A0A061IN91_CRIGR Loading...

Islet cell autoantigen 1

AlphaFold DB , UniProt , Accession A0A061IN91, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Ica1, Length 481 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.6	Very low	33.4	Very low	240 Å²	240	153.7 Å²	153.7	100%	1.182	79%	0.791	S	S	*	*				0	171.9	0	-65.7	177.2	74.3	0	0	108.7
2	S	33.8	Very low	33.7	Very low	98 Å²	98	151.5 Å²	151.5	69%	0.685	77%	0.774	S	S	*	*			trans	-2.7	126.6	-179	-58.2	0	0	0	0	118.8
3	G	30.8	Very low	33.7	Very low	75 Å²	75	150.2 Å²	150.2	77%	0.773	77%	0.77	S	S	*	*			cis	90.4	30.1	7.1	0	0	0	0	0	115.1	K5	G3-K5 PolarHBondContact O-N 3.37Å
4	H	33.3	Very low	33.4	Very low	178 Å²	178	153.8 Å²	153.8	82%	0.824	77%	0.769	S	S	*	*			trans	-73.7	122.2	173.5	-81.7	-97.6	0	0	0	111.6
5	K	33.9	Very low	33.8	Very low	193 Å²	193	154 Å²	154	84%	0.839	76%	0.764	S	S	*	*			trans	-81.1	118.9	-178.2	-63.9	176.9	-180	177.8	0	110.9	G3	G3-K5 PolarHBondContact O-N 3.37Å
6	C	33.9	Very low	34.3	Very low	123 Å²	123	148.4 Å²	148.4	83%	0.831	75%	0.749	S	S	*	*			trans	-88.9	99.5	163.9	-174.7	0	0	0	0	109.2
7	Y	35.6	Very low	34.6	Very low	201 Å²	201	150.2 Å²	150.2	79%	0.788	75%	0.754	S	S	*	*			trans	-154.6	164.2	172.7	-85	-68.6	0	0	0	110.8
8	S	35	Very low	34.9	Very low	82 Å²	82	150.1 Å²	150.1	57%	0.573	76%	0.756	S	S	*	*	S	Bend	trans	86	44.1	170.8	-159.4	0	0	0	0	118.6
9	W	32.5	Very low	36	Very low	222 Å²	222	146.5 Å²	146.5	84%	0.841	74%	0.736	S	S	*	*	S	Bend	trans	-121.4	-46.4	149.9	-69	119.6	0	0	0	112.2	L11 Q12	W9-L11 PolarHBondContact O-N 3.47Å; W9-L11 VanDerWaalsContact O-N 3.11Å; W9-Q12 WeakPolarHBondContact O-CB 3.38Å; W9-Q12 PolarHBondContact O-N 3.41Å
10	E	32.4	Very low	37.8	Very low	175 Å²	175	142.3 Å²	142.3	82%	0.818	72%	0.72	S	S	*	*	H	α-helix	trans	-62.2	-19.8	179.9	-59.3	177.7	153.6	0	0	114.6
11	L	33.8	Very low	39.8	Very low	104 Å²	104	141 Å²	141	55%	0.545	72%	0.72	S	S	.	*	H	α-helix	trans	-76.7	-23.2	173.8	-109.9	123.1	0	0	0	113	W9 D13 F15	W9-L11 PolarHBondContact O-N 3.47Å; W9-L11 VanDerWaalsContact O-N 3.11Å; L11-D13 VanDerWaalsContact C-N 3.34Å; L11-F15 WeakPolarHBondContact O-CD2 3.41Å
12	Q	37.3	Very low	42	Very low	127 Å²	127	133.8 Å²	133.8	59%	0.593	69%	0.688	S	S	*	*	H	α-helix	trans	-71	-33.6	179.1	-166	62.4	57.8	0	0	111.5	W9 R14 F15	W9-Q12 WeakPolarHBondContact O-CB 3.38Å; W9-Q12 PolarHBondContact O-N 3.41Å; Q12-R14 VanDerWaalsContact C-N 3.3Å; Q12-R14 PolarHBondContact O-N 3.45Å; Q12-F15 PolarHBondContact O-N 3.3Å; Q12-F15 VanDerWaalsContact O-N 3.17Å
13	D	33.5	Very low	44.2	Very low	134 Å²	134	130.6 Å²	130.6	72%	0.717	66%	0.664	S	S	*	*	H	α-helix	trans	-68.7	-27.7	-179.5	-125.4	15.9	0	0	0	112.3	L11 F15 A16	L11-D13 VanDerWaalsContact C-N 3.34Å; D13-F15 PolarHBondContact O-N 3.29Å; D13-A16 VanDerWaalsContact O-CB 3.24Å; D13-A16 WeakPolarHBondContact O-CB 3.2Å; D13-A16 PolarHBondContact O-N 2.9Å
14	R	29.5	Very low	46.7	Very low	201 Å²	201	132 Å²	132	76%	0.758	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-65.9	-21.5	173.4	-65.1	-167.5	-175.3	-165.5	2.2	113.4	Q12 A16	Q12-R14 VanDerWaalsContact C-N 3.3Å; Q12-R14 PolarHBondContact O-N 3.45Å; R14-A16 VanDerWaalsContact C-N 3.3Å
15	F	39.5	Very low	49.3	Very low	157 Å²	157	127.2 Å²	127.2	69%	0.689	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-81.7	-4.9	173.9	-70.5	-77.7	0	0	0	113.6	L11 Q12 D13 Q17	L11-F15 WeakPolarHBondContact O-CD2 3.41Å; Q12-F15 PolarHBondContact O-N 3.3Å; Q12-F15 VanDerWaalsContact O-N 3.17Å; D13-F15 PolarHBondContact O-N 3.29Å; F15-Q17 PolarHBondContact O-N 3.24Å
16	A	42.2	Very low	51.9	Low	64 Å²	64	120.1 Å²	120.1	53%	0.529	60%	0.597	S	S	.	*	G	3₁₀ helix	trans	-72.4	-11.1	175.4	0	0	0	0	0	113.8	D13 R14	D13-A16 VanDerWaalsContact O-CB 3.24Å; D13-A16 WeakPolarHBondContact O-CB 3.2Å; D13-A16 PolarHBondContact O-N 2.9Å; R14-A16 VanDerWaalsContact C-N 3.3Å
17	Q	38.2	Very low	54.4	Low	179 Å²	179	116.5 Å²	116.5	84%	0.836	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-101.1	-8.5	-161.8	-152.8	160.7	11.3	0	0	115.6	F15	F15-Q17 PolarHBondContact O-N 3.24Å
18	D	40.4	Very low	56.9	Low	148 Å²	148	112.1 Å²	112.1	79%	0.791	55%	0.553	S	S	*	*			trans	-104.9	67.1	172.5	-162.9	-0.5	0	0	0	112.4	S20	D18-S20 VanDerWaalsContact C-N 3.32Å; D18-S20 PolarHBondContact O-N 3.24Å
19	K	55.8	Low	59.6	Low	83 Å²	83	108.9 Å²	108.9	36%	0.361	53%	0.529	S	S	.	.			trans	-76.9	83.9	170.1	-69.3	-166.6	177.9	-162.5	0	110	K24	K19-K24 HydrophobicContact CB-CD 4.44Å; K19-K24 HydrophobicContact CB-CG 4.22Å; K19-K24 WeakPolarHBondContact O-CE 3.43Å; K19-K24 PolarHBondContact O-NZ 3.24Å
20	S	72.4	Confident	62.5	Low	62 Å²	62	99.2 Å²	99.2	43%	0.434	49%	0.492	S	S	.	.			trans	-42.1	139.6	170.5	171.2	0	0	0	0	112.1	D18 V22 N23 K24	D18-S20 VanDerWaalsContact C-N 3.32Å; D18-S20 PolarHBondContact O-N 3.24Å; S20-V22 PolarHBondContact O-N 3.07Å; S20-N23 WeakPolarHBondContact O-CB 3.34Å; S20-N23 PolarHBondContact O-N 3.02Å; S20-K24 PolarHBondContact O-N 3.03Å; S20-K24 VanDerWaalsContact O-N 3.14Å
21	V	79.4	Confident	65.2	Low	116 Å²	116	91.8 Å²	91.8	70%	0.703	46%	0.457	S	S	*	.	H	α-helix	trans	-55.9	-40.1	-177.5	-178.1	0	0	0	0	111.3	N23 K24 M25	V21-N23 VanDerWaalsContact C-N 3.33Å; V21-N23 PolarHBondContact O-N 3.21Å; V21-K24 PolarHBondContact O-N 3.07Å; V21-M25 WeakPolarHBondContact O-CB 3.35Å; V21-M25 PolarHBondContact O-N 3.13Å
22	V	79.1	Confident	68	Low	87 Å²	87	89.8 Å²	89.8	53%	0.527	45%	0.449	S	S	.	.	H	α-helix	trans	-60.9	-40.6	177.1	-177	0	0	0	0	111.5	S20 M25 Q26	S20-V22 PolarHBondContact O-N 3.07Å; V22-M25 PolarHBondContact O-N 3.27Å; V22-Q26 WeakPolarHBondContact O-CB 3.48Å; V22-Q26 VanDerWaalsContact O-CG 3.31Å; V22-Q26 WeakPolarHBondContact O-CG 3.45Å; V22-Q26 PolarHBondContact O-N 3.32Å
23	N	80.6	Confident	70.5	Confident	32 Å²	32	85.8 Å²	85.8	17%	0.171	43%	0.43	C	S	.	.	H	α-helix	trans	-68.7	-39.9	178.9	-167.1	-83.3	0	0	0	111.5	S20 V21 Q26 Q27	S20-N23 WeakPolarHBondContact O-CB 3.34Å; S20-N23 PolarHBondContact O-N 3.02Å; V21-N23 VanDerWaalsContact C-N 3.33Å; V21-N23 PolarHBondContact O-N 3.21Å; N23-Q26 PolarHBondContact O-N 3.43Å; N23-Q27 WeakPolarHBondContact O-CB 3.36Å; N23-Q27 PolarHBondContact O-N 3.35Å
24	K	83.5	Confident	73.2	Confident	105 Å²	105	79.8 Å²	79.8	46%	0.457	40%	0.398	S	S	.	.	H	α-helix	trans	-63	-41.2	172.6	-68.2	171.1	175.2	146.8	0	112	K19 S20 V21 Q27 K28	K19-K24 HydrophobicContact CB-CD 4.44Å; K19-K24 HydrophobicContact CB-CG 4.22Å; K19-K24 WeakPolarHBondContact O-CE 3.43Å; K19-K24 PolarHBondContact O-NZ 3.24Å; S20-K24 PolarHBondContact O-N 3.03Å; S20-K24 VanDerWaalsContact O-N 3.14Å; V21-K24 PolarHBondContact O-N 3.07Å; K24-Q27 PolarHBondContact O-N 3.38Å; K24-K28 WeakPolarHBondContact O-CG 3.48Å; K24-K28 PolarHBondContact O-N 3.38Å
25	M	87.8	Confident	76.1	Confident	77 Å²	77	72.4 Å²	72.4	38%	0.379	38%	0.38	S	S	.	.	H	α-helix	trans	-65.1	-45.5	177.5	-177.2	175.1	175.5	0	0	111.3	V21 V22 K28 Y29 L456 F457	V21-M25 WeakPolarHBondContact O-CB 3.35Å; V21-M25 PolarHBondContact O-N 3.13Å; V22-M25 PolarHBondContact O-N 3.27Å; M25-K28 PolarHBondContact O-N 2.99Å; M25-Y29 WeakPolarHBondContact O-CB 3.28Å; M25-Y29 PolarHBondContact O-N 3.41Å; M25-L456 HydrophobicContact CE-CD2 3.87Å; M25-F457 HydrophobicContact CE-CD1 4.09Å; M25-F457 HydrophobicContact CE-CE1 3.73Å; M25-F457 HydrophobicContact CG-CE1 4.37Å
26	Q	86.6	Confident	78.5	Confident	44 Å²	44	70.1 Å²	70.1	21%	0.206	37%	0.37	C	S	.	.	H	α-helix	trans	-60.5	-45.3	173.6	-73.2	170	-20.1	0	0	111.5	V22 N23 K28 Y29 W30 W171 L460	V22-Q26 WeakPolarHBondContact O-CB 3.48Å; V22-Q26 VanDerWaalsContact O-CG 3.31Å; V22-Q26 WeakPolarHBondContact O-CG 3.45Å; V22-Q26 PolarHBondContact O-N 3.32Å; N23-Q26 PolarHBondContact O-N 3.43Å; Q26-K28 PolarHBondContact O-N 2.95Å; Q26-Y29 WeakPolarHBondContact O-CB 3.44Å; Q26-Y29 PolarHBondContact O-N 2.95Å; Q26-W30 PolarHBondContact O-N 3.07Å; Q26-W171 HydrophobicContact CB-CH2 3.71Å; Q26-W171 HydrophobicContact CB-CZ2 3.59Å; Q26-W171 HydrophobicContact CB-CZ3 4.49Å; Q26-W171 HydrophobicContact CG-CZ2 4.34Å; Q26-L460 HydrophobicContact CG-CD1 4.49Å; Q26-L460 HydrophobicContact CG-CD2 4.17Å
27	Q	86.7	Confident	80.7	Confident	47 Å²	47	68.6 Å²	68.6	22%	0.22	35%	0.352	C	S	.	.	H	α-helix	trans	-55.7	-49.2	175	-165.1	-163	-43.4	0	0	111.3	N23 K24 Y29 W30 E31 W171	N23-Q27 WeakPolarHBondContact O-CB 3.36Å; N23-Q27 PolarHBondContact O-N 3.35Å; K24-Q27 PolarHBondContact O-N 3.38Å; Q27-Y29 PolarHBondContact O-N 3.16Å; Q27-W30 PolarHBondContact O-N 3.31Å; Q27-E31 WeakPolarHBondContact CG-OE1 3.37Å; Q27-E31 PolarHBondContact NE2-OE1 3.11Å; Q27-E31 VanDerWaalsContact O-CG 3.3Å; Q27-E31 WeakPolarHBondContact O-CG 3.38Å; Q27-E31 PolarHBondContact O-N 3.25Å; Q27-W171 HydrophobicContact CB-CZ3 4.34Å
28	K	89	Confident	83	Confident	108 Å²	108	64.5 Å²	64.5	47%	0.47	33%	0.332	S	S	.	.	H	α-helix	trans	-68.3	-31.9	179.5	-73.4	-74.8	155.9	-160.3	0	113.7	K24 M25 Q26 E31 T32	K24-K28 WeakPolarHBondContact O-CG 3.48Å; K24-K28 PolarHBondContact O-N 3.38Å; M25-K28 PolarHBondContact O-N 2.99Å; Q26-K28 PolarHBondContact O-N 2.95Å; K28-E31 VanDerWaalsContact CD-OE2 3.27Å; K28-E31 WeakPolarHBondContact CD-OE2 3.49Å; K28-E31 WeakPolarHBondContact CE-OE2 3.49Å; K28-E31 IonicContact NZ-OE1 3.05Å; K28-E31 IonicContact NZ-OE2 2.86Å; K28-E31 PolarHBondContact NZ-OE2 2.88Å; K28-T32 VanDerWaalsContact O-CB 3.3Å; K28-T32 WeakPolarHBondContact O-CB 3.32Å; K28-T32 PolarHBondContact O-N 3.49Å; K28-T32 PolarHBondContact O-OG1 3.24Å
29	Y	92.1	Very high	85.1	Confident	14 Å²	14	61.6 Å²	61.6	6%	0.055	33%	0.329	C	S	.	.	H	α-helix	trans	-61.4	-51.4	170.6	168.5	-97.4	0	0	0	111	M25 Q26 Q27 E31 T32 K33 F457 D461	M25-Y29 WeakPolarHBondContact O-CB 3.28Å; M25-Y29 PolarHBondContact O-N 3.41Å; Q26-Y29 WeakPolarHBondContact O-CB 3.44Å; Q26-Y29 PolarHBondContact O-N 2.95Å; Q27-Y29 PolarHBondContact O-N 3.16Å; Y29-E31 PolarHBondContact O-N 3.09Å; Y29-T32 CarbonylContact O-C 3.59Å; Y29-T32 PolarHBondContact O-N 3.06Å; Y29-T32 VanDerWaalsContact O-N 3.11Å; Y29-K33 HydrophobicContact CE1-CD 3.76Å; Y29-K33 WeakPolarHBondContact O-CB 3.48Å; Y29-K33 PolarHBondContact O-N 2.78Å; Y29-K33 WeakPolarHBondContact OH-CE 3.33Å; Y29-K33 PolarHBondContact OH-NZ 2.63Å; Y29-F457 HydrophobicContact CD2-CB 4.04Å; Y29-F457 AromaticContact CD2-CD1 3.38Å; Y29-F457 HydrophobicContact CD2-CD1 3.38Å; Y29-F457 HydrophobicContact CD2-CD2 4.12Å; Y29-F457 AromaticContact CD2-CE1 3.78Å; Y29-F457 HydrophobicContact CD2-CE1 3.78Å; Y29-F457 HydrophobicContact CD2-CE2 4.46Å; Y29-F457 AromaticContact CD2-CG 3.58Å; Y29-F457 HydrophobicContact CD2-CG 3.58Å; Y29-F457 HydrophobicContact CD2-CZ 4.31Å; Y29-F457 HydrophobicContact CE2-CB 3.84Å; Y29-F457 HydrophobicContact CE2-CD1 4.07Å; Y29-F457 AromaticContact CE2-CG 3.9Å; Y29-F457 HydrophobicContact CE2-CG 3.9Å; Y29-F457 HydrophobicContact CG-CD1 4.1Å; Y29-F457 HydrophobicContact CG-CE1 4.25Å; Y29-D461 WeakPolarHBondContact OH-CB 3.24Å; Y29-D461 PolarHBondContact OH-OD2 3.02Å
30	W	91.9	Very high	86.5	Confident	20 Å²	20	60.8 Å²	60.8	8%	0.076	33%	0.33	C	S	.	.	H	α-helix	trans	-68.4	-35.8	-178.2	-73.4	107.9	0	0	0	113.6	Q26 Q27 T32 K33 Q34 L170 W171 D174	Q26-W30 PolarHBondContact O-N 3.07Å; Q27-W30 PolarHBondContact O-N 3.31Å; W30-T32 VanDerWaalsContact C-N 3.32Å; W30-T32 PolarHBondContact O-N 2.6Å; W30-K33 HydrophobicContact CE3-CD 3.82Å; W30-K33 HydrophobicContact CH2-CD 4.25Å; W30-K33 HydrophobicContact CZ3-CD 3.64Å; W30-K33 PolarHBondContact O-N 3.16Å; W30-Q34 WeakPolarHBondContact O-CB 3.49Å; W30-Q34 PolarHBondContact O-N 3.18Å; W30-L170 HydrophobicContact CE3-CB 3.82Å; W30-L170 HydrophobicContact CZ3-CB 3.98Å; W30-W171 HydrophobicContact CB-CB 4.2Å; W30-W171 AromaticContact CD1-CD1 3.57Å; W30-W171 AromaticContact CD1-CD2 3.51Å; W30-W171 AromaticContact CD1-CE2 3.93Å; W30-W171 AromaticContact CD1-CG 3.29Å; W30-W171 AromaticContact CD1-NE1 3.93Å; W30-W171 HydrophobicContact CD2-CB 3.75Å; W30-W171 HydrophobicContact CD2-CG 4.13Å; W30-W171 AromaticContact CE2-CD1 3.61Å; W30-W171 AromaticContact CE2-CG 3.88Å; W30-W171 HydrophobicContact CE3-CB 4.38Å; W30-W171 HydrophobicContact CG-CB 3.61Å; W30-W171 HydrophobicContact CG-CD2 4.31Å; W30-W171 AromaticContact CG-CG 3.84Å; W30-W171 HydrophobicContact CG-CG 3.84Å; W30-W171 AromaticContact NE1-CD1 3.1Å; W30-W171 AromaticContact NE1-CD2 3.86Å; W30-W171 AromaticContact NE1-CE2 3.95Å; W30-W171 AromaticContact NE1-CG 3.35Å; W30-W171 AromaticContact NE1-NE1 3.49Å; W30-D174 HydrophobicContact CH2-CB 3.54Å; W30-D174 WeakPolarHBondContact CH2-OD1 3.42Å; W30-D174 HydrophobicContact CZ2-CB 3.86Å; W30-D174 WeakPolarHBondContact CZ2-OD2 3.43Å; W30-D174 HydrophobicContact CZ3-CB 4.34Å
31	E	90.8	Very high	86.9	Confident	18 Å²	18	61.1 Å²	61.1	8%	0.084	34%	0.344	C	S	.	.	H	α-helix	trans	-57.7	-44.1	167.9	-74.6	168.5	-158.7	0	0	112	Q27 K28 Y29 Q34 A35 E164	Q27-E31 WeakPolarHBondContact CG-OE1 3.37Å; Q27-E31 PolarHBondContact NE2-OE1 3.11Å; Q27-E31 VanDerWaalsContact O-CG 3.3Å; Q27-E31 WeakPolarHBondContact O-CG 3.38Å; Q27-E31 PolarHBondContact O-N 3.25Å; K28-E31 VanDerWaalsContact CD-OE2 3.27Å; K28-E31 WeakPolarHBondContact CD-OE2 3.49Å; K28-E31 WeakPolarHBondContact CE-OE2 3.49Å; K28-E31 IonicContact NZ-OE1 3.05Å; K28-E31 IonicContact NZ-OE2 2.86Å; K28-E31 PolarHBondContact NZ-OE2 2.88Å; Y29-E31 PolarHBondContact O-N 3.09Å; E31-Q34 PolarHBondContact O-N 3.27Å; E31-A35 WeakPolarHBondContact O-CB 3.48Å; E31-A35 PolarHBondContact O-N 2.84Å; E31-E164 HydrophobicContact CG-CB 4.46Å; E31-E164 HydrophobicContact CG-CG 4.08Å
32	T	91.2	Very high	87.2	Confident	62 Å²	62	61.5 Å²	61.5	38%	0.38	34%	0.336	S	S	.	.	H	α-helix	trans	-72.4	-39.2	-179	-56.5	0	0	0	0	111.5	K28 Y29 W30 Q34 A35 F36 W453	K28-T32 VanDerWaalsContact O-CB 3.3Å; K28-T32 WeakPolarHBondContact O-CB 3.32Å; K28-T32 PolarHBondContact O-N 3.49Å; K28-T32 PolarHBondContact O-OG1 3.24Å; Y29-T32 CarbonylContact O-C 3.59Å; Y29-T32 PolarHBondContact O-N 3.06Å; Y29-T32 VanDerWaalsContact O-N 3.11Å; W30-T32 VanDerWaalsContact C-N 3.32Å; W30-T32 PolarHBondContact O-N 2.6Å; T32-Q34 VanDerWaalsContact C-N 3.34Å; T32-Q34 PolarHBondContact O-N 2.97Å; T32-A35 PolarHBondContact O-N 3.49Å; T32-F36 WeakPolarHBondContact O-CB 3.12Å; T32-F36 PolarHBondContact O-N 3.16Å; T32-W453 HydrophobicContact CG2-CZ2 3.98Å
33	K	90.5	Very high	87.3	Confident	44 Å²	44	67.4 Å²	67.4	19%	0.191	36%	0.355	C	S	.	.	H	α-helix	trans	-61	-42.3	173.7	-161.1	172.5	-170.6	171.8	0	110.6	Y29 W30 F36 I37 D461	Y29-K33 HydrophobicContact CE1-CD 3.76Å; Y29-K33 WeakPolarHBondContact O-CB 3.48Å; Y29-K33 PolarHBondContact O-N 2.78Å; Y29-K33 WeakPolarHBondContact OH-CE 3.33Å; Y29-K33 PolarHBondContact OH-NZ 2.63Å; W30-K33 HydrophobicContact CE3-CD 3.82Å; W30-K33 HydrophobicContact CH2-CD 4.25Å; W30-K33 HydrophobicContact CZ3-CD 3.64Å; W30-K33 PolarHBondContact O-N 3.16Å; K33-F36 PolarHBondContact O-N 3.03Å; K33-I37 HydrophobicContact CG-CD1 4.49Å; K33-I37 WeakPolarHBondContact O-CB 3.37Å; K33-I37 WeakPolarHBondContact O-CD1 3.44Å; K33-I37 VanDerWaalsContact O-CG1 3.26Å; K33-I37 WeakPolarHBondContact O-CG1 3.4Å; K33-I37 PolarHBondContact O-N 2.93Å; K33-D461 IonicContact NZ-OD2 3.85Å; K33-D461 PolarHBondContact NZ-OD2 3.46Å
34	Q	90.9	Very high	87.5	Confident	8 Å²	8	69 Å²	69	4%	0.037	36%	0.361	C	S	.	.	H	α-helix	trans	-65.6	-44.6	173.1	174.4	56.9	49.8	0	0	112.7	W30 E31 T32 F36 I37 K38 E44 T163 R166 L170	W30-Q34 WeakPolarHBondContact O-CB 3.49Å; W30-Q34 PolarHBondContact O-N 3.18Å; E31-Q34 PolarHBondContact O-N 3.27Å; T32-Q34 VanDerWaalsContact C-N 3.34Å; T32-Q34 PolarHBondContact O-N 2.97Å; Q34-F36 VanDerWaalsContact C-N 3.3Å; Q34-F36 PolarHBondContact O-N 2.87Å; Q34-I37 PolarHBondContact O-N 2.82Å; Q34-K38 PolarHBondContact O-N 3.14Å; Q34-E44 PolarHBondContact NE2-OE1 3.07Å; Q34-T163 HydrophobicContact CG-CG2 4.05Å; Q34-R166 HydrophobicContact CG-CB 3.74Å; Q34-L170 HydrophobicContact CB-CD1 4.19Å; Q34-L170 VanDerWaalsContact OE1-CD1 3.31Å
35	A	89	Confident	87.5	Confident	46 Å²	46	66.7 Å²	66.7	38%	0.38	35%	0.354	S	S	.	.	H	α-helix	trans	-61	-40.7	175.9	0	0	0	0	0	111.7	E31 T32 K38 A39 T163	E31-A35 WeakPolarHBondContact O-CB 3.48Å; E31-A35 PolarHBondContact O-N 2.84Å; T32-A35 PolarHBondContact O-N 3.49Å; A35-K38 PolarHBondContact O-N 2.83Å; A35-A39 WeakPolarHBondContact O-CB 3.44Å; A35-A39 PolarHBondContact O-N 2.62Å; A35-T163 HydrophobicContact CB-CG2 4.19Å
36	F	91	Very high	87.5	Confident	108 Å²	108	70.8 Å²	70.8	47%	0.474	37%	0.372	S	S	.	.	H	α-helix	trans	-66.8	-38.9	175.2	-176.4	-98	0	0	0	112.7	T32 K33 Q34 A39 T40	T32-F36 WeakPolarHBondContact O-CB 3.12Å; T32-F36 PolarHBondContact O-N 3.16Å; K33-F36 PolarHBondContact O-N 3.03Å; Q34-F36 VanDerWaalsContact C-N 3.3Å; Q34-F36 PolarHBondContact O-N 2.87Å; F36-A39 PolarHBondContact O-N 2.71Å; F36-T40 HydrophobicContact CD1-CG2 4.17Å; F36-T40 HydrophobicContact CD2-CG2 4.15Å; F36-T40 HydrophobicContact CE1-CG2 3.79Å; F36-T40 HydrophobicContact CE2-CG2 3.78Å; F36-T40 HydrophobicContact CG-CG2 4.35Å; F36-T40 HydrophobicContact CZ-CG2 3.59Å; F36-T40 WeakPolarHBondContact O-CB 3.48Å; F36-T40 WeakPolarHBondContact O-CG2 3.31Å; F36-T40 PolarHBondContact O-N 3.25Å; F36-T40 PolarHBondContact O-OG1 3.42Å
37	I	87.3	Confident	87.5	Confident	32 Å²	32	76 Å²	76	16%	0.164	40%	0.396	C	S	.	.	H	α-helix	trans	-60.1	-49.4	173.1	-76.4	162.5	0	0	0	110.6	K33 Q34 A39 T40 G41 K42 E44 L170	K33-I37 HydrophobicContact CG-CD1 4.49Å; K33-I37 WeakPolarHBondContact O-CB 3.37Å; K33-I37 WeakPolarHBondContact O-CD1 3.44Å; K33-I37 VanDerWaalsContact O-CG1 3.26Å; K33-I37 WeakPolarHBondContact O-CG1 3.4Å; K33-I37 PolarHBondContact O-N 2.93Å; Q34-I37 PolarHBondContact O-N 2.82Å; I37-A39 VanDerWaalsContact C-N 3.33Å; I37-A39 PolarHBondContact O-N 3.25Å; I37-T40 PolarHBondContact O-N 3.03Å; I37-T40 PolarHBondContact O-OG1 3.37Å; I37-G41 PolarHBondContact O-N 3.04Å; I37-G41 VanDerWaalsContact O-N 3.17Å; I37-K42 HydrophobicContact CG2-CB 4.24Å; I37-K42 PolarHBondContact O-N 3.43Å; I37-E44 HydrophobicContact CG2-CG 3.8Å; I37-L170 HydrophobicContact CD1-CD1 3.65Å
38	K	86.1	Confident	87.6	Confident	93 Å²	93	75.4 Å²	75.4	40%	0.404	40%	0.395	S	S	.	.	H	α-helix	trans	-59.2	-41.3	175.6	-173.6	174	-179.5	175.3	0	111.9	Q34 A35 E159	Q34-K38 PolarHBondContact O-N 3.14Å; A35-K38 PolarHBondContact O-N 2.83Å; K38-E159 IonicContact NZ-OE1 3.27Å; K38-E159 IonicContact NZ-OE2 2.81Å; K38-E159 PolarHBondContact NZ-OE2 3.17Å
39	A	86.3	Confident	87.6	Confident	88 Å²	88	73.3 Å²	73.3	73%	0.727	39%	0.391	S	S	*	.	H	α-helix	trans	-74.2	-29.1	179.6	0	0	0	0	0	114.4	A35 F36 I37	A35-A39 WeakPolarHBondContact O-CB 3.44Å; A35-A39 PolarHBondContact O-N 2.62Å; F36-A39 PolarHBondContact O-N 2.71Å; I37-A39 VanDerWaalsContact C-N 3.33Å; I37-A39 PolarHBondContact O-N 3.25Å
40	T	84.8	Confident	87.5	Confident	65 Å²	65	75.9 Å²	75.9	40%	0.399	42%	0.416	S	S	.	.	H	α-helix	trans	-94.1	0.7	-179.5	53.4	0	0	0	0	114.2	F36 I37 K42	F36-T40 HydrophobicContact CD1-CG2 4.17Å; F36-T40 HydrophobicContact CD2-CG2 4.15Å; F36-T40 HydrophobicContact CE1-CG2 3.79Å; F36-T40 HydrophobicContact CE2-CG2 3.78Å; F36-T40 HydrophobicContact CG-CG2 4.35Å; F36-T40 HydrophobicContact CZ-CG2 3.59Å; F36-T40 WeakPolarHBondContact O-CB 3.48Å; F36-T40 WeakPolarHBondContact O-CG2 3.31Å; F36-T40 PolarHBondContact O-N 3.25Å; F36-T40 PolarHBondContact O-OG1 3.42Å; I37-T40 PolarHBondContact O-N 3.03Å; I37-T40 PolarHBondContact O-OG1 3.37Å; T40-K42 PolarHBondContact O-N 3.41Å
41	G	80.8	Confident	87.4	Confident	69 Å²	69	78.5 Å²	78.5	71%	0.711	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.3	21.2	178.9	0	0	0	0	0	114	I37	I37-G41 PolarHBondContact O-N 3.04Å; I37-G41 VanDerWaalsContact O-N 3.17Å
42	K	85.6	Confident	87.6	Confident	124 Å²	124	77.8 Å²	77.8	54%	0.539	43%	0.434	S	S	.	.			trans	-66.4	145.5	174.9	-72.5	-179	-179.4	-172.3	0	109.5	I37 T40 E44	I37-K42 HydrophobicContact CG2-CB 4.24Å; I37-K42 PolarHBondContact O-N 3.43Å; T40-K42 PolarHBondContact O-N 3.41Å; K42-E44 PolarHBondContact O-N 3.13Å; K42-E44 VanDerWaalsContact O-N 3.15Å
43	K	81.7	Confident	87.7	Confident	212 Å²	212	77.5 Å²	77.5	92%	0.922	44%	0.437	S	S	*	.			trans	-58	119.6	178.9	-72.4	-168.1	174.6	-169.7	0	110.8
44	E	83.1	Confident	87.8	Confident	64 Å²	64	81.7 Å²	81.7	30%	0.299	46%	0.462	S	S	.	.			trans	-84.9	177.7	170.8	-63.7	-171.7	118.8	0	0	111.2	Q34 I37 K42 E46 V49 R166	Q34-E44 PolarHBondContact NE2-OE1 3.07Å; I37-E44 HydrophobicContact CG2-CG 3.8Å; K42-E44 PolarHBondContact O-N 3.13Å; K42-E44 VanDerWaalsContact O-N 3.15Å; E44-E46 PolarHBondContact O-N 2.9Å; E44-V49 HydrophobicContact CB-CG2 3.84Å; E44-R166 IonicContact OE1-NH1 3.13Å; E44-R166 PolarHBondContact OE1-NH1 3.16Å; E44-R166 IonicContact OE2-CZ 2.62Å; E44-R166 IonicContact OE2-NH1 3.69Å; E44-R166 PolarHBondContact OE2-NH1 3.42Å
45	D	85.1	Confident	88	Confident	58 Å²	58	81.3 Å²	81.3	31%	0.31	46%	0.46	S	S	.	.			trans	-74.2	118.9	176.3	-162.6	-68.8	0	0	0	110.7	H47 V48 V49 K173	D45-H47 VanDerWaalsContact C-N 3.28Å; D45-H47 PolarHBondContact O-N 2.88Å; D45-H47 PolarHBondContact OD1-N 3.3Å; D45-V48 HydrophobicContact CB-CB 4.15Å; D45-V48 HydrophobicContact CB-CG2 3.86Å; D45-V48 WeakPolarHBondContact O-CB 3.4Å; D45-V48 PolarHBondContact O-N 3.29Å; D45-V49 PolarHBondContact O-N 3.03Å; D45-K173 IonicContact OD2-NZ 3.8Å; D45-K173 PolarHBondContact OD2-NZ 3.46Å
46	E	86.8	Confident	88.4	Confident	162 Å²	162	81.7 Å²	81.7	76%	0.757	46%	0.456	S	S	*	.	H	α-helix	trans	-59.4	-36.4	-169.5	-172.3	172.4	173.9	0	0	113	E44 V49 A50	E44-E46 PolarHBondContact O-N 2.9Å; E46-V49 PolarHBondContact O-N 2.67Å; E46-A50 WeakPolarHBondContact O-CB 3.44Å; E46-A50 PolarHBondContact O-N 3.09Å
47	H	87.7	Confident	88.6	Confident	155 Å²	155	79.1 Å²	79.1	72%	0.718	46%	0.455	S	S	*	.	H	α-helix	trans	-70.8	-31.7	176.8	-60.7	-52.1	0	0	0	112.5	D45 S51	D45-H47 VanDerWaalsContact C-N 3.28Å; D45-H47 PolarHBondContact O-N 2.88Å; D45-H47 PolarHBondContact OD1-N 3.3Å; H47-S51 VanDerWaalsContact O-CB 3.26Å; H47-S51 WeakPolarHBondContact O-CB 3.47Å; H47-S51 PolarHBondContact O-N 2.74Å
48	V	88	Confident	89.1	Confident	33 Å²	33	80.4 Å²	80.4	20%	0.2	46%	0.459	C	S	.	.	H	α-helix	trans	-73	-37.8	176.1	-179.9	0	0	0	0	110.8	D45 R166 L169	D45-V48 HydrophobicContact CB-CB 4.15Å; D45-V48 HydrophobicContact CB-CG2 3.86Å; D45-V48 WeakPolarHBondContact O-CB 3.4Å; D45-V48 PolarHBondContact O-N 3.29Å; V48-R166 HydrophobicContact CG1-CG 3.89Å; V48-L169 HydrophobicContact CG1-CD1 4.35Å; V48-L169 HydrophobicContact CG2-CD1 4.04Å
49	V	88.9	Confident	89.7	Confident	64 Å²	64	76.3 Å²	76.3	39%	0.388	44%	0.441	S	S	.	.	H	α-helix	trans	-65.3	-48.7	172.4	177.4	0	0	0	0	110.8	E44 D45 E46 S51 D52 A53	E44-V49 HydrophobicContact CB-CG2 3.84Å; D45-V49 PolarHBondContact O-N 3.03Å; E46-V49 PolarHBondContact O-N 2.67Å; V49-S51 VanDerWaalsContact C-N 3.28Å; V49-S51 PolarHBondContact O-N 3.47Å; V49-D52 PolarHBondContact O-N 3.4Å; V49-D52 VanDerWaalsContact O-N 3.07Å; V49-A53 PolarHBondContact O-N 3.13Å
50	A	90.3	Very high	90.2	Very high	69 Å²	69	79.1 Å²	79.1	57%	0.57	44%	0.44	S	S	*	.	H	α-helix	trans	-59.9	-36.6	177.6	0	0	0	0	0	112.7	E46 D52 A53	E46-A50 WeakPolarHBondContact O-CB 3.44Å; E46-A50 PolarHBondContact O-N 3.09Å; A50-D52 PolarHBondContact O-N 2.99Å; A50-A53 PolarHBondContact O-N 3.32Å
51	S	90.4	Very high	90.8	Very high	74 Å²	74	79.8 Å²	79.8	52%	0.517	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-14	176.9	-177.1	0	0	0	0	114.6	H47 V49 K208	H47-S51 VanDerWaalsContact O-CB 3.26Å; H47-S51 WeakPolarHBondContact O-CB 3.47Å; H47-S51 PolarHBondContact O-N 2.74Å; V49-S51 VanDerWaalsContact C-N 3.28Å; V49-S51 PolarHBondContact O-N 3.47Å; S51-K208 PolarHBondContact O-NZ 3.36Å
52	D	93.4	Very high	91.7	Very high	4 Å²	4	76.5 Å²	76.5	2%	0.021	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-8.2	179.1	-80.2	-23.4	0	0	0	113.6	V49 A50 D54 L55 D56 R162 R166 F204 K208	V49-D52 PolarHBondContact O-N 3.4Å; V49-D52 VanDerWaalsContact O-N 3.07Å; A50-D52 PolarHBondContact O-N 2.99Å; D52-D54 VanDerWaalsContact C-N 3.34Å; D52-D54 PolarHBondContact O-N 2.79Å; D52-L55 CarbonylContact O-C 3.6Å; D52-L55 WeakPolarHBondContact O-CA 3.45Å; D52-L55 WeakPolarHBondContact O-CB 3.49Å; D52-L55 PolarHBondContact O-N 2.99Å; D52-D56 PolarHBondContact O-N 3.33Å; D52-R162 IonicContact OD2-NH1 2.67Å; D52-R166 IonicContact OD2-CZ 2.69Å; D52-R166 VanDerWaalsContact OD2-CZ 3.32Å; D52-R166 IonicContact OD2-NE 3.96Å; D52-R166 PolarHBondContact OD2-NE 3.48Å; D52-R166 VanDerWaalsContact OD2-NE 3.09Å; D52-R166 IonicContact OD2-NH2 3.94Å; D52-R166 PolarHBondContact OD2-NH2 3.12Å; D52-F204 WeakPolarHBondContact OD1-CZ 3.25Å; D52-K208 IonicContact OD1-NZ 2.83Å
53	A	93.2	Very high	92.3	Very high	55 Å²	55	74.5 Å²	74.5	46%	0.455	40%	0.399	S	S	.	.	H	α-helix	trans	-52.5	-44.1	-175.5	0	0	0	0	0	114.2	V49 A50 L55 D56 A57	V49-A53 PolarHBondContact O-N 3.13Å; A50-A53 PolarHBondContact O-N 3.32Å; A53-L55 VanDerWaalsContact C-N 3.26Å; A53-L55 PolarHBondContact O-N 3.28Å; A53-D56 PolarHBondContact O-N 3.04Å; A53-A57 WeakPolarHBondContact O-CB 3.49Å; A53-A57 PolarHBondContact O-N 3.38Å
54	D	93.3	Very high	93.1	Very high	132 Å²	132	67.1 Å²	67.1	71%	0.706	37%	0.374	S	S	*	.	H	α-helix	trans	-61.2	-34	176.6	-64.6	-36.4	0	0	0	113.1	D52 K58	D52-D54 VanDerWaalsContact C-N 3.34Å; D52-D54 PolarHBondContact O-N 2.79Å; D54-K58 WeakPolarHBondContact O-CG 3.49Å; D54-K58 PolarHBondContact O-N 2.88Å
55	L	95.9	Very high	93.8	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-77.9	-44.9	178.4	167.1	63.8	0	0	0	110.3	D52 A53 A57 K58 L59 M158 F204 K208 V211	D52-L55 CarbonylContact O-C 3.6Å; D52-L55 WeakPolarHBondContact O-CA 3.45Å; D52-L55 WeakPolarHBondContact O-CB 3.49Å; D52-L55 PolarHBondContact O-N 2.99Å; A53-L55 VanDerWaalsContact C-N 3.26Å; A53-L55 PolarHBondContact O-N 3.28Å; L55-A57 VanDerWaalsContact C-N 3.3Å; L55-A57 PolarHBondContact O-N 3.02Å; L55-K58 CarbonylContact O-C 3.53Å; L55-K58 WeakPolarHBondContact O-CA 3.49Å; L55-K58 WeakPolarHBondContact O-CB 3.34Å; L55-K58 PolarHBondContact O-N 2.96Å; L55-K58 VanDerWaalsContact O-N 3.08Å; L55-L59 HydrophobicContact CD1-CD1 4.34Å; L55-L59 HydrophobicContact CD1-CG 4.24Å; L55-L59 HydrophobicContact CG-CD1 4.23Å; L55-L59 WeakPolarHBondContact O-CG 3.46Å; L55-L59 PolarHBondContact O-N 3.13Å; L55-M158 HydrophobicContact CD1-CE 4Å; L55-M158 HydrophobicContact CD1-SD 4.11Å; L55-M158 HydrophobicContact CD2-CE 4.22Å; L55-M158 HydrophobicContact CD2-SD 3.59Å; L55-M158 VanDerWaalsContact CD2-SD 3.59Å; L55-M158 HydrophobicContact CG-CE 4.44Å; L55-M158 HydrophobicContact CG-SD 4.36Å; L55-F204 HydrophobicContact CD2-CE2 3.76Å; L55-F204 HydrophobicContact CD2-CZ 3.73Å; L55-K208 HydrophobicContact CB-CD 4.36Å; L55-K208 HydrophobicContact CB-CG 4.47Å; L55-K208 HydrophobicContact CD1-CG 4.32Å; L55-K208 HydrophobicContact CD2-CD 4.11Å; L55-K208 HydrophobicContact CD2-CG 4.2Å; L55-V211 HydrophobicContact CD1-CG1 4.41Å
56	D	96.6	Very high	94.5	Very high	54 Å²	54	65 Å²	65	29%	0.289	36%	0.362	S	S	.	.	H	α-helix	trans	-61.8	-38.4	177	-74.1	-51.7	0	0	0	111.2	D52 A53 K58 L59 E60 R162	D52-D56 PolarHBondContact O-N 3.33Å; A53-D56 PolarHBondContact O-N 3.04Å; D56-K58 PolarHBondContact O-N 2.98Å; D56-L59 CarbonylContact O-C 3.5Å; D56-L59 WeakPolarHBondContact O-CA 3.42Å; D56-L59 WeakPolarHBondContact O-CB 3.46Å; D56-L59 PolarHBondContact O-N 3.14Å; D56-L59 VanDerWaalsContact O-N 3.09Å; D56-E60 PolarHBondContact O-N 3.15Å; D56-R162 VanDerWaalsContact CG-NH1 3.27Å; D56-R162 IonicContact OD1-CZ 3.72Å; D56-R162 VanDerWaalsContact OD1-CZ 3.27Å; D56-R162 IonicContact OD1-NH1 2.63Å; D56-R162 PolarHBondContact OD1-NH1 2.92Å; D56-R162 IonicContact OD1-NH2 2.78Å; D56-R162 PolarHBondContact OD1-NH2 3.05Å; D56-R162 IonicContact OD2-CZ 3.03Å; D56-R162 IonicContact OD2-NH1 2.84Å; D56-R162 PolarHBondContact OD2-NH1 3.2Å; D56-R162 IonicContact OD2-NH2 2.69Å
57	A	96.4	Very high	95	Very high	55 Å²	55	65.2 Å²	65.2	46%	0.455	36%	0.356	S	S	.	.	H	α-helix	trans	-61.7	-38	171.1	0	0	0	0	0	113.4	A53 L55 L59 E60 L61	A53-A57 WeakPolarHBondContact O-CB 3.49Å; A53-A57 PolarHBondContact O-N 3.38Å; L55-A57 VanDerWaalsContact C-N 3.3Å; L55-A57 PolarHBondContact O-N 3.02Å; A57-L59 VanDerWaalsContact C-N 3.34Å; A57-E60 PolarHBondContact O-N 3.39Å; A57-L61 PolarHBondContact O-N 3.09Å; A57-L61 VanDerWaalsContact O-N 3.15Å
58	K	97.2	Very high	95.5	Very high	59 Å²	59	60.4 Å²	60.4	26%	0.257	34%	0.338	S	S	.	.	H	α-helix	trans	-67.4	-34.5	172	-72.5	-84.4	176.5	171.4	0	111.8	D54 L55 D56 L61 F62 D216	D54-K58 WeakPolarHBondContact O-CG 3.49Å; D54-K58 PolarHBondContact O-N 2.88Å; L55-K58 CarbonylContact O-C 3.53Å; L55-K58 WeakPolarHBondContact O-CA 3.49Å; L55-K58 WeakPolarHBondContact O-CB 3.34Å; L55-K58 PolarHBondContact O-N 2.96Å; L55-K58 VanDerWaalsContact O-N 3.08Å; D56-K58 PolarHBondContact O-N 2.98Å; K58-L61 PolarHBondContact O-N 3.26Å; K58-F62 PolarHBondContact O-N 3.37Å; K58-D216 IonicContact NZ-OD1 2.63Å; K58-D216 PolarHBondContact NZ-OD1 3.36Å; K58-D216 IonicContact NZ-OD2 2.84Å; K58-D216 PolarHBondContact NZ-OD2 3.19Å
59	L	98	Very high	96	Very high	6 Å²	6	59 Å²	59	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-70.1	-37.5	174.4	-65.9	172.1	0	0	0	111.9	L55 D56 A57 F62 H63 V155 M158 E159 V211	L55-L59 HydrophobicContact CD1-CD1 4.34Å; L55-L59 HydrophobicContact CD1-CG 4.24Å; L55-L59 HydrophobicContact CG-CD1 4.23Å; L55-L59 WeakPolarHBondContact O-CG 3.46Å; L55-L59 PolarHBondContact O-N 3.13Å; D56-L59 CarbonylContact O-C 3.5Å; D56-L59 WeakPolarHBondContact O-CA 3.42Å; D56-L59 WeakPolarHBondContact O-CB 3.46Å; D56-L59 PolarHBondContact O-N 3.14Å; D56-L59 VanDerWaalsContact O-N 3.09Å; A57-L59 VanDerWaalsContact C-N 3.34Å; L59-F62 WeakPolarHBondContact O-CB 3.36Å; L59-F62 PolarHBondContact O-N 3.02Å; L59-H63 PolarHBondContact O-N 3.33Å; L59-H63 PolarHBondContact O-ND1 2.85Å; L59-V155 HydrophobicContact CD2-CB 4.4Å; L59-V155 HydrophobicContact CD2-CG1 3.6Å; L59-V155 HydrophobicContact CD2-CG2 3.94Å; L59-M158 HydrophobicContact CD1-CE 3.88Å; L59-M158 HydrophobicContact CD2-CE 3.96Å; L59-M158 HydrophobicContact CG-CE 4.41Å; L59-E159 WeakPolarHBondContact CD1-OE1 3.45Å; L59-V211 HydrophobicContact CD2-CG1 4.25Å
60	E	97.9	Very high	96.4	Very high	147 Å²	147	58.8 Å²	58.8	69%	0.687	33%	0.326	S	S	*	.	H	α-helix	trans	-60.9	-43.5	172.4	-72.3	-170.3	156.3	0	0	111.7	D56 A57 F62 H63 S64	D56-E60 PolarHBondContact O-N 3.15Å; A57-E60 PolarHBondContact O-N 3.39Å; E60-F62 VanDerWaalsContact C-N 3.35Å; E60-F62 PolarHBondContact O-N 3.32Å; E60-H63 PolarHBondContact O-N 2.94Å; E60-S64 VanDerWaalsContact O-CB 3.25Å; E60-S64 WeakPolarHBondContact O-CB 3.43Å; E60-S64 PolarHBondContact O-N 2.84Å
61	L	97.7	Very high	96.8	Very high	79 Å²	79	58.7 Å²	58.7	41%	0.414	32%	0.316	S	S	.	.	H	α-helix	trans	-58.7	-44.6	172.9	176.7	60	0	0	0	111.8	A57 K58 S64 I65 V215	A57-L61 PolarHBondContact O-N 3.09Å; A57-L61 VanDerWaalsContact O-N 3.15Å; K58-L61 PolarHBondContact O-N 3.26Å; L61-S64 WeakPolarHBondContact O-CB 3.31Å; L61-S64 PolarHBondContact O-N 3.41Å; L61-I65 HydrophobicContact CD1-CD1 4.2Å; L61-I65 HydrophobicContact CD1-CG1 4.46Å; L61-I65 HydrophobicContact CG-CD1 4.16Å; L61-I65 WeakPolarHBondContact O-CG1 3.45Å; L61-I65 PolarHBondContact O-N 2.87Å; L61-V215 HydrophobicContact CD2-CG1 4.11Å; L61-V215 HydrophobicContact CG-CG1 4.18Å
62	F	98.6	Very high	97.2	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-60.2	-50	175.9	171.7	-106.3	0	0	0	112.7	K58 L59 E60 S64 I65 Q66 I148 T151 W152 V155 V215 L218	K58-F62 PolarHBondContact O-N 3.37Å; L59-F62 WeakPolarHBondContact O-CB 3.36Å; L59-F62 PolarHBondContact O-N 3.02Å; E60-F62 VanDerWaalsContact C-N 3.35Å; E60-F62 PolarHBondContact O-N 3.32Å; F62-S64 VanDerWaalsContact C-N 3.29Å; F62-S64 PolarHBondContact O-N 2.96Å; F62-I65 WeakPolarHBondContact O-CB 3.44Å; F62-I65 PolarHBondContact O-N 2.87Å; F62-Q66 PolarHBondContact O-N 2.87Å; F62-I148 HydrophobicContact CE2-CG2 3.81Å; F62-I148 HydrophobicContact CZ-CG2 3.95Å; F62-T151 HydrophobicContact CD2-CG2 3.59Å; F62-T151 HydrophobicContact CE2-CG2 3.48Å; F62-T151 VanDerWaalsContact CE2-CG2 3.48Å; F62-T151 HydrophobicContact CZ-CG2 4.36Å; F62-W152 HydrophobicContact CE1-CB 4.48Å; F62-W152 HydrophobicContact CZ-CB 3.89Å; F62-V155 HydrophobicContact CD1-CG2 4.14Å; F62-V155 HydrophobicContact CE1-CG2 4.28Å; F62-V155 HydrophobicContact CG-CG2 4.45Å; F62-V215 HydrophobicContact CB-CG1 4.17Å; F62-V215 HydrophobicContact CB-CG2 3.83Å; F62-V215 HydrophobicContact CD2-CG2 4.21Å; F62-V215 HydrophobicContact CG-CG2 4.26Å; F62-L218 HydrophobicContact CD2-CD2 3.77Å; F62-L218 HydrophobicContact CE2-CD2 3.87Å
63	H	98.4	Very high	97.4	Very high	82 Å²	82	57.4 Å²	57.4	38%	0.38	30%	0.303	S	S	.	.	H	α-helix	trans	-65.4	-33.1	178.2	-67.2	109.9	0	0	0	112.3	L59 E60 Q66 R67	L59-H63 PolarHBondContact O-N 3.33Å; L59-H63 PolarHBondContact O-ND1 2.85Å; E60-H63 PolarHBondContact O-N 2.94Å; H63-Q66 PolarHBondContact O-N 2.97Å; H63-R67 VanDerWaalsContact O-CB 3.31Å; H63-R67 WeakPolarHBondContact O-CB 3.35Å; H63-R67 PolarHBondContact O-N 3.47Å
64	S	98.4	Very high	97.7	Very high	57 Å²	57	60.2 Å²	60.2	40%	0.399	31%	0.305	S	S	.	.	H	α-helix	trans	-63.4	-43.9	172	-177.8	0	0	0	0	111.8	E60 L61 F62 T68	E60-S64 VanDerWaalsContact O-CB 3.25Å; E60-S64 WeakPolarHBondContact O-CB 3.43Å; E60-S64 PolarHBondContact O-N 2.84Å; L61-S64 WeakPolarHBondContact O-CB 3.31Å; L61-S64 PolarHBondContact O-N 3.41Å; F62-S64 VanDerWaalsContact C-N 3.29Å; F62-S64 PolarHBondContact O-N 2.96Å; S64-T68 WeakPolarHBondContact O-CB 3.35Å; S64-T68 WeakPolarHBondContact O-CG2 3.43Å; S64-T68 PolarHBondContact O-N 2.94Å; S64-T68 PolarHBondContact O-OG1 3.34Å
65	I	98.3	Very high	97.9	Very high	3 Å²	3	56.4 Å²	56.4	2%	0.015	29%	0.292	C	S	.	.	H	α-helix	trans	-59.6	-50.8	172.5	-70	163.1	0	0	0	110.7	L61 F62 R67 C69 F143 I148 L218	L61-I65 HydrophobicContact CD1-CD1 4.2Å; L61-I65 HydrophobicContact CD1-CG1 4.46Å; L61-I65 HydrophobicContact CG-CD1 4.16Å; L61-I65 WeakPolarHBondContact O-CG1 3.45Å; L61-I65 PolarHBondContact O-N 2.87Å; F62-I65 WeakPolarHBondContact O-CB 3.44Å; F62-I65 PolarHBondContact O-N 2.87Å; I65-R67 PolarHBondContact O-N 3.47Å; I65-C69 VanDerWaalsContact O-CB 3.3Å; I65-C69 WeakPolarHBondContact O-CB 3.3Å; I65-C69 PolarHBondContact O-N 2.96Å; I65-C69 PolarHBondContact O-SG 3.22Å; I65-F143 HydrophobicContact CG2-CE1 4.22Å; I65-I148 HydrophobicContact CG2-CD1 4.13Å; I65-L218 HydrophobicContact CG2-CD2 3.94Å; I65-L218 HydrophobicContact CG2-CG 4.22Å
66	Q	98.3	Very high	98	Very high	74 Å²	74	56.8 Å²	56.8	35%	0.346	29%	0.294	S	S	.	.	H	α-helix	trans	-56.7	-48.9	179.1	-177.8	176.2	3.1	0	0	112.6	F62 H63 L70 I148	F62-Q66 PolarHBondContact O-N 2.87Å; H63-Q66 PolarHBondContact O-N 2.97Å; Q66-L70 WeakPolarHBondContact O-CB 3.43Å; Q66-L70 PolarHBondContact O-N 3.11Å; Q66-I148 HydrophobicContact CB-CG2 3.89Å; Q66-I148 HydrophobicContact CG-CG2 3.96Å
67	R	98.5	Very high	98	Very high	167 Å²	167	57.6 Å²	57.6	63%	0.63	30%	0.301	S	S	*	.	H	α-helix	trans	-65.4	-54.2	-179.5	-172	-175.6	-58.4	161.5	3.9	111.6	H63 I65 C69 L70 D71	H63-R67 VanDerWaalsContact O-CB 3.31Å; H63-R67 WeakPolarHBondContact O-CB 3.35Å; H63-R67 PolarHBondContact O-N 3.47Å; I65-R67 PolarHBondContact O-N 3.47Å; R67-C69 VanDerWaalsContact C-N 3.33Å; R67-C69 PolarHBondContact O-N 3.27Å; R67-L70 WeakPolarHBondContact O-CB 3.28Å; R67-L70 PolarHBondContact O-N 2.98Å; R67-L70 VanDerWaalsContact O-N 3.07Å; R67-D71 PolarHBondContact O-N 3.29Å
68	T	98.4	Very high	98.1	Very high	54 Å²	54	59.2 Å²	59.2	33%	0.331	30%	0.301	S	S	.	.	H	α-helix	trans	-69.9	-27.2	-174	55.9	0	0	0	0	113.2	S64 L72 R222	S64-T68 WeakPolarHBondContact O-CB 3.35Å; S64-T68 WeakPolarHBondContact O-CG2 3.43Å; S64-T68 PolarHBondContact O-N 2.94Å; S64-T68 PolarHBondContact O-OG1 3.34Å; T68-L72 WeakPolarHBondContact O-CB 3.08Å; T68-L72 PolarHBondContact O-N 3.38Å; T68-R222 VanDerWaalsContact OG1-CZ 3.28Å; T68-R222 PolarHBondContact OG1-NH1 3.19Å; T68-R222 PolarHBondContact OG1-NH2 3.35Å
69	C	98.3	Very high	98.1	Very high	3 Å²	3	60.5 Å²	60.5	2%	0.02	31%	0.305	C	S	.	.	H	α-helix	trans	-71.1	-36.6	168.7	-73.7	0	0	0	0	112.8	I65 R67 S73 V140 R144 I148	I65-C69 VanDerWaalsContact O-CB 3.3Å; I65-C69 WeakPolarHBondContact O-CB 3.3Å; I65-C69 PolarHBondContact O-N 2.96Å; I65-C69 PolarHBondContact O-SG 3.22Å; R67-C69 VanDerWaalsContact C-N 3.33Å; R67-C69 PolarHBondContact O-N 3.27Å; C69-S73 WeakPolarHBondContact O-CB 3.47Å; C69-S73 PolarHBondContact O-N 3.49Å; C69-V140 HydrophobicContact CB-CG1 4.43Å; C69-V140 WeakPolarHBondContact O-CG1 3Å; C69-R144 HydrophobicContact CB-CG 3.89Å; C69-I148 HydrophobicContact CB-CD1 4.06Å
70	L	97.9	Very high	98.1	Very high	61 Å²	61	61.4 Å²	61.4	32%	0.319	31%	0.309	S	S	.	.	H	α-helix	trans	-63.2	-46.8	173.5	167.9	64	0	0	0	111.1	Q66 R67 S73 K74	Q66-L70 WeakPolarHBondContact O-CB 3.43Å; Q66-L70 PolarHBondContact O-N 3.11Å; R67-L70 WeakPolarHBondContact O-CB 3.28Å; R67-L70 PolarHBondContact O-N 2.98Å; R67-L70 VanDerWaalsContact O-N 3.07Å; L70-S73 WeakPolarHBondContact O-CB 2.95Å; L70-S73 PolarHBondContact O-N 3.35Å; L70-K74 WeakPolarHBondContact O-CG 3.43Å; L70-K74 PolarHBondContact O-N 3.08Å; L70-K74 VanDerWaalsContact O-N 3.1Å
71	D	98.4	Very high	98	Very high	67 Å²	67	60.4 Å²	60.4	36%	0.358	30%	0.303	S	S	.	.	H	α-helix	trans	-72.7	-33.4	-177	-62.5	-36.4	0	0	0	112.3	R67 K74 A75	R67-D71 PolarHBondContact O-N 3.29Å; D71-K74 PolarHBondContact O-N 3.43Å; D71-K74 IonicContact OD1-NZ 3.53Å; D71-K74 PolarHBondContact OD1-NZ 3.39Å; D71-A75 WeakPolarHBondContact O-CB 3.23Å; D71-A75 PolarHBondContact O-N 3.05Å
72	L	98.3	Very high	98	Very high	46 Å²	46	64.4 Å²	64.4	24%	0.241	31%	0.312	C	S	.	.	H	α-helix	trans	-59.9	-45.6	167	176.8	62	0	0	0	111.9	T68 K74 A75 I76 F136 V140 L226	T68-L72 WeakPolarHBondContact O-CB 3.08Å; T68-L72 PolarHBondContact O-N 3.38Å; L72-K74 PolarHBondContact O-N 3.07Å; L72-A75 PolarHBondContact O-N 2.93Å; L72-I76 HydrophobicContact CD1-CD1 3.89Å; L72-I76 HydrophobicContact CD1-CG1 4.09Å; L72-I76 HydrophobicContact CG-CD1 3.85Å; L72-I76 HydrophobicContact CG-CG1 4.48Å; L72-I76 VanDerWaalsContact O-CG1 3.3Å; L72-I76 WeakPolarHBondContact O-CG1 3.5Å; L72-I76 PolarHBondContact O-N 2.86Å; L72-F136 HydrophobicContact CD1-CE1 4.46Å; L72-F136 HydrophobicContact CD1-CZ 4.22Å; L72-F136 HydrophobicContact CD2-CE2 4.26Å; L72-F136 HydrophobicContact CD2-CZ 3.96Å; L72-F136 HydrophobicContact CG-CZ 4.45Å; L72-V140 HydrophobicContact CD2-CG2 4.06Å; L72-L226 HydrophobicContact CD2-CD2 3.62Å
73	S	97.8	Very high	97.9	Very high	5 Å²	5	64.6 Å²	64.6	4%	0.035	31%	0.313	C	S	.	.	H	α-helix	trans	-56.9	-48.3	177	179.9	0	0	0	0	111.4	C69 L70 A75 I76 V77 H137 E141	C69-S73 WeakPolarHBondContact O-CB 3.47Å; C69-S73 PolarHBondContact O-N 3.49Å; L70-S73 WeakPolarHBondContact O-CB 2.95Å; L70-S73 PolarHBondContact O-N 3.35Å; S73-A75 PolarHBondContact O-N 3.32Å; S73-I76 PolarHBondContact O-N 2.88Å; S73-V77 PolarHBondContact O-N 2.85Å; S73-H137 PolarHBondContact O-ND1 3.47Å; S73-H137 PolarHBondContact OG-CE1 3.46Å; S73-H137 PolarHBondContact OG-ND1 2.97Å; S73-E141 PolarHBondContact OG-OE1 3.47Å
74	K	98.3	Very high	97.8	Very high	113 Å²	113	61.5 Å²	61.5	49%	0.491	30%	0.301	S	S	.	.	H	α-helix	trans	-58.5	-45.1	174.5	-63.9	169.7	-168.5	158.9	0	112.2	L70 D71 L72 I76 V77 L78	L70-K74 WeakPolarHBondContact O-CG 3.43Å; L70-K74 PolarHBondContact O-N 3.08Å; L70-K74 VanDerWaalsContact O-N 3.1Å; D71-K74 PolarHBondContact O-N 3.43Å; D71-K74 IonicContact OD1-NZ 3.53Å; D71-K74 PolarHBondContact OD1-NZ 3.39Å; L72-K74 PolarHBondContact O-N 3.07Å; K74-I76 PolarHBondContact O-N 3.29Å; K74-V77 PolarHBondContact O-N 2.8Å; K74-L78 PolarHBondContact O-N 3.39Å
75	A	98.4	Very high	97.7	Very high	53 Å²	53	63.9 Å²	63.9	44%	0.438	30%	0.304	S	S	.	.	H	α-helix	trans	-62.7	-41	-178.2	0	0	0	0	0	112	D71 L72 S73 V77 L78 Y79	D71-A75 WeakPolarHBondContact O-CB 3.23Å; D71-A75 PolarHBondContact O-N 3.05Å; L72-A75 PolarHBondContact O-N 2.93Å; S73-A75 PolarHBondContact O-N 3.32Å; A75-V77 PolarHBondContact O-N 3.49Å; A75-L78 PolarHBondContact O-N 3.47Å; A75-Y79 VanDerWaalsContact O-CB 3.23Å; A75-Y79 WeakPolarHBondContact O-CB 3.28Å; A75-Y79 PolarHBondContact O-N 2.81Å
76	I	98	Very high	97.6	Very high	8 Å²	8	68.4 Å²	68.4	4%	0.041	33%	0.328	C	S	.	.	H	α-helix	trans	-65	-38.4	177.4	-62.2	160.7	0	0	0	111.3	L72 S73 K74 Q80 L133 F136 H137 V140	L72-I76 HydrophobicContact CD1-CD1 3.89Å; L72-I76 HydrophobicContact CD1-CG1 4.09Å; L72-I76 HydrophobicContact CG-CD1 3.85Å; L72-I76 HydrophobicContact CG-CG1 4.48Å; L72-I76 VanDerWaalsContact O-CG1 3.3Å; L72-I76 WeakPolarHBondContact O-CG1 3.5Å; L72-I76 PolarHBondContact O-N 2.86Å; S73-I76 PolarHBondContact O-N 2.88Å; K74-I76 PolarHBondContact O-N 3.29Å; I76-Q80 WeakPolarHBondContact O-CB 3.23Å; I76-Q80 WeakPolarHBondContact O-CG 3.39Å; I76-Q80 PolarHBondContact O-N 2.69Å; I76-Q80 PolarHBondContact O-NE2 3.47Å; I76-Q80 VanDerWaalsContact O-NE2 3.15Å; I76-L133 HydrophobicContact CG2-CB 4.27Å; I76-L133 HydrophobicContact CG2-CD2 4.25Å; I76-L133 VanDerWaalsContact CG2-O 3.32Å; I76-L133 WeakPolarHBondContact CG2-O 3.36Å; I76-F136 HydrophobicContact CD1-CD1 3.61Å; I76-F136 HydrophobicContact CD1-CD2 4.15Å; I76-F136 HydrophobicContact CD1-CE1 3.71Å; I76-F136 HydrophobicContact CD1-CE2 4.23Å; I76-F136 HydrophobicContact CD1-CG 3.84Å; I76-F136 HydrophobicContact CD1-CZ 4.04Å; I76-F136 HydrophobicContact CG1-CD1 4.16Å; I76-F136 HydrophobicContact CG1-CE1 4.26Å; I76-H137 HydrophobicContact CB-CB 4.47Å; I76-H137 HydrophobicContact CG2-CB 3.81Å; I76-V140 HydrophobicContact CD1-CG2 4.49Å
77	V	97.2	Very high	97.6	Very high	71 Å²	71	64.9 Å²	64.9	43%	0.43	31%	0.311	S	S	.	.	H	α-helix	trans	-65.4	-48.4	174.6	176.7	0	0	0	0	111.3	S73 K74 A75 Y79 Q80 K81 H137	S73-V77 PolarHBondContact O-N 2.85Å; K74-V77 PolarHBondContact O-N 2.8Å; A75-V77 PolarHBondContact O-N 3.49Å; V77-Y79 VanDerWaalsContact C-N 3.3Å; V77-Y79 PolarHBondContact O-N 3.36Å; V77-Q80 PolarHBondContact O-N 2.67Å; V77-K81 PolarHBondContact O-N 3.11Å; V77-H137 WeakPolarHBondContact CG2-CE1 3.21Å
78	L	98	Very high	97.5	Very high	88 Å²	88	60.1 Å²	60.1	46%	0.461	30%	0.296	S	S	.	.	H	α-helix	trans	-62.8	-38.1	179.3	-179	60	0	0	0	111.9	K74 A75 K81 R82	K74-L78 PolarHBondContact O-N 3.39Å; A75-L78 PolarHBondContact O-N 3.47Å; L78-K81 PolarHBondContact O-N 3.3Å; L78-R82 WeakPolarHBondContact O-CG 3.34Å; L78-R82 PolarHBondContact O-N 2.62Å
79	Y	97.9	Very high	97.5	Very high	86 Å²	86	63.6 Å²	63.6	34%	0.337	31%	0.309	S	S	.	.	H	α-helix	trans	-69	-43.2	177.9	-176.8	-127.3	0	0	0	112.4	A75 V77 K81 R82 I83 L133 Y233	A75-Y79 VanDerWaalsContact O-CB 3.23Å; A75-Y79 WeakPolarHBondContact O-CB 3.28Å; A75-Y79 PolarHBondContact O-N 2.81Å; V77-Y79 VanDerWaalsContact C-N 3.3Å; V77-Y79 PolarHBondContact O-N 3.36Å; Y79-K81 VanDerWaalsContact C-N 3.33Å; Y79-K81 PolarHBondContact O-N 3.12Å; Y79-R82 PolarHBondContact O-N 2.73Å; Y79-I83 HydrophobicContact CD1-CD1 3.94Å; Y79-I83 HydrophobicContact CD2-CD1 4.4Å; Y79-I83 HydrophobicContact CE1-CD1 3.55Å; Y79-I83 HydrophobicContact CE2-CD1 4.05Å; Y79-I83 HydrophobicContact CE2-CG1 4.14Å; Y79-I83 HydrophobicContact CG-CD1 4.34Å; Y79-I83 PolarHBondContact O-N 3.38Å; Y79-L133 HydrophobicContact CD1-CD1 3.64Å; Y79-L133 HydrophobicContact CD1-CD2 3.96Å; Y79-L133 HydrophobicContact CD1-CG 4.49Å; Y79-L133 HydrophobicContact CE1-CD1 3.68Å; Y79-L133 HydrophobicContact CE1-CD2 4.19Å; Y79-Y233 HydrophobicContact CE1-CE2 4.05Å; Y79-Y233 AromaticContact CE1-CZ 3.91Å; Y79-Y233 VanDerWaalsContact CE1-OH 3.26Å; Y79-Y233 WeakPolarHBondContact CE1-OH 3.43Å; Y79-Y233 PolarHBondContact OH-OH 3.04Å; Y79-Y233 VanDerWaalsContact OH-OH 3.13Å
80	Q	96.9	Very high	97.4	Very high	25 Å²	25	64.8 Å²	64.8	12%	0.117	31%	0.314	C	S	.	.	H	α-helix	trans	-57.3	-44.2	171.5	-77	173.2	96.5	0	0	112	I76 V77 R82 I83 C84 L133	I76-Q80 WeakPolarHBondContact O-CB 3.23Å; I76-Q80 WeakPolarHBondContact O-CG 3.39Å; I76-Q80 PolarHBondContact O-N 2.69Å; I76-Q80 PolarHBondContact O-NE2 3.47Å; I76-Q80 VanDerWaalsContact O-NE2 3.15Å; V77-Q80 PolarHBondContact O-N 2.67Å; Q80-R82 VanDerWaalsContact C-N 3.33Å; Q80-R82 PolarHBondContact O-N 2.98Å; Q80-I83 PolarHBondContact O-N 3.13Å; Q80-C84 PolarHBondContact O-N 3.19Å; Q80-C84 PolarHBondContact O-SG 3.36Å; Q80-C84 VanDerWaalsContact O-SG 3.38Å; Q80-L133 HydrophobicContact CG-CB 3.63Å; Q80-L133 HydrophobicContact CG-CD1 4Å; Q80-L133 HydrophobicContact CG-CG 4.44Å
81	K	96.4	Very high	97.4	Very high	127 Å²	127	62.5 Å²	62.5	55%	0.552	30%	0.302	S	S	*	.	H	α-helix	trans	-61.9	-40.4	177.3	-162.8	-176.4	-172.3	-172.4	0	111.9	V77 L78 Y79 C84 F85	V77-K81 PolarHBondContact O-N 3.11Å; L78-K81 PolarHBondContact O-N 3.3Å; Y79-K81 VanDerWaalsContact C-N 3.33Å; Y79-K81 PolarHBondContact O-N 3.12Å; K81-C84 PolarHBondContact O-N 3.49Å; K81-F85 HydrophobicContact CD-CE2 4.01Å; K81-F85 HydrophobicContact CG-CD2 4.25Å; K81-F85 HydrophobicContact CG-CE2 3.77Å; K81-F85 HydrophobicContact CG-CZ 4.39Å; K81-F85 WeakPolarHBondContact O-CD2 3.48Å; K81-F85 PolarHBondContact O-N 3.42Å
82	R	97.6	Very high	97.3	Very high	162 Å²	162	63.2 Å²	63.2	61%	0.611	30%	0.303	S	S	*	.	H	α-helix	trans	-66.9	-37.4	175.7	-73.7	173.3	176.2	-174.3	-1.7	112.7	L78 Y79 Q80 L86	L78-R82 WeakPolarHBondContact O-CG 3.34Å; L78-R82 PolarHBondContact O-N 2.62Å; Y79-R82 PolarHBondContact O-N 2.73Å; Q80-R82 VanDerWaalsContact C-N 3.33Å; Q80-R82 PolarHBondContact O-N 2.98Å; R82-L86 WeakPolarHBondContact O-CB 3.35Å; R82-L86 PolarHBondContact O-N 2.95Å
83	I	96.5	Very high	97.3	Very high	5 Å²	5	65.2 Å²	65.2	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-60.8	-46.9	172.8	-76.8	163.4	0	0	0	110.8	Y79 Q80 F85 L86 S87 R126 L127 L129 R130 L133	Y79-I83 HydrophobicContact CD1-CD1 3.94Å; Y79-I83 HydrophobicContact CD2-CD1 4.4Å; Y79-I83 HydrophobicContact CE1-CD1 3.55Å; Y79-I83 HydrophobicContact CE2-CD1 4.05Å; Y79-I83 HydrophobicContact CE2-CG1 4.14Å; Y79-I83 HydrophobicContact CG-CD1 4.34Å; Y79-I83 PolarHBondContact O-N 3.38Å; Q80-I83 PolarHBondContact O-N 3.13Å; I83-F85 PolarHBondContact O-N 3.44Å; I83-L86 PolarHBondContact O-N 3.03Å; I83-S87 PolarHBondContact O-N 3.25Å; I83-R126 HydrophobicContact CG2-CG 4.18Å; I83-L127 HydrophobicContact CG2-CD2 4.32Å; I83-L129 HydrophobicContact CD1-CB 4.19Å; I83-L129 HydrophobicContact CD1-CD1 4.38Å; I83-R130 HydrophobicContact CG2-CG 4.15Å; I83-L133 HydrophobicContact CD1-CD1 3.4Å; I83-L133 VanDerWaalsContact CD1-CD1 3.4Å
84	C	95.6	Very high	97.3	Very high	17 Å²	17	65 Å²	65	12%	0.115	31%	0.312	C	S	.	.	H	α-helix	trans	-55.7	-53.6	177.9	-65.1	0	0	0	0	111.6	Q80 K81 S87 Q88 R130 V395 F396	Q80-C84 PolarHBondContact O-N 3.19Å; Q80-C84 PolarHBondContact O-SG 3.36Å; Q80-C84 VanDerWaalsContact O-SG 3.38Å; K81-C84 PolarHBondContact O-N 3.49Å; C84-S87 PolarHBondContact O-N 2.84Å; C84-Q88 PolarHBondContact O-N 3.18Å; C84-R130 PolarHBondContact SG-NE 3.07Å; C84-V395 HydrophobicContact CB-CG1 4.41Å; C84-F396 HydrophobicContact CB-CE1 4.17Å; C84-F396 HydrophobicContact CB-CZ 4.09Å
85	F	97	Very high	97.2	Very high	106 Å²	106	64.2 Å²	64.2	47%	0.465	31%	0.309	S	S	.	.	H	α-helix	trans	-62.9	-44.6	-179.7	-67.2	-47.1	0	0	0	112.5	K81 I83 S87 Q88 E89	K81-F85 HydrophobicContact CD-CE2 4.01Å; K81-F85 HydrophobicContact CG-CD2 4.25Å; K81-F85 HydrophobicContact CG-CE2 3.77Å; K81-F85 HydrophobicContact CG-CZ 4.39Å; K81-F85 WeakPolarHBondContact O-CD2 3.48Å; K81-F85 PolarHBondContact O-N 3.42Å; I83-F85 PolarHBondContact O-N 3.44Å; F85-S87 VanDerWaalsContact C-N 3.29Å; F85-S87 PolarHBondContact O-N 2.63Å; F85-Q88 WeakPolarHBondContact O-CB 3.44Å; F85-Q88 PolarHBondContact O-N 2.95Å; F85-E89 WeakPolarHBondContact O-CG 3.36Å; F85-E89 PolarHBondContact O-N 3.49Å
86	L	97.1	Very high	97.2	Very high	98 Å²	98	66.9 Å²	66.9	51%	0.513	31%	0.311	S	S	.	.	H	α-helix	trans	-61.7	-38.1	179.7	-177.8	61.5	0	0	0	112.2	R82 I83 E90	R82-L86 WeakPolarHBondContact O-CB 3.35Å; R82-L86 PolarHBondContact O-N 2.95Å; I83-L86 PolarHBondContact O-N 3.03Å; L86-E90 VanDerWaalsContact O-CB 3.28Å; L86-E90 WeakPolarHBondContact O-CB 3.44Å; L86-E90 PolarHBondContact O-N 2.88Å; L86-E90 VanDerWaalsContact O-N 3.13Å
87	S	97.3	Very high	97.2	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-71	-31.9	172.5	-75.3	0	0	0	0	113.2	I83 C84 F85 N91 S123 R126	I83-S87 PolarHBondContact O-N 3.25Å; C84-S87 PolarHBondContact O-N 2.84Å; F85-S87 VanDerWaalsContact C-N 3.29Å; F85-S87 PolarHBondContact O-N 2.63Å; S87-N91 VanDerWaalsContact O-CB 3.23Å; S87-N91 WeakPolarHBondContact O-CB 3.07Å; S87-N91 PolarHBondContact O-N 2.73Å; S87-N91 VanDerWaalsContact O-N 3.07Å; S87-S123 VanDerWaalsContact CB-O 3.3Å; S87-S123 WeakPolarHBondContact CB-O 3.25Å; S87-S123 VanDerWaalsContact O-CB 3.27Å; S87-S123 WeakPolarHBondContact O-CB 3.18Å; S87-S123 PolarHBondContact OG-O 3.01Å; S87-R126 PolarHBondContact OG-NH1 3.02Å; S87-R126 VanDerWaalsContact OG-NH1 3.08Å
88	Q	96.5	Very high	97.1	Very high	67 Å²	67	70.4 Å²	70.4	31%	0.313	32%	0.318	S	S	.	.	H	α-helix	trans	-65	-53.4	174.6	-172	171.3	0.1	0	0	110.9	C84 F85 E90 N91 E92 F396	C84-Q88 PolarHBondContact O-N 3.18Å; F85-Q88 WeakPolarHBondContact O-CB 3.44Å; F85-Q88 PolarHBondContact O-N 2.95Å; Q88-E90 PolarHBondContact O-N 3.14Å; Q88-N91 PolarHBondContact O-N 3.41Å; Q88-E92 PolarHBondContact O-N 2.87Å; Q88-F396 HydrophobicContact CB-CE1 4.13Å; Q88-F396 HydrophobicContact CB-CZ 4.25Å; Q88-F396 HydrophobicContact CG-CE1 4.47Å
89	E	97.5	Very high	97	Very high	128 Å²	128	69 Å²	69	60%	0.598	32%	0.316	S	S	*	.	H	α-helix	trans	-62.2	-41	-179.5	-60.2	-55.7	124.1	0	0	112.6	F85 E92 L93	F85-E89 WeakPolarHBondContact O-CG 3.36Å; F85-E89 PolarHBondContact O-N 3.49Å; E89-E92 PolarHBondContact O-N 3.45Å; E89-L93 WeakPolarHBondContact O-CB 3.29Å; E89-L93 PolarHBondContact O-N 3.19Å
90	E	97.3	Very high	96.9	Very high	27 Å²	27	68.4 Å²	68.4	13%	0.126	32%	0.316	C	S	.	.	H	α-helix	trans	-67.3	-34.7	176.7	-173.2	-173.9	-149.3	0	0	112.4	L86 Q88 G94 L119 S122 S123 R126	L86-E90 VanDerWaalsContact O-CB 3.28Å; L86-E90 WeakPolarHBondContact O-CB 3.44Å; L86-E90 PolarHBondContact O-N 2.88Å; L86-E90 VanDerWaalsContact O-N 3.13Å; Q88-E90 PolarHBondContact O-N 3.14Å; E90-G94 PolarHBondContact O-N 2.79Å; E90-L119 HydrophobicContact CG-CB 4.02Å; E90-L119 HydrophobicContact CG-CD2 4.12Å; E90-S122 VanDerWaalsContact CD-OG 3.29Å; E90-S122 VanDerWaalsContact OE1-CB 3.23Å; E90-S122 WeakPolarHBondContact OE1-CB 3.36Å; E90-S122 PolarHBondContact OE1-OG 3.2Å; E90-S122 PolarHBondContact OE2-OG 3.34Å; E90-S123 WeakPolarHBondContact OE2-CA 3.3Å; E90-S123 WeakPolarHBondContact OE2-CB 3.45Å; E90-S123 PolarHBondContact OE2-N 3.06Å; E90-R126 IonicContact OE1-NH2 3.56Å; E90-R126 PolarHBondContact OE1-NH2 2.8Å; E90-R126 IonicContact OE2-CZ 2.86Å; E90-R126 IonicContact OE2-NH1 3.61Å; E90-R126 PolarHBondContact OE2-NH1 3.15Å; E90-R126 IonicContact OE2-NH2 3.09Å; E90-R126 PolarHBondContact OE2-NH2 3.15Å
91	N	96.8	Very high	96.8	Very high	14 Å²	14	67.2 Å²	67.2	8%	0.075	31%	0.31	C	S	.	.	H	α-helix	trans	-68.4	-42.2	175.5	-167.6	27.4	0	0	0	111.7	S87 Q88 G94 K95 C120 S123 W392	S87-N91 VanDerWaalsContact O-CB 3.23Å; S87-N91 WeakPolarHBondContact O-CB 3.07Å; S87-N91 PolarHBondContact O-N 2.73Å; S87-N91 VanDerWaalsContact O-N 3.07Å; Q88-N91 PolarHBondContact O-N 3.41Å; N91-G94 PolarHBondContact O-N 3.18Å; N91-K95 WeakPolarHBondContact O-CG 3.25Å; N91-K95 PolarHBondContact O-N 3.35Å; N91-C120 PolarHBondContact OD1-SG 3.42Å; N91-S123 WeakPolarHBondContact CB-OG 3.19Å; N91-W392 HydrophobicContact CB-CH2 3.83Å; N91-W392 WeakPolarHBondContact ND2-CH2 3.45Å; N91-W392 WeakPolarHBondContact ND2-CZ2 3.27Å
92	E	97.9	Very high	96.7	Very high	82 Å²	82	69 Å²	69	38%	0.383	32%	0.318	S	S	.	.	H	α-helix	trans	-65.7	-39.2	175	-59.6	-38	123.2	0	0	111.9	Q88 E89 G94 K95 F96	Q88-E92 PolarHBondContact O-N 2.87Å; E89-E92 PolarHBondContact O-N 3.45Å; E92-G94 VanDerWaalsContact C-N 3.33Å; E92-G94 PolarHBondContact O-N 2.96Å; E92-K95 PolarHBondContact O-N 3.46Å; E92-K95 IonicContact OE1-NZ 2.74Å; E92-K95 PolarHBondContact OE1-NZ 3.4Å; E92-K95 WeakPolarHBondContact OE2-CD 3.3Å; E92-K95 IonicContact OE2-NZ 2.67Å; E92-K95 PolarHBondContact OE2-NZ 3.31Å; E92-F96 WeakPolarHBondContact O-CB 3.44Å; E92-F96 PolarHBondContact O-N 2.88Å
93	L	98.1	Very high	96.5	Very high	88 Å²	88	67.4 Å²	67.4	46%	0.461	32%	0.318	S	S	.	.	H	α-helix	trans	-61.5	-40.9	170.7	-179.1	59.3	0	0	0	111.8	E89 F96 L97 L119	E89-L93 WeakPolarHBondContact O-CB 3.29Å; E89-L93 PolarHBondContact O-N 3.19Å; L93-F96 HydrophobicContact CD1-CD1 4.49Å; L93-F96 PolarHBondContact O-N 3.28Å; L93-L97 HydrophobicContact CD1-CG 4.37Å; L93-L97 WeakPolarHBondContact O-CG 3.33Å; L93-L97 PolarHBondContact O-N 3.18Å; L93-L119 HydrophobicContact CB-CD1 4.48Å; L93-L119 HydrophobicContact CD2-CD1 3.84Å; L93-L119 HydrophobicContact CG-CD1 3.79Å
94	G	97.3	Very high	96.3	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-62.5	-44.3	175.6	0	0	0	0	0	113.3	E90 N91 E92 R98 G116	E90-G94 PolarHBondContact O-N 2.79Å; N91-G94 PolarHBondContact O-N 3.18Å; E92-G94 VanDerWaalsContact C-N 3.33Å; E92-G94 PolarHBondContact O-N 2.96Å; G94-R98 WeakPolarHBondContact O-CG 3.3Å; G94-R98 PolarHBondContact O-N 2.89Å; G94-R98 VanDerWaalsContact O-N 3.11Å; G94-G116 WeakPolarHBondContact CA-O 3.23Å; G94-G116 VanDerWaalsContact O-CA 3.31Å; G94-G116 WeakPolarHBondContact O-CA 3.37Å
95	K	96.8	Very high	96	Very high	96 Å²	96	78.2 Å²	78.2	42%	0.417	37%	0.366	S	S	.	.	H	α-helix	trans	-61.4	-44.2	172.2	-71.7	160.5	169.7	178.8	0	111.9	N91 E92 R98 S99	N91-K95 WeakPolarHBondContact O-CG 3.25Å; N91-K95 PolarHBondContact O-N 3.35Å; E92-K95 PolarHBondContact O-N 3.46Å; E92-K95 IonicContact OE1-NZ 2.74Å; E92-K95 PolarHBondContact OE1-NZ 3.4Å; E92-K95 WeakPolarHBondContact OE2-CD 3.3Å; E92-K95 IonicContact OE2-NZ 2.67Å; E92-K95 PolarHBondContact OE2-NZ 3.31Å; K95-R98 PolarHBondContact O-N 3.26Å; K95-S99 PolarHBondContact O-N 3.08Å
96	F	98.1	Very high	95.6	Very high	110 Å²	110	77 Å²	77	48%	0.482	37%	0.366	S	S	.	.	H	α-helix	trans	-61.9	-48.1	178.4	173.7	-96.3	0	0	0	112	E92 L93 R98 S99 Q100	E92-F96 WeakPolarHBondContact O-CB 3.44Å; E92-F96 PolarHBondContact O-N 2.88Å; L93-F96 HydrophobicContact CD1-CD1 4.49Å; L93-F96 PolarHBondContact O-N 3.28Å; F96-R98 VanDerWaalsContact C-N 3.26Å; F96-R98 PolarHBondContact O-N 3.45Å; F96-S99 PolarHBondContact O-N 2.92Å; F96-S99 VanDerWaalsContact O-N 3.13Å; F96-S99 PolarHBondContact O-OG 3.38Å; F96-S99 VanDerWaalsContact O-OG 3.04Å; F96-Q100 HydrophobicContact CD1-CG 4.31Å; F96-Q100 HydrophobicContact CD2-CG 4.21Å; F96-Q100 HydrophobicContact CE1-CG 3.87Å; F96-Q100 HydrophobicContact CE2-CG 3.77Å; F96-Q100 VanDerWaalsContact CE2-NE2 3.35Å; F96-Q100 HydrophobicContact CG-CG 4.47Å; F96-Q100 HydrophobicContact CZ-CG 3.58Å; F96-Q100 WeakPolarHBondContact O-CG 3.45Å; F96-Q100 PolarHBondContact O-N 2.73Å
97	L	97.3	Very high	95	Very high	37 Å²	37	74.8 Å²	74.8	19%	0.194	35%	0.352	C	S	.	.	H	α-helix	trans	-62.2	-35	176.4	-68.4	-177.9	0	0	0	112	L93 G101 M112 T115 L119	L93-L97 HydrophobicContact CD1-CG 4.37Å; L93-L97 WeakPolarHBondContact O-CG 3.33Å; L93-L97 PolarHBondContact O-N 3.18Å; L97-G101 WeakPolarHBondContact O-CA 3.43Å; L97-G101 PolarHBondContact O-N 3.03Å; L97-M112 HydrophobicContact CB-CB 4.48Å; L97-M112 WeakPolarHBondContact CB-O 3.39Å; L97-M112 CarbonylContact O-C 3.59Å; L97-M112 WeakPolarHBondContact O-CB 3.26Å; L97-T115 HydrophobicContact CD1-CG2 3.85Å; L97-L119 HydrophobicContact CD1-CD1 3.84Å
98	R	95.9	Very high	94.6	Very high	115 Å²	115	76.6 Å²	76.6	43%	0.434	37%	0.366	S	S	.	.	H	α-helix	trans	-66.1	-38.7	172.9	-73.1	170.6	65.2	176.4	1	113	G94 K95 F96 F102	G94-R98 WeakPolarHBondContact O-CG 3.3Å; G94-R98 PolarHBondContact O-N 2.89Å; G94-R98 VanDerWaalsContact O-N 3.11Å; K95-R98 PolarHBondContact O-N 3.26Å; F96-R98 VanDerWaalsContact C-N 3.26Å; F96-R98 PolarHBondContact O-N 3.45Å; R98-F102 WeakPolarHBondContact O-CB 3.31Å; R98-F102 PolarHBondContact O-N 3.02Å; R98-F102 VanDerWaalsContact O-N 3.15Å
99	S	96.3	Very high	94.4	Very high	59 Å²	59	73.4 Å²	73.4	41%	0.413	35%	0.352	S	S	.	.	H	α-helix	trans	-77.1	-35.2	-179.2	68.1	0	0	0	0	113.3	K95 F96 Q103	K95-S99 PolarHBondContact O-N 3.08Å; F96-S99 PolarHBondContact O-N 2.92Å; F96-S99 VanDerWaalsContact O-N 3.13Å; F96-S99 PolarHBondContact O-OG 3.38Å; F96-S99 VanDerWaalsContact O-OG 3.04Å; S99-Q103 PolarHBondContact O-NE2 3.34Å
100	Q	95.8	Very high	94	Very high	73 Å²	73	70.4 Å²	70.4	34%	0.341	34%	0.336	S	S	.	.	H	α-helix	trans	-70.2	-45.3	170.4	-58.4	-51.1	-31.9	0	0	111.3	F96 F102 Q103 D104 M112	F96-Q100 HydrophobicContact CD1-CG 4.31Å; F96-Q100 HydrophobicContact CD2-CG 4.21Å; F96-Q100 HydrophobicContact CE1-CG 3.87Å; F96-Q100 HydrophobicContact CE2-CG 3.77Å; F96-Q100 VanDerWaalsContact CE2-NE2 3.35Å; F96-Q100 HydrophobicContact CG-CG 4.47Å; F96-Q100 HydrophobicContact CZ-CG 3.58Å; F96-Q100 WeakPolarHBondContact O-CG 3.45Å; F96-Q100 PolarHBondContact O-N 2.73Å; Q100-F102 PolarHBondContact O-N 2.64Å; Q100-F102 VanDerWaalsContact O-N 3.14Å; Q100-Q103 WeakPolarHBondContact O-CB 3.27Å; Q100-Q103 PolarHBondContact O-N 2.96Å; Q100-D104 PolarHBondContact O-N 3.37Å; Q100-M112 HydrophobicContact CB-SD 4.25Å
101	G	94.8	Very high	93.8	Very high	0 Å²	0	73 Å²	73	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-65.3	-15.1	178.6	0	0	0	0	0	115.1	L97 D104 G109 Q113	L97-G101 WeakPolarHBondContact O-CA 3.43Å; L97-G101 PolarHBondContact O-N 3.03Å; G101-D104 VanDerWaalsContact O-O 3.07Å; G101-G109 WeakPolarHBondContact CA-O 3.4Å; G101-G109 CarbonylContact O-C 3.6Å; G101-Q113 PolarHBondContact O-NE2 3.28Å
102	F	93.5	Very high	93.7	Very high	164 Å²	164	75.4 Å²	75.4	72%	0.719	36%	0.361	S	S	*	.	H	α-helix	trans	-81.5	-25.7	171.1	-173.9	-95.1	0	0	0	112.9	R98 Q100	R98-F102 WeakPolarHBondContact O-CB 3.31Å; R98-F102 PolarHBondContact O-N 3.02Å; R98-F102 VanDerWaalsContact O-N 3.15Å; Q100-F102 PolarHBondContact O-N 2.64Å; Q100-F102 VanDerWaalsContact O-N 3.14Å
103	Q	94	Very high	93.5	Very high	130 Å²	130	74.8 Å²	74.8	61%	0.607	36%	0.358	S	S	*	.	H	α-helix	trans	-82.3	-38.5	177.2	-66.1	166.4	81	0	0	111.3	S99 Q100	S99-Q103 PolarHBondContact O-NE2 3.34Å; Q100-Q103 WeakPolarHBondContact O-CB 3.27Å; Q100-Q103 PolarHBondContact O-N 2.96Å
104	D	91.4	Very high	93.3	Very high	51 Å²	51	70.8 Å²	70.8	27%	0.273	34%	0.338	S	S	.	.			trans	-77.3	124.1	172.3	-179.5	8.5	0	0	0	111.3	Q100 G101 T106 A108 G109	Q100-D104 PolarHBondContact O-N 3.37Å; G101-D104 VanDerWaalsContact O-O 3.07Å; D104-T106 VanDerWaalsContact CG-OG1 3.25Å; D104-T106 VanDerWaalsContact OD1-CB 3.32Å; D104-T106 WeakPolarHBondContact OD1-CB 3.35Å; D104-T106 VanDerWaalsContact OD1-CG2 3.28Å; D104-T106 WeakPolarHBondContact OD1-CG2 3.45Å; D104-T106 PolarHBondContact OD1-N 3Å; D104-T106 PolarHBondContact OD1-OG1 3.04Å; D104-T106 PolarHBondContact OD2-OG1 3.48Å; D104-A108 WeakPolarHBondContact OD2-CB 3.2Å; D104-G109 WeakPolarHBondContact OD2-CA 3.43Å; D104-G109 PolarHBondContact OD2-N 2.92Å
105	K	89.6	Confident	93.2	Very high	198 Å²	198	73 Å²	73	86%	0.861	35%	0.351	S	S	*	.			trans	-93.6	-1.2	179.8	-62.4	-176.6	-179.2	179	0	113.8
106	T	88.4	Confident	93.2	Very high	79 Å²	79	68.4 Å²	68.4	49%	0.485	33%	0.332	S	S	.	.	S	Bend	trans	-82.2	177.9	-179.7	73.6	0	0	0	0	112.5	D104 A108 G109 K110	D104-T106 VanDerWaalsContact CG-OG1 3.25Å; D104-T106 VanDerWaalsContact OD1-CB 3.32Å; D104-T106 WeakPolarHBondContact OD1-CB 3.35Å; D104-T106 VanDerWaalsContact OD1-CG2 3.28Å; D104-T106 WeakPolarHBondContact OD1-CG2 3.45Å; D104-T106 PolarHBondContact OD1-N 3Å; D104-T106 PolarHBondContact OD1-OG1 3.04Å; D104-T106 PolarHBondContact OD2-OG1 3.48Å; T106-A108 PolarHBondContact O-N 3.17Å; T106-A108 WeakPolarHBondContact OG1-CB 3.36Å; T106-A108 PolarHBondContact OG1-N 3.38Å; T106-G109 PolarHBondContact O-N 3.45Å; T106-G109 VanDerWaalsContact O-N 3.16Å; T106-K110 PolarHBondContact O-N 3.4Å; T106-K110 VanDerWaalsContact O-N 3.14Å
107	R	84.6	Confident	93	Very high	53 Å²	53	66.1 Å²	66.1	20%	0.2	32%	0.321	C	S	.	.	H	α-helix	trans	-60.3	-25.7	170.8	-168.5	174.2	-178.5	-133.5	6.7	112.1	M111 S254 F255 K256 G257 Q259	R107-M111 WeakPolarHBondContact O-CB 3.23Å; R107-M111 PolarHBondContact O-N 3.23Å; R107-S254 PolarHBondContact NH2-O 2.93Å; R107-F255 HydrophobicContact CG-CD1 4.15Å; R107-F255 HydrophobicContact CG-CE1 4.11Å; R107-K256 PolarHBondContact NH2-O 3.14Å; R107-G257 PolarHBondContact NH1-O 3.12Å; R107-G257 VanDerWaalsContact NH1-O 3.16Å; R107-Q259 VanDerWaalsContact CD-CD 3.44Å
108	A	88.6	Confident	92.9	Very high	38 Å²	38	64.6 Å²	64.6	31%	0.314	31%	0.314	S	S	.	.	H	α-helix	trans	-67.5	-44.1	173.4	0	0	0	0	0	111.4	D104 T106 K110 M111 M112	D104-A108 WeakPolarHBondContact OD2-CB 3.2Å; T106-A108 PolarHBondContact O-N 3.17Å; T106-A108 WeakPolarHBondContact OG1-CB 3.36Å; T106-A108 PolarHBondContact OG1-N 3.38Å; A108-K110 PolarHBondContact O-N 3.17Å; A108-M111 CarbonylContact O-C 3.56Å; A108-M111 WeakPolarHBondContact O-CB 3.26Å; A108-M111 PolarHBondContact O-N 2.91Å; A108-M111 VanDerWaalsContact O-N 3.13Å; A108-M112 WeakPolarHBondContact O-CG 3.36Å; A108-M112 PolarHBondContact O-N 2.83Å
109	G	91.4	Very high	93	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.1	-45	172.4	0	0	0	0	0	113.3	G101 D104 T106 M111 M112 Q113	G101-G109 WeakPolarHBondContact CA-O 3.4Å; G101-G109 CarbonylContact O-C 3.6Å; D104-G109 WeakPolarHBondContact OD2-CA 3.43Å; D104-G109 PolarHBondContact OD2-N 2.92Å; T106-G109 PolarHBondContact O-N 3.45Å; T106-G109 VanDerWaalsContact O-N 3.16Å; G109-M111 VanDerWaalsContact C-N 3.32Å; G109-M111 PolarHBondContact O-N 3.48Å; G109-M112 PolarHBondContact O-N 3.13Å; G109-Q113 WeakPolarHBondContact O-CG 3.4Å; G109-Q113 PolarHBondContact O-N 3.23Å
110	K	90.5	Very high	93	Very high	64 Å²	64	58 Å²	58	28%	0.278	28%	0.283	S	S	.	.	H	α-helix	trans	-55.1	-46.4	170.9	-67.2	-172.1	178.6	-172.6	0	111.9	T106 A108 Q113 A114 F255 D367	T106-K110 PolarHBondContact O-N 3.4Å; T106-K110 VanDerWaalsContact O-N 3.14Å; A108-K110 PolarHBondContact O-N 3.17Å; K110-Q113 PolarHBondContact O-N 3.43Å; K110-A114 PolarHBondContact O-N 3.26Å; K110-F255 HydrophobicContact CB-CE1 4.31Å; K110-F255 HydrophobicContact CB-CZ 4.41Å; K110-D367 PolarHBondContact NZ-O 2.99Å; K110-D367 IonicContact NZ-OD2 3.32Å; K110-D367 PolarHBondContact NZ-OD2 3.4Å
111	M	92.1	Very high	92.9	Very high	81 Å²	81	55.2 Å²	55.2	40%	0.399	27%	0.27	S	S	.	.	H	α-helix	trans	-63.8	-42.9	178.9	-174	177.3	66.2	0	0	112	R107 A108 G109 Q113 A114 T115 F255	R107-M111 WeakPolarHBondContact O-CB 3.23Å; R107-M111 PolarHBondContact O-N 3.23Å; A108-M111 CarbonylContact O-C 3.56Å; A108-M111 WeakPolarHBondContact O-CB 3.26Å; A108-M111 PolarHBondContact O-N 2.91Å; A108-M111 VanDerWaalsContact O-N 3.13Å; G109-M111 VanDerWaalsContact C-N 3.32Å; G109-M111 PolarHBondContact O-N 3.48Å; M111-Q113 PolarHBondContact O-N 2.96Å; M111-A114 PolarHBondContact O-N 3.43Å; M111-T115 WeakPolarHBondContact O-CB 3.25Å; M111-T115 PolarHBondContact O-N 3.1Å; M111-T115 PolarHBondContact O-OG1 3.41Å; M111-T115 VanDerWaalsContact O-OG1 3.09Å; M111-F255 VanDerWaalsContact CA-CZ 3.49Å; M111-F255 HydrophobicContact CB-CD1 3.75Å; M111-F255 HydrophobicContact CB-CD2 4.23Å; M111-F255 HydrophobicContact CB-CE1 3.69Å; M111-F255 HydrophobicContact CB-CE2 4.2Å; M111-F255 HydrophobicContact CB-CG 4.04Å; M111-F255 HydrophobicContact CB-CZ 3.94Å; M111-F255 HydrophobicContact CG-CB 4.33Å; M111-F255 HydrophobicContact CG-CD1 3.98Å; M111-F255 HydrophobicContact CG-CD2 3.83Å; M111-F255 HydrophobicContact CG-CE1 4.31Å; M111-F255 HydrophobicContact CG-CE2 4.19Å; M111-F255 HydrophobicContact CG-CG 3.74Å; M111-F255 HydrophobicContact CG-CZ 4.43Å; M111-F255 HydrophobicContact SD-CB 4.02Å; M111-F255 HydrophobicContact SD-CD1 4.33Å; M111-F255 HydrophobicContact SD-CG 4.05Å
112	M	94.6	Very high	93	Very high	65 Å²	65	55.3 Å²	55.3	32%	0.32	27%	0.271	S	S	.	.	H	α-helix	trans	-61.3	-41.7	174.7	-67.9	-179.5	-164.5	0	0	111.7	L97 Q100 A108 G109 G116	L97-M112 HydrophobicContact CB-CB 4.48Å; L97-M112 WeakPolarHBondContact CB-O 3.39Å; L97-M112 CarbonylContact O-C 3.59Å; L97-M112 WeakPolarHBondContact O-CB 3.26Å; Q100-M112 HydrophobicContact CB-SD 4.25Å; A108-M112 WeakPolarHBondContact O-CG 3.36Å; A108-M112 PolarHBondContact O-N 2.83Å; G109-M112 PolarHBondContact O-N 3.13Å; M112-G116 PolarHBondContact O-N 3.38Å
113	Q	94.1	Very high	93.1	Very high	70 Å²	70	47.5 Å²	47.5	33%	0.327	24%	0.236	S	C	.	.	H	α-helix	trans	-63.9	-43.3	174.9	-69	-174.7	52.4	0	0	112.6	G101 G109 K110 M111 K117	G101-Q113 PolarHBondContact O-NE2 3.28Å; G109-Q113 WeakPolarHBondContact O-CG 3.4Å; G109-Q113 PolarHBondContact O-N 3.23Å; K110-Q113 PolarHBondContact O-N 3.43Å; M111-Q113 PolarHBondContact O-N 2.96Å; Q113-K117 WeakPolarHBondContact O-CG 3.47Å; Q113-K117 PolarHBondContact O-N 3.31Å
114	A	93.8	Very high	93.1	Very high	4 Å²	4	43.6 Å²	43.6	3%	0.033	22%	0.218	C	C	.	.	H	α-helix	trans	-66.1	-50.6	179.2	0	0	0	0	0	112	K110 M111 G116 K117 A118 I251 F255 L374	K110-A114 PolarHBondContact O-N 3.26Å; M111-A114 PolarHBondContact O-N 3.43Å; A114-G116 VanDerWaalsContact C-N 3.31Å; A114-G116 PolarHBondContact O-N 2.86Å; A114-K117 WeakPolarHBondContact O-CB 3.45Å; A114-K117 PolarHBondContact O-N 3.4Å; A114-A118 PolarHBondContact O-N 3.5Å; A114-A118 VanDerWaalsContact O-N 3.09Å; A114-I251 WeakPolarHBondContact O-CD1 3.5Å; A114-F255 HydrophobicContact CB-CE2 3.73Å; A114-F255 HydrophobicContact CB-CZ 4.15Å; A114-L374 HydrophobicContact CB-CD1 4.43Å
115	T	95.3	Very high	93.2	Very high	46 Å²	46	42.1 Å²	42.1	28%	0.282	21%	0.21	S	C	.	.	H	α-helix	trans	-59.2	-42.6	174.6	-60.8	0	0	0	0	111.1	L97 M111 K117 A118 L119	L97-T115 HydrophobicContact CD1-CG2 3.85Å; M111-T115 WeakPolarHBondContact O-CB 3.25Å; M111-T115 PolarHBondContact O-N 3.1Å; M111-T115 PolarHBondContact O-OG1 3.41Å; M111-T115 VanDerWaalsContact O-OG1 3.09Å; T115-K117 PolarHBondContact O-N 3.39Å; T115-A118 PolarHBondContact O-N 3.34Å; T115-A118 VanDerWaalsContact O-N 3.12Å; T115-L119 HydrophobicContact CG2-CD1 4.38Å; T115-L119 HydrophobicContact CG2-CG 4.37Å; T115-L119 WeakPolarHBondContact O-CG 3.34Å; T115-L119 PolarHBondContact O-N 3.01Å
116	G	96.4	Very high	93.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.2	-38.3	177.9	0	0	0	0	0	113.7	G94 M112 A114 A118 C120	G94-G116 WeakPolarHBondContact CA-O 3.23Å; G94-G116 VanDerWaalsContact O-CA 3.31Å; G94-G116 WeakPolarHBondContact O-CA 3.37Å; M112-G116 PolarHBondContact O-N 3.38Å; A114-G116 VanDerWaalsContact C-N 3.31Å; A114-G116 PolarHBondContact O-N 2.86Å; G116-A118 VanDerWaalsContact C-N 3.34Å; G116-C120 PolarHBondContact O-N 3Å; G116-C120 VanDerWaalsContact O-N 3.11Å; G116-C120 PolarHBondContact O-SG 3.19Å; G116-C120 VanDerWaalsContact O-SG 3.38Å
117	K	95.3	Very high	93.8	Very high	62 Å²	62	30.3 Å²	30.3	27%	0.27	15%	0.151	S	C	.	.	H	α-helix	trans	-59.4	-43.4	169.2	-78.1	-179.2	178	-180	0	111.6	Q113 A114 T115 C120 F121 N375 F378	Q113-K117 WeakPolarHBondContact O-CG 3.47Å; Q113-K117 PolarHBondContact O-N 3.31Å; A114-K117 WeakPolarHBondContact O-CB 3.45Å; A114-K117 PolarHBondContact O-N 3.4Å; T115-K117 PolarHBondContact O-N 3.39Å; K117-C120 WeakPolarHBondContact O-CB 3.47Å; K117-C120 PolarHBondContact O-N 3.43Å; K117-F121 PolarHBondContact O-N 3.41Å; K117-N375 PolarHBondContact NZ-OD1 3.39Å; K117-F378 HydrophobicContact CB-CD1 4.35Å; K117-F378 HydrophobicContact CB-CD2 4.38Å; K117-F378 HydrophobicContact CB-CE1 3.79Å; K117-F378 HydrophobicContact CB-CE2 3.85Å; K117-F378 HydrophobicContact CB-CZ 3.52Å; K117-F378 HydrophobicContact CD-CD2 3.78Å; K117-F378 HydrophobicContact CD-CE2 3.69Å; K117-F378 HydrophobicContact CD-CG 4.45Å; K117-F378 HydrophobicContact CD-CZ 4.26Å; K117-F378 HydrophobicContact CG-CE2 4.46Å
118	A	95.6	Very high	94.1	Very high	5 Å²	5	29.3 Å²	29.3	4%	0.041	15%	0.154	C	C	.	.	H	α-helix	trans	-71.3	-35.5	-179.5	0	0	0	0	0	114.2	A114 T115 G116 F121 S122 T247 I251 F378	A114-A118 PolarHBondContact O-N 3.5Å; A114-A118 VanDerWaalsContact O-N 3.09Å; T115-A118 PolarHBondContact O-N 3.34Å; T115-A118 VanDerWaalsContact O-N 3.12Å; G116-A118 VanDerWaalsContact C-N 3.34Å; A118-F121 PolarHBondContact O-N 3.02Å; A118-S122 VanDerWaalsContact O-CB 3.23Å; A118-S122 WeakPolarHBondContact O-CB 3.4Å; A118-S122 PolarHBondContact O-N 3.15Å; A118-T247 HydrophobicContact CB-CG2 3.79Å; A118-I251 HydrophobicContact CB-CD1 3.37Å; A118-F378 HydrophobicContact CB-CE1 4.05Å; A118-F378 HydrophobicContact CB-CZ 4.23Å
119	L	96.3	Very high	94.5	Very high	28 Å²	28	27.6 Å²	27.6	15%	0.147	14%	0.14	C	C	.	.	H	α-helix	trans	-65.7	-42.1	172.7	-68.4	-176.3	0	0	0	111.3	E90 L93 L97 T115 S123 M248	E90-L119 HydrophobicContact CG-CB 4.02Å; E90-L119 HydrophobicContact CG-CD2 4.12Å; L93-L119 HydrophobicContact CB-CD1 4.48Å; L93-L119 HydrophobicContact CD2-CD1 3.84Å; L93-L119 HydrophobicContact CG-CD1 3.79Å; L97-L119 HydrophobicContact CD1-CD1 3.84Å; T115-L119 HydrophobicContact CG2-CD1 4.38Å; T115-L119 HydrophobicContact CG2-CG 4.37Å; T115-L119 WeakPolarHBondContact O-CG 3.34Å; T115-L119 PolarHBondContact O-N 3.01Å; L119-S123 WeakPolarHBondContact O-CB 3.48Å; L119-S123 PolarHBondContact O-N 3.05Å; L119-S123 PolarHBondContact O-OG 3.44Å; L119-M248 HydrophobicContact CD2-CE 4.32Å
120	C	96.1	Very high	94.6	Very high	8 Å²	8	30.8 Å²	30.8	5%	0.054	15%	0.152	C	C	.	.	H	α-helix	trans	-54.5	-58.7	168	-70	0	0	0	0	110.3	N91 G116 K117 S122 S123 Q124	N91-C120 PolarHBondContact OD1-SG 3.42Å; G116-C120 PolarHBondContact O-N 3Å; G116-C120 VanDerWaalsContact O-N 3.11Å; G116-C120 PolarHBondContact O-SG 3.19Å; G116-C120 VanDerWaalsContact O-SG 3.38Å; K117-C120 WeakPolarHBondContact O-CB 3.47Å; K117-C120 PolarHBondContact O-N 3.43Å; C120-S122 PolarHBondContact O-N 3.2Å; C120-S123 WeakPolarHBondContact O-CB 3.44Å; C120-S123 PolarHBondContact O-N 3.43Å; C120-S123 PolarHBondContact O-OG 3.5Å; C120-Q124 VanDerWaalsContact O-CG 3.31Å; C120-Q124 WeakPolarHBondContact O-CG 3.49Å; C120-Q124 PolarHBondContact O-N 3.05Å
121	F	95.1	Very high	94.8	Very high	13 Å²	13	31.6 Å²	31.6	6%	0.057	16%	0.159	C	C	.	.	H	α-helix	trans	-54.6	-45.3	-179.3	173.8	-105.4	0	0	0	113.9	K117 A118 S123 Q124 Q125 K243 T247	K117-F121 PolarHBondContact O-N 3.41Å; A118-F121 PolarHBondContact O-N 3.02Å; F121-S123 VanDerWaalsContact C-N 3.35Å; F121-S123 PolarHBondContact O-N 3.05Å; F121-Q124 PolarHBondContact O-N 3.38Å; F121-Q125 HydrophobicContact CD1-CG 4.41Å; F121-Q125 HydrophobicContact CD2-CG 4.09Å; F121-Q125 HydrophobicContact CE1-CG 4.01Å; F121-Q125 HydrophobicContact CE2-CG 3.64Å; F121-Q125 HydrophobicContact CG-CG 4.46Å; F121-Q125 HydrophobicContact CZ-CG 3.6Å; F121-Q125 WeakPolarHBondContact O-CB 3.29Å; F121-Q125 WeakPolarHBondContact O-CG 3.47Å; F121-Q125 PolarHBondContact O-N 3.06Å; F121-K243 HydrophobicContact CE1-CB 4.26Å; F121-K243 HydrophobicContact CZ-CB 4.23Å; F121-K243 HydrophobicContact CZ-CD 4.42Å; F121-T247 HydrophobicContact CD1-CG2 4.18Å; F121-T247 VanDerWaalsContact CE1-OG1 3.27Å; F121-T247 WeakPolarHBondContact CE1-OG1 3.25Å
122	S	96.4	Very high	95.1	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.014	15%	0.145	C	C	.	.	H	α-helix	trans	-54.6	-48.7	173.1	171.6	0	0	0	0	111.5	E90 A118 C120 Q124 Q125 R126	E90-S122 VanDerWaalsContact CD-OG 3.29Å; E90-S122 VanDerWaalsContact OE1-CB 3.23Å; E90-S122 WeakPolarHBondContact OE1-CB 3.36Å; E90-S122 PolarHBondContact OE1-OG 3.2Å; E90-S122 PolarHBondContact OE2-OG 3.34Å; A118-S122 VanDerWaalsContact O-CB 3.23Å; A118-S122 WeakPolarHBondContact O-CB 3.4Å; A118-S122 PolarHBondContact O-N 3.15Å; C120-S122 PolarHBondContact O-N 3.2Å; S122-Q124 VanDerWaalsContact C-N 3.33Å; S122-Q124 PolarHBondContact O-N 2.92Å; S122-Q125 PolarHBondContact O-N 3.32Å; S122-R126 PolarHBondContact O-N 2.98Å; S122-R126 PolarHBondContact OG-NH2 3.05Å
123	S	96.6	Very high	95.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-63.2	-39	-179.7	79.2	0	0	0	0	112.7	S87 E90 N91 L119 C120 F121	S87-S123 VanDerWaalsContact CB-O 3.3Å; S87-S123 WeakPolarHBondContact CB-O 3.25Å; S87-S123 VanDerWaalsContact O-CB 3.27Å; S87-S123 WeakPolarHBondContact O-CB 3.18Å; S87-S123 PolarHBondContact OG-O 3.01Å; E90-S123 WeakPolarHBondContact OE2-CA 3.3Å; E90-S123 WeakPolarHBondContact OE2-CB 3.45Å; E90-S123 PolarHBondContact OE2-N 3.06Å; N91-S123 WeakPolarHBondContact CB-OG 3.19Å; L119-S123 WeakPolarHBondContact O-CB 3.48Å; L119-S123 PolarHBondContact O-N 3.05Å; L119-S123 PolarHBondContact O-OG 3.44Å; C120-S123 WeakPolarHBondContact O-CB 3.44Å; C120-S123 PolarHBondContact O-N 3.43Å; C120-S123 PolarHBondContact O-OG 3.5Å; F121-S123 VanDerWaalsContact C-N 3.35Å; F121-S123 PolarHBondContact O-N 3.05Å
124	Q	92.8	Very high	95.3	Very high	49 Å²	49	24.4 Å²	24.4	23%	0.229	13%	0.13	C	C	.	.	H	α-helix	trans	-65.9	-52.1	175.7	-60.8	-178	-30	0	0	110.5	C120 F121 S122 R126 L127 F388	C120-Q124 VanDerWaalsContact O-CG 3.31Å; C120-Q124 WeakPolarHBondContact O-CG 3.49Å; C120-Q124 PolarHBondContact O-N 3.05Å; F121-Q124 PolarHBondContact O-N 3.38Å; S122-Q124 VanDerWaalsContact C-N 3.33Å; S122-Q124 PolarHBondContact O-N 2.92Å; Q124-R126 PolarHBondContact O-N 2.74Å; Q124-L127 WeakPolarHBondContact O-CB 3.19Å; Q124-L127 PolarHBondContact O-N 2.81Å; Q124-F388 HydrophobicContact CB-CD2 4.06Å; Q124-F388 HydrophobicContact CB-CE1 4.03Å; Q124-F388 HydrophobicContact CB-CE2 3.51Å; Q124-F388 HydrophobicContact CB-CZ 3.48Å; Q124-F388 VanDerWaalsContact CB-CZ 3.48Å; Q124-F388 HydrophobicContact CG-CD1 4.09Å; Q124-F388 HydrophobicContact CG-CE1 3.45Å; Q124-F388 VanDerWaalsContact CG-CE1 3.45Å; Q124-F388 HydrophobicContact CG-CE2 3.91Å; Q124-F388 HydrophobicContact CG-CZ 3.32Å
125	Q	93.8	Very high	95.5	Very high	19 Å²	19	32.1 Å²	32.1	9%	0.089	16%	0.158	C	C	.	.	H	α-helix	trans	-60.9	-29.8	180	-78.2	-61.3	137.2	0	0	113.3	F121 S122 A128 F240 K243	F121-Q125 HydrophobicContact CD1-CG 4.41Å; F121-Q125 HydrophobicContact CD2-CG 4.09Å; F121-Q125 HydrophobicContact CE1-CG 4.01Å; F121-Q125 HydrophobicContact CE2-CG 3.64Å; F121-Q125 HydrophobicContact CG-CG 4.46Å; F121-Q125 HydrophobicContact CZ-CG 3.6Å; F121-Q125 WeakPolarHBondContact O-CB 3.29Å; F121-Q125 WeakPolarHBondContact O-CG 3.47Å; F121-Q125 PolarHBondContact O-N 3.06Å; S122-Q125 PolarHBondContact O-N 3.32Å; Q125-A128 WeakPolarHBondContact O-CB 3.46Å; Q125-F240 HydrophobicContact CB-CD2 3.98Å; Q125-K243 HydrophobicContact CG-CD 4.48Å
126	R	95.5	Very high	95.7	Very high	24 Å²	24	30.2 Å²	30.2	9%	0.091	15%	0.146	C	C	.	.	H	α-helix	trans	-70	-29.6	174.5	-166.1	-171.9	-59.3	102.8	6.9	112.9	I83 S87 E90 S122 Q124 A128 L129 F240	I83-R126 HydrophobicContact CG2-CG 4.18Å; S87-R126 PolarHBondContact OG-NH1 3.02Å; S87-R126 VanDerWaalsContact OG-NH1 3.08Å; E90-R126 IonicContact OE1-NH2 3.56Å; E90-R126 PolarHBondContact OE1-NH2 2.8Å; E90-R126 IonicContact OE2-CZ 2.86Å; E90-R126 IonicContact OE2-NH1 3.61Å; E90-R126 PolarHBondContact OE2-NH1 3.15Å; E90-R126 IonicContact OE2-NH2 3.09Å; E90-R126 PolarHBondContact OE2-NH2 3.15Å; S122-R126 PolarHBondContact O-N 2.98Å; S122-R126 PolarHBondContact OG-NH2 3.05Å; Q124-R126 PolarHBondContact O-N 2.74Å; R126-A128 PolarHBondContact O-N 3.48Å; R126-L129 HydrophobicContact CG-CD1 3.85Å; R126-L129 VanDerWaalsContact O-CB 3.26Å; R126-L129 WeakPolarHBondContact O-CB 3.4Å; R126-L129 VanDerWaalsContact O-CG 3.25Å; R126-L129 WeakPolarHBondContact O-CG 3.21Å; R126-L129 PolarHBondContact O-N 3.32Å; R126-L129 VanDerWaalsContact O-N 3.13Å; R126-F240 HydrophobicContact CB-CD2 4Å; R126-F240 HydrophobicContact CB-CE2 3.61Å; R126-F240 HydrophobicContact CB-CZ 4.05Å; R126-F240 HydrophobicContact CG-CE2 4.19Å; R126-F240 HydrophobicContact CG-CZ 4.16Å
127	L	94.3	Very high	95.8	Very high	5 Å²	5	32 Å²	32	3%	0.026	15%	0.154	C	C	.	.	H	α-helix	trans	-67.8	-24.7	179.6	-70.6	172.4	0	0	0	112.8	I83 Q124 L129 R130 F388 W392 F396	I83-L127 HydrophobicContact CG2-CD2 4.32Å; Q124-L127 WeakPolarHBondContact O-CB 3.19Å; Q124-L127 PolarHBondContact O-N 2.81Å; L127-L129 PolarHBondContact O-N 3.2Å; L127-L129 VanDerWaalsContact O-N 3.07Å; L127-R130 HydrophobicContact CD2-CG 4.45Å; L127-R130 VanDerWaalsContact O-CB 3.25Å; L127-R130 WeakPolarHBondContact O-CB 3.4Å; L127-R130 WeakPolarHBondContact O-CG 3.38Å; L127-R130 PolarHBondContact O-N 3.3Å; L127-F388 HydrophobicContact CD1-CE2 4.15Å; L127-F388 HydrophobicContact CD1-CZ 4.06Å; L127-W392 HydrophobicContact CD1-CE3 3.35Å; L127-W392 HydrophobicContact CD1-CZ3 3.47Å; L127-W392 VanDerWaalsContact CD1-CZ3 3.47Å; L127-F396 HydrophobicContact CD1-CE2 4.1Å
128	A	92.6	Very high	95.9	Very high	33 Å²	33	33.2 Å²	33.2	27%	0.273	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-23.7	171.8	0	0	0	0	0	113.1	Q125 R126 R130 N131 P132 T236	Q125-A128 WeakPolarHBondContact O-CB 3.46Å; R126-A128 PolarHBondContact O-N 3.48Å; A128-R130 PolarHBondContact O-N 3.4Å; A128-N131 PolarHBondContact O-N 3.2Å; A128-P132 WeakPolarHBondContact O-CD 3.46Å; A128-T236 HydrophobicContact CB-CG2 4.49Å
129	L	95.4	Very high	96	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-21.9	173.4	-56.6	175.2	0	0	0	113.2	I83 R126 L127 N131 P132 L133 T236 L237 F240	I83-L129 HydrophobicContact CD1-CB 4.19Å; I83-L129 HydrophobicContact CD1-CD1 4.38Å; R126-L129 HydrophobicContact CG-CD1 3.85Å; R126-L129 VanDerWaalsContact O-CB 3.26Å; R126-L129 WeakPolarHBondContact O-CB 3.4Å; R126-L129 VanDerWaalsContact O-CG 3.25Å; R126-L129 WeakPolarHBondContact O-CG 3.21Å; R126-L129 PolarHBondContact O-N 3.32Å; R126-L129 VanDerWaalsContact O-N 3.13Å; L127-L129 PolarHBondContact O-N 3.2Å; L127-L129 VanDerWaalsContact O-N 3.07Å; L129-N131 VanDerWaalsContact C-N 3.3Å; L129-N131 PolarHBondContact O-N 3.42Å; L129-P132 WeakPolarHBondContact O-CD 3.32Å; L129-P132 WeakPolarHBondContact O-CG 3.43Å; L129-L133 HydrophobicContact CB-CD1 4.37Å; L129-L133 WeakPolarHBondContact O-CB 3.18Å; L129-L133 WeakPolarHBondContact O-CD1 3.32Å; L129-L133 WeakPolarHBondContact O-CG 3.34Å; L129-L133 PolarHBondContact O-N 3.23Å; L129-T236 HydrophobicContact CD2-CG2 3.88Å; L129-L237 HydrophobicContact CD1-CD1 3.83Å; L129-L237 HydrophobicContact CD2-CB 4.13Å; L129-L237 HydrophobicContact CD2-CD1 4.15Å; L129-F240 HydrophobicContact CD1-CD1 4.37Å; L129-F240 HydrophobicContact CD2-CB 4.35Å
130	R	95.3	Very high	96.1	Very high	68 Å²	68	35.3 Å²	35.3	26%	0.257	17%	0.169	S	C	.	.	H	α-helix	trans	-64.1	-35.6	178.6	-64.5	179.9	72	-108	7	111.8	I83 C84 L127 A128 L133 C134 V395	I83-R130 HydrophobicContact CG2-CG 4.15Å; C84-R130 PolarHBondContact SG-NE 3.07Å; L127-R130 HydrophobicContact CD2-CG 4.45Å; L127-R130 VanDerWaalsContact O-CB 3.25Å; L127-R130 WeakPolarHBondContact O-CB 3.4Å; L127-R130 WeakPolarHBondContact O-CG 3.38Å; L127-R130 PolarHBondContact O-N 3.3Å; A128-R130 PolarHBondContact O-N 3.4Å; R130-L133 PolarHBondContact O-N 3.39Å; R130-C134 WeakPolarHBondContact O-CB 3.34Å; R130-C134 PolarHBondContact O-N 3.1Å; R130-V395 VanDerWaalsContact NH1-CG2 3.27Å
131	N	94	Very high	96.2	Very high	80 Å²	80	37.6 Å²	37.6	43%	0.428	18%	0.179	S	C	.	.	H	α-helix	trans	-62.8	-53.3	-177.7	-71.4	-25.2	0	0	0	113.3	A128 L129 R135 E391	A128-N131 PolarHBondContact O-N 3.2Å; L129-N131 VanDerWaalsContact C-N 3.3Å; L129-N131 PolarHBondContact O-N 3.42Å; N131-R135 WeakPolarHBondContact O-CG 3.3Å; N131-R135 PolarHBondContact O-N 3.42Å; N131-E391 PolarHBondContact ND2-OE1 3.45Å
132	P	97.2	Very high	96.3	Very high	15 Å²	15	40.1 Å²	40.1	10%	0.097	20%	0.196	C	C	.	.	H	α-helix	trans	-67.5	-33.9	173.6	26.8	-34.6	0	0	0	113	A128 L129 R135 F136 T232 T236	A128-P132 WeakPolarHBondContact O-CD 3.46Å; L129-P132 WeakPolarHBondContact O-CD 3.32Å; L129-P132 WeakPolarHBondContact O-CG 3.43Å; P132-R135 PolarHBondContact O-N 3.01Å; P132-F136 VanDerWaalsContact O-CB 3.3Å; P132-F136 WeakPolarHBondContact O-CB 3.32Å; P132-F136 PolarHBondContact O-N 3.07Å; P132-T232 HydrophobicContact CB-CG2 4.19Å; P132-T236 HydrophobicContact CG-CG2 4.33Å
133	L	97.4	Very high	96.4	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-66.9	-38.6	177.1	-71.9	170.3	0	0	0	112.8	I76 Y79 Q80 I83 L129 R130 F136 H137 Y233	I76-L133 HydrophobicContact CG2-CB 4.27Å; I76-L133 HydrophobicContact CG2-CD2 4.25Å; I76-L133 VanDerWaalsContact CG2-O 3.32Å; I76-L133 WeakPolarHBondContact CG2-O 3.36Å; Y79-L133 HydrophobicContact CD1-CD1 3.64Å; Y79-L133 HydrophobicContact CD1-CD2 3.96Å; Y79-L133 HydrophobicContact CD1-CG 4.49Å; Y79-L133 HydrophobicContact CE1-CD1 3.68Å; Y79-L133 HydrophobicContact CE1-CD2 4.19Å; Q80-L133 HydrophobicContact CG-CB 3.63Å; Q80-L133 HydrophobicContact CG-CD1 4Å; Q80-L133 HydrophobicContact CG-CG 4.44Å; I83-L133 HydrophobicContact CD1-CD1 3.4Å; I83-L133 VanDerWaalsContact CD1-CD1 3.4Å; L129-L133 HydrophobicContact CB-CD1 4.37Å; L129-L133 WeakPolarHBondContact O-CB 3.18Å; L129-L133 WeakPolarHBondContact O-CD1 3.32Å; L129-L133 WeakPolarHBondContact O-CG 3.34Å; L129-L133 PolarHBondContact O-N 3.23Å; R130-L133 PolarHBondContact O-N 3.39Å; L133-F136 PolarHBondContact O-N 3.13Å; L133-H137 WeakPolarHBondContact O-CB 3.16Å; L133-H137 PolarHBondContact O-N 3.34Å; L133-Y233 HydrophobicContact CD1-CD2 4.47Å; L133-Y233 HydrophobicContact CD1-CE2 4.15Å; L133-Y233 HydrophobicContact CD2-CD2 3.63Å; L133-Y233 HydrophobicContact CD2-CE2 3.72Å; L133-Y233 HydrophobicContact CD2-CG 4.19Å; L133-Y233 HydrophobicContact CG-CD2 3.81Å; L133-Y233 HydrophobicContact CG-CE2 3.96Å
134	C	96.9	Very high	96.5	Very high	46 Å²	46	42.9 Å²	42.9	31%	0.311	21%	0.206	S	C	.	.	H	α-helix	trans	-64.3	-44.9	176.4	-176.2	0	0	0	0	110.7	R130 H137 Q138	R130-C134 WeakPolarHBondContact O-CB 3.34Å; R130-C134 PolarHBondContact O-N 3.1Å; C134-H137 PolarHBondContact O-N 2.69Å; C134-Q138 VanDerWaalsContact O-CG 3.32Å; C134-Q138 WeakPolarHBondContact O-CG 3.5Å; C134-Q138 PolarHBondContact O-N 3.44Å
135	R	97.8	Very high	96.7	Very high	166 Å²	166	45.6 Å²	45.6	63%	0.626	22%	0.218	S	C	*	.	H	α-helix	trans	-61.2	-47.6	173.1	-65.9	-66.4	179.5	157.4	-0.3	111.6	N131 P132 H137 Q138 E139	N131-R135 WeakPolarHBondContact O-CG 3.3Å; N131-R135 PolarHBondContact O-N 3.42Å; P132-R135 PolarHBondContact O-N 3.01Å; R135-H137 VanDerWaalsContact C-N 3.29Å; R135-H137 PolarHBondContact O-N 2.96Å; R135-Q138 PolarHBondContact O-N 3.44Å; R135-Q138 VanDerWaalsContact O-N 3.17Å; R135-E139 WeakPolarHBondContact O-CB 3.47Å; R135-E139 VanDerWaalsContact O-CG 3.27Å; R135-E139 WeakPolarHBondContact O-CG 3.48Å; R135-E139 PolarHBondContact O-N 3.25Å
136	F	98.2	Very high	96.9	Very high	6 Å²	6	53.9 Å²	53.9	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-58.8	-39.8	177.6	-175.2	-161.4	0	0	0	112.2	L72 I76 P132 L133 V140 L226 M229 L230	L72-F136 HydrophobicContact CD1-CE1 4.46Å; L72-F136 HydrophobicContact CD1-CZ 4.22Å; L72-F136 HydrophobicContact CD2-CE2 4.26Å; L72-F136 HydrophobicContact CD2-CZ 3.96Å; L72-F136 HydrophobicContact CG-CZ 4.45Å; I76-F136 HydrophobicContact CD1-CD1 3.61Å; I76-F136 HydrophobicContact CD1-CD2 4.15Å; I76-F136 HydrophobicContact CD1-CE1 3.71Å; I76-F136 HydrophobicContact CD1-CE2 4.23Å; I76-F136 HydrophobicContact CD1-CG 3.84Å; I76-F136 HydrophobicContact CD1-CZ 4.04Å; I76-F136 HydrophobicContact CG1-CD1 4.16Å; I76-F136 HydrophobicContact CG1-CE1 4.26Å; P132-F136 VanDerWaalsContact O-CB 3.3Å; P132-F136 WeakPolarHBondContact O-CB 3.32Å; P132-F136 PolarHBondContact O-N 3.07Å; L133-F136 PolarHBondContact O-N 3.13Å; F136-V140 HydrophobicContact CD2-CG2 3.78Å; F136-V140 HydrophobicContact CE2-CG2 3.58Å; F136-V140 WeakPolarHBondContact O-CG2 3.48Å; F136-V140 PolarHBondContact O-N 3.44Å; F136-L226 HydrophobicContact CE2-CD2 3.81Å; F136-L226 HydrophobicContact CZ-CD2 3.93Å; F136-M229 HydrophobicContact CB-CB 4.07Å; F136-M229 HydrophobicContact CD2-CB 3.36Å; F136-M229 HydrophobicContact CD2-CG 4Å; F136-M229 HydrophobicContact CE2-CB 3.9Å; F136-M229 HydrophobicContact CG-CB 3.78Å; F136-L230 HydrophobicContact CE1-CD2 3.53Å; F136-L230 HydrophobicContact CE1-CG 4.26Å; F136-L230 HydrophobicContact CZ-CD2 3.71Å; F136-L230 HydrophobicContact CZ-CG 4.02Å
137	H	98.3	Very high	97	Very high	38 Å²	38	54.3 Å²	54.3	18%	0.176	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-51.1	173	179.4	64.6	0	0	0	112.3	S73 I76 V77 L133 C134 R135 E139 V140 E141	S73-H137 PolarHBondContact O-ND1 3.47Å; S73-H137 PolarHBondContact OG-CE1 3.46Å; S73-H137 PolarHBondContact OG-ND1 2.97Å; I76-H137 HydrophobicContact CB-CB 4.47Å; I76-H137 HydrophobicContact CG2-CB 3.81Å; V77-H137 WeakPolarHBondContact CG2-CE1 3.21Å; L133-H137 WeakPolarHBondContact O-CB 3.16Å; L133-H137 PolarHBondContact O-N 3.34Å; C134-H137 PolarHBondContact O-N 2.69Å; R135-H137 VanDerWaalsContact C-N 3.29Å; R135-H137 PolarHBondContact O-N 2.96Å; H137-E139 VanDerWaalsContact C-N 3.25Å; H137-E139 PolarHBondContact O-N 3.18Å; H137-V140 PolarHBondContact O-N 2.94Å; H137-E141 WeakPolarHBondContact O-CB 3.25Å; H137-E141 WeakPolarHBondContact O-CG 3.22Å; H137-E141 PolarHBondContact O-N 3.45Å
138	Q	97.9	Very high	97.2	Very high	88 Å²	88	54.3 Å²	54.3	41%	0.411	26%	0.258	S	S	.	.	H	α-helix	trans	-57	-37.7	178.5	-71.2	168.4	-4.1	0	0	112.8	C134 R135 T142	C134-Q138 VanDerWaalsContact O-CG 3.32Å; C134-Q138 WeakPolarHBondContact O-CG 3.5Å; C134-Q138 PolarHBondContact O-N 3.44Å; R135-Q138 PolarHBondContact O-N 3.44Å; R135-Q138 VanDerWaalsContact O-N 3.17Å; Q138-T142 VanDerWaalsContact O-CB 3.32Å; Q138-T142 WeakPolarHBondContact O-CB 3.26Å; Q138-T142 PolarHBondContact O-N 3.46Å; Q138-T142 PolarHBondContact O-OG1 3.1Å
139	E	98.2	Very high	97.5	Very high	76 Å²	76	55.2 Å²	55.2	36%	0.355	26%	0.262	S	S	.	.	H	α-helix	trans	-71.8	-44.5	179.1	-72.6	-66.9	158.4	0	0	112	R135 H137 T142 F143 L225 M229	R135-E139 WeakPolarHBondContact O-CB 3.47Å; R135-E139 VanDerWaalsContact O-CG 3.27Å; R135-E139 WeakPolarHBondContact O-CG 3.48Å; R135-E139 PolarHBondContact O-N 3.25Å; H137-E139 VanDerWaalsContact C-N 3.25Å; H137-E139 PolarHBondContact O-N 3.18Å; E139-T142 PolarHBondContact O-N 3.26Å; E139-F143 WeakPolarHBondContact O-CB 3.33Å; E139-F143 PolarHBondContact O-N 3.03Å; E139-L225 HydrophobicContact CB-CD1 4.1Å; E139-M229 HydrophobicContact CB-CE 4.36Å; E139-M229 HydrophobicContact CB-CG 4.36Å; E139-M229 HydrophobicContact CG-CE 3.71Å; E139-M229 HydrophobicContact CG-SD 4.11Å
140	V	98.4	Very high	97.6	Very high	1 Å²	1	59 Å²	59	1%	0.006	28%	0.282	C	S	.	.	H	α-helix	trans	-65.7	-38.1	173.5	174.1	0	0	0	0	111.6	C69 L72 I76 F136 H137 R144 L225	C69-V140 HydrophobicContact CB-CG1 4.43Å; C69-V140 WeakPolarHBondContact O-CG1 3Å; L72-V140 HydrophobicContact CD2-CG2 4.06Å; I76-V140 HydrophobicContact CD1-CG2 4.49Å; F136-V140 HydrophobicContact CD2-CG2 3.78Å; F136-V140 HydrophobicContact CE2-CG2 3.58Å; F136-V140 WeakPolarHBondContact O-CG2 3.48Å; F136-V140 PolarHBondContact O-N 3.44Å; H137-V140 PolarHBondContact O-N 2.94Å; V140-R144 WeakPolarHBondContact O-CB 3.21Å; V140-R144 VanDerWaalsContact O-CG 3.29Å; V140-R144 WeakPolarHBondContact O-CG 3.32Å; V140-R144 PolarHBondContact O-N 3.15Å; V140-L225 HydrophobicContact CG2-CD2 4.46Å
141	E	97.9	Very high	97.8	Very high	56 Å²	56	56 Å²	56	26%	0.262	27%	0.271	S	S	.	.	H	α-helix	trans	-61	-46.9	172.1	-74.3	-91.2	102.9	0	0	111.5	S73 H137 R144 H145	S73-E141 PolarHBondContact OG-OE1 3.47Å; H137-E141 WeakPolarHBondContact O-CB 3.25Å; H137-E141 WeakPolarHBondContact O-CG 3.22Å; H137-E141 PolarHBondContact O-N 3.45Å; E141-R144 PolarHBondContact O-N 2.8Å; E141-R144 IonicContact OE1-CZ 3.12Å; E141-R144 IonicContact OE1-NH1 2.69Å; E141-R144 PolarHBondContact OE1-NH1 2.88Å; E141-H145 WeakPolarHBondContact O-CB 3.4Å; E141-H145 PolarHBondContact O-N 2.98Å; E141-H145 PolarHBondContact O-ND1 3.39Å; E141-H145 IonicContact OE1-CE1 3.9Å; E141-H145 IonicContact OE2-CE1 2.67Å
142	T	97.9	Very high	98	Very high	66 Å²	66	57.4 Å²	57.4	41%	0.405	27%	0.271	S	S	.	.	H	α-helix	trans	-65.5	-43.5	-180	-61.5	0	0	0	0	111.3	Q138 E139 R144 H145 R146	Q138-T142 VanDerWaalsContact O-CB 3.32Å; Q138-T142 WeakPolarHBondContact O-CB 3.26Å; Q138-T142 PolarHBondContact O-N 3.46Å; Q138-T142 PolarHBondContact O-OG1 3.1Å; E139-T142 PolarHBondContact O-N 3.26Å; T142-R144 PolarHBondContact O-N 2.88Å; T142-H145 PolarHBondContact O-N 3.07Å; T142-R146 WeakPolarHBondContact O-CB 3.29Å; T142-R146 PolarHBondContact O-N 3.04Å
143	F	98.4	Very high	98	Very high	13 Å²	13	60.8 Å²	60.8	6%	0.057	29%	0.288	C	S	.	.	H	α-helix	trans	-58.8	-45.8	174	178.9	-99.7	0	0	0	112	I65 E139 A147 I148 L218 R222 L225	I65-F143 HydrophobicContact CG2-CE1 4.22Å; E139-F143 WeakPolarHBondContact O-CB 3.33Å; E139-F143 PolarHBondContact O-N 3.03Å; F143-A147 HydrophobicContact CD2-CB 3.97Å; F143-A147 HydrophobicContact CE2-CB 4.02Å; F143-A147 WeakPolarHBondContact O-CB 3.27Å; F143-A147 PolarHBondContact O-N 3.04Å; F143-I148 HydrophobicContact CD1-CD1 3.96Å; F143-I148 HydrophobicContact CD1-CG1 4.04Å; F143-I148 HydrophobicContact CE1-CD1 3.75Å; F143-I148 HydrophobicContact CE1-CG1 3.77Å; F143-I148 HydrophobicContact CZ-CG1 4.42Å; F143-I148 PolarHBondContact O-N 3.46Å; F143-L218 HydrophobicContact CE1-CD1 4.21Å; F143-L218 HydrophobicContact CE2-CD1 3.75Å; F143-L218 HydrophobicContact CZ-CD1 3.41Å; F143-L218 VanDerWaalsContact CZ-CD1 3.41Å; F143-L218 HydrophobicContact CZ-CG 3.84Å; F143-R222 HydrophobicContact CE1-CB 4.14Å; F143-R222 HydrophobicContact CE1-CG 4.41Å; F143-R222 HydrophobicContact CE2-CB 4.41Å; F143-R222 HydrophobicContact CZ-CB 3.72Å; F143-R222 HydrophobicContact CZ-CG 4.47Å; F143-L225 HydrophobicContact CB-CD2 3.62Å; F143-L225 HydrophobicContact CD1-CD2 4.43Å; F143-L225 HydrophobicContact CD2-CD2 4.21Å; F143-L225 HydrophobicContact CG-CD2 3.84Å
144	R	98.1	Very high	98.1	Very high	47 Å²	47	61.2 Å²	61.2	18%	0.177	29%	0.29	C	S	.	.	I	π-helix	trans	-60.5	-56.8	175	-78.3	175.4	58.3	-126	-18.4	112.1	C69 V140 E141 T142 R146 I148 S149	C69-R144 HydrophobicContact CB-CG 3.89Å; V140-R144 WeakPolarHBondContact O-CB 3.21Å; V140-R144 VanDerWaalsContact O-CG 3.29Å; V140-R144 WeakPolarHBondContact O-CG 3.32Å; V140-R144 PolarHBondContact O-N 3.15Å; E141-R144 PolarHBondContact O-N 2.8Å; E141-R144 IonicContact OE1-CZ 3.12Å; E141-R144 IonicContact OE1-NH1 2.69Å; E141-R144 PolarHBondContact OE1-NH1 2.88Å; T142-R144 PolarHBondContact O-N 2.88Å; R144-R146 VanDerWaalsContact C-N 3.28Å; R144-R146 PolarHBondContact O-N 2.76Å; R144-I148 HydrophobicContact CB-CD1 4.4Å; R144-I148 HydrophobicContact CG-CD1 3.88Å; R144-I148 WeakPolarHBondContact O-CB 3.31Å; R144-S149 PolarHBondContact O-N 3.15Å; R144-S149 PolarHBondContact O-OG 3.2Å
145	H	97.9	Very high	98.1	Very high	105 Å²	105	59.2 Å²	59.2	49%	0.486	28%	0.277	S	S	.	.	I	π-helix	trans	-70.8	-21.4	-171.4	-66.2	116.5	0	0	0	113.5	E141 T142 S149	E141-H145 WeakPolarHBondContact O-CB 3.4Å; E141-H145 PolarHBondContact O-N 2.98Å; E141-H145 PolarHBondContact O-ND1 3.39Å; E141-H145 IonicContact OE1-CE1 3.9Å; E141-H145 IonicContact OE2-CE1 2.67Å; T142-H145 PolarHBondContact O-N 3.07Å; H145-S149 VanDerWaalsContact C-OG 3.26Å; H145-S149 VanDerWaalsContact O-CB 3.3Å; H145-S149 WeakPolarHBondContact O-CB 3.45Å; H145-S149 PolarHBondContact O-OG 3.19Å
146	R	97.9	Very high	98.1	Very high	193 Å²	193	54.3 Å²	54.3	73%	0.728	26%	0.263	S	S	*	.	I	π-helix	trans	-104.5	-67.7	176.8	-61.9	-174.5	174.1	-169.2	-2.4	113.3	T142 R144 S149 D150	T142-R146 WeakPolarHBondContact O-CB 3.29Å; T142-R146 PolarHBondContact O-N 3.04Å; R144-R146 VanDerWaalsContact C-N 3.28Å; R144-R146 PolarHBondContact O-N 2.76Å; R146-S149 PolarHBondContact O-N 3.06Å; R146-D150 PolarHBondContact O-N 3.29Å
147	A	97.9	Very high	98.1	Very high	33 Å²	33	61.7 Å²	61.7	27%	0.273	29%	0.29	S	S	.	.	I	π-helix	trans	-72.1	-41.8	-168.5	0	0	0	0	0	112.9	F143 T151 L218	F143-A147 HydrophobicContact CD2-CB 3.97Å; F143-A147 HydrophobicContact CE2-CB 4.02Å; F143-A147 WeakPolarHBondContact O-CB 3.27Å; F143-A147 PolarHBondContact O-N 3.04Å; A147-T151 WeakPolarHBondContact O-CB 3.46Å; A147-T151 PolarHBondContact O-N 3.09Å; A147-T151 PolarHBondContact O-OG1 2.77Å; A147-L218 HydrophobicContact CB-CD1 3.62Å
148	I	98.3	Very high	98.1	Very high	6 Å²	6	59.9 Å²	59.9	3%	0.031	28%	0.282	C	S	.	.	I	π-helix	trans	-69.4	-40.6	176.1	-50.2	-174.1	0	0	0	110.1	F62 I65 Q66 C69 F143 R144 T151 W152 L218	F62-I148 HydrophobicContact CE2-CG2 3.81Å; F62-I148 HydrophobicContact CZ-CG2 3.95Å; I65-I148 HydrophobicContact CG2-CD1 4.13Å; Q66-I148 HydrophobicContact CB-CG2 3.89Å; Q66-I148 HydrophobicContact CG-CG2 3.96Å; C69-I148 HydrophobicContact CB-CD1 4.06Å; F143-I148 HydrophobicContact CD1-CD1 3.96Å; F143-I148 HydrophobicContact CD1-CG1 4.04Å; F143-I148 HydrophobicContact CE1-CD1 3.75Å; F143-I148 HydrophobicContact CE1-CG1 3.77Å; F143-I148 HydrophobicContact CZ-CG1 4.42Å; F143-I148 PolarHBondContact O-N 3.46Å; R144-I148 HydrophobicContact CB-CD1 4.4Å; R144-I148 HydrophobicContact CG-CD1 3.88Å; R144-I148 WeakPolarHBondContact O-CB 3.31Å; I148-T151 PolarHBondContact O-N 2.84Å; I148-W152 WeakPolarHBondContact O-CB 3.4Å; I148-W152 PolarHBondContact O-N 3.07Å; I148-L218 HydrophobicContact CG1-CD1 4.13Å; I148-L218 HydrophobicContact CG1-CD2 4.33Å
149	S	98.3	Very high	98	Very high	51 Å²	51	57.6 Å²	57.6	36%	0.357	27%	0.272	S	S	.	.	H	α-helix	trans	-59.8	-46.5	176.3	-55.7	0	0	0	0	113.9	R144 H145 R146 T151 W152 L153	R144-S149 PolarHBondContact O-N 3.15Å; R144-S149 PolarHBondContact O-OG 3.2Å; H145-S149 VanDerWaalsContact C-OG 3.26Å; H145-S149 VanDerWaalsContact O-CB 3.3Å; H145-S149 WeakPolarHBondContact O-CB 3.45Å; H145-S149 PolarHBondContact O-OG 3.19Å; R146-S149 PolarHBondContact O-N 3.06Å; S149-T151 VanDerWaalsContact C-N 3.35Å; S149-W152 WeakPolarHBondContact O-CB 3.4Å; S149-W152 PolarHBondContact O-N 2.91Å; S149-L153 WeakPolarHBondContact O-CG 3.33Å; S149-L153 PolarHBondContact O-N 3.36Å
150	D	98.1	Very high	97.9	Very high	80 Å²	80	59.1 Å²	59.1	43%	0.428	28%	0.279	S	S	.	.	H	α-helix	trans	-65.2	-38.7	176.8	166.9	71	0	0	0	112.1	R146 L153 T154 K214	R146-D150 PolarHBondContact O-N 3.29Å; D150-L153 PolarHBondContact O-N 3.15Å; D150-T154 PolarHBondContact O-N 3.36Å; D150-T154 PolarHBondContact O-OG1 3.26Å; D150-K214 IonicContact OD1-NZ 2.72Å; D150-K214 PolarHBondContact OD1-NZ 3.24Å; D150-K214 WeakPolarHBondContact OD2-CE 3.34Å; D150-K214 IonicContact OD2-NZ 2.98Å; D150-K214 PolarHBondContact OD2-NZ 2.72Å
151	T	98.3	Very high	97.8	Very high	5 Å²	5	59.9 Å²	59.9	3%	0.031	28%	0.284	C	S	.	.	H	α-helix	trans	-64.1	-44	174	-53.5	0	0	0	0	110.6	F62 A147 I148 S149 L153 T154 V155 K214 V215 L218	F62-T151 HydrophobicContact CD2-CG2 3.59Å; F62-T151 HydrophobicContact CE2-CG2 3.48Å; F62-T151 VanDerWaalsContact CE2-CG2 3.48Å; F62-T151 HydrophobicContact CZ-CG2 4.36Å; A147-T151 WeakPolarHBondContact O-CB 3.46Å; A147-T151 PolarHBondContact O-N 3.09Å; A147-T151 PolarHBondContact O-OG1 2.77Å; I148-T151 PolarHBondContact O-N 2.84Å; S149-T151 VanDerWaalsContact C-N 3.35Å; T151-L153 PolarHBondContact O-N 3.4Å; T151-T154 CarbonylContact O-C 3.54Å; T151-T154 WeakPolarHBondContact O-CA 3.33Å; T151-T154 WeakPolarHBondContact O-CB 3.32Å; T151-T154 PolarHBondContact O-N 2.86Å; T151-V155 HydrophobicContact CG2-CG2 4.44Å; T151-V155 WeakPolarHBondContact O-CG2 3.25Å; T151-V155 PolarHBondContact O-N 3.39Å; T151-K214 HydrophobicContact CG2-CB 4.12Å; T151-V215 HydrophobicContact CG2-CG2 3.99Å; T151-L218 HydrophobicContact CG2-CD2 4.2Å
152	W	98.3	Very high	97.7	Very high	111 Å²	111	57.8 Å²	57.8	42%	0.42	27%	0.273	S	S	.	.	H	α-helix	trans	-58.6	-44.8	176.3	-175.1	79	0	0	0	112.8	F62 I148 S149 T154 V155 N156	F62-W152 HydrophobicContact CE1-CB 4.48Å; F62-W152 HydrophobicContact CZ-CB 3.89Å; I148-W152 WeakPolarHBondContact O-CB 3.4Å; I148-W152 PolarHBondContact O-N 3.07Å; S149-W152 WeakPolarHBondContact O-CB 3.4Å; S149-W152 PolarHBondContact O-N 2.91Å; W152-T154 PolarHBondContact O-N 2.98Å; W152-V155 PolarHBondContact O-N 3.39Å; W152-N156 WeakPolarHBondContact CH2-ND2 3.31Å; W152-N156 WeakPolarHBondContact CZ2-ND2 3.3Å; W152-N156 VanDerWaalsContact CZ3-ND2 3.28Å; W152-N156 WeakPolarHBondContact CZ3-ND2 3.34Å; W152-N156 PolarHBondContact O-N 3.25Å
153	L	98.2	Very high	97.5	Very high	86 Å²	86	56 Å²	56	45%	0.45	26%	0.263	S	S	.	.	H	α-helix	trans	-60.8	-29.4	174.6	-71.2	173	0	0	0	112.6	S149 D150 T151 R157	S149-L153 WeakPolarHBondContact O-CG 3.33Å; S149-L153 PolarHBondContact O-N 3.36Å; D150-L153 PolarHBondContact O-N 3.15Å; T151-L153 PolarHBondContact O-N 3.4Å; L153-R157 WeakPolarHBondContact O-CD 3.27Å; L153-R157 WeakPolarHBondContact O-CG 3.41Å
154	T	97.9	Very high	97.3	Very high	13 Å²	13	57 Å²	57	8%	0.08	27%	0.267	C	S	.	.	H	α-helix	trans	-79.4	-42.7	177	-46.3	0	0	0	0	111	D150 T151 W152 N156 R157 M158 D210 V211 K214	D150-T154 PolarHBondContact O-N 3.36Å; D150-T154 PolarHBondContact O-OG1 3.26Å; T151-T154 CarbonylContact O-C 3.54Å; T151-T154 WeakPolarHBondContact O-CA 3.33Å; T151-T154 WeakPolarHBondContact O-CB 3.32Å; T151-T154 PolarHBondContact O-N 2.86Å; W152-T154 PolarHBondContact O-N 2.98Å; T154-N156 PolarHBondContact O-N 3.5Å; T154-R157 PolarHBondContact O-N 2.87Å; T154-M158 WeakPolarHBondContact O-CB 3.3Å; T154-M158 PolarHBondContact O-N 3.39Å; T154-D210 HydrophobicContact CG2-CB 4.41Å; T154-V211 HydrophobicContact CG2-CG2 4.03Å; T154-K214 HydrophobicContact CG2-CD 4.12Å; T154-K214 PolarHBondContact OG1-NZ 3.34Å
155	V	98.3	Very high	97.2	Very high	4 Å²	4	56.5 Å²	56.5	2%	0.024	27%	0.266	C	S	.	.	H	α-helix	trans	-57.3	-45.6	173.1	166.7	0	0	0	0	111.4	L59 F62 T151 W152 R157 M158 E159 V211	L59-V155 HydrophobicContact CD2-CB 4.4Å; L59-V155 HydrophobicContact CD2-CG1 3.6Å; L59-V155 HydrophobicContact CD2-CG2 3.94Å; F62-V155 HydrophobicContact CD1-CG2 4.14Å; F62-V155 HydrophobicContact CE1-CG2 4.28Å; F62-V155 HydrophobicContact CG-CG2 4.45Å; T151-V155 HydrophobicContact CG2-CG2 4.44Å; T151-V155 WeakPolarHBondContact O-CG2 3.25Å; T151-V155 PolarHBondContact O-N 3.39Å; W152-V155 PolarHBondContact O-N 3.39Å; V155-R157 PolarHBondContact O-N 3.08Å; V155-M158 WeakPolarHBondContact O-CB 3.39Å; V155-M158 PolarHBondContact O-N 2.91Å; V155-E159 PolarHBondContact O-N 3.22Å; V155-V211 HydrophobicContact CG2-CG1 3.9Å; V155-V211 HydrophobicContact CG2-CG2 4.1Å
156	N	97.8	Very high	97	Very high	63 Å²	63	52.1 Å²	52.1	34%	0.337	25%	0.245	S	C	.	.	H	α-helix	trans	-62.7	-40.6	178.8	-72.4	-9.4	0	0	0	113	W152 T154 M158 E159 Q160	W152-N156 WeakPolarHBondContact CH2-ND2 3.31Å; W152-N156 WeakPolarHBondContact CZ2-ND2 3.3Å; W152-N156 VanDerWaalsContact CZ3-ND2 3.28Å; W152-N156 WeakPolarHBondContact CZ3-ND2 3.34Å; W152-N156 PolarHBondContact O-N 3.25Å; T154-N156 PolarHBondContact O-N 3.5Å; N156-M158 VanDerWaalsContact C-N 3.32Å; N156-E159 PolarHBondContact O-N 2.88Å; N156-Q160 PolarHBondContact O-N 3.36Å
157	R	98	Very high	96.8	Very high	160 Å²	160	43 Å²	43	60%	0.604	21%	0.21	S	C	*	.	H	α-helix	trans	-65.1	-39.1	175.6	-70.3	170.1	-177.6	180	2.1	111.2	L153 T154 V155 Q160 C161 L207	L153-R157 WeakPolarHBondContact O-CD 3.27Å; L153-R157 WeakPolarHBondContact O-CG 3.41Å; T154-R157 PolarHBondContact O-N 2.87Å; V155-R157 PolarHBondContact O-N 3.08Å; R157-Q160 PolarHBondContact O-N 3.46Å; R157-C161 PolarHBondContact O-N 3.09Å; R157-L207 HydrophobicContact CB-CD1 4.37Å
158	M	97.9	Very high	96.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.2	-46.4	174.5	-176.9	-70	-56.8	0	0	111.2	L55 L59 T154 V155 N156 Q160 C161 R162 F204 L207 V211	L55-M158 HydrophobicContact CD1-CE 4Å; L55-M158 HydrophobicContact CD1-SD 4.11Å; L55-M158 HydrophobicContact CD2-CE 4.22Å; L55-M158 HydrophobicContact CD2-SD 3.59Å; L55-M158 VanDerWaalsContact CD2-SD 3.59Å; L55-M158 HydrophobicContact CG-CE 4.44Å; L55-M158 HydrophobicContact CG-SD 4.36Å; L59-M158 HydrophobicContact CD1-CE 3.88Å; L59-M158 HydrophobicContact CD2-CE 3.96Å; L59-M158 HydrophobicContact CG-CE 4.41Å; T154-M158 WeakPolarHBondContact O-CB 3.3Å; T154-M158 PolarHBondContact O-N 3.39Å; V155-M158 WeakPolarHBondContact O-CB 3.39Å; V155-M158 PolarHBondContact O-N 2.91Å; N156-M158 VanDerWaalsContact C-N 3.32Å; M158-Q160 VanDerWaalsContact C-N 3.32Å; M158-Q160 PolarHBondContact O-N 3.36Å; M158-C161 CarbonylContact O-C 3.58Å; M158-C161 PolarHBondContact O-N 3.45Å; M158-R162 WeakPolarHBondContact O-CB 3.38Å; M158-R162 PolarHBondContact O-N 3.21Å; M158-R162 HydrophobicContact SD-CB 4.4Å; M158-F204 HydrophobicContact SD-CD2 4.36Å; M158-F204 HydrophobicContact SD-CE2 3.8Å; M158-L207 HydrophobicContact CB-CB 3.9Å; M158-L207 HydrophobicContact CG-CB 4.02Å; M158-V211 HydrophobicContact CB-CG2 3.6Å; M158-V211 HydrophobicContact CG-CB 4.41Å; M158-V211 HydrophobicContact CG-CG2 3.84Å
159	E	96.4	Very high	96.4	Very high	41 Å²	41	43.7 Å²	43.7	19%	0.192	21%	0.211	C	C	.	.	H	α-helix	trans	-61.2	-37	175.6	-81.2	-70.3	179.6	0	0	112.9	K38 L59 V155 N156 R162 T163	K38-E159 IonicContact NZ-OE1 3.27Å; K38-E159 IonicContact NZ-OE2 2.81Å; K38-E159 PolarHBondContact NZ-OE2 3.17Å; L59-E159 WeakPolarHBondContact CD1-OE1 3.45Å; V155-E159 PolarHBondContact O-N 3.22Å; N156-E159 PolarHBondContact O-N 2.88Å; E159-R162 PolarHBondContact O-N 3.36Å; E159-R162 IonicContact OE1-CZ 2.74Å; E159-R162 IonicContact OE1-NE 3.93Å; E159-R162 IonicContact OE1-NH2 3.85Å; E159-R162 PolarHBondContact OE1-NH2 2.98Å; E159-R162 IonicContact OE2-CZ 3.93Å; E159-R162 IonicContact OE2-NE 3.83Å; E159-R162 PolarHBondContact OE2-NE 3.11Å; E159-R162 IonicContact OE2-NH2 3.72Å; E159-R162 PolarHBondContact OE2-NH2 3.49Å; E159-T163 WeakPolarHBondContact O-CB 3.17Å; E159-T163 PolarHBondContact O-N 2.9Å; E159-T163 PolarHBondContact O-OG1 3.34Å
160	Q	95.3	Very high	96.1	Very high	108 Å²	108	43.3 Å²	43.3	51%	0.505	21%	0.205	S	C	.	.	H	α-helix	trans	-60.9	-54.8	171.3	-173.4	-173	-32.2	0	0	110.2	N156 R157 M158 R162 T163 E164	N156-Q160 PolarHBondContact O-N 3.36Å; R157-Q160 PolarHBondContact O-N 3.46Å; M158-Q160 VanDerWaalsContact C-N 3.32Å; M158-Q160 PolarHBondContact O-N 3.36Å; Q160-R162 VanDerWaalsContact C-N 3.26Å; Q160-R162 PolarHBondContact O-N 3.4Å; Q160-T163 CarbonylContact O-C 3.59Å; Q160-T163 WeakPolarHBondContact O-CA 3.48Å; Q160-T163 WeakPolarHBondContact O-CB 3.32Å; Q160-T163 PolarHBondContact O-N 3.01Å; Q160-E164 HydrophobicContact CG-CG 4.44Å; Q160-E164 PolarHBondContact NE2-OE1 3Å; Q160-E164 WeakPolarHBondContact O-CG 3.48Å; Q160-E164 PolarHBondContact O-N 2.81Å
161	C	96	Very high	95.8	Very high	17 Å²	17	39.9 Å²	39.9	12%	0.115	19%	0.186	C	C	.	.	H	α-helix	trans	-65.3	-26.4	179.4	-70.2	0	0	0	0	113.7	R157 M158 E164 Y165 F204 L207	R157-C161 PolarHBondContact O-N 3.09Å; M158-C161 CarbonylContact O-C 3.58Å; M158-C161 PolarHBondContact O-N 3.45Å; C161-E164 PolarHBondContact SG-OE2 3.37Å; C161-E164 VanDerWaalsContact SG-OE2 3.33Å; C161-Y165 VanDerWaalsContact O-CB 3.29Å; C161-Y165 WeakPolarHBondContact O-CB 3.46Å; C161-Y165 PolarHBondContact O-N 2.92Å; C161-F204 HydrophobicContact CB-CB 4.41Å; C161-L207 HydrophobicContact CB-CD1 4.06Å
162	R	95.7	Very high	95.5	Very high	11 Å²	11	41.8 Å²	41.8	4%	0.042	20%	0.195	C	C	.	.	H	α-helix	trans	-62.8	-45.5	169	-174.6	157	84.2	143	-18.6	111.1	D52 D56 M158 E159 Q160 R166 F204	D52-R162 IonicContact OD2-NH1 2.67Å; D56-R162 VanDerWaalsContact CG-NH1 3.27Å; D56-R162 IonicContact OD1-CZ 3.72Å; D56-R162 VanDerWaalsContact OD1-CZ 3.27Å; D56-R162 IonicContact OD1-NH1 2.63Å; D56-R162 PolarHBondContact OD1-NH1 2.92Å; D56-R162 IonicContact OD1-NH2 2.78Å; D56-R162 PolarHBondContact OD1-NH2 3.05Å; D56-R162 IonicContact OD2-CZ 3.03Å; D56-R162 IonicContact OD2-NH1 2.84Å; D56-R162 PolarHBondContact OD2-NH1 3.2Å; D56-R162 IonicContact OD2-NH2 2.69Å; M158-R162 WeakPolarHBondContact O-CB 3.38Å; M158-R162 PolarHBondContact O-N 3.21Å; M158-R162 HydrophobicContact SD-CB 4.4Å; E159-R162 PolarHBondContact O-N 3.36Å; E159-R162 IonicContact OE1-CZ 2.74Å; E159-R162 IonicContact OE1-NE 3.93Å; E159-R162 IonicContact OE1-NH2 3.85Å; E159-R162 PolarHBondContact OE1-NH2 2.98Å; E159-R162 IonicContact OE2-CZ 3.93Å; E159-R162 IonicContact OE2-NE 3.83Å; E159-R162 PolarHBondContact OE2-NE 3.11Å; E159-R162 IonicContact OE2-NH2 3.72Å; E159-R162 PolarHBondContact OE2-NH2 3.49Å; Q160-R162 VanDerWaalsContact C-N 3.26Å; Q160-R162 PolarHBondContact O-N 3.4Å; R162-R166 WeakPolarHBondContact O-CB 3.32Å; R162-R166 VanDerWaalsContact O-CG 3.32Å; R162-R166 WeakPolarHBondContact O-CG 3.42Å; R162-R166 PolarHBondContact O-N 3.31Å; R162-F204 HydrophobicContact CB-CD2 3.83Å; R162-F204 HydrophobicContact CB-CE2 3.57Å; R162-F204 HydrophobicContact CB-CZ 4.36Å; R162-F204 HydrophobicContact CG-CD2 4.42Å; R162-F204 HydrophobicContact CG-CE2 3.77Å; R162-F204 HydrophobicContact CG-CZ 4.09Å
163	T	94.3	Very high	95.1	Very high	29 Å²	29	41 Å²	41	18%	0.178	19%	0.194	C	C	.	.	H	α-helix	trans	-67.5	-40.9	177	-52.7	0	0	0	0	111.3	Q34 A35 E159 Q160 G167	Q34-T163 HydrophobicContact CG-CG2 4.05Å; A35-T163 HydrophobicContact CB-CG2 4.19Å; E159-T163 WeakPolarHBondContact O-CB 3.17Å; E159-T163 PolarHBondContact O-N 2.9Å; E159-T163 PolarHBondContact O-OG1 3.34Å; Q160-T163 CarbonylContact O-C 3.59Å; Q160-T163 WeakPolarHBondContact O-CA 3.48Å; Q160-T163 WeakPolarHBondContact O-CB 3.32Å; Q160-T163 PolarHBondContact O-N 3.01Å; T163-G167 PolarHBondContact O-N 3.37Å
164	E	94.3	Very high	94.7	Very high	34 Å²	34	39.1 Å²	39.1	16%	0.159	19%	0.185	C	C	.	.	H	α-helix	trans	-62.7	-45	174.5	-66.7	170.5	169.9	0	0	112.2	E31 Q160 C161 A168	E31-E164 HydrophobicContact CG-CB 4.46Å; E31-E164 HydrophobicContact CG-CG 4.08Å; Q160-E164 HydrophobicContact CG-CG 4.44Å; Q160-E164 PolarHBondContact NE2-OE1 3Å; Q160-E164 WeakPolarHBondContact O-CG 3.48Å; Q160-E164 PolarHBondContact O-N 2.81Å; C161-E164 PolarHBondContact SG-OE2 3.37Å; C161-E164 VanDerWaalsContact SG-OE2 3.33Å; E164-A168 WeakPolarHBondContact O-CB 3.38Å; E164-A168 PolarHBondContact O-N 3.46Å
165	Y	95.9	Very high	94.2	Very high	36 Å²	36	38.7 Å²	38.7	14%	0.141	18%	0.182	C	C	.	.	H	α-helix	trans	-65.1	-47	176.5	172.6	-126.4	0	0	0	112.2	C161 G167 A168 L169 V197 A200 K201 F204	C161-Y165 VanDerWaalsContact O-CB 3.29Å; C161-Y165 WeakPolarHBondContact O-CB 3.46Å; C161-Y165 PolarHBondContact O-N 2.92Å; Y165-G167 PolarHBondContact O-N 3.42Å; Y165-A168 PolarHBondContact O-N 3.14Å; Y165-L169 HydrophobicContact CD1-CD1 4.42Å; Y165-L169 HydrophobicContact CD2-CD1 4.48Å; Y165-L169 HydrophobicContact CD2-CG 4.26Å; Y165-L169 HydrophobicContact CE1-CD1 3.89Å; Y165-L169 HydrophobicContact CE2-CD1 3.95Å; Y165-L169 HydrophobicContact CE2-CD2 4Å; Y165-L169 HydrophobicContact CE2-CG 3.85Å; Y165-L169 WeakPolarHBondContact O-CG 3.5Å; Y165-L169 PolarHBondContact O-N 2.85Å; Y165-V197 HydrophobicContact CE2-CG1 4.14Å; Y165-A200 HydrophobicContact CD2-CB 4.46Å; Y165-K201 HydrophobicContact CD2-CB 3.73Å; Y165-K201 HydrophobicContact CD2-CG 4.13Å; Y165-K201 HydrophobicContact CE1-CG 4.26Å; Y165-K201 HydrophobicContact CE2-CB 3.49Å; Y165-K201 VanDerWaalsContact CE2-CB 3.49Å; Y165-K201 HydrophobicContact CE2-CD 4.14Å; Y165-K201 HydrophobicContact CE2-CG 3.59Å; Y165-F204 AromaticContact CD1-CD1 3.6Å; Y165-F204 HydrophobicContact CD1-CD1 3.6Å; Y165-F204 HydrophobicContact CD1-CE1 4.05Å; Y165-F204 HydrophobicContact CD1-CG 4.26Å; Y165-F204 HydrophobicContact CE1-CD1 4.09Å; Y165-F204 HydrophobicContact CE1-CE1 4.34Å; Y165-F204 HydrophobicContact CG-CD1 4.33Å
166	R	94.5	Very high	93.7	Very high	14 Å²	14	41.2 Å²	41.2	5%	0.053	20%	0.2	C	C	.	.	H	α-helix	trans	-63.6	-39.9	176.8	-72.5	177.4	167.7	-142.1	-0.3	112.3	Q34 E44 V48 D52 R162 L169 L170	Q34-R166 HydrophobicContact CG-CB 3.74Å; E44-R166 IonicContact OE1-NH1 3.13Å; E44-R166 PolarHBondContact OE1-NH1 3.16Å; E44-R166 IonicContact OE2-CZ 2.62Å; E44-R166 IonicContact OE2-NH1 3.69Å; E44-R166 PolarHBondContact OE2-NH1 3.42Å; V48-R166 HydrophobicContact CG1-CG 3.89Å; D52-R166 IonicContact OD2-CZ 2.69Å; D52-R166 VanDerWaalsContact OD2-CZ 3.32Å; D52-R166 IonicContact OD2-NE 3.96Å; D52-R166 PolarHBondContact OD2-NE 3.48Å; D52-R166 VanDerWaalsContact OD2-NE 3.09Å; D52-R166 IonicContact OD2-NH2 3.94Å; D52-R166 PolarHBondContact OD2-NH2 3.12Å; R162-R166 WeakPolarHBondContact O-CB 3.32Å; R162-R166 VanDerWaalsContact O-CG 3.32Å; R162-R166 WeakPolarHBondContact O-CG 3.42Å; R162-R166 PolarHBondContact O-N 3.31Å; R166-L169 WeakPolarHBondContact O-CB 3.38Å; R166-L169 PolarHBondContact O-N 3.43Å; R166-L170 PolarHBondContact O-N 2.93Å
167	G	93.3	Very high	93	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.6	-43	172.6	0	0	0	0	0	112.6	T163 Y165 L169 L170 W171	T163-G167 PolarHBondContact O-N 3.37Å; Y165-G167 PolarHBondContact O-N 3.42Å; G167-L169 VanDerWaalsContact C-N 3.33Å; G167-L169 PolarHBondContact O-N 2.94Å; G167-L170 PolarHBondContact O-N 3.4Å; G167-W171 PolarHBondContact O-N 3.01Å
168	A	94	Very high	91.9	Very high	10 Å²	10	43 Å²	43	8%	0.083	21%	0.213	C	C	.	.	H	α-helix	trans	-64.8	-34.6	174.2	0	0	0	0	0	112.8	E164 Y165 W171 M172 V197 A200	E164-A168 WeakPolarHBondContact O-CB 3.38Å; E164-A168 PolarHBondContact O-N 3.46Å; Y165-A168 PolarHBondContact O-N 3.14Å; A168-W171 PolarHBondContact O-N 3.35Å; A168-M172 WeakPolarHBondContact O-CB 3.5Å; A168-M172 PolarHBondContact O-N 3.43Å; A168-V197 HydrophobicContact CB-CG2 3.78Å; A168-V197 VanDerWaalsContact O-CG2 3.22Å; A168-V197 WeakPolarHBondContact O-CG2 3.48Å; A168-A200 HydrophobicContact CB-CB 4.43Å
169	L	93.2	Very high	90.9	Very high	44 Å²	44	45.3 Å²	45.3	23%	0.23	23%	0.225	C	C	.	.	H	α-helix	trans	-65.6	-43.1	172.5	-72.7	176.3	0	0	0	112.1	V48 Y165 R166 G167 W171 M172 K173 V197	V48-L169 HydrophobicContact CG1-CD1 4.35Å; V48-L169 HydrophobicContact CG2-CD1 4.04Å; Y165-L169 HydrophobicContact CD1-CD1 4.42Å; Y165-L169 HydrophobicContact CD2-CD1 4.48Å; Y165-L169 HydrophobicContact CD2-CG 4.26Å; Y165-L169 HydrophobicContact CE1-CD1 3.89Å; Y165-L169 HydrophobicContact CE2-CD1 3.95Å; Y165-L169 HydrophobicContact CE2-CD2 4Å; Y165-L169 HydrophobicContact CE2-CG 3.85Å; Y165-L169 WeakPolarHBondContact O-CG 3.5Å; Y165-L169 PolarHBondContact O-N 2.85Å; R166-L169 WeakPolarHBondContact O-CB 3.38Å; R166-L169 PolarHBondContact O-N 3.43Å; G167-L169 VanDerWaalsContact C-N 3.33Å; G167-L169 PolarHBondContact O-N 2.94Å; L169-W171 VanDerWaalsContact C-N 3.34Å; L169-W171 PolarHBondContact O-N 3.18Å; L169-M172 PolarHBondContact O-N 2.65Å; L169-K173 WeakPolarHBondContact O-CB 3.46Å; L169-K173 PolarHBondContact O-N 3.43Å; L169-V197 HydrophobicContact CD2-CG1 3.81Å
170	L	91.6	Very high	89.8	Confident	43 Å²	43	46.6 Å²	46.6	23%	0.225	23%	0.233	C	C	.	.	H	α-helix	trans	-59.4	-45.3	173.5	-71.4	-177.6	0	0	0	111.3	W30 Q34 I37 R166 G167 M172 K173 D174	W30-L170 HydrophobicContact CE3-CB 3.82Å; W30-L170 HydrophobicContact CZ3-CB 3.98Å; Q34-L170 HydrophobicContact CB-CD1 4.19Å; Q34-L170 VanDerWaalsContact OE1-CD1 3.31Å; I37-L170 HydrophobicContact CD1-CD1 3.65Å; R166-L170 PolarHBondContact O-N 2.93Å; G167-L170 PolarHBondContact O-N 3.4Å; L170-M172 VanDerWaalsContact C-N 3.31Å; L170-M172 PolarHBondContact O-N 2.92Å; L170-K173 WeakPolarHBondContact O-CB 3.35Å; L170-K173 PolarHBondContact O-N 2.88Å; L170-D174 WeakPolarHBondContact O-CB 3.45Å; L170-D174 PolarHBondContact O-N 3.22Å
171	W	92.6	Very high	88.8	Confident	9 Å²	9	46 Å²	46	3%	0.034	24%	0.239	C	C	.	.	H	α-helix	trans	-61.5	-37.8	175.9	-168.8	13.8	0	0	0	112.5	Q26 Q27 W30 G167 A168 L169 V175 V193	Q26-W171 HydrophobicContact CB-CH2 3.71Å; Q26-W171 HydrophobicContact CB-CZ2 3.59Å; Q26-W171 HydrophobicContact CB-CZ3 4.49Å; Q26-W171 HydrophobicContact CG-CZ2 4.34Å; Q27-W171 HydrophobicContact CB-CZ3 4.34Å; W30-W171 HydrophobicContact CB-CB 4.2Å; W30-W171 AromaticContact CD1-CD1 3.57Å; W30-W171 AromaticContact CD1-CD2 3.51Å; W30-W171 AromaticContact CD1-CE2 3.93Å; W30-W171 AromaticContact CD1-CG 3.29Å; W30-W171 AromaticContact CD1-NE1 3.93Å; W30-W171 HydrophobicContact CD2-CB 3.75Å; W30-W171 HydrophobicContact CD2-CG 4.13Å; W30-W171 AromaticContact CE2-CD1 3.61Å; W30-W171 AromaticContact CE2-CG 3.88Å; W30-W171 HydrophobicContact CE3-CB 4.38Å; W30-W171 HydrophobicContact CG-CB 3.61Å; W30-W171 HydrophobicContact CG-CD2 4.31Å; W30-W171 AromaticContact CG-CG 3.84Å; W30-W171 HydrophobicContact CG-CG 3.84Å; W30-W171 AromaticContact NE1-CD1 3.1Å; W30-W171 AromaticContact NE1-CD2 3.86Å; W30-W171 AromaticContact NE1-CE2 3.95Å; W30-W171 AromaticContact NE1-CG 3.35Å; W30-W171 AromaticContact NE1-NE1 3.49Å; G167-W171 PolarHBondContact O-N 3.01Å; A168-W171 PolarHBondContact O-N 3.35Å; L169-W171 VanDerWaalsContact C-N 3.34Å; L169-W171 PolarHBondContact O-N 3.18Å; W171-V175 WeakPolarHBondContact O-CB 3.49Å; W171-V175 VanDerWaalsContact O-CG2 3.29Å; W171-V175 WeakPolarHBondContact O-CG2 3.34Å; W171-V175 PolarHBondContact O-N 3.07Å; W171-V193 HydrophobicContact CB-CG1 4.02Å; W171-V193 HydrophobicContact CD2-CB 4.41Å; W171-V193 HydrophobicContact CD2-CG1 3.82Å; W171-V193 HydrophobicContact CD2-CG2 3.69Å; W171-V193 VanDerWaalsContact CE2-CG2 3.44Å; W171-V193 HydrophobicContact CE3-CG1 4.11Å; W171-V193 HydrophobicContact CE3-CG2 4.18Å; W171-V193 HydrophobicContact CG-CG1 3.77Å; W171-V193 HydrophobicContact CG-CG2 4.14Å; W171-V193 HydrophobicContact CH2-CG2 4.24Å; W171-V193 HydrophobicContact CZ2-CG2 3.74Å; W171-V193 HydrophobicContact CZ3-CG2 4.44Å
172	M	92	Very high	87.8	Confident	45 Å²	45	52.4 Å²	52.4	22%	0.222	27%	0.272	C	S	.	.	H	α-helix	trans	-70.3	-34.9	176.5	-173.4	172.2	166.3	0	0	112.3	A168 L169 L170 S176 F190 V193 Q194 V197	A168-M172 WeakPolarHBondContact O-CB 3.5Å; A168-M172 PolarHBondContact O-N 3.43Å; L169-M172 PolarHBondContact O-N 2.65Å; L170-M172 VanDerWaalsContact C-N 3.31Å; L170-M172 PolarHBondContact O-N 2.92Å; M172-S176 VanDerWaalsContact O-CB 3.24Å; M172-S176 WeakPolarHBondContact O-CB 3.43Å; M172-S176 PolarHBondContact O-N 3.21Å; M172-S176 PolarHBondContact O-OG 3.26Å; M172-F190 HydrophobicContact CE-CE2 3.95Å; M172-F190 HydrophobicContact CE-CZ 3.67Å; M172-F190 HydrophobicContact CG-CE2 4.03Å; M172-V193 HydrophobicContact CB-CG1 3.9Å; M172-Q194 HydrophobicContact CE-CB 4.44Å; M172-Q194 HydrophobicContact CE-CG 3.91Å; M172-Q194 HydrophobicContact SD-CB 4.38Å; M172-Q194 HydrophobicContact SD-CG 4.19Å; M172-V197 HydrophobicContact CB-CG2 3.87Å; M172-V197 HydrophobicContact CG-CG2 4.46Å; M172-V197 HydrophobicContact SD-CB 4.25Å; M172-V197 HydrophobicContact SD-CG1 4.29Å; M172-V197 HydrophobicContact SD-CG2 3.9Å
173	K	90.6	Very high	87	Confident	93 Å²	93	56 Å²	56	40%	0.404	29%	0.292	S	S	.	.	H	α-helix	trans	-65.4	-51.9	175.7	-170.8	171.6	-173	169.6	0	110.7	D45 L169 L170 S176 Q177	D45-K173 IonicContact OD2-NZ 3.8Å; D45-K173 PolarHBondContact OD2-NZ 3.46Å; L169-K173 WeakPolarHBondContact O-CB 3.46Å; L169-K173 PolarHBondContact O-N 3.43Å; L170-K173 WeakPolarHBondContact O-CB 3.35Å; L170-K173 PolarHBondContact O-N 2.88Å; K173-S176 PolarHBondContact O-N 3.4Å; K173-S176 VanDerWaalsContact O-N 3.15Å; K173-S176 PolarHBondContact O-OG 3.28Å; K173-Q177 WeakPolarHBondContact O-CG 3.5Å; K173-Q177 PolarHBondContact O-N 3.05Å; K173-Q177 VanDerWaalsContact O-N 3.15Å
174	D	89.3	Confident	86.1	Confident	48 Å²	48	62.7 Å²	62.7	26%	0.257	32%	0.315	S	S	.	.	H	α-helix	trans	-49.2	-60.7	172.3	174.1	89.8	0	0	0	112	W30 L170 S176 Q177 E178	W30-D174 HydrophobicContact CH2-CB 3.54Å; W30-D174 WeakPolarHBondContact CH2-OD1 3.42Å; W30-D174 HydrophobicContact CZ2-CB 3.86Å; W30-D174 WeakPolarHBondContact CZ2-OD2 3.43Å; W30-D174 HydrophobicContact CZ3-CB 4.34Å; L170-D174 WeakPolarHBondContact O-CB 3.45Å; L170-D174 PolarHBondContact O-N 3.22Å; D174-S176 PolarHBondContact O-N 2.84Å; D174-S176 VanDerWaalsContact O-N 3.1Å; D174-Q177 PolarHBondContact O-N 3.01Å; D174-E178 PolarHBondContact O-N 3.38Å
175	V	87.8	Confident	85.3	Confident	3 Å²	3	69.9 Å²	69.9	2%	0.018	35%	0.346	C	S	.	.	H	α-helix	trans	-66.7	-16.6	-179.2	178.7	0	0	0	0	113.4	W171 K189 F190 V193	W171-V175 WeakPolarHBondContact O-CB 3.49Å; W171-V175 VanDerWaalsContact O-CG2 3.29Å; W171-V175 WeakPolarHBondContact O-CG2 3.34Å; W171-V175 PolarHBondContact O-N 3.07Å; V175-K189 HydrophobicContact CG1-CB 4.42Å; V175-K189 HydrophobicContact CG1-CD 3.83Å; V175-K189 HydrophobicContact CG1-CG 3.9Å; V175-K189 HydrophobicContact CG2-CD 4.17Å; V175-K189 VanDerWaalsContact CG2-CE 3.47Å; V175-K189 HydrophobicContact CG2-CG 4.48Å; V175-F190 HydrophobicContact CG1-CB 4.13Å; V175-F190 HydrophobicContact CG1-CD2 4.26Å; V175-V193 HydrophobicContact CG2-CG2 4.38Å
176	S	86.5	Confident	84.5	Confident	57 Å²	57	70.8 Å²	70.8	40%	0.399	35%	0.351	S	S	.	.	H	α-helix	trans	-83.5	-22.3	172.3	74.3	0	0	0	0	114.1	M172 K173 D174	M172-S176 VanDerWaalsContact O-CB 3.24Å; M172-S176 WeakPolarHBondContact O-CB 3.43Å; M172-S176 PolarHBondContact O-N 3.21Å; M172-S176 PolarHBondContact O-OG 3.26Å; K173-S176 PolarHBondContact O-N 3.4Å; K173-S176 VanDerWaalsContact O-N 3.15Å; K173-S176 PolarHBondContact O-OG 3.28Å; D174-S176 PolarHBondContact O-N 2.84Å; D174-S176 VanDerWaalsContact O-N 3.1Å
177	Q	83.9	Confident	84	Confident	155 Å²	155	72.9 Å²	72.9	72%	0.724	36%	0.362	S	S	*	.	H	α-helix	trans	-82.6	-28.3	178	-71.6	177	-25	0	0	111.9	K173 D174 L179	K173-Q177 WeakPolarHBondContact O-CG 3.5Å; K173-Q177 PolarHBondContact O-N 3.05Å; K173-Q177 VanDerWaalsContact O-N 3.15Å; D174-Q177 PolarHBondContact O-N 3.01Å; Q177-L179 VanDerWaalsContact C-N 3.34Å
178	E	75.4	Confident	83.5	Confident	106 Å²	106	75.5 Å²	75.5	50%	0.495	37%	0.374	S	S	.	.	S	Bend	trans	-86.3	5.5	174.1	-54	-173.7	131.6	0	0	114.4	D174 D180 Q186 K189	D174-E178 PolarHBondContact O-N 3.38Å; E178-D180 PolarHBondContact O-N 2.91Å; E178-Q186 PolarHBondContact O-NE2 3.17Å; E178-Q186 PolarHBondContact O-OE1 3.34Å; E178-K189 IonicContact OE2-NZ 2.69Å; E178-K189 PolarHBondContact OE2-NZ 2.94Å
179	L	76.8	Confident	83	Confident	49 Å²	49	78.7 Å²	78.7	26%	0.257	39%	0.386	S	S	.	.			trans	-86.6	104	-162.4	-171.5	63.8	0	0	0	113.5	Q177 Q186 M187 F190	Q177-L179 VanDerWaalsContact C-N 3.34Å; L179-Q186 HydrophobicContact CD1-CB 3.95Å; L179-M187 HydrophobicContact CD1-CG 4.37Å; L179-M187 HydrophobicContact CD1-SD 3.99Å; L179-M187 HydrophobicContact CD2-SD 4.08Å; L179-M187 HydrophobicContact CG-SD 4.31Å; L179-F190 HydrophobicContact CD1-CB 4.16Å; L179-F190 HydrophobicContact CD2-CD1 4.34Å; L179-F190 HydrophobicContact CD2-CD2 4.29Å; L179-F190 HydrophobicContact CD2-CG 4.14Å
180	D	73.8	Confident	82.7	Confident	68 Å²	68	78.2 Å²	78.2	36%	0.364	38%	0.383	S	S	.	.			trans	-85.9	118.8	162.7	-171.4	-33.7	0	0	0	109.8	E178 D182 L183 Q186	E178-D180 PolarHBondContact O-N 2.91Å; D180-D182 VanDerWaalsContact C-N 3.27Å; D180-D182 PolarHBondContact O-N 3.32Å; D180-D182 PolarHBondContact OD1-N 3.49Å; D180-L183 HydrophobicContact CB-CB 4.31Å; D180-L183 HydrophobicContact CB-CD1 3.98Å; D180-L183 PolarHBondContact O-N 3.25Å; D180-L183 WeakPolarHBondContact OD2-CD1 3.32Å; D180-Q186 VanDerWaalsContact CB-OE1 3.28Å; D180-Q186 PolarHBondContact O-OE1 3.13Å
181	P	73.8	Confident	82.6	Confident	94 Å²	94	81.1 Å²	81.1	61%	0.61	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-29.2	178.7	-24.2	35.4	0	0	0	114.7	L183	P181-L183 VanDerWaalsContact C-N 3.35Å
182	D	73.8	Confident	82.3	Confident	153 Å²	153	85.6 Å²	85.6	82%	0.818	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-20.1	-176.4	-69.1	-23.1	0	0	0	111.5	D180 Y184	D180-D182 VanDerWaalsContact C-N 3.27Å; D180-D182 PolarHBondContact O-N 3.32Å; D180-D182 PolarHBondContact OD1-N 3.49Å; D182-Y184 PolarHBondContact O-N 3.17Å; D182-Y184 VanDerWaalsContact O-N 3.13Å
183	L	79.4	Confident	82.2	Confident	87 Å²	87	83.5 Å²	83.5	46%	0.455	40%	0.4	S	S	.	.			trans	-82.3	88.2	172.2	-86.4	77.9	0	0	0	111.5	D180 P181 K185 Q186 M187	D180-L183 HydrophobicContact CB-CB 4.31Å; D180-L183 HydrophobicContact CB-CD1 3.98Å; D180-L183 PolarHBondContact O-N 3.25Å; D180-L183 WeakPolarHBondContact OD2-CD1 3.32Å; P181-L183 VanDerWaalsContact C-N 3.35Å; L183-K185 PolarHBondContact O-N 2.74Å; L183-Q186 HydrophobicContact CB-CB 4.31Å; L183-Q186 HydrophobicContact CB-CG 4.09Å; L183-Q186 HydrophobicContact CD2-CG 4.43Å; L183-Q186 PolarHBondContact O-N 3.18Å; L183-M187 PolarHBondContact O-N 3.31Å
184	Y	75.1	Confident	82.3	Confident	168 Å²	168	81.7 Å²	81.7	66%	0.659	39%	0.393	S	S	*	.	H	α-helix	trans	-44.3	-35.4	176.3	-172.7	-91.3	0	0	0	114.8	D182 E188	D182-Y184 PolarHBondContact O-N 3.17Å; D182-Y184 VanDerWaalsContact O-N 3.13Å; Y184-E188 WeakPolarHBondContact O-CB 3.47Å; Y184-E188 PolarHBondContact O-N 2.86Å; Y184-E188 VanDerWaalsContact O-N 3.09Å
185	K	78.5	Confident	82.5	Confident	186 Å²	186	83 Å²	83	81%	0.809	40%	0.403	S	S	*	.	H	α-helix	trans	-64.5	-38.9	176.3	-69.7	-178.3	179.7	176.1	0	113.2	L183 E188 K189	L183-K185 PolarHBondContact O-N 2.74Å; K185-E188 PolarHBondContact O-N 2.82Å; K185-K189 PolarHBondContact O-N 3.31Å
186	Q	78.6	Confident	82.6	Confident	54 Å²	54	84.6 Å²	84.6	25%	0.252	41%	0.41	S	S	.	.	H	α-helix	trans	-73.5	-41.9	178.1	-67.8	-177.4	-22.9	0	0	111.2	E178 L179 D180 L183 E188 K189 F190	E178-Q186 PolarHBondContact O-NE2 3.17Å; E178-Q186 PolarHBondContact O-OE1 3.34Å; L179-Q186 HydrophobicContact CD1-CB 3.95Å; D180-Q186 VanDerWaalsContact CB-OE1 3.28Å; D180-Q186 PolarHBondContact O-OE1 3.13Å; L183-Q186 HydrophobicContact CB-CB 4.31Å; L183-Q186 HydrophobicContact CB-CG 4.09Å; L183-Q186 HydrophobicContact CD2-CG 4.43Å; L183-Q186 PolarHBondContact O-N 3.18Å; Q186-E188 PolarHBondContact O-N 3.1Å; Q186-K189 WeakPolarHBondContact O-CA 3.45Å; Q186-K189 VanDerWaalsContact O-CB 3.32Å; Q186-K189 WeakPolarHBondContact O-CB 3.32Å; Q186-K189 PolarHBondContact O-N 3.22Å; Q186-F190 PolarHBondContact O-N 3.48Å
187	M	83.9	Confident	83.1	Confident	58 Å²	58	82.6 Å²	82.6	29%	0.286	40%	0.395	S	S	.	.	H	α-helix	trans	-56.2	-35.7	171.6	-77.3	-67.2	-76.9	0	0	112.3	L179 L183 F190 R191	L179-M187 HydrophobicContact CD1-CG 4.37Å; L179-M187 HydrophobicContact CD1-SD 3.99Å; L179-M187 HydrophobicContact CD2-SD 4.08Å; L179-M187 HydrophobicContact CG-SD 4.31Å; L183-M187 PolarHBondContact O-N 3.31Å; M187-F190 PolarHBondContact O-N 3.01Å; M187-R191 WeakPolarHBondContact O-CG 3.35Å; M187-R191 PolarHBondContact O-N 3.09Å
188	E	83.6	Confident	83.7	Confident	55 Å²	55	82 Å²	82	26%	0.257	39%	0.387	S	S	.	.	H	α-helix	trans	-76.5	-32.7	175.2	-171.4	55.7	-152.6	0	0	113.6	Y184 K185 Q186 R191 K192	Y184-E188 WeakPolarHBondContact O-CB 3.47Å; Y184-E188 PolarHBondContact O-N 2.86Å; Y184-E188 VanDerWaalsContact O-N 3.09Å; K185-E188 PolarHBondContact O-N 2.82Å; Q186-E188 PolarHBondContact O-N 3.1Å; E188-R191 WeakPolarHBondContact OE2-CD 3.42Å; E188-R191 IonicContact OE2-CZ 2.65Å; E188-R191 IonicContact OE2-NH1 3.74Å; E188-R191 PolarHBondContact OE2-NH1 3.23Å; E188-K192 WeakPolarHBondContact O-CD 3.47Å; E188-K192 WeakPolarHBondContact O-CG 3.31Å; E188-K192 PolarHBondContact O-N 3.34Å; E188-K192 WeakPolarHBondContact OE1-CE 3.46Å; E188-K192 IonicContact OE1-NZ 2.68Å; E188-K192 PolarHBondContact OE1-NZ 3.19Å
189	K	82.8	Confident	84.6	Confident	78 Å²	78	80.7 Å²	80.7	34%	0.339	38%	0.383	S	S	.	.	H	α-helix	trans	-57.4	-50.2	165.7	-174.5	-168.8	176.6	-165.4	0	109.3	V175 E178 K185 Q186 K192 V193	V175-K189 HydrophobicContact CG1-CB 4.42Å; V175-K189 HydrophobicContact CG1-CD 3.83Å; V175-K189 HydrophobicContact CG1-CG 3.9Å; V175-K189 HydrophobicContact CG2-CD 4.17Å; V175-K189 VanDerWaalsContact CG2-CE 3.47Å; V175-K189 HydrophobicContact CG2-CG 4.48Å; E178-K189 IonicContact OE2-NZ 2.69Å; E178-K189 PolarHBondContact OE2-NZ 2.94Å; K185-K189 PolarHBondContact O-N 3.31Å; Q186-K189 WeakPolarHBondContact O-CA 3.45Å; Q186-K189 VanDerWaalsContact O-CB 3.32Å; Q186-K189 WeakPolarHBondContact O-CB 3.32Å; Q186-K189 PolarHBondContact O-N 3.22Å; K189-K192 PolarHBondContact O-N 3.2Å; K189-V193 WeakPolarHBondContact O-CG2 3.36Å; K189-V193 PolarHBondContact O-N 3.06Å; K189-V193 VanDerWaalsContact O-N 3.11Å
190	F	87.3	Confident	85.4	Confident	34 Å²	34	79 Å²	79	15%	0.149	38%	0.375	C	S	.	.	H	α-helix	trans	-61.8	-47.3	-178.7	-177.1	-105	0	0	0	113.2	M172 V175 L179 Q186 M187 K192 V193 Q194	M172-F190 HydrophobicContact CE-CE2 3.95Å; M172-F190 HydrophobicContact CE-CZ 3.67Å; M172-F190 HydrophobicContact CG-CE2 4.03Å; V175-F190 HydrophobicContact CG1-CB 4.13Å; V175-F190 HydrophobicContact CG1-CD2 4.26Å; L179-F190 HydrophobicContact CD1-CB 4.16Å; L179-F190 HydrophobicContact CD2-CD1 4.34Å; L179-F190 HydrophobicContact CD2-CD2 4.29Å; L179-F190 HydrophobicContact CD2-CG 4.14Å; Q186-F190 PolarHBondContact O-N 3.48Å; M187-F190 PolarHBondContact O-N 3.01Å; F190-K192 VanDerWaalsContact C-N 3.26Å; F190-K192 PolarHBondContact O-N 2.86Å; F190-V193 PolarHBondContact O-N 2.92Å; F190-Q194 VanDerWaalsContact O-CB 3.29Å; F190-Q194 WeakPolarHBondContact O-CB 3.42Å; F190-Q194 PolarHBondContact O-N 3.48Å
191	R	88.4	Confident	86.5	Confident	103 Å²	103	79.8 Å²	79.8	39%	0.389	38%	0.375	S	S	.	.	H	α-helix	trans	-56.1	-39.3	175.2	-74.3	174.2	-167.6	144.5	0.2	112.9	M187 E188 T195	M187-R191 WeakPolarHBondContact O-CG 3.35Å; M187-R191 PolarHBondContact O-N 3.09Å; E188-R191 WeakPolarHBondContact OE2-CD 3.42Å; E188-R191 IonicContact OE2-CZ 2.65Å; E188-R191 IonicContact OE2-NH1 3.74Å; E188-R191 PolarHBondContact OE2-NH1 3.23Å; R191-T195 WeakPolarHBondContact O-CB 3.49Å; R191-T195 PolarHBondContact O-N 3.38Å; R191-T195 PolarHBondContact O-OG1 3.36Å
192	K	87.4	Confident	87.6	Confident	104 Å²	104	82.7 Å²	82.7	45%	0.452	38%	0.379	S	S	.	.	H	α-helix	trans	-67.4	-46.8	178.5	-76	165.2	176.3	150.8	0	111.6	E188 K189 F190 T195 Q196	E188-K192 WeakPolarHBondContact O-CD 3.47Å; E188-K192 WeakPolarHBondContact O-CG 3.31Å; E188-K192 PolarHBondContact O-N 3.34Å; E188-K192 WeakPolarHBondContact OE1-CE 3.46Å; E188-K192 IonicContact OE1-NZ 2.68Å; E188-K192 PolarHBondContact OE1-NZ 3.19Å; K189-K192 PolarHBondContact O-N 3.2Å; F190-K192 VanDerWaalsContact C-N 3.26Å; F190-K192 PolarHBondContact O-N 2.86Å; K192-T195 WeakPolarHBondContact O-CB 3.27Å; K192-T195 PolarHBondContact O-N 3.38Å; K192-Q196 PolarHBondContact O-N 2.94Å; K192-Q196 VanDerWaalsContact O-N 3.1Å
193	V	90.3	Very high	88.7	Confident	1 Å²	1	78.8 Å²	78.8	1%	0.006	36%	0.358	C	S	.	.	H	α-helix	trans	-63.3	-45.6	175.6	-178.9	0	0	0	0	111.3	W171 M172 V175 K189 F190 T195 Q196 V197	W171-V193 HydrophobicContact CB-CG1 4.02Å; W171-V193 HydrophobicContact CD2-CB 4.41Å; W171-V193 HydrophobicContact CD2-CG1 3.82Å; W171-V193 HydrophobicContact CD2-CG2 3.69Å; W171-V193 VanDerWaalsContact CE2-CG2 3.44Å; W171-V193 HydrophobicContact CE3-CG1 4.11Å; W171-V193 HydrophobicContact CE3-CG2 4.18Å; W171-V193 HydrophobicContact CG-CG1 3.77Å; W171-V193 HydrophobicContact CG-CG2 4.14Å; W171-V193 HydrophobicContact CH2-CG2 4.24Å; W171-V193 HydrophobicContact CZ2-CG2 3.74Å; W171-V193 HydrophobicContact CZ3-CG2 4.44Å; M172-V193 HydrophobicContact CB-CG1 3.9Å; V175-V193 HydrophobicContact CG2-CG2 4.38Å; K189-V193 WeakPolarHBondContact O-CG2 3.36Å; K189-V193 PolarHBondContact O-N 3.06Å; K189-V193 VanDerWaalsContact O-N 3.11Å; F190-V193 PolarHBondContact O-N 2.92Å; V193-T195 PolarHBondContact O-N 3.46Å; V193-Q196 PolarHBondContact O-N 3.24Å; V193-V197 PolarHBondContact O-N 3.48Å
194	Q	92.1	Very high	89.5	Confident	54 Å²	54	74.8 Å²	74.8	25%	0.252	34%	0.337	S	S	.	.	H	α-helix	trans	-58.1	-31.1	175.7	-165.3	-167.2	63	0	0	112.4	M172 F190 R198	M172-Q194 HydrophobicContact CE-CB 4.44Å; M172-Q194 HydrophobicContact CE-CG 3.91Å; M172-Q194 HydrophobicContact SD-CB 4.38Å; M172-Q194 HydrophobicContact SD-CG 4.19Å; F190-Q194 VanDerWaalsContact O-CB 3.29Å; F190-Q194 WeakPolarHBondContact O-CB 3.42Å; F190-Q194 PolarHBondContact O-N 3.48Å; Q194-R198 WeakPolarHBondContact O-CG 3.29Å; Q194-R198 PolarHBondContact O-N 3.38Å; Q194-R198 VanDerWaalsContact OE1-CZ 3.23Å
195	T	92.4	Very high	90.6	Very high	77 Å²	77	70 Å²	70	47%	0.472	32%	0.323	S	S	.	.	H	α-helix	trans	-73.5	-38.9	174.5	-57.7	0	0	0	0	112	R191 K192 V193 R198 L199	R191-T195 WeakPolarHBondContact O-CB 3.49Å; R191-T195 PolarHBondContact O-N 3.38Å; R191-T195 PolarHBondContact O-OG1 3.36Å; K192-T195 WeakPolarHBondContact O-CB 3.27Å; K192-T195 PolarHBondContact O-N 3.38Å; V193-T195 PolarHBondContact O-N 3.46Å; T195-R198 PolarHBondContact O-N 3.44Å; T195-L199 PolarHBondContact O-N 3.01Å; T195-L199 VanDerWaalsContact O-N 3.12Å
196	Q	91.4	Very high	91.5	Very high	35 Å²	35	67.6 Å²	67.6	16%	0.164	31%	0.312	C	S	.	.	H	α-helix	trans	-64.3	-41.1	171.6	-59.6	-54.7	-24	0	0	111.8	K192 V193 R198 L199 A200	K192-Q196 PolarHBondContact O-N 2.94Å; K192-Q196 VanDerWaalsContact O-N 3.1Å; V193-Q196 PolarHBondContact O-N 3.24Å; Q196-R198 PolarHBondContact O-N 3.44Å; Q196-L199 PolarHBondContact O-N 3.31Å; Q196-A200 WeakPolarHBondContact O-CB 3.41Å; Q196-A200 PolarHBondContact O-N 3.07Å
197	V	95.6	Very high	92.4	Very high	15 Å²	15	66.5 Å²	66.5	9%	0.091	31%	0.308	C	S	.	.	H	α-helix	trans	-57.6	-47.1	175	172	0	0	0	0	111.5	Y165 A168 L169 M172 V193 L199 K201	Y165-V197 HydrophobicContact CE2-CG1 4.14Å; A168-V197 HydrophobicContact CB-CG2 3.78Å; A168-V197 VanDerWaalsContact O-CG2 3.22Å; A168-V197 WeakPolarHBondContact O-CG2 3.48Å; L169-V197 HydrophobicContact CD2-CG1 3.81Å; M172-V197 HydrophobicContact CB-CG2 3.87Å; M172-V197 HydrophobicContact CG-CG2 4.46Å; M172-V197 HydrophobicContact SD-CB 4.25Å; M172-V197 HydrophobicContact SD-CG1 4.29Å; M172-V197 HydrophobicContact SD-CG2 3.9Å; V193-V197 PolarHBondContact O-N 3.48Å; V197-L199 VanDerWaalsContact C-N 3.32Å; V197-L199 PolarHBondContact O-N 2.91Å; V197-K201 VanDerWaalsContact O-CB 3.29Å; V197-K201 WeakPolarHBondContact O-CB 3.47Å; V197-K201 PolarHBondContact O-N 2.94Å
198	R	96.4	Very high	93	Very high	144 Å²	144	65.7 Å²	65.7	54%	0.543	30%	0.303	S	S	.	.	H	α-helix	trans	-59.3	-41.7	176	-72.1	178	-174.6	106	-1.2	112.3	Q194 T195 Q196 K202	Q194-R198 WeakPolarHBondContact O-CG 3.29Å; Q194-R198 PolarHBondContact O-N 3.38Å; Q194-R198 VanDerWaalsContact OE1-CZ 3.23Å; T195-R198 PolarHBondContact O-N 3.44Å; Q196-R198 PolarHBondContact O-N 3.44Å; R198-K202 WeakPolarHBondContact O-CB 3.26Å; R198-K202 PolarHBondContact O-N 2.98Å
199	L	94.8	Very high	93.7	Very high	78 Å²	78	68 Å²	68	41%	0.408	32%	0.315	S	S	.	.	H	α-helix	trans	-69.3	-48.4	-179.8	179.8	60	0	0	0	111.9	T195 Q196 V197 K201 K202 N203	T195-L199 PolarHBondContact O-N 3.01Å; T195-L199 VanDerWaalsContact O-N 3.12Å; Q196-L199 PolarHBondContact O-N 3.31Å; V197-L199 VanDerWaalsContact C-N 3.32Å; V197-L199 PolarHBondContact O-N 2.91Å; L199-K201 VanDerWaalsContact C-N 3.33Å; L199-K201 PolarHBondContact O-N 2.84Å; L199-K202 PolarHBondContact O-N 2.9Å; L199-N203 PolarHBondContact O-N 2.88Å; L199-N203 VanDerWaalsContact O-N 3.13Å
200	A	95.1	Very high	94.4	Very high	13 Å²	13	66.8 Å²	66.8	11%	0.107	31%	0.312	C	S	.	.	H	α-helix	trans	-60.7	-43.4	177	0	0	0	0	0	111	Y165 A168 Q196 K202 N203 F204	Y165-A200 HydrophobicContact CD2-CB 4.46Å; A168-A200 HydrophobicContact CB-CB 4.43Å; Q196-A200 WeakPolarHBondContact O-CB 3.41Å; Q196-A200 PolarHBondContact O-N 3.07Å; A200-K202 PolarHBondContact O-N 3.47Å; A200-N203 PolarHBondContact O-N 3.41Å; A200-F204 WeakPolarHBondContact O-CB 3.49Å; A200-F204 PolarHBondContact O-N 3.08Å
201	K	96.1	Very high	94.9	Very high	84 Å²	84	65.1 Å²	65.1	37%	0.365	31%	0.305	S	S	.	.	H	α-helix	trans	-59.6	-47.5	174.7	-160.8	-170.4	-177.3	-124.7	0	112	Y165 V197 L199 N203 F204 D205	Y165-K201 HydrophobicContact CD2-CB 3.73Å; Y165-K201 HydrophobicContact CD2-CG 4.13Å; Y165-K201 HydrophobicContact CE1-CG 4.26Å; Y165-K201 HydrophobicContact CE2-CB 3.49Å; Y165-K201 VanDerWaalsContact CE2-CB 3.49Å; Y165-K201 HydrophobicContact CE2-CD 4.14Å; Y165-K201 HydrophobicContact CE2-CG 3.59Å; V197-K201 VanDerWaalsContact O-CB 3.29Å; V197-K201 WeakPolarHBondContact O-CB 3.47Å; V197-K201 PolarHBondContact O-N 2.94Å; L199-K201 VanDerWaalsContact C-N 3.33Å; L199-K201 PolarHBondContact O-N 2.84Å; K201-N203 PolarHBondContact O-N 3.09Å; K201-F204 PolarHBondContact O-N 3.42Å; K201-D205 WeakPolarHBondContact CE-OD2 3.32Å; K201-D205 IonicContact NZ-OD1 2.58Å; K201-D205 IonicContact NZ-OD2 3.59Å; K201-D205 PolarHBondContact NZ-OD2 3.34Å; K201-D205 WeakPolarHBondContact O-CB 3.33Å; K201-D205 PolarHBondContact O-N 3.31Å
202	K	97.4	Very high	95.4	Very high	156 Å²	156	61.5 Å²	61.5	68%	0.678	30%	0.295	S	S	*	.	H	α-helix	trans	-57.5	-37.7	178.6	-177.7	-178	176.4	-176	0	112.3	R198 L199 A200 K206	R198-K202 WeakPolarHBondContact O-CB 3.26Å; R198-K202 PolarHBondContact O-N 2.98Å; L199-K202 PolarHBondContact O-N 2.9Å; A200-K202 PolarHBondContact O-N 3.47Å; K202-K206 PolarHBondContact O-N 3.33Å
203	N	95.5	Very high	95.8	Very high	71 Å²	71	62.3 Å²	62.3	38%	0.38	30%	0.3	S	S	.	.	H	α-helix	trans	-72.6	-42.9	177.2	-65.9	-13.1	0	0	0	111.8	L199 A200 K201 L207	L199-N203 PolarHBondContact O-N 2.88Å; L199-N203 VanDerWaalsContact O-N 3.13Å; A200-N203 PolarHBondContact O-N 3.41Å; K201-N203 PolarHBondContact O-N 3.09Å; N203-L207 PolarHBondContact O-N 3.15Å; N203-L207 VanDerWaalsContact O-N 3.08Å
204	F	97.4	Very high	96.2	Very high	3 Å²	3	65.1 Å²	65.1	1%	0.013	31%	0.312	C	S	.	.	H	α-helix	trans	-64.6	-51.1	176.2	172.5	-118	0	0	0	112.6	D52 L55 M158 C161 R162 Y165 A200 K201 K206 L207 K208	D52-F204 WeakPolarHBondContact OD1-CZ 3.25Å; L55-F204 HydrophobicContact CD2-CE2 3.76Å; L55-F204 HydrophobicContact CD2-CZ 3.73Å; M158-F204 HydrophobicContact SD-CD2 4.36Å; M158-F204 HydrophobicContact SD-CE2 3.8Å; C161-F204 HydrophobicContact CB-CB 4.41Å; R162-F204 HydrophobicContact CB-CD2 3.83Å; R162-F204 HydrophobicContact CB-CE2 3.57Å; R162-F204 HydrophobicContact CB-CZ 4.36Å; R162-F204 HydrophobicContact CG-CD2 4.42Å; R162-F204 HydrophobicContact CG-CE2 3.77Å; R162-F204 HydrophobicContact CG-CZ 4.09Å; Y165-F204 AromaticContact CD1-CD1 3.6Å; Y165-F204 HydrophobicContact CD1-CD1 3.6Å; Y165-F204 HydrophobicContact CD1-CE1 4.05Å; Y165-F204 HydrophobicContact CD1-CG 4.26Å; Y165-F204 HydrophobicContact CE1-CD1 4.09Å; Y165-F204 HydrophobicContact CE1-CE1 4.34Å; Y165-F204 HydrophobicContact CG-CD1 4.33Å; A200-F204 WeakPolarHBondContact O-CB 3.49Å; A200-F204 PolarHBondContact O-N 3.08Å; K201-F204 PolarHBondContact O-N 3.42Å; F204-K206 PolarHBondContact O-N 3.48Å; F204-L207 PolarHBondContact O-N 3.05Å; F204-L207 VanDerWaalsContact O-N 3.09Å; F204-K208 HydrophobicContact CE1-CD 4.19Å; F204-K208 HydrophobicContact CE2-CB 4.46Å; F204-K208 HydrophobicContact CZ-CD 3.97Å; F204-K208 VanDerWaalsContact O-CB 3.3Å; F204-K208 WeakPolarHBondContact O-CB 3.42Å; F204-K208 PolarHBondContact O-N 3.44Å
205	D	97.3	Very high	96.5	Very high	68 Å²	68	62.6 Å²	62.6	36%	0.364	30%	0.3	S	S	.	.	H	α-helix	trans	-56.1	-38.3	179	-74.9	-11.2	0	0	0	110.9	K201 M209	K201-D205 WeakPolarHBondContact CE-OD2 3.32Å; K201-D205 IonicContact NZ-OD1 2.58Å; K201-D205 IonicContact NZ-OD2 3.59Å; K201-D205 PolarHBondContact NZ-OD2 3.34Å; K201-D205 WeakPolarHBondContact O-CB 3.33Å; K201-D205 PolarHBondContact O-N 3.31Å; D205-M209 PolarHBondContact O-N 3.49Å
206	K	97.1	Very high	96.8	Very high	134 Å²	134	62.4 Å²	62.4	58%	0.583	30%	0.297	S	S	*	.	H	α-helix	trans	-64.5	-55	172.8	-174.8	-169.8	170.7	-173.4	0	111.7	K202 F204 K208 M209 D210	K202-K206 PolarHBondContact O-N 3.33Å; F204-K206 PolarHBondContact O-N 3.48Å; K206-K208 VanDerWaalsContact C-N 3.27Å; K206-K208 PolarHBondContact O-N 2.94Å; K206-M209 WeakPolarHBondContact O-CB 3.05Å; K206-M209 PolarHBondContact O-N 3.04Å; K206-D210 WeakPolarHBondContact CE-OD2 3.25Å; K206-D210 PolarHBondContact O-N 3.5Å
207	L	97.6	Very high	97.1	Very high	32 Å²	32	66.7 Å²	66.7	17%	0.168	32%	0.32	C	S	.	.	H	α-helix	trans	-67	-27.9	-176.5	-78.6	168.3	0	0	0	112.9	R157 M158 C161 N203 F204 D210 V211	R157-L207 HydrophobicContact CB-CD1 4.37Å; M158-L207 HydrophobicContact CB-CB 3.9Å; M158-L207 HydrophobicContact CG-CB 4.02Å; C161-L207 HydrophobicContact CB-CD1 4.06Å; N203-L207 PolarHBondContact O-N 3.15Å; N203-L207 VanDerWaalsContact O-N 3.08Å; F204-L207 PolarHBondContact O-N 3.05Å; F204-L207 VanDerWaalsContact O-N 3.09Å; L207-D210 PolarHBondContact O-N 2.98Å; L207-V211 WeakPolarHBondContact O-CB 3.23Å; L207-V211 WeakPolarHBondContact O-CG2 3.26Å; L207-V211 PolarHBondContact O-N 3.34Å
208	K	97.4	Very high	97.2	Very high	40 Å²	40	66.3 Å²	66.3	17%	0.174	32%	0.317	C	S	.	.	H	α-helix	trans	-59.9	-45.4	168.9	177.8	165.4	179.3	160.9	0	110.5	S51 D52 L55 F204 K206 C212	S51-K208 PolarHBondContact O-NZ 3.36Å; D52-K208 IonicContact OD1-NZ 2.83Å; L55-K208 HydrophobicContact CB-CD 4.36Å; L55-K208 HydrophobicContact CB-CG 4.47Å; L55-K208 HydrophobicContact CD1-CG 4.32Å; L55-K208 HydrophobicContact CD2-CD 4.11Å; L55-K208 HydrophobicContact CD2-CG 4.2Å; F204-K208 HydrophobicContact CE1-CD 4.19Å; F204-K208 HydrophobicContact CE2-CB 4.46Å; F204-K208 HydrophobicContact CZ-CD 3.97Å; F204-K208 VanDerWaalsContact O-CB 3.3Å; F204-K208 WeakPolarHBondContact O-CB 3.42Å; F204-K208 PolarHBondContact O-N 3.44Å; K206-K208 VanDerWaalsContact C-N 3.27Å; K206-K208 PolarHBondContact O-N 2.94Å; K208-C212 PolarHBondContact O-N 2.67Å; K208-C212 PolarHBondContact O-SG 2.72Å
209	M	97.4	Very high	97.3	Very high	104 Å²	104	60.3 Å²	60.3	51%	0.512	30%	0.3	S	S	.	.	H	α-helix	trans	-66.4	-47.2	174.3	-172.9	57.8	60	0	0	112.4	D205 K206 V211 C212 Q213	D205-M209 PolarHBondContact O-N 3.49Å; K206-M209 WeakPolarHBondContact O-CB 3.05Å; K206-M209 PolarHBondContact O-N 3.04Å; M209-V211 VanDerWaalsContact C-N 3.29Å; M209-V211 PolarHBondContact O-N 3Å; M209-C212 PolarHBondContact O-N 2.81Å; M209-Q213 WeakPolarHBondContact O-CG 3.34Å; M209-Q213 PolarHBondContact O-N 3.32Å; M209-Q213 HydrophobicContact SD-CG 4.17Å; M209-Q213 PolarHBondContact SD-NE2 2.93Å; M209-Q213 VanDerWaalsContact SD-NE2 3.4Å
210	D	97.7	Very high	97.4	Very high	52 Å²	52	59 Å²	59	28%	0.278	30%	0.301	S	S	.	.	H	α-helix	trans	-57.2	-41.5	178.6	-65.5	-22.4	0	0	0	111.3	T154 K206 L207 K214	T154-D210 HydrophobicContact CG2-CB 4.41Å; K206-D210 WeakPolarHBondContact CE-OD2 3.25Å; K206-D210 PolarHBondContact O-N 3.5Å; L207-D210 PolarHBondContact O-N 2.98Å; D210-K214 WeakPolarHBondContact O-CB 3.5Å; D210-K214 WeakPolarHBondContact O-CG 3.47Å; D210-K214 PolarHBondContact O-N 2.98Å; D210-K214 VanDerWaalsContact O-N 3.12Å
211	V	98.4	Very high	97.5	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-66.6	-49.8	175.3	165.3	0	0	0	0	111.9	L55 L59 T154 V155 M158 L207 M209 Q213 K214 V215	L55-V211 HydrophobicContact CD1-CG1 4.41Å; L59-V211 HydrophobicContact CD2-CG1 4.25Å; T154-V211 HydrophobicContact CG2-CG2 4.03Å; V155-V211 HydrophobicContact CG2-CG1 3.9Å; V155-V211 HydrophobicContact CG2-CG2 4.1Å; M158-V211 HydrophobicContact CB-CG2 3.6Å; M158-V211 HydrophobicContact CG-CB 4.41Å; M158-V211 HydrophobicContact CG-CG2 3.84Å; L207-V211 WeakPolarHBondContact O-CB 3.23Å; L207-V211 WeakPolarHBondContact O-CG2 3.26Å; L207-V211 PolarHBondContact O-N 3.34Å; M209-V211 VanDerWaalsContact C-N 3.29Å; M209-V211 PolarHBondContact O-N 3Å; V211-Q213 VanDerWaalsContact C-N 3.31Å; V211-Q213 PolarHBondContact O-N 3.19Å; V211-K214 PolarHBondContact O-N 3.15Å; V211-V215 HydrophobicContact CG1-CG2 4.16Å; V211-V215 WeakPolarHBondContact O-CG2 3.21Å; V211-V215 PolarHBondContact O-N 2.98Å
212	C	97.4	Very high	97.6	Very high	26 Å²	26	59.2 Å²	59.2	18%	0.176	30%	0.304	C	S	.	.	H	α-helix	trans	-55.6	-47.2	-180	-72.7	0	0	0	0	111.7	K208 M209 V215 D216	K208-C212 PolarHBondContact O-N 2.67Å; K208-C212 PolarHBondContact O-SG 2.72Å; M209-C212 PolarHBondContact O-N 2.81Å; C212-V215 PolarHBondContact O-N 3.49Å; C212-D216 PolarHBondContact O-N 3.32Å
213	Q	97.9	Very high	97.7	Very high	121 Å²	121	55.3 Å²	55.3	57%	0.565	30%	0.296	S	S	*	.	H	α-helix	trans	-64.1	-42.1	178.8	-66.9	-179.6	10.1	0	0	112.5	M209 V211 L217	M209-Q213 WeakPolarHBondContact O-CG 3.34Å; M209-Q213 PolarHBondContact O-N 3.32Å; M209-Q213 HydrophobicContact SD-CG 4.17Å; M209-Q213 PolarHBondContact SD-NE2 2.93Å; M209-Q213 VanDerWaalsContact SD-NE2 3.4Å; V211-Q213 VanDerWaalsContact C-N 3.31Å; V211-Q213 PolarHBondContact O-N 3.19Å; Q213-L217 WeakPolarHBondContact O-CB 3.34Å; Q213-L217 PolarHBondContact O-N 2.91Å
214	K	98.1	Very high	97.7	Very high	61 Å²	61	57.5 Å²	57.5	27%	0.265	31%	0.307	S	S	.	.	H	α-helix	trans	-64.3	-41.4	175.4	-79.3	-163.6	179.1	-169.2	0	112.6	D150 T151 T154 D210 V211 L217 L218	D150-K214 IonicContact OD1-NZ 2.72Å; D150-K214 PolarHBondContact OD1-NZ 3.24Å; D150-K214 WeakPolarHBondContact OD2-CE 3.34Å; D150-K214 IonicContact OD2-NZ 2.98Å; D150-K214 PolarHBondContact OD2-NZ 2.72Å; T151-K214 HydrophobicContact CG2-CB 4.12Å; T154-K214 HydrophobicContact CG2-CD 4.12Å; T154-K214 PolarHBondContact OG1-NZ 3.34Å; D210-K214 WeakPolarHBondContact O-CB 3.5Å; D210-K214 WeakPolarHBondContact O-CG 3.47Å; D210-K214 PolarHBondContact O-N 2.98Å; D210-K214 VanDerWaalsContact O-N 3.12Å; V211-K214 PolarHBondContact O-N 3.15Å; K214-L217 PolarHBondContact O-N 2.78Å; K214-L218 WeakPolarHBondContact O-CB 3.41Å; K214-L218 PolarHBondContact O-N 2.92Å
215	V	98.4	Very high	97.7	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-66.5	-39.6	179.7	173.6	0	0	0	0	111.5	L61 F62 T151 V211 C212 L218 G219	L61-V215 HydrophobicContact CD2-CG1 4.11Å; L61-V215 HydrophobicContact CG-CG1 4.18Å; F62-V215 HydrophobicContact CB-CG1 4.17Å; F62-V215 HydrophobicContact CB-CG2 3.83Å; F62-V215 HydrophobicContact CD2-CG2 4.21Å; F62-V215 HydrophobicContact CG-CG2 4.26Å; T151-V215 HydrophobicContact CG2-CG2 3.99Å; V211-V215 HydrophobicContact CG1-CG2 4.16Å; V211-V215 WeakPolarHBondContact O-CG2 3.21Å; V211-V215 PolarHBondContact O-N 2.98Å; C212-V215 PolarHBondContact O-N 3.49Å; V215-L218 WeakPolarHBondContact O-CB 3.5Å; V215-L218 PolarHBondContact O-N 2.89Å; V215-G219 PolarHBondContact O-N 2.89Å
216	D	97.8	Very high	97.7	Very high	74 Å²	74	57.1 Å²	57.1	40%	0.396	31%	0.305	S	S	.	.	H	α-helix	trans	-68.5	-41	176.9	-68.6	-30.8	0	0	0	111.9	K58 C212 L218 G219 A220	K58-D216 IonicContact NZ-OD1 2.63Å; K58-D216 PolarHBondContact NZ-OD1 3.36Å; K58-D216 IonicContact NZ-OD2 2.84Å; K58-D216 PolarHBondContact NZ-OD2 3.19Å; C212-D216 PolarHBondContact O-N 3.32Å; D216-L218 VanDerWaalsContact C-N 3.35Å; D216-G219 PolarHBondContact O-N 2.89Å; D216-A220 PolarHBondContact O-N 3.28Å
217	L	97.6	Very high	97.7	Very high	125 Å²	125	54.6 Å²	54.6	65%	0.654	31%	0.305	S	S	*	.	H	α-helix	trans	-63.7	-39	172.3	-178.9	61.1	0	0	0	112.2	Q213 K214 G219 A220 S221	Q213-L217 WeakPolarHBondContact O-CB 3.34Å; Q213-L217 PolarHBondContact O-N 2.91Å; K214-L217 PolarHBondContact O-N 2.78Å; L217-G219 VanDerWaalsContact C-N 3.35Å; L217-A220 PolarHBondContact O-N 3.41Å; L217-S221 WeakPolarHBondContact O-CB 3.22Å; L217-S221 PolarHBondContact O-N 2.95Å
218	L	98.1	Very high	97.6	Very high	6 Å²	6	58.7 Å²	58.7	3%	0.031	32%	0.323	C	S	.	.	H	α-helix	trans	-64.1	-40	175.4	-171.6	73	0	0	0	111.2	F62 I65 F143 A147 I148 T151 K214 V215 D216 R222	F62-L218 HydrophobicContact CD2-CD2 3.77Å; F62-L218 HydrophobicContact CE2-CD2 3.87Å; I65-L218 HydrophobicContact CG2-CD2 3.94Å; I65-L218 HydrophobicContact CG2-CG 4.22Å; F143-L218 HydrophobicContact CE1-CD1 4.21Å; F143-L218 HydrophobicContact CE2-CD1 3.75Å; F143-L218 HydrophobicContact CZ-CD1 3.41Å; F143-L218 VanDerWaalsContact CZ-CD1 3.41Å; F143-L218 HydrophobicContact CZ-CG 3.84Å; A147-L218 HydrophobicContact CB-CD1 3.62Å; I148-L218 HydrophobicContact CG1-CD1 4.13Å; I148-L218 HydrophobicContact CG1-CD2 4.33Å; T151-L218 HydrophobicContact CG2-CD2 4.2Å; K214-L218 WeakPolarHBondContact O-CB 3.41Å; K214-L218 PolarHBondContact O-N 2.92Å; V215-L218 WeakPolarHBondContact O-CB 3.5Å; V215-L218 PolarHBondContact O-N 2.89Å; D216-L218 VanDerWaalsContact C-N 3.35Å; L218-R222 WeakPolarHBondContact O-CB 3.32Å; L218-R222 PolarHBondContact O-N 2.76Å
219	G	98	Very high	97.6	Very high	18 Å²	18	58.1 Å²	58.1	19%	0.186	32%	0.321	C	S	.	.	H	α-helix	trans	-61.2	-50.8	172.8	0	0	0	0	0	112.5	V215 D216 L217 S221 R222 C223	V215-G219 PolarHBondContact O-N 2.89Å; D216-G219 PolarHBondContact O-N 2.89Å; L217-G219 VanDerWaalsContact C-N 3.35Å; G219-S221 PolarHBondContact O-N 3.49Å; G219-R222 WeakPolarHBondContact O-CB 3.5Å; G219-R222 PolarHBondContact O-N 2.69Å; G219-C223 PolarHBondContact O-N 2.93Å; G219-C223 PolarHBondContact O-SG 2.65Å; G219-C223 VanDerWaalsContact O-SG 3.38Å
220	A	97.9	Very high	97.6	Very high	52 Å²	52	56.8 Å²	56.8	43%	0.43	32%	0.316	S	S	.	.	H	α-helix	trans	-62	-43.7	177.3	0	0	0	0	0	112.4	D216 L217 R222 C223 N224	D216-A220 PolarHBondContact O-N 3.28Å; L217-A220 PolarHBondContact O-N 3.41Å; A220-R222 PolarHBondContact O-N 3.34Å; A220-C223 PolarHBondContact O-N 2.93Å; A220-N224 PolarHBondContact O-N 2.99Å
221	S	97.8	Very high	97.6	Very high	49 Å²	49	56.6 Å²	56.6	34%	0.343	32%	0.321	S	S	.	.	H	α-helix	trans	-61.3	-42.8	176.5	179.3	0	0	0	0	111.9	L217 G219 C223 N224 L225	L217-S221 WeakPolarHBondContact O-CB 3.22Å; L217-S221 PolarHBondContact O-N 2.95Å; G219-S221 PolarHBondContact O-N 3.49Å; S221-C223 PolarHBondContact O-N 3.44Å; S221-N224 PolarHBondContact O-N 3.42Å; S221-L225 WeakPolarHBondContact O-CB 3.44Å; S221-L225 PolarHBondContact O-N 3.44Å
222	R	98.1	Very high	97.4	Very high	51 Å²	51	59.6 Å²	59.6	19%	0.192	34%	0.339	C	S	.	.	H	α-helix	trans	-58.2	-47.3	172.8	-178.2	-168.5	174.5	170.2	8.3	111.7	T68 F143 L218 G219 A220 N224 L225 L226	T68-R222 VanDerWaalsContact OG1-CZ 3.28Å; T68-R222 PolarHBondContact OG1-NH1 3.19Å; T68-R222 PolarHBondContact OG1-NH2 3.35Å; F143-R222 HydrophobicContact CE1-CB 4.14Å; F143-R222 HydrophobicContact CE1-CG 4.41Å; F143-R222 HydrophobicContact CE2-CB 4.41Å; F143-R222 HydrophobicContact CZ-CB 3.72Å; F143-R222 HydrophobicContact CZ-CG 4.47Å; L218-R222 WeakPolarHBondContact O-CB 3.32Å; L218-R222 PolarHBondContact O-N 2.76Å; G219-R222 WeakPolarHBondContact O-CB 3.5Å; G219-R222 PolarHBondContact O-N 2.69Å; A220-R222 PolarHBondContact O-N 3.34Å; R222-N224 PolarHBondContact O-N 3.3Å; R222-L225 WeakPolarHBondContact O-CB 3.48Å; R222-L225 PolarHBondContact O-N 3Å; R222-L226 HydrophobicContact CG-CD1 3.99Å; R222-L226 HydrophobicContact CG-CG 4.34Å; R222-L226 VanDerWaalsContact O-CG 3.32Å; R222-L226 WeakPolarHBondContact O-CG 3.34Å; R222-L226 PolarHBondContact O-N 3.24Å
223	C	97.8	Very high	97.4	Very high	74 Å²	74	60.1 Å²	60.1	50%	0.5	34%	0.338	S	S	.	.	H	α-helix	trans	-59.8	-46.2	179.8	-70.4	0	0	0	0	111.5	G219 A220 S221 L225 L226 S227	G219-C223 PolarHBondContact O-N 2.93Å; G219-C223 PolarHBondContact O-SG 2.65Å; G219-C223 VanDerWaalsContact O-SG 3.38Å; A220-C223 PolarHBondContact O-N 2.93Å; S221-C223 PolarHBondContact O-N 3.44Å; C223-L225 PolarHBondContact O-N 2.9Å; C223-L226 PolarHBondContact O-N 2.58Å; C223-S227 WeakPolarHBondContact O-CB 3.45Å; C223-S227 PolarHBondContact O-N 2.69Å; C223-S227 PolarHBondContact O-OG 2.88Å
224	N	96.9	Very high	97.4	Very high	117 Å²	117	59.8 Å²	59.8	63%	0.626	34%	0.337	S	S	*	.	H	α-helix	trans	-61.9	-43.2	178	-67.2	-7.6	0	0	0	112.3	A220 S221 R222 H228	A220-N224 PolarHBondContact O-N 2.99Å; S221-N224 PolarHBondContact O-N 3.42Å; R222-N224 PolarHBondContact O-N 3.3Å; N224-H228 PolarHBondContact O-N 3.22Å
225	L	97.4	Very high	97.4	Very high	29 Å²	29	61.4 Å²	61.4	15%	0.152	35%	0.352	C	S	.	.	H	α-helix	trans	-59	-49.8	176.7	-167.9	76.5	0	0	0	111.7	E139 V140 F143 S221 R222 C223 M229	E139-L225 HydrophobicContact CB-CD1 4.1Å; V140-L225 HydrophobicContact CG2-CD2 4.46Å; F143-L225 HydrophobicContact CB-CD2 3.62Å; F143-L225 HydrophobicContact CD1-CD2 4.43Å; F143-L225 HydrophobicContact CD2-CD2 4.21Å; F143-L225 HydrophobicContact CG-CD2 3.84Å; S221-L225 WeakPolarHBondContact O-CB 3.44Å; S221-L225 PolarHBondContact O-N 3.44Å; R222-L225 WeakPolarHBondContact O-CB 3.48Å; R222-L225 PolarHBondContact O-N 3Å; C223-L225 PolarHBondContact O-N 2.9Å; L225-M229 VanDerWaalsContact O-CG 3.31Å; L225-M229 WeakPolarHBondContact O-CG 3.43Å; L225-M229 PolarHBondContact O-N 2.91Å; L225-M229 VanDerWaalsContact O-N 3.16Å
226	L	97.6	Very high	97.3	Very high	34 Å²	34	63.2 Å²	63.2	18%	0.178	36%	0.363	C	S	.	.	H	α-helix	trans	-65.3	-45.3	-179.6	-67.7	179.7	0	0	0	111.5	L72 F136 R222 C223 H228 M229 L230	L72-L226 HydrophobicContact CD2-CD2 3.62Å; F136-L226 HydrophobicContact CE2-CD2 3.81Å; F136-L226 HydrophobicContact CZ-CD2 3.93Å; R222-L226 HydrophobicContact CG-CD1 3.99Å; R222-L226 HydrophobicContact CG-CG 4.34Å; R222-L226 VanDerWaalsContact O-CG 3.32Å; R222-L226 WeakPolarHBondContact O-CG 3.34Å; R222-L226 PolarHBondContact O-N 3.24Å; C223-L226 PolarHBondContact O-N 2.58Å; L226-H228 VanDerWaalsContact C-N 3.34Å; L226-H228 PolarHBondContact O-N 3.23Å; L226-M229 PolarHBondContact O-N 3.48Å; L226-L230 HydrophobicContact CB-CD1 4.17Å; L226-L230 WeakPolarHBondContact O-CB 3.35Å; L226-L230 VanDerWaalsContact O-CG 3.25Å; L226-L230 WeakPolarHBondContact O-CG 3.45Å; L226-L230 PolarHBondContact O-N 2.99Å
227	S	96.9	Very high	97.3	Very high	82 Å²	82	61.5 Å²	61.5	57%	0.573	35%	0.353	S	S	*	.	H	α-helix	trans	-57.6	-43.6	179.9	-66.8	0	0	0	0	112.6	C223 A231	C223-S227 WeakPolarHBondContact O-CB 3.45Å; C223-S227 PolarHBondContact O-N 2.69Å; C223-S227 PolarHBondContact O-OG 2.88Å; S227-A231 VanDerWaalsContact O-CB 3.27Å; S227-A231 WeakPolarHBondContact O-CB 3.41Å; S227-A231 PolarHBondContact O-N 3Å
228	H	95.1	Very high	97.3	Very high	117 Å²	117	60.6 Å²	60.6	54%	0.542	35%	0.349	S	S	.	.	H	α-helix	trans	-67.8	-54.2	177.7	-173.5	-77.2	0	0	0	111.7	N224 L226 L230 A231 T232	N224-H228 PolarHBondContact O-N 3.22Å; L226-H228 VanDerWaalsContact C-N 3.34Å; L226-H228 PolarHBondContact O-N 3.23Å; H228-L230 PolarHBondContact O-N 3.35Å; H228-A231 PolarHBondContact O-N 2.9Å; H228-T232 PolarHBondContact O-N 3.45Å; H228-T232 VanDerWaalsContact O-N 3.14Å; H228-T232 PolarHBondContact O-OG1 3.04Å; H228-T232 VanDerWaalsContact O-OG1 3.12Å
229	M	97.5	Very high	97.1	Very high	29 Å²	29	65 Å²	65	14%	0.143	37%	0.369	C	S	.	.	H	α-helix	trans	-71.6	-34.5	-170.6	-57.8	-55.6	156.9	0	0	112.9	F136 E139 L225 L226 Y233	F136-M229 HydrophobicContact CB-CB 4.07Å; F136-M229 HydrophobicContact CD2-CB 3.36Å; F136-M229 HydrophobicContact CD2-CG 4Å; F136-M229 HydrophobicContact CE2-CB 3.9Å; F136-M229 HydrophobicContact CG-CB 3.78Å; E139-M229 HydrophobicContact CB-CE 4.36Å; E139-M229 HydrophobicContact CB-CG 4.36Å; E139-M229 HydrophobicContact CG-CE 3.71Å; E139-M229 HydrophobicContact CG-SD 4.11Å; L225-M229 VanDerWaalsContact O-CG 3.31Å; L225-M229 WeakPolarHBondContact O-CG 3.43Å; L225-M229 PolarHBondContact O-N 2.91Å; L225-M229 VanDerWaalsContact O-N 3.16Å; L226-M229 PolarHBondContact O-N 3.48Å; M229-Y233 WeakPolarHBondContact O-CB 3.39Å; M229-Y233 PolarHBondContact O-N 2.86Å; M229-Y233 VanDerWaalsContact O-N 3.1Å
230	L	96.5	Very high	97.1	Very high	76 Å²	76	64.3 Å²	64.3	40%	0.398	36%	0.361	S	S	.	.	H	α-helix	trans	-67.8	-39.5	173.8	-68.8	170.9	0	0	0	111.7	F136 L226 H228 Y233 Q234	F136-L230 HydrophobicContact CE1-CD2 3.53Å; F136-L230 HydrophobicContact CE1-CG 4.26Å; F136-L230 HydrophobicContact CZ-CD2 3.71Å; F136-L230 HydrophobicContact CZ-CG 4.02Å; L226-L230 HydrophobicContact CB-CD1 4.17Å; L226-L230 WeakPolarHBondContact O-CB 3.35Å; L226-L230 VanDerWaalsContact O-CG 3.25Å; L226-L230 WeakPolarHBondContact O-CG 3.45Å; L226-L230 PolarHBondContact O-N 2.99Å; H228-L230 PolarHBondContact O-N 3.35Å; L230-Y233 PolarHBondContact O-N 3.35Å; L230-Q234 WeakPolarHBondContact O-CB 3.45Å; L230-Q234 PolarHBondContact O-N 2.68Å
231	A	97.4	Very high	97	Very high	48 Å²	48	69 Å²	69	40%	0.397	37%	0.367	S	S	.	.	H	α-helix	trans	-63.6	-41.8	176.8	0	0	0	0	0	112	S227 H228 T235	S227-A231 VanDerWaalsContact O-CB 3.27Å; S227-A231 WeakPolarHBondContact O-CB 3.41Å; S227-A231 PolarHBondContact O-N 3Å; H228-A231 PolarHBondContact O-N 2.9Å; A231-T235 WeakPolarHBondContact O-CB 3.41Å; A231-T235 PolarHBondContact O-N 2.84Å; A231-T235 PolarHBondContact O-OG1 3.36Å
232	T	95.9	Very high	97	Very high	62 Å²	62	72.7 Å²	72.7	38%	0.38	38%	0.379	S	S	.	.	H	α-helix	trans	-60.8	-51.8	174.5	-46.7	0	0	0	0	111.1	P132 H228 Q234 T235 T236	P132-T232 HydrophobicContact CB-CG2 4.19Å; H228-T232 PolarHBondContact O-N 3.45Å; H228-T232 VanDerWaalsContact O-N 3.14Å; H228-T232 PolarHBondContact O-OG1 3.04Å; H228-T232 VanDerWaalsContact O-OG1 3.12Å; T232-Q234 PolarHBondContact O-N 2.74Å; T232-T235 PolarHBondContact O-N 2.86Å; T232-T236 PolarHBondContact O-N 2.72Å; T232-T236 PolarHBondContact O-OG1 2.83Å
233	Y	97.5	Very high	96.8	Very high	38 Å²	38	72.3 Å²	72.3	15%	0.149	38%	0.379	C	S	.	.	H	α-helix	trans	-60.3	-44.9	178.6	163.1	-108.5	0	0	0	112.7	Y79 L133 M229 L230 T235 T236 L237	Y79-Y233 HydrophobicContact CE1-CE2 4.05Å; Y79-Y233 AromaticContact CE1-CZ 3.91Å; Y79-Y233 VanDerWaalsContact CE1-OH 3.26Å; Y79-Y233 WeakPolarHBondContact CE1-OH 3.43Å; Y79-Y233 PolarHBondContact OH-OH 3.04Å; Y79-Y233 VanDerWaalsContact OH-OH 3.13Å; L133-Y233 HydrophobicContact CD1-CD2 4.47Å; L133-Y233 HydrophobicContact CD1-CE2 4.15Å; L133-Y233 HydrophobicContact CD2-CD2 3.63Å; L133-Y233 HydrophobicContact CD2-CE2 3.72Å; L133-Y233 HydrophobicContact CD2-CG 4.19Å; L133-Y233 HydrophobicContact CG-CD2 3.81Å; L133-Y233 HydrophobicContact CG-CE2 3.96Å; M229-Y233 WeakPolarHBondContact O-CB 3.39Å; M229-Y233 PolarHBondContact O-N 2.86Å; M229-Y233 VanDerWaalsContact O-N 3.1Å; L230-Y233 PolarHBondContact O-N 3.35Å; Y233-T235 VanDerWaalsContact C-N 3.32Å; Y233-T235 PolarHBondContact O-N 3.09Å; Y233-T236 PolarHBondContact O-N 3.03Å; Y233-L237 HydrophobicContact CE1-CD2 4.29Å; Y233-L237 WeakPolarHBondContact O-CB 3.46Å; Y233-L237 PolarHBondContact O-N 3.18Å
234	Q	97.7	Very high	96.6	Very high	114 Å²	114	69 Å²	69	53%	0.533	36%	0.357	S	S	.	.	H	α-helix	trans	-60.4	-41.1	177.9	-179.4	-179.5	1	0	0	111.7	L230 T232 L237 L238	L230-Q234 WeakPolarHBondContact O-CB 3.45Å; L230-Q234 PolarHBondContact O-N 2.68Å; T232-Q234 PolarHBondContact O-N 2.74Å; Q234-L237 PolarHBondContact O-N 2.79Å; Q234-L238 HydrophobicContact CG-CD1 4.18Å; Q234-L238 WeakPolarHBondContact O-CG 3.1Å; Q234-L238 PolarHBondContact O-N 3.48Å
235	T	97.2	Very high	96.6	Very high	95 Å²	95	67.1 Å²	67.1	58%	0.583	35%	0.353	S	S	*	.	H	α-helix	trans	-63.1	-45.4	178.6	-55.3	0	0	0	0	111.1	A231 T232 Y233 L237 L238 H239	A231-T235 WeakPolarHBondContact O-CB 3.41Å; A231-T235 PolarHBondContact O-N 2.84Å; A231-T235 PolarHBondContact O-OG1 3.36Å; T232-T235 PolarHBondContact O-N 2.86Å; Y233-T235 VanDerWaalsContact C-N 3.32Å; Y233-T235 PolarHBondContact O-N 3.09Å; T235-L237 VanDerWaalsContact C-N 3.34Å; T235-L237 PolarHBondContact O-N 2.86Å; T235-L238 PolarHBondContact O-N 3.43Å; T235-H239 PolarHBondContact O-N 3.24Å; T235-H239 VanDerWaalsContact O-N 3.1Å
236	T	96.2	Very high	96.5	Very high	38 Å²	38	71.6 Å²	71.6	23%	0.233	37%	0.372	C	S	.	.	H	α-helix	trans	-65.6	-36.6	175.2	-43	0	0	0	0	112.1	A128 L129 P132 T232 Y233 H239 F240	A128-T236 HydrophobicContact CB-CG2 4.49Å; L129-T236 HydrophobicContact CD2-CG2 3.88Å; P132-T236 HydrophobicContact CG-CG2 4.33Å; T232-T236 PolarHBondContact O-N 2.72Å; T232-T236 PolarHBondContact O-OG1 2.83Å; Y233-T236 PolarHBondContact O-N 3.03Å; T236-H239 PolarHBondContact O-N 3.24Å; T236-F240 PolarHBondContact O-N 3.31Å
237	L	97.3	Very high	96.2	Very high	38 Å²	38	70.1 Å²	70.1	20%	0.199	37%	0.365	C	S	.	.	H	α-helix	trans	-64.7	-43	177	-174.5	68.2	0	0	0	112.5	L129 Y233 Q234 T235 F240 W241	L129-L237 HydrophobicContact CD1-CD1 3.83Å; L129-L237 HydrophobicContact CD2-CB 4.13Å; L129-L237 HydrophobicContact CD2-CD1 4.15Å; Y233-L237 HydrophobicContact CE1-CD2 4.29Å; Y233-L237 WeakPolarHBondContact O-CB 3.46Å; Y233-L237 PolarHBondContact O-N 3.18Å; Q234-L237 PolarHBondContact O-N 2.79Å; T235-L237 VanDerWaalsContact C-N 3.34Å; T235-L237 PolarHBondContact O-N 2.86Å; L237-F240 HydrophobicContact CD1-CD1 4.38Å; L237-F240 PolarHBondContact O-N 2.9Å; L237-W241 PolarHBondContact O-N 3.45Å; L237-W241 VanDerWaalsContact O-N 3.14Å
238	L	97.5	Very high	96	Very high	106 Å²	106	70.1 Å²	70.1	56%	0.555	36%	0.357	S	S	*	.	H	α-helix	trans	-63.1	-45.9	175	-71	170.1	0	0	0	111.1	Q234 T235 F240 W241 E242	Q234-L238 HydrophobicContact CG-CD1 4.18Å; Q234-L238 WeakPolarHBondContact O-CG 3.1Å; Q234-L238 PolarHBondContact O-N 3.48Å; T235-L238 PolarHBondContact O-N 3.43Å; L238-F240 VanDerWaalsContact C-N 3.32Å; L238-F240 PolarHBondContact O-N 2.84Å; L238-W241 PolarHBondContact O-N 3.19Å; L238-E242 WeakPolarHBondContact O-CB 3.28Å; L238-E242 PolarHBondContact O-N 2.86Å
239	H	95.8	Very high	95.9	Very high	98 Å²	98	67 Å²	67	45%	0.454	35%	0.351	S	S	.	.	H	α-helix	trans	-63.4	-34.8	178.3	-171	59.1	0	0	0	113.1	T235 T236 E242 K243	T235-H239 PolarHBondContact O-N 3.24Å; T235-H239 VanDerWaalsContact O-N 3.1Å; T236-H239 PolarHBondContact O-N 3.24Å; H239-E242 IonicContact CE1-OE2 3.36Å; H239-E242 PolarHBondContact CE1-OE2 3.47Å; H239-E242 IonicContact ND1-OE2 2.72Å; H239-K243 WeakPolarHBondContact NE2-CE 3.3Å; H239-K243 WeakPolarHBondContact O-CB 3.13Å; H239-K243 PolarHBondContact O-N 3.39Å; H239-K243 VanDerWaalsContact O-N 3.15Å
240	F	96.3	Very high	95.6	Very high	4 Å²	4	66.7 Å²	66.7	2%	0.018	35%	0.353	C	S	.	.	H	α-helix	trans	-60.9	-50.1	170.8	158.5	-105.4	0	0	0	111.8	Q125 R126 L129 T236 L237 L238 T244	Q125-F240 HydrophobicContact CB-CD2 3.98Å; R126-F240 HydrophobicContact CB-CD2 4Å; R126-F240 HydrophobicContact CB-CE2 3.61Å; R126-F240 HydrophobicContact CB-CZ 4.05Å; R126-F240 HydrophobicContact CG-CE2 4.19Å; R126-F240 HydrophobicContact CG-CZ 4.16Å; L129-F240 HydrophobicContact CD1-CD1 4.37Å; L129-F240 HydrophobicContact CD2-CB 4.35Å; T236-F240 PolarHBondContact O-N 3.31Å; L237-F240 HydrophobicContact CD1-CD1 4.38Å; L237-F240 PolarHBondContact O-N 2.9Å; L238-F240 VanDerWaalsContact C-N 3.32Å; L238-F240 PolarHBondContact O-N 2.84Å; F240-T244 VanDerWaalsContact CE2-OG1 3.3Å; F240-T244 WeakPolarHBondContact CE2-OG1 3.34Å; F240-T244 VanDerWaalsContact O-CB 3.3Å; F240-T244 WeakPolarHBondContact O-CB 3.23Å; F240-T244 PolarHBondContact O-N 2.83Å; F240-T244 PolarHBondContact O-OG1 3.02Å
241	W	97.3	Very high	95.3	Very high	149 Å²	149	63.8 Å²	63.8	56%	0.564	34%	0.338	S	S	*	.	H	α-helix	trans	-67	-40.6	-179.3	-74.8	120.1	0	0	0	112.6	L237 L238 S245	L237-W241 PolarHBondContact O-N 3.45Å; L237-W241 VanDerWaalsContact O-N 3.14Å; L238-W241 PolarHBondContact O-N 3.19Å; W241-S245 WeakPolarHBondContact O-CB 3.42Å; W241-S245 PolarHBondContact O-N 3.02Å
242	E	96.6	Very high	94.9	Very high	128 Å²	128	67.2 Å²	67.2	60%	0.598	35%	0.345	S	S	*	.	H	α-helix	trans	-58.7	-54.8	177.2	-179.3	178.6	-146	0	0	111.5	L238 H239 T244 S245 H246	L238-E242 WeakPolarHBondContact O-CB 3.28Å; L238-E242 PolarHBondContact O-N 2.86Å; H239-E242 IonicContact CE1-OE2 3.36Å; H239-E242 PolarHBondContact CE1-OE2 3.47Å; H239-E242 IonicContact ND1-OE2 2.72Å; E242-T244 PolarHBondContact O-N 2.99Å; E242-S245 PolarHBondContact O-N 3.33Å; E242-H246 WeakPolarHBondContact O-CB 3.49Å; E242-H246 PolarHBondContact O-N 3Å
243	K	93.8	Very high	94.6	Very high	43 Å²	43	69 Å²	69	19%	0.187	35%	0.35	C	S	.	.	H	α-helix	trans	-57.8	-50.6	176.8	-82.6	180	157.5	174.5	0	112.2	F121 Q125 H239 S245 H246 T247	F121-K243 HydrophobicContact CE1-CB 4.26Å; F121-K243 HydrophobicContact CZ-CB 4.23Å; F121-K243 HydrophobicContact CZ-CD 4.42Å; Q125-K243 HydrophobicContact CG-CD 4.48Å; H239-K243 WeakPolarHBondContact NE2-CE 3.3Å; H239-K243 WeakPolarHBondContact O-CB 3.13Å; H239-K243 PolarHBondContact O-N 3.39Å; H239-K243 VanDerWaalsContact O-N 3.15Å; K243-S245 PolarHBondContact O-N 3.29Å; K243-H246 PolarHBondContact O-N 3.48Å; K243-T247 PolarHBondContact O-N 2.62Å; K243-T247 VanDerWaalsContact O-N 3.08Å; K243-T247 PolarHBondContact O-OG1 3.18Å
244	T	95.2	Very high	93.9	Very high	5 Å²	5	68.2 Å²	68.2	3%	0.031	35%	0.349	C	S	.	.	H	α-helix	trans	-63.8	-42.7	-176.8	-56.1	0	0	0	0	111.5	F240 E242 T247 M248	F240-T244 VanDerWaalsContact CE2-OG1 3.3Å; F240-T244 WeakPolarHBondContact CE2-OG1 3.34Å; F240-T244 VanDerWaalsContact O-CB 3.3Å; F240-T244 WeakPolarHBondContact O-CB 3.23Å; F240-T244 PolarHBondContact O-N 2.83Å; F240-T244 PolarHBondContact O-OG1 3.02Å; E242-T244 PolarHBondContact O-N 2.99Å; T244-T247 PolarHBondContact O-N 2.86Å; T244-M248 HydrophobicContact CG2-CE 3.68Å; T244-M248 HydrophobicContact CG2-CG 4.48Å; T244-M248 HydrophobicContact CG2-SD 3.94Å; T244-M248 WeakPolarHBondContact O-CB 3.26Å; T244-M248 VanDerWaalsContact O-CG 3.3Å; T244-M248 WeakPolarHBondContact O-CG 3.42Å; T244-M248 PolarHBondContact O-N 2.96Å
245	S	95.9	Very high	93.2	Very high	77 Å²	77	64.6 Å²	64.6	54%	0.538	33%	0.332	S	S	.	.	H	α-helix	trans	-63.3	-41.7	176.6	-173.2	0	0	0	0	112	W241 E242 K243 M248 A249	W241-S245 WeakPolarHBondContact O-CB 3.42Å; W241-S245 PolarHBondContact O-N 3.02Å; E242-S245 PolarHBondContact O-N 3.33Å; K243-S245 PolarHBondContact O-N 3.29Å; S245-M248 PolarHBondContact O-N 3.32Å; S245-A249 VanDerWaalsContact O-CB 3.25Å; S245-A249 WeakPolarHBondContact O-CB 3.3Å; S245-A249 PolarHBondContact O-N 2.95Å
246	H	94.5	Very high	92.4	Very high	122 Å²	122	65.7 Å²	65.7	57%	0.565	33%	0.329	S	S	*	.	H	α-helix	trans	-61.9	-47.9	177.2	-170.1	81.6	0	0	0	111.9	E242 K243 M248 A249 A250	E242-H246 WeakPolarHBondContact O-CB 3.49Å; E242-H246 PolarHBondContact O-N 3Å; K243-H246 PolarHBondContact O-N 3.48Å; H246-M248 PolarHBondContact O-N 3Å; H246-A249 PolarHBondContact O-N 3.26Å; H246-A250 PolarHBondContact O-N 2.79Å
247	T	92.6	Very high	91	Very high	4 Å²	4	66.6 Å²	66.6	3%	0.025	35%	0.346	C	S	.	.	H	α-helix	trans	-62.8	-41.6	176.8	-52.6	0	0	0	0	112.4	A118 F121 K243 T244 I251 F378	A118-T247 HydrophobicContact CB-CG2 3.79Å; F121-T247 HydrophobicContact CD1-CG2 4.18Å; F121-T247 VanDerWaalsContact CE1-OG1 3.27Å; F121-T247 WeakPolarHBondContact CE1-OG1 3.25Å; K243-T247 PolarHBondContact O-N 2.62Å; K243-T247 VanDerWaalsContact O-N 3.08Å; K243-T247 PolarHBondContact O-OG1 3.18Å; T244-T247 PolarHBondContact O-N 2.86Å; T247-I251 WeakPolarHBondContact O-CG1 3.45Å; T247-I251 PolarHBondContact O-N 2.86Å; T247-F378 HydrophobicContact CG2-CD1 4.14Å; T247-F378 HydrophobicContact CG2-CE1 3.51Å; T247-F378 HydrophobicContact CG2-CZ 4.22Å
248	M	93	Very high	88.8	Confident	82 Å²	82	73.3 Å²	73.3	40%	0.404	37%	0.37	S	S	.	.	H	α-helix	trans	-68.4	-37.2	177.4	-72.2	179.7	175.1	0	0	112.5	L119 T244 S245 H246 I251 H252	L119-M248 HydrophobicContact CD2-CE 4.32Å; T244-M248 HydrophobicContact CG2-CE 3.68Å; T244-M248 HydrophobicContact CG2-CG 4.48Å; T244-M248 HydrophobicContact CG2-SD 3.94Å; T244-M248 WeakPolarHBondContact O-CB 3.26Å; T244-M248 VanDerWaalsContact O-CG 3.3Å; T244-M248 WeakPolarHBondContact O-CG 3.42Å; T244-M248 PolarHBondContact O-N 2.96Å; S245-M248 PolarHBondContact O-N 3.32Å; H246-M248 PolarHBondContact O-N 3Å; M248-I251 PolarHBondContact O-N 3.48Å; M248-H252 PolarHBondContact O-N 3.49Å
249	A	93.3	Very high	86.8	Confident	50 Å²	50	73.5 Å²	73.5	41%	0.413	37%	0.368	S	S	.	.	H	α-helix	trans	-66.2	-40.7	176.3	0	0	0	0	0	112.3	S245 H246 I251 H252 E253	S245-A249 VanDerWaalsContact O-CB 3.25Å; S245-A249 WeakPolarHBondContact O-CB 3.3Å; S245-A249 PolarHBondContact O-N 2.95Å; H246-A249 PolarHBondContact O-N 3.26Å; A249-I251 VanDerWaalsContact C-N 3.29Å; A249-I251 PolarHBondContact O-N 3.46Å; A249-H252 WeakPolarHBondContact O-CB 3.46Å; A249-H252 PolarHBondContact O-N 3.49Å; A249-E253 PolarHBondContact O-N 3.28Å
250	A	90.3	Very high	84.7	Confident	24 Å²	24	71 Å²	71	20%	0.198	36%	0.36	C	S	.	.	H	α-helix	trans	-58.3	-41.8	175.2	0	0	0	0	0	112	H246 E253 S254 L374 I377	H246-A250 PolarHBondContact O-N 2.79Å; A250-E253 PolarHBondContact O-N 2.76Å; A250-S254 PolarHBondContact O-N 2.72Å; A250-S254 PolarHBondContact O-OG 3.43Å; A250-L374 HydrophobicContact CB-CD2 3.93Å; A250-I377 HydrophobicContact CB-CD1 4.07Å
251	I	89.7	Confident	82.8	Confident	15 Å²	15	78.2 Å²	78.2	8%	0.077	39%	0.389	C	S	.	.	H	α-helix	trans	-67.7	-40.9	176.4	-66.8	170.5	0	0	0	111.6	A114 A118 T247 M248 A249 E253 S254 F255 L374 F378	A114-I251 WeakPolarHBondContact O-CD1 3.5Å; A118-I251 HydrophobicContact CB-CD1 3.37Å; T247-I251 WeakPolarHBondContact O-CG1 3.45Å; T247-I251 PolarHBondContact O-N 2.86Å; M248-I251 PolarHBondContact O-N 3.48Å; A249-I251 VanDerWaalsContact C-N 3.29Å; A249-I251 PolarHBondContact O-N 3.46Å; I251-E253 VanDerWaalsContact C-N 3.3Å; I251-E253 PolarHBondContact O-N 3.48Å; I251-S254 WeakPolarHBondContact CA-OG 3.4Å; I251-S254 PolarHBondContact O-N 3.09Å; I251-S254 PolarHBondContact O-OG 2.92Å; I251-S254 VanDerWaalsContact O-OG 3.07Å; I251-F255 HydrophobicContact CG2-CD2 3.83Å; I251-F255 HydrophobicContact CG2-CE2 4.18Å; I251-F255 VanDerWaalsContact O-CD2 3.31Å; I251-F255 WeakPolarHBondContact O-CD2 3.46Å; I251-F255 PolarHBondContact O-N 3.23Å; I251-F255 VanDerWaalsContact O-N 3.13Å; I251-L374 HydrophobicContact CG1-CD2 3.95Å; I251-F378 HydrophobicContact CD1-CZ 4.14Å
252	H	88.8	Confident	80.6	Confident	119 Å²	119	76.1 Å²	76.1	55%	0.551	39%	0.385	S	S	*	.	H	α-helix	trans	-58.2	-42.9	175.6	174.3	-91.8	0	0	0	111.9	M248 A249 K256	M248-H252 PolarHBondContact O-N 3.49Å; A249-H252 WeakPolarHBondContact O-CB 3.46Å; A249-H252 PolarHBondContact O-N 3.49Å; H252-K256 PolarHBondContact O-N 3.04Å
253	E	89.3	Confident	78.6	Confident	101 Å²	101	73.2 Å²	73.2	47%	0.472	37%	0.371	S	S	.	.	H	α-helix	trans	-72.6	-39.9	179.3	-63.2	-58.5	113.2	0	0	112.7	A249 A250 I251 F255 K256	A249-E253 PolarHBondContact O-N 3.28Å; A250-E253 PolarHBondContact O-N 2.76Å; I251-E253 VanDerWaalsContact C-N 3.3Å; I251-E253 PolarHBondContact O-N 3.48Å; E253-F255 VanDerWaalsContact C-N 3.32Å; E253-F255 PolarHBondContact O-N 3.21Å; E253-K256 WeakPolarHBondContact O-CB 3.46Å; E253-K256 PolarHBondContact O-N 3.19Å; E253-K256 WeakPolarHBondContact OE1-CD 3.44Å; E253-K256 IonicContact OE1-NZ 2.62Å; E253-K256 PolarHBondContact OE1-NZ 2.85Å; E253-K256 WeakPolarHBondContact OE2-CD 3.45Å; E253-K256 IonicContact OE2-NZ 2.63Å; E253-K256 PolarHBondContact OE2-NZ 3.22Å
254	S	84.8	Confident	76.8	Confident	20 Å²	20	76.6 Å²	76.6	14%	0.14	40%	0.395	C	S	.	.	H	α-helix	trans	-67.6	-27.8	178.7	65.2	0	0	0	0	114	R107 A250 I251	R107-S254 PolarHBondContact NH2-O 2.93Å; A250-S254 PolarHBondContact O-N 2.72Å; A250-S254 PolarHBondContact O-OG 3.43Å; I251-S254 WeakPolarHBondContact CA-OG 3.4Å; I251-S254 PolarHBondContact O-N 3.09Å; I251-S254 PolarHBondContact O-OG 2.92Å; I251-S254 VanDerWaalsContact O-OG 3.07Å
255	F	82.4	Confident	74.8	Confident	39 Å²	39	82.4 Å²	82.4	17%	0.171	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	10.4	176.7	-65	-70.7	0	0	0	113.9	R107 K110 M111 A114 I251 E253 L374	R107-F255 HydrophobicContact CG-CD1 4.15Å; R107-F255 HydrophobicContact CG-CE1 4.11Å; K110-F255 HydrophobicContact CB-CE1 4.31Å; K110-F255 HydrophobicContact CB-CZ 4.41Å; M111-F255 VanDerWaalsContact CA-CZ 3.49Å; M111-F255 HydrophobicContact CB-CD1 3.75Å; M111-F255 HydrophobicContact CB-CD2 4.23Å; M111-F255 HydrophobicContact CB-CE1 3.69Å; M111-F255 HydrophobicContact CB-CE2 4.2Å; M111-F255 HydrophobicContact CB-CG 4.04Å; M111-F255 HydrophobicContact CB-CZ 3.94Å; M111-F255 HydrophobicContact CG-CB 4.33Å; M111-F255 HydrophobicContact CG-CD1 3.98Å; M111-F255 HydrophobicContact CG-CD2 3.83Å; M111-F255 HydrophobicContact CG-CE1 4.31Å; M111-F255 HydrophobicContact CG-CE2 4.19Å; M111-F255 HydrophobicContact CG-CG 3.74Å; M111-F255 HydrophobicContact CG-CZ 4.43Å; M111-F255 HydrophobicContact SD-CB 4.02Å; M111-F255 HydrophobicContact SD-CD1 4.33Å; M111-F255 HydrophobicContact SD-CG 4.05Å; A114-F255 HydrophobicContact CB-CE2 3.73Å; A114-F255 HydrophobicContact CB-CZ 4.15Å; I251-F255 HydrophobicContact CG2-CD2 3.83Å; I251-F255 HydrophobicContact CG2-CE2 4.18Å; I251-F255 VanDerWaalsContact O-CD2 3.31Å; I251-F255 WeakPolarHBondContact O-CD2 3.46Å; I251-F255 PolarHBondContact O-N 3.23Å; I251-F255 VanDerWaalsContact O-N 3.13Å; E253-F255 VanDerWaalsContact C-N 3.32Å; E253-F255 PolarHBondContact O-N 3.21Å; F255-L374 HydrophobicContact CE2-CD1 4.48Å
256	K	80.8	Confident	72.8	Confident	117 Å²	117	82.9 Å²	82.9	51%	0.509	43%	0.427	S	S	.	.			trans	-63.5	152.8	173.6	-152.8	157.8	179.3	171.5	0	110.8	R107 H252 E253	R107-K256 PolarHBondContact NH2-O 3.14Å; H252-K256 PolarHBondContact O-N 3.04Å; E253-K256 WeakPolarHBondContact O-CB 3.46Å; E253-K256 PolarHBondContact O-N 3.19Å; E253-K256 WeakPolarHBondContact OE1-CD 3.44Å; E253-K256 IonicContact OE1-NZ 2.62Å; E253-K256 PolarHBondContact OE1-NZ 2.85Å; E253-K256 WeakPolarHBondContact OE2-CD 3.45Å; E253-K256 IonicContact OE2-NZ 2.63Å; E253-K256 PolarHBondContact OE2-NZ 3.22Å
257	G	65.3	Low	71.1	Confident	58 Å²	58	84.9 Å²	84.9	60%	0.598	43%	0.434	S	S	*	.	S	Bend	trans	83.4	131.8	179.9	0	0	0	0	0	114.7	R107 Q259	R107-G257 PolarHBondContact NH1-O 3.12Å; R107-G257 VanDerWaalsContact NH1-O 3.16Å; G257-Q259 PolarHBondContact O-N 2.87Å
258	Y	52.7	Low	69.5	Low	178 Å²	178	88.7 Å²	88.7	70%	0.698	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-70.8	122.5	174.2	-179.8	-93	0	0	0	110.4
259	Q	55.2	Low	67.8	Low	110 Å²	110	88.1 Å²	88.1	51%	0.514	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-94.4	128.9	167.3	-87.1	-174.7	-10.6	0	0	110	R107 G257	R107-Q259 VanDerWaalsContact CD-CD 3.44Å; G257-Q259 PolarHBondContact O-N 2.87Å
260	P	50.7	Low	66.2	Low	46 Å²	46	88 Å²	88	30%	0.299	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-67.2	138.5	172.6	31.4	-37.3	0	0	0	110.5	E262 M273 V277	P260-E262 PolarHBondContact O-N 3.37Å; P260-E262 VanDerWaalsContact O-N 3.11Å; P260-M273 HydrophobicContact CB-CE 3.88Å; P260-M273 HydrophobicContact CB-CG 4.19Å; P260-M273 HydrophobicContact CB-SD 4.27Å; P260-V277 HydrophobicContact CB-CG2 3.72Å; P260-V277 HydrophobicContact CG-CG2 3.75Å
261	Y	56.4	Low	64.7	Low	155 Å²	155	91.7 Å²	91.7	61%	0.608	47%	0.466	S	S	*	.			trans	-69.7	102	171.6	178.4	-92.6	0	0	0	110.3	F263	Y261-F263 HydrophobicContact CD1-CD1 4.41Å; Y261-F263 AromaticContact CD1-CD2 3.88Å; Y261-F263 HydrophobicContact CD1-CD2 3.88Å; Y261-F263 HydrophobicContact CD1-CE1 4.32Å; Y261-F263 AromaticContact CD1-CE2 3.78Å; Y261-F263 HydrophobicContact CD1-CE2 3.78Å; Y261-F263 HydrophobicContact CD1-CG 4.2Å; Y261-F263 HydrophobicContact CD1-CZ 4.01Å; Y261-F263 AromaticContact CE1-CD1 3.94Å; Y261-F263 HydrophobicContact CE1-CD1 3.94Å; Y261-F263 HydrophobicContact CE1-CD2 4.24Å; Y261-F263 AromaticContact CE1-CE1 3.9Å; Y261-F263 HydrophobicContact CE1-CE1 3.9Å; Y261-F263 HydrophobicContact CE1-CE2 4.2Å; Y261-F263 HydrophobicContact CE1-CG 4.12Å; Y261-F263 HydrophobicContact CE1-CZ 4.03Å; Y261-F263 PolarHBondContact O-N 3.31Å; Y261-F263 VanDerWaalsContact O-N 3.16Å
262	E	51.9	Low	63.3	Low	106 Å²	106	94.3 Å²	94.3	50%	0.495	48%	0.484	S	S	.	.			trans	-69.6	111.1	176.3	-78.3	-136.3	107.7	0	0	111.6	P260 T264 Q270	P260-E262 PolarHBondContact O-N 3.37Å; P260-E262 VanDerWaalsContact O-N 3.11Å; E262-T264 VanDerWaalsContact C-N 3.34Å; E262-T264 PolarHBondContact O-N 2.88Å; E262-Q270 PolarHBondContact OE1-NE2 3.07Å
263	F	53.8	Low	61.8	Low	67 Å²	67	90.6 Å²	90.6	29%	0.294	47%	0.468	S	S	.	.			trans	-67.7	85.3	172	-81.2	-87.2	0	0	0	111.8	Y261 T265 L266 L269 M273	Y261-F263 HydrophobicContact CD1-CD1 4.41Å; Y261-F263 AromaticContact CD1-CD2 3.88Å; Y261-F263 HydrophobicContact CD1-CD2 3.88Å; Y261-F263 HydrophobicContact CD1-CE1 4.32Å; Y261-F263 AromaticContact CD1-CE2 3.78Å; Y261-F263 HydrophobicContact CD1-CE2 3.78Å; Y261-F263 HydrophobicContact CD1-CG 4.2Å; Y261-F263 HydrophobicContact CD1-CZ 4.01Å; Y261-F263 AromaticContact CE1-CD1 3.94Å; Y261-F263 HydrophobicContact CE1-CD1 3.94Å; Y261-F263 HydrophobicContact CE1-CD2 4.24Å; Y261-F263 AromaticContact CE1-CE1 3.9Å; Y261-F263 HydrophobicContact CE1-CE1 3.9Å; Y261-F263 HydrophobicContact CE1-CE2 4.2Å; Y261-F263 HydrophobicContact CE1-CG 4.12Å; Y261-F263 HydrophobicContact CE1-CZ 4.03Å; Y261-F263 PolarHBondContact O-N 3.31Å; Y261-F263 VanDerWaalsContact O-N 3.16Å; F263-T265 VanDerWaalsContact C-N 3.26Å; F263-T265 PolarHBondContact O-N 3.31Å; F263-L266 HydrophobicContact CB-CB 4.33Å; F263-L266 HydrophobicContact CD1-CB 4.42Å; F263-L266 CarbonylContact O-C 3.55Å; F263-L266 PolarHBondContact O-N 3.17Å; F263-L269 HydrophobicContact CB-CB 4.15Å; F263-L269 HydrophobicContact CD1-CD1 3.93Å; F263-L269 HydrophobicContact CD2-CB 3.96Å; F263-L269 HydrophobicContact CD2-CD1 4.14Å; F263-L269 HydrophobicContact CE1-CD1 3.97Å; F263-L269 HydrophobicContact CE2-CD1 4.17Å; F263-L269 HydrophobicContact CG-CB 4.05Å; F263-L269 HydrophobicContact CG-CD1 4.02Å; F263-L269 HydrophobicContact CZ-CD1 4.09Å; F263-M273 HydrophobicContact CD2-SD 4.36Å
264	T	56.2	Low	60.4	Low	114 Å²	114	90.7 Å²	90.7	70%	0.699	47%	0.466	S	S	*	.	S	Bend	trans	-61.3	-32	174.7	49.8	0	0	0	0	113.1	E262	E262-T264 VanDerWaalsContact C-N 3.34Å; E262-T264 PolarHBondContact O-N 2.88Å
265	T	52.5	Low	59.2	Low	126 Å²	126	96 Å²	96	77%	0.773	49%	0.487	S	S	*	.	S	Bend	trans	-81.9	-26.5	-179.9	-26.4	0	0	0	0	113.9	F263	F263-T265 VanDerWaalsContact C-N 3.26Å; F263-T265 PolarHBondContact O-N 3.31Å
266	L	54.3	Low	58.1	Low	88 Å²	88	99.4 Å²	99.4	46%	0.461	51%	0.507	S	S	.	.			trans	-127.9	81.5	-172.2	-80.4	169.8	0	0	0	110.9	F263 S268 L269	F263-L266 HydrophobicContact CB-CB 4.33Å; F263-L266 HydrophobicContact CD1-CB 4.42Å; F263-L266 CarbonylContact O-C 3.55Å; F263-L266 PolarHBondContact O-N 3.17Å; L266-S268 PolarHBondContact O-N 2.86Å; L266-S268 VanDerWaalsContact O-N 3.07Å; L266-L269 HydrophobicContact CB-CD1 4.04Å; L266-L269 HydrophobicContact CB-CG 4.25Å; L266-L269 HydrophobicContact CD1-CD1 3.92Å; L266-L269 PolarHBondContact O-N 2.86Å
267	K	59.3	Low	57	Low	163 Å²	163	96.9 Å²	96.9	71%	0.709	50%	0.501	S	S	*	.	H	α-helix	trans	-53.3	-29.9	178.9	-64.3	-177.4	178.2	-179.3	0	113.6	L269 Q270	K267-L269 PolarHBondContact O-N 3.4Å; K267-Q270 PolarHBondContact O-N 3.29Å
268	S	58.8	Low	56.7	Low	85 Å²	85	100.1 Å²	100.1	59%	0.594	50%	0.5	S	S	*	.	H	α-helix	trans	-63.2	-18.6	174.9	49.6	0	0	0	0	114.6	L266 P272	L266-S268 PolarHBondContact O-N 2.86Å; L266-S268 VanDerWaalsContact O-N 3.07Å; S268-P272 WeakPolarHBondContact O-CD 3.39Å
269	L	57.8	Low	56.8	Low	70 Å²	70	98.7 Å²	98.7	37%	0.366	50%	0.498	S	S	.	.	H	α-helix	trans	-95.4	-13.5	177.3	-64.6	177.7	0	0	0	113.7	F263 L266 K267 M273	F263-L269 HydrophobicContact CB-CB 4.15Å; F263-L269 HydrophobicContact CD1-CD1 3.93Å; F263-L269 HydrophobicContact CD2-CB 3.96Å; F263-L269 HydrophobicContact CD2-CD1 4.14Å; F263-L269 HydrophobicContact CE1-CD1 3.97Å; F263-L269 HydrophobicContact CE2-CD1 4.17Å; F263-L269 HydrophobicContact CG-CB 4.05Å; F263-L269 HydrophobicContact CG-CD1 4.02Å; F263-L269 HydrophobicContact CZ-CD1 4.09Å; L266-L269 HydrophobicContact CB-CD1 4.04Å; L266-L269 HydrophobicContact CB-CG 4.25Å; L266-L269 HydrophobicContact CD1-CD1 3.92Å; L266-L269 PolarHBondContact O-N 2.86Å; K267-L269 PolarHBondContact O-N 3.4Å; L269-M273 WeakPolarHBondContact O-CB 3.29Å; L269-M273 PolarHBondContact O-N 3.21Å
270	Q	59.2	Low	56.7	Low	46 Å²	46	98.5 Å²	98.5	22%	0.215	50%	0.497	C	S	.	.	H	α-helix	trans	-65.6	-42.1	176.6	-68.9	-175.1	-79.6	0	0	112	E262 K267 M273 K274	E262-Q270 PolarHBondContact OE1-NE2 3.07Å; K267-Q270 PolarHBondContact O-N 3.29Å; Q270-M273 PolarHBondContact O-N 3.34Å; Q270-K274 WeakPolarHBondContact O-CG 3.42Å; Q270-K274 PolarHBondContact O-N 3.34Å
271	D	59.6	Low	56.5	Low	103 Å²	103	99.7 Å²	99.7	55%	0.551	52%	0.518	S	S	*	.	H	α-helix	trans	-70	-42.3	-177.5	-73.8	-13.5	0	0	0	114.3	M273 K275	D271-M273 VanDerWaalsContact C-N 3.28Å; D271-M273 PolarHBondContact O-N 2.78Å; D271-K275 WeakPolarHBondContact O-CG 3.34Å; D271-K275 PolarHBondContact O-N 3.35Å
272	P	60.3	Low	55.9	Low	70 Å²	70	100.4 Å²	100.4	46%	0.455	52%	0.524	S	S	.	.	H	α-helix	trans	-58	-39	168.3	-26.7	34.9	0	0	0	113.1	S268 K275 L276	S268-P272 WeakPolarHBondContact O-CD 3.39Å; P272-K275 PolarHBondContact O-N 3.24Å; P272-L276 PolarHBondContact O-N 3.06Å
273	M	56.3	Low	55.2	Low	41 Å²	41	102.8 Å²	102.8	20%	0.202	53%	0.533	C	S	.	.	H	α-helix	trans	-76.1	-40.1	-173.9	-160.2	164.2	-165.9	0	0	112.7	P260 F263 L269 Q270 D271 K275 L276 V277	P260-M273 HydrophobicContact CB-CE 3.88Å; P260-M273 HydrophobicContact CB-CG 4.19Å; P260-M273 HydrophobicContact CB-SD 4.27Å; F263-M273 HydrophobicContact CD2-SD 4.36Å; L269-M273 WeakPolarHBondContact O-CB 3.29Å; L269-M273 PolarHBondContact O-N 3.21Å; Q270-M273 PolarHBondContact O-N 3.34Å; D271-M273 VanDerWaalsContact C-N 3.28Å; D271-M273 PolarHBondContact O-N 2.78Å; M273-K275 VanDerWaalsContact C-N 3.25Å; M273-K275 PolarHBondContact O-N 2.91Å; M273-L276 WeakPolarHBondContact O-CB 3.39Å; M273-L276 PolarHBondContact O-N 3.04Å; M273-V277 WeakPolarHBondContact O-CG2 3.48Å; M273-V277 PolarHBondContact O-N 2.98Å; M273-V277 VanDerWaalsContact O-N 3.13Å
274	K	59.6	Low	54.2	Low	102 Å²	102	104.6 Å²	104.6	44%	0.443	55%	0.554	S	S	.	*	H	α-helix	trans	-56.3	-40.7	171.5	-73.5	171	-179	176.7	0	111.7	Q270 L276 V277 E278	Q270-K274 WeakPolarHBondContact O-CG 3.42Å; Q270-K274 PolarHBondContact O-N 3.34Å; K274-L276 PolarHBondContact O-N 3.12Å; K274-V277 PolarHBondContact O-N 2.67Å; K274-E278 WeakPolarHBondContact O-CG 3.47Å; K274-E278 PolarHBondContact O-N 3.3Å
275	K	59.8	Low	53.2	Low	133 Å²	133	104.6 Å²	104.6	58%	0.578	56%	0.556	S	S	*	*	H	α-helix	trans	-69.9	-11.1	175.6	-70	172.2	-178	169.8	0	115.1	D271 P272 M273 K279	D271-K275 WeakPolarHBondContact O-CG 3.34Å; D271-K275 PolarHBondContact O-N 3.35Å; P272-K275 PolarHBondContact O-N 3.24Å; M273-K275 VanDerWaalsContact C-N 3.25Å; M273-K275 PolarHBondContact O-N 2.91Å; K275-K279 WeakPolarHBondContact O-CD 3.39Å; K275-K279 WeakPolarHBondContact O-CG 3.32Å
276	L	58.9	Low	52.4	Low	110 Å²	110	104.8 Å²	104.8	58%	0.576	56%	0.559	S	S	*	*	H	α-helix	trans	-88.6	-43.4	168.6	-74.1	165.7	0	0	0	110.9	P272 M273 K274 E278 K279 E280	P272-L276 PolarHBondContact O-N 3.06Å; M273-L276 WeakPolarHBondContact O-CB 3.39Å; M273-L276 PolarHBondContact O-N 3.04Å; K274-L276 PolarHBondContact O-N 3.12Å; L276-E278 VanDerWaalsContact C-N 3.35Å; L276-E278 PolarHBondContact O-N 3.15Å; L276-K279 WeakPolarHBondContact O-CB 3.36Å; L276-K279 PolarHBondContact O-N 2.91Å; L276-E280 PolarHBondContact O-N 3.15Å; L276-E280 VanDerWaalsContact O-N 3.07Å
277	V	58.5	Low	51.3	Low	64 Å²	64	110.5 Å²	110.5	39%	0.388	58%	0.58	S	S	.	*	H	α-helix	trans	-58.8	-45.2	176.8	178.5	0	0	0	0	111.2	P260 M273 K274 K279 E280 G281	P260-V277 HydrophobicContact CB-CG2 3.72Å; P260-V277 HydrophobicContact CG-CG2 3.75Å; M273-V277 WeakPolarHBondContact O-CG2 3.48Å; M273-V277 PolarHBondContact O-N 2.98Å; M273-V277 VanDerWaalsContact O-N 3.13Å; K274-V277 PolarHBondContact O-N 2.67Å; V277-K279 PolarHBondContact O-N 3.2Å; V277-E280 PolarHBondContact O-N 3.22Å; V277-G281 PolarHBondContact O-N 3.49Å; V277-G281 VanDerWaalsContact O-N 3.09Å
278	E	58.2	Low	50	Low	125 Å²	125	112.3 Å²	112.3	58%	0.584	59%	0.588	S	S	*	*	H	α-helix	trans	-62	-22.6	175.1	-73.4	179.6	-174.5	0	0	114.4	K274 L276	K274-E278 WeakPolarHBondContact O-CG 3.47Å; K274-E278 PolarHBondContact O-N 3.3Å; L276-E278 VanDerWaalsContact C-N 3.35Å; L276-E278 PolarHBondContact O-N 3.15Å
279	K	56.2	Low	48.5	Very low	149 Å²	149	116.6 Å²	116.6	65%	0.648	60%	0.599	S	S	*	*	H	α-helix	trans	-85.6	-36.6	176.7	-73.8	177.1	179.6	-178.8	0	112	K275 L276 V277 K282	K275-K279 WeakPolarHBondContact O-CD 3.39Å; K275-K279 WeakPolarHBondContact O-CG 3.32Å; L276-K279 WeakPolarHBondContact O-CB 3.36Å; L276-K279 PolarHBondContact O-N 2.91Å; V277-K279 PolarHBondContact O-N 3.2Å; K279-K282 PolarHBondContact O-N 3.46Å
280	E	53.4	Low	47.1	Very low	105 Å²	105	120.8 Å²	120.8	49%	0.491	62%	0.621	S	S	.	*	H	α-helix	trans	-67	-42.4	176.1	-66.5	-111.2	84.7	0	0	111.2	L276 V277 K282 K283	L276-E280 PolarHBondContact O-N 3.15Å; L276-E280 VanDerWaalsContact O-N 3.07Å; V277-E280 PolarHBondContact O-N 3.22Å; E280-K282 PolarHBondContact O-N 3.22Å; E280-K282 VanDerWaalsContact O-N 3.07Å; E280-K283 PolarHBondContact O-N 2.92Å; E280-K283 WeakPolarHBondContact OE1-CE 3.4Å; E280-K283 IonicContact OE1-NZ 2.6Å; E280-K283 PolarHBondContact OE1-NZ 3.49Å
281	G	45.2	Very low	46.2	Very low	72 Å²	72	123.7 Å²	123.7	74%	0.742	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-1.7	174.6	0	0	0	0	0	115.6	V277	V277-G281 PolarHBondContact O-N 3.49Å; V277-G281 VanDerWaalsContact O-N 3.09Å
282	K	43.6	Very low	44.6	Very low	169 Å²	169	128 Å²	128	74%	0.735	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.9	25.1	179.6	-75.8	179.6	177.8	166.6	0	113.7	K279 E280 S284	K279-K282 PolarHBondContact O-N 3.46Å; E280-K282 PolarHBondContact O-N 3.22Å; E280-K282 VanDerWaalsContact O-N 3.07Å; K282-S284 PolarHBondContact O-N 3.25Å
283	K	38.4	Very low	43.1	Very low	157 Å²	157	129.1 Å²	129.1	68%	0.683	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-70.6	118.8	169.5	-76.5	170.8	172.6	169.4	0	110.6	E280	E280-K283 PolarHBondContact O-N 2.92Å; E280-K283 WeakPolarHBondContact OE1-CE 3.4Å; E280-K283 IonicContact OE1-NZ 2.6Å; E280-K283 PolarHBondContact OE1-NZ 3.49Å
284	S	33.1	Very low	41.9	Very low	105 Å²	105	133.6 Å²	133.6	73%	0.734	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-76.1	161	-177.9	42.4	0	0	0	0	113.2	K282	K282-S284 PolarHBondContact O-N 3.25Å
285	P	34.4	Very low	40.4	Very low	114 Å²	114	132.7 Å²	132.7	74%	0.74	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-64.4	156.4	178.2	26.7	-36	0	0	0	112.9
286	P	36.3	Very low	38.9	Very low	130 Å²	130	135.7 Å²	135.7	84%	0.844	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-68.9	133.7	-169.4	27.5	-35.5	0	0	0	113
287	K	31.2	Very low	37.6	Very low	207 Å²	207	138.8 Å²	138.8	90%	0.9	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-94.8	145.5	160.3	-76.8	-172.8	173.7	-177	0	109.7
288	K	31.2	Very low	37	Very low	202 Å²	202	139.8 Å²	139.8	88%	0.878	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-74.7	165.9	-178.3	-65.6	-175.1	175.5	-174.4	0	112.6
289	E	27.9	Very low	36	Very low	175 Å²	175	142.7 Å²	142.7	82%	0.818	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-64.4	146.3	-178.8	-55.1	126.5	129.8	0	0	113.3
290	N	27.7	Very low	34.8	Very low	158 Å²	158	143.6 Å²	143.6	85%	0.845	77%	0.77	S	S	*	*				-163.7	156.1	102.6	-125.6	13.1	0	0	0	111.2
291	P	39.5	Very low	33.9	Very low	107 Å²	107	145.2 Å²	145.2	70%	0.695	78%	0.781	S	S	*	*			trans	-106.4	156	-178.7	38.9	-32.1	0	0	0	113.9
292	E	26.2	Very low	33.2	Very low	192 Å²	192	149 Å²	149	90%	0.897	78%	0.783	S	S	*	*			trans	-173.1	143.2	140.5	-112.8	172.4	-173.4	0	0	113.5
293	A	30.2	Very low	32.5	Very low	94 Å²	94	145.4 Å²	145.4	78%	0.777	78%	0.779	S	S	*	*			trans	49.7	151.3	151.2	0	0	0	0	0	123.2
294	V	29.7	Very low	32.1	Very low	136 Å²	136	144.7 Å²	144.7	82%	0.824	78%	0.782	S	S	*	*			cis	-173.3	147.6	-38	122	0	0	0	0	108.4
295	A	28.6	Very low	31.9	Very low	83 Å²	83	147.7 Å²	147.7	69%	0.686	78%	0.784	S	S	*	*			trans	65.3	154	166.4	0	0	0	0	0	118.2
296	Q	28.7	Very low	31.6	Very low	196 Å²	196	149.4 Å²	149.4	92%	0.916	79%	0.788	S	S	*	*			cis	-149.5	168	-6.7	-125.1	162.3	10.4	0	0	112.9
297	E	32.3	Very low	31.3	Very low	174 Å²	174	152.1 Å²	152.1	81%	0.813	79%	0.789	S	S	*	*			trans	-87.7	-158	-173.9	-127.7	-164.9	-133.4	0	0	111.8
298	P	45.8	Very low	31.2	Very low	86 Å²	86	148.2 Å²	148.2	56%	0.558	78%	0.778	S	S	*	*			cis	-143.7	-176.4	4.8	31.5	-5.3	0	0	0	118.6
299	K	37	Very low	31.1	Very low	185 Å²	185	145.5 Å²	145.5	80%	0.804	77%	0.768	S	S	*	*			trans	81.3	148.4	156.9	-40.4	-167.2	-178.6	178.3	0	117.6
300	Q	31.2	Very low	31.1	Very low	168 Å²	168	144.3 Å²	144.3	79%	0.785	76%	0.763	S	S	*	*			cis	-140.6	150.4	24	-82.8	-175.1	-18.4	0	0	115.7
301	L	32.9	Very low	31.4	Very low	139 Å²	139	145.2 Å²	145.2	73%	0.728	76%	0.759	S	S	*	*			trans	67.2	123.2	159.6	-59.5	160.4	0	0	0	117.7
302	I	31.3	Very low	30.7	Very low	151 Å²	151	149.4 Å²	149.4	77%	0.774	77%	0.769	S	S	*	*			cis	77.6	126.5	45.4	-64.1	175.5	0	0	0	111.8
303	S	28.2	Very low	30.8	Very low	95 Å²	95	145.7 Å²	145.7	66%	0.664	76%	0.764	S	S	*	*			cis	-175.2	-171.2	-17.3	-115.9	0	0	0	0	107.9
304	L	30.8	Very low	30.6	Very low	142 Å²	142	146.4 Å²	146.4	74%	0.743	76%	0.764	S	S	*	*			cis	-105.6	-124.2	5.8	-69.6	160.7	0	0	0	110
305	E	29.1	Very low	30.2	Very low	167 Å²	167	146.5 Å²	146.5	78%	0.78	77%	0.765	S	S	*	*			cis	-171.4	143.7	-6.6	-135.8	153.6	-134.2	0	0	105.2
306	D	29.1	Very low	29.9	Very low	151 Å²	151	149 Å²	149	81%	0.807	78%	0.775	S	S	*	*			cis	-141.6	-179.9	-9.6	-158.5	-6.1	0	0	0	109
307	E	29.8	Very low	29.7	Very low	187 Å²	187	149.2 Å²	149.2	87%	0.874	77%	0.773	S	S	*	*			trans	-64.8	153.3	-158.7	-75.6	-155.9	116.9	0	0	119.9
308	N	28	Very low	29.2	Very low	125 Å²	125	144.9 Å²	144.9	67%	0.668	77%	0.767	S	S	*	*			trans	-100.8	131.4	178.7	-124.2	-20.8	0	0	0	110.6
309	Q	29.5	Very low	28.2	Very low	144 Å²	144	149.6 Å²	149.6	67%	0.673	78%	0.782	S	S	*	*			trans	65.4	-173.7	145.1	-55.6	159.3	7.8	0	0	114.7
310	H	28.1	Very low	27.6	Very low	151 Å²	151	149 Å²	149	70%	0.699	79%	0.788	S	S	*	*			cis	-137.9	165.6	-6.3	-137.7	-63.9	0	0	0	111.1
311	K	32.7	Very low	27.3	Very low	177 Å²	177	144.1 Å²	144.1	77%	0.77	78%	0.783	S	S	*	*			trans	-54.3	153.1	163.6	-51.4	167.6	-179.6	171.9	0	111
312	E	24.8	Very low	27.1	Very low	195 Å²	195	147 Å²	147	91%	0.911	79%	0.789	S	S	*	*				-157.3	177.2	110.8	-116.5	172.2	-147.3	0	0	113.2
313	S	29.8	Very low	26.8	Very low	114 Å²	114	145.1 Å²	145.1	80%	0.797	79%	0.789	S	S	*	*			trans	-122.6	147	-155.9	55.7	0	0	0	0	114.5
314	S	24.8	Very low	26.8	Very low	109 Å²	109	147.8 Å²	147.8	76%	0.762	80%	0.795	S	S	*	*			trans	-154	129	154.2	65.3	0	0	0	0	113
315	T	22.6	Very low	26.7	Very low	137 Å²	137	148.8 Å²	148.8	84%	0.84	80%	0.8	S	S	*	*			trans	42.7	114.6	142.3	-49	0	0	0	0	120.1
316	C	22	Very low	26.8	Very low	135 Å²	135	145.9 Å²	145.9	91%	0.912	80%	0.796	S	S	*	*			trans	-139.1	148.8	141.4	-105.7	0	0	0	0	110.6
317	K	23	Very low	26.6	Very low	201 Å²	201	143.9 Å²	143.9	87%	0.874	79%	0.793	S	S	*	*			trans	-124.4	159.8	170.8	-121.1	-164.3	-178.4	-168.7	0	108.2
318	A	23.6	Very low	26.5	Very low	83 Å²	83	142.2 Å²	142.2	69%	0.686	80%	0.796	S	S	*	*			trans	70.7	111.1	161.5	0	0	0	0	0	118.9
319	E	23.9	Very low	26.3	Very low	185 Å²	185	142 Å²	142	86%	0.864	79%	0.794	S	S	*	*				90.1	131	124.3	-71	178.3	-176.1	0	0	123.2
320	D	24.3	Very low	26.4	Very low	173 Å²	173	142.4 Å²	142.4	93%	0.925	79%	0.794	S	S	*	*			trans	60.2	156.9	151.4	-108.2	-18.2	0	0	0	122
321	G	25.2	Very low	26.3	Very low	66 Å²	66	140 Å²	140	68%	0.68	79%	0.794	S	S	*	*			trans	146.6	20.3	156.4	0	0	0	0	0	122.6
322	K	28.5	Very low	26	Very low	198 Å²	198	137.2 Å²	137.2	86%	0.861	80%	0.797	S	S	*	*			trans	64.4	122.5	151.7	-164.1	172.9	-172.8	171.9	0	119.5
323	S	25.1	Very low	26.1	Very low	112 Å²	112	131.9 Å²	131.9	78%	0.783	79%	0.786	S	S	*	*			trans	-70.7	140.5	172.8	55.1	0	0	0	0	115
324	I	28.1	Very low	25.9	Very low	151 Å²	151	132.4 Å²	132.4	77%	0.774	79%	0.785	S	S	*	*			trans	-139.1	136.5	155.4	-63	-175.3	0	0	0	109.5
325	L	29.3	Very low	25.8	Very low	163 Å²	163	134.6 Å²	134.6	85%	0.853	79%	0.788	S	S	*	*			trans	-108	150.4	166.6	-70.4	170.3	0	0	0	109.6
326	P	31.8	Very low	26.2	Very low	107 Å²	107	131.8 Å²	131.8	70%	0.695	78%	0.778	S	S	*	*				-132.7	137	122.4	30.6	-17.6	0	0	0	110.7
327	S	24.5	Very low	26.4	Very low	108 Å²	108	131.6 Å²	131.6	76%	0.755	78%	0.777	S	S	*	*				68.1	99.7	52	82.8	0	0	0	0	114.2
328	V	26.9	Very low	26.6	Very low	152 Å²	152	127.8 Å²	127.8	92%	0.921	78%	0.776	S	S	*	*			trans	-137.9	139.2	161.3	179.1	0	0	0	0	107.5
329	D	24.8	Very low	26.8	Very low	120 Å²	120	127.2 Å²	127.2	64%	0.642	78%	0.778	S	S	*	*			trans	-144.5	153.2	-179.6	-174.4	22.7	0	0	0	109.9
330	K	30.6	Very low	27.9	Very low	154 Å²	154	124.6 Å²	124.6	67%	0.67	78%	0.777	S	S	*	*			trans	57	94.8	164.8	-81	165.6	-165.5	71.6	0	122.1
331	S	25.6	Very low	28.1	Very low	101 Å²	101	124.8 Å²	124.8	71%	0.706	78%	0.777	S	S	*	*				65.6	156.6	102.3	71.6	0	0	0	0	124.2
332	S	27.9	Very low	28.2	Very low	117 Å²	117	124.9 Å²	124.9	82%	0.818	78%	0.778	S	S	*	*			trans	87.8	143.7	162.4	78.3	0	0	0	0	117.7
333	A	26.2	Very low	28.1	Very low	83 Å²	83	124.2 Å²	124.2	69%	0.686	78%	0.778	S	S	*	*			cis	-168.6	-177.9	-18.8	0	0	0	0	0	112
334	T	24.8	Very low	28.1	Very low	125 Å²	125	125.7 Å²	125.7	77%	0.767	78%	0.776	S	S	*	*			trans	108.2	128.9	153.2	67.3	0	0	0	0	121.4
335	D	24.2	Very low	28.2	Very low	156 Å²	156	126.5 Å²	126.5	83%	0.834	78%	0.781	S	S	*	*			trans	67.6	150.7	144.4	-61.8	-0.2	0	0	0	123.8
336	A	30.5	Very low	28.1	Very low	77 Å²	77	125 Å²	125	64%	0.636	77%	0.774	S	S	*	*			cis	-172.9	160.9	-26.9	0	0	0	0	0	111.9
337	C	25.1	Very low	27.9	Very low	131 Å²	131	128 Å²	128	89%	0.885	78%	0.781	S	S	*	*			trans	66.5	154.3	161.6	-71.9	0	0	0	0	119.1
338	S	28.7	Very low	28	Very low	121 Å²	121	131.6 Å²	131.6	85%	0.846	78%	0.782	S	S	*	*			cis	-151.6	169.6	-6.8	45.4	0	0	0	0	111.2
339	G	27.6	Very low	28.5	Very low	72 Å²	72	129.6 Å²	129.6	74%	0.742	77%	0.773	S	S	*	*			trans	-105.2	-129	-166.7	0	0	0	0	0	118.1
340	P	45.4	Very low	28.4	Very low	130 Å²	130	134 Å²	134	84%	0.844	79%	0.786	S	S	*	*				-128.9	163.2	-118	39.9	-25.8	0	0	0	117.2
341	I	29.9	Very low	28.3	Very low	177 Å²	177	135.7 Å²	135.7	91%	0.908	80%	0.797	S	S	*	*			trans	-137.9	150.9	160.2	-75.9	178.4	0	0	0	107.8
342	G	26.8	Very low	28.3	Very low	68 Å²	68	135.8 Å²	135.8	70%	0.701	80%	0.803	S	S	*	*			trans	-157.9	152.3	166	0	0	0	0	0	111.7
343	E	26	Very low	28.1	Very low	184 Å²	184	135.8 Å²	135.8	86%	0.86	80%	0.802	S	S	*	*			trans	-157.4	157.7	165.1	-126.4	179.9	170.9	0	0	111.1
344	L	26.4	Very low	28.2	Very low	143 Å²	143	140.1 Å²	140.1	75%	0.749	81%	0.813	S	S	*	*			trans	8.4	127.3	168	-92.9	58.4	0	0	0	119.9
345	L	30.1	Very low	28.1	Very low	167 Å²	167	137.8 Å²	137.8	87%	0.874	81%	0.814	S	S	*	*				-156.4	140.5	81.3	-95.3	175.7	0	0	0	111.9
346	D	27.3	Very low	28.7	Very low	132 Å²	132	135.9 Å²	135.9	71%	0.706	81%	0.809	S	S	*	*			trans	-104.9	146.9	173.2	174.4	37.1	0	0	0	110.2
347	M	27.1	Very low	28.5	Very low	171 Å²	171	140.2 Å²	140.2	84%	0.842	82%	0.82	S	S	*	*			trans	-175.3	125.1	152.4	-106.1	-63.8	125.9	0	0	110.4
348	K	26	Very low	28.6	Very low	182 Å²	182	138.9 Å²	138.9	79%	0.791	82%	0.818	S	S	*	*			trans	-131.1	172.6	168.1	-141.5	-170	-179.7	-179.2	0	110.1
349	P	37	Very low	28.5	Very low	111 Å²	111	136.7 Å²	136.7	72%	0.721	82%	0.815	S	S	*	*				-90.4	175.9	-99.9	39.1	-29.4	0	0	0	113.7
350	K	23.4	Very low	28.4	Very low	211 Å²	211	140 Å²	140	92%	0.917	82%	0.822	S	S	*	*			trans	-137.3	133.7	161.8	-98.5	-175.4	176.3	177	0	112.3
351	E	29.1	Very low	27.8	Very low	191 Å²	191	139.6 Å²	139.6	89%	0.893	82%	0.818	S	S	*	*			trans	-97.2	145.4	169.4	-60.5	176.4	131	0	0	110.2
352	A	24.3	Very low	27.6	Very low	103 Å²	103	138 Å²	138	85%	0.851	81%	0.807	S	S	*	*			trans	-162	151.2	162.5	0	0	0	0	0	108.8
353	C	25.4	Very low	27.8	Very low	116 Å²	116	140.4 Å²	140.4	78%	0.784	81%	0.811	S	S	*	*			trans	-126.3	164.2	-160.5	-58	0	0	0	0	115.2
354	L	27.2	Very low	28.1	Very low	175 Å²	175	140.8 Å²	140.8	92%	0.916	81%	0.812	S	S	*	*			trans	81.4	81.3	154.5	-65.9	163.2	0	0	0	121.8
355	G	22.6	Very low	28.5	Very low	76 Å²	76	136.7 Å²	136.7	78%	0.784	80%	0.804	S	S	*	*				63.4	-174.8	128.3	0	0	0	0	0	121.7
356	P	36.1	Very low	29.3	Very low	115 Å²	115	130.6 Å²	130.6	75%	0.747	78%	0.782	S	S	*	*			cis	-134.5	163.3	-10	41.7	-25.9	0	0	0	116.7
357	I	27.4	Very low	30.3	Very low	169 Å²	169	127.3 Å²	127.3	87%	0.867	76%	0.764	S	S	*	*			trans	59.8	110.9	154.6	-59.6	157.3	0	0	0	120.3
358	A	26.9	Very low	31.5	Very low	102 Å²	102	124.4 Å²	124.4	84%	0.843	75%	0.747	S	S	*	*			trans	-156.8	141.2	132	0	0	0	0	0	108.2
359	G	26.7	Very low	33	Very low	76 Å²	76	120.7 Å²	120.7	78%	0.784	74%	0.736	S	S	*	*			trans	-117.5	150.8	-163	0	0	0	0	0	116.9
360	T	25.4	Very low	34.2	Very low	142 Å²	142	119.1 Å²	119.1	87%	0.871	72%	0.721	S	S	*	*			trans	-149.2	156.1	160.6	12	0	0	0	0	108.3
361	P	32.2	Very low	36.1	Very low	120 Å²	120	112.7 Å²	112.7	78%	0.779	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-79.9	148.7	-154.8	30.4	-36.6	0	0	0	115.7
362	E	25.3	Very low	37.9	Very low	145 Å²	145	108.9 Å²	108.9	68%	0.678	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-74.7	147.4	158.3	-75	-155.4	146.4	0	0	110.8	K368	E362-K368 IonicContact OE1-NZ 2.71Å; E362-K368 PolarHBondContact OE1-NZ 3.29Å; E362-K368 IonicContact OE2-NZ 2.74Å; E362-K368 PolarHBondContact OE2-NZ 2.86Å
363	P	32.7	Very low	39.9	Very low	118 Å²	118	108.5 Å²	108.5	77%	0.766	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-75.7	151.8	162.6	33	-33.4	0	0	0	111.6	G365	P363-G365 PolarHBondContact O-N 2.69Å
364	E	31.3	Very low	41.8	Very low	191 Å²	191	103.4 Å²	103.4	89%	0.893	63%	0.63	S	S	*	*			trans	-54.5	109.1	-165.5	-61.4	168.8	135.2	0	0	116.2	G366	E364-G366 VanDerWaalsContact C-N 3.3Å; E364-G366 PolarHBondContact O-N 3.03Å
365	G	35.1	Very low	43.6	Very low	57 Å²	57	98.3 Å²	98.3	59%	0.588	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn		69	-45.1	114.8	0	0	0	0	0	121.1	P363	P363-G365 PolarHBondContact O-N 2.69Å
366	G	46.2	Very low	45.8	Very low	39 Å²	39	101.1 Å²	101.1	40%	0.402	60%	0.596	S	S	.	*	H	α-helix	trans	-86.3	-44.8	-170.4	0	0	0	0	0	114.3	E364 K368 D369 D370	E364-G366 VanDerWaalsContact C-N 3.3Å; E364-G366 PolarHBondContact O-N 3.03Å; G366-K368 PolarHBondContact O-N 3.39Å; G366-D369 PolarHBondContact O-N 2.95Å; G366-D370 PolarHBondContact O-N 3.46Å
367	D	49.9	Very low	47.3	Very low	63 Å²	63	97.2 Å²	97.2	34%	0.337	57%	0.569	S	S	.	*	H	α-helix	trans	-64	-5.7	-169.2	-123.3	61.3	0	0	0	115.3	K110	K110-D367 PolarHBondContact NZ-O 2.99Å; K110-D367 IonicContact NZ-OD2 3.32Å; K110-D367 PolarHBondContact NZ-OD2 3.4Å
368	K	51.3	Low	48.7	Very low	110 Å²	110	90.6 Å²	90.6	48%	0.478	53%	0.534	S	S	.	.	H	α-helix	trans	-95.6	-44.1	174.2	-73.1	174.3	-179.5	170.4	0	111.1	E362 G366 L371 L372	E362-K368 IonicContact OE1-NZ 2.71Å; E362-K368 PolarHBondContact OE1-NZ 3.29Å; E362-K368 IonicContact OE2-NZ 2.74Å; E362-K368 PolarHBondContact OE2-NZ 2.86Å; G366-K368 PolarHBondContact O-N 3.39Å; K368-L371 PolarHBondContact O-N 2.88Å; K368-L372 WeakPolarHBondContact O-CG 3.47Å; K368-L372 PolarHBondContact O-N 2.89Å
369	D	58.1	Low	50.1	Low	104 Å²	104	89.4 Å²	89.4	56%	0.556	52%	0.52	S	S	*	.	H	α-helix	trans	-76.4	-38.5	-172.7	-67.6	-1.4	0	0	0	111.5	G366 L371 L372 L373	G366-D369 PolarHBondContact O-N 2.95Å; D369-L371 PolarHBondContact O-N 2.96Å; D369-L372 PolarHBondContact O-N 2.85Å; D369-L373 WeakPolarHBondContact O-CB 3.33Å; D369-L373 PolarHBondContact O-N 2.97Å
370	D	61.1	Low	51.3	Low	78 Å²	78	90 Å²	90	42%	0.417	52%	0.517	S	S	.	.	H	α-helix	trans	-60.3	-35.8	170.6	-74.9	-27.4	0	0	0	112	G366 L374	G366-D370 PolarHBondContact O-N 3.46Å; D370-L374 WeakPolarHBondContact O-CB 3.47Å; D370-L374 WeakPolarHBondContact O-CG 3.3Å; D370-L374 PolarHBondContact O-N 2.96Å
371	L	63.9	Low	52.3	Low	76 Å²	76	84.7 Å²	84.7	40%	0.398	49%	0.486	S	S	.	.	H	α-helix	trans	-74.2	-32.7	178.6	-169.9	66.2	0	0	0	111.9	K368 D369 N375	K368-L371 PolarHBondContact O-N 2.88Å; D369-L371 PolarHBondContact O-N 2.96Å; L371-N375 WeakPolarHBondContact O-CB 3.36Å; L371-N375 PolarHBondContact O-N 3.04Å
372	L	67.5	Low	52.6	Low	112 Å²	112	81.8 Å²	81.8	59%	0.586	47%	0.468	S	S	*	.	H	α-helix	trans	-68.5	-45.5	170.9	-72.6	169.8	0	0	0	111	K368 D369 L374 N375 E376	K368-L372 WeakPolarHBondContact O-CG 3.47Å; K368-L372 PolarHBondContact O-N 2.89Å; D369-L372 PolarHBondContact O-N 2.85Å; L372-L374 PolarHBondContact O-N 3.28Å; L372-N375 CarbonylContact O-C 3.59Å; L372-N375 WeakPolarHBondContact O-CA 3.48Å; L372-N375 WeakPolarHBondContact O-CB 3.34Å; L372-N375 PolarHBondContact O-N 3.4Å; L372-E376 PolarHBondContact O-N 3.02Å
373	L	66.6	Low	53.5	Low	94 Å²	94	80.3 Å²	80.3	49%	0.492	46%	0.464	S	S	.	.	H	α-helix	trans	-58.5	-46	175.3	-178.4	69.1	0	0	0	111.6	D369 N375 E376 I377	D369-L373 WeakPolarHBondContact O-CB 3.33Å; D369-L373 PolarHBondContact O-N 2.97Å; L373-N375 VanDerWaalsContact C-N 3.31Å; L373-N375 PolarHBondContact O-N 3.46Å; L373-E376 PolarHBondContact O-N 3.03Å; L373-I377 HydrophobicContact CG-CD1 4.13Å; L373-I377 VanDerWaalsContact O-CG1 3.28Å; L373-I377 WeakPolarHBondContact O-CG1 3.21Å; L373-I377 PolarHBondContact O-N 3Å
374	L	65.1	Low	53.9	Low	9 Å²	9	80 Å²	80	5%	0.047	46%	0.455	C	S	.	.	H	α-helix	trans	-58.6	-43.7	172.2	-77.5	173.1	0	0	0	111.7	A114 A250 I251 F255 D370 L372 E376 I377 F378	A114-L374 HydrophobicContact CB-CD1 4.43Å; A250-L374 HydrophobicContact CB-CD2 3.93Å; I251-L374 HydrophobicContact CG1-CD2 3.95Å; F255-L374 HydrophobicContact CE2-CD1 4.48Å; D370-L374 WeakPolarHBondContact O-CB 3.47Å; D370-L374 WeakPolarHBondContact O-CG 3.3Å; D370-L374 PolarHBondContact O-N 2.96Å; L372-L374 PolarHBondContact O-N 3.28Å; L374-E376 VanDerWaalsContact C-N 3.33Å; L374-E376 PolarHBondContact O-N 3.46Å; L374-I377 PolarHBondContact O-N 2.77Å; L374-F378 HydrophobicContact CB-CE2 4.33Å; L374-F378 WeakPolarHBondContact O-CD2 3.43Å; L374-F378 WeakPolarHBondContact O-CG 3.45Å; L374-F378 PolarHBondContact O-N 3.19Å
375	N	63.8	Low	54.6	Low	69 Å²	69	77.5 Å²	77.5	37%	0.369	44%	0.444	S	S	.	.	H	α-helix	trans	-67.3	-34.4	179.8	-155.8	72.1	0	0	0	112.2	K117 L371 L372 L373 F378 S379	K117-N375 PolarHBondContact NZ-OD1 3.39Å; L371-N375 WeakPolarHBondContact O-CB 3.36Å; L371-N375 PolarHBondContact O-N 3.04Å; L372-N375 CarbonylContact O-C 3.59Å; L372-N375 WeakPolarHBondContact O-CA 3.48Å; L372-N375 WeakPolarHBondContact O-CB 3.34Å; L372-N375 PolarHBondContact O-N 3.4Å; L373-N375 VanDerWaalsContact C-N 3.31Å; L373-N375 PolarHBondContact O-N 3.46Å; N375-F378 PolarHBondContact O-N 3.47Å; N375-S379 WeakPolarHBondContact O-CB 3.34Å; N375-S379 PolarHBondContact O-N 3.33Å; N375-S379 PolarHBondContact O-OG 2.97Å
376	E	69.9	Low	55.3	Low	134 Å²	134	76.5 Å²	76.5	63%	0.626	43%	0.433	S	S	*	.	H	α-helix	trans	-66.9	-43.4	171.5	-173	172	-168.2	0	0	111.7	L372 L373 L374 F378 S379 A380	L372-E376 PolarHBondContact O-N 3.02Å; L373-E376 PolarHBondContact O-N 3.03Å; L374-E376 VanDerWaalsContact C-N 3.33Å; L374-E376 PolarHBondContact O-N 3.46Å; E376-F378 VanDerWaalsContact C-N 3.32Å; E376-F378 PolarHBondContact O-N 3.49Å; E376-S379 PolarHBondContact O-N 3.31Å; E376-A380 VanDerWaalsContact O-CB 3.29Å; E376-A380 WeakPolarHBondContact O-CB 3.3Å; E376-A380 PolarHBondContact O-N 2.83Å
377	I	66.9	Low	55.6	Low	34 Å²	34	79.9 Å²	79.9	17%	0.174	44%	0.439	C	S	.	.	H	α-helix	trans	-58.8	-43.2	173.1	-70	163.4	0	0	0	110.9	A250 L373 L374 S381	A250-I377 HydrophobicContact CB-CD1 4.07Å; L373-I377 HydrophobicContact CG-CD1 4.13Å; L373-I377 VanDerWaalsContact O-CG1 3.28Å; L373-I377 WeakPolarHBondContact O-CG1 3.21Å; L373-I377 PolarHBondContact O-N 3Å; L374-I377 PolarHBondContact O-N 2.77Å; I377-S381 VanDerWaalsContact O-CB 3.25Å; I377-S381 WeakPolarHBondContact O-CB 3.29Å; I377-S381 PolarHBondContact O-N 3.22Å; I377-S381 PolarHBondContact O-OG 3.11Å
378	F	57.8	Low	55.7	Low	29 Å²	29	78.6 Å²	78.6	13%	0.127	43%	0.43	C	S	.	.	H	α-helix	trans	-64.1	-43.2	174.4	-71.8	-58.2	0	0	0	112.2	K117 A118 T247 I251 L374 N375 E376 C382	K117-F378 HydrophobicContact CB-CD1 4.35Å; K117-F378 HydrophobicContact CB-CD2 4.38Å; K117-F378 HydrophobicContact CB-CE1 3.79Å; K117-F378 HydrophobicContact CB-CE2 3.85Å; K117-F378 HydrophobicContact CB-CZ 3.52Å; K117-F378 HydrophobicContact CD-CD2 3.78Å; K117-F378 HydrophobicContact CD-CE2 3.69Å; K117-F378 HydrophobicContact CD-CG 4.45Å; K117-F378 HydrophobicContact CD-CZ 4.26Å; K117-F378 HydrophobicContact CG-CE2 4.46Å; A118-F378 HydrophobicContact CB-CE1 4.05Å; A118-F378 HydrophobicContact CB-CZ 4.23Å; T247-F378 HydrophobicContact CG2-CD1 4.14Å; T247-F378 HydrophobicContact CG2-CE1 3.51Å; T247-F378 HydrophobicContact CG2-CZ 4.22Å; I251-F378 HydrophobicContact CD1-CZ 4.14Å; L374-F378 HydrophobicContact CB-CE2 4.33Å; L374-F378 WeakPolarHBondContact O-CD2 3.43Å; L374-F378 WeakPolarHBondContact O-CG 3.45Å; L374-F378 PolarHBondContact O-N 3.19Å; N375-F378 PolarHBondContact O-N 3.47Å; E376-F378 VanDerWaalsContact C-N 3.32Å; E376-F378 PolarHBondContact O-N 3.49Å; F378-C382 PolarHBondContact O-N 3.04Å
379	S	56.3	Low	56.2	Low	78 Å²	78	77 Å²	77	55%	0.545	43%	0.433	S	S	.	.	H	α-helix	trans	-70.9	-42.5	-179.6	-71.6	0	0	0	0	113.4	N375 E376 S381 C382	N375-S379 WeakPolarHBondContact O-CB 3.34Å; N375-S379 PolarHBondContact O-N 3.33Å; N375-S379 PolarHBondContact O-OG 2.97Å; E376-S379 PolarHBondContact O-N 3.31Å; S379-S381 VanDerWaalsContact C-N 3.27Å; S379-S381 PolarHBondContact O-N 3.06Å; S379-C382 WeakPolarHBondContact O-CB 3.36Å; S379-C382 PolarHBondContact O-N 3.01Å
380	A	50.7	Low	56.7	Low	88 Å²	88	79.4 Å²	79.4	73%	0.727	43%	0.434	S	S	*	.	H	α-helix	trans	-70.4	-23.2	178.8	0	0	0	0	0	113.1	E376	E376-A380 VanDerWaalsContact O-CB 3.29Å; E376-A380 WeakPolarHBondContact O-CB 3.3Å; E376-A380 PolarHBondContact O-N 2.83Å
381	S	47.1	Very low	56.7	Low	31 Å²	31	79 Å²	79	22%	0.217	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-10.8	176	-57.2	0	0	0	0	113.7	I377 S379 L383	I377-S381 VanDerWaalsContact O-CB 3.25Å; I377-S381 WeakPolarHBondContact O-CB 3.29Å; I377-S381 PolarHBondContact O-N 3.22Å; I377-S381 PolarHBondContact O-OG 3.11Å; S379-S381 VanDerWaalsContact C-N 3.27Å; S379-S381 PolarHBondContact O-N 3.06Å; S381-L383 PolarHBondContact O-N 3.49Å
382	C	38.9	Very low	56.8	Low	59 Å²	59	77.7 Å²	77.7	40%	0.399	42%	0.419	S	S	.	.			trans	-78.3	109.7	-175.1	-158.8	0	0	0	0	110.6	F378 S379	F378-C382 PolarHBondContact O-N 3.04Å; S379-C382 WeakPolarHBondContact O-CB 3.36Å; S379-C382 PolarHBondContact O-N 3.01Å
383	L	43	Very low	57.2	Low	114 Å²	114	74.2 Å²	74.2	60%	0.597	41%	0.407	S	S	*	.			trans	-61.8	146.6	155.6	-73	166.3	0	0	0	108.2	S381 E385	S381-L383 PolarHBondContact O-N 3.49Å; L383-E385 PolarHBondContact O-N 3.35Å; L383-E385 VanDerWaalsContact O-N 3.15Å
384	D	42	Very low	57.5	Low	110 Å²	110	73.9 Å²	73.9	59%	0.588	42%	0.418	S	S	*	.			trans	-42.5	119.7	-175.5	171.8	33.6	0	0	0	112	G386 E387 F388	D384-G386 PolarHBondContact O-N 3.42Å; D384-G386 VanDerWaalsContact O-N 3.07Å; D384-G386 PolarHBondContact OD1-N 3.31Å; D384-E387 PolarHBondContact O-N 2.69Å; D384-E387 PolarHBondContact OD2-N 2.88Å; D384-F388 PolarHBondContact O-N 3.39Å
385	E	45.8	Very low	57.5	Low	140 Å²	140	75.1 Å²	75.1	65%	0.654	43%	0.426	S	S	*	.	H	α-helix	trans	-56.1	-28.5	178.3	-76.8	-159.1	148.8	0	0	110.9	L383 E387 S389	L383-E385 PolarHBondContact O-N 3.35Å; L383-E385 VanDerWaalsContact O-N 3.15Å; E385-E387 VanDerWaalsContact C-N 3.29Å; E385-E387 PolarHBondContact O-N 3.33Å; E385-S389 WeakPolarHBondContact O-CB 3.45Å; E385-S389 PolarHBondContact O-N 2.91Å
386	G	50.4	Low	57.9	Low	35 Å²	35	74.9 Å²	74.9	36%	0.361	42%	0.421	S	S	.	.	H	α-helix	trans	-63.3	-27.6	174.2	0	0	0	0	0	114.5	D384 R390	D384-G386 PolarHBondContact O-N 3.42Å; D384-G386 VanDerWaalsContact O-N 3.07Å; D384-G386 PolarHBondContact OD1-N 3.31Å; G386-R390 WeakPolarHBondContact O-CG 3.4Å; G386-R390 PolarHBondContact O-NE 3.14Å
387	E	51.4	Low	57.3	Low	110 Å²	110	70.4 Å²	70.4	51%	0.514	41%	0.412	S	S	.	.	H	α-helix	trans	-86.6	-47.3	174.2	-170.7	139.3	-90.4	0	0	112	D384 E385 S389 R390 E391	D384-E387 PolarHBondContact O-N 2.69Å; D384-E387 PolarHBondContact OD2-N 2.88Å; E385-E387 VanDerWaalsContact C-N 3.29Å; E385-E387 PolarHBondContact O-N 3.33Å; E387-S389 VanDerWaalsContact C-N 3.35Å; E387-S389 PolarHBondContact O-N 2.84Å; E387-R390 VanDerWaalsContact CA-NH2 3.33Å; E387-R390 WeakPolarHBondContact O-CB 3.24Å; E387-R390 PolarHBondContact O-N 2.77Å; E387-R390 IonicContact OE1-CZ 3.03Å; E387-R390 IonicContact OE1-NH1 2.86Å; E387-R390 IonicContact OE1-NH2 3.63Å; E387-R390 PolarHBondContact OE1-NH2 3.31Å; E387-R390 VanDerWaalsContact OE1-NH2 3.13Å; E387-E391 PolarHBondContact O-N 3.26Å
388	F	52.3	Low	56.8	Low	37 Å²	37	74.3 Å²	74.3	16%	0.162	43%	0.433	C	S	.	.	H	α-helix	trans	-62.5	-40.5	177.9	179.2	-95.6	0	0	0	112.7	Q124 L127 D384 R390 E391 W392	Q124-F388 HydrophobicContact CB-CD2 4.06Å; Q124-F388 HydrophobicContact CB-CE1 4.03Å; Q124-F388 HydrophobicContact CB-CE2 3.51Å; Q124-F388 HydrophobicContact CB-CZ 3.48Å; Q124-F388 VanDerWaalsContact CB-CZ 3.48Å; Q124-F388 HydrophobicContact CG-CD1 4.09Å; Q124-F388 HydrophobicContact CG-CE1 3.45Å; Q124-F388 VanDerWaalsContact CG-CE1 3.45Å; Q124-F388 HydrophobicContact CG-CE2 3.91Å; Q124-F388 HydrophobicContact CG-CZ 3.32Å; L127-F388 HydrophobicContact CD1-CE2 4.15Å; L127-F388 HydrophobicContact CD1-CZ 4.06Å; D384-F388 PolarHBondContact O-N 3.39Å; F388-R390 VanDerWaalsContact C-N 3.27Å; F388-R390 PolarHBondContact O-N 3.16Å; F388-E391 PolarHBondContact O-N 3.17Å; F388-E391 VanDerWaalsContact O-N 3.15Å; F388-W392 HydrophobicContact CE1-CB 4.02Å; F388-W392 HydrophobicContact CE1-CD2 4.39Å; F388-W392 AromaticContact CE1-CE3 3.96Å; F388-W392 HydrophobicContact CE1-CE3 3.96Å; F388-W392 HydrophobicContact CE1-CG 4.46Å; F388-W392 HydrophobicContact CZ-CB 4.23Å; F388-W392 HydrophobicContact CZ-CD2 4.33Å; F388-W392 AromaticContact CZ-CE3 3.52Å; F388-W392 HydrophobicContact CZ-CE3 3.52Å; F388-W392 HydrophobicContact CZ-CZ3 4.24Å; F388-W392 PolarHBondContact O-N 3.1Å
389	S	62.8	Low	56	Low	76 Å²	76	80.8 Å²	80.8	53%	0.531	47%	0.469	S	S	.	.	H	α-helix	trans	-61	-37	177.3	-176	0	0	0	0	111.9	E385 E387 A393	E385-S389 WeakPolarHBondContact O-CB 3.45Å; E385-S389 PolarHBondContact O-N 2.91Å; E387-S389 VanDerWaalsContact C-N 3.35Å; E387-S389 PolarHBondContact O-N 2.84Å; S389-A393 VanDerWaalsContact O-CB 3.32Å; S389-A393 WeakPolarHBondContact O-CB 3.44Å; S389-A393 PolarHBondContact O-N 3.47Å
390	R	67.4	Low	55	Low	154 Å²	154	86.6 Å²	86.6	58%	0.581	48%	0.479	S	S	*	.	H	α-helix	trans	-66.6	-42.7	172.8	-76.3	-179.8	-73	138.5	4.5	112	G386 E387 F388 A394	G386-R390 WeakPolarHBondContact O-CG 3.4Å; G386-R390 PolarHBondContact O-NE 3.14Å; E387-R390 VanDerWaalsContact CA-NH2 3.33Å; E387-R390 WeakPolarHBondContact O-CB 3.24Å; E387-R390 PolarHBondContact O-N 2.77Å; E387-R390 IonicContact OE1-CZ 3.03Å; E387-R390 IonicContact OE1-NH1 2.86Å; E387-R390 IonicContact OE1-NH2 3.63Å; E387-R390 PolarHBondContact OE1-NH2 3.31Å; E387-R390 VanDerWaalsContact OE1-NH2 3.13Å; F388-R390 VanDerWaalsContact C-N 3.27Å; F388-R390 PolarHBondContact O-N 3.16Å; R390-A394 WeakPolarHBondContact O-CB 3.43Å; R390-A394 PolarHBondContact O-N 2.92Å
391	E	61.1	Low	54.2	Low	70 Å²	70	90.9 Å²	90.9	33%	0.327	49%	0.488	S	S	.	.	H	α-helix	trans	-62.5	-48.4	174.1	-71.7	-154.7	138.8	0	0	111.5	N131 E387 F388 A393 A394 V395	N131-E391 PolarHBondContact ND2-OE1 3.45Å; E387-E391 PolarHBondContact O-N 3.26Å; F388-E391 PolarHBondContact O-N 3.17Å; F388-E391 VanDerWaalsContact O-N 3.15Å; E391-A393 PolarHBondContact O-N 3.23Å; E391-A394 CarbonylContact O-C 3.6Å; E391-A394 WeakPolarHBondContact O-CA 3.22Å; E391-A394 WeakPolarHBondContact O-CB 3.38Å; E391-A394 PolarHBondContact O-N 3.36Å; E391-A394 VanDerWaalsContact O-N 3.09Å; E391-V395 VanDerWaalsContact O-CG2 3.26Å; E391-V395 WeakPolarHBondContact O-CG2 3.42Å; E391-V395 PolarHBondContact O-N 2.92Å
392	W	67.1	Low	53.4	Low	48 Å²	48	98.9 Å²	98.9	18%	0.182	52%	0.519	C	S	.	.	H	α-helix	trans	-58.2	-48.7	179.4	-174.5	-84.8	0	0	0	112	N91 L127 F388 A394 V395 F396	N91-W392 HydrophobicContact CB-CH2 3.83Å; N91-W392 WeakPolarHBondContact ND2-CH2 3.45Å; N91-W392 WeakPolarHBondContact ND2-CZ2 3.27Å; L127-W392 HydrophobicContact CD1-CE3 3.35Å; L127-W392 HydrophobicContact CD1-CZ3 3.47Å; L127-W392 VanDerWaalsContact CD1-CZ3 3.47Å; F388-W392 HydrophobicContact CE1-CB 4.02Å; F388-W392 HydrophobicContact CE1-CD2 4.39Å; F388-W392 AromaticContact CE1-CE3 3.96Å; F388-W392 HydrophobicContact CE1-CE3 3.96Å; F388-W392 HydrophobicContact CE1-CG 4.46Å; F388-W392 HydrophobicContact CZ-CB 4.23Å; F388-W392 HydrophobicContact CZ-CD2 4.33Å; F388-W392 AromaticContact CZ-CE3 3.52Å; F388-W392 HydrophobicContact CZ-CE3 3.52Å; F388-W392 HydrophobicContact CZ-CZ3 4.24Å; F388-W392 PolarHBondContact O-N 3.1Å; W392-A394 PolarHBondContact O-N 3.03Å; W392-V395 PolarHBondContact O-N 2.89Å; W392-F396 AromaticContact CD2-CD2 3.63Å; W392-F396 HydrophobicContact CD2-CD2 3.63Å; W392-F396 AromaticContact CD2-CE2 3.86Å; W392-F396 HydrophobicContact CD2-CE2 3.86Å; W392-F396 AromaticContact CE2-CD2 3.54Å; W392-F396 AromaticContact CE2-CE2 3.94Å; W392-F396 HydrophobicContact CE3-CD2 4.01Å; W392-F396 AromaticContact CE3-CE2 3.73Å; W392-F396 HydrophobicContact CE3-CE2 3.73Å; W392-F396 HydrophobicContact CG-CD2 4.03Å; W392-F396 HydrophobicContact CH2-CD2 4.3Å; W392-F396 AromaticContact CH2-CE2 3.88Å; W392-F396 HydrophobicContact CH2-CE2 3.88Å; W392-F396 HydrophobicContact CH2-CZ 4.47Å; W392-F396 AromaticContact CZ2-CD2 3.89Å; W392-F396 HydrophobicContact CZ2-CD2 3.89Å; W392-F396 AromaticContact CZ2-CE2 3.95Å; W392-F396 HydrophobicContact CZ2-CE2 3.95Å; W392-F396 HydrophobicContact CZ3-CD2 4.36Å; W392-F396 AromaticContact CZ3-CE2 3.78Å; W392-F396 HydrophobicContact CZ3-CE2 3.78Å; W392-F396 AromaticContact NE1-CD2 3.82Å; W392-F396 PolarHBondContact O-N 3.25Å
393	A	76	Confident	52.7	Low	39 Å²	39	104.8 Å²	104.8	32%	0.322	54%	0.541	S	S	.	.	H	α-helix	trans	-61.8	-31.9	176.4	0	0	0	0	0	112.4	S389 E391 V395 G397	S389-A393 VanDerWaalsContact O-CB 3.32Å; S389-A393 WeakPolarHBondContact O-CB 3.44Å; S389-A393 PolarHBondContact O-N 3.47Å; E391-A393 PolarHBondContact O-N 3.23Å; A393-V395 VanDerWaalsContact C-N 3.34Å; A393-G397 WeakPolarHBondContact O-CA 3.29Å; A393-G397 PolarHBondContact O-N 3.41Å
394	A	72.6	Confident	52.2	Low	87 Å²	87	105 Å²	105	72%	0.719	55%	0.549	S	S	*	.	H	α-helix	trans	-76	-14.9	173.3	0	0	0	0	0	114.3	R390 E391 W392	R390-A394 WeakPolarHBondContact O-CB 3.43Å; R390-A394 PolarHBondContact O-N 2.92Å; E391-A394 CarbonylContact O-C 3.6Å; E391-A394 WeakPolarHBondContact O-CA 3.22Å; E391-A394 WeakPolarHBondContact O-CB 3.38Å; E391-A394 PolarHBondContact O-N 3.36Å; E391-A394 VanDerWaalsContact O-N 3.09Å; W392-A394 PolarHBondContact O-N 3.03Å
395	V	64.9	Low	51.6	Low	35 Å²	35	104.5 Å²	104.5	21%	0.212	56%	0.56	C	S	.	*	H	α-helix	trans	-92.1	-43.2	172.2	-170.9	0	0	0	0	112.2	C84 R130 E391 W392 A393	C84-V395 HydrophobicContact CB-CG1 4.41Å; R130-V395 VanDerWaalsContact NH1-CG2 3.27Å; E391-V395 VanDerWaalsContact O-CG2 3.26Å; E391-V395 WeakPolarHBondContact O-CG2 3.42Å; E391-V395 PolarHBondContact O-N 2.92Å; W392-V395 PolarHBondContact O-N 2.89Å; A393-V395 VanDerWaalsContact C-N 3.34Å
396	F	72	Confident	51.1	Low	64 Å²	64	103.6 Å²	103.6	28%	0.281	57%	0.567	S	S	.	*	H	α-helix	trans	-120.2	-12.1	-165.7	-58.4	-75.3	0	0	0	114.8	C84 Q88 L127 W392	C84-F396 HydrophobicContact CB-CE1 4.17Å; C84-F396 HydrophobicContact CB-CZ 4.09Å; Q88-F396 HydrophobicContact CB-CE1 4.13Å; Q88-F396 HydrophobicContact CB-CZ 4.25Å; Q88-F396 HydrophobicContact CG-CE1 4.47Å; L127-F396 HydrophobicContact CD1-CE2 4.1Å; W392-F396 AromaticContact CD2-CD2 3.63Å; W392-F396 HydrophobicContact CD2-CD2 3.63Å; W392-F396 AromaticContact CD2-CE2 3.86Å; W392-F396 HydrophobicContact CD2-CE2 3.86Å; W392-F396 AromaticContact CE2-CD2 3.54Å; W392-F396 AromaticContact CE2-CE2 3.94Å; W392-F396 HydrophobicContact CE3-CD2 4.01Å; W392-F396 AromaticContact CE3-CE2 3.73Å; W392-F396 HydrophobicContact CE3-CE2 3.73Å; W392-F396 HydrophobicContact CG-CD2 4.03Å; W392-F396 HydrophobicContact CH2-CD2 4.3Å; W392-F396 AromaticContact CH2-CE2 3.88Å; W392-F396 HydrophobicContact CH2-CE2 3.88Å; W392-F396 HydrophobicContact CH2-CZ 4.47Å; W392-F396 AromaticContact CZ2-CD2 3.89Å; W392-F396 HydrophobicContact CZ2-CD2 3.89Å; W392-F396 AromaticContact CZ2-CE2 3.95Å; W392-F396 HydrophobicContact CZ2-CE2 3.95Å; W392-F396 HydrophobicContact CZ3-CD2 4.36Å; W392-F396 AromaticContact CZ3-CE2 3.78Å; W392-F396 HydrophobicContact CZ3-CE2 3.78Å; W392-F396 AromaticContact NE1-CD2 3.82Å; W392-F396 PolarHBondContact O-N 3.25Å
397	G	58.1	Low	50.1	Low	41 Å²	41	109.1 Å²	109.1	42%	0.423	59%	0.593	S	S	.	*			trans	90.1	168	-167.2	0	0	0	0	0	113.1	A393	A393-G397 WeakPolarHBondContact O-CA 3.29Å; A393-G397 PolarHBondContact O-N 3.41Å
398	D	55.1	Low	49	Very low	115 Å²	115	107.6 Å²	107.6	62%	0.615	61%	0.607	S	S	*	*			trans	-100.2	119.9	168.2	-177.6	12.7	0	0	0	108.6	R400	D398-R400 PolarHBondContact O-N 3.48Å; D398-R400 WeakPolarHBondContact OD1-CB 3.4Å; D398-R400 WeakPolarHBondContact OD1-CD 3.46Å; D398-R400 VanDerWaalsContact OD1-CG 3.29Å; D398-R400 WeakPolarHBondContact OD1-CG 3.47Å; D398-R400 PolarHBondContact OD1-N 3.08Å
399	D	40.4	Very low	47.9	Very low	165 Å²	165	110.4 Å²	110.4	88%	0.882	64%	0.637	S	S	*	*			trans	-80.9	9.1	-174.2	-145.6	13.6	0	0	0	112.5	L401	D399-L401 PolarHBondContact O-N 3.09Å; D399-L401 VanDerWaalsContact O-N 3.17Å
400	R	37.2	Very low	46.3	Very low	201 Å²	201	116.5 Å²	116.5	76%	0.758	66%	0.657	S	S	*	*			trans	-82.2	88.5	178	-70.1	174.4	175.4	-99.2	-0.1	111.4	D398 K402	D398-R400 PolarHBondContact O-N 3.48Å; D398-R400 WeakPolarHBondContact OD1-CB 3.4Å; D398-R400 WeakPolarHBondContact OD1-CD 3.46Å; D398-R400 VanDerWaalsContact OD1-CG 3.29Å; D398-R400 WeakPolarHBondContact OD1-CG 3.47Å; D398-R400 PolarHBondContact OD1-N 3.08Å; R400-K402 PolarHBondContact O-N 3.24Å
401	L	32	Very low	44.4	Very low	177 Å²	177	112.9 Å²	112.9	93%	0.927	67%	0.668	S	S	*	*			trans	-49.3	113.6	161.4	-71.7	174	0	0	0	109.9	D399 E403	D399-L401 PolarHBondContact O-N 3.09Å; D399-L401 VanDerWaalsContact O-N 3.17Å; L401-E403 PolarHBondContact O-N 3.25Å
402	K	30.5	Very low	42.9	Very low	200 Å²	200	117 Å²	117	87%	0.87	69%	0.687	S	S	*	*			trans	-96	97.9	-169.3	-158.4	171.7	-171.7	174.1	0	110.9	R400	R400-K402 PolarHBondContact O-N 3.24Å
403	E	25.6	Very low	41.5	Very low	183 Å²	183	120.5 Å²	120.5	86%	0.855	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-60.6	128	177.2	-169.7	170.9	-139.3	0	0	111.4	L401	L401-E403 PolarHBondContact O-N 3.25Å
404	P	32.3	Very low	39.3	Very low	119 Å²	119	122.1 Å²	122.1	77%	0.773	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-89.1	125.8	-175.1	32.7	-33.1	0	0	0	113
405	A	27.8	Very low	37.4	Very low	99 Å²	99	124.1 Å²	124.1	82%	0.818	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-84.3	143.6	170	0	0	0	0	0	111.8
406	P	36.8	Very low	35.7	Very low	121 Å²	121	129.6 Å²	129.6	79%	0.786	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-99	137.7	-169.4	36	-34.2	0	0	0	114.8
407	V	29.8	Very low	34.2	Very low	151 Å²	151	132 Å²	132	92%	0.915	77%	0.767	S	S	*	*			trans	-149.3	134	163.1	-176.7	0	0	0	0	111.3
408	G	28.1	Very low	32.8	Very low	78 Å²	78	139.8 Å²	139.8	80%	0.804	79%	0.793	S	S	*	*			trans	85.8	137.1	149.7	0	0	0	0	0	117.6
409	A	28	Very low	31.6	Very low	95 Å²	95	143.1 Å²	143.1	79%	0.785	81%	0.81	S	S	*	*			trans	-135.7	-179.9	176.8	0	0	0	0	0	111.1
410	Q	29.4	Very low	31.1	Very low	204 Å²	204	138.7 Å²	138.7	95%	0.953	80%	0.803	S	S	*	*			trans	81.6	130.8	-173.2	-51.9	-178.8	-7.2	0	0	114.1
411	G	28	Very low	31	Very low	79 Å²	79	133.4 Å²	133.4	81%	0.814	80%	0.797	S	S	*	*			cis	-164.6	158.9	-4.1	0	0	0	0	0	112.9
412	E	28.7	Very low	31.3	Very low	155 Å²	155	128.5 Å²	128.5	72%	0.724	79%	0.789	S	S	*	*			trans	-91.6	167.4	-178.8	-141.3	-159.5	-112.8	0	0	111.1	D414	E412-D414 PolarHBondContact OE2-N 3.03Å
413	P	38.3	Very low	32	Very low	122 Å²	122	125.9 Å²	125.9	79%	0.792	78%	0.778	S	S	*	*				-140.9	153	76.8	36.1	-18.6	0	0	0	117.7
414	D	29.1	Very low	33.3	Very low	74 Å²	74	122.2 Å²	122.2	40%	0.396	76%	0.764	S	S	.	*			trans	-33.6	157.2	164.7	-141.5	5.4	0	0	0	117.7	E412 K416	E412-D414 PolarHBondContact OE2-N 3.03Å; D414-K416 VanDerWaalsContact CG-N 3.31Å; D414-K416 PolarHBondContact OD1-N 2.93Å; D414-K416 IonicContact OD1-NZ 3.86Å; D414-K416 VanDerWaalsContact OD2-CD 3.25Å; D414-K416 WeakPolarHBondContact OD2-CD 3.18Å; D414-K416 WeakPolarHBondContact OD2-CE 3.39Å; D414-K416 VanDerWaalsContact OD2-CG 3.23Å; D414-K416 WeakPolarHBondContact OD2-CG 3.27Å; D414-K416 IonicContact OD2-NZ 3.36Å; D414-K416 PolarHBondContact OD2-NZ 3.33Å
415	P	33.1	Very low	34	Very low	128 Å²	128	121.5 Å²	121.5	83%	0.831	76%	0.759	S	S	*	*				-141.4	123.7	88.6	36.4	-21.3	0	0	0	117.9
416	K	30.5	Very low	34.8	Very low	151 Å²	151	120.3 Å²	120.3	66%	0.657	74%	0.744	S	S	*	*			trans	-48	171.9	155.1	-78.5	167.4	-169.4	67.3	0	115.1	D414	D414-K416 VanDerWaalsContact CG-N 3.31Å; D414-K416 PolarHBondContact OD1-N 2.93Å; D414-K416 IonicContact OD1-NZ 3.86Å; D414-K416 VanDerWaalsContact OD2-CD 3.25Å; D414-K416 WeakPolarHBondContact OD2-CD 3.18Å; D414-K416 WeakPolarHBondContact OD2-CE 3.39Å; D414-K416 VanDerWaalsContact OD2-CG 3.23Å; D414-K416 WeakPolarHBondContact OD2-CG 3.27Å; D414-K416 IonicContact OD2-NZ 3.36Å; D414-K416 PolarHBondContact OD2-NZ 3.33Å
417	P	39.3	Very low	35.5	Very low	113 Å²	113	118.4 Å²	118.4	73%	0.734	73%	0.725	S	S	*	*			cis	-139.4	159.7	-36.2	37	-21.4	0	0	0	113.7
418	Q	28.9	Very low	36.4	Very low	206 Å²	206	117 Å²	117	96%	0.963	71%	0.711	S	S	*	*			trans	-136.8	146.9	148.9	-76	-161.9	-15.2	0	0	111
419	L	30	Very low	37.6	Very low	184 Å²	184	118.7 Å²	118.7	96%	0.963	70%	0.702	S	S	*	*			trans	-121.6	129.7	-167.6	-171.3	86.1	0	0	0	109.8
420	G	28.9	Very low	38.8	Very low	72 Å²	72	118.9 Å²	118.9	74%	0.742	69%	0.69	S	S	*	*			trans	156.4	133.5	164.4	0	0	0	0	0	116.9
421	S	36.6	Very low	40	Very low	91 Å²	91	113.8 Å²	113.8	64%	0.636	67%	0.666	S	S	*	*			trans	58.2	67.5	156.5	-163.2	0	0	0	0	118.5	F423	S421-F423 PolarHBondContact O-N 2.78Å
422	G	38.4	Very low	41.1	Very low	73 Å²	73	114.9 Å²	114.9	75%	0.753	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-65.3	120	150.7	0	0	0	0	0	109.9
423	F	44.7	Very low	42.4	Very low	146 Å²	146	113 Å²	113	64%	0.64	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-68.9	130	-179.9	-98	-103.8	0	0	0	111.6	S421 Q427	S421-F423 PolarHBondContact O-N 2.78Å; F423-Q427 HydrophobicContact CD1-CB 4.02Å; F423-Q427 HydrophobicContact CE1-CB 4.32Å
424	L	53.5	Low	43.2	Very low	106 Å²	106	112.7 Å²	112.7	56%	0.555	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-87.3	144.9	170.9	-67.8	173.9	0	0	0	110.5	S426 Q427	L424-S426 PolarHBondContact O-N 3.43Å; L424-Q427 HydrophobicContact CB-CG 4.46Å; L424-Q427 WeakPolarHBondContact O-CB 3.3Å; L424-Q427 PolarHBondContact O-N 2.63Å
425	P	46	Very low	44	Very low	104 Å²	104	113.6 Å²	113.6	68%	0.675	64%	0.637	S	S	*	*	H	α-helix	trans	-55.8	-27	179.8	-28.5	36	0	0	0	114.9	L428 L429	P425-L428 PolarHBondContact O-N 2.92Å; P425-L429 PolarHBondContact O-N 2.72Å
426	S	44.1	Very low	44.4	Very low	73 Å²	73	112 Å²	112	51%	0.51	62%	0.62	S	S	.	*	H	α-helix	trans	-64.1	-34.8	173.1	46.1	0	0	0	0	113.4	L424 L428 L429 D430	L424-S426 PolarHBondContact O-N 3.43Å; S426-L428 VanDerWaalsContact C-N 3.32Å; S426-L428 PolarHBondContact O-N 3.26Å; S426-L429 WeakPolarHBondContact O-CB 3.31Å; S426-L429 PolarHBondContact O-N 3.49Å; S426-D430 PolarHBondContact O-N 3.41Å
427	Q	51.1	Low	45.1	Very low	82 Å²	82	111.4 Å²	111.4	38%	0.383	62%	0.62	S	S	.	*	H	α-helix	trans	-70.6	-31.1	178.8	-65.1	170.1	-39.9	0	0	111.7	F423 L424 L429 D430 Q431	F423-Q427 HydrophobicContact CD1-CB 4.02Å; F423-Q427 HydrophobicContact CE1-CB 4.32Å; L424-Q427 HydrophobicContact CB-CG 4.46Å; L424-Q427 WeakPolarHBondContact O-CB 3.3Å; L424-Q427 PolarHBondContact O-N 2.63Å; Q427-L429 VanDerWaalsContact C-N 3.32Å; Q427-D430 PolarHBondContact O-N 3.11Å; Q427-Q431 WeakPolarHBondContact O-CB 3.41Å; Q427-Q431 PolarHBondContact O-N 3.01Å
428	L	49.4	Very low	45.3	Very low	120 Å²	120	109.3 Å²	109.3	63%	0.628	61%	0.612	S	S	*	*	H	α-helix	trans	-67	-34	172	-113.5	167.6	0	0	0	112	P425 S426 N432	P425-L428 PolarHBondContact O-N 2.92Å; S426-L428 VanDerWaalsContact C-N 3.32Å; S426-L428 PolarHBondContact O-N 3.26Å; L428-N432 WeakPolarHBondContact O-CB 3.39Å; L428-N432 PolarHBondContact O-N 2.9Å; L428-N432 VanDerWaalsContact O-N 3.09Å
429	L	54.1	Low	45.9	Very low	114 Å²	114	104.1 Å²	104.1	60%	0.597	60%	0.599	S	S	*	*	H	α-helix	trans	-70.3	-44.3	173.8	-107.9	161.7	0	0	0	112.1	P425 S426 Q427 Q431 N432 M433	P425-L429 PolarHBondContact O-N 2.72Å; S426-L429 WeakPolarHBondContact O-CB 3.31Å; S426-L429 PolarHBondContact O-N 3.49Å; Q427-L429 VanDerWaalsContact C-N 3.32Å; L429-Q431 VanDerWaalsContact C-N 3.32Å; L429-Q431 PolarHBondContact O-N 2.78Å; L429-N432 PolarHBondContact O-N 3.3Å; L429-M433 WeakPolarHBondContact O-CB 3.44Å; L429-M433 WeakPolarHBondContact O-CG 3.46Å; L429-M433 PolarHBondContact O-N 3.48Å
430	D	53.1	Low	46.2	Very low	100 Å²	100	101.5 Å²	101.5	54%	0.535	59%	0.585	S	S	.	*	H	α-helix	trans	-62.3	-37	174.2	-100	9.4	0	0	0	112.7	S426 Q427 K434	S426-D430 PolarHBondContact O-N 3.41Å; Q427-D430 PolarHBondContact O-N 3.11Å; D430-K434 WeakPolarHBondContact O-CD 3.32Å; D430-K434 WeakPolarHBondContact O-CG 3.29Å; D430-K434 PolarHBondContact O-N 3.33Å; D430-K434 VanDerWaalsContact O-N 3.11Å
431	Q	54.4	Low	46.6	Very low	97 Å²	97	106.1 Å²	106.1	45%	0.453	59%	0.587	S	S	.	*	H	α-helix	trans	-66.2	-49.7	175.6	-166	64.2	49.2	0	0	110.6	Q427 L429 M433 K434 D435	Q427-Q431 WeakPolarHBondContact O-CB 3.41Å; Q427-Q431 PolarHBondContact O-N 3.01Å; L429-Q431 VanDerWaalsContact C-N 3.32Å; L429-Q431 PolarHBondContact O-N 2.78Å; Q431-M433 VanDerWaalsContact C-N 3.34Å; Q431-M433 PolarHBondContact O-N 3.33Å; Q431-K434 WeakPolarHBondContact O-CB 3.45Å; Q431-K434 PolarHBondContact O-N 2.86Å; Q431-K434 VanDerWaalsContact O-N 3.09Å; Q431-D435 VanDerWaalsContact O-CG 3.27Å; Q431-D435 PolarHBondContact O-N 3.33Å
432	N	50.5	Low	46.5	Very low	102 Å²	102	108.7 Å²	108.7	55%	0.545	59%	0.589	S	S	.	*	H	α-helix	trans	-60.3	-40.3	177.4	-168.4	-15.3	0	0	0	112.1	L428 L429 K434 D435 L436	L428-N432 WeakPolarHBondContact O-CB 3.39Å; L428-N432 PolarHBondContact O-N 2.9Å; L428-N432 VanDerWaalsContact O-N 3.09Å; L429-N432 PolarHBondContact O-N 3.3Å; N432-K434 PolarHBondContact O-N 2.99Å; N432-D435 PolarHBondContact O-N 2.87Å; N432-L436 VanDerWaalsContact O-CB 3.31Å; N432-L436 WeakPolarHBondContact O-CB 3.47Å; N432-L436 PolarHBondContact O-N 2.85Å
433	M	56.3	Low	46.2	Very low	116 Å²	116	111.1 Å²	111.1	57%	0.571	59%	0.592	S	S	*	*	H	α-helix	trans	-64.2	-36.3	174.2	-76.2	-68.9	-71	0	0	112.9	L429 Q431 Q437	L429-M433 WeakPolarHBondContact O-CB 3.44Å; L429-M433 WeakPolarHBondContact O-CG 3.46Å; L429-M433 PolarHBondContact O-N 3.48Å; Q431-M433 VanDerWaalsContact C-N 3.34Å; Q431-M433 PolarHBondContact O-N 3.33Å; M433-Q437 VanDerWaalsContact O-CB 3.27Å; M433-Q437 WeakPolarHBondContact O-CB 3.48Å; M433-Q437 PolarHBondContact O-N 3.25Å
434	K	54.2	Low	45.5	Very low	115 Å²	115	108.8 Å²	108.8	50%	0.5	60%	0.599	S	S	.	*	H	α-helix	trans	-70.1	-41.3	174.4	-74.6	164.3	-174.4	158.7	0	112.1	D430 Q431 N432 L436 Q437 A438	D430-K434 WeakPolarHBondContact O-CD 3.32Å; D430-K434 WeakPolarHBondContact O-CG 3.29Å; D430-K434 PolarHBondContact O-N 3.33Å; D430-K434 VanDerWaalsContact O-N 3.11Å; Q431-K434 WeakPolarHBondContact O-CB 3.45Å; Q431-K434 PolarHBondContact O-N 2.86Å; Q431-K434 VanDerWaalsContact O-N 3.09Å; N432-K434 PolarHBondContact O-N 2.99Å; K434-L436 VanDerWaalsContact C-N 3.32Å; K434-L436 PolarHBondContact O-N 3Å; K434-Q437 PolarHBondContact O-N 2.91Å; K434-A438 WeakPolarHBondContact O-CB 3.45Å; K434-A438 PolarHBondContact O-N 3Å
435	D	46.1	Very low	44.7	Very low	93 Å²	93	112.5 Å²	112.5	50%	0.497	61%	0.611	S	S	.	*	H	α-helix	trans	-65.3	-38.1	176.3	-61.5	-25.3	0	0	0	110.8	Q431 N432 A438 S439	Q431-D435 VanDerWaalsContact O-CG 3.27Å; Q431-D435 PolarHBondContact O-N 3.33Å; N432-D435 PolarHBondContact O-N 2.87Å; D435-A438 PolarHBondContact O-N 3.1Å; D435-S439 WeakPolarHBondContact O-CB 3.35Å; D435-S439 PolarHBondContact O-N 3.17Å
436	L	42.7	Very low	44.2	Very low	93 Å²	93	111.4 Å²	111.4	49%	0.487	61%	0.61	S	S	.	*	H	α-helix	trans	-66.5	-39.4	172.4	-161.7	75.5	0	0	0	112.1	N432 K434 S439 L440	N432-L436 VanDerWaalsContact O-CB 3.31Å; N432-L436 WeakPolarHBondContact O-CB 3.47Å; N432-L436 PolarHBondContact O-N 2.85Å; K434-L436 VanDerWaalsContact C-N 3.32Å; K434-L436 PolarHBondContact O-N 3Å; L436-S439 CarbonylContact O-C 3.59Å; L436-S439 WeakPolarHBondContact O-CB 3.44Å; L436-S439 PolarHBondContact O-N 3.28Å; L436-L440 HydrophobicContact CG-CD1 4.42Å; L436-L440 VanDerWaalsContact O-CG 3.29Å; L436-L440 WeakPolarHBondContact O-CG 3.45Å; L436-L440 PolarHBondContact O-N 3.2Å; L436-L440 VanDerWaalsContact O-N 3.08Å
437	Q	44.7	Very low	44	Very low	139 Å²	139	113 Å²	113	65%	0.65	63%	0.629	S	S	*	*	H	α-helix	trans	-70.4	-33.4	177.8	-165.6	169.8	30.5	0	0	112.4	M433 K434 L440	M433-Q437 VanDerWaalsContact O-CB 3.27Å; M433-Q437 WeakPolarHBondContact O-CB 3.48Å; M433-Q437 PolarHBondContact O-N 3.25Å; K434-Q437 PolarHBondContact O-N 2.91Å; Q437-L440 PolarHBondContact O-N 3.03Å
438	A	43.2	Very low	43.7	Very low	69 Å²	69	113 Å²	113	57%	0.57	64%	0.638	S	S	*	*	H	α-helix	trans	-67.4	-39.4	168.7	0	0	0	0	0	111.7	K434 D435 L440 Q441	K434-A438 WeakPolarHBondContact O-CB 3.45Å; K434-A438 PolarHBondContact O-N 3Å; D435-A438 PolarHBondContact O-N 3.1Å; A438-L440 PolarHBondContact O-N 3.17Å; A438-Q441 PolarHBondContact O-N 3.17Å
439	S	41.9	Very low	43.6	Very low	97 Å²	97	111.7 Å²	111.7	68%	0.678	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-11.2	174.1	-169.5	0	0	0	0	114.3	D435 L436	D435-S439 WeakPolarHBondContact O-CB 3.35Å; D435-S439 PolarHBondContact O-N 3.17Å; L436-S439 CarbonylContact O-C 3.59Å; L436-S439 WeakPolarHBondContact O-CB 3.44Å; L436-S439 PolarHBondContact O-N 3.28Å
440	L	37.2	Very low	43.4	Very low	130 Å²	130	112 Å²	112	68%	0.681	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	1.5	179.1	-76	168.8	0	0	0	113.9	L436 Q437 A438 E442	L436-L440 HydrophobicContact CG-CD1 4.42Å; L436-L440 VanDerWaalsContact O-CG 3.29Å; L436-L440 WeakPolarHBondContact O-CG 3.45Å; L436-L440 PolarHBondContact O-N 3.2Å; L436-L440 VanDerWaalsContact O-N 3.08Å; Q437-L440 PolarHBondContact O-N 3.03Å; A438-L440 PolarHBondContact O-N 3.17Å; L440-E442 VanDerWaalsContact C-N 3.34Å; L440-E442 PolarHBondContact O-N 2.83Å; L440-E442 VanDerWaalsContact O-N 3.15Å
441	Q	37.4	Very low	43.5	Very low	168 Å²	168	111.9 Å²	111.9	79%	0.785	64%	0.636	S	S	*	*			trans	-80.5	84.2	162.1	-72.5	-167.7	-21.6	0	0	109.7	A438	A438-Q441 PolarHBondContact O-N 3.17Å
442	E	33.4	Very low	43.5	Very low	146 Å²	146	109.4 Å²	109.4	68%	0.682	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-53.3	128.8	164.2	-71.7	-166.9	147.1	0	0	109.2	L440 A444	L440-E442 VanDerWaalsContact C-N 3.34Å; L440-E442 PolarHBondContact O-N 2.83Å; L440-E442 VanDerWaalsContact O-N 3.15Å; E442-A444 PolarHBondContact O-N 3.12Å
443	P	32.5	Very low	43.5	Very low	123 Å²	123	109.2 Å²	109.2	80%	0.799	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-61.1	123.4	161.6	26.8	-31.9	0	0	0	107.6	K445	P443-K445 PolarHBondContact O-N 3.05Å
444	A	29.5	Very low	43.2	Very low	97 Å²	97	108.2 Å²	108.2	80%	0.802	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-51	131.5	-171.4	0	0	0	0	0	111.5	E442 A446	E442-A444 PolarHBondContact O-N 3.12Å; A444-A446 PolarHBondContact O-N 3.44Å
445	K	37.4	Very low	43.3	Very low	185 Å²	185	106.5 Å²	106.5	80%	0.804	62%	0.618	S	S	*	*			trans	-45.4	97.7	-170.6	-71.3	174.8	-179.1	170	0	112.7	P443 A447	P443-K445 PolarHBondContact O-N 3.05Å; K445-A447 PolarHBondContact O-N 3.42Å
446	A	34.3	Very low	44	Very low	80 Å²	80	107.5 Å²	107.5	66%	0.661	62%	0.623	S	S	*	*			trans	-68.5	102	167.4	0	0	0	0	0	107.9	A444 S448	A444-A446 PolarHBondContact O-N 3.44Å; A446-S448 WeakPolarHBondContact CB-OG 3.47Å; A446-S448 PolarHBondContact O-N 3.13Å
447	A	40.5	Very low	44.3	Very low	108 Å²	108	104.5 Å²	104.5	89%	0.893	61%	0.606	S	S	*	*			trans	-72.6	40.1	163.3	0	0	0	0	0	110.6	K445	K445-A447 PolarHBondContact O-N 3.42Å
448	S	44.5	Very low	44.9	Very low	82 Å²	82	99.1 Å²	99.1	57%	0.573	59%	0.585	S	S	*	*			trans	-81.6	118.7	-173.5	52.7	0	0	0	0	110.3	A446	A446-S448 WeakPolarHBondContact CB-OG 3.47Å; A446-S448 PolarHBondContact O-N 3.13Å
449	D	48.3	Very low	45.3	Very low	92 Å²	92	103.4 Å²	103.4	49%	0.492	60%	0.599	S	S	.	*			trans	67.1	42.7	151	-69.3	-40.9	0	0	0	118.9	A452 W453	D449-A452 HydrophobicContact CB-CB 3.67Å; D449-A452 VanDerWaalsContact OD1-CB 3.26Å; D449-A452 WeakPolarHBondContact OD1-CB 3.1Å; D449-A452 PolarHBondContact OD1-N 3.06Å; D449-W453 VanDerWaalsContact O-CB 3.25Å; D449-W453 WeakPolarHBondContact O-CB 3.43Å; D449-W453 PolarHBondContact O-N 3.22Å; D449-W453 VanDerWaalsContact O-N 3.17Å
450	L	49.8	Very low	45.7	Very low	119 Å²	119	102 Å²	102	62%	0.623	58%	0.584	S	S	*	*	H	α-helix		-54.4	-39.3	129.5	-88.8	163.6	0	0	0	110.5	W453 F454	L450-W453 WeakPolarHBondContact O-CB 3.45Å; L450-W453 PolarHBondContact O-N 3.27Å; L450-F454 HydrophobicContact CB-CD2 4.47Å; L450-F454 HydrophobicContact CB-CE2 4.31Å; L450-F454 HydrophobicContact CD2-CE2 4.1Å; L450-F454 WeakPolarHBondContact O-CD2 3.16Å; L450-F454 PolarHBondContact O-N 3.25Å
451	T	54.1	Low	46.4	Very low	99 Å²	99	97.2 Å²	97.2	61%	0.607	56%	0.559	S	S	*	*	H	α-helix	trans	-59.9	-58.1	177.8	-44.2	0	0	0	0	112.9	W453 F454 S455	T451-W453 VanDerWaalsContact C-N 3.25Å; T451-W453 PolarHBondContact O-N 2.85Å; T451-F454 PolarHBondContact O-N 3.47Å; T451-F454 VanDerWaalsContact O-N 3.14Å; T451-S455 PolarHBondContact O-N 2.89Å; T451-S455 PolarHBondContact O-OG 3.14Å; T451-S455 VanDerWaalsContact O-OG 3.12Å
452	A	53.8	Low	46.8	Very low	44 Å²	44	93.1 Å²	93.1	36%	0.364	55%	0.547	S	S	.	.	H	α-helix	trans	-65.2	-26.9	176	0	0	0	0	0	113.2	D449 S455 L456	D449-A452 HydrophobicContact CB-CB 3.67Å; D449-A452 VanDerWaalsContact OD1-CB 3.26Å; D449-A452 WeakPolarHBondContact OD1-CB 3.1Å; D449-A452 PolarHBondContact OD1-N 3.06Å; A452-S455 PolarHBondContact O-N 3.26Å; A452-L456 VanDerWaalsContact O-CB 3.3Å; A452-L456 WeakPolarHBondContact O-CB 3.46Å; A452-L456 PolarHBondContact O-N 3.4Å
453	W	50.4	Low	47.3	Very low	99 Å²	99	94.3 Å²	94.3	38%	0.375	56%	0.556	S	S	.	*	H	α-helix	trans	-63.8	-43.9	170.4	-170.4	91.6	0	0	0	112	T32 D449 L450 T451 L456 F457	T32-W453 HydrophobicContact CG2-CZ2 3.98Å; D449-W453 VanDerWaalsContact O-CB 3.25Å; D449-W453 WeakPolarHBondContact O-CB 3.43Å; D449-W453 PolarHBondContact O-N 3.22Å; D449-W453 VanDerWaalsContact O-N 3.17Å; L450-W453 WeakPolarHBondContact O-CB 3.45Å; L450-W453 PolarHBondContact O-N 3.27Å; T451-W453 VanDerWaalsContact C-N 3.25Å; T451-W453 PolarHBondContact O-N 2.85Å; W453-L456 PolarHBondContact O-N 3.11Å; W453-F457 HydrophobicContact CD2-CD2 4.23Å; W453-F457 HydrophobicContact CD2-CE2 4.45Å; W453-F457 AromaticContact CE2-CE2 3.91Å; W453-F457 HydrophobicContact CZ2-CD2 4.23Å; W453-F457 HydrophobicContact CZ2-CE2 4.2Å; W453-F457 AromaticContact NE1-CE2 3.82Å; W453-F457 WeakPolarHBondContact O-CD2 3.44Å
454	F	50.8	Low	48.3	Very low	94 Å²	94	91.7 Å²	91.7	41%	0.412	54%	0.541	S	S	.	.	H	α-helix	trans	-63.1	-44.2	171.4	-75.5	-61.6	0	0	0	111.6	L450 T451 L456 F457 A458	L450-F454 HydrophobicContact CB-CD2 4.47Å; L450-F454 HydrophobicContact CB-CE2 4.31Å; L450-F454 HydrophobicContact CD2-CE2 4.1Å; L450-F454 WeakPolarHBondContact O-CD2 3.16Å; L450-F454 PolarHBondContact O-N 3.25Å; T451-F454 PolarHBondContact O-N 3.47Å; T451-F454 VanDerWaalsContact O-N 3.14Å; F454-L456 VanDerWaalsContact C-N 3.27Å; F454-L456 PolarHBondContact O-N 3.34Å; F454-F457 CarbonylContact O-C 3.51Å; F454-F457 PolarHBondContact O-N 3Å; F454-F457 VanDerWaalsContact O-N 3.14Å; F454-A458 PolarHBondContact O-N 3.5Å
455	S	57.2	Low	49.1	Very low	79 Å²	79	89 Å²	89	55%	0.552	51%	0.514	S	S	*	.	H	α-helix	trans	-60.2	-34.2	176.8	-58.3	0	0	0	0	113.1	T451 A452 F457	T451-S455 PolarHBondContact O-N 2.89Å; T451-S455 PolarHBondContact O-OG 3.14Å; T451-S455 VanDerWaalsContact O-OG 3.12Å; A452-S455 PolarHBondContact O-N 3.26Å; S455-F457 PolarHBondContact O-N 3.13Å
456	L	60.7	Low	49.6	Very low	114 Å²	114	85.3 Å²	85.3	60%	0.597	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-10.3	-179.6	-152	136.3	0	0	0	113.3	M25 A452 W453 F454	M25-L456 HydrophobicContact CE-CD2 3.87Å; A452-L456 VanDerWaalsContact O-CB 3.3Å; A452-L456 WeakPolarHBondContact O-CB 3.46Å; A452-L456 PolarHBondContact O-N 3.4Å; W453-L456 PolarHBondContact O-N 3.11Å; F454-L456 VanDerWaalsContact C-N 3.27Å; F454-L456 PolarHBondContact O-N 3.34Å
457	F	47.8	Very low	50.5	Low	31 Å²	31	87.1 Å²	87.1	14%	0.136	51%	0.507	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.1	3.9	177.9	-65.2	-65.9	0	0	0	114.3	M25 Y29 W453 F454 S455 D459 L460 D461	M25-F457 HydrophobicContact CE-CD1 4.09Å; M25-F457 HydrophobicContact CE-CE1 3.73Å; M25-F457 HydrophobicContact CG-CE1 4.37Å; Y29-F457 HydrophobicContact CD2-CB 4.04Å; Y29-F457 AromaticContact CD2-CD1 3.38Å; Y29-F457 HydrophobicContact CD2-CD1 3.38Å; Y29-F457 HydrophobicContact CD2-CD2 4.12Å; Y29-F457 AromaticContact CD2-CE1 3.78Å; Y29-F457 HydrophobicContact CD2-CE1 3.78Å; Y29-F457 HydrophobicContact CD2-CE2 4.46Å; Y29-F457 AromaticContact CD2-CG 3.58Å; Y29-F457 HydrophobicContact CD2-CG 3.58Å; Y29-F457 HydrophobicContact CD2-CZ 4.31Å; Y29-F457 HydrophobicContact CE2-CB 3.84Å; Y29-F457 HydrophobicContact CE2-CD1 4.07Å; Y29-F457 AromaticContact CE2-CG 3.9Å; Y29-F457 HydrophobicContact CE2-CG 3.9Å; Y29-F457 HydrophobicContact CG-CD1 4.1Å; Y29-F457 HydrophobicContact CG-CE1 4.25Å; W453-F457 HydrophobicContact CD2-CD2 4.23Å; W453-F457 HydrophobicContact CD2-CE2 4.45Å; W453-F457 AromaticContact CE2-CE2 3.91Å; W453-F457 HydrophobicContact CZ2-CD2 4.23Å; W453-F457 HydrophobicContact CZ2-CE2 4.2Å; W453-F457 AromaticContact NE1-CE2 3.82Å; W453-F457 WeakPolarHBondContact O-CD2 3.44Å; F454-F457 CarbonylContact O-C 3.51Å; F454-F457 PolarHBondContact O-N 3Å; F454-F457 VanDerWaalsContact O-N 3.14Å; S455-F457 PolarHBondContact O-N 3.13Å; F457-D459 VanDerWaalsContact C-N 3.28Å; F457-D459 PolarHBondContact O-N 2.76Å; F457-L460 HydrophobicContact CD1-CD1 4.12Å; F457-L460 PolarHBondContact O-N 2.82Å; F457-D461 PolarHBondContact O-N 3.09Å
458	A	57.2	Low	50.8	Low	25 Å²	25	84.2 Å²	84.2	21%	0.207	48%	0.483	C	S	.	.	G	3₁₀ helix	trans	-58	-39.8	-178.6	0	0	0	0	0	112.4	F454 L460 D461	F454-A458 PolarHBondContact O-N 3.5Å; A458-L460 PolarHBondContact O-N 2.92Å; A458-L460 VanDerWaalsContact O-N 3.11Å; A458-D461 CarbonylContact O-C 3.53Å; A458-D461 PolarHBondContact O-N 3.26Å
459	D	52.8	Low	50.9	Low	160 Å²	160	86.5 Å²	86.5	86%	0.856	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-66.1	-8.9	177.7	-59.1	-12.4	0	0	0	114.1	F457	F457-D459 VanDerWaalsContact C-N 3.28Å; F457-D459 PolarHBondContact O-N 2.76Å
460	L	50.3	Low	50.7	Low	68 Å²	68	85.2 Å²	85.2	36%	0.356	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-112	-12.5	-178	-72.5	168	0	0	0	113.8	Q26 F457 A458	Q26-L460 HydrophobicContact CG-CD1 4.49Å; Q26-L460 HydrophobicContact CG-CD2 4.17Å; F457-L460 HydrophobicContact CD1-CD1 4.12Å; F457-L460 PolarHBondContact O-N 2.82Å; A458-L460 PolarHBondContact O-N 2.92Å; A458-L460 VanDerWaalsContact O-N 3.11Å
461	D	50.7	Low	50.4	Low	29 Å²	29	87.3 Å²	87.3	16%	0.155	51%	0.506	C	S	.	.			trans	-156.8	72.8	177.4	-169.6	-30	0	0	0	110	Y29 K33 F457 A458 L463 S464	Y29-D461 WeakPolarHBondContact OH-CB 3.24Å; Y29-D461 PolarHBondContact OH-OD2 3.02Å; K33-D461 IonicContact NZ-OD2 3.85Å; K33-D461 PolarHBondContact NZ-OD2 3.46Å; F457-D461 PolarHBondContact O-N 3.09Å; A458-D461 CarbonylContact O-C 3.53Å; A458-D461 PolarHBondContact O-N 3.26Å; D461-L463 PolarHBondContact O-N 3.25Å; D461-S464 PolarHBondContact O-N 2.86Å; D461-S464 VanDerWaalsContact OD1-CB 3.23Å; D461-S464 WeakPolarHBondContact OD1-CB 3.32Å; D461-S464 PolarHBondContact OD1-N 3.17Å; D461-S464 VanDerWaalsContact OD1-N 3.09Å; D461-S464 PolarHBondContact OD1-OG 3.42Å; D461-S464 PolarHBondContact OD2-OG 3.32Å
462	P	46.8	Very low	49.7	Very low	82 Å²	82	88.1 Å²	88.1	53%	0.532	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-69.8	-13.4	-174.3	27.9	-35.7	0	0	0	113.6
463	L	43.9	Very low	49.2	Very low	170 Å²	170	92.6 Å²	92.6	89%	0.89	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-83.4	-18.7	176.8	-64.3	177.8	0	0	0	113	D461 N465	D461-L463 PolarHBondContact O-N 3.25Å; L463-N465 VanDerWaalsContact C-N 3.29Å; L463-N465 PolarHBondContact O-N 2.96Å
464	S	53.2	Low	48.7	Very low	69 Å²	69	96.4 Å²	96.4	48%	0.483	55%	0.548	S	S	.	.	G	3₁₀ helix	trans	-81.9	-1.1	176.6	-68.8	0	0	0	0	114.4	D461	D461-S464 PolarHBondContact O-N 2.86Å; D461-S464 VanDerWaalsContact OD1-CB 3.23Å; D461-S464 WeakPolarHBondContact OD1-CB 3.32Å; D461-S464 PolarHBondContact OD1-N 3.17Å; D461-S464 VanDerWaalsContact OD1-N 3.09Å; D461-S464 PolarHBondContact OD1-OG 3.42Å; D461-S464 PolarHBondContact OD2-OG 3.32Å
465	N	46.5	Very low	48.4	Very low	41 Å²	41	100.9 Å²	100.9	22%	0.219	57%	0.57	C	S	.	*			trans	-117.2	110.4	-178.2	-172.8	0.7	0	0	0	111.9	L463 D467 A468	L463-N465 VanDerWaalsContact C-N 3.29Å; L463-N465 PolarHBondContact O-N 2.96Å; N465-D467 PolarHBondContact O-N 3.31Å; N465-D467 PolarHBondContact OD1-N 3.27Å; N465-A468 HydrophobicContact CB-CB 4.33Å; N465-A468 WeakPolarHBondContact O-CB 3.38Å; N465-A468 PolarHBondContact O-N 3.03Å
466	P	48.9	Very low	47.7	Very low	107 Å²	107	105.2 Å²	105.2	70%	0.695	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-64.2	-25.6	-179.3	26.8	-34.4	0	0	0	113.5	A468 V469	P466-A468 PolarHBondContact O-N 3.05Å; P466-V469 PolarHBondContact O-N 3.07Å
467	D	51.1	Low	46.7	Very low	117 Å²	117	108.2 Å²	108.2	63%	0.626	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-78.6	-3.8	179.4	-75.3	-14.2	0	0	0	114.1	N465	N465-D467 PolarHBondContact O-N 3.31Å; N465-D467 PolarHBondContact OD1-N 3.27Å
468	A	48.8	Very low	46.4	Very low	47 Å²	47	114.4 Å²	114.4	39%	0.388	63%	0.626	S	S	.	*	G	3₁₀ helix	trans	-82.7	-23.8	173.2	0	0	0	0	0	112.4	N465 P466 G470	N465-A468 HydrophobicContact CB-CB 4.33Å; N465-A468 WeakPolarHBondContact O-CB 3.38Å; N465-A468 PolarHBondContact O-N 3.03Å; P466-A468 PolarHBondContact O-N 3.05Å; A468-G470 PolarHBondContact O-N 2.95Å
469	V	44.6	Very low	45.6	Very low	131 Å²	131	120.9 Å²	120.9	79%	0.794	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	91.6	-178.6	-177.2	0	0	0	0	110.2	P466	P466-V469 PolarHBondContact O-N 3.07Å
470	G	45.4	Very low	45.1	Very low	65 Å²	65	121.1 Å²	121.1	67%	0.67	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	134.5	-5.8	169.6	0	0	0	0	0	116.3	A468 T472	A468-G470 PolarHBondContact O-N 2.95Å; G470-T472 PolarHBondContact O-N 3.11Å
471	K	43.2	Very low	44.5	Very low	163 Å²	163	126.4 Å²	126.4	71%	0.709	71%	0.711	S	S	*	*			trans	-88.2	77.1	172.8	-71.3	173.5	-175.5	153.3	0	110.6
472	T	40.5	Very low	44.2	Very low	115 Å²	115	131.3 Å²	131.3	71%	0.706	74%	0.739	S	S	*	*			trans	-69.6	133.2	165.5	52.6	0	0	0	0	110.1	G470 K474	G470-T472 PolarHBondContact O-N 3.11Å; T472-K474 PolarHBondContact O-N 3.49Å; T472-K474 VanDerWaalsContact O-N 3.16Å
473	D	42.6	Very low	44	Very low	138 Å²	138	133.9 Å²	133.9	74%	0.738	75%	0.749	S	S	*	*			trans	-58.5	115	-177.6	-60.5	-62.6	0	0	0	112.6	E475	D473-E475 VanDerWaalsContact C-N 3.31Å
474	K	39	Very low	44.1	Very low	180 Å²	180	131.9 Å²	131.9	78%	0.783	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	1.1	174.1	-76.9	-166.3	170.8	-171.8	0	114.1	T472	T472-K474 PolarHBondContact O-N 3.49Å; T472-K474 VanDerWaalsContact O-N 3.16Å
475	E	45	Very low	43.5	Very low	187 Å²	187	135.6 Å²	135.6	87%	0.874	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-2.2	-174.9	-56.3	-163.5	162.8	0	0	113.4	D473	D473-E475 VanDerWaalsContact C-N 3.31Å
476	H	42	Very low	43.3	Very low	170 Å²	170	141.5 Å²	141.5	79%	0.787	79%	0.79	S	S	*	*	S	Bend	trans	-98	-4.7	-176.6	-103.8	-64.4	0	0	0	116.4
477	E	39.6	Very low	43	Very low	178 Å²	178	143.8 Å²	143.8	83%	0.832	80%	0.797	S	S	*	*	S	Bend	trans	-98	1.4	-177.3	-76.2	-167.1	137.1	0	0	115.7
478	L	42.6	Very low	42.4	Very low	160 Å²	160	145.7 Å²	145.7	84%	0.838	81%	0.809	S	S	*	*	S	Bend	trans	-107.5	27.2	-178	-67.4	179.2	0	0	0	114.9
479	L	40.6	Very low	41.9	Very low	162 Å²	162	153.3 Å²	153.3	85%	0.848	84%	0.841	S	S	*	*	S	Bend	trans	-130.9	30.9	174	-78.6	174.8	0	0	0	113.9
480	N	41.8	Very low	41.6	Very low	165 Å²	165	155.2 Å²	155.2	88%	0.882	85%	0.845	S	S	*	*			trans	-145	80	164.8	-88.6	-52.2	0	0	0	110.7
481	A	37.6	Very low	41.3	Very low	179 Å²	179	163.4 Å²	163.4	100%	1.479	86%	0.861	S	S	*	*			trans	-150.1	0	167.8	0	0	0	0	0	109.2

Retrieved 481 of 481 residues in 181.8 ms (Link to these results)

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