	-61.5	-48.9	-178.6	175.2	0	0	0	0	110.9	F208 F212 V451 C452 C453 C457 W458 L459	F208-V455 HydrophobicContact CZ-CG1 4.29Å; F212-V455 HydrophobicContact CD2-CB 4.39Å; F212-V455 HydrophobicContact CD2-CG1 3.95Å; F212-V455 HydrophobicContact CD2-CG2 3.47Å; F212-V455 VanDerWaalsContact CD2-CG2 3.47Å; F212-V455 HydrophobicContact CE2-CB 4.38Å; F212-V455 HydrophobicContact CE2-CG1 3.67Å; F212-V455 HydrophobicContact CE2-CG2 3.79Å; V451-V455 WeakPolarHBondContact O-CG2 3.27Å; V451-V455 PolarHBondContact O-N 3.48Å; C452-V455 PolarHBondContact O-N 3.02Å; C453-V455 VanDerWaalsContact C-N 3.35Å; C453-V455 PolarHBondContact O-N 3.47Å; V455-C457 VanDerWaalsContact C-N 3.31Å; V455-C457 PolarHBondContact O-N 3.38Å; V455-W458 PolarHBondContact O-N 3.34Å; V455-L459 WeakPolarHBondContact O-CB 3.39Å; V455-L459 PolarHBondContact O-N 3.05Å
456	L	96	Very high	94.3	Very high	122 Å²	122	33.3 Å²	33.3	64%	0.639	18%	0.183	S	C	*	.	H	α-helix	trans	-63.6	-37.4	-178	-70.1	172.5	0	0	0	112.5	C452 C453 F454 P460	C452-L456 WeakPolarHBondContact O-CB 3.44Å; C452-L456 VanDerWaalsContact O-CG 3.25Å; C452-L456 WeakPolarHBondContact O-CG 3.31Å; C452-L456 PolarHBondContact O-N 3.09Å; C453-L456 PolarHBondContact O-N 3.42Å; F454-L456 PolarHBondContact O-N 2.87Å; L456-P460 VanDerWaalsContact O-CD 3.32Å; L456-P460 WeakPolarHBondContact O-CD 3.49Å
457	C	97	Very high	94.1	Very high	15 Å²	15	36.5 Å²	36.5	10%	0.101	20%	0.199	C	C	.	.	H	α-helix	trans	-71.4	-41.8	178.5	-77.2	0	0	0	0	112.7	C453 F454 V455 I486 A487 N490	C453-C457 VanDerWaalsContact O-CB 3.28Å; C453-C457 WeakPolarHBondContact O-CB 3.24Å; C453-C457 PolarHBondContact O-N 2.95Å; C453-C457 PolarHBondContact O-SG 2.81Å; C453-C457 VanDerWaalsContact O-SG 3.37Å; F454-C457 PolarHBondContact O-N 3.41Å; V455-C457 VanDerWaalsContact C-N 3.31Å; V455-C457 PolarHBondContact O-N 3.38Å; C457-I486 WeakPolarHBondContact CB-O 3.45Å; C457-I486 CarbonylContact O-C 3.56Å; C457-I486 PolarHBondContact SG-O 3.12Å; C457-I486 VanDerWaalsContact SG-O 3.32Å; C457-A487 VanDerWaalsContact O-CA 3.31Å; C457-A487 WeakPolarHBondContact O-CA 3.27Å; C457-A487 PolarHBondContact O-N 3.2Å; C457-N490 HydrophobicContact CB-CB 3.76Å
458	W	95.9	Very high	93.9	Very high	21 Å²	21	37.5 Å²	37.5	8%	0.08	20%	0.203	C	C	.	.	H	α-helix	trans	-88.8	-20.5	-174.3	-80.4	92.5	0	0	0	114.3	C127 F208 F454 V455 F461 T462 A487	C127-W458 HydrophobicContact CB-CH2 3.3Å; C127-W458 HydrophobicContact CB-CZ2 3.53Å; C127-W458 HydrophobicContact CB-CZ3 4Å; F208-W458 HydrophobicContact CD2-CB 4.01Å; F208-W458 HydrophobicContact CE2-CB 3.6Å; F454-W458 AromaticContact CD2-CD1 3.74Å; F454-W458 AromaticContact CD2-NE1 3.98Å; F454-W458 HydrophobicContact CE1-CB 4.18Å; F454-W458 AromaticContact CE1-CD1 3.83Å; F454-W458 HydrophobicContact CE1-CG 4.03Å; F454-W458 AromaticContact CE2-CD1 3.46Å; F454-W458 VanDerWaalsContact CE2-CD1 3.46Å; F454-W458 HydrophobicContact CE2-CG 4.26Å; F454-W458 AromaticContact CE2-NE1 3.46Å; F454-W458 HydrophobicContact CZ-CB 4.45Å; F454-W458 AromaticContact CZ-CD1 3.47Å; F454-W458 VanDerWaalsContact CZ-CD1 3.47Å; F454-W458 HydrophobicContact CZ-CD2 4.32Å; F454-W458 AromaticContact CZ-CG 3.83Å; F454-W458 HydrophobicContact CZ-CG 3.83Å; F454-W458 AromaticContact CZ-NE1 3.76Å; F454-W458 WeakPolarHBondContact O-CB 3.41Å; F454-W458 PolarHBondContact O-N 3.4Å; V455-W458 PolarHBondContact O-N 3.34Å; W458-F461 HydrophobicContact CE3-CD1 4.4Å; W458-F461 HydrophobicContact CZ3-CD1 4.24Å; W458-F461 PolarHBondContact O-N 2.84Å; W458-T462 WeakPolarHBondContact O-CB 3.31Å; W458-T462 PolarHBondContact O-N 3.29Å; W458-T462 PolarHBondContact O-OG1 3.06Å; W458-A487 HydrophobicContact CD2-CB 3.78Å; W458-A487 HydrophobicContact CE3-CB 3.84Å; W458-A487 HydrophobicContact CG-CB 4.29Å; W458-A487 HydrophobicContact CH2-CB 4.21Å; W458-A487 HydrophobicContact CZ2-CB 4.16Å; W458-A487 HydrophobicContact CZ3-CB 4.06Å
459	L	94.8	Very high	93.5	Very high	60 Å²	60	37.2 Å²	37.2	31%	0.314	20%	0.201	S	C	.	.	H	α-helix	trans	-59.6	-46.1	-176.3	-176.7	68.2	0	0	0	113.5	F208 V455 F461 T462 I463	F208-L459 HydrophobicContact CE1-CD1 3.8Å; F208-L459 HydrophobicContact CZ-CB 4.13Å; F208-L459 HydrophobicContact CZ-CD1 4.03Å; V455-L459 WeakPolarHBondContact O-CB 3.39Å; V455-L459 PolarHBondContact O-N 3.05Å; L459-F461 PolarHBondContact O-N 3.43Å; L459-T462 PolarHBondContact O-N 3.13Å; L459-I463 HydrophobicContact CD1-CD1 3.9Å; L459-I463 HydrophobicContact CD1-CG1 4.1Å; L459-I463 HydrophobicContact CD2-CD1 4.44Å; L459-I463 HydrophobicContact CG-CD1 3.77Å; L459-I463 HydrophobicContact CG-CG1 4.35Å; L459-I463 WeakPolarHBondContact O-CG1 3.46Å; L459-I463 PolarHBondContact O-N 2.89Å
460	P	95.2	Very high	93.2	Very high	43 Å²	43	35.9 Å²	35.9	28%	0.279	20%	0.203	S	C	.	.	H	α-helix	trans	-59.9	-46	-179.5	-24.1	34.9	0	0	0	112.9	L456 I463 S464 A483	L456-P460 VanDerWaalsContact O-CD 3.32Å; L456-P460 WeakPolarHBondContact O-CD 3.49Å; P460-I463 PolarHBondContact O-N 3.26Å; P460-S464 PolarHBondContact O-N 3.47Å; P460-S464 VanDerWaalsContact O-N 3.11Å; P460-A483 HydrophobicContact CB-CB 4.28Å
461	F	94	Very high	92.7	Very high	62 Å²	62	40.6 Å²	40.6	27%	0.272	24%	0.235	S	C	.	.	H	α-helix	trans	-66.3	-39.4	177.7	-177.8	-93.7	0	0	0	111.7	W458 L459 I463 S464 Y465 A483 A487	W458-F461 HydrophobicContact CE3-CD1 4.4Å; W458-F461 HydrophobicContact CZ3-CD1 4.24Å; W458-F461 PolarHBondContact O-N 2.84Å; L459-F461 PolarHBondContact O-N 3.43Å; F461-I463 PolarHBondContact O-N 2.95Å; F461-S464 PolarHBondContact O-N 3.44Å; F461-S464 PolarHBondContact O-OG 3.4Å; F461-S464 VanDerWaalsContact O-OG 3.06Å; F461-Y465 VanDerWaalsContact O-CB 3.23Å; F461-Y465 WeakPolarHBondContact O-CB 3.35Å; F461-Y465 PolarHBondContact O-N 3.5Å; F461-A483 HydrophobicContact CB-CB 4.13Å; F461-A483 HydrophobicContact CD2-CB 4.44Å; F461-A487 HydrophobicContact CB-CB 4.44Å
462	T	93.5	Very high	91.8	Very high	9 Å²	9	47.7 Å²	47.7	6%	0.055	27%	0.267	C	S	.	.	H	α-helix	trans	-66.1	-40	179	-54.4	0	0	0	0	111.5	F208 F209 W458 L459 L466	F208-T462 HydrophobicContact CB-CG2 3.88Å; F208-T462 HydrophobicContact CD1-CG2 3.68Å; F208-T462 HydrophobicContact CE1-CG2 4.37Å; F208-T462 HydrophobicContact CG-CG2 3.83Å; F209-T462 HydrophobicContact CD2-CG2 4.41Å; F209-T462 HydrophobicContact CE2-CG2 3.76Å; W458-T462 WeakPolarHBondContact O-CB 3.31Å; W458-T462 PolarHBondContact O-N 3.29Å; W458-T462 PolarHBondContact O-OG1 3.06Å; L459-T462 PolarHBondContact O-N 3.13Å; T462-L466 HydrophobicContact CG2-CD1 4.14Å; T462-L466 WeakPolarHBondContact O-CG 3.43Å; T462-L466 PolarHBondContact O-N 2.73Å; T462-L466 VanDerWaalsContact O-N 3.08Å
463	I	92.3	Very high	91	Very high	74 Å²	74	50.6 Å²	50.6	38%	0.379	27%	0.269	S	S	.	.	H	α-helix	trans	-63	-46.9	176	-69.9	169.7	0	0	0	110.1	L459 P460 F461 L466 M467	L459-I463 HydrophobicContact CD1-CD1 3.9Å; L459-I463 HydrophobicContact CD1-CG1 4.1Å; L459-I463 HydrophobicContact CD2-CD1 4.44Å; L459-I463 HydrophobicContact CG-CD1 3.77Å; L459-I463 HydrophobicContact CG-CG1 4.35Å; L459-I463 WeakPolarHBondContact O-CG1 3.46Å; L459-I463 PolarHBondContact O-N 2.89Å; P460-I463 PolarHBondContact O-N 3.26Å; F461-I463 PolarHBondContact O-N 2.95Å; I463-L466 PolarHBondContact O-N 3.28Å; I463-M467 HydrophobicContact CG2-CG 4.2Å; I463-M467 HydrophobicContact CG2-SD 3.74Å; I463-M467 WeakPolarHBondContact O-CB 3.47Å; I463-M467 WeakPolarHBondContact O-CG 3.39Å; I463-M467 PolarHBondContact O-N 3.47Å
464	S	91.6	Very high	90.2	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.007	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-43.4	179.2	73.2	0	0	0	0	112.2	P460 F461 L466 M467 E468 N480	P460-S464 PolarHBondContact O-N 3.47Å; P460-S464 VanDerWaalsContact O-N 3.11Å; F461-S464 PolarHBondContact O-N 3.44Å; F461-S464 PolarHBondContact O-OG 3.4Å; F461-S464 VanDerWaalsContact O-OG 3.06Å; S464-L466 VanDerWaalsContact C-N 3.29Å; S464-L466 PolarHBondContact O-N 3.31Å; S464-M467 PolarHBondContact O-N 2.92Å; S464-E468 WeakPolarHBondContact O-CB 3.44Å; S464-E468 WeakPolarHBondContact O-CG 3.4Å; S464-E468 PolarHBondContact O-N 2.88Å; S464-N480 PolarHBondContact OG-OD1 3.01Å; S464-N480 VanDerWaalsContact OG-OD1 3.06Å
465	Y	91.8	Very high	89.7	Confident	20 Å²	20	57.7 Å²	57.7	8%	0.078	30%	0.302	C	S	.	.	H	α-helix	trans	-56.2	-41.4	176.9	179.8	-107.3	0	0	0	112.8	I193 R200 T203 F461	I193-Y465 HydrophobicContact CB-CE2 4.42Å; I193-Y465 HydrophobicContact CD1-CE2 4.16Å; I193-Y465 HydrophobicContact CG2-CE2 4.13Å; R200-Y465 HydrophobicContact CB-CD1 4.44Å; R200-Y465 HydrophobicContact CB-CE1 3.85Å; R200-Y465 HydrophobicContact CB-CE2 4.47Å; R200-Y465 HydrophobicContact CG-CE1 4.1Å; R200-Y465 HydrophobicContact CG-CE2 3.83Å; R200-Y465 PolarHBondContact NH1-O 3.19Å; R200-Y465 VanDerWaalsContact O-CE1 3.27Å; R200-Y465 WeakPolarHBondContact O-CE1 3.15Å; T203-Y465 WeakPolarHBondContact OG1-CE1 3.46Å; T203-Y465 PolarHBondContact OG1-OH 2.86Å; F461-Y465 VanDerWaalsContact O-CB 3.23Å; F461-Y465 WeakPolarHBondContact O-CB 3.35Å; F461-Y465 PolarHBondContact O-N 3.5Å
466	L	92.3	Very high	89.5	Confident	21 Å²	21	60.2 Å²	60.2	11%	0.11	32%	0.321	C	S	.	.	H	α-helix	trans	-77.3	-39.1	177.4	-70	173.8	0	0	0	112.9	R200 F201 F209 T462 I463 S464 E468 G469 A470	R200-L466 WeakPolarHBondContact O-CD2 3.27Å; F201-L466 HydrophobicContact CD1-CD2 3.75Å; F201-L466 HydrophobicContact CE1-CD2 4.22Å; F201-L466 HydrophobicContact CG-CD2 4.39Å; F209-L466 HydrophobicContact CD2-CD1 4.16Å; F209-L466 HydrophobicContact CE2-CD1 3.4Å; F209-L466 HydrophobicContact CZ-CD1 4.22Å; T462-L466 HydrophobicContact CG2-CD1 4.14Å; T462-L466 WeakPolarHBondContact O-CG 3.43Å; T462-L466 PolarHBondContact O-N 2.73Å; T462-L466 VanDerWaalsContact O-N 3.08Å; I463-L466 PolarHBondContact O-N 3.28Å; S464-L466 VanDerWaalsContact C-N 3.29Å; S464-L466 PolarHBondContact O-N 3.31Å; L466-E468 VanDerWaalsContact C-N 3.34Å; L466-E468 PolarHBondContact O-N 3.4Å; L466-G469 CarbonylContact O-C 3.5Å; L466-G469 PolarHBondContact O-N 3.13Å; L466-G469 VanDerWaalsContact O-N 3.08Å; L466-A470 WeakPolarHBondContact O-CB 3.2Å; L466-A470 PolarHBondContact O-N 2.98Å
467	M	90.7	Very high	88.9	Confident	73 Å²	73	59.3 Å²	59.3	36%	0.36	31%	0.314	S	S	.	.	H	α-helix	trans	-65.5	-36.3	178.5	-79.7	-173.7	67.5	0	0	112.5	I463 S464 G469 A470 C471 F475	I463-M467 HydrophobicContact CG2-CG 4.2Å; I463-M467 HydrophobicContact CG2-SD 3.74Å; I463-M467 WeakPolarHBondContact O-CB 3.47Å; I463-M467 WeakPolarHBondContact O-CG 3.39Å; I463-M467 PolarHBondContact O-N 3.47Å; S464-M467 PolarHBondContact O-N 2.92Å; M467-G469 PolarHBondContact O-N 3.08Å; M467-A470 PolarHBondContact O-N 3.33Å; M467-C471 PolarHBondContact O-N 3Å; M467-F475 HydrophobicContact CB-CE2 3.75Å; M467-F475 HydrophobicContact CB-CZ 4.23Å; M467-F475 HydrophobicContact CE-CE2 4.42Å; M467-F475 HydrophobicContact CE-CZ 3.91Å; M467-F475 HydrophobicContact SD-CE2 4.24Å; M467-F475 HydrophobicContact SD-CZ 3.72Å
468	E	87.8	Confident	88.4	Confident	29 Å²	29	62.4 Å²	62.4	14%	0.136	34%	0.34	C	S	.	.	H	α-helix	trans	-60.2	-32.7	170.6	-81.1	177.1	-166.2	0	0	112.1	R200 S464 L466 E472 Y473 F475 N480	R200-E468 IonicContact CZ-OE2 3.3Å; R200-E468 VanDerWaalsContact CZ-OE2 3.3Å; R200-E468 IonicContact NH1-OE2 2.69Å; R200-E468 PolarHBondContact NH1-OE2 2.93Å; R200-E468 IonicContact NH2-OE2 3.03Å; R200-E468 PolarHBondContact NH2-OE2 3.47Å; S464-E468 WeakPolarHBondContact O-CB 3.44Å; S464-E468 WeakPolarHBondContact O-CG 3.4Å; S464-E468 PolarHBondContact O-N 2.88Å; L466-E468 VanDerWaalsContact C-N 3.34Å; L466-E468 PolarHBondContact O-N 3.4Å; E468-E472 WeakPolarHBondContact O-CA 3.35Å; E468-E472 PolarHBondContact O-N 3.33Å; E468-Y473 VanDerWaalsContact CG-O 3.3Å; E468-Y473 WeakPolarHBondContact CG-O 3.44Å; E468-F475 HydrophobicContact CG-CD2 4.41Å; E468-N480 PolarHBondContact OE1-ND2 3.23Å
469	G	85.8	Confident	88.3	Confident	9 Å²	9	65.6 Å²	65.6	9%	0.093	36%	0.355	C	S	.	.	H	α-helix	trans	-83	-28.3	174	0	0	0	0	0	114.2	A197 L466 M467	A197-G469 WeakPolarHBondContact CB-O 3.39Å; L466-G469 CarbonylContact O-C 3.5Å; L466-G469 PolarHBondContact O-N 3.13Å; L466-G469 VanDerWaalsContact O-N 3.08Å; M467-G469 PolarHBondContact O-N 3.08Å
470	A	88.1	Confident	88	Confident	58 Å²	58	64.4 Å²	64.4	48%	0.479	35%	0.349	S	S	.	.	H	α-helix	trans	-81.9	-45.5	-174.2	0	0	0	0	0	113.4	F201 L466 M467	F201-A470 HydrophobicContact CE2-CB 4.35Å; F201-A470 HydrophobicContact CZ-CB 3.61Å; L466-A470 WeakPolarHBondContact O-CB 3.2Å; L466-A470 PolarHBondContact O-N 2.98Å; M467-A470 PolarHBondContact O-N 3.33Å
471	C	85.6	Confident	87.9	Confident	99 Å²	99	63.5 Å²	63.5	67%	0.669	34%	0.341	S	S	*	.	S	Bend	trans	-127.4	8.6	-170.2	-58.8	0	0	0	0	112.5	M467 Y473	M467-C471 PolarHBondContact O-N 3Å; C471-Y473 PolarHBondContact O-N 2.92Å
472	E	75.6	Confident	87.9	Confident	166 Å²	166	62.1 Å²	62.1	78%	0.776	35%	0.345	S	S	*	.			trans	51.4	24.6	-171.7	-60.3	-179.8	-172.4	0	0	112.7	E468 I474	E468-E472 WeakPolarHBondContact O-CA 3.35Å; E468-E472 PolarHBondContact O-N 3.33Å; E472-I474 PolarHBondContact O-N 2.88Å; E472-I474 VanDerWaalsContact O-N 3.17Å
473	Y	78	Confident	88	Confident	130 Å²	130	61.9 Å²	61.9	51%	0.51	34%	0.343	S	S	.	.			trans	-75.7	109.9	-179.2	-178	-91.9	0	0	0	109.1	E468 C471 F475	E468-Y473 VanDerWaalsContact CG-O 3.3Å; E468-Y473 WeakPolarHBondContact CG-O 3.44Å; C471-Y473 PolarHBondContact O-N 2.92Å; Y473-F475 HydrophobicContact CD1-CD1 4.22Å; Y473-F475 AromaticContact CD1-CD2 3.75Å; Y473-F475 HydrophobicContact CD1-CD2 3.75Å; Y473-F475 HydrophobicContact CD1-CE1 4.06Å; Y473-F475 AromaticContact CD1-CE2 3.56Å; Y473-F475 HydrophobicContact CD1-CE2 3.56Å; Y473-F475 HydrophobicContact CD1-CG 4.08Å; Y473-F475 AromaticContact CD1-CZ 3.72Å; Y473-F475 HydrophobicContact CD1-CZ 3.72Å; Y473-F475 AromaticContact CE1-CD1 3.7Å; Y473-F475 HydrophobicContact CE1-CD1 3.7Å; Y473-F475 HydrophobicContact CE1-CD2 4.07Å; Y473-F475 AromaticContact CE1-CE1 3.66Å; Y473-F475 HydrophobicContact CE1-CE1 3.66Å; Y473-F475 HydrophobicContact CE1-CE2 4.02Å; Y473-F475 AromaticContact CE1-CG 3.9Å; Y473-F475 HydrophobicContact CE1-CG 3.9Å; Y473-F475 AromaticContact CE1-CZ 3.82Å; Y473-F475 HydrophobicContact CE1-CZ 3.82Å; Y473-F475 PolarHBondContact O-N 3.43Å
474	I	79	Confident	88.1	Confident	145 Å²	145	58.5 Å²	58.5	74%	0.744	33%	0.327	S	S	*	.			trans	-84.7	106.4	-179.7	-53.4	174.4	0	0	0	108.3	E472	E472-I474 PolarHBondContact O-N 2.88Å; E472-I474 VanDerWaalsContact O-N 3.17Å
475	F	85.1	Confident	88.4	Confident	33 Å²	33	59.2 Å²	59.2	15%	0.145	33%	0.329	C	S	.	.			trans	-65.5	153.2	169.2	-70.7	-92	0	0	0	110.3	M467 E468 Y473 F479	M467-F475 HydrophobicContact CB-CE2 3.75Å; M467-F475 HydrophobicContact CB-CZ 4.23Å; M467-F475 HydrophobicContact CE-CE2 4.42Å; M467-F475 HydrophobicContact CE-CZ 3.91Å; M467-F475 HydrophobicContact SD-CE2 4.24Å; M467-F475 HydrophobicContact SD-CZ 3.72Å; E468-F475 HydrophobicContact CG-CD2 4.41Å; Y473-F475 HydrophobicContact CD1-CD1 4.22Å; Y473-F475 AromaticContact CD1-CD2 3.75Å; Y473-F475 HydrophobicContact CD1-CD2 3.75Å; Y473-F475 HydrophobicContact CD1-CE1 4.06Å; Y473-F475 AromaticContact CD1-CE2 3.56Å; Y473-F475 HydrophobicContact CD1-CE2 3.56Å; Y473-F475 HydrophobicContact CD1-CG 4.08Å; Y473-F475 AromaticContact CD1-CZ 3.72Å; Y473-F475 HydrophobicContact CD1-CZ 3.72Å; Y473-F475 AromaticContact CE1-CD1 3.7Å; Y473-F475 HydrophobicContact CE1-CD1 3.7Å; Y473-F475 HydrophobicContact CE1-CD2 4.07Å; Y473-F475 AromaticContact CE1-CE1 3.66Å; Y473-F475 HydrophobicContact CE1-CE1 3.66Å; Y473-F475 HydrophobicContact CE1-CE2 4.02Å; Y473-F475 AromaticContact CE1-CG 3.9Å; Y473-F475 HydrophobicContact CE1-CG 3.9Å; Y473-F475 AromaticContact CE1-CZ 3.82Å; Y473-F475 HydrophobicContact CE1-CZ 3.82Å; Y473-F475 PolarHBondContact O-N 3.43Å; F475-F479 HydrophobicContact CB-CB 4.44Å; F475-F479 HydrophobicContact CB-CD1 3.75Å; F475-F479 HydrophobicContact CB-CE1 4.5Å; F475-F479 HydrophobicContact CB-CG 4.4Å; F475-F479 AromaticContact CD1-CD1 3.52Å; F475-F479 HydrophobicContact CD1-CD1 3.52Å; F475-F479 AromaticContact CD1-CE1 3.62Å; F475-F479 HydrophobicContact CD1-CE1 3.62Å; F475-F479 HydrophobicContact CD1-CG 4.1Å; F475-F479 HydrophobicContact CD1-CZ 4.26Å; F475-F479 HydrophobicContact CE1-CD1 4.36Å; F475-F479 HydrophobicContact CE1-CE1 4.02Å; F475-F479 HydrophobicContact CE1-CZ 4.35Å; F475-F479 AromaticContact CG-CD1 3.78Å; F475-F479 HydrophobicContact CG-CD1 3.78Å; F475-F479 HydrophobicContact CG-CE1 4.07Å
476	S	88.5	Confident	88.6	Confident	75 Å²	75	61.9 Å²	61.9	52%	0.524	34%	0.344	S	S	.	.			trans	-59.4	145.6	174.5	67.9	0	0	0	0	110.5	A478 F479 N480	S476-A478 PolarHBondContact O-N 2.99Å; S476-F479 WeakPolarHBondContact O-CB 3.4Å; S476-F479 PolarHBondContact O-N 3.28Å; S476-F479 WeakPolarHBondContact OG-CB 3.4Å; S476-F479 PolarHBondContact OG-N 2.91Å; S476-N480 PolarHBondContact O-N 2.83Å
477	E	84.1	Confident	88.9	Confident	103 Å²	103	61 Å²	61	48%	0.481	34%	0.339	S	S	.	.	H	α-helix	trans	-57.3	-37.2	178	-177.5	167	-157.1	0	0	111.6	F479 N480 M481	E477-F479 VanDerWaalsContact C-N 3.33Å; E477-F479 PolarHBondContact O-N 3Å; E477-N480 PolarHBondContact O-N 3.34Å; E477-M481 WeakPolarHBondContact O-CB 3.2Å; E477-M481 PolarHBondContact O-N 2.85Å
478	A	87.7	Confident	89.2	Confident	79 Å²	79	58 Å²	58	65%	0.653	32%	0.324	S	S	*	.	H	α-helix	trans	-59.7	-40.9	173.9	0	0	0	0	0	112.7	S476 G482	S476-A478 PolarHBondContact O-N 2.99Å; A478-G482 PolarHBondContact O-N 3.45Å
479	F	92	Very high	89.5	Confident	89 Å²	89	59.3 Å²	59.3	39%	0.39	33%	0.332	S	S	.	.	H	α-helix	trans	-66.6	-49.1	176.5	178	-88.3	0	0	0	111.2	F475 S476 E477 M481 G482 A483	F475-F479 HydrophobicContact CB-CB 4.44Å; F475-F479 HydrophobicContact CB-CD1 3.75Å; F475-F479 HydrophobicContact CB-CE1 4.5Å; F475-F479 HydrophobicContact CB-CG 4.4Å; F475-F479 AromaticContact CD1-CD1 3.52Å; F475-F479 HydrophobicContact CD1-CD1 3.52Å; F475-F479 AromaticContact CD1-CE1 3.62Å; F475-F479 HydrophobicContact CD1-CE1 3.62Å; F475-F479 HydrophobicContact CD1-CG 4.1Å; F475-F479 HydrophobicContact CD1-CZ 4.26Å; F475-F479 HydrophobicContact CE1-CD1 4.36Å; F475-F479 HydrophobicContact CE1-CE1 4.02Å; F475-F479 HydrophobicContact CE1-CZ 4.35Å; F475-F479 AromaticContact CG-CD1 3.78Å; F475-F479 HydrophobicContact CG-CD1 3.78Å; F475-F479 HydrophobicContact CG-CE1 4.07Å; S476-F479 WeakPolarHBondContact O-CB 3.4Å; S476-F479 PolarHBondContact O-N 3.28Å; S476-F479 WeakPolarHBondContact OG-CB 3.4Å; S476-F479 PolarHBondContact OG-N 2.91Å; E477-F479 VanDerWaalsContact C-N 3.33Å; E477-F479 PolarHBondContact O-N 3Å; F479-M481 VanDerWaalsContact C-N 3.31Å; F479-M481 PolarHBondContact O-N 3.16Å; F479-G482 PolarHBondContact O-N 3.24Å; F479-A483 HydrophobicContact CE1-CB 4.41Å; F479-A483 WeakPolarHBondContact O-CB 3.06Å; F479-A483 PolarHBondContact O-N 2.83Å
480	N	90	Very high	90	Very high	35 Å²	35	58.9 Å²	58.9	19%	0.187	33%	0.328	C	S	.	.	H	α-helix	trans	-63.1	-38.7	179.7	-85.1	-27.6	0	0	0	111.9	S464 E468 S476 E477 G484	S464-N480 PolarHBondContact OG-OD1 3.01Å; S464-N480 VanDerWaalsContact OG-OD1 3.06Å; E468-N480 PolarHBondContact OE1-ND2 3.23Å; S476-N480 PolarHBondContact O-N 2.83Å; E477-N480 PolarHBondContact O-N 3.34Å; N480-G484 PolarHBondContact O-N 3.47Å
481	M	91.5	Very high	90.5	Very high	24 Å²	24	56.3 Å²	56.3	12%	0.118	31%	0.306	C	S	.	.	H	α-helix	trans	-61.9	-49.3	172.9	-172.3	66.7	76.2	0	0	111.1	F99 Q103 E477 F479 A483 G484 W485	F99-M481 HydrophobicContact CD2-SD 4.44Å; F99-M481 HydrophobicContact CE1-SD 3.82Å; F99-M481 HydrophobicContact CE2-SD 3.72Å; F99-M481 HydrophobicContact CZ-SD 3.36Å; F99-M481 WeakPolarHBondContact CZ-SD 2.9Å; Q103-M481 HydrophobicContact CB-CE 3.68Å; Q103-M481 HydrophobicContact CB-SD 4.08Å; Q103-M481 HydrophobicContact CG-CE 3.94Å; Q103-M481 HydrophobicContact CG-CG 4.4Å; Q103-M481 HydrophobicContact CG-SD 4.22Å; Q103-M481 PolarHBondContact OE1-SD 2.84Å; Q103-M481 VanDerWaalsContact OE1-SD 3.38Å; E477-M481 WeakPolarHBondContact O-CB 3.2Å; E477-M481 PolarHBondContact O-N 2.85Å; F479-M481 VanDerWaalsContact C-N 3.31Å; F479-M481 PolarHBondContact O-N 3.16Å; M481-A483 PolarHBondContact O-N 3.45Å; M481-G484 PolarHBondContact O-N 3.23Å; M481-W485 VanDerWaalsContact O-CD1 3.27Å; M481-W485 PolarHBondContact O-N 3.23Å
482	G	94.4	Very high	91	Very high	33 Å²	33	53.6 Å²	53.6	34%	0.34	28%	0.284	S	S	.	.	H	α-helix	trans	-60.1	-45.1	177.2	0	0	0	0	0	112.8	A478 F479 G484 W485 I486	A478-G482 PolarHBondContact O-N 3.45Å; F479-G482 PolarHBondContact O-N 3.24Å; G482-G484 PolarHBondContact O-N 2.03Å; G482-W485 PolarHBondContact O-N 2.91Å; G482-I486 VanDerWaalsContact O-CG1 3.31Å; G482-I486 WeakPolarHBondContact O-CG1 3.43Å; G482-I486 PolarHBondContact O-N 3.16Å
483	A	96.1	Very high	92	Very high	4 Å²	4	47.3 Å²	47.3	3%	0.033	26%	0.258	C	S	.	.	H	α-helix	trans	-62.6	-40.8	176.3	0	0	0	0	0	112	P460 F461 F479 M481 I486 A487	P460-A483 HydrophobicContact CB-CB 4.28Å; F461-A483 HydrophobicContact CB-CB 4.13Å; F461-A483 HydrophobicContact CD2-CB 4.44Å; F479-A483 HydrophobicContact CE1-CB 4.41Å; F479-A483 WeakPolarHBondContact O-CB 3.06Å; F479-A483 PolarHBondContact O-N 2.83Å; M481-A483 PolarHBondContact O-N 3.45Å; A483-I486 PolarHBondContact O-N 3.07Å; A483-A487 PolarHBondContact O-N 3.48Å
484	G	95.5	Very high	92.8	Very high	3 Å²	3	41.2 Å²	41.2	3%	0.031	23%	0.234	C	C	.	.	H	α-helix	trans	-60.9	-44.4	173.8	0	0	0	0	0	112.5	N480 M481 G482 A487 Y488	N480-G484 PolarHBondContact O-N 3.47Å; M481-G484 PolarHBondContact O-N 3.23Å; G482-G484 PolarHBondContact O-N 2.03Å; G484-A487 WeakPolarHBondContact O-CB 3.05Å; G484-A487 PolarHBondContact O-N 3.23Å; G484-Y488 WeakPolarHBondContact O-CD2 3.43Å; G484-Y488 PolarHBondContact O-N 3.46Å
485	W	96.6	Very high	93.6	Very high	16 Å²	16	34.8 Å²	34.8	6%	0.061	20%	0.202	C	C	.	.	H	α-helix	trans	-65	-41.7	175.2	-83.1	106.3	0	0	0	113.2	Q49 L96 F99 I100 M481 G482 A487 Y488 L489	Q49-W485 HydrophobicContact CB-CD2 4.39Å; Q49-W485 HydrophobicContact CB-CE3 4.29Å; Q49-W485 HydrophobicContact CB-CH2 3.47Å; Q49-W485 VanDerWaalsContact CB-CH2 3.47Å; Q49-W485 HydrophobicContact CB-CZ2 3.56Å; Q49-W485 HydrophobicContact CB-CZ3 3.85Å; Q49-W485 VanDerWaalsContact CD-CZ2 3.46Å; Q49-W485 HydrophobicContact CG-CD2 3.64Å; Q49-W485 VanDerWaalsContact CG-CE2 3.47Å; Q49-W485 HydrophobicContact CG-CE3 3.86Å; Q49-W485 HydrophobicContact CG-CG 4.28Å; Q49-W485 HydrophobicContact CG-CH2 3.83Å; Q49-W485 HydrophobicContact CG-CZ2 3.58Å; Q49-W485 HydrophobicContact CG-CZ3 3.94Å; Q49-W485 VanDerWaalsContact NE2-CE2 3.33Å; L96-W485 HydrophobicContact CD2-CH2 4.05Å; L96-W485 HydrophobicContact CD2-CZ3 3.92Å; F99-W485 HydrophobicContact CD1-CD2 4.18Å; F99-W485 AromaticContact CD1-CE2 3.52Å; F99-W485 HydrophobicContact CD1-CH2 4.42Å; F99-W485 AromaticContact CD1-CZ2 3.68Å; F99-W485 HydrophobicContact CD1-CZ2 3.68Å; F99-W485 AromaticContact CD1-NE1 3.57Å; F99-W485 AromaticContact CE1-CD1 3.47Å; F99-W485 VanDerWaalsContact CE1-CD1 3.47Å; F99-W485 AromaticContact CE1-CD2 3.97Å; F99-W485 HydrophobicContact CE1-CD2 3.97Å; F99-W485 AromaticContact CE1-CE2 3.58Å; F99-W485 AromaticContact CE1-CG 3.91Å; F99-W485 HydrophobicContact CE1-CG 3.91Å; F99-W485 HydrophobicContact CE1-CZ2 4.22Å; F99-W485 AromaticContact CE1-NE1 3.24Å; I100-W485 HydrophobicContact CD1-CH2 3.97Å; I100-W485 HydrophobicContact CD1-CZ2 4.4Å; I100-W485 HydrophobicContact CG1-CH2 3.61Å; I100-W485 HydrophobicContact CG1-CZ2 3.54Å; M481-W485 VanDerWaalsContact O-CD1 3.27Å; M481-W485 PolarHBondContact O-N 3.23Å; G482-W485 PolarHBondContact O-N 2.91Å; W485-A487 PolarHBondContact O-N 3Å; W485-Y488 PolarHBondContact O-N 2.94Å; W485-Y488 VanDerWaalsContact O-N 3.17Å; W485-L489 VanDerWaalsContact O-CG 3.31Å; W485-L489 WeakPolarHBondContact O-CG 3.45Å; W485-L489 PolarHBondContact O-N 3.35Å
486	I	97.1	Very high	94.1	Very high	76 Å²	76	37.6 Å²	37.6	39%	0.39	22%	0.215	S	C	.	.	H	α-helix	trans	-58.7	-39.6	173.8	-68.9	166.8	0	0	0	110.6	C457 G482 A483 L489	C457-I486 WeakPolarHBondContact CB-O 3.45Å; C457-I486 CarbonylContact O-C 3.56Å; C457-I486 PolarHBondContact SG-O 3.12Å; C457-I486 VanDerWaalsContact SG-O 3.32Å; G482-I486 VanDerWaalsContact O-CG1 3.31Å; G482-I486 WeakPolarHBondContact O-CG1 3.43Å; G482-I486 PolarHBondContact O-N 3.16Å; A483-I486 PolarHBondContact O-N 3.07Å; I486-L489 PolarHBondContact O-N 3.23Å
487	A	97.1	Very high	94.4	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.008	20%	0.195	C	C	.	.	H	α-helix	trans	-63.1	-46.1	174.5	0	0	0	0	0	112.1	C457 W458 F461 A483 G484 W485 L489 N490	C457-A487 VanDerWaalsContact O-CA 3.31Å; C457-A487 WeakPolarHBondContact O-CA 3.27Å; C457-A487 PolarHBondContact O-N 3.2Å; W458-A487 HydrophobicContact CD2-CB 3.78Å; W458-A487 HydrophobicContact CE3-CB 3.84Å; W458-A487 HydrophobicContact CG-CB 4.29Å; W458-A487 HydrophobicContact CH2-CB 4.21Å; W458-A487 HydrophobicContact CZ2-CB 4.16Å; W458-A487 HydrophobicContact CZ3-CB 4.06Å; F461-A487 HydrophobicContact CB-CB 4.44Å; A483-A487 PolarHBondContact O-N 3.48Å; G484-A487 WeakPolarHBondContact O-CB 3.05Å; G484-A487 PolarHBondContact O-N 3.23Å; W485-A487 PolarHBondContact O-N 3Å; A487-L489 VanDerWaalsContact C-N 3.34Å; A487-L489 PolarHBondContact O-N 2.96Å; A487-N490 WeakPolarHBondContact O-CB 3.02Å; A487-N490 PolarHBondContact O-N 3.42Å
488	Y	97.2	Very high	94.9	Very high	10 Å²	10	30.5 Å²	30.5	4%	0.039	17%	0.173	C	C	.	.	H	α-helix	trans	-69.6	-26.3	178.4	-62.4	-48.9	0	0	0	114.2	V91 I95 L96 F99 N123 G484 W485 N490 S491	V91-Y488 HydrophobicContact CG1-CD1 3.74Å; V91-Y488 HydrophobicContact CG1-CE1 4.22Å; I95-Y488 HydrophobicContact CG2-CE1 3.76Å; I95-Y488 HydrophobicContact CG2-CE2 4.44Å; I95-Y488 VanDerWaalsContact CG2-OH 3.28Å; I95-Y488 WeakPolarHBondContact CG2-OH 3.33Å; L96-Y488 HydrophobicContact CD2-CD1 4.26Å; L96-Y488 HydrophobicContact CD2-CD2 3.66Å; L96-Y488 HydrophobicContact CD2-CE2 4.28Å; L96-Y488 HydrophobicContact CD2-CG 3.67Å; F99-Y488 AromaticContact CD1-CD2 3.82Å; F99-Y488 HydrophobicContact CD1-CD2 3.82Å; F99-Y488 AromaticContact CD1-CE2 3.43Å; F99-Y488 HydrophobicContact CD1-CE2 3.43Å; F99-Y488 VanDerWaalsContact CD1-CE2 3.43Å; F99-Y488 HydrophobicContact CD2-CE2 4.4Å; F99-Y488 AromaticContact CE1-CD2 3.83Å; F99-Y488 HydrophobicContact CE1-CD2 3.83Å; F99-Y488 AromaticContact CE1-CE2 3.5Å; F99-Y488 HydrophobicContact CE1-CE2 3.5Å; F99-Y488 VanDerWaalsContact CE1-CE2 3.5Å; F99-Y488 HydrophobicContact CE2-CE2 4.47Å; F99-Y488 AromaticContact CG-CE2 3.91Å; F99-Y488 HydrophobicContact CG-CE2 3.91Å; F99-Y488 HydrophobicContact CZ-CE2 4.04Å; N123-Y488 PolarHBondContact ND2-OH 3.18Å; G484-Y488 WeakPolarHBondContact O-CD2 3.43Å; G484-Y488 PolarHBondContact O-N 3.46Å; W485-Y488 PolarHBondContact O-N 2.94Å; W485-Y488 VanDerWaalsContact O-N 3.17Å; Y488-N490 PolarHBondContact O-N 3.08Å; Y488-N490 VanDerWaalsContact O-N 3.16Å; Y488-S491 WeakPolarHBondContact O-CB 3.37Å; Y488-S491 PolarHBondContact O-N 2.92Å
489	L	95.3	Very high	95.1	Very high	57 Å²	57	28.1 Å²	28.1	30%	0.298	15%	0.154	S	C	.	.	H	α-helix	trans	-61	-21.5	173.1	-72.3	173.9	0	0	0	112.6	W485 I486 A487 S491 M492 C493	W485-L489 VanDerWaalsContact O-CG 3.31Å; W485-L489 WeakPolarHBondContact O-CG 3.45Å; W485-L489 PolarHBondContact O-N 3.35Å; I486-L489 PolarHBondContact O-N 3.23Å; A487-L489 VanDerWaalsContact C-N 3.34Å; A487-L489 PolarHBondContact O-N 2.96Å; L489-S491 PolarHBondContact O-N 3.47Å; L489-M492 HydrophobicContact CD2-CE 3.63Å; L489-M492 HydrophobicContact CD2-SD 4.2Å; L489-M492 WeakPolarHBondContact O-CA 2.98Å; L489-M492 VanDerWaalsContact O-CB 3.28Å; L489-M492 WeakPolarHBondContact O-CB 3.4Å; L489-M492 PolarHBondContact O-N 2.71Å; L489-C493 PolarHBondContact O-N 3.44Å; L489-C493 PolarHBondContact O-SG 2.93Å
490	N	96.1	Very high	95.2	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-50.2	-45.7	168.8	170	66.1	0	0	0	112	F454 C457 A487 Y488 M492 C493	F454-N490 WeakPolarHBondContact CA-OD1 3.45Å; F454-N490 WeakPolarHBondContact CD2-ND2 3.36Å; F454-N490 PolarHBondContact N-OD1 3.46Å; C457-N490 HydrophobicContact CB-CB 3.76Å; A487-N490 WeakPolarHBondContact O-CB 3.02Å; A487-N490 PolarHBondContact O-N 3.42Å; Y488-N490 PolarHBondContact O-N 3.08Å; Y488-N490 VanDerWaalsContact O-N 3.16Å; N490-M492 PolarHBondContact O-N 3.26Å; N490-C493 PolarHBondContact O-N 2.95Å; N490-C493 VanDerWaalsContact O-N 3.15Å
491	S	97.2	Very high	95.3	Very high	4 Å²	4	32.7 Å²	32.7	3%	0.028	18%	0.179	C	C	.	.	H	α-helix	trans	-66.6	-21.2	-179.5	-62	0	0	0	0	112.3	N60 D88 Y488 L489	N60-S491 PolarHBondContact ND2-O 2.89Å; D88-S491 WeakPolarHBondContact OD1-CB 3.42Å; D88-S491 PolarHBondContact OD1-OG 3.45Å; Y488-S491 WeakPolarHBondContact O-CB 3.37Å; Y488-S491 PolarHBondContact O-N 2.92Å; L489-S491 PolarHBondContact O-N 3.47Å
492	M	96.6	Very high	95.2	Very high	42 Å²	42	32.6 Å²	32.6	21%	0.207	18%	0.179	C	C	.	.	H	α-helix	trans	-80.5	-41	172.9	-165.8	175.6	69.4	0	0	111.1	F55 I56 L489 N490 N494 P495 F496	F55-M492 HydrophobicContact CB-CG 4.2Å; F55-M492 HydrophobicContact CB-SD 4.05Å; I56-M492 HydrophobicContact CD1-CB 4.2Å; I56-M492 HydrophobicContact CG1-CB 3.54Å; I56-M492 HydrophobicContact CG1-CG 4.07Å; L489-M492 HydrophobicContact CD2-CE 3.63Å; L489-M492 HydrophobicContact CD2-SD 4.2Å; L489-M492 WeakPolarHBondContact O-CA 2.98Å; L489-M492 VanDerWaalsContact O-CB 3.28Å; L489-M492 WeakPolarHBondContact O-CB 3.4Å; L489-M492 PolarHBondContact O-N 2.71Å; N490-M492 PolarHBondContact O-N 3.26Å; M492-N494 VanDerWaalsContact C-N 3.3Å; M492-N494 PolarHBondContact O-N 2.94Å; M492-P495 WeakPolarHBondContact O-CD 3.42Å; M492-F496 HydrophobicContact CG-CD2 4.36Å; M492-F496 HydrophobicContact CG-CE2 3.92Å; M492-F496 VanDerWaalsContact O-CD2 3.27Å; M492-F496 WeakPolarHBondContact O-CD2 3.22Å
493	C	96.7	Very high	95	Very high	34 Å²	34	35.6 Å²	35.6	23%	0.23	19%	0.191	C	C	.	.	H	α-helix	trans	-64	-31.1	-172.5	-67.7	0	0	0	0	113.9	C453 L489 N490 F496 I497	C453-C493 WeakPolarHBondContact SG-CB 3.49Å; L489-C493 PolarHBondContact O-N 3.44Å; L489-C493 PolarHBondContact O-SG 2.93Å; N490-C493 PolarHBondContact O-N 2.95Å; N490-C493 VanDerWaalsContact O-N 3.15Å; C493-F496 WeakPolarHBondContact O-CB 3.45Å; C493-F496 PolarHBondContact O-N 3.41Å; C493-F496 VanDerWaalsContact O-N 3.14Å; C493-I497 HydrophobicContact CB-CD1 4.29Å; C493-I497 VanDerWaalsContact O-CG1 3.31Å; C493-I497 WeakPolarHBondContact O-CG1 3.5Å; C493-I497 PolarHBondContact O-N 3.47Å
494	N	94.9	Very high	94.7	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-56	-57.1	-176.3	-74.8	-25.7	0	0	0	113.2	D88 V450 M492 F496 I497 Y498	D88-N494 PolarHBondContact OD2-ND2 3.4Å; V450-N494 WeakPolarHBondContact CG1-OD1 3.36Å; M492-N494 VanDerWaalsContact C-N 3.3Å; M492-N494 PolarHBondContact O-N 2.94Å; N494-F496 VanDerWaalsContact C-N 3.28Å; N494-F496 PolarHBondContact O-N 3.34Å; N494-I497 PolarHBondContact O-N 3.37Å; N494-I497 VanDerWaalsContact O-N 3.15Å; N494-Y498 HydrophobicContact CB-CE2 4.06Å; N494-Y498 WeakPolarHBondContact O-CD2 3.24Å; N494-Y498 PolarHBondContact O-N 2.94Å
495	P	95.7	Very high	94.4	Very high	11 Å²	11	39.2 Å²	39.2	7%	0.071	21%	0.205	C	C	.	.	H	α-helix	trans	-50.9	-42.1	172	-30.3	33.7	0	0	0	114.5	G59 M492 Y498 A499	G59-P495 WeakPolarHBondContact O-CG 3.44Å; M492-P495 WeakPolarHBondContact O-CD 3.42Å; P495-Y498 PolarHBondContact O-N 2.87Å; P495-A499 WeakPolarHBondContact O-CB 3.21Å; P495-A499 PolarHBondContact O-N 3.4Å
496	F	95.5	Very high	94.2	Very high	92 Å²	92	39.6 Å²	39.6	40%	0.404	21%	0.211	S	C	.	.	H	α-helix	trans	-64.4	-46.2	177.7	-75.7	-99.9	0	0	0	111.4	M492 C493 N494 Y498 A499 F500	M492-F496 HydrophobicContact CG-CD2 4.36Å; M492-F496 HydrophobicContact CG-CE2 3.92Å; M492-F496 VanDerWaalsContact O-CD2 3.27Å; M492-F496 WeakPolarHBondContact O-CD2 3.22Å; C493-F496 WeakPolarHBondContact O-CB 3.45Å; C493-F496 PolarHBondContact O-N 3.41Å; C493-F496 VanDerWaalsContact O-N 3.14Å; N494-F496 VanDerWaalsContact C-N 3.28Å; N494-F496 PolarHBondContact O-N 3.34Å; F496-Y498 VanDerWaalsContact C-N 3.26Å; F496-Y498 PolarHBondContact O-N 2.89Å; F496-A499 PolarHBondContact O-N 2.88Å; F496-A499 VanDerWaalsContact O-N 3.13Å; F496-F500 HydrophobicContact CB-CD2 4.4Å; F496-F500 HydrophobicContact CD1-CD2 4.44Å; F496-F500 AromaticContact CD1-CE2 3.83Å; F496-F500 HydrophobicContact CD1-CE2 3.83Å; F496-F500 WeakPolarHBondContact O-CD2 3.33Å; F496-F500 PolarHBondContact O-N 3.41Å
497	I	96.2	Very high	93.9	Very high	22 Å²	22	42.4 Å²	42.4	11%	0.113	22%	0.221	C	C	.	.	H	α-helix	trans	-58.9	-40.5	176.3	-66.6	165.1	0	0	0	110.2	T446 L449 V450 C453 C493 N494 C501	T446-I497 HydrophobicContact CG2-CG2 3.8Å; L449-I497 HydrophobicContact CB-CG2 4.13Å; V450-I497 HydrophobicContact CG2-CB 4.38Å; V450-I497 HydrophobicContact CG2-CD1 4.07Å; V450-I497 HydrophobicContact CG2-CG2 3.89Å; C453-I497 HydrophobicContact CB-CD1 4.06Å; C493-I497 HydrophobicContact CB-CD1 4.29Å; C493-I497 VanDerWaalsContact O-CG1 3.31Å; C493-I497 WeakPolarHBondContact O-CG1 3.5Å; C493-I497 PolarHBondContact O-N 3.47Å; N494-I497 PolarHBondContact O-N 3.37Å; N494-I497 VanDerWaalsContact O-N 3.15Å; I497-C501 HydrophobicContact CG2-CB 4.31Å; I497-C501 WeakPolarHBondContact O-CA 3.43Å; I497-C501 WeakPolarHBondContact O-CB 3.38Å; I497-C501 PolarHBondContact O-N 3.37Å
498	Y	93.5	Very high	93.6	Very high	6 Å²	6	42.6 Å²	42.6	2%	0.024	22%	0.222	C	C	.	.	H	α-helix	trans	-68.2	-40.5	175.6	-57.4	-41.2	0	0	0	112.7	I81 T446 V450 N494 P495 F496 N502 Y505	I81-Y498 HydrophobicContact CD1-CE1 4.3Å; I81-Y498 HydrophobicContact CG2-CD2 4.36Å; I81-Y498 HydrophobicContact CG2-CE1 4.42Å; I81-Y498 HydrophobicContact CG2-CE2 3.66Å; T446-Y498 HydrophobicContact CG2-CD1 4.07Å; T446-Y498 HydrophobicContact CG2-CE1 4.39Å; V450-Y498 HydrophobicContact CG2-CE1 4.06Å; N494-Y498 HydrophobicContact CB-CE2 4.06Å; N494-Y498 WeakPolarHBondContact O-CD2 3.24Å; N494-Y498 PolarHBondContact O-N 2.94Å; P495-Y498 PolarHBondContact O-N 2.87Å; F496-Y498 VanDerWaalsContact C-N 3.26Å; F496-Y498 PolarHBondContact O-N 2.89Å; Y498-N502 WeakPolarHBondContact O-CB 3.37Å; Y498-N502 PolarHBondContact O-N 3.47Å; Y498-Y505 HydrophobicContact CG-CD1 4.4Å
499	A	92.9	Very high	93.3	Very high	30 Å²	30	42.8 Å²	42.8	25%	0.248	22%	0.223	C	C	.	.	H	α-helix	trans	-64.7	-39.1	179.3	0	0	0	0	0	112.8	P495 F496 A506 F509	P495-A499 WeakPolarHBondContact O-CB 3.21Å; P495-A499 PolarHBondContact O-N 3.4Å; F496-A499 PolarHBondContact O-N 2.88Å; F496-A499 VanDerWaalsContact O-N 3.13Å; A499-A506 WeakPolarHBondContact O-CB 3.31Å; A499-F509 HydrophobicContact CB-CD2 3.79Å; A499-F509 HydrophobicContact CB-CE2 3.94Å
500	F	93.2	Very high	93.1	Very high	162 Å²	162	46 Å²	46	71%	0.711	24%	0.235	S	C	*	.	H	α-helix	trans	-99.9	-32.4	-174.5	-66.2	-69.3	0	0	0	113.9	F496	F496-F500 HydrophobicContact CB-CD2 4.4Å; F496-F500 HydrophobicContact CD1-CD2 4.44Å; F496-F500 AromaticContact CD1-CE2 3.83Å; F496-F500 HydrophobicContact CD1-CE2 3.83Å; F496-F500 WeakPolarHBondContact O-CD2 3.33Å; F496-F500 PolarHBondContact O-N 3.41Å
501	C	91.9	Very high	92.8	Very high	58 Å²	58	55 Å²	55	39%	0.392	27%	0.269	S	S	.	.	H	α-helix	trans	-104.1	-10.4	-173.8	-52.3	0	0	0	0	113.9	T446 L449 I497	T446-C501 HydrophobicContact CG2-CB 4.24Å; T446-C501 PolarHBondContact OG1-O 2.71Å; L449-C501 HydrophobicContact CD1-CB 4.2Å; I497-C501 HydrophobicContact CG2-CB 4.31Å; I497-C501 WeakPolarHBondContact O-CA 3.43Å; I497-C501 WeakPolarHBondContact O-CB 3.38Å; I497-C501 PolarHBondContact O-N 3.37Å
502	N	90.6	Very high	92.4	Very high	21 Å²	21	57.7 Å²	57.7	11%	0.112	28%	0.282	C	S	.	.			trans	-120.4	101.5	177	-173.4	-25.7	0	0	0	111.6	T446 Y498 K504 Y505 A506	T446-N502 HydrophobicContact CG2-CB 4.16Å; Y498-N502 WeakPolarHBondContact O-CB 3.37Å; Y498-N502 PolarHBondContact O-N 3.47Å; N502-K504 PolarHBondContact O-N 2.83Å; N502-K504 PolarHBondContact OD1-N 3.01Å; N502-K504 VanDerWaalsContact OD1-N 3.12Å; N502-Y505 HydrophobicContact CB-CD2 4.3Å; N502-Y505 WeakPolarHBondContact ND2-CD2 3.48Å; N502-Y505 PolarHBondContact O-N 3.46Å; N502-Y505 PolarHBondContact OD1-N 3.43Å; N502-A506 WeakPolarHBondContact O-CB 3.5Å; N502-A506 PolarHBondContact O-N 2.97Å
503	T	89	Confident	92.1	Very high	97 Å²	97	60 Å²	60	60%	0.595	30%	0.295	S	S	*	.	H	α-helix	trans	-60.3	-24.1	-175.2	58	0	0	0	0	114.5	K507	T503-K507 VanDerWaalsContact O-CG 3.28Å; T503-K507 WeakPolarHBondContact O-CG 3.3Å; T503-K507 PolarHBondContact O-N 2.92Å
504	K	89.9	Confident	91.5	Very high	83 Å²	83	65.3 Å²	65.3	36%	0.361	32%	0.316	S	S	.	.	H	α-helix	trans	-75.8	-44.1	175.9	-62.3	179.1	-176.1	165.6	0	111.1	L73 R75 N502 A508	L73-K504 HydrophobicContact CD2-CB 3.87Å; R75-K504 VanDerWaalsContact NH1-NZ 3.14Å; N502-K504 PolarHBondContact O-N 2.83Å; N502-K504 PolarHBondContact OD1-N 3.01Å; N502-K504 VanDerWaalsContact OD1-N 3.12Å; K504-A508 WeakPolarHBondContact O-CB 3.3Å; K504-A508 PolarHBondContact O-N 3.34Å; K504-A508 VanDerWaalsContact O-N 3.08Å
505	Y	89.9	Confident	90.6	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-65.6	-45.5	174.6	-84.9	-105.5	0	0	0	110.8	V66 V67 L73 D78 I81 Y498 N502 K507 A508 F509	V66-Y505 HydrophobicContact CG1-CD1 4.47Å; V67-Y505 HydrophobicContact CG2-CE1 4.04Å; V67-Y505 VanDerWaalsContact CG2-OH 3.3Å; V67-Y505 WeakPolarHBondContact CG2-OH 3.44Å; L73-Y505 HydrophobicContact CD1-CD2 4.4Å; L73-Y505 HydrophobicContact CD1-CE2 4.48Å; L73-Y505 HydrophobicContact CD2-CD2 3.97Å; L73-Y505 HydrophobicContact CD2-CE2 3.8Å; D78-Y505 VanDerWaalsContact OD1-CE2 3.31Å; D78-Y505 WeakPolarHBondContact OD1-CE2 3.26Å; D78-Y505 PolarHBondContact OD1-OH 3.29Å; I81-Y505 HydrophobicContact CD1-CE2 4.3Å; I81-Y505 WeakPolarHBondContact CD1-OH 3.29Å; I81-Y505 HydrophobicContact CG2-CE1 4.31Å; Y498-Y505 HydrophobicContact CG-CD1 4.4Å; N502-Y505 HydrophobicContact CB-CD2 4.3Å; N502-Y505 WeakPolarHBondContact ND2-CD2 3.48Å; N502-Y505 PolarHBondContact O-N 3.46Å; N502-Y505 PolarHBondContact OD1-N 3.43Å; Y505-K507 VanDerWaalsContact C-N 3.32Å; Y505-K507 PolarHBondContact O-N 3.31Å; Y505-A508 CarbonylContact O-C 3.52Å; Y505-A508 PolarHBondContact O-N 3.09Å; Y505-F509 HydrophobicContact CD1-CE1 4.4Å; Y505-F509 HydrophobicContact CD1-CZ 4.09Å; Y505-F509 WeakPolarHBondContact O-CG 3.22Å; Y505-F509 PolarHBondContact O-N 3.25Å
506	A	91.6	Very high	89.2	Confident	23 Å²	23	72.7 Å²	72.7	19%	0.19	37%	0.37	C	S	.	.	H	α-helix	trans	-52.2	-48.3	175.8	0	0	0	0	0	112.7	A499 N502 A508 K510	A499-A506 WeakPolarHBondContact O-CB 3.31Å; N502-A506 WeakPolarHBondContact O-CB 3.5Å; N502-A506 PolarHBondContact O-N 2.97Å; A506-A508 VanDerWaalsContact C-N 3.34Å; A506-K510 WeakPolarHBondContact O-CG 3.42Å; A506-K510 PolarHBondContact O-N 3.41Å
507	K	91.9	Very high	87.5	Confident	136 Å²	136	72.5 Å²	72.5	59%	0.591	38%	0.379	S	S	*	.	H	α-helix	trans	-65.4	-37.8	177.1	-74.5	180	-178.4	-168.1	0	112.2	T503 Y505 R511	T503-K507 VanDerWaalsContact O-CG 3.28Å; T503-K507 WeakPolarHBondContact O-CG 3.3Å; T503-K507 PolarHBondContact O-N 2.92Å; Y505-K507 VanDerWaalsContact C-N 3.32Å; Y505-K507 PolarHBondContact O-N 3.31Å; K507-R511 VanDerWaalsContact O-CG 3.28Å; K507-R511 WeakPolarHBondContact O-CG 3.12Å; K507-R511 PolarHBondContact O-N 3.39Å
508	A	90.4	Very high	85.3	Confident	5 Å²	5	79.1 Å²	79.1	4%	0.041	42%	0.415	C	S	.	.	H	α-helix	trans	-72.8	-38.7	179.7	0	0	0	0	0	112.4	V66 T70 L73 K504 Y505 A506 R511 L512	V66-A508 HydrophobicContact CB-CB 4.46Å; V66-A508 HydrophobicContact CG1-CB 3.41Å; V66-A508 VanDerWaalsContact CG1-CB 3.41Å; V66-A508 HydrophobicContact CG2-CB 4.21Å; T70-A508 HydrophobicContact CG2-CB 4.44Å; L73-A508 HydrophobicContact CD1-CB 3.6Å; K504-A508 WeakPolarHBondContact O-CB 3.3Å; K504-A508 PolarHBondContact O-N 3.34Å; K504-A508 VanDerWaalsContact O-N 3.08Å; Y505-A508 CarbonylContact O-C 3.52Å; Y505-A508 PolarHBondContact O-N 3.09Å; A506-A508 VanDerWaalsContact C-N 3.34Å; A508-R511 PolarHBondContact O-N 2.98Å; A508-L512 WeakPolarHBondContact O-CB 3.5Å; A508-L512 PolarHBondContact O-N 3.32Å
509	F	91.4	Very high	82.6	Confident	13 Å²	13	89.4 Å²	89.4	6%	0.057	47%	0.471	C	S	.	.	H	α-helix	trans	-58.9	-48.3	170.5	-70.6	-23.8	0	0	0	111.2	L62 A63 V66 A499 Y505 R511 L512 L513	L62-F509 HydrophobicContact CB-CE1 4.39Å; L62-F509 HydrophobicContact CD1-CD1 4.27Å; L62-F509 HydrophobicContact CD2-CB 4.28Å; L62-F509 HydrophobicContact CD2-CD1 3.47Å; L62-F509 VanDerWaalsContact CD2-CD1 3.47Å; L62-F509 HydrophobicContact CD2-CD2 4.38Å; L62-F509 HydrophobicContact CD2-CE1 3.82Å; L62-F509 HydrophobicContact CD2-CG 3.82Å; L62-F509 HydrophobicContact CD2-CZ 4.38Å; L62-F509 HydrophobicContact CG-CD1 3.5Å; L62-F509 HydrophobicContact CG-CE1 3.63Å; L62-F509 HydrophobicContact CG-CG 4.36Å; A63-F509 HydrophobicContact CB-CZ 4.42Å; V66-F509 HydrophobicContact CB-CD1 4.15Å; V66-F509 HydrophobicContact CB-CE1 4.03Å; V66-F509 HydrophobicContact CG1-CE1 4.43Å; V66-F509 HydrophobicContact CG2-CD1 3.42Å; V66-F509 VanDerWaalsContact CG2-CD1 3.42Å; V66-F509 HydrophobicContact CG2-CE1 3.78Å; A499-F509 HydrophobicContact CB-CD2 3.79Å; A499-F509 HydrophobicContact CB-CE2 3.94Å; Y505-F509 HydrophobicContact CD1-CE1 4.4Å; Y505-F509 HydrophobicContact CD1-CZ 4.09Å; Y505-F509 WeakPolarHBondContact O-CG 3.22Å; Y505-F509 PolarHBondContact O-N 3.25Å; F509-R511 VanDerWaalsContact C-N 3.33Å; F509-R511 PolarHBondContact O-N 3.15Å; F509-L512 PolarHBondContact O-N 3.41Å; F509-L513 WeakPolarHBondContact O-CB 3.37Å; F509-L513 WeakPolarHBondContact O-CG 3.16Å; F509-L513 PolarHBondContact O-N 3.21Å
510	K	91	Very high	82.1	Confident	125 Å²	125	92.4 Å²	92.4	54%	0.543	48%	0.482	S	S	.	.	H	α-helix	trans	-57.6	-44.8	176.6	-74.1	-177.4	-179	-166.5	0	112.4	A506 H514 I515	A506-K510 WeakPolarHBondContact O-CG 3.42Å; A506-K510 PolarHBondContact O-N 3.41Å; K510-H514 CarbonylContact O-C 3.59Å; K510-H514 PolarHBondContact O-N 3.1Å; K510-H514 VanDerWaalsContact O-N 3.12Å; K510-I515 HydrophobicContact CB-CB 4.49Å; K510-I515 HydrophobicContact CG-CB 4.49Å; K510-I515 PolarHBondContact O-N 3.2Å
511	R	89.7	Confident	81.5	Confident	190 Å²	190	88.7 Å²	88.7	72%	0.717	47%	0.47	S	S	*	.	H	α-helix	trans	-63	-46.5	177.8	-74.8	173	-178.8	-166.1	-3.8	112.3	K507 A508 F509 H514	K507-R511 VanDerWaalsContact O-CG 3.28Å; K507-R511 WeakPolarHBondContact O-CG 3.12Å; K507-R511 PolarHBondContact O-N 3.39Å; A508-R511 PolarHBondContact O-N 2.98Å; F509-R511 VanDerWaalsContact C-N 3.33Å; F509-R511 PolarHBondContact O-N 3.15Å; R511-H514 PolarHBondContact O-N 2.93Å
512	L	88.7	Confident	81	Confident	61 Å²	61	90.4 Å²	90.4	32%	0.319	47%	0.474	S	S	.	.	H	α-helix	trans	-69.5	-36	-177.2	-172.5	60.7	0	0	0	112.2	L62 V66 A508 F509 H514	L62-L512 HydrophobicContact CD1-CD2 3.7Å; L62-L512 HydrophobicContact CD1-CG 4.32Å; V66-L512 HydrophobicContact CG2-CB 4.17Å; V66-L512 HydrophobicContact CG2-CD2 3.62Å; A508-L512 WeakPolarHBondContact O-CB 3.5Å; A508-L512 PolarHBondContact O-N 3.32Å; F509-L512 PolarHBondContact O-N 3.41Å; L512-H514 PolarHBondContact O-N 3.25Å; L512-H514 PolarHBondContact O-ND1 3.18Å
513	L	89.2	Confident	80.4	Confident	91 Å²	91	94.5 Å²	94.5	48%	0.476	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	4.1	175.3	-63	174.6	0	0	0	113.2	L62 F509 I515	L62-L513 HydrophobicContact CD1-CD2 4.05Å; L62-L513 HydrophobicContact CD1-CG 4.21Å; L62-L513 HydrophobicContact CD2-CD1 4.01Å; L62-L513 HydrophobicContact CD2-CG 4.44Å; F509-L513 WeakPolarHBondContact O-CB 3.37Å; F509-L513 WeakPolarHBondContact O-CG 3.16Å; F509-L513 PolarHBondContact O-N 3.21Å; L513-I515 HydrophobicContact CB-CD1 3.66Å; L513-I515 HydrophobicContact CB-CG1 3.75Å; L513-I515 HydrophobicContact CD1-CD1 3.79Å; L513-I515 HydrophobicContact CG-CD1 4.4Å; L513-I515 PolarHBondContact O-N 3.46Å
514	H	85.1	Confident	79.9	Confident	145 Å²	145	94.3 Å²	94.3	67%	0.671	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	23.8	-174.9	-58.4	87.3	0	0	0	114.4	K510 R511 L512 G516	K510-H514 CarbonylContact O-C 3.59Å; K510-H514 PolarHBondContact O-N 3.1Å; K510-H514 VanDerWaalsContact O-N 3.12Å; R511-H514 PolarHBondContact O-N 2.93Å; L512-H514 PolarHBondContact O-N 3.25Å; L512-H514 PolarHBondContact O-ND1 3.18Å; H514-G516 PolarHBondContact O-N 3.47Å
515	I	76.4	Confident	79.2	Confident	101 Å²	101	95.1 Å²	95.1	52%	0.518	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	110.9	179.5	-61.8	170.1	0	0	0	108.8	K510 L513	K510-I515 HydrophobicContact CB-CB 4.49Å; K510-I515 HydrophobicContact CG-CB 4.49Å; K510-I515 PolarHBondContact O-N 3.2Å; L513-I515 HydrophobicContact CB-CD1 3.66Å; L513-I515 HydrophobicContact CB-CG1 3.75Å; L513-I515 HydrophobicContact CD1-CD1 3.79Å; L513-I515 HydrophobicContact CG-CD1 4.4Å; L513-I515 PolarHBondContact O-N 3.46Å
516	G	65.2	Low	78.4	Confident	66 Å²	66	101.9 Å²	101.9	68%	0.68	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	21.6	176.1	0	0	0	0	0	115	H514 N518	H514-G516 PolarHBondContact O-N 3.47Å; G516-N518 PolarHBondContact O-N 3.33Å
517	S	59	Low	77.4	Confident	87 Å²	87	107.9 Å²	107.9	61%	0.608	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	9.8	175.4	-165	0	0	0	0	114.7
518	N	51	Low	76.2	Confident	161 Å²	161	105.6 Å²	105.6	86%	0.861	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	9.2	179.5	-84	4.8	0	0	0	115	G516	G516-N518 PolarHBondContact O-N 3.33Å
519	N	37.7	Very low	74.9	Confident	222 Å²	222	114.7 Å²	114.7	100%	1.187	60%	0.604	S	S	*	*			trans	-131.8	0	171.8	-67.9	-9.2	0	0	0	109.8

Retrieved 519 of 519 residues in 216.4 ms (Link to these results)

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