A0A087YBB2_POEFO Loading...

UDP-glucuronic acid decarboxylase 1

AlphaFold DB , UniProt , Accession A0A087YBB2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 419 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	50.7	Low	45.1	Very low	224 Å²	224	172.5 Å²	172.5	100%	1.103	85%	0.852	S	S	*	*				0	48.9	0	-154.1	164	95.2	0	0	110.4	K3	M1-K3 PolarHBondContact O-N 3.36Å
2	M	48.5	Very low	45.7	Very low	196 Å²	196	168.5 Å²	168.5	97%	0.966	84%	0.836	S	S	*	*			trans	-109.2	38.4	-165.4	-81.3	160.1	68	0	0	111.2
3	K	52.7	Low	46.4	Very low	211 Å²	211	164.3 Å²	164.3	92%	0.917	82%	0.818	S	S	*	*	S	Bend	trans	-112.8	14	173.7	-101.7	-172.2	178.5	-177.9	0	112.6	M1	M1-K3 PolarHBondContact O-N 3.36Å
4	R	41.3	Very low	47.2	Very low	225 Å²	225	167.3 Å²	167.3	85%	0.849	82%	0.816	S	S	*	*	S	Bend	trans	-138.7	-8.1	-174.2	-88.2	-171.4	175.8	179.2	-1.6	119.3
5	V	43.5	Very low	48	Very low	126 Å²	126	169.7 Å²	169.7	76%	0.764	81%	0.812	S	S	*	*	S	Bend	trans	-87.6	-15.9	177.9	-179.5	0	0	0	0	112.9	W7	V5-W7 PolarHBondContact O-N 3.5Å
6	F	42.8	Very low	48.9	Very low	214 Å²	214	165.6 Å²	165.6	94%	0.939	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	21.3	-179.2	-109	-85.4	0	0	0	115.1
7	W	36.5	Very low	49.6	Very low	216 Å²	216	162.7 Å²	162.7	82%	0.818	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.6	-2.1	178.4	-144.4	75.7	0	0	0	114.6	V5 S10	V5-W7 PolarHBondContact O-N 3.5Å; W7-S10 PolarHBondContact O-OG 2.89Å
8	L	40.6	Very low	50.6	Low	152 Å²	152	162.2 Å²	162.2	80%	0.796	77%	0.774	S	S	*	*	S	Bend	trans	-108.3	-9.4	-176.5	-91	153.2	0	0	0	115.1
9	L	46.6	Very low	51.8	Low	180 Å²	180	159.4 Å²	159.4	94%	0.942	76%	0.764	S	S	*	*	S	Bend	trans	-103.7	23	172.3	-74.5	164.9	0	0	0	112.8
10	S	45.3	Very low	52.7	Low	89 Å²	89	156.9 Å²	156.9	62%	0.622	75%	0.754	S	S	*	*	S	Bend	trans	-111.7	11.4	171.7	55.8	0	0	0	0	113	W7	W7-S10 PolarHBondContact O-OG 2.89Å
11	G	47.8	Very low	53.5	Low	64 Å²	64	157 Å²	157	66%	0.66	75%	0.751	S	S	*	*			trans	-102.5	-0.3	-176.5	0	0	0	0	0	116.1
12	L	51.6	Low	54.4	Low	125 Å²	125	148.4 Å²	148.4	65%	0.654	72%	0.716	S	S	*	*	S	Bend	trans	-101.9	91	170.1	-94.7	96.6	0	0	0	110.2	R14 M16	L12-R14 PolarHBondContact O-N 2.98Å; L12-M16 HydrophobicContact CD2-CE 3.56Å; L12-M16 HydrophobicContact CG-CE 4.32Å
13	N	54.7	Low	55.7	Low	114 Å²	114	143.9 Å²	143.9	61%	0.61	70%	0.696	S	S	*	*			trans	-52.7	132.4	178	-158.4	-13.2	0	0	0	110.6	R15 M16	N13-R15 PolarHBondContact O-N 3.47Å; N13-M16 PolarHBondContact O-N 3.47Å
14	R	58.1	Low	56.5	Low	206 Å²	206	136.8 Å²	136.8	78%	0.777	68%	0.676	S	S	*	*	H	α-helix	trans	-45.6	-26.3	178.6	-84.8	179	172.6	-178.7	-3.1	113.5	L12 K18	L12-R14 PolarHBondContact O-N 2.98Å; R14-K18 WeakPolarHBondContact O-CB 3.5Å; R14-K18 VanDerWaalsContact O-CG 3.28Å; R14-K18 WeakPolarHBondContact O-CG 3.49Å; R14-K18 PolarHBondContact O-N 3.33Å; R14-K18 VanDerWaalsContact O-N 3.13Å
15	R	59.8	Low	58	Low	204 Å²	204	131 Å²	131	77%	0.77	66%	0.662	S	S	*	*	H	α-helix	trans	-60.3	-41.9	176.2	-73.4	-173.8	175.6	-178.6	-1.1	113.4	N13 K18 L19	N13-R15 PolarHBondContact O-N 3.47Å; R15-K18 PolarHBondContact O-N 2.91Å; R15-L19 WeakPolarHBondContact O-CB 3.48Å; R15-L19 PolarHBondContact O-N 2.83Å
16	M	62.2	Low	59.5	Low	104 Å²	104	130.3 Å²	130.3	51%	0.512	65%	0.652	S	S	.	*	H	α-helix	trans	-73.8	-37.2	-175	-147.7	177.2	89.1	0	0	111.8	L12 N13 L19 L20	L12-M16 HydrophobicContact CD2-CE 3.56Å; L12-M16 HydrophobicContact CG-CE 4.32Å; N13-M16 PolarHBondContact O-N 3.47Å; M16-L19 WeakPolarHBondContact O-CB 3.4Å; M16-L19 PolarHBondContact O-N 2.93Å; M16-L20 PolarHBondContact O-N 2.92Å; M16-L20 VanDerWaalsContact O-N 3.07Å
17	M	60.6	Low	60.7	Low	116 Å²	116	123.1 Å²	123.1	57%	0.571	63%	0.632	S	S	*	*	H	α-helix	trans	-68.1	-39.1	175	-138.5	-165.1	-66.9	0	0	111.6	L19 L20 F21	M17-L19 VanDerWaalsContact C-N 3.32Å; M17-L19 PolarHBondContact O-N 3.44Å; M17-L20 PolarHBondContact O-N 3.13Å; M17-F21 PolarHBondContact O-N 3.46Å; M17-F21 VanDerWaalsContact O-N 3.09Å
18	K	67.3	Low	62.4	Low	153 Å²	153	120.4 Å²	120.4	67%	0.665	62%	0.623	S	S	*	*	H	α-helix	trans	-62.8	-37.9	171.9	-76.2	-178.9	177.7	-167.3	0	112.3	R14 R15 A22	R14-K18 WeakPolarHBondContact O-CB 3.5Å; R14-K18 VanDerWaalsContact O-CG 3.28Å; R14-K18 WeakPolarHBondContact O-CG 3.49Å; R14-K18 PolarHBondContact O-N 3.33Å; R14-K18 VanDerWaalsContact O-N 3.13Å; R15-K18 PolarHBondContact O-N 2.91Å; K18-A22 VanDerWaalsContact O-CB 3.28Å; K18-A22 WeakPolarHBondContact O-CB 3.44Å; K18-A22 PolarHBondContact O-N 3.07Å
19	L	73.3	Confident	63.9	Low	109 Å²	109	117.4 Å²	117.4	57%	0.571	61%	0.607	S	S	*	*	H	α-helix	trans	-65.9	-43.5	178.1	-160.7	81.8	0	0	0	111.7	R15 M16 M17 A22 L23	R15-L19 WeakPolarHBondContact O-CB 3.48Å; R15-L19 PolarHBondContact O-N 2.83Å; M16-L19 WeakPolarHBondContact O-CB 3.4Å; M16-L19 PolarHBondContact O-N 2.93Å; M17-L19 VanDerWaalsContact C-N 3.32Å; M17-L19 PolarHBondContact O-N 3.44Å; L19-A22 PolarHBondContact O-N 3.29Å; L19-L23 HydrophobicContact CG-CD1 4.39Å; L19-L23 WeakPolarHBondContact O-CB 3.28Å; L19-L23 WeakPolarHBondContact O-CG 3.47Å; L19-L23 PolarHBondContact O-N 3.5Å
20	L	69.4	Low	64.9	Low	109 Å²	109	111.7 Å²	111.7	57%	0.571	59%	0.586	S	S	*	*	H	α-helix	trans	-65.5	-42	177.5	-75.2	166.9	0	0	0	112.3	M16 M17 L23 A24	M16-L20 PolarHBondContact O-N 2.92Å; M16-L20 VanDerWaalsContact O-N 3.07Å; M17-L20 PolarHBondContact O-N 3.13Å; L20-L23 PolarHBondContact O-N 3.42Å; L20-A24 WeakPolarHBondContact O-CB 3.22Å; L20-A24 PolarHBondContact O-N 3.37Å
21	F	70.1	Confident	66	Low	159 Å²	159	111.2 Å²	111.2	70%	0.697	58%	0.582	S	S	*	*	H	α-helix	trans	-64.5	-40.2	173.5	-98.8	-82.9	0	0	0	112.4	M17 A24 L25	M17-F21 PolarHBondContact O-N 3.46Å; M17-F21 VanDerWaalsContact O-N 3.09Å; F21-A24 PolarHBondContact O-N 3.09Å; F21-L25 WeakPolarHBondContact O-CB 3.28Å; F21-L25 PolarHBondContact O-N 3.46Å
22	A	70.6	Confident	66.9	Low	45 Å²	45	111.4 Å²	111.4	37%	0.372	57%	0.57	S	S	.	*	H	α-helix	trans	-63.6	-43.1	176.6	0	0	0	0	0	111.6	K18 L19 L25 I26	K18-A22 VanDerWaalsContact O-CB 3.28Å; K18-A22 WeakPolarHBondContact O-CB 3.44Å; K18-A22 PolarHBondContact O-N 3.07Å; L19-A22 PolarHBondContact O-N 3.29Å; A22-L25 PolarHBondContact O-N 3.01Å; A22-I26 WeakPolarHBondContact O-CD1 3.46Å; A22-I26 WeakPolarHBondContact O-CG1 3.33Å; A22-I26 PolarHBondContact O-N 3.38Å
23	L	74.4	Confident	67.5	Low	101 Å²	101	113.8 Å²	113.8	53%	0.529	57%	0.571	S	S	.	*	H	α-helix	trans	-64.7	-42.4	177.2	-76.5	165.7	0	0	0	112.3	L19 L20 L25 I26 A27	L19-L23 HydrophobicContact CG-CD1 4.39Å; L19-L23 WeakPolarHBondContact O-CB 3.28Å; L19-L23 WeakPolarHBondContact O-CG 3.47Å; L19-L23 PolarHBondContact O-N 3.5Å; L20-L23 PolarHBondContact O-N 3.42Å; L23-L25 VanDerWaalsContact C-N 3.35Å; L23-I26 PolarHBondContact O-N 2.94Å; L23-A27 PolarHBondContact O-N 2.99Å
24	A	69.3	Low	67.8	Low	61 Å²	61	110.1 Å²	110.1	50%	0.504	56%	0.56	S	S	.	*	H	α-helix	trans	-64	-40	176	0	0	0	0	0	112.1	L20 F21 A27 Y28	L20-A24 WeakPolarHBondContact O-CB 3.22Å; L20-A24 PolarHBondContact O-N 3.37Å; F21-A24 PolarHBondContact O-N 3.09Å; A24-A27 PolarHBondContact O-N 3.44Å; A24-Y28 WeakPolarHBondContact O-CB 3.48Å; A24-Y28 PolarHBondContact O-N 3.39Å
25	L	72.8	Confident	67.8	Low	105 Å²	105	104.6 Å²	104.6	55%	0.55	55%	0.549	S	S	.	.	H	α-helix	trans	-66.1	-41.6	176.7	-171	70.1	0	0	0	111.7	F21 A22 L23 Y28 I29	F21-L25 WeakPolarHBondContact O-CB 3.28Å; F21-L25 PolarHBondContact O-N 3.46Å; A22-L25 PolarHBondContact O-N 3.01Å; L23-L25 VanDerWaalsContact C-N 3.35Å; L25-Y28 PolarHBondContact O-N 3.48Å; L25-I29 HydrophobicContact CD1-CD1 4.45Å; L25-I29 HydrophobicContact CD2-CD1 4.46Å; L25-I29 HydrophobicContact CG-CD1 3.92Å; L25-I29 WeakPolarHBondContact O-CB 3.24Å; L25-I29 VanDerWaalsContact O-CG1 3.24Å; L25-I29 WeakPolarHBondContact O-CG1 3.49Å; L25-I29 PolarHBondContact O-N 2.91Å
26	I	75.1	Confident	67.7	Low	110 Å²	110	101 Å²	101	56%	0.564	54%	0.537	S	S	*	.	H	α-helix	trans	-63.1	-44	176.2	-69.6	164.5	0	0	0	110.7	A22 L23 Y28 I29 A30	A22-I26 WeakPolarHBondContact O-CD1 3.46Å; A22-I26 WeakPolarHBondContact O-CG1 3.33Å; A22-I26 PolarHBondContact O-N 3.38Å; L23-I26 PolarHBondContact O-N 2.94Å; I26-Y28 PolarHBondContact O-N 2.88Å; I26-I29 PolarHBondContact O-N 3.43Å; I26-A30 WeakPolarHBondContact O-CB 3.35Å; I26-A30 PolarHBondContact O-N 3.38Å
27	A	67.9	Low	67.6	Low	63 Å²	63	99.2 Å²	99.2	52%	0.521	53%	0.532	S	S	.	.	H	α-helix	trans	-63.5	-40.5	177.7	0	0	0	0	0	112.2	L23 A24 A30 S31	L23-A27 PolarHBondContact O-N 2.99Å; A24-A27 PolarHBondContact O-N 3.44Å; A27-A30 PolarHBondContact O-N 3.01Å; A27-S31 PolarHBondContact O-N 2.99Å
28	Y	72.9	Confident	67.4	Low	159 Å²	159	98.3 Å²	98.3	62%	0.624	53%	0.529	S	S	*	.	H	α-helix	trans	-65.2	-46.3	175.5	-177.8	-102.1	0	0	0	112	A24 L25 I26 A30 S31 V32	A24-Y28 WeakPolarHBondContact O-CB 3.48Å; A24-Y28 PolarHBondContact O-N 3.39Å; L25-Y28 PolarHBondContact O-N 3.48Å; I26-Y28 PolarHBondContact O-N 2.88Å; Y28-A30 VanDerWaalsContact C-N 3.32Å; Y28-A30 PolarHBondContact O-N 2.97Å; Y28-S31 PolarHBondContact O-N 2.87Å; Y28-V32 HydrophobicContact CD1-CG2 4.3Å; Y28-V32 HydrophobicContact CD2-CG2 4.48Å; Y28-V32 HydrophobicContact CE1-CG2 3.91Å; Y28-V32 HydrophobicContact CE2-CG2 4.11Å; Y28-V32 WeakPolarHBondContact O-CG2 3.22Å; Y28-V32 PolarHBondContact O-N 3.4Å
29	I	72.8	Confident	66.9	Low	89 Å²	89	96.9 Å²	96.9	46%	0.456	53%	0.526	S	S	.	.	H	α-helix	trans	-60.9	-43.2	176.6	-68.6	168	0	0	0	110.4	L25 I26 S31 V32 W33	L25-I29 HydrophobicContact CD1-CD1 4.45Å; L25-I29 HydrophobicContact CD2-CD1 4.46Å; L25-I29 HydrophobicContact CG-CD1 3.92Å; L25-I29 WeakPolarHBondContact O-CB 3.24Å; L25-I29 VanDerWaalsContact O-CG1 3.24Å; L25-I29 WeakPolarHBondContact O-CG1 3.49Å; L25-I29 PolarHBondContact O-N 2.91Å; I26-I29 PolarHBondContact O-N 3.43Å; I29-S31 PolarHBondContact O-N 3.46Å; I29-V32 PolarHBondContact O-N 2.85Å; I29-W33 WeakPolarHBondContact O-CB 3.35Å; I29-W33 PolarHBondContact O-N 3.38Å
30	A	66.6	Low	66.2	Low	61 Å²	61	98.5 Å²	98.5	50%	0.504	53%	0.525	S	S	.	.	H	α-helix	trans	-63.2	-39.7	177.6	0	0	0	0	0	112.4	I26 A27 Y28 G34	I26-A30 WeakPolarHBondContact O-CB 3.35Å; I26-A30 PolarHBondContact O-N 3.38Å; A27-A30 PolarHBondContact O-N 3.01Å; Y28-A30 VanDerWaalsContact C-N 3.32Å; Y28-A30 PolarHBondContact O-N 2.97Å; A30-G34 PolarHBondContact O-N 3.47Å
31	S	69	Low	65.5	Low	78 Å²	78	95.2 Å²	95.2	55%	0.545	51%	0.511	S	S	.	.	H	α-helix	trans	-66	-43.9	176.3	-179.3	0	0	0	0	112.3	A27 Y28 I29 G34 T35	A27-S31 PolarHBondContact O-N 2.99Å; Y28-S31 PolarHBondContact O-N 2.87Å; I29-S31 PolarHBondContact O-N 3.46Å; S31-G34 PolarHBondContact O-N 3.24Å; S31-T35 PolarHBondContact O-N 2.75Å; S31-T35 VanDerWaalsContact O-N 3.11Å; S31-T35 PolarHBondContact O-OG1 2.9Å; S31-T35 VanDerWaalsContact O-OG1 3.05Å
32	V	65.9	Low	65	Low	68 Å²	68	93 Å²	93	41%	0.412	51%	0.505	S	S	.	.	H	α-helix	trans	-69.6	-36.5	179.1	174.9	0	0	0	0	110.8	Y28 I29 T35 Y36	Y28-V32 HydrophobicContact CD1-CG2 4.3Å; Y28-V32 HydrophobicContact CD2-CG2 4.48Å; Y28-V32 HydrophobicContact CE1-CG2 3.91Å; Y28-V32 HydrophobicContact CE2-CG2 4.11Å; Y28-V32 WeakPolarHBondContact O-CG2 3.22Å; Y28-V32 PolarHBondContact O-N 3.4Å; I29-V32 PolarHBondContact O-N 2.85Å; V32-T35 PolarHBondContact O-OG1 3.43Å; V32-T35 VanDerWaalsContact O-OG1 3.06Å; V32-Y36 VanDerWaalsContact O-CB 3.27Å; V32-Y36 WeakPolarHBondContact O-CB 3.33Å; V32-Y36 PolarHBondContact O-N 3.19Å
33	W	65.1	Low	64.5	Low	176 Å²	176	96.6 Å²	96.6	67%	0.667	51%	0.514	S	S	*	.	H	α-helix	trans	-69.9	-38.6	175.5	-159.4	-83.2	0	0	0	112	I29 Y36 T37	I29-W33 WeakPolarHBondContact O-CB 3.35Å; I29-W33 PolarHBondContact O-N 3.38Å; W33-Y36 PolarHBondContact O-N 2.97Å; W33-T37 WeakPolarHBondContact O-CB 3.42Å; W33-T37 WeakPolarHBondContact O-CG2 3.41Å; W33-T37 PolarHBondContact O-N 3.05Å; W33-T37 PolarHBondContact O-OG1 2.98Å
34	G	60.5	Low	63.8	Low	37 Å²	37	97.3 Å²	97.3	38%	0.381	52%	0.515	S	S	.	.	H	α-helix	trans	-63	-41.7	175.4	0	0	0	0	0	112.9	A30 S31 T37 N38	A30-G34 PolarHBondContact O-N 3.47Å; S31-G34 PolarHBondContact O-N 3.24Å; G34-T37 PolarHBondContact O-OG1 3.38Å; G34-T37 VanDerWaalsContact O-OG1 3.06Å; G34-N38 WeakPolarHBondContact O-CB 3.27Å; G34-N38 PolarHBondContact O-N 2.99Å
35	T	57.9	Low	63.4	Low	90 Å²	90	99.7 Å²	99.7	55%	0.552	52%	0.519	S	S	*	.	H	α-helix	trans	-71.2	-39.7	174.2	44.1	0	0	0	0	112.3	S31 V32 N38 M39	S31-T35 PolarHBondContact O-N 2.75Å; S31-T35 VanDerWaalsContact O-N 3.11Å; S31-T35 PolarHBondContact O-OG1 2.9Å; S31-T35 VanDerWaalsContact O-OG1 3.05Å; V32-T35 PolarHBondContact O-OG1 3.43Å; V32-T35 VanDerWaalsContact O-OG1 3.06Å; T35-N38 PolarHBondContact O-N 3.11Å; T35-M39 WeakPolarHBondContact O-CB 3.36Å; T35-M39 PolarHBondContact O-N 3.06Å
36	Y	57.6	Low	62.9	Low	129 Å²	129	96.1 Å²	96.1	51%	0.506	51%	0.508	S	S	.	.	H	α-helix	trans	-63.6	-44.2	177.8	-171.8	-99	0	0	0	112.7	V32 W33 M39 R40	V32-Y36 VanDerWaalsContact O-CB 3.27Å; V32-Y36 WeakPolarHBondContact O-CB 3.33Å; V32-Y36 PolarHBondContact O-N 3.19Å; W33-Y36 PolarHBondContact O-N 2.97Å; Y36-M39 PolarHBondContact O-N 2.98Å; Y36-R40 PolarHBondContact O-N 3.41Å
37	T	59.7	Low	62.4	Low	66 Å²	66	95 Å²	95	41%	0.405	50%	0.503	S	S	.	.	H	α-helix	trans	-65.2	-40.9	177.1	47.5	0	0	0	0	112.2	W33 G34 R40 S41	W33-T37 WeakPolarHBondContact O-CB 3.42Å; W33-T37 WeakPolarHBondContact O-CG2 3.41Å; W33-T37 PolarHBondContact O-N 3.05Å; W33-T37 PolarHBondContact O-OG1 2.98Å; G34-T37 PolarHBondContact O-OG1 3.38Å; G34-T37 VanDerWaalsContact O-OG1 3.06Å; T37-R40 PolarHBondContact O-N 3.06Å; T37-S41 PolarHBondContact O-N 2.77Å
38	N	57.5	Low	62.3	Low	96 Å²	96	95.4 Å²	95.4	51%	0.513	50%	0.499	S	S	.	.	H	α-helix	trans	-65.6	-41.8	177.2	-155.7	8.7	0	0	0	111.5	G34 T35 R40 S41 I42	G34-N38 WeakPolarHBondContact O-CB 3.27Å; G34-N38 PolarHBondContact O-N 2.99Å; T35-N38 PolarHBondContact O-N 3.11Å; N38-R40 PolarHBondContact O-N 3.01Å; N38-S41 PolarHBondContact O-N 3.23Å; N38-S41 PolarHBondContact O-OG 3.01Å; N38-I42 WeakPolarHBondContact O-CG1 3.37Å; N38-I42 PolarHBondContact O-N 3.06Å
39	M	55.9	Low	62.2	Low	123 Å²	123	94.5 Å²	94.5	61%	0.606	50%	0.498	S	S	*	.	H	α-helix	trans	-63.4	-40.5	176.6	-142.2	169.9	77.7	0	0	112	T35 Y36 I42 Q43	T35-M39 WeakPolarHBondContact O-CB 3.36Å; T35-M39 PolarHBondContact O-N 3.06Å; Y36-M39 PolarHBondContact O-N 2.98Å; M39-I42 PolarHBondContact O-N 2.97Å; M39-Q43 WeakPolarHBondContact O-CB 3.28Å; M39-Q43 PolarHBondContact O-N 3.04Å
40	R	58.2	Low	62.1	Low	143 Å²	143	95 Å²	95	54%	0.54	50%	0.5	S	S	.	.	H	α-helix	trans	-63	-41.8	174	-133.1	179.9	-174.4	177	0.6	112	Y36 T37 N38 I42 Q43 E44	Y36-R40 PolarHBondContact O-N 3.41Å; T37-R40 PolarHBondContact O-N 3.06Å; N38-R40 PolarHBondContact O-N 3.01Å; R40-I42 PolarHBondContact O-N 3.42Å; R40-Q43 PolarHBondContact O-N 3.49Å; R40-E44 WeakPolarHBondContact O-CB 3.34Å; R40-E44 WeakPolarHBondContact O-CG 3.41Å; R40-E44 PolarHBondContact O-N 3.33Å
41	S	56.3	Low	62.3	Low	40 Å²	40	98 Å²	98	28%	0.28	50%	0.504	S	S	.	.	H	α-helix	trans	-68.3	-32.5	178.7	76.8	0	0	0	0	113.6	T37 N38 N45	T37-S41 PolarHBondContact O-N 2.77Å; N38-S41 PolarHBondContact O-N 3.23Å; N38-S41 PolarHBondContact O-OG 3.01Å; S41-N45 VanDerWaalsContact O-CB 3.28Å; S41-N45 WeakPolarHBondContact O-CB 3.34Å; S41-N45 VanDerWaalsContact O-CG 3.29Å; S41-N45 PolarHBondContact O-N 3.46Å; S41-N45 PolarHBondContact O-ND2 3.3Å
42	I	58.4	Low	62.5	Low	112 Å²	112	99.9 Å²	99.9	57%	0.574	50%	0.504	S	S	*	.	H	α-helix	trans	-72.4	-38.7	175.5	-68	166.2	0	0	0	110.2	N38 M39 R40 G46	N38-I42 WeakPolarHBondContact O-CG1 3.37Å; N38-I42 PolarHBondContact O-N 3.06Å; M39-I42 PolarHBondContact O-N 2.97Å; R40-I42 PolarHBondContact O-N 3.42Å; I42-G46 PolarHBondContact O-N 3.3Å
43	Q	60.3	Low	62.8	Low	121 Å²	121	103.4 Å²	103.4	57%	0.565	51%	0.514	S	S	*	.	H	α-helix	trans	-69.6	-45.9	177.9	-159.8	164.4	-7.8	0	0	111.2	M39 R40 N45 G46 D47	M39-Q43 WeakPolarHBondContact O-CB 3.28Å; M39-Q43 PolarHBondContact O-N 3.04Å; R40-Q43 PolarHBondContact O-N 3.49Å; Q43-N45 PolarHBondContact O-N 3.29Å; Q43-G46 PolarHBondContact O-N 2.96Å; Q43-G46 VanDerWaalsContact O-N 3.16Å; Q43-D47 WeakPolarHBondContact O-CB 3.39Å; Q43-D47 VanDerWaalsContact O-CG 3.3Å; Q43-D47 PolarHBondContact O-N 3.44Å
44	E	60	Low	63.3	Low	117 Å²	117	99.5 Å²	99.5	55%	0.547	51%	0.505	S	S	.	.	H	α-helix	trans	-59.5	-43.9	173.4	-77.5	172.6	-179	0	0	112	R40 G46 D47 V48	R40-E44 WeakPolarHBondContact O-CB 3.34Å; R40-E44 WeakPolarHBondContact O-CG 3.41Å; R40-E44 PolarHBondContact O-N 3.33Å; E44-G46 VanDerWaalsContact C-N 3.33Å; E44-G46 PolarHBondContact O-N 2.97Å; E44-D47 PolarHBondContact O-N 3.16Å; E44-V48 WeakPolarHBondContact O-CB 3.19Å; E44-V48 WeakPolarHBondContact O-CG2 3.45Å; E44-V48 PolarHBondContact O-N 3.44Å
45	N	60.6	Low	64.1	Low	111 Å²	111	102 Å²	102	59%	0.594	51%	0.51	S	S	*	.	H	α-helix	trans	-67.9	-31	176.4	-80.2	-41.1	0	0	0	113.2	S41 Q43 K49	S41-N45 VanDerWaalsContact O-CB 3.28Å; S41-N45 WeakPolarHBondContact O-CB 3.34Å; S41-N45 VanDerWaalsContact O-CG 3.29Å; S41-N45 PolarHBondContact O-N 3.46Å; S41-N45 PolarHBondContact O-ND2 3.3Å; Q43-N45 PolarHBondContact O-N 3.29Å; N45-K49 WeakPolarHBondContact O-CB 3.48Å; N45-K49 PolarHBondContact O-N 3.4Å
46	G	63.1	Low	65.1	Low	30 Å²	30	104.8 Å²	104.8	31%	0.309	52%	0.517	S	S	.	.	H	α-helix	trans	-69.1	-45	173.9	0	0	0	0	0	112	I42 Q43 E44 K49 I50	I42-G46 PolarHBondContact O-N 3.3Å; Q43-G46 PolarHBondContact O-N 2.96Å; Q43-G46 VanDerWaalsContact O-N 3.16Å; E44-G46 VanDerWaalsContact C-N 3.33Å; E44-G46 PolarHBondContact O-N 2.97Å; G46-K49 PolarHBondContact O-N 2.89Å; G46-I50 VanDerWaalsContact O-CG1 3.32Å; G46-I50 WeakPolarHBondContact O-CG1 3.4Å; G46-I50 PolarHBondContact O-N 3.39Å
47	D	63.7	Low	66	Low	87 Å²	87	101.5 Å²	101.5	47%	0.465	52%	0.516	S	S	.	.	H	α-helix	trans	-65.4	-44.6	179.3	-69.9	-23.3	0	0	0	111.2	Q43 E44 K49 I50 E51	Q43-D47 WeakPolarHBondContact O-CB 3.39Å; Q43-D47 VanDerWaalsContact O-CG 3.3Å; Q43-D47 PolarHBondContact O-N 3.44Å; E44-D47 PolarHBondContact O-N 3.16Å; D47-K49 VanDerWaalsContact C-N 3.27Å; D47-K49 PolarHBondContact O-N 2.85Å; D47-I50 PolarHBondContact O-N 3.21Å; D47-I50 VanDerWaalsContact O-N 3.14Å; D47-E51 WeakPolarHBondContact O-CG 3.49Å; D47-E51 PolarHBondContact O-N 3.38Å
48	V	66.9	Low	67	Low	71 Å²	71	100.6 Å²	100.6	43%	0.43	51%	0.51	S	S	.	.	H	α-helix	trans	-60.3	-37.4	175.4	171.4	0	0	0	0	111.8	E44 Q52	E44-V48 WeakPolarHBondContact O-CB 3.19Å; E44-V48 WeakPolarHBondContact O-CG2 3.45Å; E44-V48 PolarHBondContact O-N 3.44Å; V48-Q52 WeakPolarHBondContact O-CG 3.32Å; V48-Q52 PolarHBondContact O-N 2.84Å
49	K	69.2	Low	68.2	Low	140 Å²	140	98.5 Å²	98.5	61%	0.609	51%	0.506	S	S	*	.	H	α-helix	trans	-74.7	-28	-180	-158.4	173.5	-170.9	175.3	0	112.5	N45 G46 D47 K53	N45-K49 WeakPolarHBondContact O-CB 3.48Å; N45-K49 PolarHBondContact O-N 3.4Å; G46-K49 PolarHBondContact O-N 2.89Å; D47-K49 VanDerWaalsContact C-N 3.27Å; D47-K49 PolarHBondContact O-N 2.85Å; K49-K53 WeakPolarHBondContact O-CG 3.36Å; K49-K53 PolarHBondContact O-N 2.99Å
50	I	70.7	Confident	69.3	Low	98 Å²	98	95.7 Å²	95.7	50%	0.503	50%	0.498	S	S	.	.	H	α-helix	trans	-74.6	-44.9	172.5	-69.8	166.8	0	0	0	109.8	G46 D47 Q52 K53 I54	G46-I50 VanDerWaalsContact O-CG1 3.32Å; G46-I50 WeakPolarHBondContact O-CG1 3.4Å; G46-I50 PolarHBondContact O-N 3.39Å; D47-I50 PolarHBondContact O-N 3.21Å; D47-I50 VanDerWaalsContact O-N 3.14Å; I50-Q52 PolarHBondContact O-N 3.19Å; I50-K53 PolarHBondContact O-N 3.45Å; I50-I54 HydrophobicContact CG2-CD1 3.71Å; I50-I54 HydrophobicContact CG2-CG1 4.36Å; I50-I54 VanDerWaalsContact O-CG1 3.32Å; I50-I54 WeakPolarHBondContact O-CG1 3.48Å; I50-I54 PolarHBondContact O-N 3.45Å
51	E	71.4	Confident	70.3	Confident	125 Å²	125	93.6 Å²	93.6	58%	0.584	50%	0.497	S	S	*	.	H	α-helix	trans	-58.2	-45.9	175.7	-76.3	-176.8	167.3	0	0	111.8	D47 K53 I54 D55	D47-E51 WeakPolarHBondContact O-CG 3.49Å; D47-E51 PolarHBondContact O-N 3.38Å; E51-K53 VanDerWaalsContact C-N 3.34Å; E51-K53 PolarHBondContact O-N 2.88Å; E51-I54 PolarHBondContact O-N 2.9Å; E51-D55 PolarHBondContact O-N 3.38Å
52	Q	73.4	Confident	71.4	Confident	118 Å²	118	99.2 Å²	99.2	55%	0.551	51%	0.511	S	S	*	.	H	α-helix	trans	-58.9	-42.7	175.8	-79.5	-179.7	-21.1	0	0	112.8	V48 I50 D55 E56	V48-Q52 WeakPolarHBondContact O-CG 3.32Å; V48-Q52 PolarHBondContact O-N 2.84Å; I50-Q52 PolarHBondContact O-N 3.19Å; Q52-D55 PolarHBondContact O-N 3.04Å; Q52-E56 WeakPolarHBondContact O-CB 3.34Å; Q52-E56 WeakPolarHBondContact O-CG 3.21Å; Q52-E56 PolarHBondContact O-N 3.14Å
53	K	73.3	Confident	72.3	Confident	142 Å²	142	99.3 Å²	99.3	62%	0.617	51%	0.51	S	S	*	.	H	α-helix	trans	-68.5	-35.3	177.4	-79.2	-174.2	173.6	-171.6	0	112.9	K49 I50 E51 A57	K49-K53 WeakPolarHBondContact O-CG 3.36Å; K49-K53 PolarHBondContact O-N 2.99Å; I50-K53 PolarHBondContact O-N 3.45Å; E51-K53 VanDerWaalsContact C-N 3.34Å; E51-K53 PolarHBondContact O-N 2.88Å; K53-A57 WeakPolarHBondContact O-CB 3.26Å; K53-A57 PolarHBondContact O-N 3.07Å
54	I	74.8	Confident	73.1	Confident	93 Å²	93	100.1 Å²	100.1	48%	0.477	51%	0.511	S	S	.	.	H	α-helix	trans	-66.6	-45.5	174.3	-69.6	169.7	0	0	0	109.3	I50 E51 E56 A57 V58	I50-I54 HydrophobicContact CG2-CD1 3.71Å; I50-I54 HydrophobicContact CG2-CG1 4.36Å; I50-I54 VanDerWaalsContact O-CG1 3.32Å; I50-I54 WeakPolarHBondContact O-CG1 3.48Å; I50-I54 PolarHBondContact O-N 3.45Å; E51-I54 PolarHBondContact O-N 2.9Å; I54-E56 PolarHBondContact O-N 3.33Å; I54-A57 PolarHBondContact O-N 2.83Å; I54-V58 HydrophobicContact CG2-CG2 4Å; I54-V58 WeakPolarHBondContact O-CB 3.35Å; I54-V58 WeakPolarHBondContact O-CG2 3.46Å; I54-V58 PolarHBondContact O-N 3.22Å
55	D	76.9	Confident	74	Confident	91 Å²	91	98.8 Å²	98.8	49%	0.487	51%	0.507	S	S	.	.	H	α-helix	trans	-64.6	-40.3	178.1	-88.7	-16.6	0	0	0	112.5	E51 Q52 A57 V58 A59	E51-D55 PolarHBondContact O-N 3.38Å; Q52-D55 PolarHBondContact O-N 3.04Å; D55-A57 VanDerWaalsContact C-N 3.33Å; D55-A57 PolarHBondContact O-N 2.91Å; D55-V58 PolarHBondContact O-N 3.5Å; D55-A59 VanDerWaalsContact O-CB 3.26Å; D55-A59 WeakPolarHBondContact O-CB 3.32Å; D55-A59 PolarHBondContact O-N 2.71Å
56	E	78.8	Confident	74.6	Confident	148 Å²	148	100.5 Å²	100.5	69%	0.692	51%	0.505	S	S	*	.	H	α-helix	trans	-61.4	-39.9	172.8	-77.6	177.4	177.2	0	0	112.3	Q52 I54 P60	Q52-E56 WeakPolarHBondContact O-CB 3.34Å; Q52-E56 WeakPolarHBondContact O-CG 3.21Å; Q52-E56 PolarHBondContact O-N 3.14Å; I54-E56 PolarHBondContact O-N 3.33Å; E56-P60 WeakPolarHBondContact O-CD 3.13Å
57	A	76.6	Confident	75	Confident	60 Å²	60	102.9 Å²	102.9	50%	0.496	51%	0.511	S	S	.	.	H	α-helix	trans	-74.3	-31.4	178.1	0	0	0	0	0	113	K53 I54 D55	K53-A57 WeakPolarHBondContact O-CB 3.26Å; K53-A57 PolarHBondContact O-N 3.07Å; I54-A57 PolarHBondContact O-N 2.83Å; D55-A57 VanDerWaalsContact C-N 3.33Å; D55-A57 PolarHBondContact O-N 2.91Å
58	V	81.4	Confident	75.2	Confident	46 Å²	46	103.2 Å²	103.2	28%	0.279	51%	0.512	S	S	.	.	H	α-helix	trans	-90.2	-23.3	-175.7	174.2	0	0	0	0	112	I54 D55 L61 R62	I54-V58 HydrophobicContact CG2-CG2 4Å; I54-V58 WeakPolarHBondContact O-CB 3.35Å; I54-V58 WeakPolarHBondContact O-CG2 3.46Å; I54-V58 PolarHBondContact O-N 3.22Å; D55-V58 PolarHBondContact O-N 3.5Å; V58-L61 CarbonylContact O-C 3.59Å; V58-L61 WeakPolarHBondContact O-CB 3.32Å; V58-L61 PolarHBondContact O-N 3.43Å; V58-L61 VanDerWaalsContact O-N 3.07Å; V58-R62 HydrophobicContact CG1-CG 3.85Å; V58-R62 PolarHBondContact O-N 3.07Å
59	A	81.5	Confident	75.3	Confident	52 Å²	52	105.7 Å²	105.7	43%	0.43	52%	0.519	S	S	.	.	H	α-helix	trans	-50.4	-52.1	176.3	0	0	0	0	0	114.4	D55 L61 R62 E63	D55-A59 VanDerWaalsContact O-CB 3.26Å; D55-A59 WeakPolarHBondContact O-CB 3.32Å; D55-A59 PolarHBondContact O-N 2.71Å; A59-L61 VanDerWaalsContact C-N 3.26Å; A59-L61 PolarHBondContact O-N 3.01Å; A59-R62 PolarHBondContact O-N 2.82Å; A59-E63 PolarHBondContact O-N 2.83Å
60	P	80.3	Confident	74.9	Confident	65 Å²	65	104 Å²	104	42%	0.422	51%	0.513	S	S	.	.	H	α-helix	trans	-68.8	-24.9	178.5	26.7	-34.9	0	0	0	112.9	E56 K64	E56-P60 WeakPolarHBondContact O-CD 3.13Å; P60-K64 WeakPolarHBondContact O-CG 3.25Å; P60-K64 PolarHBondContact O-N 2.87Å; P60-K64 VanDerWaalsContact O-N 3.15Å
61	L	77.9	Confident	74.2	Confident	99 Å²	99	102.9 Å²	102.9	52%	0.518	51%	0.514	S	S	.	.	H	α-helix	trans	-75	-39.1	174.6	-69.5	168.8	0	0	0	111.4	V58 A59 E63 K64 I65	V58-L61 CarbonylContact O-C 3.59Å; V58-L61 WeakPolarHBondContact O-CB 3.32Å; V58-L61 PolarHBondContact O-N 3.43Å; V58-L61 VanDerWaalsContact O-N 3.07Å; A59-L61 VanDerWaalsContact C-N 3.26Å; A59-L61 PolarHBondContact O-N 3.01Å; L61-E63 VanDerWaalsContact C-N 3.34Å; L61-K64 PolarHBondContact O-N 3.37Å; L61-I65 WeakPolarHBondContact O-CB 3.48Å; L61-I65 VanDerWaalsContact O-CG1 3.22Å; L61-I65 WeakPolarHBondContact O-CG1 3.39Å; L61-I65 PolarHBondContact O-N 3.42Å
62	R	80.6	Confident	73.5	Confident	157 Å²	157	105.2 Å²	105.2	59%	0.592	52%	0.522	S	S	*	.	H	α-helix	trans	-63.4	-40	173.1	-74.9	177.5	-171.3	-123.5	12.6	111.7	V58 A59 I65 R66	V58-R62 HydrophobicContact CG1-CG 3.85Å; V58-R62 PolarHBondContact O-N 3.07Å; A59-R62 PolarHBondContact O-N 2.82Å; R62-I65 PolarHBondContact O-N 3.05Å; R62-R66 WeakPolarHBondContact O-CB 3.05Å; R62-R66 PolarHBondContact O-N 3.26Å
63	E	76.9	Confident	72.9	Confident	114 Å²	114	103.9 Å²	103.9	53%	0.533	53%	0.526	S	S	.	.	H	α-helix	trans	-62.6	-48.4	175.5	-167.3	174	-159.4	0	0	111	A59 L61 I65 R66 D67	A59-E63 PolarHBondContact O-N 2.83Å; L61-E63 VanDerWaalsContact C-N 3.34Å; E63-I65 VanDerWaalsContact C-N 3.33Å; E63-I65 PolarHBondContact O-N 3.33Å; E63-R66 WeakPolarHBondContact O-CB 3.5Å; E63-R66 PolarHBondContact O-N 3.07Å; E63-R66 VanDerWaalsContact O-N 3.15Å; E63-D67 VanDerWaalsContact O-CG 3.27Å; E63-D67 PolarHBondContact O-N 2.89Å
64	K	76.8	Confident	72.5	Confident	138 Å²	138	102.1 Å²	102.1	60%	0.6	52%	0.52	S	S	*	.	H	α-helix	trans	-60.6	-38.4	174.1	-78.6	179	177.4	178.8	0	113.7	P60 L61 L68	P60-K64 WeakPolarHBondContact O-CG 3.25Å; P60-K64 PolarHBondContact O-N 2.87Å; P60-K64 VanDerWaalsContact O-N 3.15Å; L61-K64 PolarHBondContact O-N 3.37Å; K64-L68 WeakPolarHBondContact O-CB 3.45Å; K64-L68 WeakPolarHBondContact O-CD1 3.4Å; K64-L68 VanDerWaalsContact O-CG 3.25Å; K64-L68 WeakPolarHBondContact O-CG 3.3Å; K64-L68 PolarHBondContact O-N 2.93Å
65	I	78.8	Confident	72.8	Confident	90 Å²	90	105.3 Å²	105.3	46%	0.462	53%	0.531	S	S	.	.	H	α-helix	trans	-66.6	-42.2	176	-71.7	165.7	0	0	0	110	L61 R62 E63 D67 L68 E69	L61-I65 WeakPolarHBondContact O-CB 3.48Å; L61-I65 VanDerWaalsContact O-CG1 3.22Å; L61-I65 WeakPolarHBondContact O-CG1 3.39Å; L61-I65 PolarHBondContact O-N 3.42Å; R62-I65 PolarHBondContact O-N 3.05Å; E63-I65 VanDerWaalsContact C-N 3.33Å; E63-I65 PolarHBondContact O-N 3.33Å; I65-D67 PolarHBondContact O-N 3.3Å; I65-L68 WeakPolarHBondContact O-CB 3.36Å; I65-L68 PolarHBondContact O-N 2.92Å; I65-E69 HydrophobicContact CG2-CG 4.28Å; I65-E69 WeakPolarHBondContact O-CB 3.31Å; I65-E69 VanDerWaalsContact O-CG 3.3Å; I65-E69 WeakPolarHBondContact O-CG 3.45Å; I65-E69 PolarHBondContact O-N 3.32Å
66	R	73.8	Confident	73.3	Confident	147 Å²	147	103.3 Å²	103.3	56%	0.555	52%	0.517	S	S	*	.	H	α-helix	trans	-63	-42.1	176	-166.9	-177.5	77.4	-179.3	2.2	111.8	R62 E63 L68 E69 Q70	R62-R66 WeakPolarHBondContact O-CB 3.05Å; R62-R66 PolarHBondContact O-N 3.26Å; E63-R66 WeakPolarHBondContact O-CB 3.5Å; E63-R66 PolarHBondContact O-N 3.07Å; E63-R66 VanDerWaalsContact O-N 3.15Å; R66-L68 VanDerWaalsContact C-N 3.32Å; R66-E69 PolarHBondContact O-N 3.06Å; R66-Q70 WeakPolarHBondContact O-CB 3.27Å; R66-Q70 PolarHBondContact O-N 3.42Å
67	D	70.8	Confident	73.9	Confident	79 Å²	79	98.1 Å²	98.1	42%	0.422	50%	0.496	S	S	.	.	H	α-helix	trans	-65.6	-38.4	176.3	-67.3	-11.6	0	0	0	111	E63 I65 Q70 S71	E63-D67 VanDerWaalsContact O-CG 3.27Å; E63-D67 PolarHBondContact O-N 2.89Å; I65-D67 PolarHBondContact O-N 3.3Å; D67-Q70 PolarHBondContact O-N 3.15Å; D67-S71 WeakPolarHBondContact O-CB 3.32Å; D67-S71 PolarHBondContact O-N 2.9Å
68	L	69	Low	74.5	Confident	94 Å²	94	99.8 Å²	99.8	49%	0.492	50%	0.501	S	S	.	.	H	α-helix	trans	-65.3	-47.4	173.1	-79.3	165.7	0	0	0	111.5	K64 I65 R66 Q70 S71 F72	K64-L68 WeakPolarHBondContact O-CB 3.45Å; K64-L68 WeakPolarHBondContact O-CD1 3.4Å; K64-L68 VanDerWaalsContact O-CG 3.25Å; K64-L68 WeakPolarHBondContact O-CG 3.3Å; K64-L68 PolarHBondContact O-N 2.93Å; I65-L68 WeakPolarHBondContact O-CB 3.36Å; I65-L68 PolarHBondContact O-N 2.92Å; R66-L68 VanDerWaalsContact C-N 3.32Å; L68-Q70 VanDerWaalsContact C-N 3.31Å; L68-Q70 PolarHBondContact O-N 2.87Å; L68-S71 WeakPolarHBondContact CA-OG 3.22Å; L68-S71 CarbonylContact O-C 3.58Å; L68-S71 WeakPolarHBondContact O-CA 3.48Å; L68-S71 WeakPolarHBondContact O-CB 3.41Å; L68-S71 PolarHBondContact O-N 2.86Å; L68-S71 PolarHBondContact O-OG 2.91Å; L68-F72 HydrophobicContact CB-CE2 4.48Å; L68-F72 HydrophobicContact CD2-CE2 4.36Å; L68-F72 WeakPolarHBondContact O-CD2 3.45Å; L68-F72 PolarHBondContact O-N 3.15Å
69	E	68.6	Low	75.1	Confident	123 Å²	123	99.8 Å²	99.8	58%	0.575	50%	0.502	S	S	*	.	H	α-helix	trans	-61	-37.8	176.1	-74.3	175.3	169.1	0	0	112.2	I65 R66 F72 S73	I65-E69 HydrophobicContact CG2-CG 4.28Å; I65-E69 WeakPolarHBondContact O-CB 3.31Å; I65-E69 VanDerWaalsContact O-CG 3.3Å; I65-E69 WeakPolarHBondContact O-CG 3.45Å; I65-E69 PolarHBondContact O-N 3.32Å; R66-E69 PolarHBondContact O-N 3.06Å; E69-F72 PolarHBondContact O-N 3.37Å; E69-S73 WeakPolarHBondContact O-CB 3.46Å; E69-S73 PolarHBondContact O-N 2.73Å; E69-S73 VanDerWaalsContact O-N 3.11Å; E69-S73 PolarHBondContact O-OG 3.4Å
70	Q	60.1	Low	75.7	Confident	105 Å²	105	103.7 Å²	103.7	49%	0.491	51%	0.509	S	S	.	.	H	α-helix	trans	-64.7	-42.8	169.2	-84.6	-173.5	-16.9	0	0	111.8	R66 D67 L68 F72 S73 Q74	R66-Q70 WeakPolarHBondContact O-CB 3.27Å; R66-Q70 PolarHBondContact O-N 3.42Å; D67-Q70 PolarHBondContact O-N 3.15Å; L68-Q70 VanDerWaalsContact C-N 3.31Å; L68-Q70 PolarHBondContact O-N 2.87Å; Q70-F72 VanDerWaalsContact C-N 3.27Å; Q70-F72 PolarHBondContact O-N 3.41Å; Q70-S73 WeakPolarHBondContact CA-OG 3.25Å; Q70-S73 PolarHBondContact O-N 3.49Å; Q70-S73 PolarHBondContact O-OG 3.38Å; Q70-Q74 VanDerWaalsContact O-CB 3.24Å; Q70-Q74 WeakPolarHBondContact O-CB 3.44Å; Q70-Q74 PolarHBondContact O-N 3.49Å
71	S	56.6	Low	76.2	Confident	74 Å²	74	109.2 Å²	109.2	52%	0.517	53%	0.527	S	S	.	.	H	α-helix	trans	-65.3	-29.6	178	78.7	0	0	0	0	113.4	D67 L68	D67-S71 WeakPolarHBondContact O-CB 3.32Å; D67-S71 PolarHBondContact O-N 2.9Å; L68-S71 WeakPolarHBondContact CA-OG 3.22Å; L68-S71 CarbonylContact O-C 3.58Å; L68-S71 WeakPolarHBondContact O-CA 3.48Å; L68-S71 WeakPolarHBondContact O-CB 3.41Å; L68-S71 PolarHBondContact O-N 2.86Å; L68-S71 PolarHBondContact O-OG 2.91Å
72	F	57	Low	77	Confident	174 Å²	174	105.5 Å²	105.5	76%	0.763	51%	0.507	S	S	*	.	H	α-helix	trans	-80	-25.1	175.3	-78.5	-67.8	0	0	0	113.1	L68 E69 Q70	L68-F72 HydrophobicContact CB-CE2 4.48Å; L68-F72 HydrophobicContact CD2-CE2 4.36Å; L68-F72 WeakPolarHBondContact O-CD2 3.45Å; L68-F72 PolarHBondContact O-N 3.15Å; E69-F72 PolarHBondContact O-N 3.37Å; Q70-F72 VanDerWaalsContact C-N 3.27Å; Q70-F72 PolarHBondContact O-N 3.41Å
73	S	60.5	Low	77.6	Confident	91 Å²	91	100.4 Å²	100.4	64%	0.636	50%	0.495	S	S	*	.	H	α-helix	trans	-94.4	-30.2	-179.7	53.4	0	0	0	0	113.3	E69 Q70 K75	E69-S73 WeakPolarHBondContact O-CB 3.46Å; E69-S73 PolarHBondContact O-N 2.73Å; E69-S73 VanDerWaalsContact O-N 3.11Å; E69-S73 PolarHBondContact O-OG 3.4Å; Q70-S73 WeakPolarHBondContact CA-OG 3.25Å; Q70-S73 PolarHBondContact O-N 3.49Å; Q70-S73 PolarHBondContact O-OG 3.38Å; S73-K75 PolarHBondContact O-N 3.35Å
74	Q	64.4	Low	78	Confident	104 Å²	104	103.2 Å²	103.2	49%	0.486	51%	0.509	S	S	.	.			trans	-83.1	84.9	-178.9	-170.3	149.4	18.5	0	0	111.3	Q70 Y76	Q70-Q74 VanDerWaalsContact O-CB 3.24Å; Q70-Q74 WeakPolarHBondContact O-CB 3.44Å; Q70-Q74 PolarHBondContact O-N 3.49Å; Q74-Y76 WeakPolarHBondContact CG-O 3.49Å; Q74-Y76 PolarHBondContact O-N 2.87Å
75	K	80.8	Confident	78.6	Confident	160 Å²	160	105.9 Å²	105.9	70%	0.696	52%	0.52	S	S	*	.			trans	-65.5	-22.5	-178.1	-168.8	177	175.6	-160.5	0	114.3	S73	S73-K75 PolarHBondContact O-N 3.35Å
76	Y	88.8	Confident	79.2	Confident	49 Å²	49	106.2 Å²	106.2	19%	0.192	52%	0.523	C	S	.	.	S	Bend	trans	-134.2	155.6	-175	-49.1	-65.1	0	0	0	110.5	Q74 H130 G133 H134	Q74-Y76 WeakPolarHBondContact CG-O 3.49Å; Q74-Y76 PolarHBondContact O-N 2.87Å; Y76-H130 WeakPolarHBondContact CD1-O 3.41Å; Y76-G133 WeakPolarHBondContact OH-CA 3.49Å; Y76-G133 PolarHBondContact OH-O 2.79Å; Y76-H134 HydrophobicContact CD1-CB 4.21Å; Y76-H134 HydrophobicContact CD2-CB 4.1Å; Y76-H134 AromaticContact CD2-CD2 3.58Å; Y76-H134 HydrophobicContact CE1-CB 4.35Å; Y76-H134 HydrophobicContact CE2-CB 4.21Å; Y76-H134 HydrophobicContact CG-CB 4.1Å; Y76-H134 AromaticContact CG-CD2 3.72Å
77	P	90.1	Very high	80.2	Confident	39 Å²	39	102.2 Å²	102.2	25%	0.253	51%	0.508	S	S	.	.			trans	-55.1	149.2	173.5	-19.2	29	0	0	0	111.8	V79 M109 W131	P77-V79 PolarHBondContact O-N 2.9Å; P77-M109 HydrophobicContact CB-CE 4.48Å; P77-W131 HydrophobicContact CB-CH2 3.58Å; P77-W131 HydrophobicContact CB-CZ2 4.22Å; P77-W131 HydrophobicContact CB-CZ3 4.02Å; P77-W131 HydrophobicContact CG-CE3 4.47Å; P77-W131 HydrophobicContact CG-CH2 3.69Å; P77-W131 HydrophobicContact CG-CZ2 4.02Å; P77-W131 HydrophobicContact CG-CZ3 3.93Å
78	P	90.1	Very high	81.5	Confident	95 Å²	95	101.5 Å²	101.5	62%	0.617	50%	0.501	S	S	*	.			trans	-61.7	133.8	-179.9	25.4	-33.6	0	0	0	111.1
79	V	92.8	Very high	82.9	Confident	47 Å²	47	101.1 Å²	101.1	29%	0.285	49%	0.493	S	S	.	.			trans	-118.6	144.9	177.2	-61	0	0	0	0	110.2	P77 M108 W131	P77-V79 PolarHBondContact O-N 2.9Å; V79-M108 WeakPolarHBondContact CB-O 3.34Å; V79-M108 VanDerWaalsContact CG1-O 3.25Å; V79-M108 WeakPolarHBondContact CG1-O 3.31Å; V79-W131 HydrophobicContact CG1-CH2 3.91Å; V79-W131 HydrophobicContact CG1-CZ3 3.69Å
80	K	94.6	Very high	84.4	Confident	134 Å²	134	95.3 Å²	95.3	58%	0.583	47%	0.466	S	S	*	.			trans	-68.9	136.8	172.7	-176.2	-179.8	177.1	-174.9	0	109.7	L82 M109 G111	K80-L82 HydrophobicContact CD-CD2 4.13Å; K80-L82 HydrophobicContact CG-CD2 4.42Å; K80-M109 WeakPolarHBondContact CB-O 3.28Å; K80-M109 PolarHBondContact N-O 3.41Å; K80-G111 WeakPolarHBondContact O-CA 3.37Å
81	F	92.4	Very high	86.2	Confident	180 Å²	180	90.3 Å²	90.3	79%	0.789	44%	0.443	S	S	*	.			trans	-76.8	127.4	168.8	-177.4	-97.2	0	0	0	110.1
82	L	94.4	Very high	88.3	Confident	22 Å²	22	86.8 Å²	86.8	12%	0.115	42%	0.418	C	S	.	.			trans	-118.6	141.4	171.2	-66.7	-177.4	0	0	0	109.6	K80 D86 R87 D110	K80-L82 HydrophobicContact CD-CD2 4.13Å; K80-L82 HydrophobicContact CG-CD2 4.42Å; L82-D86 HydrophobicContact CB-CB 4.49Å; L82-D86 HydrophobicContact CD2-CB 4.39Å; L82-R87 HydrophobicContact CB-CB 3.99Å; L82-R87 HydrophobicContact CB-CG 4.43Å; L82-D110 VanDerWaalsContact CD1-O 3.27Å; L82-D110 WeakPolarHBondContact CD1-O 3.2Å
83	S	91.6	Very high	90.3	Very high	49 Å²	49	78.5 Å²	78.5	34%	0.343	38%	0.382	S	S	.	.			trans	-66.3	159	170.1	80.7	0	0	0	0	110.4	K85 D86 R87	S83-K85 PolarHBondContact O-N 3.48Å; S83-K85 PolarHBondContact OG-N 3.11Å; S83-D86 PolarHBondContact O-N 3.24Å; S83-D86 PolarHBondContact OG-N 2.67Å; S83-D86 PolarHBondContact OG-OD2 3.42Å; S83-R87 VanDerWaalsContact O-CB 3.32Å; S83-R87 WeakPolarHBondContact O-CB 3.3Å; S83-R87 PolarHBondContact O-N 3.44Å
84	E	86.8	Confident	92.1	Very high	174 Å²	174	74.7 Å²	74.7	81%	0.813	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-29.4	176.4	-66.5	-175.2	158.4	0	0	113.1
85	K	88.8	Confident	93.7	Very high	193 Å²	193	69.8 Å²	69.8	84%	0.839	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-33.8	178.6	-175.1	-177.9	175.6	-174.1	0	113.1	S83	S83-K85 PolarHBondContact O-N 3.48Å; S83-K85 PolarHBondContact OG-N 3.11Å
86	D	91.9	Very high	94.5	Very high	97 Å²	97	62.1 Å²	62.1	52%	0.519	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-21	-175.5	-55.5	-53.8	0	0	0	112.2	L82 S83	L82-D86 HydrophobicContact CB-CB 4.49Å; L82-D86 HydrophobicContact CD2-CB 4.39Å; S83-D86 PolarHBondContact O-N 3.24Å; S83-D86 PolarHBondContact OG-N 2.67Å; S83-D86 PolarHBondContact OG-OD2 3.42Å
87	R	94.9	Very high	94.9	Very high	63 Å²	63	60.5 Å²	60.5	24%	0.238	30%	0.299	C	S	.	.			trans	-73.7	147.9	176.5	-161.9	163.5	69.8	-164.5	2.4	110.2	L82 S83 G111 E113	L82-R87 HydrophobicContact CB-CB 3.99Å; L82-R87 HydrophobicContact CB-CG 4.43Å; S83-R87 VanDerWaalsContact O-CB 3.32Å; S83-R87 WeakPolarHBondContact O-CB 3.3Å; S83-R87 PolarHBondContact O-N 3.44Å; R87-G111 VanDerWaalsContact CD-O 3.31Å; R87-G111 WeakPolarHBondContact CD-O 3.49Å; R87-G111 WeakPolarHBondContact CG-O 3.44Å; R87-E113 HydrophobicContact CG-CG 4.35Å; R87-E113 IonicContact CZ-OE1 3.46Å; R87-E113 IonicContact NE-OE1 3.3Å; R87-E113 PolarHBondContact NE-OE1 3.34Å; R87-E113 IonicContact NH2-OE1 3.52Å; R87-E113 PolarHBondContact NH2-OE1 3.34Å
88	K	98.2	Very high	95.3	Very high	65 Å²	65	60 Å²	60	28%	0.283	29%	0.292	S	S	.	.			trans	-128.1	149.1	177.6	-66.9	177.5	-177.2	163.6	0	108.7	I90 H112 E113 Q154 N313	K88-I90 HydrophobicContact CB-CD1 4.3Å; K88-I90 HydrophobicContact CB-CG1 4Å; K88-H112 PolarHBondContact N-ND1 2.86Å; K88-E113 PolarHBondContact O-N 2.93Å; K88-Q154 HydrophobicContact CD-CG 4.45Å; K88-N313 PolarHBondContact NZ-OD1 3.35Å
89	R	98.6	Very high	95.7	Very high	86 Å²	86	56.7 Å²	56.7	33%	0.325	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	115.9	169.8	-60.3	168.4	-61.8	165.4	8.3	108.4	E113 E151 V152 D153 Q154	R89-E113 HydrophobicContact CG-CB 4.39Å; R89-E151 VanDerWaalsContact NH1-CB 3.31Å; R89-E151 PolarHBondContact NH1-O 3Å; R89-V152 HydrophobicContact CB-CB 4.43Å; R89-V152 HydrophobicContact CB-CG1 4.35Å; R89-D153 IonicContact CZ-OD1 2.8Å; R89-D153 PolarHBondContact N-OD2 3.22Å; R89-D153 IonicContact NE-OD1 3.33Å; R89-D153 PolarHBondContact NE-OD1 3.23Å; R89-D153 IonicContact NE-OD2 3.92Å; R89-D153 PolarHBondContact NE-OD2 3.47Å; R89-D153 IonicContact NH2-OD1 3.02Å; R89-D153 PolarHBondContact NH2-OD1 3.08Å; R89-D153 PolarHBondContact O-N 2.76Å; R89-Q154 PolarHBondContact O-N 2.99Å
90	I	98.9	Very high	95.9	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	118.9	-169.6	-52.3	-179.9	0	0	0	109.9	K88 I92 L107 H112 E113 V114 T115 Q154 Y156	K88-I90 HydrophobicContact CB-CD1 4.3Å; K88-I90 HydrophobicContact CB-CG1 4Å; I90-I92 HydrophobicContact CG2-CG1 4.32Å; I90-L107 HydrophobicContact CD1-CD1 4.07Å; I90-L107 HydrophobicContact CD1-CD2 3.82Å; I90-L107 HydrophobicContact CD1-CG 4.36Å; I90-L107 HydrophobicContact CG2-CD1 3.89Å; I90-H112 HydrophobicContact CD1-CB 3.75Å; I90-H112 HydrophobicContact CG1-CB 4.37Å; I90-E113 PolarHBondContact N-O 3.16Å; I90-V114 WeakPolarHBondContact O-CA 3.42Å; I90-T115 PolarHBondContact O-N 2.74Å; I90-Q154 WeakPolarHBondContact CA-O 3.43Å; I90-Q154 HydrophobicContact CG1-CB 4.35Å; I90-Q154 HydrophobicContact CG2-CB 4.29Å; I90-Y156 HydrophobicContact CG2-CD2 3.54Å; I90-Y156 HydrophobicContact CG2-CE2 3.67Å
91	L	98.9	Very high	96.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	130.7	170.6	173.7	61.9	0	0	0	110.3	T93 T115 V117 L148 I150 V152 Q154 I155 Y156 M185 L188	L91-T93 HydrophobicContact CD2-CG2 4.24Å; L91-T93 HydrophobicContact CG-CG2 4.25Å; L91-T115 CarbonylContact C-O 3.5Å; L91-T115 WeakPolarHBondContact CA-O 3.2Å; L91-T115 HydrophobicContact CD1-CG2 4.31Å; L91-V117 HydrophobicContact CD1-CB 4.06Å; L91-V117 HydrophobicContact CD1-CG2 3.6Å; L91-L148 HydrophobicContact CD1-CD2 4.44Å; L91-L148 HydrophobicContact CD2-CD2 4.07Å; L91-I150 HydrophobicContact CB-CD1 4.32Å; L91-I150 HydrophobicContact CD1-CD1 3.9Å; L91-I150 HydrophobicContact CD2-CD1 4.05Å; L91-I150 HydrophobicContact CG-CD1 4.31Å; L91-V152 HydrophobicContact CB-CB 4.46Å; L91-V152 HydrophobicContact CB-CG1 4.12Å; L91-V152 HydrophobicContact CB-CG2 4.18Å; L91-Q154 PolarHBondContact N-O 3.38Å; L91-I155 HydrophobicContact CB-CG1 4.23Å; L91-I155 HydrophobicContact CD2-CD1 4.42Å; L91-I155 HydrophobicContact CD2-CG1 4.23Å; L91-I155 HydrophobicContact CD2-CG2 4.05Å; L91-I155 HydrophobicContact CG-CG2 4.32Å; L91-I155 CarbonylContact O-C 3.33Å; L91-I155 WeakPolarHBondContact O-CA 3.25Å; L91-Y156 PolarHBondContact O-N 3.47Å; L91-M185 HydrophobicContact CD2-SD 4.04Å; L91-L188 HydrophobicContact CD2-CD2 3.68Å
92	I	98.9	Very high	96.4	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	104.2	171.5	-48.9	172.7	0	0	0	109	I90 G95 L103 L107 V114 T115 V116 V117	I90-I92 HydrophobicContact CG2-CG1 4.32Å; I92-G95 PolarHBondContact O-N 3.02Å; I92-L103 HydrophobicContact CD1-CD2 4.36Å; I92-L103 HydrophobicContact CD1-CG 4.17Å; I92-L103 HydrophobicContact CG2-CD2 4.26Å; I92-L107 HydrophobicContact CD1-CD1 3.86Å; I92-L107 HydrophobicContact CG1-CD1 4.44Å; I92-V114 HydrophobicContact CD1-CG1 3.59Å; I92-V114 HydrophobicContact CG1-CG1 4.16Å; I92-T115 PolarHBondContact N-O 3.46Å; I92-V116 HydrophobicContact CB-CG2 4.5Å; I92-V116 WeakPolarHBondContact O-CA 3.31Å; I92-V117 PolarHBondContact O-N 3.49Å
93	T	98.9	Very high	96.6	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	136.5	170.4	69.4	0	0	0	0	109.6	L91 V117 V144 Y156 H157 L158 A159 M185	L91-T93 HydrophobicContact CD2-CG2 4.24Å; L91-T93 HydrophobicContact CG-CG2 4.25Å; T93-V117 CarbonylContact C-O 3.28Å; T93-V117 WeakPolarHBondContact CA-O 3.24Å; T93-V117 HydrophobicContact CG2-CB 4.42Å; T93-V117 HydrophobicContact CG2-CG1 4.49Å; T93-V144 HydrophobicContact CG2-CG1 3.81Å; T93-Y156 PolarHBondContact N-O 3.09Å; T93-H157 VanDerWaalsContact OG1-CA 3.3Å; T93-H157 WeakPolarHBondContact OG1-CA 3.34Å; T93-H157 PolarHBondContact OG1-ND1 2.99Å; T93-L158 CarbonylContact O-C 3.58Å; T93-L158 VanDerWaalsContact O-CA 3.32Å; T93-L158 WeakPolarHBondContact O-CA 3.32Å; T93-L158 VanDerWaalsContact O-CB 3.26Å; T93-L158 WeakPolarHBondContact O-CB 3.43Å; T93-L158 PolarHBondContact O-N 3.37Å; T93-L158 PolarHBondContact OG1-N 3.43Å; T93-A159 PolarHBondContact O-N 2.97Å; T93-A159 VanDerWaalsContact O-N 3.09Å; T93-A159 PolarHBondContact OG1-N 2.88Å; T93-M185 HydrophobicContact CG2-CG 4.12Å; T93-M185 HydrophobicContact CG2-SD 3.53Å; T93-M185 VanDerWaalsContact CG2-SD 3.53Å
94	G	98.5	Very high	97	Very high	11 Å²	11	37.6 Å²	37.6	11%	0.113	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	20.1	-170.6	0	0	0	0	0	113	A96 G97 V117 D118	G94-A96 PolarHBondContact O-N 3.4Å; G94-G97 PolarHBondContact O-N 2.97Å; G94-G97 VanDerWaalsContact O-N 3.09Å; G94-V117 PolarHBondContact N-O 3.03Å; G94-D118 VanDerWaalsContact C-OD2 3.22Å; G94-D118 VanDerWaalsContact CA-OD2 3.28Å; G94-D118 WeakPolarHBondContact CA-OD2 3.37Å
95	G	98.3	Very high	97.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-16.8	-175.6	0	0	0	0	0	114.4	I92 G97 G100 S101	I92-G95 PolarHBondContact O-N 3.02Å; G95-G97 VanDerWaalsContact C-N 3.32Å; G95-G100 CarbonylContact O-C 3.51Å; G95-S101 VanDerWaalsContact O-CA 3.23Å; G95-S101 WeakPolarHBondContact O-CA 3.4Å; G95-S101 PolarHBondContact O-N 3.33Å
96	A	98.3	Very high	98	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	3.9	173.5	0	0	0	0	0	112.9	G94 D118 F120 G123 R124 N127 V128	G94-A96 PolarHBondContact O-N 3.4Å; A96-D118 WeakPolarHBondContact CA-OD2 3.41Å; A96-D118 HydrophobicContact CB-CB 3.86Å; A96-D118 WeakPolarHBondContact CB-OD2 3.38Å; A96-D118 PolarHBondContact N-OD2 3.15Å; A96-F120 HydrophobicContact CB-CD1 4.14Å; A96-F120 HydrophobicContact CB-CE1 3.72Å; A96-G123 VanDerWaalsContact O-CA 3.31Å; A96-G123 WeakPolarHBondContact O-CA 3.3Å; A96-R124 PolarHBondContact O-N 2.91Å; A96-R124 VanDerWaalsContact O-N 3.08Å; A96-N127 PolarHBondContact O-ND2 2.99Å; A96-V128 HydrophobicContact CB-CG2 4.3Å
97	G	97.2	Very high	98.3	Very high	15 Å²	15	19.2 Å²	19.2	16%	0.155	9%	0.091	C	C	.	.	S	Bend	trans	-77.5	-176	171.2	0	0	0	0	0	113.5	G94 G95 S101	G94-G97 PolarHBondContact O-N 2.97Å; G94-G97 VanDerWaalsContact O-N 3.09Å; G95-G97 VanDerWaalsContact C-N 3.32Å; G97-S101 VanDerWaalsContact O-CB 3.24Å; G97-S101 WeakPolarHBondContact O-CB 3.38Å; G97-S101 PolarHBondContact O-N 3.2Å; G97-S101 VanDerWaalsContact O-N 3.09Å; G97-S101 PolarHBondContact O-OG 3.29Å
98	F	97.5	Very high	98.5	Very high	27 Å²	27	16.3 Å²	16.3	12%	0.118	8%	0.08	C	C	.	.	H	α-helix	trans	-57.2	-71.4	179.2	163.8	-136.2	0	0	0	111.8	G100 S101 H102 T260 F261 S263 R264 M265 V301	F98-G100 PolarHBondContact O-N 3.49Å; F98-S101 PolarHBondContact O-N 2.85Å; F98-S101 PolarHBondContact O-OG 3.48Å; F98-H102 AromaticContact CD2-CD2 3.99Å; F98-H102 AromaticContact CE2-CD2 3.95Å; F98-H102 AromaticContact CE2-NE2 3.96Å; F98-H102 PolarHBondContact O-CD2 3.36Å; F98-H102 VanDerWaalsContact O-CD2 3.22Å; F98-T260 HydrophobicContact CE1-CG2 4.16Å; F98-T260 HydrophobicContact CZ-CG2 4.25Å; F98-F261 VanDerWaalsContact CZ-C 3.44Å; F98-S263 WeakPolarHBondContact CD2-O 3.41Å; F98-S263 WeakPolarHBondContact CE2-O 3.36Å; F98-R264 HydrophobicContact CD2-CB 4.49Å; F98-M265 HydrophobicContact CD1-CG 3.67Å; F98-M265 HydrophobicContact CD2-CG 3.81Å; F98-M265 HydrophobicContact CE1-CG 3.59Å; F98-M265 HydrophobicContact CE1-SD 4.19Å; F98-M265 HydrophobicContact CE2-CG 3.75Å; F98-M265 HydrophobicContact CG-CG 3.79Å; F98-M265 HydrophobicContact CZ-CG 3.63Å; F98-M265 HydrophobicContact CZ-SD 4.2Å; F98-V301 HydrophobicContact CD2-CG2 4.47Å; F98-V301 HydrophobicContact CE1-CG2 4.49Å; F98-V301 HydrophobicContact CE2-CB 3.83Å; F98-V301 HydrophobicContact CE2-CG1 4.15Å; F98-V301 HydrophobicContact CE2-CG2 3.69Å; F98-V301 HydrophobicContact CZ-CB 3.66Å; F98-V301 HydrophobicContact CZ-CG1 4.38Å; F98-V301 HydrophobicContact CZ-CG2 3.7Å
99	V	98.5	Very high	98.5	Very high	26 Å²	26	17.5 Å²	17.5	16%	0.158	9%	0.088	C	C	.	.	H	α-helix	trans	-63.6	-42.1	-178.3	179.5	0	0	0	0	111.6	S101 H102 L103 L158 V301 L304 L308	V99-S101 VanDerWaalsContact C-N 3.28Å; V99-S101 PolarHBondContact O-N 2.94Å; V99-H102 PolarHBondContact O-N 3.01Å; V99-L103 PolarHBondContact O-N 2.82Å; V99-L158 HydrophobicContact CB-CD2 4.21Å; V99-L158 HydrophobicContact CG1-CD2 3.91Å; V99-V301 HydrophobicContact CG2-CG2 4.42Å; V99-L304 HydrophobicContact CB-CD2 4.41Å; V99-L304 HydrophobicContact CG1-CD2 3.65Å; V99-L304 HydrophobicContact CG1-CG 4.34Å; V99-L304 HydrophobicContact CG2-CD2 3.8Å; V99-L308 HydrophobicContact CG1-CD1 4.04Å
100	G	98.5	Very high	98.5	Very high	2 Å²	2	15.9 Å²	15.9	2%	0.021	9%	0.085	C	C	.	.	H	α-helix	trans	-58.9	-35.4	-177.6	0	0	0	0	0	113.9	G95 F98 L103 T104	G95-G100 CarbonylContact O-C 3.51Å; F98-G100 PolarHBondContact O-N 3.49Å; G100-L103 PolarHBondContact O-N 3.07Å; G100-T104 WeakPolarHBondContact O-CB 3.22Å; G100-T104 PolarHBondContact O-N 2.99Å; G100-T104 PolarHBondContact O-OG1 3.19Å
101	S	98.7	Very high	98.4	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-72.1	-36.2	178.8	65.6	0	0	0	0	112.8	G95 G97 F98 V99 T104 D105 N127 R264	G95-S101 VanDerWaalsContact O-CA 3.23Å; G95-S101 WeakPolarHBondContact O-CA 3.4Å; G95-S101 PolarHBondContact O-N 3.33Å; G97-S101 VanDerWaalsContact O-CB 3.24Å; G97-S101 WeakPolarHBondContact O-CB 3.38Å; G97-S101 PolarHBondContact O-N 3.2Å; G97-S101 VanDerWaalsContact O-N 3.09Å; G97-S101 PolarHBondContact O-OG 3.29Å; F98-S101 PolarHBondContact O-N 2.85Å; F98-S101 PolarHBondContact O-OG 3.48Å; V99-S101 VanDerWaalsContact C-N 3.28Å; V99-S101 PolarHBondContact O-N 2.94Å; S101-T104 WeakPolarHBondContact O-CB 2.84Å; S101-T104 PolarHBondContact O-N 3.4Å; S101-D105 VanDerWaalsContact O-CG 3.3Å; S101-D105 PolarHBondContact O-N 2.81Å; S101-N127 WeakPolarHBondContact CB-O 3.43Å; S101-R264 PolarHBondContact O-NH1 3.11Å; S101-R264 WeakPolarHBondContact OG-CD 3.36Å; S101-R264 PolarHBondContact OG-NH1 2.94Å
102	H	98.8	Very high	98.4	Very high	30 Å²	30	17.2 Å²	17.2	14%	0.139	9%	0.092	C	C	.	.	H	α-helix	trans	-70.1	-35.6	173.9	-70.3	-74.8	0	0	0	111.8	F98 V99 D105 K106 S263 V301 V305	F98-H102 AromaticContact CD2-CD2 3.99Å; F98-H102 AromaticContact CE2-CD2 3.95Å; F98-H102 AromaticContact CE2-NE2 3.96Å; F98-H102 PolarHBondContact O-CD2 3.36Å; F98-H102 VanDerWaalsContact O-CD2 3.22Å; V99-H102 PolarHBondContact O-N 3.01Å; H102-D105 PolarHBondContact O-N 2.7Å; H102-K106 PolarHBondContact O-N 2.7Å; H102-K106 VanDerWaalsContact O-N 3.1Å; H102-S263 PolarHBondContact CE1-OG 3.37Å; H102-S263 PolarHBondContact NE2-O 3.39Å; H102-V301 HydrophobicContact CB-CG2 4.08Å; H102-V305 HydrophobicContact CB-CG2 3.8Å
103	L	98.9	Very high	98.4	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-64.5	-42.6	172	179.1	63.3	0	0	0	111.4	I92 V99 G100 D105 K106 L107 Y156 L158 V305 V309	I92-L103 HydrophobicContact CD1-CD2 4.36Å; I92-L103 HydrophobicContact CD1-CG 4.17Å; I92-L103 HydrophobicContact CG2-CD2 4.26Å; V99-L103 PolarHBondContact O-N 2.82Å; G100-L103 PolarHBondContact O-N 3.07Å; L103-D105 VanDerWaalsContact C-N 3.35Å; L103-D105 PolarHBondContact O-N 2.74Å; L103-K106 PolarHBondContact O-N 3.46Å; L103-L107 HydrophobicContact CD1-CD1 3.84Å; L103-L107 HydrophobicContact CD1-CG 4.09Å; L103-L107 HydrophobicContact CG-CD1 3.87Å; L103-L107 HydrophobicContact CG-CG 4.48Å; L103-L107 WeakPolarHBondContact O-CG 3.1Å; L103-L107 PolarHBondContact O-N 2.78Å; L103-Y156 HydrophobicContact CD1-CE1 4.31Å; L103-Y156 HydrophobicContact CD2-CD1 3.61Å; L103-Y156 HydrophobicContact CD2-CD2 4.36Å; L103-Y156 HydrophobicContact CD2-CE1 4.21Å; L103-Y156 HydrophobicContact CD2-CG 3.68Å; L103-L158 HydrophobicContact CD2-CD1 4.35Å; L103-L158 HydrophobicContact CD2-CD2 4.3Å; L103-V305 HydrophobicContact CB-CG1 4.34Å; L103-V305 HydrophobicContact CB-CG2 4.37Å; L103-V305 HydrophobicContact CD1-CG1 3.95Å; L103-V309 HydrophobicContact CD1-CG2 3.75Å
104	T	98.8	Very high	98.4	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-55	-50.6	172.6	-58.5	0	0	0	0	110.6	G100 S101 K106 L107 M108 V114 V116 V128 F137	G100-T104 WeakPolarHBondContact O-CB 3.22Å; G100-T104 PolarHBondContact O-N 2.99Å; G100-T104 PolarHBondContact O-OG1 3.19Å; S101-T104 WeakPolarHBondContact O-CB 2.84Å; S101-T104 PolarHBondContact O-N 3.4Å; T104-K106 VanDerWaalsContact C-N 3.35Å; T104-K106 PolarHBondContact O-N 3.5Å; T104-L107 PolarHBondContact O-N 2.93Å; T104-M108 HydrophobicContact CG2-CG 4.13Å; T104-M108 WeakPolarHBondContact O-CB 3.43Å; T104-M108 VanDerWaalsContact O-CG 3.26Å; T104-M108 WeakPolarHBondContact O-CG 3.33Å; T104-M108 PolarHBondContact O-N 3.47Å; T104-V114 HydrophobicContact CG2-CG1 4.2Å; T104-V116 HydrophobicContact CG2-CG2 4.19Å; T104-V128 HydrophobicContact CG2-CG1 4.43Å; T104-F137 HydrophobicContact CG2-CD2 4.18Å; T104-F137 HydrophobicContact CG2-CE2 3.55Å; T104-F137 HydrophobicContact CG2-CZ 4.43Å
105	D	98.6	Very high	98.4	Very high	19 Å²	19	20.8 Å²	20.8	10%	0.102	11%	0.107	C	C	.	.	H	α-helix	trans	-56.5	-48.5	179.7	-68.6	-17.6	0	0	0	112	S101 H102 L103 L107 M108 M109 H130 W131 R264	S101-D105 VanDerWaalsContact O-CG 3.3Å; S101-D105 PolarHBondContact O-N 2.81Å; H102-D105 PolarHBondContact O-N 2.7Å; L103-D105 VanDerWaalsContact C-N 3.35Å; L103-D105 PolarHBondContact O-N 2.74Å; D105-L107 PolarHBondContact O-N 2.99Å; D105-M108 PolarHBondContact O-N 2.9Å; D105-M109 HydrophobicContact CB-CE 4.43Å; D105-M109 WeakPolarHBondContact O-CB 3.4Å; D105-M109 WeakPolarHBondContact O-CG 3.36Å; D105-M109 PolarHBondContact O-N 3.33Å; D105-H130 IonicContact OD1-CD2 2.78Å; D105-H130 IonicContact OD1-CE1 3.68Å; D105-H130 PolarHBondContact OD1-CE1 3.5Å; D105-H130 IonicContact OD1-NE2 3.16Å; D105-H130 PolarHBondContact OD1-NE2 3.47Å; D105-H130 IonicContact OD2-NE2 2.7Å; D105-W131 PolarHBondContact OD1-NE1 3.35Å; D105-R264 IonicContact OD1-NH1 2.67Å; D105-R264 IonicContact OD1-NH2 3.27Å; D105-R264 IonicContact OD2-CZ 3.58Å; D105-R264 IonicContact OD2-NH1 2.81Å; D105-R264 PolarHBondContact OD2-NH1 3.28Å; D105-R264 IonicContact OD2-NH2 3.37Å; D105-R264 PolarHBondContact OD2-NH2 2.93Å
106	K	98.5	Very high	98.4	Very high	57 Å²	57	20.8 Å²	20.8	25%	0.248	11%	0.107	C	C	.	.	H	α-helix	trans	-60.9	-47.8	179.7	175.4	142.2	177	49.3	0	111.9	H102 L103 T104 M109 D110 V305 N306	H102-K106 PolarHBondContact O-N 2.7Å; H102-K106 VanDerWaalsContact O-N 3.1Å; L103-K106 PolarHBondContact O-N 3.46Å; T104-K106 VanDerWaalsContact C-N 3.35Å; T104-K106 PolarHBondContact O-N 3.5Å; K106-M109 PolarHBondContact O-N 2.7Å; K106-D110 IonicContact NZ-OD1 3.37Å; K106-D110 PolarHBondContact NZ-OD1 2.82Å; K106-D110 IonicContact NZ-OD2 2.73Å; K106-D110 PolarHBondContact NZ-OD2 3.38Å; K106-D110 WeakPolarHBondContact O-CB 3.38Å; K106-D110 PolarHBondContact O-N 3.21Å; K106-V305 HydrophobicContact CB-CG1 3.85Å; K106-V305 HydrophobicContact CD-CG1 3.98Å; K106-V305 HydrophobicContact CG-CG1 4.3Å; K106-N306 VanDerWaalsContact CE-OD1 3.31Å; K106-N306 WeakPolarHBondContact CE-OD1 3.27Å
107	L	98.7	Very high	98.4	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.01	11%	0.107	C	C	.	.	H	α-helix	trans	-69.7	-34.5	-176.9	-66.8	172.4	0	0	0	112.7	I90 I92 L103 T104 D105 D110 G111 H112 V114 Y156 V309	I90-L107 HydrophobicContact CD1-CD1 4.07Å; I90-L107 HydrophobicContact CD1-CD2 3.82Å; I90-L107 HydrophobicContact CD1-CG 4.36Å; I90-L107 HydrophobicContact CG2-CD1 3.89Å; I92-L107 HydrophobicContact CD1-CD1 3.86Å; I92-L107 HydrophobicContact CG1-CD1 4.44Å; L103-L107 HydrophobicContact CD1-CD1 3.84Å; L103-L107 HydrophobicContact CD1-CG 4.09Å; L103-L107 HydrophobicContact CG-CD1 3.87Å; L103-L107 HydrophobicContact CG-CG 4.48Å; L103-L107 WeakPolarHBondContact O-CG 3.1Å; L103-L107 PolarHBondContact O-N 2.78Å; T104-L107 PolarHBondContact O-N 2.93Å; D105-L107 PolarHBondContact O-N 2.99Å; L107-D110 PolarHBondContact O-N 3.04Å; L107-G111 PolarHBondContact O-N 2.65Å; L107-H112 WeakPolarHBondContact O-CB 3.5Å; L107-H112 PolarHBondContact O-N 3.24Å; L107-H112 VanDerWaalsContact O-N 3.12Å; L107-V114 HydrophobicContact CB-CG2 3.83Å; L107-Y156 HydrophobicContact CD1-CD2 4.36Å; L107-Y156 HydrophobicContact CD1-CE2 4.04Å; L107-V309 HydrophobicContact CD2-CG2 4.19Å
108	M	98.4	Very high	98.5	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-64.5	-48.9	171.9	-75.2	-62.7	-63	0	0	111.3	V79 T104 D105 D110 G111 V114 W131 H134 N136 F137	V79-M108 WeakPolarHBondContact CB-O 3.34Å; V79-M108 VanDerWaalsContact CG1-O 3.25Å; V79-M108 WeakPolarHBondContact CG1-O 3.31Å; T104-M108 HydrophobicContact CG2-CG 4.13Å; T104-M108 WeakPolarHBondContact O-CB 3.43Å; T104-M108 VanDerWaalsContact O-CG 3.26Å; T104-M108 WeakPolarHBondContact O-CG 3.33Å; T104-M108 PolarHBondContact O-N 3.47Å; D105-M108 PolarHBondContact O-N 2.9Å; M108-D110 VanDerWaalsContact C-N 3.26Å; M108-D110 PolarHBondContact O-N 3.3Å; M108-G111 WeakPolarHBondContact O-CA 3.25Å; M108-G111 PolarHBondContact O-N 3.12Å; M108-V114 HydrophobicContact CG-CB 4.29Å; M108-V114 HydrophobicContact CG-CG2 4.05Å; M108-V114 HydrophobicContact SD-CB 3.75Å; M108-V114 HydrophobicContact SD-CG2 3.74Å; M108-W131 HydrophobicContact CB-CD2 4.02Å; M108-W131 HydrophobicContact CB-CE3 4.2Å; M108-W131 HydrophobicContact CB-CH2 3.71Å; M108-W131 HydrophobicContact CB-CZ2 3.52Å; M108-W131 HydrophobicContact CB-CZ3 4.05Å; M108-W131 HydrophobicContact CE-CD2 3.98Å; M108-W131 HydrophobicContact CE-CE3 3.57Å; M108-W131 HydrophobicContact CE-CG 4.43Å; M108-W131 HydrophobicContact CE-CZ3 4.01Å; M108-W131 HydrophobicContact CG-CD2 3.9Å; M108-W131 HydrophobicContact CG-CE3 4.32Å; M108-W131 HydrophobicContact CG-CG 4.17Å; M108-W131 HydrophobicContact CG-CZ2 4.25Å; M108-H134 HydrophobicContact CE-CB 4.21Å; M108-H134 WeakPolarHBondContact CE-ND1 3.33Å; M108-N136 HydrophobicContact CE-CB 4.28Å; M108-F137 HydrophobicContact CE-CB 3.73Å; M108-F137 HydrophobicContact CG-CD2 4.39Å; M108-F137 HydrophobicContact SD-CB 3.95Å; M108-F137 HydrophobicContact SD-CD2 3.96Å; M108-F137 HydrophobicContact SD-CG 4.42Å
109	M	97.9	Very high	98.5	Very high	90 Å²	90	21.7 Å²	21.7	44%	0.443	11%	0.11	S	C	.	.	H	α-helix	trans	-62.1	-34.3	177.5	-71.1	174.7	-172.5	0	0	112.3	P77 K80 D105 K106 G111 W131	P77-M109 HydrophobicContact CB-CE 4.48Å; K80-M109 WeakPolarHBondContact CB-O 3.28Å; K80-M109 PolarHBondContact N-O 3.41Å; D105-M109 HydrophobicContact CB-CE 4.43Å; D105-M109 WeakPolarHBondContact O-CB 3.4Å; D105-M109 WeakPolarHBondContact O-CG 3.36Å; D105-M109 PolarHBondContact O-N 3.33Å; K106-M109 PolarHBondContact O-N 2.7Å; M109-G111 PolarHBondContact O-N 3.14Å; M109-W131 HydrophobicContact CE-CZ2 4.35Å; M109-W131 HydrophobicContact CG-CH2 4.23Å; M109-W131 HydrophobicContact CG-CZ2 4.32Å
110	D	97.8	Very high	98.5	Very high	52 Å²	52	23.2 Å²	23.2	28%	0.278	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-11	175.6	-70.1	-19.7	0	0	0	112.8	L82 K106 L107 M108	L82-D110 VanDerWaalsContact CD1-O 3.27Å; L82-D110 WeakPolarHBondContact CD1-O 3.2Å; K106-D110 IonicContact NZ-OD1 3.37Å; K106-D110 PolarHBondContact NZ-OD1 2.82Å; K106-D110 IonicContact NZ-OD2 2.73Å; K106-D110 PolarHBondContact NZ-OD2 3.38Å; K106-D110 WeakPolarHBondContact O-CB 3.38Å; K106-D110 PolarHBondContact O-N 3.21Å; L107-D110 PolarHBondContact O-N 3.04Å; M108-D110 VanDerWaalsContact C-N 3.26Å; M108-D110 PolarHBondContact O-N 3.3Å
111	G	97.6	Very high	98.4	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.01	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.2	13.8	171.1	0	0	0	0	0	115.9	K80 R87 L107 M108 M109	K80-G111 WeakPolarHBondContact O-CA 3.37Å; R87-G111 VanDerWaalsContact CD-O 3.31Å; R87-G111 WeakPolarHBondContact CD-O 3.49Å; R87-G111 WeakPolarHBondContact CG-O 3.44Å; L107-G111 PolarHBondContact O-N 2.65Å; M108-G111 WeakPolarHBondContact O-CA 3.25Å; M108-G111 PolarHBondContact O-N 3.12Å; M109-G111 PolarHBondContact O-N 3.14Å
112	H	98.6	Very high	98.1	Very high	28 Å²	28	29.1 Å²	29.1	13%	0.13	14%	0.144	C	C	.	.			trans	-82.8	162.8	-177.9	-61.7	-53.5	0	0	0	113.3	K88 I90 L107 V114 N136	K88-H112 PolarHBondContact N-ND1 2.86Å; I90-H112 HydrophobicContact CD1-CB 3.75Å; I90-H112 HydrophobicContact CG1-CB 4.37Å; L107-H112 WeakPolarHBondContact O-CB 3.5Å; L107-H112 PolarHBondContact O-N 3.24Å; L107-H112 VanDerWaalsContact O-N 3.12Å; H112-V114 HydrophobicContact CB-CG2 4.43Å; H112-N136 WeakPolarHBondContact O-CB 3.44Å
113	E	98.6	Very high	97.9	Very high	64 Å²	64	27.9 Å²	27.9	30%	0.299	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	118.9	168.1	-70.8	172.2	-139.7	0	0	108.7	R87 K88 R89 I90 N136	R87-E113 HydrophobicContact CG-CG 4.35Å; R87-E113 IonicContact CZ-OE1 3.46Å; R87-E113 IonicContact NE-OE1 3.3Å; R87-E113 PolarHBondContact NE-OE1 3.34Å; R87-E113 IonicContact NH2-OE1 3.52Å; R87-E113 PolarHBondContact NH2-OE1 3.34Å; K88-E113 PolarHBondContact O-N 2.93Å; R89-E113 HydrophobicContact CG-CB 4.39Å; I90-E113 PolarHBondContact N-O 3.16Å; E113-N136 CarbonylContact C-O 3.48Å; E113-N136 WeakPolarHBondContact CA-O 3.47Å; E113-N136 HydrophobicContact CG-CB 4.37Å
114	V	98.8	Very high	97.7	Very high	1 Å²	1	32 Å²	32	1%	0.006	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	119.4	-172	-176.2	0	0	0	0	110.7	I90 I92 T104 L107 M108 H112 V116 N136 F137 E138	I90-V114 WeakPolarHBondContact O-CA 3.42Å; I92-V114 HydrophobicContact CD1-CG1 3.59Å; I92-V114 HydrophobicContact CG1-CG1 4.16Å; T104-V114 HydrophobicContact CG2-CG1 4.2Å; L107-V114 HydrophobicContact CB-CG2 3.83Å; M108-V114 HydrophobicContact CG-CB 4.29Å; M108-V114 HydrophobicContact CG-CG2 4.05Å; M108-V114 HydrophobicContact SD-CB 3.75Å; M108-V114 HydrophobicContact SD-CG2 3.74Å; H112-V114 HydrophobicContact CB-CG2 4.43Å; V114-V116 HydrophobicContact CG1-CG2 4.32Å; V114-N136 PolarHBondContact N-O 3.47Å; V114-F137 HydrophobicContact CB-CD2 4.34Å; V114-F137 HydrophobicContact CG1-CD2 4.5Å; V114-F137 WeakPolarHBondContact O-CA 3.14Å; V114-E138 PolarHBondContact O-N 2.88Å
115	T	98.9	Very high	97.6	Very high	21 Å²	21	37.8 Å²	37.8	13%	0.129	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	121.1	170.5	-55.8	0	0	0	0	109.2	I90 L91 I92 E138 I140 I150	I90-T115 PolarHBondContact O-N 2.74Å; L91-T115 CarbonylContact C-O 3.5Å; L91-T115 WeakPolarHBondContact CA-O 3.2Å; L91-T115 HydrophobicContact CD1-CG2 4.31Å; I92-T115 PolarHBondContact N-O 3.46Å; T115-E138 CarbonylContact C-O 3.58Å; T115-E138 WeakPolarHBondContact CA-O 3.45Å; T115-E138 HydrophobicContact CG2-CB 4.28Å; T115-I140 HydrophobicContact CG2-CD1 3.54Å; T115-I140 HydrophobicContact CG2-CG1 4Å; T115-I150 HydrophobicContact CG2-CD1 4.27Å
116	V	98.9	Very high	97.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	128.7	174.4	170.8	0	0	0	0	109.9	I92 T104 V114 D118 F137 E138 L139 I140	I92-V116 HydrophobicContact CB-CG2 4.5Å; I92-V116 WeakPolarHBondContact O-CA 3.31Å; T104-V116 HydrophobicContact CG2-CG2 4.19Å; V114-V116 HydrophobicContact CG1-CG2 4.32Å; V116-D118 HydrophobicContact CG1-CB 4.48Å; V116-F137 HydrophobicContact CB-CE2 4.34Å; V116-F137 HydrophobicContact CB-CZ 4.29Å; V116-F137 HydrophobicContact CG2-CE2 3.65Å; V116-F137 HydrophobicContact CG2-CZ 3.98Å; V116-E138 PolarHBondContact N-O 2.87Å; V116-L139 HydrophobicContact CB-CD1 3.89Å; V116-L139 HydrophobicContact CG1-CD1 3.58Å; V116-I140 PolarHBondContact O-N 3.47Å
117	V	98.9	Very high	97.4	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	122.1	170.7	162.5	0	0	0	0	109.2	L91 I92 T93 G94 I140 H142 V144 L148	L91-V117 HydrophobicContact CD1-CB 4.06Å; L91-V117 HydrophobicContact CD1-CG2 3.6Å; I92-V117 PolarHBondContact O-N 3.49Å; T93-V117 CarbonylContact C-O 3.28Å; T93-V117 WeakPolarHBondContact CA-O 3.24Å; T93-V117 HydrophobicContact CG2-CB 4.42Å; T93-V117 HydrophobicContact CG2-CG1 4.49Å; G94-V117 PolarHBondContact N-O 3.03Å; V117-I140 WeakPolarHBondContact CA-O 3.35Å; V117-I140 HydrophobicContact CG2-CB 4.05Å; V117-I140 HydrophobicContact CG2-CD1 4.39Å; V117-H142 HydrophobicContact CG1-CB 3.98Å; V117-V144 HydrophobicContact CG1-CG1 4.2Å; V117-L148 HydrophobicContact CG2-CD2 3.78Å
118	D	98.8	Very high	97.3	Very high	11 Å²	11	38.3 Å²	38.3	6%	0.059	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	143.1	179	-151.4	-63.4	0	0	0	110.9	G94 A96 V116 F120 I140 N141 H142	G94-D118 VanDerWaalsContact C-OD2 3.22Å; G94-D118 VanDerWaalsContact CA-OD2 3.28Å; G94-D118 WeakPolarHBondContact CA-OD2 3.37Å; A96-D118 WeakPolarHBondContact CA-OD2 3.41Å; A96-D118 HydrophobicContact CB-CB 3.86Å; A96-D118 WeakPolarHBondContact CB-OD2 3.38Å; A96-D118 PolarHBondContact N-OD2 3.15Å; V116-D118 HydrophobicContact CG1-CB 4.48Å; D118-F120 HydrophobicContact CB-CD1 4.48Å; D118-F120 HydrophobicContact CB-CE1 4.29Å; D118-F120 WeakPolarHBondContact OD1-CA 3.47Å; D118-F120 PolarHBondContact OD1-N 2.82Å; D118-I140 PolarHBondContact N-O 2.89Å; D118-I140 VanDerWaalsContact N-O 3.15Å; D118-N141 VanDerWaalsContact O-CA 3.32Å; D118-N141 WeakPolarHBondContact O-CA 3.46Å; D118-N141 PolarHBondContact O-OD1 3.05Å; D118-H142 CarbonylContact C-O 3.52Å; D118-H142 PolarHBondContact O-N 3.03Å; D118-H142 VanDerWaalsContact O-N 3.11Å
119	N	98	Very high	97.3	Very high	50 Å²	50	43.5 Å²	43.5	27%	0.267	21%	0.205	S	C	.	.			trans	-96.8	2.2	174.1	71.1	-3	0	0	0	112.7	F121 H142 D143 K173	N119-F121 PolarHBondContact O-N 3.11Å; N119-F121 VanDerWaalsContact O-N 3.16Å; N119-F121 WeakPolarHBondContact OD1-CB 3.47Å; N119-F121 PolarHBondContact OD1-N 3.19Å; N119-H142 PolarHBondContact N-O 3.46Å; N119-D143 HydrophobicContact CB-CB 4.06Å; N119-D143 PolarHBondContact ND2-OD2 3.25Å; N119-K173 PolarHBondContact ND2-NZ 3.38Å
120	F	97.8	Very high	97.2	Very high	58 Å²	58	42 Å²	42	25%	0.254	20%	0.196	S	C	.	.			trans	56.2	26.8	-177.7	-50.8	-72.9	0	0	0	114.6	A96 D118 T122 K125 L139 N141	A96-F120 HydrophobicContact CB-CD1 4.14Å; A96-F120 HydrophobicContact CB-CE1 3.72Å; D118-F120 HydrophobicContact CB-CD1 4.48Å; D118-F120 HydrophobicContact CB-CE1 4.29Å; D118-F120 WeakPolarHBondContact OD1-CA 3.47Å; D118-F120 PolarHBondContact OD1-N 2.82Å; F120-T122 VanDerWaalsContact C-N 3.34Å; F120-T122 PolarHBondContact O-N 2.79Å; F120-K125 HydrophobicContact CE1-CB 4.25Å; F120-L139 HydrophobicContact CZ-CD1 4.12Å; F120-L139 HydrophobicContact CZ-CD2 4.12Å; F120-L139 HydrophobicContact CZ-CG 4.35Å; F120-N141 HydrophobicContact CE2-CB 3.93Å
121	F	95.7	Very high	97.2	Very high	71 Å²	71	39.5 Å²	39.5	31%	0.311	18%	0.183	S	C	.	.	S	Bend	trans	-63.7	-41.3	177	179.7	-115	0	0	0	112	N119 P161 K173	N119-F121 PolarHBondContact O-N 3.11Å; N119-F121 VanDerWaalsContact O-N 3.16Å; N119-F121 WeakPolarHBondContact OD1-CB 3.47Å; N119-F121 PolarHBondContact OD1-N 3.19Å; F121-P161 HydrophobicContact CD1-CB 4.45Å; F121-P161 HydrophobicContact CD1-CG 3.94Å; F121-P161 HydrophobicContact CE1-CB 4.2Å; F121-P161 HydrophobicContact CE1-CG 3.85Å; F121-K173 HydrophobicContact CD2-CD 4.35Å; F121-K173 VanDerWaalsContact CD2-NZ 3.29Å; F121-K173 HydrophobicContact CE2-CD 4.25Å; F121-K173 HydrophobicContact CZ-CD 4.34Å
122	T	93.6	Very high	97.1	Very high	54 Å²	54	42.6 Å²	42.6	33%	0.331	20%	0.199	S	C	.	.	S	Bend	trans	-128.4	-21.7	172.6	56	0	0	0	0	113.1	F120 N166	F120-T122 VanDerWaalsContact C-N 3.34Å; F120-T122 PolarHBondContact O-N 2.79Å; T122-N166 HydrophobicContact CG2-CB 4.16Å
123	G	94.5	Very high	96.9	Very high	5 Å²	5	43.9 Å²	43.9	5%	0.052	22%	0.219	C	C	.	.			trans	-72.6	169.2	170.9	0	0	0	0	0	112.7	A96	A96-G123 VanDerWaalsContact O-CA 3.31Å; A96-G123 WeakPolarHBondContact O-CA 3.3Å
124	R	95.1	Very high	96.9	Very high	85 Å²	85	41.6 Å²	41.6	32%	0.321	21%	0.208	S	C	.	.			trans	-142.7	140.2	179.7	-61.7	179.7	-178.7	-180	-3.8	110.2	A96 R126 N127 H266	A96-R124 PolarHBondContact O-N 2.91Å; A96-R124 VanDerWaalsContact O-N 3.08Å; R124-R126 PolarHBondContact O-N 2.67Å; R124-N127 WeakPolarHBondContact O-CB 3.4Å; R124-N127 PolarHBondContact O-N 3.11Å; R124-H266 PolarHBondContact NH2-CD2 3.02Å; R124-H266 PolarHBondContact NH2-CE1 3.36Å; R124-H266 PolarHBondContact NH2-NE2 2.91Å
125	K	95.9	Very high	96.7	Very high	122 Å²	122	49.6 Å²	49.6	53%	0.53	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-54.2	-37.9	178.7	-171.3	175.9	-179.4	-179	0	113.2	F120 N127 V128 E129 I132 L139	F120-K125 HydrophobicContact CE1-CB 4.25Å; K125-N127 PolarHBondContact O-N 2.97Å; K125-V128 WeakPolarHBondContact O-CG2 3.48Å; K125-V128 PolarHBondContact O-N 3.02Å; K125-E129 PolarHBondContact O-N 2.81Å; K125-E129 VanDerWaalsContact O-N 3.13Å; K125-I132 HydrophobicContact CD-CD1 4.3Å; K125-I132 HydrophobicContact CG-CD1 4.07Å; K125-L139 HydrophobicContact CG-CD2 4.14Å
126	R	95.3	Very high	96.6	Very high	81 Å²	81	49.6 Å²	49.6	31%	0.306	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-54.6	-26.4	177.8	-166.3	-174.6	61.9	-179.7	-2.9	113.7	R124 V128 E129 Y389 E393	R124-R126 PolarHBondContact O-N 2.67Å; R126-V128 PolarHBondContact O-N 2.89Å; R126-E129 WeakPolarHBondContact CA-OE2 3.46Å; R126-E129 WeakPolarHBondContact CG-OE1 3.06Å; R126-Y389 PolarHBondContact NH2-OH 3.27Å; R126-E393 IonicContact CZ-OE1 3.06Å; R126-E393 IonicContact CZ-OE2 3.8Å; R126-E393 VanDerWaalsContact CZ-OE2 3.24Å; R126-E393 VanDerWaalsContact NH1-CD 3.28Å; R126-E393 IonicContact NH1-OE1 3.09Å; R126-E393 PolarHBondContact NH1-OE1 3.02Å; R126-E393 IonicContact NH1-OE2 2.77Å; R126-E393 PolarHBondContact NH1-OE2 2.83Å; R126-E393 IonicContact NH2-OE1 2.76Å; R126-E393 PolarHBondContact NH2-OE1 2.82Å; R126-E393 VanDerWaalsContact NH2-OE1 3.09Å; R126-E393 IonicContact NH2-OE2 3.12Å; R126-E393 PolarHBondContact NH2-OE2 3.45Å
127	N	97.3	Very high	96.6	Very high	9 Å²	9	50.5 Å²	50.5	5%	0.048	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-69.4	-18.7	-179.6	-68.4	-15.1	0	0	0	113.3	A96 S101 R124 K125 H130	A96-N127 PolarHBondContact O-ND2 2.99Å; S101-N127 WeakPolarHBondContact CB-O 3.43Å; R124-N127 WeakPolarHBondContact O-CB 3.4Å; R124-N127 PolarHBondContact O-N 3.11Å; K125-N127 PolarHBondContact O-N 2.97Å; N127-H130 PolarHBondContact O-CE1 2.87Å
128	V	97.9	Very high	96.6	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.4	9.7	-176.7	-63	0	0	0	0	112.6	A96 T104 K125 R126 H130 W131 F137 L139	A96-V128 HydrophobicContact CB-CG2 4.3Å; T104-V128 HydrophobicContact CG2-CG1 4.43Å; K125-V128 WeakPolarHBondContact O-CG2 3.48Å; K125-V128 PolarHBondContact O-N 3.02Å; R126-V128 PolarHBondContact O-N 2.89Å; V128-H130 VanDerWaalsContact C-N 3.26Å; V128-H130 PolarHBondContact O-N 2.82Å; V128-W131 PolarHBondContact O-N 2.74Å; V128-F137 HydrophobicContact CB-CZ 4Å; V128-F137 HydrophobicContact CG2-CZ 4.23Å; V128-L139 HydrophobicContact CG2-CD1 4.34Å; V128-L139 HydrophobicContact CG2-CD2 4.15Å
129	E	96.4	Very high	96.6	Very high	110 Å²	110	57.1 Å²	57.1	51%	0.514	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-66.3	-28.3	-170.8	71.1	-173.7	-177.9	0	0	113.6	K125 R126 W131 I132	K125-E129 PolarHBondContact O-N 2.81Å; K125-E129 VanDerWaalsContact O-N 3.13Å; R126-E129 WeakPolarHBondContact CA-OE2 3.46Å; R126-E129 WeakPolarHBondContact CG-OE1 3.06Å; E129-W131 PolarHBondContact O-N 3.18Å; E129-I132 HydrophobicContact CB-CD1 4.34Å; E129-I132 PolarHBondContact O-N 2.97Å; E129-I132 VanDerWaalsContact O-N 3.11Å
130	H	96.1	Very high	96.6	Very high	57 Å²	57	56.5 Å²	56.5	26%	0.264	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-67.5	-9.5	178.1	54.6	-78.5	0	0	0	114.1	Y76 D105 N127 V128	Y76-H130 WeakPolarHBondContact CD1-O 3.41Å; D105-H130 IonicContact OD1-CD2 2.78Å; D105-H130 IonicContact OD1-CE1 3.68Å; D105-H130 PolarHBondContact OD1-CE1 3.5Å; D105-H130 IonicContact OD1-NE2 3.16Å; D105-H130 PolarHBondContact OD1-NE2 3.47Å; D105-H130 IonicContact OD2-NE2 2.7Å; N127-H130 PolarHBondContact O-CE1 2.87Å; V128-H130 VanDerWaalsContact C-N 3.26Å; V128-H130 PolarHBondContact O-N 2.82Å
131	W	97.8	Very high	96.7	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-102	-10.6	173.1	-62.6	122.4	0	0	0	113.8	P77 V79 D105 M108 M109 V128 E129 G133 H134 F137	P77-W131 HydrophobicContact CB-CH2 3.58Å; P77-W131 HydrophobicContact CB-CZ2 4.22Å; P77-W131 HydrophobicContact CB-CZ3 4.02Å; P77-W131 HydrophobicContact CG-CE3 4.47Å; P77-W131 HydrophobicContact CG-CH2 3.69Å; P77-W131 HydrophobicContact CG-CZ2 4.02Å; P77-W131 HydrophobicContact CG-CZ3 3.93Å; V79-W131 HydrophobicContact CG1-CH2 3.91Å; V79-W131 HydrophobicContact CG1-CZ3 3.69Å; D105-W131 PolarHBondContact OD1-NE1 3.35Å; M108-W131 HydrophobicContact CB-CD2 4.02Å; M108-W131 HydrophobicContact CB-CE3 4.2Å; M108-W131 HydrophobicContact CB-CH2 3.71Å; M108-W131 HydrophobicContact CB-CZ2 3.52Å; M108-W131 HydrophobicContact CB-CZ3 4.05Å; M108-W131 HydrophobicContact CE-CD2 3.98Å; M108-W131 HydrophobicContact CE-CE3 3.57Å; M108-W131 HydrophobicContact CE-CG 4.43Å; M108-W131 HydrophobicContact CE-CZ3 4.01Å; M108-W131 HydrophobicContact CG-CD2 3.9Å; M108-W131 HydrophobicContact CG-CE3 4.32Å; M108-W131 HydrophobicContact CG-CG 4.17Å; M108-W131 HydrophobicContact CG-CZ2 4.25Å; M109-W131 HydrophobicContact CE-CZ2 4.35Å; M109-W131 HydrophobicContact CG-CH2 4.23Å; M109-W131 HydrophobicContact CG-CZ2 4.32Å; V128-W131 PolarHBondContact O-N 2.74Å; E129-W131 PolarHBondContact O-N 3.18Å; W131-G133 PolarHBondContact O-N 3.25Å; W131-G133 VanDerWaalsContact O-N 3.16Å; W131-H134 VanDerWaalsContact O-CB 3.22Å; W131-H134 WeakPolarHBondContact O-CB 3.49Å; W131-H134 PolarHBondContact O-N 3.21Å; W131-F137 HydrophobicContact CB-CB 4.05Å; W131-F137 HydrophobicContact CB-CD1 3.53Å; W131-F137 HydrophobicContact CB-CD2 3.85Å; W131-F137 HydrophobicContact CB-CE1 3.86Å; W131-F137 HydrophobicContact CB-CE2 4.17Å; W131-F137 HydrophobicContact CB-CG 3.52Å; W131-F137 HydrophobicContact CB-CZ 4.17Å; W131-F137 HydrophobicContact CG-CD2 4.45Å; W131-F137 VanDerWaalsContact O-CD1 3.3Å; W131-F137 WeakPolarHBondContact O-CD1 3.48Å
132	I	96.7	Very high	96.8	Very high	67 Å²	67	58 Å²	58	34%	0.344	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	119.7	-174	-64.4	177.3	0	0	0	110.3	K125 E129 F137 L139	K125-I132 HydrophobicContact CD-CD1 4.3Å; K125-I132 HydrophobicContact CG-CD1 4.07Å; E129-I132 HydrophobicContact CB-CD1 4.34Å; E129-I132 PolarHBondContact O-N 2.97Å; E129-I132 VanDerWaalsContact O-N 3.11Å; I132-F137 HydrophobicContact CG1-CE1 4.05Å; I132-L139 HydrophobicContact CD1-CD2 4.01Å
133	G	94.7	Very high	97	Very high	54 Å²	54	57.2 Å²	57.2	56%	0.557	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.8	-1.1	-177.1	0	0	0	0	0	114.3	Y76 W131	Y76-G133 WeakPolarHBondContact OH-CA 3.49Å; Y76-G133 PolarHBondContact OH-O 2.79Å; W131-G133 PolarHBondContact O-N 3.25Å; W131-G133 VanDerWaalsContact O-N 3.16Å
134	H	97	Very high	97.2	Very high	17 Å²	17	57.2 Å²	57.2	8%	0.079	28%	0.282	C	S	.	.			trans	-69.8	140.7	167.3	-171.4	-75.6	0	0	0	109.5	Y76 M108 W131 N136 F137	Y76-H134 HydrophobicContact CD1-CB 4.21Å; Y76-H134 HydrophobicContact CD2-CB 4.1Å; Y76-H134 AromaticContact CD2-CD2 3.58Å; Y76-H134 HydrophobicContact CE1-CB 4.35Å; Y76-H134 HydrophobicContact CE2-CB 4.21Å; Y76-H134 HydrophobicContact CG-CB 4.1Å; Y76-H134 AromaticContact CG-CD2 3.72Å; M108-H134 HydrophobicContact CE-CB 4.21Å; M108-H134 WeakPolarHBondContact CE-ND1 3.33Å; W131-H134 VanDerWaalsContact O-CB 3.22Å; W131-H134 WeakPolarHBondContact O-CB 3.49Å; W131-H134 PolarHBondContact O-N 3.21Å; H134-N136 VanDerWaalsContact C-N 3.26Å; H134-N136 PolarHBondContact ND1-N 3.36Å; H134-N136 VanDerWaalsContact ND1-N 3.14Å; H134-N136 PolarHBondContact O-N 3.27Å; H134-F137 HydrophobicContact CB-CB 4.18Å; H134-F137 PolarHBondContact O-N 3.32Å
135	E	95.1	Very high	97.4	Very high	169 Å²	169	54.7 Å²	54.7	79%	0.79	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-36.2	-175.1	55.9	179.3	-174.9	0	0	113.9
136	N	97.1	Very high	97.5	Very high	20 Å²	20	54.2 Å²	54.2	11%	0.107	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	8.3	-179.8	-61.8	-24.3	0	0	0	114.4	M108 H112 E113 V114 H134	M108-N136 HydrophobicContact CE-CB 4.28Å; H112-N136 WeakPolarHBondContact O-CB 3.44Å; E113-N136 CarbonylContact C-O 3.48Å; E113-N136 WeakPolarHBondContact CA-O 3.47Å; E113-N136 HydrophobicContact CG-CB 4.37Å; V114-N136 PolarHBondContact N-O 3.47Å; H134-N136 VanDerWaalsContact C-N 3.26Å; H134-N136 PolarHBondContact ND1-N 3.36Å; H134-N136 VanDerWaalsContact ND1-N 3.14Å; H134-N136 PolarHBondContact O-N 3.27Å
137	F	98.6	Very high	97.7	Very high	19 Å²	19	53.5 Å²	53.5	8%	0.083	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	130.4	-175	-174.9	-103.6	0	0	0	113.4	T104 M108 V114 V116 V128 W131 I132 H134 L139	T104-F137 HydrophobicContact CG2-CD2 4.18Å; T104-F137 HydrophobicContact CG2-CE2 3.55Å; T104-F137 HydrophobicContact CG2-CZ 4.43Å; M108-F137 HydrophobicContact CE-CB 3.73Å; M108-F137 HydrophobicContact CG-CD2 4.39Å; M108-F137 HydrophobicContact SD-CB 3.95Å; M108-F137 HydrophobicContact SD-CD2 3.96Å; M108-F137 HydrophobicContact SD-CG 4.42Å; V114-F137 HydrophobicContact CB-CD2 4.34Å; V114-F137 HydrophobicContact CG1-CD2 4.5Å; V114-F137 WeakPolarHBondContact O-CA 3.14Å; V116-F137 HydrophobicContact CB-CE2 4.34Å; V116-F137 HydrophobicContact CB-CZ 4.29Å; V116-F137 HydrophobicContact CG2-CE2 3.65Å; V116-F137 HydrophobicContact CG2-CZ 3.98Å; V128-F137 HydrophobicContact CB-CZ 4Å; V128-F137 HydrophobicContact CG2-CZ 4.23Å; W131-F137 HydrophobicContact CB-CB 4.05Å; W131-F137 HydrophobicContact CB-CD1 3.53Å; W131-F137 HydrophobicContact CB-CD2 3.85Å; W131-F137 HydrophobicContact CB-CE1 3.86Å; W131-F137 HydrophobicContact CB-CE2 4.17Å; W131-F137 HydrophobicContact CB-CG 3.52Å; W131-F137 HydrophobicContact CB-CZ 4.17Å; W131-F137 HydrophobicContact CG-CD2 4.45Å; W131-F137 VanDerWaalsContact O-CD1 3.3Å; W131-F137 WeakPolarHBondContact O-CD1 3.48Å; I132-F137 HydrophobicContact CG1-CE1 4.05Å; H134-F137 HydrophobicContact CB-CB 4.18Å; H134-F137 PolarHBondContact O-N 3.32Å; F137-L139 HydrophobicContact CE1-CB 3.97Å; F137-L139 HydrophobicContact CZ-CB 4.3Å
138	E	98.8	Very high	97.7	Very high	105 Å²	105	54 Å²	54	49%	0.491	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	138	172.7	-171	178.8	-161.9	0	0	111.3	V114 T115 V116 I140	V114-E138 PolarHBondContact O-N 2.88Å; T115-E138 CarbonylContact C-O 3.58Å; T115-E138 WeakPolarHBondContact CA-O 3.45Å; T115-E138 HydrophobicContact CG2-CB 4.28Å; V116-E138 PolarHBondContact N-O 2.87Å; E138-I140 HydrophobicContact CG-CG1 4.06Å
139	L	98.8	Very high	97.8	Very high	47 Å²	47	62.2 Å²	62.2	25%	0.246	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	115.9	174.7	176.6	62.9	0	0	0	110.1	V116 F120 K125 V128 I132 F137	V116-L139 HydrophobicContact CB-CD1 3.89Å; V116-L139 HydrophobicContact CG1-CD1 3.58Å; F120-L139 HydrophobicContact CZ-CD1 4.12Å; F120-L139 HydrophobicContact CZ-CD2 4.12Å; F120-L139 HydrophobicContact CZ-CG 4.35Å; K125-L139 HydrophobicContact CG-CD2 4.14Å; V128-L139 HydrophobicContact CG2-CD1 4.34Å; V128-L139 HydrophobicContact CG2-CD2 4.15Å; I132-L139 HydrophobicContact CD1-CD2 4.01Å; F137-L139 HydrophobicContact CE1-CB 3.97Å; F137-L139 HydrophobicContact CZ-CB 4.3Å
140	I	98.7	Very high	97.9	Very high	36 Å²	36	58.6 Å²	58.6	19%	0.185	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	119.9	-179.9	-51.7	179.1	0	0	0	109	T115 V116 V117 D118 E138 H142	T115-I140 HydrophobicContact CG2-CD1 3.54Å; T115-I140 HydrophobicContact CG2-CG1 4Å; V116-I140 PolarHBondContact O-N 3.47Å; V117-I140 WeakPolarHBondContact CA-O 3.35Å; V117-I140 HydrophobicContact CG2-CB 4.05Å; V117-I140 HydrophobicContact CG2-CD1 4.39Å; D118-I140 PolarHBondContact N-O 2.89Å; D118-I140 VanDerWaalsContact N-O 3.15Å; E138-I140 HydrophobicContact CG-CG1 4.06Å; I140-H142 HydrophobicContact CG2-CB 3.87Å; I140-H142 PolarHBondContact O-N 2.83Å
141	N	98.8	Very high	98	Very high	119 Å²	119	61.2 Å²	61.2	64%	0.636	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	98.8	170.3	-173.4	-7.6	0	0	0	109.4	D118 F120	D118-N141 VanDerWaalsContact O-CA 3.32Å; D118-N141 WeakPolarHBondContact O-CA 3.46Å; D118-N141 PolarHBondContact O-OD1 3.05Å; F120-N141 HydrophobicContact CE2-CB 3.93Å
142	H	98.7	Very high	98	Very high	42 Å²	42	61.4 Å²	61.4	19%	0.194	31%	0.314	C	S	.	.			trans	-151.1	140.8	-173.4	-176.1	90.1	0	0	0	111.1	V117 D118 N119 I140 E146 P147	V117-H142 HydrophobicContact CG1-CB 3.98Å; D118-H142 CarbonylContact C-O 3.52Å; D118-H142 PolarHBondContact O-N 3.03Å; D118-H142 VanDerWaalsContact O-N 3.11Å; N119-H142 PolarHBondContact N-O 3.46Å; I140-H142 HydrophobicContact CG2-CB 3.87Å; I140-H142 PolarHBondContact O-N 2.83Å; H142-E146 PolarHBondContact NE2-O 3.4Å; H142-P147 PolarHBondContact CE1-O 2.92Å
143	D	98.7	Very high	98.1	Very high	38 Å²	38	61 Å²	61	20%	0.203	31%	0.312	C	S	.	.			trans	-94.4	126	174	-161.6	-39.5	0	0	0	109.6	N119 V145 E146	N119-D143 HydrophobicContact CB-CB 4.06Å; N119-D143 PolarHBondContact ND2-OD2 3.25Å; D143-V145 HydrophobicContact CB-CG2 4.16Å; D143-V145 PolarHBondContact O-N 3.12Å; D143-V145 WeakPolarHBondContact OD1-CG2 3.44Å; D143-V145 PolarHBondContact OD1-N 3.15Å; D143-E146 WeakPolarHBondContact O-CB 3.37Å; D143-E146 PolarHBondContact O-N 3.22Å
144	V	98.7	Very high	98.3	Very high	5 Å²	5	59 Å²	59	3%	0.03	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-17.4	-176	-66.5	0	0	0	0	113.9	T93 V117 E146 A159 T177 G181 N184	T93-V144 HydrophobicContact CG2-CG1 3.81Å; V117-V144 HydrophobicContact CG1-CG1 4.2Å; V144-E146 PolarHBondContact O-N 3.48Å; V144-A159 HydrophobicContact CG1-CB 3.83Å; V144-A159 HydrophobicContact CG2-CB 3.98Å; V144-T177 HydrophobicContact CG2-CG2 4.01Å; V144-G181 WeakPolarHBondContact O-CA 3.34Å; V144-N184 PolarHBondContact O-ND2 2.9Å
145	V	98.7	Very high	98.4	Very high	31 Å²	31	58.2 Å²	58.2	19%	0.188	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-21.3	172.4	-56.3	0	0	0	0	112.6	D143 K176 I180 N184	D143-V145 HydrophobicContact CB-CG2 4.16Å; D143-V145 PolarHBondContact O-N 3.12Å; D143-V145 WeakPolarHBondContact OD1-CG2 3.44Å; D143-V145 PolarHBondContact OD1-N 3.15Å; V145-K176 HydrophobicContact CG1-CB 4.24Å; V145-I180 HydrophobicContact CB-CG2 4.36Å; V145-N184 PolarHBondContact O-ND2 3.02Å
146	E	98.7	Very high	98.6	Very high	113 Å²	113	50.1 Å²	50.1	53%	0.528	25%	0.247	S	C	.	.	S	Bend	trans	-91.1	141.2	172.6	-57.7	-57.6	150.5	0	0	110.3	H142 D143 V144	H142-E146 PolarHBondContact NE2-O 3.4Å; D143-E146 WeakPolarHBondContact O-CB 3.37Å; D143-E146 PolarHBondContact O-N 3.22Å; V144-E146 PolarHBondContact O-N 3.48Å
147	P	98.4	Very high	98.7	Very high	66 Å²	66	49.3 Å²	49.3	43%	0.429	24%	0.243	S	C	.	.			trans	-56.5	145.1	177.3	-27.1	36.1	0	0	0	113.4	H142 Y149	H142-P147 PolarHBondContact CE1-O 2.92Å; P147-Y149 HydrophobicContact CB-CE2 3.69Å
148	L	98.4	Very high	98.7	Very high	20 Å²	20	49.5 Å²	49.5	11%	0.105	24%	0.244	C	C	.	.			trans	-129.5	136.3	178.4	-174.9	67.3	0	0	0	110.8	L91 V117 I150 M185 L188	L91-L148 HydrophobicContact CD1-CD2 4.44Å; L91-L148 HydrophobicContact CD2-CD2 4.07Å; V117-L148 HydrophobicContact CG2-CD2 3.78Å; L148-I150 HydrophobicContact CD1-CG2 4.3Å; L148-I150 HydrophobicContact CD2-CD1 4.2Å; L148-I150 HydrophobicContact CD2-CG1 4.35Å; L148-I150 HydrophobicContact CG-CG1 4.43Å; L148-I150 HydrophobicContact CG-CG2 4.37Å; L148-M185 HydrophobicContact CB-CE 4.05Å; L148-M185 HydrophobicContact CD2-CE 4.4Å; L148-L188 HydrophobicContact CD2-CD2 4.37Å
149	Y	98.4	Very high	98.7	Very high	172 Å²	172	45.2 Å²	45.2	68%	0.675	23%	0.227	S	C	*	.			trans	-127.4	90.3	-176.6	-61.1	-97.3	0	0	0	110.8	P147 R191	P147-Y149 HydrophobicContact CB-CE2 3.69Å; Y149-R191 VanDerWaalsContact CE1-NH1 3.35Å
150	I	98.4	Very high	98.6	Very high	34 Å²	34	43.9 Å²	43.9	17%	0.174	22%	0.221	C	C	.	.			trans	-136.7	160.2	175.3	64.7	171.1	0	0	0	110.1	L91 T115 L148 V152 L188 R191	L91-I150 HydrophobicContact CB-CD1 4.32Å; L91-I150 HydrophobicContact CD1-CD1 3.9Å; L91-I150 HydrophobicContact CD2-CD1 4.05Å; L91-I150 HydrophobicContact CG-CD1 4.31Å; T115-I150 HydrophobicContact CG2-CD1 4.27Å; L148-I150 HydrophobicContact CD1-CG2 4.3Å; L148-I150 HydrophobicContact CD2-CD1 4.2Å; L148-I150 HydrophobicContact CD2-CG1 4.35Å; L148-I150 HydrophobicContact CG-CG1 4.43Å; L148-I150 HydrophobicContact CG-CG2 4.37Å; I150-V152 HydrophobicContact CD1-CG1 3.73Å; I150-V152 HydrophobicContact CG1-CG1 4.04Å; I150-L188 HydrophobicContact CG1-CD2 4.28Å; I150-L188 WeakPolarHBondContact O-CD1 3.49Å; I150-R191 PolarHBondContact O-NH2 2.78Å
151	E	98.4	Very high	98.4	Very high	112 Å²	112	42.5 Å²	42.5	52%	0.523	22%	0.215	S	C	.	.			trans	-101.1	115.4	178.4	-67.9	-63.9	145.8	0	0	110.3	R89	R89-E151 VanDerWaalsContact NH1-CB 3.31Å; R89-E151 PolarHBondContact NH1-O 3Å
152	V	98.7	Very high	97.9	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.018	21%	0.206	C	C	.	.			trans	-144.9	156.6	-175.5	-66.7	0	0	0	0	111.5	R89 L91 I150 I155 V192 A194	R89-V152 HydrophobicContact CB-CB 4.43Å; R89-V152 HydrophobicContact CB-CG1 4.35Å; L91-V152 HydrophobicContact CB-CB 4.46Å; L91-V152 HydrophobicContact CB-CG1 4.12Å; L91-V152 HydrophobicContact CB-CG2 4.18Å; I150-V152 HydrophobicContact CD1-CG1 3.73Å; I150-V152 HydrophobicContact CG1-CG1 4.04Å; V152-I155 HydrophobicContact CG2-CD1 4.22Å; V152-I155 HydrophobicContact CG2-CG1 3.84Å; V152-V192 HydrophobicContact CG2-CG2 4.34Å; V152-V192 WeakPolarHBondContact O-CG2 3.37Å; V152-A194 HydrophobicContact CG2-CB 4.27Å; V152-A194 WeakPolarHBondContact O-CB 3.41Å
153	D	98.8	Very high	97.4	Very high	60 Å²	60	37.5 Å²	37.5	32%	0.321	20%	0.197	S	C	.	.	S	Bend	trans	-97.8	-30.1	-179	-46.4	-52.4	0	0	0	111.5	R89 A194 R195	R89-D153 IonicContact CZ-OD1 2.8Å; R89-D153 PolarHBondContact N-OD2 3.22Å; R89-D153 IonicContact NE-OD1 3.33Å; R89-D153 PolarHBondContact NE-OD1 3.23Å; R89-D153 IonicContact NE-OD2 3.92Å; R89-D153 PolarHBondContact NE-OD2 3.47Å; R89-D153 IonicContact NH2-OD1 3.02Å; R89-D153 PolarHBondContact NH2-OD1 3.08Å; R89-D153 PolarHBondContact O-N 2.76Å; D153-A194 WeakPolarHBondContact O-CA 3.47Å; D153-R195 PolarHBondContact O-N 2.86Å
154	Q	98.9	Very high	96.9	Very high	11 Å²	11	37.1 Å²	37.1	5%	0.051	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	142.8	179.9	-65.3	-173.5	-15.6	0	0	111.8	K88 R89 I90 L91 R195 M312 N313	K88-Q154 HydrophobicContact CD-CG 4.45Å; R89-Q154 PolarHBondContact O-N 2.99Å; I90-Q154 WeakPolarHBondContact CA-O 3.43Å; I90-Q154 HydrophobicContact CG1-CB 4.35Å; I90-Q154 HydrophobicContact CG2-CB 4.29Å; L91-Q154 PolarHBondContact N-O 3.38Å; Q154-R195 CarbonylContact C-O 3.44Å; Q154-R195 WeakPolarHBondContact CA-O 3.06Å; Q154-M312 HydrophobicContact CB-CE 4.18Å; Q154-M312 HydrophobicContact CB-SD 4.35Å; Q154-M312 HydrophobicContact CG-CG 4.34Å; Q154-M312 HydrophobicContact CG-SD 4.23Å; Q154-N313 PolarHBondContact NE2-OD1 3.38Å
155	I	98.9	Very high	96.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	114.9	176.5	-55.8	175.7	0	0	0	109.3	L91 V152 L188 A189 A194 R195 L196 L197 M312	L91-I155 HydrophobicContact CB-CG1 4.23Å; L91-I155 HydrophobicContact CD2-CD1 4.42Å; L91-I155 HydrophobicContact CD2-CG1 4.23Å; L91-I155 HydrophobicContact CD2-CG2 4.05Å; L91-I155 HydrophobicContact CG-CG2 4.32Å; L91-I155 CarbonylContact O-C 3.33Å; L91-I155 WeakPolarHBondContact O-CA 3.25Å; V152-I155 HydrophobicContact CG2-CD1 4.22Å; V152-I155 HydrophobicContact CG2-CG1 3.84Å; I155-L188 HydrophobicContact CD1-CB 4.42Å; I155-L188 HydrophobicContact CD1-CD2 3.92Å; I155-L188 HydrophobicContact CD1-CG 3.92Å; I155-A189 HydrophobicContact CD1-CB 4.02Å; I155-A194 HydrophobicContact CD1-CB 4Å; I155-A194 HydrophobicContact CG1-CB 3.97Å; I155-R195 PolarHBondContact N-O 3.26Å; I155-L196 HydrophobicContact CB-CB 4.4Å; I155-L196 HydrophobicContact CB-CD1 4.35Å; I155-L196 HydrophobicContact CB-CG 4.24Å; I155-L196 HydrophobicContact CG2-CD1 4.13Å; I155-L196 HydrophobicContact CG2-CG 4.29Å; I155-L196 CarbonylContact O-C 3.36Å; I155-L196 WeakPolarHBondContact O-CA 3.03Å; I155-L197 PolarHBondContact O-N 2.91Å; I155-M312 WeakPolarHBondContact O-CE 3.45Å
156	Y	98.9	Very high	95.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	105.9	166.5	-69.3	-97.8	0	0	0	109	I90 L91 T93 L103 L107 L158 L197 L308 M312	I90-Y156 HydrophobicContact CG2-CD2 3.54Å; I90-Y156 HydrophobicContact CG2-CE2 3.67Å; L91-Y156 PolarHBondContact O-N 3.47Å; T93-Y156 PolarHBondContact N-O 3.09Å; L103-Y156 HydrophobicContact CD1-CE1 4.31Å; L103-Y156 HydrophobicContact CD2-CD1 3.61Å; L103-Y156 HydrophobicContact CD2-CD2 4.36Å; L103-Y156 HydrophobicContact CD2-CE1 4.21Å; L103-Y156 HydrophobicContact CD2-CG 3.68Å; L107-Y156 HydrophobicContact CD1-CD2 4.36Å; L107-Y156 HydrophobicContact CD1-CE2 4.04Å; Y156-L158 PolarHBondContact O-N 2.99Å; Y156-L197 HydrophobicContact CD1-CB 4.27Å; Y156-L197 HydrophobicContact CD1-CD1 4.38Å; Y156-L197 HydrophobicContact CD1-CD2 4.27Å; Y156-L197 HydrophobicContact CE1-CD1 4.21Å; Y156-L308 HydrophobicContact CE1-CB 4.39Å; Y156-M312 HydrophobicContact CD1-CE 3.94Å; Y156-M312 HydrophobicContact CD2-CE 3.73Å; Y156-M312 HydrophobicContact CE1-CB 3.75Å; Y156-M312 HydrophobicContact CE1-CE 3.86Å; Y156-M312 HydrophobicContact CE1-CG 4.14Å; Y156-M312 HydrophobicContact CE2-CB 4.49Å; Y156-M312 HydrophobicContact CE2-CE 3.64Å; Y156-M312 HydrophobicContact CE2-CG 4.03Å; Y156-M312 HydrophobicContact CG-CE 3.89Å; Y156-M312 WeakPolarHBondContact OH-CB 3.49Å; Y156-M312 VanDerWaalsContact OH-CG 3.28Å; Y156-M312 WeakPolarHBondContact OH-CG 3.47Å
157	H	98.9	Very high	95.5	Very high	3 Å²	3	35.4 Å²	35.4	1%	0.014	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	86.7	-176.2	-170.5	37.8	0	0	0	111.7	T93 T182 L196 L197 A199	T93-H157 VanDerWaalsContact OG1-CA 3.3Å; T93-H157 WeakPolarHBondContact OG1-CA 3.34Å; T93-H157 PolarHBondContact OG1-ND1 2.99Å; H157-T182 WeakPolarHBondContact NE2-CA 3.26Å; H157-T182 PolarHBondContact NE2-OG1 3.5Å; H157-L196 HydrophobicContact CB-CD2 4.34Å; H157-L196 HydrophobicContact CB-CG 4.49Å; H157-L197 PolarHBondContact N-O 2.94Å; H157-A199 WeakPolarHBondContact O-CB 3.25Å; H157-A199 PolarHBondContact O-N 3.11Å; H157-A199 VanDerWaalsContact O-N 3.09Å
158	L	98.9	Very high	95.1	Very high	23 Å²	23	36 Å²	36	12%	0.12	19%	0.192	C	C	.	.			trans	-106	-6.1	-179.3	-75.9	65.1	0	0	0	113.5	T93 V99 L103 Y156 S160 A199	T93-L158 CarbonylContact O-C 3.58Å; T93-L158 VanDerWaalsContact O-CA 3.32Å; T93-L158 WeakPolarHBondContact O-CA 3.32Å; T93-L158 VanDerWaalsContact O-CB 3.26Å; T93-L158 WeakPolarHBondContact O-CB 3.43Å; T93-L158 PolarHBondContact O-N 3.37Å; T93-L158 PolarHBondContact OG1-N 3.43Å; V99-L158 HydrophobicContact CB-CD2 4.21Å; V99-L158 HydrophobicContact CG1-CD2 3.91Å; L103-L158 HydrophobicContact CD2-CD1 4.35Å; L103-L158 HydrophobicContact CD2-CD2 4.3Å; Y156-L158 PolarHBondContact O-N 2.99Å; L158-S160 PolarHBondContact O-N 3.06Å; L158-A199 HydrophobicContact CB-CB 4.37Å; L158-A199 HydrophobicContact CD1-CB 4.08Å; L158-A199 HydrophobicContact CG-CB 3.78Å
159	A	98.4	Very high	94.9	Very high	14 Å²	14	44 Å²	44	12%	0.116	22%	0.222	C	C	.	.			trans	-64.4	102.1	-176.9	0	0	0	0	0	112.3	T93 V144 T177	T93-A159 PolarHBondContact O-N 2.97Å; T93-A159 VanDerWaalsContact O-N 3.09Å; T93-A159 PolarHBondContact OG1-N 2.88Å; V144-A159 HydrophobicContact CG1-CB 3.83Å; V144-A159 HydrophobicContact CG2-CB 3.98Å; A159-T177 WeakPolarHBondContact O-CG2 3.47Å
160	S	97.7	Very high	94.8	Very high	20 Å²	20	38.7 Å²	38.7	14%	0.14	21%	0.205	C	C	.	.	S	Bend	trans	-169.3	141.2	172.5	-165.6	0	0	0	0	109.9	L158 A162 N178	L158-S160 PolarHBondContact O-N 3.06Å; S160-A162 PolarHBondContact O-N 3.12Å; S160-N178 WeakPolarHBondContact CB-OD1 3.32Å; S160-N178 VanDerWaalsContact OG-CG 3.27Å; S160-N178 PolarHBondContact OG-ND2 3.24Å; S160-N178 PolarHBondContact OG-OD1 3.31Å
161	P	93.9	Very high	94.7	Very high	6 Å²	6	39.7 Å²	39.7	4%	0.039	21%	0.214	C	C	.	.			trans	-61.8	126.6	166.4	-14.5	28.5	0	0	0	109.6	F121 Y230	F121-P161 HydrophobicContact CD1-CB 4.45Å; F121-P161 HydrophobicContact CD1-CG 3.94Å; F121-P161 HydrophobicContact CE1-CB 4.2Å; F121-P161 HydrophobicContact CE1-CG 3.85Å; P161-Y230 WeakPolarHBondContact O-CD2 3.33Å; P161-Y230 VanDerWaalsContact O-CE2 3.22Å; P161-Y230 WeakPolarHBondContact O-CE2 3.46Å
162	A	88.8	Confident	94.7	Very high	56 Å²	56	39.8 Å²	39.8	46%	0.463	22%	0.216	S	C	.	.			trans	-109.8	-23.8	-167.3	0	0	0	0	0	115.3	S160	S160-A162 PolarHBondContact O-N 3.12Å
163	S	88.1	Confident	94.7	Very high	1 Å²	1	42 Å²	42	1%	0.007	23%	0.226	C	C	.	.	S	Bend	trans	-95.4	144.3	-179.1	80.1	0	0	0	0	112.1	N166 Y167 D269	S163-N166 PolarHBondContact O-N 2.63Å; S163-N166 PolarHBondContact OG-ND2 3.39Å; S163-Y167 WeakPolarHBondContact O-CD1 3.48Å; S163-Y167 PolarHBondContact O-N 3.1Å; S163-D269 WeakPolarHBondContact CB-O 3.46Å; S163-D269 WeakPolarHBondContact CB-OD1 3.38Å; S163-D269 PolarHBondContact OG-O 3.09Å
164	P	87.3	Confident	94.6	Very high	30 Å²	30	39.2 Å²	39.2	20%	0.195	21%	0.211	C	C	.	.	H	α-helix	trans	-51.8	-47.8	-175.6	-23.9	30.9	0	0	0	115.4	N166 Y167 M168	P164-N166 PolarHBondContact O-N 3.02Å; P164-Y167 HydrophobicContact CB-CE1 3.98Å; P164-Y167 HydrophobicContact CB-CE2 4.4Å; P164-Y167 WeakPolarHBondContact CB-OH 3.37Å; P164-Y167 HydrophobicContact CG-CE1 3.92Å; P164-Y167 WeakPolarHBondContact CG-OH 3.45Å; P164-M168 HydrophobicContact CB-CE 3.78Å; P164-M168 VanDerWaalsContact O-CB 3.25Å; P164-M168 WeakPolarHBondContact O-CB 3.41Å; P164-M168 VanDerWaalsContact O-CE 3.3Å; P164-M168 WeakPolarHBondContact O-CE 3.35Å; P164-M168 VanDerWaalsContact O-CG 3.22Å; P164-M168 WeakPolarHBondContact O-CG 3.39Å; P164-M168 PolarHBondContact O-N 3.35Å
165	P	87.5	Confident	94.6	Very high	67 Å²	67	42.2 Å²	42.2	44%	0.435	23%	0.227	S	C	.	.	H	α-helix	trans	-58	-37.5	177.4	-24.5	35.4	0	0	0	112.7	Y169	P165-Y169 VanDerWaalsContact O-CB 3.25Å; P165-Y169 WeakPolarHBondContact O-CB 3.14Å; P165-Y169 PolarHBondContact O-N 3.49Å; P165-Y169 VanDerWaalsContact O-N 3.14Å
166	N	88.8	Confident	94.6	Very high	44 Å²	44	47.6 Å²	47.6	24%	0.235	25%	0.25	C	S	.	.	H	α-helix	trans	-78.9	-42	-175.1	-71.6	-37.7	0	0	0	113.2	T122 S163 P164	T122-N166 HydrophobicContact CG2-CB 4.16Å; S163-N166 PolarHBondContact O-N 2.63Å; S163-N166 PolarHBondContact OG-ND2 3.39Å; P164-N166 PolarHBondContact O-N 3.02Å
167	Y	90.3	Very high	94.6	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.008	25%	0.252	C	S	.	.	H	α-helix	trans	-76.5	-29.9	179.5	66.7	-119.3	0	0	0	112.5	S163 P164 T174 R227 Y230	S163-Y167 WeakPolarHBondContact O-CD1 3.48Å; S163-Y167 PolarHBondContact O-N 3.1Å; P164-Y167 HydrophobicContact CB-CE1 3.98Å; P164-Y167 HydrophobicContact CB-CE2 4.4Å; P164-Y167 WeakPolarHBondContact CB-OH 3.37Å; P164-Y167 HydrophobicContact CG-CE1 3.92Å; P164-Y167 WeakPolarHBondContact CG-OH 3.45Å; Y167-T174 WeakPolarHBondContact CA-OG1 3.33Å; Y167-T174 PolarHBondContact O-OG1 3.01Å; Y167-R227 HydrophobicContact CE2-CB 4.34Å; Y167-R227 HydrophobicContact CE2-CG 4.39Å; Y167-R227 VanDerWaalsContact OH-CZ 3.29Å; Y167-R227 PolarHBondContact OH-NE 3.27Å; Y167-R227 VanDerWaalsContact OH-NE 3.15Å; Y167-R227 PolarHBondContact OH-NH2 2.97Å; Y167-Y230 HydrophobicContact CD1-CD1 4.41Å; Y167-Y230 AromaticContact CD1-CD2 3.89Å; Y167-Y230 HydrophobicContact CD1-CD2 3.89Å; Y167-Y230 HydrophobicContact CD1-CE2 4.46Å; Y167-Y230 AromaticContact CD1-CG 3.86Å; Y167-Y230 HydrophobicContact CD1-CG 3.86Å; Y167-Y230 HydrophobicContact CD2-CG 4.37Å; Y167-Y230 HydrophobicContact CE1-CD1 4.13Å; Y167-Y230 HydrophobicContact CE1-CD2 4.41Å; Y167-Y230 HydrophobicContact CE1-CG 4.01Å; Y167-Y230 HydrophobicContact CG-CD2 4.14Å; Y167-Y230 HydrophobicContact CG-CG 4.07Å
168	M	91.4	Very high	94.6	Very high	78 Å²	78	47.8 Å²	47.8	38%	0.384	25%	0.252	S	S	.	.	H	α-helix	trans	-77.6	-23.4	174.9	-64.2	-171.5	-64.6	0	0	112.5	P164 N170 P226 R227	P164-M168 HydrophobicContact CB-CE 3.78Å; P164-M168 VanDerWaalsContact O-CB 3.25Å; P164-M168 WeakPolarHBondContact O-CB 3.41Å; P164-M168 VanDerWaalsContact O-CE 3.3Å; P164-M168 WeakPolarHBondContact O-CE 3.35Å; P164-M168 VanDerWaalsContact O-CG 3.22Å; P164-M168 WeakPolarHBondContact O-CG 3.39Å; P164-M168 PolarHBondContact O-N 3.35Å; M168-N170 VanDerWaalsContact C-N 3.27Å; M168-N170 PolarHBondContact O-N 2.89Å; M168-P226 HydrophobicContact SD-CB 4.46Å; M168-R227 HydrophobicContact SD-CG 4.17Å
169	Y	93.3	Very high	94.6	Very high	189 Å²	189	48.4 Å²	48.4	74%	0.741	26%	0.256	S	S	*	.	H	α-helix	trans	-59.8	-37.3	176.8	175.3	-102.6	0	0	0	112.7	P165	P165-Y169 VanDerWaalsContact O-CB 3.25Å; P165-Y169 WeakPolarHBondContact O-CB 3.14Å; P165-Y169 PolarHBondContact O-N 3.49Å; P165-Y169 VanDerWaalsContact O-N 3.14Å
170	N	95.8	Very high	94.6	Very high	59 Å²	59	51 Å²	51	32%	0.316	27%	0.268	S	S	.	.			trans	-139.4	81.9	176.7	-168.4	-23.6	0	0	0	111.1	M168 I172 K173 T174	M168-N170 VanDerWaalsContact C-N 3.27Å; M168-N170 PolarHBondContact O-N 2.89Å; N170-I172 VanDerWaalsContact C-N 3.27Å; N170-I172 PolarHBondContact O-N 2.79Å; N170-K173 HydrophobicContact CB-CB 4.06Å; N170-K173 VanDerWaalsContact CG-CB 3.48Å; N170-K173 PolarHBondContact O-N 2.85Å; N170-K173 VanDerWaalsContact O-N 3.16Å; N170-K173 WeakPolarHBondContact OD1-CB 3.46Å; N170-K173 PolarHBondContact OD1-N 3.49Å; N170-T174 PolarHBondContact O-N 2.72Å; N170-T174 PolarHBondContact O-OG1 3Å
171	P	97.1	Very high	94.7	Very high	56 Å²	56	50 Å²	50	36%	0.364	26%	0.261	S	S	.	.	H	α-helix	trans	-63.8	-32.6	-173.6	25	-34.1	0	0	0	112.5	T174 L175 C229	P171-T174 PolarHBondContact O-N 3.44Å; P171-L175 WeakPolarHBondContact O-CB 3.44Å; P171-L175 WeakPolarHBondContact O-CG 3.37Å; P171-L175 PolarHBondContact O-N 2.82Å; P171-C229 HydrophobicContact CB-CB 3.55Å
172	I	98.3	Very high	94.9	Very high	113 Å²	113	49.8 Å²	49.8	58%	0.579	26%	0.259	S	S	*	.	H	α-helix	trans	-65.8	-43.8	177.3	-61.7	175.4	0	0	0	110.6	N170 L175 K176	N170-I172 VanDerWaalsContact C-N 3.27Å; N170-I172 PolarHBondContact O-N 2.79Å; I172-L175 PolarHBondContact O-N 3.06Å; I172-K176 HydrophobicContact CG2-CD 4.48Å; I172-K176 WeakPolarHBondContact O-CG 3.43Å; I172-K176 PolarHBondContact O-N 3.16Å
173	K	97.8	Very high	95.4	Very high	51 Å²	51	50.3 Å²	50.3	22%	0.222	25%	0.254	C	S	.	.	H	α-helix	trans	-63.9	-45.5	176.5	-173	173.4	-177.9	179	0	110.6	N119 F121 N170 L175 K176 T177	N119-K173 PolarHBondContact ND2-NZ 3.38Å; F121-K173 HydrophobicContact CD2-CD 4.35Å; F121-K173 VanDerWaalsContact CD2-NZ 3.29Å; F121-K173 HydrophobicContact CE2-CD 4.25Å; F121-K173 HydrophobicContact CZ-CD 4.34Å; N170-K173 HydrophobicContact CB-CB 4.06Å; N170-K173 VanDerWaalsContact CG-CB 3.48Å; N170-K173 PolarHBondContact O-N 2.85Å; N170-K173 VanDerWaalsContact O-N 3.16Å; N170-K173 WeakPolarHBondContact OD1-CB 3.46Å; N170-K173 PolarHBondContact OD1-N 3.49Å; K173-L175 VanDerWaalsContact C-N 3.33Å; K173-L175 PolarHBondContact O-N 2.99Å; K173-K176 PolarHBondContact O-N 2.76Å; K173-T177 WeakPolarHBondContact O-CB 3.42Å; K173-T177 PolarHBondContact O-N 3.49Å; K173-T177 PolarHBondContact O-OG1 3.28Å; K173-T177 VanDerWaalsContact O-OG1 3.13Å
174	T	98.4	Very high	95.9	Very high	1 Å²	1	52 Å²	52	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-54.7	-48	175.6	-56.9	0	0	0	0	111.6	Y167 N170 P171 T177 N178 C229 Y230	Y167-T174 WeakPolarHBondContact CA-OG1 3.33Å; Y167-T174 PolarHBondContact O-OG1 3.01Å; N170-T174 PolarHBondContact O-N 2.72Å; N170-T174 PolarHBondContact O-OG1 3Å; P171-T174 PolarHBondContact O-N 3.44Å; T174-T177 PolarHBondContact O-N 2.75Å; T174-N178 PolarHBondContact O-N 3.11Å; T174-N178 VanDerWaalsContact O-N 3.12Å; T174-N178 PolarHBondContact O-ND2 3.07Å; T174-C229 WeakPolarHBondContact CG2-O 3.5Å; T174-Y230 HydrophobicContact CG2-CD2 4.28Å
175	L	98.7	Very high	96.5	Very high	73 Å²	73	50.6 Å²	50.6	38%	0.382	25%	0.254	S	S	.	.	H	α-helix	trans	-61.2	-49.3	177.6	-78.7	166.9	0	0	0	112.2	P171 I172 K173 T177 N178 T179 C229	P171-L175 WeakPolarHBondContact O-CB 3.44Å; P171-L175 WeakPolarHBondContact O-CG 3.37Å; P171-L175 PolarHBondContact O-N 2.82Å; I172-L175 PolarHBondContact O-N 3.06Å; K173-L175 VanDerWaalsContact C-N 3.33Å; K173-L175 PolarHBondContact O-N 2.99Å; L175-T177 PolarHBondContact O-N 2.93Å; L175-N178 PolarHBondContact O-N 3.36Å; L175-T179 WeakPolarHBondContact O-CB 3.43Å; L175-T179 WeakPolarHBondContact O-CG2 3.16Å; L175-T179 PolarHBondContact O-N 3.4Å; L175-T179 PolarHBondContact O-OG1 2.96Å; L175-C229 HydrophobicContact CD1-CB 4.32Å; L175-C229 HydrophobicContact CG-CB 3.99Å
176	K	98.8	Very high	97	Very high	113 Å²	113	47.4 Å²	47.4	49%	0.491	23%	0.233	S	C	.	.	H	α-helix	trans	-60.6	-44	179.4	-74.7	-174.1	174.8	-170.8	0	112.3	V145 I172 K173 T179 I180 G181	V145-K176 HydrophobicContact CG1-CB 4.24Å; I172-K176 HydrophobicContact CG2-CD 4.48Å; I172-K176 WeakPolarHBondContact O-CG 3.43Å; I172-K176 PolarHBondContact O-N 3.16Å; K173-K176 PolarHBondContact O-N 2.76Å; K176-T179 PolarHBondContact O-N 2.92Å; K176-T179 PolarHBondContact O-OG1 3.03Å; K176-I180 HydrophobicContact CB-CD1 4.32Å; K176-I180 HydrophobicContact CD-CD1 4.47Å; K176-I180 HydrophobicContact CG-CD1 4.1Å; K176-I180 WeakPolarHBondContact O-CB 3.45Å; K176-I180 PolarHBondContact O-N 3.02Å; K176-G181 PolarHBondContact O-N 2.67Å
177	T	98.7	Very high	97.5	Very high	7 Å²	7	46.6 Å²	46.6	4%	0.043	24%	0.236	C	C	.	.	H	α-helix	trans	-61.6	-44.8	178.8	-63.9	0	0	0	0	111.6	V144 A159 K173 T174 L175 G181	V144-T177 HydrophobicContact CG2-CG2 4.01Å; A159-T177 WeakPolarHBondContact O-CG2 3.47Å; K173-T177 WeakPolarHBondContact O-CB 3.42Å; K173-T177 PolarHBondContact O-N 3.49Å; K173-T177 PolarHBondContact O-OG1 3.28Å; K173-T177 VanDerWaalsContact O-OG1 3.13Å; T174-T177 PolarHBondContact O-N 2.75Å; L175-T177 PolarHBondContact O-N 2.93Å; T177-G181 VanDerWaalsContact O-CA 3.26Å; T177-G181 WeakPolarHBondContact O-CA 3.43Å; T177-G181 PolarHBondContact O-N 2.97Å
178	N	98.8	Very high	97.9	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-79.4	-14.3	-179.4	-66.9	-71.5	0	0	0	113.9	S160 T174 L175 T182 K234	S160-N178 WeakPolarHBondContact CB-OD1 3.32Å; S160-N178 VanDerWaalsContact OG-CG 3.27Å; S160-N178 PolarHBondContact OG-ND2 3.24Å; S160-N178 PolarHBondContact OG-OD1 3.31Å; T174-N178 PolarHBondContact O-N 3.11Å; T174-N178 VanDerWaalsContact O-N 3.12Å; T174-N178 PolarHBondContact O-ND2 3.07Å; L175-N178 PolarHBondContact O-N 3.36Å; N178-T182 PolarHBondContact O-OG1 3.33Å; N178-T182 VanDerWaalsContact O-OG1 3.09Å; N178-K234 WeakPolarHBondContact OD1-CD 3.41Å; N178-K234 WeakPolarHBondContact OD1-CE 3.47Å; N178-K234 PolarHBondContact OD1-NZ 2.73Å
179	T	98.8	Very high	98.3	Very high	35 Å²	35	43 Å²	43	22%	0.215	22%	0.218	C	C	.	.	H	α-helix	trans	-103.2	-73	177.7	52.1	0	0	0	0	111.5	L175 K176 G181 T182 L183 V236 M240	L175-T179 WeakPolarHBondContact O-CB 3.43Å; L175-T179 WeakPolarHBondContact O-CG2 3.16Å; L175-T179 PolarHBondContact O-N 3.4Å; L175-T179 PolarHBondContact O-OG1 2.96Å; K176-T179 PolarHBondContact O-N 2.92Å; K176-T179 PolarHBondContact O-OG1 3.03Å; T179-G181 VanDerWaalsContact C-N 3.3Å; T179-G181 PolarHBondContact O-N 3.3Å; T179-T182 PolarHBondContact O-N 2.96Å; T179-L183 WeakPolarHBondContact O-CG 3.42Å; T179-L183 PolarHBondContact O-N 2.94Å; T179-V236 HydrophobicContact CG2-CG1 3.7Å; T179-M240 HydrophobicContact CG2-CE 4.2Å
180	I	98.9	Very high	98.5	Very high	68 Å²	68	38.6 Å²	38.6	35%	0.349	20%	0.203	S	C	.	.	H	α-helix	trans	-60.1	-42.5	-179.5	-56.2	175	0	0	0	110.3	V145 K176 T182 L183 N184	V145-I180 HydrophobicContact CB-CG2 4.36Å; K176-I180 HydrophobicContact CB-CD1 4.32Å; K176-I180 HydrophobicContact CD-CD1 4.47Å; K176-I180 HydrophobicContact CG-CD1 4.1Å; K176-I180 WeakPolarHBondContact O-CB 3.45Å; K176-I180 PolarHBondContact O-N 3.02Å; I180-T182 VanDerWaalsContact C-N 3.35Å; I180-T182 PolarHBondContact O-N 3.43Å; I180-L183 PolarHBondContact O-N 3.05Å; I180-N184 PolarHBondContact O-N 3.45Å
181	G	98.9	Very high	98.7	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.6	-42.7	178.1	0	0	0	0	0	113.1	V144 K176 T177 T179 N184 M185	V144-G181 WeakPolarHBondContact O-CA 3.34Å; K176-G181 PolarHBondContact O-N 2.67Å; T177-G181 VanDerWaalsContact O-CA 3.26Å; T177-G181 WeakPolarHBondContact O-CA 3.43Å; T177-G181 PolarHBondContact O-N 2.97Å; T179-G181 VanDerWaalsContact C-N 3.3Å; T179-G181 PolarHBondContact O-N 3.3Å; G181-N184 PolarHBondContact O-N 3.13Å; G181-M185 WeakPolarHBondContact O-CG 3.34Å; G181-M185 PolarHBondContact O-N 3.42Å; G181-M185 VanDerWaalsContact O-N 3.12Å
182	T	98.9	Very high	98.7	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.006	20%	0.199	C	C	.	.	H	α-helix	trans	-68	-39.9	176.1	-60.9	0	0	0	0	112	H157 N178 T179 I180 N184 M185 L186 A237 M240	H157-T182 WeakPolarHBondContact NE2-CA 3.26Å; H157-T182 PolarHBondContact NE2-OG1 3.5Å; N178-T182 PolarHBondContact O-OG1 3.33Å; N178-T182 VanDerWaalsContact O-OG1 3.09Å; T179-T182 PolarHBondContact O-N 2.96Å; I180-T182 VanDerWaalsContact C-N 3.35Å; I180-T182 PolarHBondContact O-N 3.43Å; T182-N184 PolarHBondContact O-N 3.47Å; T182-M185 PolarHBondContact O-N 2.93Å; T182-L186 HydrophobicContact CG2-CD1 3.8Å; T182-L186 HydrophobicContact CG2-CG 4.34Å; T182-L186 WeakPolarHBondContact O-CB 3.48Å; T182-L186 WeakPolarHBondContact O-CG 3.47Å; T182-L186 PolarHBondContact O-N 2.92Å; T182-A237 HydrophobicContact CG2-CB 4.1Å; T182-M240 HydrophobicContact CG2-CB 4.37Å; T182-M240 HydrophobicContact CG2-SD 4.27Å
183	L	98.9	Very high	98.7	Very high	67 Å²	67	37.6 Å²	37.6	35%	0.351	20%	0.204	S	C	.	.	H	α-helix	trans	-59.6	-43.7	174	-71.8	173.9	0	0	0	112.3	T179 I180 L186 G187 M240 Y244	T179-L183 WeakPolarHBondContact O-CG 3.42Å; T179-L183 PolarHBondContact O-N 2.94Å; I180-L183 PolarHBondContact O-N 3.05Å; L183-L186 PolarHBondContact O-N 3.42Å; L183-G187 PolarHBondContact O-N 2.99Å; L183-M240 HydrophobicContact CD1-CE 4.24Å; L183-M240 HydrophobicContact CD2-CE 4.25Å; L183-M240 HydrophobicContact CD2-CG 4.18Å; L183-M240 HydrophobicContact CD2-SD 3.84Å; L183-M240 HydrophobicContact CG-CE 4.05Å; L183-M240 HydrophobicContact CG-SD 3.81Å; L183-Y244 HydrophobicContact CD2-CE2 4.02Å
184	N	98.9	Very high	98.8	Very high	37 Å²	37	35.2 Å²	35.2	20%	0.198	20%	0.195	C	C	.	.	H	α-helix	trans	-63	-43.5	177.7	-74.1	-19.2	0	0	0	111.8	V144 V145 I180 G181 T182 G187 L188	V144-N184 PolarHBondContact O-ND2 2.9Å; V145-N184 PolarHBondContact O-ND2 3.02Å; I180-N184 PolarHBondContact O-N 3.45Å; G181-N184 PolarHBondContact O-N 3.13Å; T182-N184 PolarHBondContact O-N 3.47Å; N184-G187 PolarHBondContact O-N 2.99Å; N184-L188 WeakPolarHBondContact O-CB 3.49Å; N184-L188 PolarHBondContact O-N 3.5Å
185	M	98.9	Very high	98.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-70.7	-35	179.8	-65.3	-58	97.2	0	0	112.7	L91 T93 L148 G181 T182 L188 A189 L196	L91-M185 HydrophobicContact CD2-SD 4.04Å; T93-M185 HydrophobicContact CG2-CG 4.12Å; T93-M185 HydrophobicContact CG2-SD 3.53Å; T93-M185 VanDerWaalsContact CG2-SD 3.53Å; L148-M185 HydrophobicContact CB-CE 4.05Å; L148-M185 HydrophobicContact CD2-CE 4.4Å; G181-M185 WeakPolarHBondContact O-CG 3.34Å; G181-M185 PolarHBondContact O-N 3.42Å; G181-M185 VanDerWaalsContact O-N 3.12Å; T182-M185 PolarHBondContact O-N 2.93Å; M185-L188 HydrophobicContact CE-CD2 4.37Å; M185-L188 PolarHBondContact O-N 3.27Å; M185-L188 HydrophobicContact SD-CD2 4.29Å; M185-A189 WeakPolarHBondContact O-CB 3.41Å; M185-A189 PolarHBondContact O-N 2.87Å; M185-L196 HydrophobicContact CB-CD1 3.78Å
186	L	98.9	Very high	98.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-68.1	-38.3	171.4	-73.5	167.2	0	0	0	111.8	T182 L183 A189 K190 L196 M240 Y244 V252	T182-L186 HydrophobicContact CG2-CD1 3.8Å; T182-L186 HydrophobicContact CG2-CG 4.34Å; T182-L186 WeakPolarHBondContact O-CB 3.48Å; T182-L186 WeakPolarHBondContact O-CG 3.47Å; T182-L186 PolarHBondContact O-N 2.92Å; L183-L186 PolarHBondContact O-N 3.42Å; L186-A189 PolarHBondContact O-N 2.83Å; L186-K190 WeakPolarHBondContact O-CB 3.22Å; L186-K190 PolarHBondContact O-N 3.47Å; L186-L196 HydrophobicContact CD2-CD1 4.12Å; L186-L196 HydrophobicContact CD2-CD2 4.25Å; L186-L196 HydrophobicContact CG-CD1 4.34Å; L186-M240 HydrophobicContact CD1-CB 3.74Å; L186-Y244 HydrophobicContact CB-CD1 3.88Å; L186-Y244 HydrophobicContact CB-CD2 3.97Å; L186-Y244 HydrophobicContact CB-CE1 3.9Å; L186-Y244 HydrophobicContact CB-CE2 4Å; L186-Y244 HydrophobicContact CB-CG 3.89Å; L186-Y244 HydrophobicContact CD1-CD2 3.73Å; L186-Y244 HydrophobicContact CD1-CE2 4.11Å; L186-Y244 HydrophobicContact CD1-CG 4.19Å; L186-Y244 HydrophobicContact CD2-CG 4.35Å; L186-Y244 HydrophobicContact CG-CD2 4.35Å; L186-Y244 HydrophobicContact CG-CG 4.38Å; L186-V252 HydrophobicContact CD2-CG1 4.11Å
187	G	98.8	Very high	98.8	Very high	28 Å²	28	28.3 Å²	28.3	29%	0.289	16%	0.16	S	C	.	.	H	α-helix	trans	-62.1	-41.5	172.5	0	0	0	0	0	112.5	L183 N184 R191	L183-G187 PolarHBondContact O-N 2.99Å; N184-G187 PolarHBondContact O-N 2.99Å; G187-R191 WeakPolarHBondContact O-CB 3.31Å; G187-R191 PolarHBondContact O-N 3.26Å; G187-R191 VanDerWaalsContact O-N 3.08Å
188	L	98.9	Very high	98.9	Very high	2 Å²	2	28 Å²	28	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-60.9	-51.7	171.8	174.5	60.3	0	0	0	111	L91 L148 I150 I155 N184 M185 K190 R191 V192	L91-L188 HydrophobicContact CD2-CD2 3.68Å; L148-L188 HydrophobicContact CD2-CD2 4.37Å; I150-L188 HydrophobicContact CG1-CD2 4.28Å; I150-L188 WeakPolarHBondContact O-CD1 3.49Å; I155-L188 HydrophobicContact CD1-CB 4.42Å; I155-L188 HydrophobicContact CD1-CD2 3.92Å; I155-L188 HydrophobicContact CD1-CG 3.92Å; N184-L188 WeakPolarHBondContact O-CB 3.49Å; N184-L188 PolarHBondContact O-N 3.5Å; M185-L188 HydrophobicContact CE-CD2 4.37Å; M185-L188 PolarHBondContact O-N 3.27Å; M185-L188 HydrophobicContact SD-CD2 4.29Å; L188-K190 VanDerWaalsContact C-N 3.31Å; L188-K190 PolarHBondContact O-N 2.82Å; L188-R191 PolarHBondContact O-N 2.83Å; L188-V192 HydrophobicContact CD1-CG1 4.17Å; L188-V192 WeakPolarHBondContact O-CG2 3.44Å; L188-V192 PolarHBondContact O-N 3.29Å; L188-V192 VanDerWaalsContact O-N 3.12Å
189	A	98.9	Very high	98.9	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-55.4	-45.8	179	0	0	0	0	0	112.2	I155 M185 L186 R191 G193 A194 L196 V250	I155-A189 HydrophobicContact CD1-CB 4.02Å; M185-A189 WeakPolarHBondContact O-CB 3.41Å; M185-A189 PolarHBondContact O-N 2.87Å; L186-A189 PolarHBondContact O-N 2.83Å; A189-R191 PolarHBondContact O-N 3.41Å; A189-G193 CarbonylContact O-C 3.56Å; A189-G193 WeakPolarHBondContact O-CA 3.31Å; A189-G193 PolarHBondContact O-N 3.02Å; A189-A194 HydrophobicContact CB-CB 4.45Å; A189-A194 PolarHBondContact O-N 3.34Å; A189-L196 HydrophobicContact CB-CB 4.17Å; A189-L196 HydrophobicContact CB-CD1 4.29Å; A189-V250 HydrophobicContact CB-CG1 3.85Å
190	K	98.8	Very high	98.8	Very high	98 Å²	98	26.8 Å²	26.8	43%	0.426	15%	0.152	S	C	.	.	H	α-helix	trans	-57.3	-46.9	174.4	-179.8	-174.1	175.1	177.7	0	111.9	L186 L188 Y244 E248 V250	L186-K190 WeakPolarHBondContact O-CB 3.22Å; L186-K190 PolarHBondContact O-N 3.47Å; L188-K190 VanDerWaalsContact C-N 3.31Å; L188-K190 PolarHBondContact O-N 2.82Å; K190-Y244 HydrophobicContact CD-CE1 4.48Å; K190-E248 HydrophobicContact CD-CB 4.12Å; K190-E248 HydrophobicContact CD-CG 4.1Å; K190-E248 VanDerWaalsContact CE-CD 3.46Å; K190-E248 WeakPolarHBondContact CE-OE2 3.45Å; K190-E248 HydrophobicContact CG-CB 4.43Å; K190-E248 IonicContact NZ-OE1 3.35Å; K190-E248 PolarHBondContact NZ-OE1 2.87Å; K190-E248 IonicContact NZ-OE2 3.38Å; K190-E248 PolarHBondContact NZ-OE2 2.98Å; K190-V250 HydrophobicContact CB-CG2 3.8Å; K190-V250 HydrophobicContact CG-CG2 4.35Å
191	R	98.7	Very high	98.8	Very high	108 Å²	108	24 Å²	24	41%	0.408	14%	0.138	S	C	.	.	H	α-helix	trans	-65.6	-42.6	-173.9	-171.2	-174.5	72.4	-126.4	-4.3	112.5	Y149 I150 G187 L188 A189	Y149-R191 VanDerWaalsContact CE1-NH1 3.35Å; I150-R191 PolarHBondContact O-NH2 2.78Å; G187-R191 WeakPolarHBondContact O-CB 3.31Å; G187-R191 PolarHBondContact O-N 3.26Å; G187-R191 VanDerWaalsContact O-N 3.08Å; L188-R191 PolarHBondContact O-N 2.83Å; A189-R191 PolarHBondContact O-N 3.41Å
192	V	98.7	Very high	98.6	Very high	30 Å²	30	24.1 Å²	24.1	18%	0.182	14%	0.139	C	C	.	.	H	α-helix	trans	-102.4	-1.6	-172.7	-50.9	0	0	0	0	113.4	V152 L188 A194	V152-V192 HydrophobicContact CG2-CG2 4.34Å; V152-V192 WeakPolarHBondContact O-CG2 3.37Å; L188-V192 HydrophobicContact CD1-CG1 4.17Å; L188-V192 WeakPolarHBondContact O-CG2 3.44Å; L188-V192 PolarHBondContact O-N 3.29Å; L188-V192 VanDerWaalsContact O-N 3.12Å; V192-A194 VanDerWaalsContact C-N 3.34Å; V192-A194 HydrophobicContact CG2-CB 3.8Å
193	G	98.6	Very high	98.4	Very high	68 Å²	68	25 Å²	25	70%	0.701	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.4	23.4	-177.2	0	0	0	0	0	114.1	A189	A189-G193 CarbonylContact O-C 3.56Å; A189-G193 WeakPolarHBondContact O-CA 3.31Å; A189-G193 PolarHBondContact O-N 3.02Å
194	A	98.8	Very high	98.4	Very high	2 Å²	2	22 Å²	22	2%	0.017	13%	0.127	C	C	.	.			trans	-74.4	146.5	179.7	0	0	0	0	0	112.1	V152 D153 I155 A189 V192	V152-A194 HydrophobicContact CG2-CB 4.27Å; V152-A194 WeakPolarHBondContact O-CB 3.41Å; D153-A194 WeakPolarHBondContact O-CA 3.47Å; I155-A194 HydrophobicContact CD1-CB 4Å; I155-A194 HydrophobicContact CG1-CB 3.97Å; A189-A194 HydrophobicContact CB-CB 4.45Å; A189-A194 PolarHBondContact O-N 3.34Å; V192-A194 VanDerWaalsContact C-N 3.34Å; V192-A194 HydrophobicContact CG2-CB 3.8Å
195	R	98.9	Very high	98.2	Very high	41 Å²	41	20.3 Å²	20.3	16%	0.155	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	129.7	165.6	-175.8	179.7	-65.6	178.2	0.6	110	D153 Q154 I155 E251 R253 M312 S314	D153-R195 PolarHBondContact O-N 2.86Å; Q154-R195 CarbonylContact C-O 3.44Å; Q154-R195 WeakPolarHBondContact CA-O 3.06Å; I155-R195 PolarHBondContact N-O 3.26Å; R195-E251 CarbonylContact C-O 3.56Å; R195-E251 WeakPolarHBondContact CA-O 3.46Å; R195-E251 HydrophobicContact CB-CB 4.14Å; R195-E251 HydrophobicContact CG-CB 3.89Å; R195-E251 WeakPolarHBondContact CG-O 3.33Å; R195-E251 IonicContact CZ-OE2 3.42Å; R195-E251 IonicContact NE-OE2 3.5Å; R195-E251 PolarHBondContact NE-OE2 3.43Å; R195-E251 IonicContact NH2-OE1 3.93Å; R195-E251 IonicContact NH2-OE2 3.93Å; R195-E251 PolarHBondContact NH2-OE2 2.86Å; R195-R253 HydrophobicContact CG-CG 4.39Å; R195-M312 HydrophobicContact CB-SD 4.18Å; R195-M312 WeakPolarHBondContact CD-O 3.41Å; R195-M312 HydrophobicContact CG-SD 3.7Å; R195-M312 PolarHBondContact NH1-O 3.26Å; R195-S314 PolarHBondContact NH1-O 3.27Å; R195-S314 VanDerWaalsContact NH1-O 3.16Å
196	L	98.9	Very high	97.9	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	128	-179.6	-173.6	148.7	0	0	0	111.8	I155 H157 M185 L186 A189 L198 E251 V252 R253	I155-L196 HydrophobicContact CB-CB 4.4Å; I155-L196 HydrophobicContact CB-CD1 4.35Å; I155-L196 HydrophobicContact CB-CG 4.24Å; I155-L196 HydrophobicContact CG2-CD1 4.13Å; I155-L196 HydrophobicContact CG2-CG 4.29Å; I155-L196 CarbonylContact O-C 3.36Å; I155-L196 WeakPolarHBondContact O-CA 3.03Å; H157-L196 HydrophobicContact CB-CD2 4.34Å; H157-L196 HydrophobicContact CB-CG 4.49Å; M185-L196 HydrophobicContact CB-CD1 3.78Å; L186-L196 HydrophobicContact CD2-CD1 4.12Å; L186-L196 HydrophobicContact CD2-CD2 4.25Å; L186-L196 HydrophobicContact CG-CD1 4.34Å; A189-L196 HydrophobicContact CB-CB 4.17Å; A189-L196 HydrophobicContact CB-CD1 4.29Å; L196-L198 HydrophobicContact CD2-CB 4.4Å; L196-E251 PolarHBondContact N-O 3.12Å; L196-V252 CarbonylContact O-C 3.57Å; L196-V252 VanDerWaalsContact O-CA 3.25Å; L196-V252 WeakPolarHBondContact O-CA 3.46Å; L196-R253 PolarHBondContact O-N 3.45Å
197	L	98.9	Very high	97.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122.5	168.3	-173.9	152.8	0	0	0	110	I155 Y156 H157 R253 A255 L308 L311 M312	I155-L197 PolarHBondContact O-N 2.91Å; Y156-L197 HydrophobicContact CD1-CB 4.27Å; Y156-L197 HydrophobicContact CD1-CD1 4.38Å; Y156-L197 HydrophobicContact CD1-CD2 4.27Å; Y156-L197 HydrophobicContact CE1-CD1 4.21Å; H157-L197 PolarHBondContact N-O 2.94Å; L197-R253 CarbonylContact C-O 3.56Å; L197-R253 VanDerWaalsContact CA-O 3.28Å; L197-R253 WeakPolarHBondContact CA-O 3.5Å; L197-R253 HydrophobicContact CB-CB 3.96Å; L197-R253 HydrophobicContact CD1-CB 4.01Å; L197-R253 HydrophobicContact CG-CB 3.89Å; L197-A255 HydrophobicContact CD2-CB 4.27Å; L197-L308 HydrophobicContact CD1-CD2 4.46Å; L197-L308 WeakPolarHBondContact CD1-O 3.44Å; L197-L308 HydrophobicContact CD2-CD2 3.78Å; L197-L311 HydrophobicContact CD1-CB 4.18Å; L197-L311 HydrophobicContact CD1-CD2 4.1Å; L197-L311 HydrophobicContact CD1-CG 4.13Å; L197-M312 HydrophobicContact CB-CE 3.33Å; L197-M312 HydrophobicContact CB-SD 4.18Å; L197-M312 HydrophobicContact CD1-CB 4Å
198	L	98.9	Very high	96.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	125.2	172.3	177.7	66.5	0	0	0	110.3	L196 S200 A237 E238 R253 V254 A255	L196-L198 HydrophobicContact CD2-CB 4.4Å; L198-S200 VanDerWaalsContact C-N 3.34Å; L198-S200 PolarHBondContact O-N 3.09Å; L198-S200 VanDerWaalsContact O-N 3.11Å; L198-A237 HydrophobicContact CD1-CB 4.29Å; L198-A237 HydrophobicContact CD2-CB 3.91Å; L198-E238 HydrophobicContact CD2-CG 4.07Å; L198-R253 PolarHBondContact N-O 2.92Å; L198-V254 HydrophobicContact CB-CG2 4.48Å; L198-A255 PolarHBondContact O-N 3.32Å
199	A	98.8	Very high	96.5	Very high	9 Å²	9	31.6 Å²	31.6	7%	0.074	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	86	163.9	0	0	0	0	0	109.5	H157 L158 K234 I257	H157-A199 WeakPolarHBondContact O-CB 3.25Å; H157-A199 PolarHBondContact O-N 3.11Å; H157-A199 VanDerWaalsContact O-N 3.09Å; L158-A199 HydrophobicContact CB-CB 4.37Å; L158-A199 HydrophobicContact CD1-CB 4.08Å; L158-A199 HydrophobicContact CG-CB 3.78Å; A199-K234 PolarHBondContact O-NZ 2.8Å; A199-I257 HydrophobicContact CB-CD1 3.77Å
200	S	98.7	Very high	96.2	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-168.2	168.3	-165.5	0	0	0	0	110	L198 E238 A255 I257	L198-S200 VanDerWaalsContact C-N 3.34Å; L198-S200 PolarHBondContact O-N 3.09Å; L198-S200 VanDerWaalsContact O-N 3.11Å; S200-E238 VanDerWaalsContact CB-OE1 3.26Å; S200-E238 WeakPolarHBondContact CB-OE1 3.49Å; S200-E238 PolarHBondContact OG-OE1 2.66Å; S200-A255 CarbonylContact C-O 3.57Å; S200-A255 VanDerWaalsContact C-O 3.28Å; S200-A255 VanDerWaalsContact CA-O 3.22Å; S200-A255 WeakPolarHBondContact CA-O 3.34Å; S200-A255 VanDerWaalsContact CB-O 3.24Å; S200-A255 WeakPolarHBondContact CB-O 3.44Å; S200-A255 PolarHBondContact N-O 3.46Å; S200-I257 PolarHBondContact O-N 3.36Å
201	T	98	Very high	95.7	Very high	10 Å²	10	33.6 Å²	33.6	6%	0.061	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	153.1	-168	-179.7	0	0	0	0	111.3	E203 V204 Y230 K234	T201-E203 HydrophobicContact CG2-CB 3.77Å; T201-E203 HydrophobicContact CG2-CG 4.39Å; T201-E203 PolarHBondContact O-N 2.8Å; T201-E203 PolarHBondContact OG1-N 2.9Å; T201-E203 VanDerWaalsContact OG1-N 3.17Å; T201-V204 HydrophobicContact CG2-CG1 3.92Å; T201-V204 WeakPolarHBondContact O-CG1 3.15Å; T201-V204 WeakPolarHBondContact O-CG2 3.34Å; T201-V204 PolarHBondContact O-N 3.44Å; T201-Y230 HydrophobicContact CG2-CE1 3.72Å; T201-K234 HydrophobicContact CG2-CB 3.76Å; T201-K234 HydrophobicContact CG2-CG 3.75Å
202	S	95.5	Very high	95.5	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.014	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-62	-18.3	166.5	59.9	0	0	0	0	113.9	V204 Y205 I257 R360	S202-V204 PolarHBondContact O-N 3.08Å; S202-Y205 WeakPolarHBondContact O-CB 3.27Å; S202-Y205 VanDerWaalsContact O-CD2 3.28Å; S202-Y205 WeakPolarHBondContact O-CD2 3.48Å; S202-Y205 PolarHBondContact O-N 3.06Å; S202-Y205 VanDerWaalsContact O-N 3.1Å; S202-I257 PolarHBondContact N-O 3.09Å; S202-I257 PolarHBondContact OG-O 2.96Å; S202-R360 WeakPolarHBondContact OG-CD 3.39Å; S202-R360 PolarHBondContact OG-NH1 3.35Å
203	E	94.8	Very high	95.3	Very high	19 Å²	19	29.3 Å²	29.3	9%	0.089	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-65.1	-16.3	175.6	-58.6	-75.1	134.6	0	0	112.8	T201 Y205 G206 R227 Y230 D231 R360	T201-E203 HydrophobicContact CG2-CB 3.77Å; T201-E203 HydrophobicContact CG2-CG 4.39Å; T201-E203 PolarHBondContact O-N 2.8Å; T201-E203 PolarHBondContact OG1-N 2.9Å; T201-E203 VanDerWaalsContact OG1-N 3.17Å; E203-Y205 PolarHBondContact O-N 3.36Å; E203-Y205 VanDerWaalsContact O-N 3.16Å; E203-G206 PolarHBondContact O-N 2.89Å; E203-R227 VanDerWaalsContact CD-NH2 3.3Å; E203-R227 IonicContact OE1-NH2 2.66Å; E203-R227 PolarHBondContact OE1-NH2 2.89Å; E203-R227 IonicContact OE2-CZ 2.73Å; E203-R227 IonicContact OE2-NE 3.95Å; E203-R227 PolarHBondContact OE2-NE 3.09Å; E203-R227 IonicContact OE2-NH2 2.72Å; E203-R227 PolarHBondContact OE2-NH2 3.45Å; E203-Y230 HydrophobicContact CB-CD1 4.31Å; E203-Y230 HydrophobicContact CB-CE1 4.12Å; E203-Y230 HydrophobicContact CG-CD1 4.19Å; E203-Y230 HydrophobicContact CG-CE1 3.85Å; E203-D231 WeakPolarHBondContact CB-OD1 3.37Å; E203-R360 VanDerWaalsContact CD-NH2 3.31Å; E203-R360 IonicContact OE1-CZ 2.72Å; E203-R360 IonicContact OE1-NH1 3.99Å; E203-R360 PolarHBondContact OE1-NH1 2.88Å; E203-R360 IonicContact OE1-NH2 3.87Å; E203-R360 PolarHBondContact OE1-NH2 3.48Å; E203-R360 IonicContact OE2-NH2 3.44Å
204	V	97.3	Very high	95.2	Very high	3 Å²	3	28.2 Å²	28.2	2%	0.018	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-63.3	-20.3	173	-55.7	0	0	0	0	112.6	T201 S202 K234 R235 R256	T201-V204 HydrophobicContact CG2-CG1 3.92Å; T201-V204 WeakPolarHBondContact O-CG1 3.15Å; T201-V204 WeakPolarHBondContact O-CG2 3.34Å; T201-V204 PolarHBondContact O-N 3.44Å; S202-V204 PolarHBondContact O-N 3.08Å; V204-K234 HydrophobicContact CG1-CB 4.14Å; V204-R235 HydrophobicContact CB-CG 3.85Å; V204-R235 HydrophobicContact CG1-CG 3.9Å; V204-R235 PolarHBondContact O-NH1 3.41Å; V204-R256 HydrophobicContact CG2-CG 4.34Å
205	Y	96.1	Very high	95.2	Very high	3 Å²	3	29.1 Å²	29.1	1%	0.012	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-82.6	-16.5	173	-56.2	-57	0	0	0	113.1	S202 E203 Q213 N214 E215 Y217 G219 H220 R256 F258 N321	S202-Y205 WeakPolarHBondContact O-CB 3.27Å; S202-Y205 VanDerWaalsContact O-CD2 3.28Å; S202-Y205 WeakPolarHBondContact O-CD2 3.48Å; S202-Y205 PolarHBondContact O-N 3.06Å; S202-Y205 VanDerWaalsContact O-N 3.1Å; E203-Y205 PolarHBondContact O-N 3.36Å; E203-Y205 VanDerWaalsContact O-N 3.16Å; Y205-Q213 HydrophobicContact CD2-CB 4Å; Y205-Q213 HydrophobicContact CD2-CG 4.35Å; Y205-Q213 HydrophobicContact CE2-CB 4.17Å; Y205-Q213 HydrophobicContact CG-CB 4.27Å; Y205-Q213 HydrophobicContact CG-CG 4.37Å; Y205-N214 WeakPolarHBondContact CE1-O 3.49Å; Y205-N214 PolarHBondContact OH-O 3.03Å; Y205-E215 WeakPolarHBondContact OH-CA 3.24Å; Y205-Y217 AromaticContact CD1-CD1 3.79Å; Y205-Y217 HydrophobicContact CD1-CD1 3.79Å; Y205-Y217 HydrophobicContact CG-CD1 4.36Å; Y205-G219 VanDerWaalsContact O-CA 3.25Å; Y205-G219 WeakPolarHBondContact O-CA 3.05Å; Y205-H220 PolarHBondContact O-N 3.18Å; Y205-R256 VanDerWaalsContact CE1-NH1 3.29Å; Y205-R256 WeakPolarHBondContact OH-CD 3.37Å; Y205-R256 PolarHBondContact OH-NH1 2.89Å; Y205-F258 HydrophobicContact CD2-CZ 4.19Å; Y205-F258 HydrophobicContact CE2-CE2 4.11Å; Y205-F258 AromaticContact CE2-CZ 3.83Å; Y205-F258 HydrophobicContact CE2-CZ 3.83Å; Y205-N321 PolarHBondContact OH-OD1 2.87Å
206	G	91.9	Very high	95.1	Very high	8 Å²	8	33.5 Å²	33.5	8%	0.082	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	65.7	-129.8	178.6	0	0	0	0	0	114.3	E203 P208 H220	E203-G206 PolarHBondContact O-N 2.89Å; G206-P208 VanDerWaalsContact O-CD 3.26Å; G206-P208 WeakPolarHBondContact O-CD 3.29Å; G206-H220 WeakPolarHBondContact CA-O 3.38Å
207	D	88.9	Confident	95.1	Very high	85 Å²	85	35.3 Å²	35.3	46%	0.455	19%	0.187	S	C	.	.	S	Bend	trans	-97.2	90.8	169.2	-173	29.7	0	0	0	108.9	H220	D207-H220 PolarHBondContact N-O 2.75Å; D207-H220 WeakPolarHBondContact O-CB 3.31Å; D207-H220 PolarHBondContact O-ND1 3.29Å
208	P	87.4	Confident	95	Very high	21 Å²	21	46.2 Å²	46.2	14%	0.136	23%	0.229	C	C	.	.			trans	-73.3	135	-162.2	30.4	-36.1	0	0	0	112.2	G206 V210 Q213 Y217	G206-P208 VanDerWaalsContact O-CD 3.26Å; G206-P208 WeakPolarHBondContact O-CD 3.29Å; P208-V210 VanDerWaalsContact C-N 3.26Å; P208-V210 PolarHBondContact O-N 2.94Å; P208-Q213 HydrophobicContact CB-CG 3.71Å; P208-Q213 HydrophobicContact CG-CG 3.93Å; P208-Y217 HydrophobicContact CB-CE1 3.79Å
209	E	90.6	Very high	94.9	Very high	153 Å²	153	47.2 Å²	47.2	72%	0.715	24%	0.238	S	C	*	.	S	Bend	trans	-85.5	-0.6	174.1	-59.7	179.4	142.3	0	0	112.7	Y217 H220	E209-Y217 PolarHBondContact N-OH 3.45Å; E209-Y217 VanDerWaalsContact N-OH 3.08Å; E209-H220 HydrophobicContact CG-CB 4.42Å
210	V	92.1	Very high	94.7	Very high	66 Å²	66	51.3 Å²	51.3	40%	0.4	26%	0.256	S	S	.	.	S	Bend	trans	-126.6	141.3	-179.8	179.1	0	0	0	0	110	P208 Q213 Y217	P208-V210 VanDerWaalsContact C-N 3.26Å; P208-V210 PolarHBondContact O-N 2.94Å; V210-Q213 PolarHBondContact O-NE2 3.16Å; V210-Y217 HydrophobicContact CB-CD2 4.43Å; V210-Y217 HydrophobicContact CB-CE2 4.49Å; V210-Y217 HydrophobicContact CG2-CD2 4.12Å; V210-Y217 HydrophobicContact CG2-CE2 4.02Å
211	H	90.1	Very high	94.6	Very high	75 Å²	75	52.4 Å²	52.4	35%	0.347	26%	0.262	S	S	.	.	S	Bend	trans	-142.1	125.9	-179.4	-169.7	97.1	0	0	0	111.5	E327 R361	H211-E327 IonicContact CE1-OE1 3.24Å; H211-E327 PolarHBondContact CE1-OE1 3.05Å; H211-E327 IonicContact CE1-OE2 3.19Å; H211-E327 IonicContact NE2-OE1 2.97Å; H211-E327 IonicContact NE2-OE2 2.63Å; H211-E327 PolarHBondContact NE2-OE2 2.93Å; H211-R361 WeakPolarHBondContact CE1-CB 3.41Å
212	P	93.8	Very high	94.5	Very high	46 Å²	46	56.1 Å²	56.1	30%	0.299	28%	0.282	S	S	.	.	S	Bend	cis	-70.7	166.7	-3.7	32.2	-36.5	0	0	0	112.8	R361 D363	P212-R361 WeakPolarHBondContact CA-O 3.06Å; P212-R361 HydrophobicContact CB-CB 4.25Å; P212-R361 HydrophobicContact CB-CG 4.22Å; P212-R361 VanDerWaalsContact CB-O 3.31Å; P212-R361 WeakPolarHBondContact CB-O 3.35Å; P212-D363 HydrophobicContact CB-CB 4.28Å; P212-D363 HydrophobicContact CG-CB 4.17Å
213	Q	94.4	Very high	94.6	Very high	1 Å²	1	59.9 Å²	59.9	1%	0.005	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-85.8	114	178.2	-63	78.3	58.5	0	0	110.2	Y205 P208 V210 F258 N321 R361 D363	Y205-Q213 HydrophobicContact CD2-CB 4Å; Y205-Q213 HydrophobicContact CD2-CG 4.35Å; Y205-Q213 HydrophobicContact CE2-CB 4.17Å; Y205-Q213 HydrophobicContact CG-CB 4.27Å; Y205-Q213 HydrophobicContact CG-CG 4.37Å; P208-Q213 HydrophobicContact CB-CG 3.71Å; P208-Q213 HydrophobicContact CG-CG 3.93Å; V210-Q213 PolarHBondContact O-NE2 3.16Å; Q213-F258 HydrophobicContact CB-CZ 4.44Å; Q213-N321 PolarHBondContact O-ND2 3.32Å; Q213-R361 PolarHBondContact N-O 2.89Å; Q213-R361 PolarHBondContact OE1-O 3.49Å; Q213-D363 PolarHBondContact O-N 3.45Å
214	N	96.7	Very high	94.7	Very high	45 Å²	45	66.4 Å²	66.4	24%	0.241	34%	0.34	C	S	.	.			trans	-94.7	168.4	170.8	66.9	44.1	0	0	0	111.3	Y205 D216 Y217 D363	Y205-N214 WeakPolarHBondContact CE1-O 3.49Å; Y205-N214 PolarHBondContact OH-O 3.03Å; N214-D216 PolarHBondContact O-N 3.19Å; N214-D216 WeakPolarHBondContact OD1-CB 3.28Å; N214-D216 PolarHBondContact OD1-N 3.38Å; N214-Y217 PolarHBondContact O-N 3.44Å; N214-Y217 PolarHBondContact OD1-N 3.35Å; N214-Y217 VanDerWaalsContact OD1-N 3.11Å; N214-D363 HydrophobicContact CB-CB 4.07Å
215	E	98.3	Very high	94.5	Very high	22 Å²	22	67 Å²	67	10%	0.103	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-15.8	-175.7	-61.6	94.3	150.3	0	0	114.7	Y205 R256 P319 N321 K366	Y205-E215 WeakPolarHBondContact OH-CA 3.24Å; E215-R256 PolarHBondContact O-NH1 2.81Å; E215-P319 WeakPolarHBondContact CG-O 3.47Å; E215-N321 HydrophobicContact CG-CB 4.34Å; E215-N321 WeakPolarHBondContact OE1-CB 3.22Å; E215-N321 PolarHBondContact OE1-N 3.36Å; E215-K366 HydrophobicContact CG-CD 4.41Å
216	D	97.5	Very high	94.3	Very high	133 Å²	133	70.7 Å²	70.7	71%	0.711	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-19.9	178.2	-61.5	-30.3	0	0	0	112.4	N214 W218	N214-D216 PolarHBondContact O-N 3.19Å; N214-D216 WeakPolarHBondContact OD1-CB 3.28Å; N214-D216 PolarHBondContact OD1-N 3.38Å; D216-W218 VanDerWaalsContact O-CD1 3.26Å; D216-W218 PolarHBondContact O-N 2.94Å
217	Y	97.8	Very high	94.4	Very high	37 Å²	37	72.1 Å²	72.1	15%	0.145	37%	0.374	C	S	.	.			trans	-67.9	130.7	178.3	-177.1	-122.2	0	0	0	111.8	Y205 P208 E209 V210 N214 G219	Y205-Y217 AromaticContact CD1-CD1 3.79Å; Y205-Y217 HydrophobicContact CD1-CD1 3.79Å; Y205-Y217 HydrophobicContact CG-CD1 4.36Å; P208-Y217 HydrophobicContact CB-CE1 3.79Å; E209-Y217 PolarHBondContact N-OH 3.45Å; E209-Y217 VanDerWaalsContact N-OH 3.08Å; V210-Y217 HydrophobicContact CB-CD2 4.43Å; V210-Y217 HydrophobicContact CB-CE2 4.49Å; V210-Y217 HydrophobicContact CG2-CD2 4.12Å; V210-Y217 HydrophobicContact CG2-CE2 4.02Å; N214-Y217 PolarHBondContact O-N 3.44Å; N214-Y217 PolarHBondContact OD1-N 3.35Å; N214-Y217 VanDerWaalsContact OD1-N 3.11Å; Y217-G219 VanDerWaalsContact CE1-CA 3.41Å
218	W	97.7	Very high	94.7	Very high	230 Å²	230	68.5 Å²	68.5	87%	0.871	36%	0.356	S	S	*	.			trans	-79	-17.1	-175.1	-64.6	-5.8	0	0	0	114.5	D216 R235	D216-W218 VanDerWaalsContact O-CD1 3.26Å; D216-W218 PolarHBondContact O-N 2.94Å; W218-R235 PolarHBondContact O-NH1 3.21Å
219	G	96	Very high	95.2	Very high	20 Å²	20	67.9 Å²	67.9	21%	0.206	35%	0.352	C	S	.	.			trans	87.6	154.5	-175.9	0	0	0	0	0	114	Y205 Y217	Y205-G219 VanDerWaalsContact O-CA 3.25Å; Y205-G219 WeakPolarHBondContact O-CA 3.05Å; Y217-G219 VanDerWaalsContact CE1-CA 3.41Å
220	H	95.4	Very high	95.6	Very high	96 Å²	96	61.5 Å²	61.5	44%	0.444	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-122.4	93.2	172.2	173.4	-122.1	0	0	0	108.1	Y205 G206 D207 E209	Y205-H220 PolarHBondContact O-N 3.18Å; G206-H220 WeakPolarHBondContact CA-O 3.38Å; D207-H220 PolarHBondContact N-O 2.75Å; D207-H220 WeakPolarHBondContact O-CB 3.31Å; D207-H220 PolarHBondContact O-ND1 3.29Å; E209-H220 HydrophobicContact CG-CB 4.42Å
221	V	95.5	Very high	95.8	Very high	25 Å²	25	58.9 Å²	58.9	15%	0.152	31%	0.305	C	S	.	.			trans	-122.1	134	-168.2	178.4	0	0	0	0	109.3	P223 D231	V221-P223 WeakPolarHBondContact O-CD 3.47Å; V221-D231 HydrophobicContact CG1-CB 3.83Å
222	N	95.9	Very high	96.2	Very high	88 Å²	88	58.1 Å²	58.1	47%	0.471	30%	0.302	S	S	.	.			trans	-82.5	113	173.3	179.3	-5.6	0	0	0	110.1	I224 G225	N222-I224 VanDerWaalsContact C-N 3.27Å; N222-I224 PolarHBondContact O-N 2.88Å; N222-I224 WeakPolarHBondContact OD1-CG1 3.4Å; N222-I224 PolarHBondContact OD1-N 3.09Å; N222-G225 PolarHBondContact O-N 3.39Å; N222-G225 PolarHBondContact OD1-N 3.22Å
223	P	97.7	Very high	96.4	Very high	82 Å²	82	55.9 Å²	55.9	53%	0.532	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-10	-170.9	31.8	-37.4	0	0	0	114.4	V221 A228 E232	V221-P223 WeakPolarHBondContact O-CD 3.47Å; P223-A228 VanDerWaalsContact C-CB 3.48Å; P223-A228 VanDerWaalsContact O-CB 3.27Å; P223-A228 WeakPolarHBondContact O-CB 3.39Å; P223-E232 HydrophobicContact CB-CG 4.26Å
224	I	97.4	Very high	96.6	Very high	156 Å²	156	56.1 Å²	56.1	80%	0.8	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.6	3.9	-179.2	62.5	170	0	0	0	113	N222	N222-I224 VanDerWaalsContact C-N 3.27Å; N222-I224 PolarHBondContact O-N 2.88Å; N222-I224 WeakPolarHBondContact OD1-CG1 3.4Å; N222-I224 PolarHBondContact OD1-N 3.09Å
225	G	93.9	Very high	96.7	Very high	14 Å²	14	57.6 Å²	57.6	14%	0.144	29%	0.291	C	S	.	.	S	Bend	trans	-66.6	167.6	176.7	0	0	0	0	0	112.5	N222 R227 A228	N222-G225 PolarHBondContact O-N 3.39Å; N222-G225 PolarHBondContact OD1-N 3.22Å; G225-R227 PolarHBondContact O-N 3.43Å; G225-R227 VanDerWaalsContact O-N 3.12Å; G225-A228 WeakPolarHBondContact O-CB 3.4Å; G225-A228 PolarHBondContact O-N 2.8Å
226	P	91.3	Very high	96.8	Very high	82 Å²	82	59.1 Å²	59.1	53%	0.532	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-25.1	-178.5	25.1	-34.2	0	0	0	113.3	M168	M168-P226 HydrophobicContact SD-CB 4.46Å
227	R	94	Very high	96.8	Very high	37 Å²	37	52.8 Å²	52.8	14%	0.14	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-12.7	178.4	-58.4	175.7	72.6	127.3	-4.2	113.8	Y167 M168 E203 G225 C229 Y230 D231	Y167-R227 HydrophobicContact CE2-CB 4.34Å; Y167-R227 HydrophobicContact CE2-CG 4.39Å; Y167-R227 VanDerWaalsContact OH-CZ 3.29Å; Y167-R227 PolarHBondContact OH-NE 3.27Å; Y167-R227 VanDerWaalsContact OH-NE 3.15Å; Y167-R227 PolarHBondContact OH-NH2 2.97Å; M168-R227 HydrophobicContact SD-CG 4.17Å; E203-R227 VanDerWaalsContact CD-NH2 3.3Å; E203-R227 IonicContact OE1-NH2 2.66Å; E203-R227 PolarHBondContact OE1-NH2 2.89Å; E203-R227 IonicContact OE2-CZ 2.73Å; E203-R227 IonicContact OE2-NE 3.95Å; E203-R227 PolarHBondContact OE2-NE 3.09Å; E203-R227 IonicContact OE2-NH2 2.72Å; E203-R227 PolarHBondContact OE2-NH2 3.45Å; G225-R227 PolarHBondContact O-N 3.43Å; G225-R227 VanDerWaalsContact O-N 3.12Å; R227-C229 PolarHBondContact O-N 2.99Å; R227-Y230 PolarHBondContact O-N 3.19Å; R227-D231 WeakPolarHBondContact CB-OD2 3.24Å; R227-D231 PolarHBondContact O-N 2.85Å; R227-D231 VanDerWaalsContact O-N 3.17Å
228	A	96.2	Very high	96.9	Very high	9 Å²	9	51.6 Å²	51.6	7%	0.074	26%	0.263	C	S	.	.	H	α-helix	trans	-57.7	-29	-173.9	0	0	0	0	0	113.6	P223 G225 Y230 D231 E232	P223-A228 VanDerWaalsContact C-CB 3.48Å; P223-A228 VanDerWaalsContact O-CB 3.27Å; P223-A228 WeakPolarHBondContact O-CB 3.39Å; G225-A228 WeakPolarHBondContact O-CB 3.4Å; G225-A228 PolarHBondContact O-N 2.8Å; A228-Y230 PolarHBondContact O-N 3.49Å; A228-D231 PolarHBondContact O-N 2.98Å; A228-E232 HydrophobicContact CB-CG 4.46Å; A228-E232 WeakPolarHBondContact O-CB 3.16Å; A228-E232 PolarHBondContact O-N 3.19Å
229	C	97.4	Very high	97	Very high	9 Å²	9	45 Å²	45	6%	0.061	25%	0.249	C	C	.	.	H	α-helix	trans	-57.5	-30.9	175.9	65	0	0	0	0	113.7	P171 T174 L175 R227	P171-C229 HydrophobicContact CB-CB 3.55Å; T174-C229 WeakPolarHBondContact CG2-O 3.5Å; L175-C229 HydrophobicContact CD1-CB 4.32Å; L175-C229 HydrophobicContact CG-CB 3.99Å; R227-C229 PolarHBondContact O-N 2.99Å
230	Y	97.9	Very high	97.1	Very high	18 Å²	18	45.5 Å²	45.5	7%	0.071	25%	0.246	C	C	.	.	H	α-helix	trans	-92.1	-49.5	174.5	-179.1	-98.5	0	0	0	110.8	P161 Y167 T174 T201 E203 R227 A228 G233 K234	P161-Y230 WeakPolarHBondContact O-CD2 3.33Å; P161-Y230 VanDerWaalsContact O-CE2 3.22Å; P161-Y230 WeakPolarHBondContact O-CE2 3.46Å; Y167-Y230 HydrophobicContact CD1-CD1 4.41Å; Y167-Y230 AromaticContact CD1-CD2 3.89Å; Y167-Y230 HydrophobicContact CD1-CD2 3.89Å; Y167-Y230 HydrophobicContact CD1-CE2 4.46Å; Y167-Y230 AromaticContact CD1-CG 3.86Å; Y167-Y230 HydrophobicContact CD1-CG 3.86Å; Y167-Y230 HydrophobicContact CD2-CG 4.37Å; Y167-Y230 HydrophobicContact CE1-CD1 4.13Å; Y167-Y230 HydrophobicContact CE1-CD2 4.41Å; Y167-Y230 HydrophobicContact CE1-CG 4.01Å; Y167-Y230 HydrophobicContact CG-CD2 4.14Å; Y167-Y230 HydrophobicContact CG-CG 4.07Å; T174-Y230 HydrophobicContact CG2-CD2 4.28Å; T201-Y230 HydrophobicContact CG2-CE1 3.72Å; E203-Y230 HydrophobicContact CB-CD1 4.31Å; E203-Y230 HydrophobicContact CB-CE1 4.12Å; E203-Y230 HydrophobicContact CG-CD1 4.19Å; E203-Y230 HydrophobicContact CG-CE1 3.85Å; R227-Y230 PolarHBondContact O-N 3.19Å; A228-Y230 PolarHBondContact O-N 3.49Å; Y230-G233 PolarHBondContact O-N 2.96Å; Y230-K234 HydrophobicContact CE1-CG 4.26Å; Y230-K234 HydrophobicContact CE2-CG 4.18Å; Y230-K234 WeakPolarHBondContact O-CG 3.3Å; Y230-K234 PolarHBondContact O-N 3.36Å
231	D	97.1	Very high	97.3	Very high	12 Å²	12	41 Å²	41	6%	0.064	23%	0.225	C	C	.	.	H	α-helix	trans	-63.9	-53.7	-172.1	-52.5	-16.7	0	0	0	111.5	E203 V221 R227 A228 G233 K234 R235	E203-D231 WeakPolarHBondContact CB-OD1 3.37Å; V221-D231 HydrophobicContact CG1-CB 3.83Å; R227-D231 WeakPolarHBondContact CB-OD2 3.24Å; R227-D231 PolarHBondContact O-N 2.85Å; R227-D231 VanDerWaalsContact O-N 3.17Å; A228-D231 PolarHBondContact O-N 2.98Å; D231-G233 VanDerWaalsContact C-N 3.32Å; D231-G233 PolarHBondContact O-N 3.38Å; D231-K234 PolarHBondContact O-N 3.37Å; D231-R235 VanDerWaalsContact O-CG 3.27Å; D231-R235 WeakPolarHBondContact O-CG 3.38Å; D231-R235 PolarHBondContact O-N 3.17Å
232	E	98.6	Very high	97.4	Very high	58 Å²	58	41.9 Å²	41.9	27%	0.271	23%	0.226	S	C	.	.	H	α-helix	trans	-69	-32.9	176.2	-69.3	-60.4	157.5	0	0	111.8	P223 A228 K234 R235 V236	P223-E232 HydrophobicContact CB-CG 4.26Å; A228-E232 HydrophobicContact CB-CG 4.46Å; A228-E232 WeakPolarHBondContact O-CB 3.16Å; A228-E232 PolarHBondContact O-N 3.19Å; E232-K234 VanDerWaalsContact C-N 3.32Å; E232-K234 PolarHBondContact O-N 2.72Å; E232-R235 PolarHBondContact O-N 3.19Å; E232-R235 IonicContact OE1-NE 3.11Å; E232-R235 IonicContact OE2-NE 2.63Å; E232-R235 PolarHBondContact OE2-NE 2.8Å; E232-V236 WeakPolarHBondContact O-CG1 3.5Å; E232-V236 PolarHBondContact O-N 3.28Å
233	G	98.6	Very high	97.6	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-57.6	-44.1	172.9	0	0	0	0	0	112.2	Y230 D231 V236 A237	Y230-G233 PolarHBondContact O-N 2.96Å; D231-G233 VanDerWaalsContact C-N 3.32Å; D231-G233 PolarHBondContact O-N 3.38Å; G233-V236 WeakPolarHBondContact O-CG1 3.37Å; G233-A237 WeakPolarHBondContact O-CB 3.47Å; G233-A237 PolarHBondContact O-N 3.11Å
234	K	98.8	Very high	97.6	Very high	6 Å²	6	38.9 Å²	38.9	3%	0.026	21%	0.208	C	C	.	.	H	α-helix	trans	-74.4	-37.8	177	-72.1	-66	-170.6	-179.7	0	112.7	N178 A199 T201 V204 Y230 D231 E232 A237 E238	N178-K234 WeakPolarHBondContact OD1-CD 3.41Å; N178-K234 WeakPolarHBondContact OD1-CE 3.47Å; N178-K234 PolarHBondContact OD1-NZ 2.73Å; A199-K234 PolarHBondContact O-NZ 2.8Å; T201-K234 HydrophobicContact CG2-CB 3.76Å; T201-K234 HydrophobicContact CG2-CG 3.75Å; V204-K234 HydrophobicContact CG1-CB 4.14Å; Y230-K234 HydrophobicContact CE1-CG 4.26Å; Y230-K234 HydrophobicContact CE2-CG 4.18Å; Y230-K234 WeakPolarHBondContact O-CG 3.3Å; Y230-K234 PolarHBondContact O-N 3.36Å; D231-K234 PolarHBondContact O-N 3.37Å; E232-K234 VanDerWaalsContact C-N 3.32Å; E232-K234 PolarHBondContact O-N 2.72Å; K234-A237 WeakPolarHBondContact O-CB 3.47Å; K234-A237 PolarHBondContact O-N 2.85Å; K234-E238 PolarHBondContact O-N 3.48Å; K234-E238 VanDerWaalsContact O-N 3.13Å
235	R	98.9	Very high	97.7	Very high	76 Å²	76	34 Å²	34	29%	0.287	18%	0.183	S	C	.	.	H	α-helix	trans	-61.2	-45.2	175.1	-72.1	167.4	63	77.1	3.7	112.1	V204 W218 D231 E232 A237 E238 T239	V204-R235 HydrophobicContact CB-CG 3.85Å; V204-R235 HydrophobicContact CG1-CG 3.9Å; V204-R235 PolarHBondContact O-NH1 3.41Å; W218-R235 PolarHBondContact O-NH1 3.21Å; D231-R235 VanDerWaalsContact O-CG 3.27Å; D231-R235 WeakPolarHBondContact O-CG 3.38Å; D231-R235 PolarHBondContact O-N 3.17Å; E232-R235 PolarHBondContact O-N 3.19Å; E232-R235 IonicContact OE1-NE 3.11Å; E232-R235 IonicContact OE2-NE 2.63Å; E232-R235 PolarHBondContact OE2-NE 2.8Å; R235-A237 VanDerWaalsContact C-N 3.33Å; R235-E238 PolarHBondContact O-N 2.83Å; R235-T239 PolarHBondContact O-N 3.42Å; R235-T239 PolarHBondContact O-OG1 3.33Å
236	V	98.9	Very high	97.9	Very high	53 Å²	53	41.6 Å²	41.6	32%	0.321	21%	0.212	S	C	.	.	H	α-helix	trans	-70.5	-31.3	177.6	76.5	0	0	0	0	111.9	T179 E232 G233 E238 T239 M240	T179-V236 HydrophobicContact CG2-CG1 3.7Å; E232-V236 WeakPolarHBondContact O-CG1 3.5Å; E232-V236 PolarHBondContact O-N 3.28Å; G233-V236 WeakPolarHBondContact O-CG1 3.37Å; V236-E238 PolarHBondContact O-N 3.18Å; V236-T239 WeakPolarHBondContact O-CB 3.39Å; V236-T239 PolarHBondContact O-N 2.8Å; V236-T239 VanDerWaalsContact O-N 3.15Å; V236-M240 HydrophobicContact CG1-CE 4.37Å; V236-M240 HydrophobicContact CG2-CE 4.12Å; V236-M240 WeakPolarHBondContact O-CG 3.49Å; V236-M240 PolarHBondContact O-N 2.56Å
237	A	98.9	Very high	98.3	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.4	-38.8	173.3	0	0	0	0	0	112.6	T182 L198 G233 K234 R235 M240 C241	T182-A237 HydrophobicContact CG2-CB 4.1Å; L198-A237 HydrophobicContact CD1-CB 4.29Å; L198-A237 HydrophobicContact CD2-CB 3.91Å; G233-A237 WeakPolarHBondContact O-CB 3.47Å; G233-A237 PolarHBondContact O-N 3.11Å; K234-A237 WeakPolarHBondContact O-CB 3.47Å; K234-A237 PolarHBondContact O-N 2.85Å; R235-A237 VanDerWaalsContact C-N 3.33Å; A237-M240 PolarHBondContact O-N 3.38Å; A237-C241 PolarHBondContact O-N 3.4Å; A237-C241 VanDerWaalsContact O-N 3.13Å; A237-C241 PolarHBondContact O-SG 3.24Å
238	E	98.9	Very high	98.5	Very high	13 Å²	13	47.6 Å²	47.6	6%	0.061	23%	0.234	C	C	.	.	H	α-helix	trans	-60.8	-46.2	170.7	-66.9	-166.9	-173.5	0	0	110.8	L198 S200 K234 R235 V236 M240 C241 Y242 V254 R256	L198-E238 HydrophobicContact CD2-CG 4.07Å; S200-E238 VanDerWaalsContact CB-OE1 3.26Å; S200-E238 WeakPolarHBondContact CB-OE1 3.49Å; S200-E238 PolarHBondContact OG-OE1 2.66Å; K234-E238 PolarHBondContact O-N 3.48Å; K234-E238 VanDerWaalsContact O-N 3.13Å; R235-E238 PolarHBondContact O-N 2.83Å; V236-E238 PolarHBondContact O-N 3.18Å; E238-M240 VanDerWaalsContact C-N 3.33Å; E238-M240 PolarHBondContact O-N 2.88Å; E238-C241 WeakPolarHBondContact O-CB 3.26Å; E238-C241 PolarHBondContact O-N 3.37Å; E238-Y242 WeakPolarHBondContact O-CD2 3.5Å; E238-Y242 PolarHBondContact O-N 3.19Å; E238-Y242 VanDerWaalsContact O-N 3.13Å; E238-V254 HydrophobicContact CG-CG1 3.82Å; E238-R256 WeakPolarHBondContact OE1-CG 3.47Å; E238-R256 IonicContact OE1-CZ 3.5Å; E238-R256 IonicContact OE1-NE 2.67Å; E238-R256 PolarHBondContact OE1-NE 3.03Å; E238-R256 IonicContact OE1-NH2 3.02Å; E238-R256 IonicContact OE2-CZ 2.7Å; E238-R256 IonicContact OE2-NE 2.89Å; E238-R256 PolarHBondContact OE2-NE 3.43Å; E238-R256 IonicContact OE2-NH2 3.19Å; E238-R256 PolarHBondContact OE2-NH2 3.21Å
239	T	98.9	Very high	98.6	Very high	92 Å²	92	50 Å²	50	56%	0.564	26%	0.26	S	S	*	.	H	α-helix	trans	-56.6	-45.3	176.9	-57.8	0	0	0	0	111.7	R235 V236 C241 Y242 A243	R235-T239 PolarHBondContact O-N 3.42Å; R235-T239 PolarHBondContact O-OG1 3.33Å; V236-T239 WeakPolarHBondContact O-CB 3.39Å; V236-T239 PolarHBondContact O-N 2.8Å; V236-T239 VanDerWaalsContact O-N 3.15Å; T239-C241 PolarHBondContact O-N 3.02Å; T239-Y242 PolarHBondContact O-N 2.83Å; T239-A243 WeakPolarHBondContact O-CB 3.28Å; T239-A243 PolarHBondContact O-N 2.92Å
240	M	98.9	Very high	98.7	Very high	30 Å²	30	50 Å²	50	15%	0.148	26%	0.259	C	S	.	.	H	α-helix	trans	-60	-44.2	177.6	-69.4	172.4	179.8	0	0	111.7	T179 T182 L183 L186 V236 A237 E238 Y242 A243 Y244	T179-M240 HydrophobicContact CG2-CE 4.2Å; T182-M240 HydrophobicContact CG2-CB 4.37Å; T182-M240 HydrophobicContact CG2-SD 4.27Å; L183-M240 HydrophobicContact CD1-CE 4.24Å; L183-M240 HydrophobicContact CD2-CE 4.25Å; L183-M240 HydrophobicContact CD2-CG 4.18Å; L183-M240 HydrophobicContact CD2-SD 3.84Å; L183-M240 HydrophobicContact CG-CE 4.05Å; L183-M240 HydrophobicContact CG-SD 3.81Å; L186-M240 HydrophobicContact CD1-CB 3.74Å; V236-M240 HydrophobicContact CG1-CE 4.37Å; V236-M240 HydrophobicContact CG2-CE 4.12Å; V236-M240 WeakPolarHBondContact O-CG 3.49Å; V236-M240 PolarHBondContact O-N 2.56Å; A237-M240 PolarHBondContact O-N 3.38Å; E238-M240 VanDerWaalsContact C-N 3.33Å; E238-M240 PolarHBondContact O-N 2.88Å; M240-Y242 VanDerWaalsContact C-N 3.34Å; M240-Y242 PolarHBondContact O-N 2.83Å; M240-A243 PolarHBondContact O-N 3.01Å; M240-Y244 WeakPolarHBondContact O-CD2 3.42Å; M240-Y244 PolarHBondContact O-N 2.88Å
241	C	98.9	Very high	98.7	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-58.4	-46.9	177.4	-66.8	0	0	0	0	111.5	A237 E238 T239 A243 Y244 M245 V252 V254	A237-C241 PolarHBondContact O-N 3.4Å; A237-C241 VanDerWaalsContact O-N 3.13Å; A237-C241 PolarHBondContact O-SG 3.24Å; E238-C241 WeakPolarHBondContact O-CB 3.26Å; E238-C241 PolarHBondContact O-N 3.37Å; T239-C241 PolarHBondContact O-N 3.02Å; C241-A243 PolarHBondContact O-N 3.3Å; C241-Y244 PolarHBondContact O-N 3.47Å; C241-M245 WeakPolarHBondContact O-CB 3.44Å; C241-M245 PolarHBondContact O-N 3.15Å; C241-V252 HydrophobicContact CB-CB 4.16Å; C241-V252 HydrophobicContact CB-CG1 4.08Å; C241-V252 HydrophobicContact CB-CG2 4.28Å; C241-V254 HydrophobicContact CB-CG2 4.45Å
242	Y	98.9	Very high	98.8	Very high	44 Å²	44	53.2 Å²	53.2	17%	0.173	28%	0.275	C	S	.	.	H	α-helix	trans	-71	-29.8	179.9	-69.1	-57.6	0	0	0	113.6	E238 T239 M240 M245 K246 V252 V254 S317 P319	E238-Y242 WeakPolarHBondContact O-CD2 3.5Å; E238-Y242 PolarHBondContact O-N 3.19Å; E238-Y242 VanDerWaalsContact O-N 3.13Å; T239-Y242 PolarHBondContact O-N 2.83Å; M240-Y242 VanDerWaalsContact C-N 3.34Å; M240-Y242 PolarHBondContact O-N 2.83Å; Y242-M245 HydrophobicContact CD1-CE 3.74Å; Y242-M245 HydrophobicContact CD1-SD 4.34Å; Y242-M245 HydrophobicContact CE1-CE 4.29Å; Y242-K246 WeakPolarHBondContact O-CB 3.28Å; Y242-K246 VanDerWaalsContact O-CG 3.31Å; Y242-K246 WeakPolarHBondContact O-CG 3.39Å; Y242-K246 PolarHBondContact O-N 3.13Å; Y242-V252 HydrophobicContact CD1-CG2 4.43Å; Y242-V252 HydrophobicContact CE1-CG2 4.36Å; Y242-V254 HydrophobicContact CE2-CG2 4.11Å; Y242-V254 WeakPolarHBondContact OH-CG2 3.38Å; Y242-S317 WeakPolarHBondContact CE1-O 3.46Å; Y242-S317 PolarHBondContact OH-O 3.19Å; Y242-P319 HydrophobicContact CE2-CG 4.15Å; Y242-P319 WeakPolarHBondContact OH-CD 3.14Å; Y242-P319 VanDerWaalsContact OH-CG 3.25Å; Y242-P319 WeakPolarHBondContact OH-CG 3.36Å; Y242-P319 VanDerWaalsContact OH-N 3.16Å
243	A	98.9	Very high	98.8	Very high	50 Å²	50	51 Å²	51	41%	0.413	26%	0.264	S	S	.	.	H	α-helix	trans	-64.8	-49.2	172.3	0	0	0	0	0	111.4	T239 M240 C241 M245 K246 Q247	T239-A243 WeakPolarHBondContact O-CB 3.28Å; T239-A243 PolarHBondContact O-N 2.92Å; M240-A243 PolarHBondContact O-N 3.01Å; C241-A243 PolarHBondContact O-N 3.3Å; A243-M245 VanDerWaalsContact C-N 3.34Å; A243-M245 PolarHBondContact O-N 3.29Å; A243-K246 PolarHBondContact O-N 3.29Å; A243-Q247 VanDerWaalsContact O-CB 3.27Å; A243-Q247 WeakPolarHBondContact O-CB 3.42Å; A243-Q247 PolarHBondContact O-N 3.47Å
244	Y	98.9	Very high	98.8	Very high	58 Å²	58	51 Å²	51	23%	0.227	26%	0.264	C	S	.	.	H	α-helix	trans	-63.1	-38.7	176.4	-89.4	-102.4	0	0	0	112.3	L183 L186 K190 M240 C241 E248 G249 V250	L183-Y244 HydrophobicContact CD2-CE2 4.02Å; L186-Y244 HydrophobicContact CB-CD1 3.88Å; L186-Y244 HydrophobicContact CB-CD2 3.97Å; L186-Y244 HydrophobicContact CB-CE1 3.9Å; L186-Y244 HydrophobicContact CB-CE2 4Å; L186-Y244 HydrophobicContact CB-CG 3.89Å; L186-Y244 HydrophobicContact CD1-CD2 3.73Å; L186-Y244 HydrophobicContact CD1-CE2 4.11Å; L186-Y244 HydrophobicContact CD1-CG 4.19Å; L186-Y244 HydrophobicContact CD2-CG 4.35Å; L186-Y244 HydrophobicContact CG-CD2 4.35Å; L186-Y244 HydrophobicContact CG-CG 4.38Å; K190-Y244 HydrophobicContact CD-CE1 4.48Å; M240-Y244 WeakPolarHBondContact O-CD2 3.42Å; M240-Y244 PolarHBondContact O-N 2.88Å; C241-Y244 PolarHBondContact O-N 3.47Å; Y244-E248 CarbonylContact O-C 3.58Å; Y244-E248 WeakPolarHBondContact O-CA 3.26Å; Y244-E248 WeakPolarHBondContact O-CB 3.23Å; Y244-E248 PolarHBondContact O-N 3.36Å; Y244-G249 PolarHBondContact O-N 2.82Å; Y244-V250 HydrophobicContact CD1-CG2 4.07Å; Y244-V250 PolarHBondContact O-N 3.49Å
245	M	98.8	Very high	98.8	Very high	52 Å²	52	50.7 Å²	50.7	26%	0.256	26%	0.263	S	S	.	.	H	α-helix	trans	-61.5	-47.7	175.5	-175.4	-174.3	75.8	0	0	112	C241 Y242 A243 G249 V250 V252	C241-M245 WeakPolarHBondContact O-CB 3.44Å; C241-M245 PolarHBondContact O-N 3.15Å; Y242-M245 HydrophobicContact CD1-CE 3.74Å; Y242-M245 HydrophobicContact CD1-SD 4.34Å; Y242-M245 HydrophobicContact CE1-CE 4.29Å; A243-M245 VanDerWaalsContact C-N 3.34Å; A243-M245 PolarHBondContact O-N 3.29Å; M245-G249 WeakPolarHBondContact O-CA 3.19Å; M245-G249 PolarHBondContact O-N 3.13Å; M245-V250 WeakPolarHBondContact CA-O 3.3Å; M245-V250 WeakPolarHBondContact CB-O 3.36Å; M245-V250 WeakPolarHBondContact CG-O 3.35Å; M245-V252 HydrophobicContact CB-CG1 4.49Å; M245-V252 HydrophobicContact CB-CG2 3.81Å; M245-V252 HydrophobicContact CG-CG2 4.11Å; M245-V252 HydrophobicContact SD-CG2 3.7Å
246	K	98.7	Very high	98.8	Very high	175 Å²	175	48.3 Å²	48.3	76%	0.761	25%	0.254	S	S	*	.	H	α-helix	trans	-71.4	-40.5	-177.4	-72.8	176.5	-178.9	-179.3	0	113	Y242 A243	Y242-K246 WeakPolarHBondContact O-CB 3.28Å; Y242-K246 VanDerWaalsContact O-CG 3.31Å; Y242-K246 WeakPolarHBondContact O-CG 3.39Å; Y242-K246 PolarHBondContact O-N 3.13Å; A243-K246 PolarHBondContact O-N 3.29Å
247	Q	98.7	Very high	98.8	Very high	153 Å²	153	47 Å²	47	72%	0.715	25%	0.245	S	C	*	.	H	α-helix	trans	-88.5	-35.8	-172.4	-173.6	63.2	28.1	0	0	112.8	A243	A243-Q247 VanDerWaalsContact O-CB 3.27Å; A243-Q247 WeakPolarHBondContact O-CB 3.42Å; A243-Q247 PolarHBondContact O-N 3.47Å
248	E	98.4	Very high	98.6	Very high	91 Å²	91	47.3 Å²	47.3	43%	0.425	25%	0.246	S	C	.	.	H	α-helix	trans	-123.6	1.7	-167.5	-57.2	-72.2	-166.6	0	0	112.8	K190 Y244 V250	K190-E248 HydrophobicContact CD-CB 4.12Å; K190-E248 HydrophobicContact CD-CG 4.1Å; K190-E248 VanDerWaalsContact CE-CD 3.46Å; K190-E248 WeakPolarHBondContact CE-OE2 3.45Å; K190-E248 HydrophobicContact CG-CB 4.43Å; K190-E248 IonicContact NZ-OE1 3.35Å; K190-E248 PolarHBondContact NZ-OE1 2.87Å; K190-E248 IonicContact NZ-OE2 3.38Å; K190-E248 PolarHBondContact NZ-OE2 2.98Å; Y244-E248 CarbonylContact O-C 3.58Å; Y244-E248 WeakPolarHBondContact O-CA 3.26Å; Y244-E248 WeakPolarHBondContact O-CB 3.23Å; Y244-E248 PolarHBondContact O-N 3.36Å; E248-V250 HydrophobicContact CB-CG2 4.25Å; E248-V250 PolarHBondContact O-N 2.97Å
249	G	98.4	Very high	98.3	Very high	59 Å²	59	48.5 Å²	48.5	61%	0.608	25%	0.253	S	S	*	.			trans	69.4	16	177	0	0	0	0	0	114.9	Y244 M245 E251	Y244-G249 PolarHBondContact O-N 2.82Å; M245-G249 WeakPolarHBondContact O-CA 3.19Å; M245-G249 PolarHBondContact O-N 3.13Å; G249-E251 PolarHBondContact O-N 3.09Å
250	V	98.8	Very high	98.2	Very high	9 Å²	9	44.5 Å²	44.5	6%	0.055	23%	0.228	C	C	.	.			trans	-64.6	128.4	178.4	-178.8	0	0	0	0	110.1	A189 K190 Y244 M245 E248 V252	A189-V250 HydrophobicContact CB-CG1 3.85Å; K190-V250 HydrophobicContact CB-CG2 3.8Å; K190-V250 HydrophobicContact CG-CG2 4.35Å; Y244-V250 HydrophobicContact CD1-CG2 4.07Å; Y244-V250 PolarHBondContact O-N 3.49Å; M245-V250 WeakPolarHBondContact CA-O 3.3Å; M245-V250 WeakPolarHBondContact CB-O 3.36Å; M245-V250 WeakPolarHBondContact CG-O 3.35Å; E248-V250 HydrophobicContact CB-CG2 4.25Å; E248-V250 PolarHBondContact O-N 2.97Å; V250-V252 HydrophobicContact CB-CG1 4.45Å; V250-V252 HydrophobicContact CG1-CG1 4.01Å; V250-V252 PolarHBondContact O-N 3.35Å
251	E	98.9	Very high	98.1	Very high	98 Å²	98	43.2 Å²	43.2	46%	0.458	22%	0.222	S	C	.	.			trans	-74.4	110.8	175.1	-62.9	-169.5	170.3	0	0	110.7	R195 L196 G249	R195-E251 CarbonylContact C-O 3.56Å; R195-E251 WeakPolarHBondContact CA-O 3.46Å; R195-E251 HydrophobicContact CB-CB 4.14Å; R195-E251 HydrophobicContact CG-CB 3.89Å; R195-E251 WeakPolarHBondContact CG-O 3.33Å; R195-E251 IonicContact CZ-OE2 3.42Å; R195-E251 IonicContact NE-OE2 3.5Å; R195-E251 PolarHBondContact NE-OE2 3.43Å; R195-E251 IonicContact NH2-OE1 3.93Å; R195-E251 IonicContact NH2-OE2 3.93Å; R195-E251 PolarHBondContact NH2-OE2 2.86Å; L196-E251 PolarHBondContact N-O 3.12Å; G249-E251 PolarHBondContact O-N 3.09Å
252	V	98.9	Very high	97.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	150.2	-179.2	-57.9	0	0	0	0	112.7	L186 L196 C241 Y242 M245 V250 S317	L186-V252 HydrophobicContact CD2-CG1 4.11Å; L196-V252 CarbonylContact O-C 3.57Å; L196-V252 VanDerWaalsContact O-CA 3.25Å; L196-V252 WeakPolarHBondContact O-CA 3.46Å; C241-V252 HydrophobicContact CB-CB 4.16Å; C241-V252 HydrophobicContact CB-CG1 4.08Å; C241-V252 HydrophobicContact CB-CG2 4.28Å; Y242-V252 HydrophobicContact CD1-CG2 4.43Å; Y242-V252 HydrophobicContact CE1-CG2 4.36Å; M245-V252 HydrophobicContact CB-CG1 4.49Å; M245-V252 HydrophobicContact CB-CG2 3.81Å; M245-V252 HydrophobicContact CG-CG2 4.11Å; M245-V252 HydrophobicContact SD-CG2 3.7Å; V250-V252 HydrophobicContact CB-CG1 4.45Å; V250-V252 HydrophobicContact CG1-CG1 4.01Å; V250-V252 PolarHBondContact O-N 3.35Å; V252-S317 WeakPolarHBondContact O-CA 3.38Å
253	R	98.9	Very high	97.7	Very high	12 Å²	12	42.3 Å²	42.3	5%	0.045	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	138.7	171.6	-57.9	-65.8	178.6	-85.4	2.2	108.1	R195 L196 L197 L198 L311 S314 I316	R195-R253 HydrophobicContact CG-CG 4.39Å; L196-R253 PolarHBondContact O-N 3.45Å; L197-R253 CarbonylContact C-O 3.56Å; L197-R253 VanDerWaalsContact CA-O 3.28Å; L197-R253 WeakPolarHBondContact CA-O 3.5Å; L197-R253 HydrophobicContact CB-CB 3.96Å; L197-R253 HydrophobicContact CD1-CB 4.01Å; L197-R253 HydrophobicContact CG-CB 3.89Å; L198-R253 PolarHBondContact N-O 2.92Å; R253-L311 HydrophobicContact CB-CG 4.2Å; R253-L311 WeakPolarHBondContact CD-O 3.47Å; R253-S314 VanDerWaalsContact CZ-O 3.28Å; R253-S314 PolarHBondContact NE-O 3.45Å; R253-S314 PolarHBondContact NH2-O 3.02Å; R253-I316 WeakPolarHBondContact CD-O 3.42Å; R253-I316 PolarHBondContact NE-O 2.63Å
254	V	98.9	Very high	97.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	113.7	-178.9	178.5	0	0	0	0	109.3	L198 E238 C241 Y242 P319 V320	L198-V254 HydrophobicContact CB-CG2 4.48Å; E238-V254 HydrophobicContact CG-CG1 3.82Å; C241-V254 HydrophobicContact CB-CG2 4.45Å; Y242-V254 HydrophobicContact CE2-CG2 4.11Å; Y242-V254 WeakPolarHBondContact OH-CG2 3.38Å; V254-P319 HydrophobicContact CB-CB 4.33Å; V254-P319 HydrophobicContact CG1-CB 4.14Å; V254-P319 HydrophobicContact CG1-CG 4.42Å; V254-P319 WeakPolarHBondContact O-CA 3.34Å; V254-V320 PolarHBondContact O-N 3.23Å
255	A	98.9	Very high	97.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	117.5	174	0	0	0	0	0	109.6	L197 L198 S200 I257 L308 L311 L322	L197-A255 HydrophobicContact CD2-CB 4.27Å; L198-A255 PolarHBondContact O-N 3.32Å; S200-A255 CarbonylContact C-O 3.57Å; S200-A255 VanDerWaalsContact C-O 3.28Å; S200-A255 VanDerWaalsContact CA-O 3.22Å; S200-A255 WeakPolarHBondContact CA-O 3.34Å; S200-A255 VanDerWaalsContact CB-O 3.24Å; S200-A255 WeakPolarHBondContact CB-O 3.44Å; S200-A255 PolarHBondContact N-O 3.46Å; A255-I257 HydrophobicContact CB-CG1 4.13Å; A255-I257 PolarHBondContact O-N 2.95Å; A255-L308 HydrophobicContact CB-CD2 3.64Å; A255-L311 HydrophobicContact CB-CD2 3.86Å; A255-L322 HydrophobicContact CB-CD1 3.92Å
256	R	98.7	Very high	96.5	Very high	25 Å²	25	39.6 Å²	39.6	9%	0.094	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	99.4	170	-72.9	-179.5	179.8	164.9	1	108.6	V204 Y205 E215 E238 P319 V320 N321 L322	V204-R256 HydrophobicContact CG2-CG 4.34Å; Y205-R256 VanDerWaalsContact CE1-NH1 3.29Å; Y205-R256 WeakPolarHBondContact OH-CD 3.37Å; Y205-R256 PolarHBondContact OH-NH1 2.89Å; E215-R256 PolarHBondContact O-NH1 2.81Å; E238-R256 WeakPolarHBondContact OE1-CG 3.47Å; E238-R256 IonicContact OE1-CZ 3.5Å; E238-R256 IonicContact OE1-NE 2.67Å; E238-R256 PolarHBondContact OE1-NE 3.03Å; E238-R256 IonicContact OE1-NH2 3.02Å; E238-R256 IonicContact OE2-CZ 2.7Å; E238-R256 IonicContact OE2-NE 2.89Å; E238-R256 PolarHBondContact OE2-NE 3.43Å; E238-R256 IonicContact OE2-NH2 3.19Å; E238-R256 PolarHBondContact OE2-NH2 3.21Å; R256-P319 HydrophobicContact CG-CB 4.39Å; R256-V320 PolarHBondContact N-O 3.34Å; R256-N321 WeakPolarHBondContact O-CA 3.46Å; R256-L322 PolarHBondContact O-N 2.88Å
257	I	98.4	Very high	95.7	Very high	26 Å²	26	32 Å²	32	13%	0.133	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	128.5	-170	-57.2	174.7	0	0	0	110.2	A199 S200 S202 A255 L304 L308	A199-I257 HydrophobicContact CB-CD1 3.77Å; S200-I257 PolarHBondContact O-N 3.36Å; S202-I257 PolarHBondContact N-O 3.09Å; S202-I257 PolarHBondContact OG-O 2.96Å; A255-I257 HydrophobicContact CB-CG1 4.13Å; A255-I257 PolarHBondContact O-N 2.95Å; I257-L304 HydrophobicContact CB-CD1 4.49Å; I257-L304 HydrophobicContact CD1-CD1 4.25Å; I257-L304 HydrophobicContact CD1-CD2 4.39Å; I257-L304 HydrophobicContact CG1-CD1 4.02Å; I257-L304 HydrophobicContact CG2-CD1 3.85Å; I257-L304 HydrophobicContact CG2-CD2 3.71Å; I257-L304 HydrophobicContact CG2-CG 4.45Å; I257-L308 HydrophobicContact CD1-CD2 4.29Å
258	F	95.5	Very high	94.7	Very high	7 Å²	7	30.4 Å²	30.4	3%	0.031	16%	0.164	C	C	.	.			trans	-91.9	174.2	172.9	-76.9	-109.9	0	0	0	111.3	Y205 Q213 T260 N321 L322 R360 P362	Y205-F258 HydrophobicContact CD2-CZ 4.19Å; Y205-F258 HydrophobicContact CE2-CE2 4.11Å; Y205-F258 AromaticContact CE2-CZ 3.83Å; Y205-F258 HydrophobicContact CE2-CZ 3.83Å; Q213-F258 HydrophobicContact CB-CZ 4.44Å; F258-T260 PolarHBondContact O-N 3.27Å; F258-T260 PolarHBondContact O-OG1 2.84Å; F258-N321 HydrophobicContact CE2-CB 3.98Å; F258-L322 PolarHBondContact N-O 2.91Å; F258-R360 HydrophobicContact CD1-CG 3.91Å; F258-R360 HydrophobicContact CE1-CG 3.71Å; F258-P362 HydrophobicContact CD1-CB 3.72Å; F258-P362 HydrophobicContact CD1-CG 3.91Å; F258-P362 HydrophobicContact CD2-CB 3.71Å; F258-P362 HydrophobicContact CD2-CG 4.43Å; F258-P362 HydrophobicContact CE1-CB 3.61Å; F258-P362 HydrophobicContact CE1-CG 4.2Å; F258-P362 HydrophobicContact CE2-CB 3.63Å; F258-P362 HydrophobicContact CG-CB 3.76Å; F258-P362 HydrophobicContact CG-CG 4.04Å; F258-P362 HydrophobicContact CZ-CB 3.57Å
259	N	92.8	Very high	93.6	Very high	38 Å²	38	26.5 Å²	26.5	20%	0.203	15%	0.146	C	C	.	.			trans	-53.6	113.8	-172.4	-67.2	14.2	0	0	0	111.4	F298 Q299	N259-F298 HydrophobicContact CB-CD1 4.04Å; N259-F298 HydrophobicContact CB-CE1 4.33Å; N259-F298 WeakPolarHBondContact O-CA 3.35Å; N259-Q299 PolarHBondContact O-N 3.16Å
260	T	95.9	Very high	92.4	Very high	8 Å²	8	25.2 Å²	25.2	5%	0.049	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	138.9	-176.7	-58.9	0	0	0	0	110.6	F98 F258 R271 Q299 V301 L304	F98-T260 HydrophobicContact CE1-CG2 4.16Å; F98-T260 HydrophobicContact CZ-CG2 4.25Å; F258-T260 PolarHBondContact O-N 3.27Å; F258-T260 PolarHBondContact O-OG1 2.84Å; T260-R271 PolarHBondContact O-NH1 3.04Å; T260-Q299 CarbonylContact C-O 3.55Å; T260-Q299 VanDerWaalsContact CA-O 3.24Å; T260-Q299 WeakPolarHBondContact CA-O 3.31Å; T260-V301 HydrophobicContact CG2-CB 4.08Å; T260-V301 HydrophobicContact CG2-CG2 4.33Å; T260-L304 HydrophobicContact CG2-CB 4.15Å; T260-L304 HydrophobicContact CG2-CD2 3.81Å
261	F	96.2	Very high	91.6	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.009	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	161	178.9	79.5	-79.6	0	0	0	112.6	F98 M265 V273 F298 Q299 Y300 V301 L379 G382 L383 T386	F98-F261 VanDerWaalsContact CZ-C 3.44Å; F261-M265 WeakPolarHBondContact CA-SD 3.39Å; F261-M265 HydrophobicContact CB-CE 4.49Å; F261-M265 HydrophobicContact CB-SD 3.75Å; F261-V273 HydrophobicContact CB-CB 4.25Å; F261-V273 HydrophobicContact CB-CG1 3.97Å; F261-V273 HydrophobicContact CB-CG2 4.1Å; F261-V273 HydrophobicContact CD2-CG1 4Å; F261-V273 HydrophobicContact CG-CG1 4.15Å; F261-F298 HydrophobicContact CD1-CB 3.82Å; F261-F298 HydrophobicContact CE1-CB 3.92Å; F261-Q299 WeakPolarHBondContact CD1-O 3.46Å; F261-Q299 PolarHBondContact N-O 3.03Å; F261-Y300 HydrophobicContact CD2-CD2 4.39Å; F261-Y300 AromaticContact CE2-CD2 3.93Å; F261-Y300 HydrophobicContact CE2-CD2 3.93Å; F261-Y300 HydrophobicContact CZ-CD2 4.02Å; F261-V301 PolarHBondContact O-N 3.27Å; F261-L379 HydrophobicContact CE1-CD1 3.74Å; F261-L379 HydrophobicContact CZ-CD1 3.72Å; F261-G382 VanDerWaalsContact CE2-C 3.42Å; F261-L383 HydrophobicContact CD2-CD2 4.26Å; F261-L383 HydrophobicContact CE2-CD2 3.8Å; F261-L383 HydrophobicContact CE2-CG 4.04Å; F261-L383 HydrophobicContact CZ-CD2 4.35Å; F261-L383 HydrophobicContact CZ-CG 4.28Å; F261-T386 HydrophobicContact CD2-CG2 4.45Å
262	G	96.4	Very high	90.9	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.13	C	C	.	.			trans	161.8	-176.3	-177.2	0	0	0	0	0	113.5	M265 T386	G262-M265 PolarHBondContact N-SD 3.12Å; G262-M265 VanDerWaalsContact N-SD 3.36Å; G262-M265 VanDerWaalsContact O-CG 3.24Å; G262-M265 WeakPolarHBondContact O-CG 3.4Å; G262-T386 WeakPolarHBondContact CA-OG1 3.26Å
263	S	94.8	Very high	90.4	Very high	25 Å²	25	25 Å²	25	18%	0.175	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	156.1	172.3	53.9	0	0	0	0	111.6	F98 H102 M265	F98-S263 WeakPolarHBondContact CD2-O 3.41Å; F98-S263 WeakPolarHBondContact CE2-O 3.36Å; H102-S263 PolarHBondContact CE1-OG 3.37Å; H102-S263 PolarHBondContact NE2-O 3.39Å; S263-M265 PolarHBondContact O-N 3.38Å
264	R	94.9	Very high	89.8	Confident	46 Å²	46	24.5 Å²	24.5	17%	0.174	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	5.4	-175.3	-50	176.1	-176.7	151.1	2	115.8	F98 S101 D105 Y389	F98-R264 HydrophobicContact CD2-CB 4.49Å; S101-R264 PolarHBondContact O-NH1 3.11Å; S101-R264 WeakPolarHBondContact OG-CD 3.36Å; S101-R264 PolarHBondContact OG-NH1 2.94Å; D105-R264 IonicContact OD1-NH1 2.67Å; D105-R264 IonicContact OD1-NH2 3.27Å; D105-R264 IonicContact OD2-CZ 3.58Å; D105-R264 IonicContact OD2-NH1 2.81Å; D105-R264 PolarHBondContact OD2-NH1 3.28Å; D105-R264 IonicContact OD2-NH2 3.37Å; D105-R264 PolarHBondContact OD2-NH2 2.93Å; R264-Y389 VanDerWaalsContact CA-CZ 3.5Å; R264-Y389 HydrophobicContact CG-CE2 4.24Å; R264-Y389 VanDerWaalsContact N-CZ 3.28Å
265	M	91.4	Very high	89.4	Confident	3 Å²	3	26.5 Å²	26.5	2%	0.015	14%	0.14	C	C	.	.			trans	-58.3	140.6	160.9	-73.9	178	76.2	0	0	109.8	F98 F261 G262 S263 F390	F98-M265 HydrophobicContact CD1-CG 3.67Å; F98-M265 HydrophobicContact CD2-CG 3.81Å; F98-M265 HydrophobicContact CE1-CG 3.59Å; F98-M265 HydrophobicContact CE1-SD 4.19Å; F98-M265 HydrophobicContact CE2-CG 3.75Å; F98-M265 HydrophobicContact CG-CG 3.79Å; F98-M265 HydrophobicContact CZ-CG 3.63Å; F98-M265 HydrophobicContact CZ-SD 4.2Å; F261-M265 WeakPolarHBondContact CA-SD 3.39Å; F261-M265 HydrophobicContact CB-CE 4.49Å; F261-M265 HydrophobicContact CB-SD 3.75Å; G262-M265 PolarHBondContact N-SD 3.12Å; G262-M265 VanDerWaalsContact N-SD 3.36Å; G262-M265 VanDerWaalsContact O-CG 3.24Å; G262-M265 WeakPolarHBondContact O-CG 3.4Å; S263-M265 PolarHBondContact O-N 3.38Å; M265-F390 HydrophobicContact CB-CZ 3.9Å
266	H	83.6	Confident	89.1	Confident	55 Å²	55	26.7 Å²	26.7	26%	0.255	14%	0.14	S	C	.	.			trans	-65.9	139.2	176.8	-166.3	-84.6	0	0	0	109.6	R124 N268 D269	R124-H266 PolarHBondContact NH2-CD2 3.02Å; R124-H266 PolarHBondContact NH2-CE1 3.36Å; R124-H266 PolarHBondContact NH2-NE2 2.91Å; H266-N268 VanDerWaalsContact C-N 3.34Å; H266-N268 PolarHBondContact ND1-N 3.44Å; H266-N268 VanDerWaalsContact ND1-N 3.1Å; H266-N268 PolarHBondContact O-N 2.78Å; H266-D269 HydrophobicContact CB-CB 4.14Å; H266-D269 WeakPolarHBondContact O-CB 3.48Å; H266-D269 PolarHBondContact O-N 3.37Å; H266-D269 VanDerWaalsContact O-N 3.09Å
267	M	82.6	Confident	88.9	Confident	15 Å²	15	25.5 Å²	25.5	7%	0.074	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-62.3	-42.7	179.7	-71.8	166.8	40.2	0	0	112.2	D269 L278 F390 E393 L394 Q397	M267-D269 PolarHBondContact O-N 3.01Å; M267-L278 HydrophobicContact CB-CD1 3.87Å; M267-L278 HydrophobicContact CG-CD1 4.36Å; M267-L278 HydrophobicContact CG-CD2 4.35Å; M267-L278 WeakPolarHBondContact O-CD1 3.44Å; M267-F390 HydrophobicContact CB-CE1 4.46Å; M267-F390 HydrophobicContact CG-CD1 3.88Å; M267-F390 HydrophobicContact CG-CE1 3.8Å; M267-E393 HydrophobicContact SD-CB 4.06Å; M267-L394 HydrophobicContact CE-CD2 4.26Å; M267-Q397 VanDerWaalsContact CE-CD 3.45Å; M267-Q397 VanDerWaalsContact CE-OE1 3.29Å; M267-Q397 PolarHBondContact SD-NE2 2.8Å; M267-Q397 VanDerWaalsContact SD-NE2 3.44Å
268	N	77.3	Confident	88.6	Confident	119 Å²	119	24.9 Å²	24.9	64%	0.636	13%	0.133	S	C	*	.	G	3₁₀ helix	trans	-88.6	30.9	175.3	-53.6	-12.9	0	0	0	111.9	H266 G270	H266-N268 VanDerWaalsContact C-N 3.34Å; H266-N268 PolarHBondContact ND1-N 3.44Å; H266-N268 VanDerWaalsContact ND1-N 3.1Å; H266-N268 PolarHBondContact O-N 2.78Å; N268-G270 PolarHBondContact O-N 2.78Å
269	D	75.8	Confident	88.6	Confident	10 Å²	10	26.1 Å²	26.1	5%	0.053	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-62.9	-31.5	178.5	173.1	89.7	0	0	0	111.7	S163 H266 M267 R271	S163-D269 WeakPolarHBondContact CB-O 3.46Å; S163-D269 WeakPolarHBondContact CB-OD1 3.38Å; S163-D269 PolarHBondContact OG-O 3.09Å; H266-D269 HydrophobicContact CB-CB 4.14Å; H266-D269 WeakPolarHBondContact O-CB 3.48Å; H266-D269 PolarHBondContact O-N 3.37Å; H266-D269 VanDerWaalsContact O-N 3.09Å; M267-D269 PolarHBondContact O-N 3.01Å; D269-R271 VanDerWaalsContact C-N 3.28Å; D269-R271 VanDerWaalsContact CG-NE 3.27Å; D269-R271 VanDerWaalsContact CG-NH2 3.29Å; D269-R271 PolarHBondContact O-N 3.48Å; D269-R271 IonicContact OD1-CZ 2.83Å; D269-R271 IonicContact OD1-NE 3.18Å; D269-R271 PolarHBondContact OD1-NE 3.23Å; D269-R271 IonicContact OD1-NH2 3.29Å; D269-R271 PolarHBondContact OD1-NH2 2.87Å; D269-R271 WeakPolarHBondContact OD2-CB 3.47Å; D269-R271 WeakPolarHBondContact OD2-CD 3.32Å; D269-R271 WeakPolarHBondContact OD2-CG 3.26Å; D269-R271 IonicContact OD2-CZ 3.96Å; D269-R271 PolarHBondContact OD2-N 3.29Å; D269-R271 IonicContact OD2-NE 3.34Å; D269-R271 PolarHBondContact OD2-NE 3.28Å; D269-R271 IonicContact OD2-NH2 2.78Å; D269-R271 PolarHBondContact OD2-NH2 3.08Å
270	G	72.4	Confident	88.7	Confident	31 Å²	31	24.4 Å²	24.4	32%	0.32	13%	0.13	S	C	.	.			trans	82.4	-2.1	173.2	0	0	0	0	0	114.5	N268 N275	N268-G270 PolarHBondContact O-N 2.78Å; G270-N275 WeakPolarHBondContact CA-OD1 3.43Å; G270-N275 PolarHBondContact O-ND2 3.02Å
271	R	82.4	Confident	88.5	Confident	64 Å²	64	26.4 Å²	26.4	24%	0.242	14%	0.14	C	C	.	.	S	Bend	trans	-77	158.8	170.5	-67.5	177.4	-80.8	161.2	2.8	111	T260 D269 V273 S274 N275	T260-R271 PolarHBondContact O-NH1 3.04Å; D269-R271 VanDerWaalsContact C-N 3.28Å; D269-R271 VanDerWaalsContact CG-NE 3.27Å; D269-R271 VanDerWaalsContact CG-NH2 3.29Å; D269-R271 PolarHBondContact O-N 3.48Å; D269-R271 IonicContact OD1-CZ 2.83Å; D269-R271 IonicContact OD1-NE 3.18Å; D269-R271 PolarHBondContact OD1-NE 3.23Å; D269-R271 IonicContact OD1-NH2 3.29Å; D269-R271 PolarHBondContact OD1-NH2 2.87Å; D269-R271 WeakPolarHBondContact OD2-CB 3.47Å; D269-R271 WeakPolarHBondContact OD2-CD 3.32Å; D269-R271 WeakPolarHBondContact OD2-CG 3.26Å; D269-R271 IonicContact OD2-CZ 3.96Å; D269-R271 PolarHBondContact OD2-N 3.29Å; D269-R271 IonicContact OD2-NE 3.34Å; D269-R271 PolarHBondContact OD2-NE 3.28Å; D269-R271 IonicContact OD2-NH2 2.78Å; D269-R271 PolarHBondContact OD2-NH2 3.08Å; R271-V273 VanDerWaalsContact C-N 3.34Å; R271-V273 PolarHBondContact O-N 2.81Å; R271-S274 PolarHBondContact O-N 2.85Å; R271-S274 PolarHBondContact O-OG 3.18Å; R271-N275 PolarHBondContact O-N 3.28Å; R271-N275 VanDerWaalsContact O-N 3.12Å; R271-N275 PolarHBondContact O-OD1 3.03Å
272	V	85	Confident	88.4	Confident	36 Å²	36	31.9 Å²	31.9	22%	0.218	17%	0.166	C	C	.	.	H	α-helix	trans	-58.4	-38.8	-171.5	65.7	0	0	0	0	114.1	N275 F276 F298 I330	V272-N275 PolarHBondContact O-N 3.15Å; V272-F276 HydrophobicContact CG2-CD1 4.49Å; V272-F276 HydrophobicContact CG2-CD2 3.68Å; V272-F276 HydrophobicContact CG2-CE1 4.16Å; V272-F276 HydrophobicContact CG2-CE2 3.27Å; V272-F276 HydrophobicContact CG2-CG 4.28Å; V272-F276 HydrophobicContact CG2-CZ 3.53Å; V272-F276 WeakPolarHBondContact O-CB 3.34Å; V272-F276 WeakPolarHBondContact O-CG 3.38Å; V272-F276 PolarHBondContact O-N 3.2Å; V272-F298 HydrophobicContact CG1-CE1 3.75Å; V272-F298 HydrophobicContact CG1-CZ 3.45Å; V272-F298 VanDerWaalsContact CG1-CZ 3.45Å; V272-I330 HydrophobicContact CG1-CD1 4.33Å; V272-I330 HydrophobicContact CG2-CD1 4.18Å; V272-I330 HydrophobicContact CG2-CG2 4.39Å
273	V	86.5	Confident	88.2	Confident	4 Å²	4	34.3 Å²	34.3	2%	0.024	19%	0.191	C	C	.	.	H	α-helix	trans	-63.7	-51.5	-179.2	-173.2	0	0	0	0	112.1	F261 R271 N275 I277 F298 F333 L383	F261-V273 HydrophobicContact CB-CB 4.25Å; F261-V273 HydrophobicContact CB-CG1 3.97Å; F261-V273 HydrophobicContact CB-CG2 4.1Å; F261-V273 HydrophobicContact CD2-CG1 4Å; F261-V273 HydrophobicContact CG-CG1 4.15Å; R271-V273 VanDerWaalsContact C-N 3.34Å; R271-V273 PolarHBondContact O-N 2.81Å; V273-N275 VanDerWaalsContact C-N 3.35Å; V273-N275 PolarHBondContact O-N 3.3Å; V273-I277 HydrophobicContact CG1-CD1 3.83Å; V273-I277 VanDerWaalsContact O-CG1 3.28Å; V273-I277 WeakPolarHBondContact O-CG1 3.11Å; V273-I277 PolarHBondContact O-N 3.28Å; V273-F298 HydrophobicContact CG2-CD1 3.68Å; V273-F298 HydrophobicContact CG2-CE1 3.53Å; V273-F298 HydrophobicContact CG2-CG 4.37Å; V273-F298 HydrophobicContact CG2-CZ 4.12Å; V273-F333 HydrophobicContact CB-CE1 4.19Å; V273-F333 HydrophobicContact CB-CZ 4.17Å; V273-F333 HydrophobicContact CG1-CE1 4.34Å; V273-F333 HydrophobicContact CG1-CZ 3.97Å; V273-F333 HydrophobicContact CG2-CE1 3.76Å; V273-F333 HydrophobicContact CG2-CZ 3.6Å; V273-L383 HydrophobicContact CG1-CD2 4.09Å
274	S	87.4	Confident	88.2	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.2	-40.8	178.5	44.9	0	0	0	0	111.7	R271 L278	R271-S274 PolarHBondContact O-N 2.85Å; R271-S274 PolarHBondContact O-OG 3.18Å; S274-L278 WeakPolarHBondContact O-CB 3.29Å; S274-L278 VanDerWaalsContact O-CG 3.26Å; S274-L278 WeakPolarHBondContact O-CG 3.47Å; S274-L278 PolarHBondContact O-N 3.29Å
275	N	90	Very high	88.2	Confident	43 Å²	43	38.4 Å²	38.4	23%	0.23	21%	0.213	C	C	.	.	H	α-helix	trans	-64.7	-49.2	-177.9	-70.4	2.8	0	0	0	111.6	G270 R271 V272 V273 I277 L278 Q279	G270-N275 WeakPolarHBondContact CA-OD1 3.43Å; G270-N275 PolarHBondContact O-ND2 3.02Å; R271-N275 PolarHBondContact O-N 3.28Å; R271-N275 VanDerWaalsContact O-N 3.12Å; R271-N275 PolarHBondContact O-OD1 3.03Å; V272-N275 PolarHBondContact O-N 3.15Å; V273-N275 VanDerWaalsContact C-N 3.35Å; V273-N275 PolarHBondContact O-N 3.3Å; N275-I277 PolarHBondContact O-N 3.44Å; N275-L278 PolarHBondContact O-N 3.13Å; N275-Q279 VanDerWaalsContact O-CB 3.28Å; N275-Q279 WeakPolarHBondContact O-CB 3.24Å; N275-Q279 WeakPolarHBondContact O-CG 3.44Å; N275-Q279 PolarHBondContact O-N 3.05Å; N275-Q279 PolarHBondContact O-OE1 3.08Å
276	F	93.8	Very high	88.3	Confident	3 Å²	3	38.3 Å²	38.3	1%	0.013	21%	0.213	C	C	.	.	H	α-helix	trans	-64.1	-41	179.7	-72.1	-13.3	0	0	0	112.7	V272 A280 L286 T287 V288 I330 F333 A334 I337	V272-F276 HydrophobicContact CG2-CD1 4.49Å; V272-F276 HydrophobicContact CG2-CD2 3.68Å; V272-F276 HydrophobicContact CG2-CE1 4.16Å; V272-F276 HydrophobicContact CG2-CE2 3.27Å; V272-F276 HydrophobicContact CG2-CG 4.28Å; V272-F276 HydrophobicContact CG2-CZ 3.53Å; V272-F276 WeakPolarHBondContact O-CB 3.34Å; V272-F276 WeakPolarHBondContact O-CG 3.38Å; V272-F276 PolarHBondContact O-N 3.2Å; F276-A280 WeakPolarHBondContact O-CB 3.35Å; F276-A280 PolarHBondContact O-N 2.97Å; F276-L286 HydrophobicContact CB-CD2 4.17Å; F276-L286 HydrophobicContact CB-CG 4.41Å; F276-L286 HydrophobicContact CD1-CB 4.14Å; F276-L286 HydrophobicContact CD1-CD2 4.36Å; F276-L286 HydrophobicContact CD1-CG 4.13Å; F276-L286 HydrophobicContact CE1-CB 4.37Å; F276-L286 HydrophobicContact CG-CD2 4.21Å; F276-L286 HydrophobicContact CG-CG 4.41Å; F276-T287 WeakPolarHBondContact CE1-O 3.24Å; F276-V288 HydrophobicContact CE1-CG2 4.39Å; F276-V288 HydrophobicContact CZ-CG2 3.88Å; F276-I330 HydrophobicContact CE2-CG2 3.91Å; F276-I330 HydrophobicContact CZ-CG2 3.8Å; F276-F333 AromaticContact CD2-CD1 3.83Å; F276-F333 HydrophobicContact CD2-CD1 3.83Å; F276-F333 HydrophobicContact CD2-CE1 4.31Å; F276-F333 HydrophobicContact CE2-CD1 4.18Å; F276-A334 HydrophobicContact CD2-CB 4.03Å; F276-A334 HydrophobicContact CE2-CB 3.68Å; F276-A334 HydrophobicContact CZ-CB 4.08Å; F276-I337 HydrophobicContact CB-CD1 3.59Å; F276-I337 HydrophobicContact CB-CG2 4.2Å; F276-I337 HydrophobicContact CD2-CD1 4.16Å; F276-I337 HydrophobicContact CG-CD1 4.42Å
277	I	93.6	Very high	88.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.3	-47	177.8	-68.5	171.3	0	0	0	110.4	V273 N275 A280 L281 I337 L383 T386 I387 F390	V273-I277 HydrophobicContact CG1-CD1 3.83Å; V273-I277 VanDerWaalsContact O-CG1 3.28Å; V273-I277 WeakPolarHBondContact O-CG1 3.11Å; V273-I277 PolarHBondContact O-N 3.28Å; N275-I277 PolarHBondContact O-N 3.44Å; I277-A280 PolarHBondContact O-N 2.85Å; I277-L281 HydrophobicContact CG2-CD1 3.63Å; I277-L281 HydrophobicContact CG2-CG 4.29Å; I277-L281 WeakPolarHBondContact O-CB 3.28Å; I277-L281 VanDerWaalsContact O-CG 3.26Å; I277-L281 WeakPolarHBondContact O-CG 3.46Å; I277-L281 PolarHBondContact O-N 3.41Å; I277-I337 HydrophobicContact CG1-CD1 3.96Å; I277-I337 HydrophobicContact CG1-CG1 4.28Å; I277-I337 HydrophobicContact CG1-CG2 3.99Å; I277-L383 HydrophobicContact CD1-CD2 4.36Å; I277-T386 HydrophobicContact CD1-CG2 3.73Å; I277-I387 HydrophobicContact CD1-CG1 3.97Å; I277-I387 HydrophobicContact CG1-CG1 3.98Å; I277-I387 HydrophobicContact CG2-CB 4.49Å; I277-I387 HydrophobicContact CG2-CG1 3.95Å; I277-F390 HydrophobicContact CB-CD2 4.37Å; I277-F390 HydrophobicContact CD1-CD2 4.36Å; I277-F390 HydrophobicContact CG2-CB 4Å; I277-F390 HydrophobicContact CG2-CD2 3.81Å; I277-F390 HydrophobicContact CG2-CG 4.26Å
278	L	92.6	Very high	89.1	Confident	14 Å²	14	36.2 Å²	36.2	7%	0.073	21%	0.205	C	C	.	.	H	α-helix	trans	-65.7	-44.7	179.4	-70.4	169.3	0	0	0	111.9	M267 S274 N275 A280 L281 Q282 F390 L394	M267-L278 HydrophobicContact CB-CD1 3.87Å; M267-L278 HydrophobicContact CG-CD1 4.36Å; M267-L278 HydrophobicContact CG-CD2 4.35Å; M267-L278 WeakPolarHBondContact O-CD1 3.44Å; S274-L278 WeakPolarHBondContact O-CB 3.29Å; S274-L278 VanDerWaalsContact O-CG 3.26Å; S274-L278 WeakPolarHBondContact O-CG 3.47Å; S274-L278 PolarHBondContact O-N 3.29Å; N275-L278 PolarHBondContact O-N 3.13Å; L278-A280 VanDerWaalsContact C-N 3.34Å; L278-A280 PolarHBondContact O-N 2.97Å; L278-L281 PolarHBondContact O-N 3.49Å; L278-Q282 WeakPolarHBondContact O-CB 3.17Å; L278-Q282 VanDerWaalsContact O-CG 3.25Å; L278-Q282 WeakPolarHBondContact O-CG 3.43Å; L278-Q282 PolarHBondContact O-N 3.44Å; L278-Q282 PolarHBondContact O-OE1 3.03Å; L278-F390 HydrophobicContact CD2-CB 4.35Å; L278-F390 HydrophobicContact CD2-CD1 4.08Å; L278-F390 HydrophobicContact CD2-CG 4.36Å; L278-L394 HydrophobicContact CD2-CD1 4.21Å; L278-L394 HydrophobicContact CD2-CD2 4.19Å; L278-L394 HydrophobicContact CD2-CG 4.25Å
279	Q	94.4	Very high	89.5	Confident	32 Å²	32	35.6 Å²	35.6	15%	0.15	19%	0.194	C	C	.	.	H	α-helix	trans	-57.7	-47.5	175.2	-75.3	166.1	-19.7	0	0	111	N275 Q282 G283 E284 P285 L286 T287 S345	N275-Q279 VanDerWaalsContact O-CB 3.28Å; N275-Q279 WeakPolarHBondContact O-CB 3.24Å; N275-Q279 WeakPolarHBondContact O-CG 3.44Å; N275-Q279 PolarHBondContact O-N 3.05Å; N275-Q279 PolarHBondContact O-OE1 3.08Å; Q279-Q282 PolarHBondContact O-N 3.02Å; Q279-G283 PolarHBondContact O-N 2.91Å; Q279-E284 CarbonylContact C-O 3.04Å; Q279-E284 HydrophobicContact CB-CB 4.25Å; Q279-E284 HydrophobicContact CG-CB 4.29Å; Q279-E284 PolarHBondContact O-N 3.18Å; Q279-P285 PolarHBondContact OE1-O 3.22Å; Q279-L286 HydrophobicContact CB-CD1 4.2Å; Q279-L286 HydrophobicContact CB-CG 4.39Å; Q279-T287 PolarHBondContact NE2-OG1 3.32Å; Q279-S345 PolarHBondContact O-OG 2.76Å
280	A	95	Very high	89.9	Confident	3 Å²	3	35.8 Å²	35.8	3%	0.025	20%	0.199	C	C	.	.	H	α-helix	trans	-62.1	-44.8	177.7	0	0	0	0	0	112.5	F276 I277 L278 Q282 G283 L286 I337 V341 S343	F276-A280 WeakPolarHBondContact O-CB 3.35Å; F276-A280 PolarHBondContact O-N 2.97Å; I277-A280 PolarHBondContact O-N 2.85Å; L278-A280 VanDerWaalsContact C-N 3.34Å; L278-A280 PolarHBondContact O-N 2.97Å; A280-Q282 VanDerWaalsContact C-N 3.34Å; A280-G283 PolarHBondContact O-N 3.16Å; A280-L286 HydrophobicContact CB-CD1 4.12Å; A280-I337 HydrophobicContact CB-CG2 4.06Å; A280-V341 HydrophobicContact CB-CB 3.96Å; A280-V341 HydrophobicContact CB-CG1 3.93Å; A280-V341 HydrophobicContact CB-CG2 3.95Å; A280-S343 VanDerWaalsContact O-CB 3.29Å; A280-S343 WeakPolarHBondContact O-CB 3.49Å; A280-S343 PolarHBondContact O-OG 2.94Å
281	L	93.2	Very high	90.5	Very high	49 Å²	49	38.5 Å²	38.5	26%	0.257	21%	0.209	S	C	.	.	H	α-helix	trans	-66.6	-34	179.9	-76.6	169.6	0	0	0	112.6	I277 L278 V341 I387 F390 L394	I277-L281 HydrophobicContact CG2-CD1 3.63Å; I277-L281 HydrophobicContact CG2-CG 4.29Å; I277-L281 WeakPolarHBondContact O-CB 3.28Å; I277-L281 VanDerWaalsContact O-CG 3.26Å; I277-L281 WeakPolarHBondContact O-CG 3.46Å; I277-L281 PolarHBondContact O-N 3.41Å; L278-L281 PolarHBondContact O-N 3.49Å; L281-V341 HydrophobicContact CD2-CG1 3.75Å; L281-V341 HydrophobicContact CG-CG1 4.06Å; L281-I387 HydrophobicContact CD2-CG2 4.38Å; L281-F390 HydrophobicContact CD1-CB 3.84Å; L281-L394 HydrophobicContact CB-CD1 3.72Å; L281-L394 HydrophobicContact CD1-CD1 4.01Å; L281-L394 HydrophobicContact CG-CD1 4.48Å
282	Q	92.6	Very high	90.6	Very high	117 Å²	117	35.5 Å²	35.5	55%	0.547	20%	0.198	S	C	.	.	H	α-helix	trans	-89.3	-5.6	-179.3	-63.9	178.2	-74	0	0	113	L278 Q279 A280 E284 L394	L278-Q282 WeakPolarHBondContact O-CB 3.17Å; L278-Q282 VanDerWaalsContact O-CG 3.25Å; L278-Q282 WeakPolarHBondContact O-CG 3.43Å; L278-Q282 PolarHBondContact O-N 3.44Å; L278-Q282 PolarHBondContact O-OE1 3.03Å; Q279-Q282 PolarHBondContact O-N 3.02Å; A280-Q282 VanDerWaalsContact C-N 3.34Å; Q282-E284 VanDerWaalsContact C-N 3.28Å; Q282-E284 HydrophobicContact CB-CG 4.13Å; Q282-L394 HydrophobicContact CG-CD1 4.01Å; Q282-L394 HydrophobicContact CG-CD2 4.35Å
283	G	92.8	Very high	90.7	Very high	51 Å²	51	37.9 Å²	37.9	53%	0.526	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	12.7	-176.9	0	0	0	0	0	114.3	Q279 A280 S345	Q279-G283 PolarHBondContact O-N 2.91Å; A280-G283 PolarHBondContact O-N 3.16Å; G283-S345 VanDerWaalsContact C-OG 3.25Å; G283-S345 WeakPolarHBondContact CA-OG 3.34Å
284	E	94.1	Very high	90.5	Very high	112 Å²	112	39.4 Å²	39.4	52%	0.523	22%	0.223	S	C	.	.			trans	-81.1	155.6	177.4	-63.5	-61.9	156.7	0	0	111.3	Q279 Q282 S345	Q279-E284 CarbonylContact C-O 3.04Å; Q279-E284 HydrophobicContact CB-CB 4.25Å; Q279-E284 HydrophobicContact CG-CB 4.29Å; Q279-E284 PolarHBondContact O-N 3.18Å; Q282-E284 VanDerWaalsContact C-N 3.28Å; Q282-E284 HydrophobicContact CB-CG 4.13Å; E284-S345 WeakPolarHBondContact O-CB 3.47Å; E284-S345 PolarHBondContact O-OG 3.1Å
285	P	94.9	Very high	90.3	Very high	46 Å²	46	40.7 Å²	40.7	30%	0.299	23%	0.231	S	C	.	.			trans	-59.5	137.2	175.5	-22.7	33.6	0	0	0	112.9	Q279 T287 Q346 Q348	Q279-P285 PolarHBondContact OE1-O 3.22Å; P285-T287 PolarHBondContact O-N 3.19Å; P285-Q346 CarbonylContact C-O 3.57Å; P285-Q346 VanDerWaalsContact CA-O 3.29Å; P285-Q346 WeakPolarHBondContact CA-O 3.44Å; P285-Q348 HydrophobicContact CB-CB 4.25Å
286	L	93.8	Very high	90	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	115.2	172.1	-82.6	69.8	0	0	0	109.1	F276 Q279 A280 V288 A334 K338 Q346 I347 Q348	F276-L286 HydrophobicContact CB-CD2 4.17Å; F276-L286 HydrophobicContact CB-CG 4.41Å; F276-L286 HydrophobicContact CD1-CB 4.14Å; F276-L286 HydrophobicContact CD1-CD2 4.36Å; F276-L286 HydrophobicContact CD1-CG 4.13Å; F276-L286 HydrophobicContact CE1-CB 4.37Å; F276-L286 HydrophobicContact CG-CD2 4.21Å; F276-L286 HydrophobicContact CG-CG 4.41Å; Q279-L286 HydrophobicContact CB-CD1 4.2Å; Q279-L286 HydrophobicContact CB-CG 4.39Å; A280-L286 HydrophobicContact CB-CD1 4.12Å; L286-V288 PolarHBondContact O-N 3.46Å; L286-A334 HydrophobicContact CD2-CB 4.02Å; L286-A334 WeakPolarHBondContact CD2-O 3.49Å; L286-K338 HydrophobicContact CD2-CB 4.47Å; L286-Q346 PolarHBondContact N-O 3.15Å; L286-I347 HydrophobicContact CB-CG1 4.33Å; L286-Q348 PolarHBondContact O-N 3.4Å
287	T	92.4	Very high	89.7	Confident	26 Å²	26	39.4 Å²	39.4	16%	0.16	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	100.3	-172	54.2	0	0	0	0	112.2	F276 Q279 P285 L350	F276-T287 WeakPolarHBondContact CE1-O 3.24Å; Q279-T287 PolarHBondContact NE2-OG1 3.32Å; P285-T287 PolarHBondContact O-N 3.19Å; T287-L350 HydrophobicContact CG2-CD1 3.9Å
288	V	90.3	Very high	89.6	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	121.8	175	176.6	0	0	0	0	109.2	F276 L286 G292 I330 A334 I347 Q348 F349 L350	F276-V288 HydrophobicContact CE1-CG2 4.39Å; F276-V288 HydrophobicContact CZ-CG2 3.88Å; L286-V288 PolarHBondContact O-N 3.46Å; V288-G292 VanDerWaalsContact CG1-CA 3.41Å; V288-I330 HydrophobicContact CG1-CG2 4.02Å; V288-I330 HydrophobicContact CG2-CG2 4.34Å; V288-A334 HydrophobicContact CG2-CB 4.2Å; V288-I347 HydrophobicContact CB-CG2 4.48Å; V288-I347 HydrophobicContact CG2-CG2 3.67Å; V288-Q348 PolarHBondContact N-O 3.17Å; V288-F349 HydrophobicContact CB-CD1 3.98Å; V288-F349 HydrophobicContact CB-CE1 4.19Å; V288-F349 HydrophobicContact CG1-CD1 3.89Å; V288-F349 HydrophobicContact CG1-CE1 3.96Å; V288-F349 CarbonylContact O-C 3.54Å; V288-F349 VanDerWaalsContact O-CA 3.26Å; V288-F349 WeakPolarHBondContact O-CA 3.36Å; V288-L350 PolarHBondContact O-N 2.89Å
289	Y	85.6	Confident	89.7	Confident	106 Å²	106	39.1 Å²	39.1	42%	0.416	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	132	174.4	-62.2	-73.3	0	0	0	110.5	Q294 L350 S351	Y289-Q294 PolarHBondContact O-NE2 3.05Å; Y289-L350 HydrophobicContact CD1-CB 3.57Å; Y289-L350 HydrophobicContact CD1-CD1 4.18Å; Y289-L350 HydrophobicContact CD1-CG 4.49Å; Y289-L350 HydrophobicContact CE1-CB 3.82Å; Y289-L350 HydrophobicContact CE1-CD1 3.6Å; Y289-L350 HydrophobicContact CE1-CG 4.35Å; Y289-S351 WeakPolarHBondContact CD1-O 3.44Å
290	G	85.6	Confident	89.9	Confident	15 Å²	15	38.5 Å²	38.5	16%	0.155	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	-146.8	-173.2	0	0	0	0	0	112.5	F349 L350	G290-F349 WeakPolarHBondContact O-CD1 3.35Å; G290-L350 PolarHBondContact N-O 3.36Å
291	T	85.2	Confident	90.1	Very high	88 Å²	88	38.5 Å²	38.5	54%	0.54	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-16.5	178.2	57.7	0	0	0	0	113.4	S293 F349	T291-S293 VanDerWaalsContact C-N 3.29Å; T291-S293 PolarHBondContact OG1-N 3.47Å; T291-S293 PolarHBondContact OG1-OG 3.07Å; T291-F349 WeakPolarHBondContact O-CE1 3.13Å
292	G	84.4	Confident	90.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.22	C	C	.	.	S	Bend	trans	80	4.1	-171.7	0	0	0	0	0	114.6	V288 Q294 T329 I330 L331	V288-G292 VanDerWaalsContact CG1-CA 3.41Å; G292-Q294 VanDerWaalsContact C-N 3.3Å; G292-T329 WeakPolarHBondContact O-CB 3.45Å; G292-I330 PolarHBondContact O-N 3.34Å; G292-I330 VanDerWaalsContact O-N 3.16Å; G292-L331 PolarHBondContact O-N 3.42Å
293	S	86.1	Confident	90.6	Very high	86 Å²	86	32.7 Å²	32.7	60%	0.601	19%	0.194	S	C	*	.			trans	-79.2	-10.1	179.3	63.1	0	0	0	0	114.1	T291	T291-S293 VanDerWaalsContact C-N 3.29Å; T291-S293 PolarHBondContact OG1-N 3.47Å; T291-S293 PolarHBondContact OG1-OG 3.07Å
294	Q	83.3	Confident	90.9	Very high	37 Å²	37	30.2 Å²	30.2	17%	0.173	17%	0.169	C	C	.	.			trans	-64.9	141.1	173.4	70.1	-79.7	24.9	0	0	110.5	Y289 G292 T329 I330	Y289-Q294 PolarHBondContact O-NE2 3.05Å; G292-Q294 VanDerWaalsContact C-N 3.3Å; Q294-T329 WeakPolarHBondContact O-CA 3.15Å; Q294-I330 HydrophobicContact CG-CG1 3.69Å; Q294-I330 PolarHBondContact O-N 3.02Å
295	T	82.7	Confident	91.1	Very high	26 Å²	26	25.1 Å²	25.1	16%	0.16	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	147.1	-176.6	57	0	0	0	0	111.6	E327 H328 T329	T295-E327 WeakPolarHBondContact CB-OE1 3.44Å; T295-E327 PolarHBondContact OG1-OE1 3.17Å; T295-H328 WeakPolarHBondContact CA-O 3.15Å; T295-T329 HydrophobicContact CG2-CG2 4.22Å
296	R	82.9	Confident	91.3	Very high	15 Å²	15	25.8 Å²	25.8	6%	0.057	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	146.1	170.1	-66	-65.7	-179.6	-98.3	5.4	109.1	F298 H328 I330 D356 P357 Q358	R296-F298 HydrophobicContact CB-CD2 4.3Å; R296-F298 HydrophobicContact CB-CE1 4.2Å; R296-F298 HydrophobicContact CB-CE2 3.54Å; R296-F298 HydrophobicContact CB-CZ 3.47Å; R296-F298 VanDerWaalsContact CB-CZ 3.47Å; R296-F298 HydrophobicContact CG-CZ 4.05Å; R296-H328 PolarHBondContact N-O 3.18Å; R296-H328 PolarHBondContact O-N 3.48Å; R296-I330 HydrophobicContact CB-CD1 4.25Å; R296-I330 HydrophobicContact CG-CD1 3.61Å; R296-I330 HydrophobicContact CG-CG1 4.47Å; R296-D356 IonicContact NH2-OD1 3.48Å; R296-D356 PolarHBondContact NH2-OD1 2.94Å; R296-D356 IonicContact NH2-OD2 3.5Å; R296-D356 PolarHBondContact NH2-OD2 3.03Å; R296-P357 PolarHBondContact NH1-O 2.8Å; R296-P357 PolarHBondContact NH2-O 2.93Å; R296-Q358 PolarHBondContact NH1-O 3.43Å
297	A	87.9	Confident	91.5	Very high	5 Å²	5	25.8 Å²	25.8	4%	0.041	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	125.1	172.4	0	0	0	0	0	109.2	N324 E326 E327	A297-N324 WeakPolarHBondContact CB-O 3.26Å; A297-E326 VanDerWaalsContact CA-O 3.31Å; A297-E326 WeakPolarHBondContact CA-O 3.33Å; A297-E326 WeakPolarHBondContact CB-O 3.5Å; A297-E327 HydrophobicContact CB-CG 4.22Å
298	F	91.3	Very high	91.9	Very high	8 Å²	8	24.6 Å²	24.6	4%	0.035	14%	0.139	C	C	.	.			trans	-116.5	129	-174.4	-63.9	-73.7	0	0	0	111.3	N259 F261 V272 V273 R296 N324 F333 L379	N259-F298 HydrophobicContact CB-CD1 4.04Å; N259-F298 HydrophobicContact CB-CE1 4.33Å; N259-F298 WeakPolarHBondContact O-CA 3.35Å; F261-F298 HydrophobicContact CD1-CB 3.82Å; F261-F298 HydrophobicContact CE1-CB 3.92Å; V272-F298 HydrophobicContact CG1-CE1 3.75Å; V272-F298 HydrophobicContact CG1-CZ 3.45Å; V272-F298 VanDerWaalsContact CG1-CZ 3.45Å; V273-F298 HydrophobicContact CG2-CD1 3.68Å; V273-F298 HydrophobicContact CG2-CE1 3.53Å; V273-F298 HydrophobicContact CG2-CG 4.37Å; V273-F298 HydrophobicContact CG2-CZ 4.12Å; R296-F298 HydrophobicContact CB-CD2 4.3Å; R296-F298 HydrophobicContact CB-CE1 4.2Å; R296-F298 HydrophobicContact CB-CE2 3.54Å; R296-F298 HydrophobicContact CB-CZ 3.47Å; R296-F298 VanDerWaalsContact CB-CZ 3.47Å; R296-F298 HydrophobicContact CG-CZ 4.05Å; F298-N324 WeakPolarHBondContact O-CB 3.43Å; F298-F333 HydrophobicContact CD2-CD2 4.06Å; F298-F333 AromaticContact CD2-CE2 3.83Å; F298-F333 HydrophobicContact CD2-CE2 3.83Å; F298-F333 HydrophobicContact CD2-CZ 4.21Å; F298-F333 HydrophobicContact CE2-CD1 4.26Å; F298-F333 AromaticContact CE2-CD2 3.97Å; F298-F333 HydrophobicContact CE2-CD2 3.97Å; F298-F333 HydrophobicContact CE2-CE1 4.28Å; F298-F333 HydrophobicContact CE2-CE2 4Å; F298-F333 HydrophobicContact CE2-CG 4.1Å; F298-F333 HydrophobicContact CE2-CZ 4.16Å; F298-F333 HydrophobicContact CG-CE2 4.5Å; F298-F333 HydrophobicContact CZ-CE1 4.45Å; F298-L379 HydrophobicContact CB-CD1 4.19Å
299	Q	96.3	Very high	92.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	137.7	177.8	-177	179.1	3.1	0	0	110.7	N259 T260 F261 D303 L322 G323 N324	N259-Q299 PolarHBondContact O-N 3.16Å; T260-Q299 CarbonylContact C-O 3.55Å; T260-Q299 VanDerWaalsContact CA-O 3.24Å; T260-Q299 WeakPolarHBondContact CA-O 3.31Å; F261-Q299 WeakPolarHBondContact CD1-O 3.46Å; F261-Q299 PolarHBondContact N-O 3.03Å; Q299-D303 HydrophobicContact CG-CB 4.1Å; Q299-L322 VanDerWaalsContact OE1-C 3.31Å; Q299-L322 PolarHBondContact OE1-O 2.78Å; Q299-G323 VanDerWaalsContact OE1-N 3.16Å; Q299-N324 HydrophobicContact CB-CB 4.14Å
300	Y	98.1	Very high	92.9	Very high	19 Å²	19	24.1 Å²	24.1	8%	0.075	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	142.3	172.4	-171.6	-112.9	0	0	0	111.4	F261 S302 D303 L304 V377 G382 K385	F261-Y300 HydrophobicContact CD2-CD2 4.39Å; F261-Y300 AromaticContact CE2-CD2 3.93Å; F261-Y300 HydrophobicContact CE2-CD2 3.93Å; F261-Y300 HydrophobicContact CZ-CD2 4.02Å; Y300-S302 VanDerWaalsContact C-N 3.29Å; Y300-S302 WeakPolarHBondContact CD1-OG 3.47Å; Y300-S302 WeakPolarHBondContact CE1-OG 3.49Å; Y300-S302 PolarHBondContact O-N 2.67Å; Y300-S302 VanDerWaalsContact O-N 3.16Å; Y300-D303 WeakPolarHBondContact O-CB 3.46Å; Y300-D303 PolarHBondContact O-N 2.97Å; Y300-D303 VanDerWaalsContact O-N 3.08Å; Y300-L304 PolarHBondContact O-N 3.28Å; Y300-V377 HydrophobicContact CD1-CB 4.05Å; Y300-V377 HydrophobicContact CD1-CG1 3.74Å; Y300-V377 HydrophobicContact CD1-CG2 3.96Å; Y300-V377 HydrophobicContact CE1-CG1 4.45Å; Y300-V377 HydrophobicContact CG-CB 4.38Å; Y300-V377 HydrophobicContact CG-CG1 3.99Å; Y300-G382 VanDerWaalsContact CD2-CA 3.41Å; Y300-G382 WeakPolarHBondContact CE2-O 3.42Å; Y300-K385 HydrophobicContact CE1-CD 4.31Å; Y300-K385 HydrophobicContact CE2-CB 4.46Å; Y300-K385 VanDerWaalsContact OH-CD 3.26Å; Y300-K385 WeakPolarHBondContact OH-CD 3.5Å
301	V	98.4	Very high	93.5	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.012	14%	0.137	C	C	.	.	H	α-helix	trans	-57.8	-33.7	-169.7	67.7	0	0	0	0	114.9	F98 V99 H102 T260 F261 D303 L304 V305	F98-V301 HydrophobicContact CD2-CG2 4.47Å; F98-V301 HydrophobicContact CE1-CG2 4.49Å; F98-V301 HydrophobicContact CE2-CB 3.83Å; F98-V301 HydrophobicContact CE2-CG1 4.15Å; F98-V301 HydrophobicContact CE2-CG2 3.69Å; F98-V301 HydrophobicContact CZ-CB 3.66Å; F98-V301 HydrophobicContact CZ-CG1 4.38Å; F98-V301 HydrophobicContact CZ-CG2 3.7Å; V99-V301 HydrophobicContact CG2-CG2 4.42Å; H102-V301 HydrophobicContact CB-CG2 4.08Å; T260-V301 HydrophobicContact CG2-CB 4.08Å; T260-V301 HydrophobicContact CG2-CG2 4.33Å; F261-V301 PolarHBondContact O-N 3.27Å; V301-D303 VanDerWaalsContact C-N 3.33Å; V301-D303 PolarHBondContact O-N 3.3Å; V301-L304 WeakPolarHBondContact O-CB 3.25Å; V301-L304 PolarHBondContact O-N 3.17Å; V301-V305 HydrophobicContact CG2-CG2 4.37Å; V301-V305 WeakPolarHBondContact O-CG2 3.46Å; V301-V305 PolarHBondContact O-N 3.35Å
302	S	98.4	Very high	94.2	Very high	43 Å²	43	19.2 Å²	19.2	30%	0.301	11%	0.111	S	C	.	.	H	α-helix	trans	-67	-35.8	179.1	61.9	0	0	0	0	112.3	Y300 L304 V305 N306	Y300-S302 VanDerWaalsContact C-N 3.29Å; Y300-S302 WeakPolarHBondContact CD1-OG 3.47Å; Y300-S302 WeakPolarHBondContact CE1-OG 3.49Å; Y300-S302 PolarHBondContact O-N 2.67Å; Y300-S302 VanDerWaalsContact O-N 3.16Å; S302-L304 VanDerWaalsContact C-N 3.3Å; S302-L304 PolarHBondContact O-N 2.86Å; S302-V305 PolarHBondContact O-N 3.17Å; S302-N306 VanDerWaalsContact O-CG 3.31Å; S302-N306 PolarHBondContact O-N 3.48Å; S302-N306 PolarHBondContact O-ND2 3.24Å
303	D	98.6	Very high	94.8	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-63.3	-41.5	174.6	-70.4	-41.2	0	0	0	110.4	Q299 Y300 V301 N306 G307 W373 P375 V376 V377	Q299-D303 HydrophobicContact CG-CB 4.1Å; Y300-D303 WeakPolarHBondContact O-CB 3.46Å; Y300-D303 PolarHBondContact O-N 2.97Å; Y300-D303 VanDerWaalsContact O-N 3.08Å; V301-D303 VanDerWaalsContact C-N 3.33Å; V301-D303 PolarHBondContact O-N 3.3Å; D303-N306 PolarHBondContact O-N 3Å; D303-G307 PolarHBondContact O-N 3.3Å; D303-W373 HydrophobicContact CB-CZ2 4.22Å; D303-W373 WeakPolarHBondContact O-CZ2 3.45Å; D303-W373 PolarHBondContact O-NE1 3.45Å; D303-P375 HydrophobicContact CB-CB 4.18Å; D303-V376 WeakPolarHBondContact OD1-CG2 3.26Å; D303-V376 PolarHBondContact OD1-N 3.39Å; D303-V376 PolarHBondContact OD2-N 3.01Å; D303-V377 WeakPolarHBondContact OD2-CB 3.38Å; D303-V377 PolarHBondContact OD2-N 3.22Å
304	L	98.8	Very high	95.4	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-62.8	-48.7	177.2	174.3	62.8	0	0	0	110.8	V99 I257 T260 Y300 V301 S302 N306 G307 L308 L322	V99-L304 HydrophobicContact CB-CD2 4.41Å; V99-L304 HydrophobicContact CG1-CD2 3.65Å; V99-L304 HydrophobicContact CG1-CG 4.34Å; V99-L304 HydrophobicContact CG2-CD2 3.8Å; I257-L304 HydrophobicContact CB-CD1 4.49Å; I257-L304 HydrophobicContact CD1-CD1 4.25Å; I257-L304 HydrophobicContact CD1-CD2 4.39Å; I257-L304 HydrophobicContact CG1-CD1 4.02Å; I257-L304 HydrophobicContact CG2-CD1 3.85Å; I257-L304 HydrophobicContact CG2-CD2 3.71Å; I257-L304 HydrophobicContact CG2-CG 4.45Å; T260-L304 HydrophobicContact CG2-CB 4.15Å; T260-L304 HydrophobicContact CG2-CD2 3.81Å; Y300-L304 PolarHBondContact O-N 3.28Å; V301-L304 WeakPolarHBondContact O-CB 3.25Å; V301-L304 PolarHBondContact O-N 3.17Å; S302-L304 VanDerWaalsContact C-N 3.3Å; S302-L304 PolarHBondContact O-N 2.86Å; L304-N306 VanDerWaalsContact C-N 3.29Å; L304-N306 PolarHBondContact O-N 3.33Å; L304-G307 PolarHBondContact O-N 2.93Å; L304-G307 VanDerWaalsContact O-N 3.09Å; L304-L308 HydrophobicContact CD1-CD1 4.27Å; L304-L308 HydrophobicContact CD1-CD2 4.39Å; L304-L308 HydrophobicContact CD1-CG 4.05Å; L304-L308 HydrophobicContact CG-CD1 4.02Å; L304-L308 HydrophobicContact CG-CG 4.26Å; L304-L308 WeakPolarHBondContact O-CG 3.26Å; L304-L308 PolarHBondContact O-N 2.72Å; L304-L322 HydrophobicContact CD1-CB 3.9Å; L304-L322 HydrophobicContact CD1-CD1 4.05Å
305	V	98.8	Very high	96.1	Very high	4 Å²	4	24.6 Å²	24.6	2%	0.024	14%	0.136	C	C	.	.	H	α-helix	trans	-58.9	-43.1	179.9	173.2	0	0	0	0	110.8	H102 L103 K106 V301 S302 G307 L308 V309	H102-V305 HydrophobicContact CB-CG2 3.8Å; L103-V305 HydrophobicContact CB-CG1 4.34Å; L103-V305 HydrophobicContact CB-CG2 4.37Å; L103-V305 HydrophobicContact CD1-CG1 3.95Å; K106-V305 HydrophobicContact CB-CG1 3.85Å; K106-V305 HydrophobicContact CD-CG1 3.98Å; K106-V305 HydrophobicContact CG-CG1 4.3Å; V301-V305 HydrophobicContact CG2-CG2 4.37Å; V301-V305 WeakPolarHBondContact O-CG2 3.46Å; V301-V305 PolarHBondContact O-N 3.35Å; S302-V305 PolarHBondContact O-N 3.17Å; V305-G307 PolarHBondContact O-N 3.36Å; V305-L308 PolarHBondContact O-N 3.02Å; V305-V309 WeakPolarHBondContact O-CG2 3.33Å; V305-V309 PolarHBondContact O-N 3.44Å
306	N	98.7	Very high	96.8	Very high	61 Å²	61	24 Å²	24	33%	0.326	13%	0.131	S	C	.	.	H	α-helix	trans	-60.1	-44.8	174.5	-72.5	-22.8	0	0	0	111.8	K106 S302 D303 L304 L308 V309 L310	K106-N306 VanDerWaalsContact CE-OD1 3.31Å; K106-N306 WeakPolarHBondContact CE-OD1 3.27Å; S302-N306 VanDerWaalsContact O-CG 3.31Å; S302-N306 PolarHBondContact O-N 3.48Å; S302-N306 PolarHBondContact O-ND2 3.24Å; D303-N306 PolarHBondContact O-N 3Å; L304-N306 VanDerWaalsContact C-N 3.29Å; L304-N306 PolarHBondContact O-N 3.33Å; N306-L308 PolarHBondContact O-N 3.22Å; N306-V309 PolarHBondContact O-N 2.99Å; N306-L310 WeakPolarHBondContact O-CG 3.09Å; N306-L310 PolarHBondContact O-N 3.37Å
307	G	98.8	Very high	97.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.2	-40.3	177.1	0	0	0	0	0	113.1	D303 L304 V305 L310 L311	D303-G307 PolarHBondContact O-N 3.3Å; L304-G307 PolarHBondContact O-N 2.93Å; L304-G307 VanDerWaalsContact O-N 3.09Å; V305-G307 PolarHBondContact O-N 3.36Å; G307-L310 PolarHBondContact O-N 3.33Å; G307-L311 WeakPolarHBondContact O-CB 3.28Å; G307-L311 PolarHBondContact O-N 2.97Å
308	L	98.9	Very high	98.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.6	-45.7	177.1	-69.1	173.2	0	0	0	111.8	V99 Y156 L197 A255 I257 L304 V305 N306 L311 M312 L322	V99-L308 HydrophobicContact CG1-CD1 4.04Å; Y156-L308 HydrophobicContact CE1-CB 4.39Å; L197-L308 HydrophobicContact CD1-CD2 4.46Å; L197-L308 WeakPolarHBondContact CD1-O 3.44Å; L197-L308 HydrophobicContact CD2-CD2 3.78Å; A255-L308 HydrophobicContact CB-CD2 3.64Å; I257-L308 HydrophobicContact CD1-CD2 4.29Å; L304-L308 HydrophobicContact CD1-CD1 4.27Å; L304-L308 HydrophobicContact CD1-CD2 4.39Å; L304-L308 HydrophobicContact CD1-CG 4.05Å; L304-L308 HydrophobicContact CG-CD1 4.02Å; L304-L308 HydrophobicContact CG-CG 4.26Å; L304-L308 WeakPolarHBondContact O-CG 3.26Å; L304-L308 PolarHBondContact O-N 2.72Å; V305-L308 PolarHBondContact O-N 3.02Å; N306-L308 PolarHBondContact O-N 3.22Å; L308-L311 PolarHBondContact O-N 3.36Å; L308-M312 WeakPolarHBondContact O-CB 3.37Å; L308-M312 PolarHBondContact O-N 3.12Å; L308-L322 HydrophobicContact CD2-CD1 3.89Å; L308-L322 HydrophobicContact CG-CD1 4.2Å
309	V	98.8	Very high	98.4	Very high	18 Å²	18	27.8 Å²	27.8	11%	0.109	16%	0.161	C	C	.	.	H	α-helix	trans	-65.4	-42	179.1	173.7	0	0	0	0	111	L103 L107 V305 N306 N313	L103-V309 HydrophobicContact CD1-CG2 3.75Å; L107-V309 HydrophobicContact CD2-CG2 4.19Å; V305-V309 WeakPolarHBondContact O-CG2 3.33Å; V305-V309 PolarHBondContact O-N 3.44Å; N306-V309 PolarHBondContact O-N 2.99Å; V309-N313 PolarHBondContact O-N 2.91Å; V309-N313 PolarHBondContact O-ND2 3.43Å
310	L	98.8	Very high	98.6	Very high	78 Å²	78	27.8 Å²	27.8	41%	0.408	16%	0.161	S	C	.	.	H	α-helix	trans	-63.9	-45.3	175.7	-71.5	171.6	0	0	0	111.5	N306 G307 M312 N313 S314 L371 W373	N306-L310 WeakPolarHBondContact O-CG 3.09Å; N306-L310 PolarHBondContact O-N 3.37Å; G307-L310 PolarHBondContact O-N 3.33Å; L310-M312 PolarHBondContact O-N 3.24Å; L310-N313 PolarHBondContact O-N 2.97Å; L310-S314 WeakPolarHBondContact O-CB 3.47Å; L310-S314 PolarHBondContact O-N 3.35Å; L310-L371 HydrophobicContact CB-CB 4.46Å; L310-W373 HydrophobicContact CD1-CB 3.8Å; L310-W373 HydrophobicContact CD1-CG 4.12Å
311	L	98.9	Very high	98.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.5	-45	178.8	-179.2	61	0	0	0	111.9	L197 R253 A255 G307 L308 N313 S314 I316 V320 L371	L197-L311 HydrophobicContact CD1-CB 4.18Å; L197-L311 HydrophobicContact CD1-CD2 4.1Å; L197-L311 HydrophobicContact CD1-CG 4.13Å; R253-L311 HydrophobicContact CB-CG 4.2Å; R253-L311 WeakPolarHBondContact CD-O 3.47Å; A255-L311 HydrophobicContact CB-CD2 3.86Å; G307-L311 WeakPolarHBondContact O-CB 3.28Å; G307-L311 PolarHBondContact O-N 2.97Å; L308-L311 PolarHBondContact O-N 3.36Å; L311-N313 VanDerWaalsContact C-N 3.27Å; L311-N313 PolarHBondContact O-N 2.99Å; L311-S314 PolarHBondContact O-N 3.03Å; L311-S314 PolarHBondContact O-OG 3.37Å; L311-I316 HydrophobicContact CD1-CB 4.35Å; L311-V320 HydrophobicContact CD1-CB 4.19Å; L311-V320 HydrophobicContact CD1-CG2 3.75Å; L311-V320 HydrophobicContact CD2-CB 4.26Å; L311-L371 HydrophobicContact CB-CD1 4.07Å; L311-L371 HydrophobicContact CD1-CD1 4.31Å; L311-L371 HydrophobicContact CD1-CD2 4.42Å
312	M	98.8	Very high	98.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-54.6	-45.1	176.6	177.2	61	86.5	0	0	111.7	Q154 I155 Y156 R195 L197 L308 L310	Q154-M312 HydrophobicContact CB-CE 4.18Å; Q154-M312 HydrophobicContact CB-SD 4.35Å; Q154-M312 HydrophobicContact CG-CG 4.34Å; Q154-M312 HydrophobicContact CG-SD 4.23Å; I155-M312 WeakPolarHBondContact O-CE 3.45Å; Y156-M312 HydrophobicContact CD1-CE 3.94Å; Y156-M312 HydrophobicContact CD2-CE 3.73Å; Y156-M312 HydrophobicContact CE1-CB 3.75Å; Y156-M312 HydrophobicContact CE1-CE 3.86Å; Y156-M312 HydrophobicContact CE1-CG 4.14Å; Y156-M312 HydrophobicContact CE2-CB 4.49Å; Y156-M312 HydrophobicContact CE2-CE 3.64Å; Y156-M312 HydrophobicContact CE2-CG 4.03Å; Y156-M312 HydrophobicContact CG-CE 3.89Å; Y156-M312 WeakPolarHBondContact OH-CB 3.49Å; Y156-M312 VanDerWaalsContact OH-CG 3.28Å; Y156-M312 WeakPolarHBondContact OH-CG 3.47Å; R195-M312 HydrophobicContact CB-SD 4.18Å; R195-M312 WeakPolarHBondContact CD-O 3.41Å; R195-M312 HydrophobicContact CG-SD 3.7Å; R195-M312 PolarHBondContact NH1-O 3.26Å; L197-M312 HydrophobicContact CB-CE 3.33Å; L197-M312 HydrophobicContact CB-SD 4.18Å; L197-M312 HydrophobicContact CD1-CB 4Å; L308-M312 WeakPolarHBondContact O-CB 3.37Å; L308-M312 PolarHBondContact O-N 3.12Å; L310-M312 PolarHBondContact O-N 3.24Å
313	N	98.5	Very high	98.6	Very high	69 Å²	69	24.8 Å²	24.8	37%	0.369	14%	0.142	S	C	.	.	H	α-helix	trans	-86.5	-5.1	-175.7	-65.8	-64	0	0	0	113.7	K88 Q154 V309 L310 L311	K88-N313 PolarHBondContact NZ-OD1 3.35Å; Q154-N313 PolarHBondContact NE2-OD1 3.38Å; V309-N313 PolarHBondContact O-N 2.91Å; V309-N313 PolarHBondContact O-ND2 3.43Å; L310-N313 PolarHBondContact O-N 2.97Å; L311-N313 VanDerWaalsContact C-N 3.27Å; L311-N313 PolarHBondContact O-N 2.99Å
314	S	98.4	Very high	98.5	Very high	19 Å²	19	25.4 Å²	25.4	13%	0.133	15%	0.146	C	C	.	.	S	Bend	trans	-78.6	172	173.8	80.4	0	0	0	0	112.8	R195 R253 L310 L311 I316 L371	R195-S314 PolarHBondContact NH1-O 3.27Å; R195-S314 VanDerWaalsContact NH1-O 3.16Å; R253-S314 VanDerWaalsContact CZ-O 3.28Å; R253-S314 PolarHBondContact NE-O 3.45Å; R253-S314 PolarHBondContact NH2-O 3.02Å; L310-S314 WeakPolarHBondContact O-CB 3.47Å; L310-S314 PolarHBondContact O-N 3.35Å; L311-S314 PolarHBondContact O-N 3.03Å; L311-S314 PolarHBondContact O-OG 3.37Å; S314-I316 PolarHBondContact OG-N 2.7Å; S314-L371 VanDerWaalsContact CB-CD2 3.46Å
315	N	97.8	Very high	98.3	Very high	148 Å²	148	26.9 Å²	26.9	79%	0.791	16%	0.155	S	C	*	.	S	Bend	trans	-94	11.6	171.5	-68.1	-26.7	0	0	0	113.6
316	I	98.1	Very high	97.9	Very high	14 Å²	14	31.2 Å²	31.2	7%	0.072	18%	0.175	C	C	.	.			trans	-90.2	111.9	-174.1	-50	167.6	0	0	0	110.2	R253 L311 S314 V320 M370 L371	R253-I316 WeakPolarHBondContact CD-O 3.42Å; R253-I316 PolarHBondContact NE-O 2.63Å; L311-I316 HydrophobicContact CD1-CB 4.35Å; S314-I316 PolarHBondContact OG-N 2.7Å; I316-V320 HydrophobicContact CG2-CG2 3.98Å; I316-M370 HydrophobicContact CD1-CB 3.23Å; I316-M370 HydrophobicContact CD1-CE 4.13Å; I316-M370 HydrophobicContact CD1-CG 4.22Å; I316-M370 HydrophobicContact CD1-SD 4.03Å; I316-M370 HydrophobicContact CG1-CB 4.21Å; I316-M370 HydrophobicContact CG1-CE 3.9Å; I316-M370 HydrophobicContact CG1-SD 4.35Å; I316-M370 HydrophobicContact CG2-CE 4.39Å; I316-M370 HydrophobicContact CG2-SD 4.32Å; I316-L371 HydrophobicContact CD1-CD2 3.5Å; I316-L371 VanDerWaalsContact CD1-CD2 3.5Å; I316-L371 HydrophobicContact CD1-CG 3.96Å
317	S	98.3	Very high	97.4	Very high	42 Å²	42	30.9 Å²	30.9	29%	0.294	17%	0.172	S	C	.	.			trans	-94	-22.9	177.7	58.1	0	0	0	0	114.8	Y242 V252	Y242-S317 WeakPolarHBondContact CE1-O 3.46Å; Y242-S317 PolarHBondContact OH-O 3.19Å; V252-S317 WeakPolarHBondContact O-CA 3.38Å
318	S	98.4	Very high	97	Very high	49 Å²	49	32.7 Å²	32.7	34%	0.343	18%	0.18	S	C	.	.	S	Bend	trans	-69.7	156.8	176.1	54.9	0	0	0	0	111.4	K366	S318-K366 WeakPolarHBondContact OG-CE 3.34Å; S318-K366 PolarHBondContact OG-NZ 2.83Å
319	P	98.8	Very high	96.5	Very high	17 Å²	17	34.2 Å²	34.2	11%	0.11	19%	0.189	C	C	.	.			trans	-60.9	147.1	-174.2	-20.6	32.9	0	0	0	111.7	E215 Y242 V254 R256 K366	E215-P319 WeakPolarHBondContact CG-O 3.47Å; Y242-P319 HydrophobicContact CE2-CG 4.15Å; Y242-P319 WeakPolarHBondContact OH-CD 3.14Å; Y242-P319 VanDerWaalsContact OH-CG 3.25Å; Y242-P319 WeakPolarHBondContact OH-CG 3.36Å; Y242-P319 VanDerWaalsContact OH-N 3.16Å; V254-P319 HydrophobicContact CB-CB 4.33Å; V254-P319 HydrophobicContact CG1-CB 4.14Å; V254-P319 HydrophobicContact CG1-CG 4.42Å; V254-P319 WeakPolarHBondContact O-CA 3.34Å; R256-P319 HydrophobicContact CG-CB 4.39Å; P319-K366 WeakPolarHBondContact O-CE 3.49Å; P319-K366 PolarHBondContact O-NZ 2.82Å
320	V	98.9	Very high	96.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	128.5	175.4	-179.6	0	0	0	0	109.5	V254 R256 L311 I316 L322 K366 A367 L371	V254-V320 PolarHBondContact O-N 3.23Å; R256-V320 PolarHBondContact N-O 3.34Å; L311-V320 HydrophobicContact CD1-CB 4.19Å; L311-V320 HydrophobicContact CD1-CG2 3.75Å; L311-V320 HydrophobicContact CD2-CB 4.26Å; I316-V320 HydrophobicContact CG2-CG2 3.98Å; V320-L322 HydrophobicContact CG1-CD2 4.3Å; V320-L322 PolarHBondContact O-N 3.33Å; V320-K366 HydrophobicContact CG2-CD 4.19Å; V320-K366 HydrophobicContact CG2-CG 4.47Å; V320-A367 HydrophobicContact CG1-CB 3.68Å; V320-L371 HydrophobicContact CG1-CD1 4.22Å
321	N	98.7	Very high	95.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	125.3	172	-72.6	-27.1	0	0	0	110	Y205 Q213 E215 R256 F258 D363	Y205-N321 PolarHBondContact OH-OD1 2.87Å; Q213-N321 PolarHBondContact O-ND2 3.32Å; E215-N321 HydrophobicContact CG-CB 4.34Å; E215-N321 WeakPolarHBondContact OE1-CB 3.22Å; E215-N321 PolarHBondContact OE1-N 3.36Å; R256-N321 WeakPolarHBondContact O-CA 3.46Å; F258-N321 HydrophobicContact CE2-CB 3.98Å; N321-D363 WeakPolarHBondContact CB-O 3.44Å; N321-D363 PolarHBondContact ND2-O 2.92Å
322	L	98.6	Very high	95.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	111.6	169.8	-62.3	-178.9	0	0	0	108	A255 R256 F258 Q299 L304 L308 V320 A367 W373	A255-L322 HydrophobicContact CB-CD1 3.92Å; R256-L322 PolarHBondContact O-N 2.88Å; F258-L322 PolarHBondContact N-O 2.91Å; Q299-L322 VanDerWaalsContact OE1-C 3.31Å; Q299-L322 PolarHBondContact OE1-O 2.78Å; L304-L322 HydrophobicContact CD1-CB 3.9Å; L304-L322 HydrophobicContact CD1-CD1 4.05Å; L308-L322 HydrophobicContact CD2-CD1 3.89Å; L308-L322 HydrophobicContact CG-CD1 4.2Å; V320-L322 HydrophobicContact CG1-CD2 4.3Å; V320-L322 PolarHBondContact O-N 3.33Å; L322-A367 HydrophobicContact CD2-CB 4.34Å; L322-W373 HydrophobicContact CB-CH2 4.43Å; L322-W373 HydrophobicContact CD2-CD2 4.18Å; L322-W373 HydrophobicContact CD2-CE3 3.85Å; L322-W373 HydrophobicContact CD2-CH2 4.21Å; L322-W373 HydrophobicContact CD2-CZ3 3.85Å
323	G	97.3	Very high	95.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.202	C	C	.	.	S	Bend	trans	-166.8	165.5	-171.5	0	0	0	0	0	111.6	Q299 W373	Q299-G323 VanDerWaalsContact OE1-N 3.16Å; G323-W373 WeakPolarHBondContact O-CH2 3.22Å
324	N	96.6	Very high	94.9	Very high	15 Å²	15	33.9 Å²	33.9	8%	0.08	18%	0.184	C	C	.	.			trans	-97.4	125.7	163.6	-173.3	-14.4	0	0	0	108.5	A297 F298 Q299 E326 P362 P375	A297-N324 WeakPolarHBondContact CB-O 3.26Å; F298-N324 WeakPolarHBondContact O-CB 3.43Å; Q299-N324 HydrophobicContact CB-CB 4.14Å; N324-E326 VanDerWaalsContact C-N 3.26Å; N324-E326 PolarHBondContact O-N 3.04Å; N324-E326 VanDerWaalsContact OD1-CB 3.29Å; N324-E326 WeakPolarHBondContact OD1-CB 3.43Å; N324-E326 PolarHBondContact OD1-N 3.26Å; N324-P362 WeakPolarHBondContact O-CG 3.39Å; N324-P375 HydrophobicContact CB-CB 4.25Å; N324-P375 HydrophobicContact CB-CG 4.07Å
325	P	94.4	Very high	94.7	Very high	31 Å²	31	38 Å²	38	20%	0.201	20%	0.201	C	C	.	.			trans	-79.9	-2.2	179.6	33.9	-38.4	0	0	0	114	E327 R361 I364	P325-E327 PolarHBondContact O-N 3.34Å; P325-R361 PolarHBondContact O-NE 2.64Å; P325-I364 HydrophobicContact CG-CD1 3.93Å; P325-I364 HydrophobicContact CG-CG1 4.13Å
326	E	92.3	Very high	94.5	Very high	95 Å²	95	33.2 Å²	33.2	44%	0.444	18%	0.175	S	C	.	.			trans	-71.6	115.5	174.8	-166.2	-179.2	179	0	0	110.3	A297 N324 H328	A297-E326 VanDerWaalsContact CA-O 3.31Å; A297-E326 WeakPolarHBondContact CA-O 3.33Å; A297-E326 WeakPolarHBondContact CB-O 3.5Å; N324-E326 VanDerWaalsContact C-N 3.26Å; N324-E326 PolarHBondContact O-N 3.04Å; N324-E326 VanDerWaalsContact OD1-CB 3.29Å; N324-E326 WeakPolarHBondContact OD1-CB 3.43Å; N324-E326 PolarHBondContact OD1-N 3.26Å; E326-H328 WeakPolarHBondContact CG-NE2 3.45Å; E326-H328 IonicContact OE1-CE1 2.74Å; E326-H328 PolarHBondContact OE1-CE1 3.49Å; E326-H328 VanDerWaalsContact OE1-CE1 3.29Å; E326-H328 IonicContact OE1-NE2 3.4Å; E326-H328 PolarHBondContact OE1-NE2 3.09Å
327	E	88.3	Confident	94.4	Very high	53 Å²	53	32.6 Å²	32.6	25%	0.248	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	138.1	179.5	-75.8	-171.5	110.2	0	0	111	H211 T295 A297 P325 R361	H211-E327 IonicContact CE1-OE1 3.24Å; H211-E327 PolarHBondContact CE1-OE1 3.05Å; H211-E327 IonicContact CE1-OE2 3.19Å; H211-E327 IonicContact NE2-OE1 2.97Å; H211-E327 IonicContact NE2-OE2 2.63Å; H211-E327 PolarHBondContact NE2-OE2 2.93Å; T295-E327 WeakPolarHBondContact CB-OE1 3.44Å; T295-E327 PolarHBondContact OG1-OE1 3.17Å; A297-E327 HydrophobicContact CB-CG 4.22Å; P325-E327 PolarHBondContact O-N 3.34Å; E327-R361 HydrophobicContact CG-CB 4.08Å; E327-R361 HydrophobicContact CG-CG 4Å; E327-R361 WeakPolarHBondContact OE2-CD 3.47Å
328	H	88.4	Confident	94.2	Very high	38 Å²	38	33.8 Å²	33.8	18%	0.176	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	148.3	168.4	-56.5	-82.9	0	0	0	109.3	T295 R296 E326 L379	T295-H328 WeakPolarHBondContact CA-O 3.15Å; R296-H328 PolarHBondContact N-O 3.18Å; R296-H328 PolarHBondContact O-N 3.48Å; E326-H328 WeakPolarHBondContact CG-NE2 3.45Å; E326-H328 IonicContact OE1-CE1 2.74Å; E326-H328 PolarHBondContact OE1-CE1 3.49Å; E326-H328 VanDerWaalsContact OE1-CE1 3.29Å; E326-H328 IonicContact OE1-NE2 3.4Å; E326-H328 PolarHBondContact OE1-NE2 3.09Å; H328-L379 VanDerWaalsContact CD2-CD2 3.47Å; H328-L379 WeakPolarHBondContact CD2-CD2 3.42Å; H328-L379 WeakPolarHBondContact NE2-CD2 3.25Å
329	T	90.3	Very high	94	Very high	32 Å²	32	35.2 Å²	35.2	20%	0.196	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	152.4	169.1	65.3	0	0	0	0	110.2	G292 Q294 T295 L331 E332 F333	G292-T329 WeakPolarHBondContact O-CB 3.45Å; Q294-T329 WeakPolarHBondContact O-CA 3.15Å; T295-T329 HydrophobicContact CG2-CG2 4.22Å; T329-L331 PolarHBondContact O-N 2.92Å; T329-E332 WeakPolarHBondContact CB-OE2 2.96Å; T329-E332 WeakPolarHBondContact CG2-OE2 3.41Å; T329-E332 PolarHBondContact N-OE2 3.37Å; T329-E332 PolarHBondContact O-N 2.9Å; T329-E332 VanDerWaalsContact OG1-CB 3.28Å; T329-E332 WeakPolarHBondContact OG1-CB 3.48Å; T329-E332 WeakPolarHBondContact OG1-CG 3.34Å; T329-E332 PolarHBondContact OG1-N 3.43Å; T329-E332 PolarHBondContact OG1-OE2 3.27Å; T329-F333 WeakPolarHBondContact O-CB 3.35Å; T329-F333 PolarHBondContact O-N 2.95Å
330	I	90.3	Very high	93.8	Very high	9 Å²	9	35.9 Å²	35.9	5%	0.046	18%	0.184	C	C	.	.	H	α-helix	trans	-60.2	-34.2	174.9	-66.1	-55.3	0	0	0	111.3	V272 F276 V288 G292 Q294 R296 F333 A334	V272-I330 HydrophobicContact CG1-CD1 4.33Å; V272-I330 HydrophobicContact CG2-CD1 4.18Å; V272-I330 HydrophobicContact CG2-CG2 4.39Å; F276-I330 HydrophobicContact CE2-CG2 3.91Å; F276-I330 HydrophobicContact CZ-CG2 3.8Å; V288-I330 HydrophobicContact CG1-CG2 4.02Å; V288-I330 HydrophobicContact CG2-CG2 4.34Å; G292-I330 PolarHBondContact O-N 3.34Å; G292-I330 VanDerWaalsContact O-N 3.16Å; Q294-I330 HydrophobicContact CG-CG1 3.69Å; Q294-I330 PolarHBondContact O-N 3.02Å; R296-I330 HydrophobicContact CB-CD1 4.25Å; R296-I330 HydrophobicContact CG-CD1 3.61Å; R296-I330 HydrophobicContact CG-CG1 4.47Å; I330-F333 PolarHBondContact O-N 3Å; I330-A334 WeakPolarHBondContact O-CB 3.46Å; I330-A334 PolarHBondContact O-N 3.41Å
331	L	91.9	Very high	93.5	Very high	51 Å²	51	37.2 Å²	37.2	27%	0.267	19%	0.192	S	C	.	.	H	α-helix	trans	-66.9	-48	176.9	-177.6	60.2	0	0	0	112.5	G292 T329 F333 A334 Q335 I347 F349	G292-L331 PolarHBondContact O-N 3.42Å; T329-L331 PolarHBondContact O-N 2.92Å; L331-F333 PolarHBondContact O-N 3.36Å; L331-A334 PolarHBondContact O-N 3.36Å; L331-Q335 WeakPolarHBondContact O-CG 3.18Å; L331-Q335 PolarHBondContact O-N 3.4Å; L331-I347 HydrophobicContact CD1-CD1 4.36Å; L331-I347 HydrophobicContact CD1-CG2 4.33Å; L331-F349 HydrophobicContact CD1-CE1 4.4Å; L331-F349 HydrophobicContact CD1-CZ 4.17Å
332	E	92.5	Very high	93.2	Very high	98 Å²	98	43.3 Å²	43.3	46%	0.458	23%	0.229	S	C	.	.	H	α-helix	trans	-57.8	-41	174.5	-75.2	161.1	159.4	0	0	110.7	T329 Q335 L336	T329-E332 WeakPolarHBondContact CB-OE2 2.96Å; T329-E332 WeakPolarHBondContact CG2-OE2 3.41Å; T329-E332 PolarHBondContact N-OE2 3.37Å; T329-E332 PolarHBondContact O-N 2.9Å; T329-E332 VanDerWaalsContact OG1-CB 3.28Å; T329-E332 WeakPolarHBondContact OG1-CB 3.48Å; T329-E332 WeakPolarHBondContact OG1-CG 3.34Å; T329-E332 PolarHBondContact OG1-N 3.43Å; T329-E332 PolarHBondContact OG1-OE2 3.27Å; E332-Q335 PolarHBondContact O-N 2.78Å; E332-L336 WeakPolarHBondContact O-CB 3.28Å; E332-L336 PolarHBondContact O-N 3.11Å
333	F	91.8	Very high	92.7	Very high	1 Å²	1	44.2 Å²	44.2	0%	0.004	24%	0.235	C	C	.	.	H	α-helix	trans	-65.5	-41.4	179.2	-166.6	-105	0	0	0	112.7	V273 F276 F298 T329 I330 L331 L336 I337 L379 L383	V273-F333 HydrophobicContact CB-CE1 4.19Å; V273-F333 HydrophobicContact CB-CZ 4.17Å; V273-F333 HydrophobicContact CG1-CE1 4.34Å; V273-F333 HydrophobicContact CG1-CZ 3.97Å; V273-F333 HydrophobicContact CG2-CE1 3.76Å; V273-F333 HydrophobicContact CG2-CZ 3.6Å; F276-F333 AromaticContact CD2-CD1 3.83Å; F276-F333 HydrophobicContact CD2-CD1 3.83Å; F276-F333 HydrophobicContact CD2-CE1 4.31Å; F276-F333 HydrophobicContact CE2-CD1 4.18Å; F298-F333 HydrophobicContact CD2-CD2 4.06Å; F298-F333 AromaticContact CD2-CE2 3.83Å; F298-F333 HydrophobicContact CD2-CE2 3.83Å; F298-F333 HydrophobicContact CD2-CZ 4.21Å; F298-F333 HydrophobicContact CE2-CD1 4.26Å; F298-F333 AromaticContact CE2-CD2 3.97Å; F298-F333 HydrophobicContact CE2-CD2 3.97Å; F298-F333 HydrophobicContact CE2-CE1 4.28Å; F298-F333 HydrophobicContact CE2-CE2 4Å; F298-F333 HydrophobicContact CE2-CG 4.1Å; F298-F333 HydrophobicContact CE2-CZ 4.16Å; F298-F333 HydrophobicContact CG-CE2 4.5Å; F298-F333 HydrophobicContact CZ-CE1 4.45Å; T329-F333 WeakPolarHBondContact O-CB 3.35Å; T329-F333 PolarHBondContact O-N 2.95Å; I330-F333 PolarHBondContact O-N 3Å; L331-F333 PolarHBondContact O-N 3.36Å; F333-L336 PolarHBondContact O-N 2.97Å; F333-I337 HydrophobicContact CD1-CD1 3.76Å; F333-I337 HydrophobicContact CE1-CD1 3.27Å; F333-I337 HydrophobicContact CE1-CG1 4.34Å; F333-I337 HydrophobicContact CZ-CD1 3.72Å; F333-I337 HydrophobicContact CZ-CG1 4.48Å; F333-I337 PolarHBondContact O-N 3.09Å; F333-L379 HydrophobicContact CD2-CD2 4.23Å; F333-L379 HydrophobicContact CE2-CD1 4.21Å; F333-L379 HydrophobicContact CE2-CD2 4.2Å; F333-L383 HydrophobicContact CE2-CD1 4Å; F333-L383 HydrophobicContact CE2-CD2 4.03Å; F333-L383 HydrophobicContact CZ-CD2 3.79Å
334	A	93.4	Very high	92.3	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-41.6	173.5	0	0	0	0	0	111.9	F276 L286 V288 I330 L331 K338 I347	F276-A334 HydrophobicContact CD2-CB 4.03Å; F276-A334 HydrophobicContact CE2-CB 3.68Å; F276-A334 HydrophobicContact CZ-CB 4.08Å; L286-A334 HydrophobicContact CD2-CB 4.02Å; L286-A334 WeakPolarHBondContact CD2-O 3.49Å; V288-A334 HydrophobicContact CG2-CB 4.2Å; I330-A334 WeakPolarHBondContact O-CB 3.46Å; I330-A334 PolarHBondContact O-N 3.41Å; L331-A334 PolarHBondContact O-N 3.36Å; A334-K338 WeakPolarHBondContact O-CB 3.45Å; A334-K338 PolarHBondContact O-N 3.43Å; A334-I347 HydrophobicContact CB-CD1 4.15Å
335	Q	94.3	Very high	92.2	Very high	105 Å²	105	55.1 Å²	55.1	49%	0.491	28%	0.276	S	S	.	.	H	α-helix	trans	-64.6	-43.7	176.9	-71.1	172.3	-9.6	0	0	111.8	L331 E332 K338 S339 I347	L331-Q335 WeakPolarHBondContact O-CG 3.18Å; L331-Q335 PolarHBondContact O-N 3.4Å; E332-Q335 PolarHBondContact O-N 2.78Å; Q335-K338 PolarHBondContact O-N 3.25Å; Q335-S339 PolarHBondContact O-N 3.07Å; Q335-I347 HydrophobicContact CG-CD1 3.95Å
336	L	93.9	Very high	92.2	Very high	48 Å²	48	60.8 Å²	60.8	25%	0.251	30%	0.3	S	S	.	.	H	α-helix	trans	-61	-50.2	177.1	179	59.8	0	0	0	111.5	E332 F333 K338 S339 L340 L379 L383	E332-L336 WeakPolarHBondContact O-CB 3.28Å; E332-L336 PolarHBondContact O-N 3.11Å; F333-L336 PolarHBondContact O-N 2.97Å; L336-K338 VanDerWaalsContact C-N 3.32Å; L336-K338 PolarHBondContact O-N 2.66Å; L336-S339 PolarHBondContact O-N 2.77Å; L336-S339 VanDerWaalsContact O-N 3.12Å; L336-S339 PolarHBondContact O-OG 3.4Å; L336-L340 HydrophobicContact CD1-CD1 4.07Å; L336-L340 HydrophobicContact CD1-CG 4.14Å; L336-L340 HydrophobicContact CG-CD1 4.06Å; L336-L340 HydrophobicContact CG-CG 4.49Å; L336-L340 WeakPolarHBondContact O-CG 3.32Å; L336-L340 PolarHBondContact O-N 2.69Å; L336-L379 HydrophobicContact CD2-CD2 3.99Å; L336-L379 HydrophobicContact CD2-CG 4.41Å; L336-L383 HydrophobicContact CD2-CD1 3.57Å; L336-L383 HydrophobicContact CG-CD1 4.01Å
337	I	94.4	Very high	92.3	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-60	-43.9	177.9	-73.3	170.8	0	0	0	111.1	F276 I277 A280 F333 S339 L340 V341 L383	F276-I337 HydrophobicContact CB-CD1 3.59Å; F276-I337 HydrophobicContact CB-CG2 4.2Å; F276-I337 HydrophobicContact CD2-CD1 4.16Å; F276-I337 HydrophobicContact CG-CD1 4.42Å; I277-I337 HydrophobicContact CG1-CD1 3.96Å; I277-I337 HydrophobicContact CG1-CG1 4.28Å; I277-I337 HydrophobicContact CG1-CG2 3.99Å; A280-I337 HydrophobicContact CB-CG2 4.06Å; F333-I337 HydrophobicContact CD1-CD1 3.76Å; F333-I337 HydrophobicContact CE1-CD1 3.27Å; F333-I337 HydrophobicContact CE1-CG1 4.34Å; F333-I337 HydrophobicContact CZ-CD1 3.72Å; F333-I337 HydrophobicContact CZ-CG1 4.48Å; F333-I337 PolarHBondContact O-N 3.09Å; I337-S339 VanDerWaalsContact C-N 3.26Å; I337-S339 PolarHBondContact O-N 2.97Å; I337-L340 PolarHBondContact O-N 2.82Å; I337-V341 HydrophobicContact CG2-CG2 4.15Å; I337-V341 WeakPolarHBondContact O-CB 3.29Å; I337-V341 WeakPolarHBondContact O-CG2 3.26Å; I337-V341 PolarHBondContact O-N 3.28Å; I337-L383 HydrophobicContact CD1-CD2 4.45Å; I337-L383 HydrophobicContact CG1-CD1 4.44Å; I337-L383 HydrophobicContact CG1-CD2 4.32Å
338	K	93.9	Very high	92.5	Very high	68 Å²	68	60.5 Å²	60.5	30%	0.296	30%	0.3	S	S	.	.	H	α-helix	trans	-58.6	-39.6	177.1	179.5	176.1	172.3	169	0	111.8	L286 A334 Q335 L336 V342 S343 S345	L286-K338 HydrophobicContact CD2-CB 4.47Å; A334-K338 WeakPolarHBondContact O-CB 3.45Å; A334-K338 PolarHBondContact O-N 3.43Å; Q335-K338 PolarHBondContact O-N 3.25Å; L336-K338 VanDerWaalsContact C-N 3.32Å; L336-K338 PolarHBondContact O-N 2.66Å; K338-V342 PolarHBondContact O-N 2.96Å; K338-S343 WeakPolarHBondContact CE-O 3.34Å; K338-S343 WeakPolarHBondContact CG-O 3.35Å; K338-S343 PolarHBondContact O-N 3.39Å; K338-S345 WeakPolarHBondContact CD-O 3.35Å; K338-S345 WeakPolarHBondContact CE-O 3.38Å; K338-S345 PolarHBondContact NZ-O 3.3Å
339	S	95.1	Very high	92.7	Very high	78 Å²	78	64 Å²	64	55%	0.545	31%	0.314	S	S	.	.	H	α-helix	trans	-68.2	-45.5	177.2	112.5	0	0	0	0	111.8	Q335 L336 I337 V342	Q335-S339 PolarHBondContact O-N 3.07Å; L336-S339 PolarHBondContact O-N 2.77Å; L336-S339 VanDerWaalsContact O-N 3.12Å; L336-S339 PolarHBondContact O-OG 3.4Å; I337-S339 VanDerWaalsContact C-N 3.26Å; I337-S339 PolarHBondContact O-N 2.97Å; S339-V342 PolarHBondContact O-N 2.83Å; S339-V342 VanDerWaalsContact O-N 3.11Å
340	L	94.4	Very high	92.6	Very high	31 Å²	31	65.4 Å²	65.4	16%	0.162	32%	0.321	C	S	.	.	H	α-helix	trans	-67.8	-37.4	-177.9	-67.9	176.4	0	0	0	113	L336 I337 V342 E380 L383 I387	L336-L340 HydrophobicContact CD1-CD1 4.07Å; L336-L340 HydrophobicContact CD1-CG 4.14Å; L336-L340 HydrophobicContact CG-CD1 4.06Å; L336-L340 HydrophobicContact CG-CG 4.49Å; L336-L340 WeakPolarHBondContact O-CG 3.32Å; L336-L340 PolarHBondContact O-N 2.69Å; I337-L340 PolarHBondContact O-N 2.82Å; L340-V342 PolarHBondContact O-N 2.93Å; L340-E380 HydrophobicContact CD1-CG 4.13Å; L340-E380 HydrophobicContact CD2-CG 3.8Å; L340-L383 HydrophobicContact CD1-CB 3.74Å; L340-L383 HydrophobicContact CD1-CD1 3.96Å; L340-I387 HydrophobicContact CB-CD1 3.63Å; L340-I387 HydrophobicContact CD1-CD1 4.2Å
341	V	93.2	Very high	92.3	Very high	28 Å²	28	69.9 Å²	69.9	17%	0.17	35%	0.353	C	S	.	.	H	α-helix	trans	-77.1	-13.8	174.9	-179.2	0	0	0	0	111.5	A280 L281 I337 S343 I387	A280-V341 HydrophobicContact CB-CB 3.96Å; A280-V341 HydrophobicContact CB-CG1 3.93Å; A280-V341 HydrophobicContact CB-CG2 3.95Å; L281-V341 HydrophobicContact CD2-CG1 3.75Å; L281-V341 HydrophobicContact CG-CG1 4.06Å; I337-V341 HydrophobicContact CG2-CG2 4.15Å; I337-V341 WeakPolarHBondContact O-CB 3.29Å; I337-V341 WeakPolarHBondContact O-CG2 3.26Å; I337-V341 PolarHBondContact O-N 3.28Å; V341-S343 PolarHBondContact O-N 3.3Å; V341-I387 HydrophobicContact CG2-CD1 3.82Å; V341-I387 HydrophobicContact CG2-CG1 4.05Å; V341-I387 HydrophobicContact CG2-CG2 3.98Å
342	V	91.3	Very high	91.6	Very high	128 Å²	128	74.5 Å²	74.5	78%	0.776	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	42.5	-171.7	-162.8	0	0	0	0	110.7	K338 S339 L340	K338-V342 PolarHBondContact O-N 2.96Å; S339-V342 PolarHBondContact O-N 2.83Å; S339-V342 VanDerWaalsContact O-N 3.11Å; L340-V342 PolarHBondContact O-N 2.93Å
343	S	88.4	Confident	90.6	Very high	19 Å²	19	72.2 Å²	72.2	13%	0.133	37%	0.371	C	S	.	.			trans	-90.4	146.7	-173.9	-175.9	0	0	0	0	112.9	A280 K338 V341 S345	A280-S343 VanDerWaalsContact O-CB 3.29Å; A280-S343 WeakPolarHBondContact O-CB 3.49Å; A280-S343 PolarHBondContact O-OG 2.94Å; K338-S343 WeakPolarHBondContact CE-O 3.34Å; K338-S343 WeakPolarHBondContact CG-O 3.35Å; K338-S343 PolarHBondContact O-N 3.39Å; V341-S343 PolarHBondContact O-N 3.3Å; S343-S345 VanDerWaalsContact C-N 3.33Å; S343-S345 WeakPolarHBondContact OG-CB 3.44Å; S343-S345 PolarHBondContact OG-N 3.06Å; S343-S345 VanDerWaalsContact OG-N 3.14Å; S343-S345 PolarHBondContact OG-OG 3.48Å
344	R	90.1	Very high	89.5	Confident	240 Å²	240	80.1 Å²	80.1	91%	0.906	41%	0.408	S	S	*	.			trans	-86.6	-1.9	171.6	-63.8	-176	-177.2	179.6	1.4	113.2	Q346	R344-Q346 PolarHBondContact O-N 2.83Å
345	S	93.4	Very high	88.1	Confident	5 Å²	5	84.4 Å²	84.4	4%	0.035	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-50.2	136.8	-179.8	-69.2	0	0	0	0	112.6	Q279 G283 E284 K338 S343	Q279-S345 PolarHBondContact O-OG 2.76Å; G283-S345 VanDerWaalsContact C-OG 3.25Å; G283-S345 WeakPolarHBondContact CA-OG 3.34Å; E284-S345 WeakPolarHBondContact O-CB 3.47Å; E284-S345 PolarHBondContact O-OG 3.1Å; K338-S345 WeakPolarHBondContact CD-O 3.35Å; K338-S345 WeakPolarHBondContact CE-O 3.38Å; K338-S345 PolarHBondContact NZ-O 3.3Å; S343-S345 VanDerWaalsContact C-N 3.33Å; S343-S345 WeakPolarHBondContact OG-CB 3.44Å; S343-S345 PolarHBondContact OG-N 3.06Å; S343-S345 VanDerWaalsContact OG-N 3.14Å; S343-S345 PolarHBondContact OG-OG 3.48Å
346	Q	93.8	Very high	86.9	Confident	149 Å²	149	82.5 Å²	82.5	70%	0.696	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-78.9	151.9	173.1	-64.1	-174.4	-3.8	0	0	110.2	P285 L286 R344	P285-Q346 CarbonylContact C-O 3.57Å; P285-Q346 VanDerWaalsContact CA-O 3.29Å; P285-Q346 WeakPolarHBondContact CA-O 3.44Å; L286-Q346 PolarHBondContact N-O 3.15Å; R344-Q346 PolarHBondContact O-N 2.83Å
347	I	94.7	Very high	85.7	Confident	46 Å²	46	80.5 Å²	80.5	24%	0.236	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	122.2	170.1	-60.9	175.6	0	0	0	106.8	L286 V288 L331 A334 Q335 F349	L286-I347 HydrophobicContact CB-CG1 4.33Å; V288-I347 HydrophobicContact CB-CG2 4.48Å; V288-I347 HydrophobicContact CG2-CG2 3.67Å; L331-I347 HydrophobicContact CD1-CD1 4.36Å; L331-I347 HydrophobicContact CD1-CG2 4.33Å; A334-I347 HydrophobicContact CB-CD1 4.15Å; Q335-I347 HydrophobicContact CG-CD1 3.95Å; I347-F349 HydrophobicContact CG2-CZ 4.33Å
348	Q	93.6	Very high	84.7	Confident	96 Å²	96	87.2 Å²	87.2	45%	0.449	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	138.2	-179.5	-176.4	177.8	15.7	0	0	110.2	P285 L286 V288 L350	P285-Q348 HydrophobicContact CB-CB 4.25Å; L286-Q348 PolarHBondContact O-N 3.4Å; V288-Q348 PolarHBondContact N-O 3.17Å; Q348-L350 HydrophobicContact CG-CD2 4.38Å
349	F	92.1	Very high	83.9	Confident	111 Å²	111	91.5 Å²	91.5	49%	0.487	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	131.3	177.2	-59.6	-84.3	0	0	0	111	V288 G290 T291 L331 I347	V288-F349 HydrophobicContact CB-CD1 3.98Å; V288-F349 HydrophobicContact CB-CE1 4.19Å; V288-F349 HydrophobicContact CG1-CD1 3.89Å; V288-F349 HydrophobicContact CG1-CE1 3.96Å; V288-F349 CarbonylContact O-C 3.54Å; V288-F349 VanDerWaalsContact O-CA 3.26Å; V288-F349 WeakPolarHBondContact O-CA 3.36Å; G290-F349 WeakPolarHBondContact O-CD1 3.35Å; T291-F349 WeakPolarHBondContact O-CE1 3.13Å; L331-F349 HydrophobicContact CD1-CE1 4.4Å; L331-F349 HydrophobicContact CD1-CZ 4.17Å; I347-F349 HydrophobicContact CG2-CZ 4.33Å
350	L	88.9	Confident	83.3	Confident	63 Å²	63	88.4 Å²	88.4	33%	0.33	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	168.5	178.7	-61.9	-177.8	0	0	0	110.7	T287 V288 Y289 G290 Q348	T287-L350 HydrophobicContact CG2-CD1 3.9Å; V288-L350 PolarHBondContact O-N 2.89Å; Y289-L350 HydrophobicContact CD1-CB 3.57Å; Y289-L350 HydrophobicContact CD1-CD1 4.18Å; Y289-L350 HydrophobicContact CD1-CG 4.49Å; Y289-L350 HydrophobicContact CE1-CB 3.82Å; Y289-L350 HydrophobicContact CE1-CD1 3.6Å; Y289-L350 HydrophobicContact CE1-CG 4.35Å; G290-L350 PolarHBondContact N-O 3.36Å; Q348-L350 HydrophobicContact CG-CD2 4.38Å
351	S	84.3	Confident	83.1	Confident	102 Å²	102	91.6 Å²	91.6	71%	0.713	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-61.6	147.9	176.5	54.3	0	0	0	0	112.4	Y289	Y289-S351 WeakPolarHBondContact CD1-O 3.44Å
352	E	76.6	Confident	83.2	Confident	148 Å²	148	90.3 Å²	90.3	69%	0.692	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-57.7	146.7	-179.2	-65.7	-179.7	173.4	0	0	113.1
353	A	71.7	Confident	83.5	Confident	50 Å²	50	85 Å²	85	41%	0.413	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-79.4	135	173.6	0	0	0	0	0	110.1	D355 D356	A353-D355 PolarHBondContact O-N 3.28Å; A353-D356 HydrophobicContact CB-CB 4Å
354	Q	68.6	Low	84	Confident	168 Å²	168	84.5 Å²	84.5	79%	0.785	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	133.5	178.4	-173.1	176.6	6	0	0	111.1	D356	Q354-D356 PolarHBondContact O-N 3.2Å
355	D	64.3	Low	84.4	Confident	90 Å²	90	80.8 Å²	80.8	48%	0.481	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	28	178.6	-53.7	-23.2	0	0	0	114.2	A353 P357	A353-D355 PolarHBondContact O-N 3.28Å; D355-P357 WeakPolarHBondContact O-CD 3.44Å
356	D	68.8	Low	84.6	Confident	65 Å²	65	82.5 Å²	82.5	35%	0.348	39%	0.394	S	S	.	.			trans	-81.1	119.1	171.6	-168.1	32.7	0	0	0	109.8	R296 A353 Q354 Q358	R296-D356 IonicContact NH2-OD1 3.48Å; R296-D356 PolarHBondContact NH2-OD1 2.94Å; R296-D356 IonicContact NH2-OD2 3.5Å; R296-D356 PolarHBondContact NH2-OD2 3.03Å; A353-D356 HydrophobicContact CB-CB 4Å; Q354-D356 PolarHBondContact O-N 3.2Å; D356-Q358 PolarHBondContact O-N 3.4Å
357	P	68.6	Low	84.8	Confident	6 Å²	6	75.4 Å²	75.4	4%	0.039	36%	0.361	C	S	.	.			trans	-58.3	135.2	-174.1	-30	39.4	0	0	0	112.3	R296 D355 R359	R296-P357 PolarHBondContact NH1-O 2.8Å; R296-P357 PolarHBondContact NH2-O 2.93Å; D355-P357 WeakPolarHBondContact O-CD 3.44Å; P357-R359 PolarHBondContact O-N 3.15Å
358	Q	72.8	Confident	85	Confident	141 Å²	141	77.5 Å²	77.5	66%	0.659	37%	0.368	S	S	*	.	S	Bend	trans	-72.1	-35.3	-173.8	-67.4	-163.3	-6.3	0	0	112.9	R296 D356	R296-Q358 PolarHBondContact NH1-O 3.43Å; D356-Q358 PolarHBondContact O-N 3.4Å
359	R	78.3	Confident	85.2	Confident	157 Å²	157	80.7 Å²	80.7	59%	0.592	39%	0.385	S	S	*	.			trans	-142.6	137.9	-178.6	-61.7	-176.1	-176.4	-178.3	0.1	110.9	P357	P357-R359 PolarHBondContact O-N 3.15Å
360	R	81.5	Confident	85.4	Confident	14 Å²	14	80.4 Å²	80.4	5%	0.053	39%	0.386	C	S	.	.			trans	-147.4	115.2	175.7	-172.4	179.5	-71.1	166.1	-5	110.3	S202 E203 F258	S202-R360 WeakPolarHBondContact OG-CD 3.39Å; S202-R360 PolarHBondContact OG-NH1 3.35Å; E203-R360 VanDerWaalsContact CD-NH2 3.31Å; E203-R360 IonicContact OE1-CZ 2.72Å; E203-R360 IonicContact OE1-NH1 3.99Å; E203-R360 PolarHBondContact OE1-NH1 2.88Å; E203-R360 IonicContact OE1-NH2 3.87Å; E203-R360 PolarHBondContact OE1-NH2 3.48Å; E203-R360 IonicContact OE2-NH2 3.44Å; F258-R360 HydrophobicContact CD1-CG 3.91Å; F258-R360 HydrophobicContact CE1-CG 3.71Å
361	R	91.1	Very high	85.8	Confident	97 Å²	97	78.5 Å²	78.5	37%	0.366	38%	0.377	S	S	.	.			trans	-138.7	119.7	-179.2	-173.4	-178.2	-176.3	-170.2	-4.4	109.9	H211 P212 Q213 P325 E327	H211-R361 WeakPolarHBondContact CE1-CB 3.41Å; P212-R361 WeakPolarHBondContact CA-O 3.06Å; P212-R361 HydrophobicContact CB-CB 4.25Å; P212-R361 HydrophobicContact CB-CG 4.22Å; P212-R361 VanDerWaalsContact CB-O 3.31Å; P212-R361 WeakPolarHBondContact CB-O 3.35Å; Q213-R361 PolarHBondContact N-O 2.89Å; Q213-R361 PolarHBondContact OE1-O 3.49Å; P325-R361 PolarHBondContact O-NE 2.64Å; E327-R361 HydrophobicContact CG-CB 4.08Å; E327-R361 HydrophobicContact CG-CG 4Å; E327-R361 WeakPolarHBondContact OE2-CD 3.47Å
362	P	94.8	Very high	86.5	Confident	2 Å²	2	77 Å²	77	1%	0.013	38%	0.377	C	S	.	.	B	Isolated β-bridge	trans	-70.2	133.8	177.2	28.5	-32.9	0	0	0	111	F258 N324 I364	F258-P362 HydrophobicContact CD1-CB 3.72Å; F258-P362 HydrophobicContact CD1-CG 3.91Å; F258-P362 HydrophobicContact CD2-CB 3.71Å; F258-P362 HydrophobicContact CD2-CG 4.43Å; F258-P362 HydrophobicContact CE1-CB 3.61Å; F258-P362 HydrophobicContact CE1-CG 4.2Å; F258-P362 HydrophobicContact CE2-CB 3.63Å; F258-P362 HydrophobicContact CG-CB 3.76Å; F258-P362 HydrophobicContact CG-CG 4.04Å; F258-P362 HydrophobicContact CZ-CB 3.57Å; N324-P362 WeakPolarHBondContact O-CG 3.39Å; P362-I364 HydrophobicContact CB-CG2 3.86Å; P362-I364 HydrophobicContact CG-CG2 4.21Å
363	D	97.4	Very high	87.5	Confident	17 Å²	17	70.4 Å²	70.4	9%	0.091	35%	0.346	C	S	.	.			trans	-82.1	115.7	154.4	-172.2	-16.2	0	0	0	108.3	P212 Q213 N214 N321 R365	P212-D363 HydrophobicContact CB-CB 4.28Å; P212-D363 HydrophobicContact CG-CB 4.17Å; Q213-D363 PolarHBondContact O-N 3.45Å; N214-D363 HydrophobicContact CB-CB 4.07Å; N321-D363 WeakPolarHBondContact CB-O 3.44Å; N321-D363 PolarHBondContact ND2-O 2.92Å; D363-R365 VanDerWaalsContact OD1-CB 3.31Å; D363-R365 WeakPolarHBondContact OD1-CB 3.12Å; D363-R365 WeakPolarHBondContact OD1-CG 3.38Å; D363-R365 PolarHBondContact OD1-N 3.27Å; D363-R365 IonicContact OD1-NE 2.7Å; D363-R365 PolarHBondContact OD1-NE 3.12Å; D363-R365 VanDerWaalsContact OD1-NE 3.11Å; D363-R365 IonicContact OD2-CZ 2.67Å; D363-R365 IonicContact OD2-NE 3.12Å; D363-R365 PolarHBondContact OD2-NE 2.94Å; D363-R365 IonicContact OD2-NH2 3.9Å; D363-R365 PolarHBondContact OD2-NH2 3.39Å
364	I	98.1	Very high	88.8	Confident	7 Å²	7	72.8 Å²	72.8	4%	0.036	35%	0.348	C	S	.	.			trans	-107.5	13.4	-178.7	63.2	162.4	0	0	0	113.1	P325 P362 K366 A367 K368 W373	P325-I364 HydrophobicContact CG-CD1 3.93Å; P325-I364 HydrophobicContact CG-CG1 4.13Å; P362-I364 HydrophobicContact CB-CG2 3.86Å; P362-I364 HydrophobicContact CG-CG2 4.21Å; I364-K366 PolarHBondContact O-N 3.44Å; I364-A367 HydrophobicContact CB-CB 4.5Å; I364-A367 PolarHBondContact O-N 2.96Å; I364-A367 VanDerWaalsContact O-N 3.11Å; I364-K368 HydrophobicContact CD1-CD 4.46Å; I364-K368 VanDerWaalsContact CD1-CE 3.45Å; I364-K368 HydrophobicContact CD1-CG 4.33Å; I364-K368 HydrophobicContact CG1-CG 4.45Å; I364-K368 PolarHBondContact O-N 3.01Å; I364-W373 HydrophobicContact CG2-CZ3 4.48Å
365	R	98.2	Very high	90.2	Very high	163 Å²	163	65.9 Å²	65.9	62%	0.615	32%	0.318	S	S	*	.	H	α-helix	trans	-55.2	-40	-180	-74.8	-179.9	-64.9	157.6	0.2	112.1	D363 K368 M369	D363-R365 VanDerWaalsContact OD1-CB 3.31Å; D363-R365 WeakPolarHBondContact OD1-CB 3.12Å; D363-R365 WeakPolarHBondContact OD1-CG 3.38Å; D363-R365 PolarHBondContact OD1-N 3.27Å; D363-R365 IonicContact OD1-NE 2.7Å; D363-R365 PolarHBondContact OD1-NE 3.12Å; D363-R365 VanDerWaalsContact OD1-NE 3.11Å; D363-R365 IonicContact OD2-CZ 2.67Å; D363-R365 IonicContact OD2-NE 3.12Å; D363-R365 PolarHBondContact OD2-NE 2.94Å; D363-R365 IonicContact OD2-NH2 3.9Å; D363-R365 PolarHBondContact OD2-NH2 3.39Å; R365-K368 PolarHBondContact O-N 3.31Å; R365-M369 WeakPolarHBondContact O-CB 3.48Å; R365-M369 VanDerWaalsContact O-CG 3.3Å; R365-M369 WeakPolarHBondContact O-CG 3.45Å; R365-M369 PolarHBondContact O-N 3.43Å
366	K	98.1	Very high	91.8	Very high	41 Å²	41	66.7 Å²	66.7	18%	0.178	33%	0.326	C	S	.	.	H	α-helix	trans	-61.7	-45.9	177	-170.9	176.2	-175.3	175.9	0	112.4	E215 S318 P319 V320 I364 M369 M370	E215-K366 HydrophobicContact CG-CD 4.41Å; S318-K366 WeakPolarHBondContact OG-CE 3.34Å; S318-K366 PolarHBondContact OG-NZ 2.83Å; P319-K366 WeakPolarHBondContact O-CE 3.49Å; P319-K366 PolarHBondContact O-NZ 2.82Å; V320-K366 HydrophobicContact CG2-CD 4.19Å; V320-K366 HydrophobicContact CG2-CG 4.47Å; I364-K366 PolarHBondContact O-N 3.44Å; K366-M369 PolarHBondContact O-N 3.13Å; K366-M370 HydrophobicContact CD-SD 4.5Å; K366-M370 HydrophobicContact CG-CG 4.29Å; K366-M370 HydrophobicContact CG-SD 3.76Å; K366-M370 VanDerWaalsContact O-CB 3.3Å; K366-M370 WeakPolarHBondContact O-CB 3.45Å; K366-M370 WeakPolarHBondContact O-CG 3.41Å; K366-M370 PolarHBondContact O-N 2.76Å
367	A	98.4	Very high	93.1	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.4	-43.2	177.1	0	0	0	0	0	111.5	V320 L322 I364 L371 G372 W373	V320-A367 HydrophobicContact CG1-CB 3.68Å; L322-A367 HydrophobicContact CD2-CB 4.34Å; I364-A367 HydrophobicContact CB-CB 4.5Å; I364-A367 PolarHBondContact O-N 2.96Å; I364-A367 VanDerWaalsContact O-N 3.11Å; A367-L371 HydrophobicContact CB-CD1 4.47Å; A367-L371 WeakPolarHBondContact O-CA 3.16Å; A367-L371 WeakPolarHBondContact O-CB 3.44Å; A367-L371 PolarHBondContact O-N 3.48Å; A367-G372 PolarHBondContact O-N 3.43Å; A367-W373 HydrophobicContact CB-CE3 3.66Å; A367-W373 HydrophobicContact CB-CZ3 4.18Å; A367-W373 PolarHBondContact O-N 3.41Å
368	K	98.1	Very high	94.4	Very high	89 Å²	89	67.6 Å²	67.6	39%	0.387	34%	0.335	S	S	.	.	H	α-helix	trans	-60.1	-52.5	175.4	-67.9	-167.9	-177.8	-145.9	0	112.2	I364 R365 G372 W373 E374	I364-K368 HydrophobicContact CD1-CD 4.46Å; I364-K368 VanDerWaalsContact CD1-CE 3.45Å; I364-K368 HydrophobicContact CD1-CG 4.33Å; I364-K368 HydrophobicContact CG1-CG 4.45Å; I364-K368 PolarHBondContact O-N 3.01Å; R365-K368 PolarHBondContact O-N 3.31Å; K368-G372 VanDerWaalsContact O-CA 3.25Å; K368-G372 WeakPolarHBondContact O-CA 3.03Å; K368-G372 PolarHBondContact O-N 2.99Å; K368-W373 WeakPolarHBondContact CA-O 3.33Å; K368-W373 WeakPolarHBondContact CG-O 3.07Å; K368-W373 PolarHBondContact N-O 3.43Å; K368-E374 HydrophobicContact CD-CB 4.45Å; K368-E374 WeakPolarHBondContact CE-OE2 3.28Å; K368-E374 HydrophobicContact CG-CB 4.23Å; K368-E374 IonicContact NZ-OE2 3.68Å; K368-E374 PolarHBondContact NZ-OE2 2.86Å
369	M	97.8	Very high	95.4	Very high	163 Å²	163	61.5 Å²	61.5	80%	0.803	31%	0.307	S	S	*	.	H	α-helix	trans	-70.2	-38.7	-173.8	-70.9	178.5	66.9	0	0	113.1	R365 K366	R365-M369 WeakPolarHBondContact O-CB 3.48Å; R365-M369 VanDerWaalsContact O-CG 3.3Å; R365-M369 WeakPolarHBondContact O-CG 3.45Å; R365-M369 PolarHBondContact O-N 3.43Å; K366-M369 PolarHBondContact O-N 3.13Å
370	M	97.7	Very high	96.1	Very high	106 Å²	106	59.2 Å²	59.2	52%	0.522	30%	0.303	S	S	.	.	H	α-helix	trans	-100.8	-23.1	-170.6	-53.1	-170.1	79.1	0	0	114	I316 K366	I316-M370 HydrophobicContact CD1-CB 3.23Å; I316-M370 HydrophobicContact CD1-CE 4.13Å; I316-M370 HydrophobicContact CD1-CG 4.22Å; I316-M370 HydrophobicContact CD1-SD 4.03Å; I316-M370 HydrophobicContact CG1-CB 4.21Å; I316-M370 HydrophobicContact CG1-CE 3.9Å; I316-M370 HydrophobicContact CG1-SD 4.35Å; I316-M370 HydrophobicContact CG2-CE 4.39Å; I316-M370 HydrophobicContact CG2-SD 4.32Å; K366-M370 HydrophobicContact CD-SD 4.5Å; K366-M370 HydrophobicContact CG-CG 4.29Å; K366-M370 HydrophobicContact CG-SD 3.76Å; K366-M370 VanDerWaalsContact O-CB 3.3Å; K366-M370 WeakPolarHBondContact O-CB 3.45Å; K366-M370 WeakPolarHBondContact O-CG 3.41Å; K366-M370 PolarHBondContact O-N 2.76Å
371	L	97.8	Very high	96.8	Very high	23 Å²	23	62.7 Å²	62.7	12%	0.12	32%	0.32	C	S	.	.	H	α-helix	trans	-110.8	-12.6	178	-56.2	175.8	0	0	0	113.2	L310 L311 S314 I316 V320 A367 W373	L310-L371 HydrophobicContact CB-CB 4.46Å; L311-L371 HydrophobicContact CB-CD1 4.07Å; L311-L371 HydrophobicContact CD1-CD1 4.31Å; L311-L371 HydrophobicContact CD1-CD2 4.42Å; S314-L371 VanDerWaalsContact CB-CD2 3.46Å; I316-L371 HydrophobicContact CD1-CD2 3.5Å; I316-L371 VanDerWaalsContact CD1-CD2 3.5Å; I316-L371 HydrophobicContact CD1-CG 3.96Å; V320-L371 HydrophobicContact CG1-CD1 4.22Å; A367-L371 HydrophobicContact CB-CD1 4.47Å; A367-L371 WeakPolarHBondContact O-CA 3.16Å; A367-L371 WeakPolarHBondContact O-CB 3.44Å; A367-L371 PolarHBondContact O-N 3.48Å; L371-W373 HydrophobicContact CB-CB 3.9Å; L371-W373 PolarHBondContact O-N 2.89Å
372	G	98.1	Very high	97.1	Very high	70 Å²	70	58.1 Å²	58.1	72%	0.722	30%	0.303	S	S	*	.			trans	62.5	26.2	-168.3	0	0	0	0	0	112.4	A367 K368	A367-G372 PolarHBondContact O-N 3.43Å; K368-G372 VanDerWaalsContact O-CA 3.25Å; K368-G372 WeakPolarHBondContact O-CA 3.03Å; K368-G372 PolarHBondContact O-N 2.99Å
373	W	98.5	Very high	97.1	Very high	10 Å²	10	58 Å²	58	4%	0.038	30%	0.302	C	S	.	.			trans	-107.1	135.5	-173.9	177.4	83.6	0	0	0	111.6	D303 L310 L322 G323 I364 A367 K368 L371	D303-W373 HydrophobicContact CB-CZ2 4.22Å; D303-W373 WeakPolarHBondContact O-CZ2 3.45Å; D303-W373 PolarHBondContact O-NE1 3.45Å; L310-W373 HydrophobicContact CD1-CB 3.8Å; L310-W373 HydrophobicContact CD1-CG 4.12Å; L322-W373 HydrophobicContact CB-CH2 4.43Å; L322-W373 HydrophobicContact CD2-CD2 4.18Å; L322-W373 HydrophobicContact CD2-CE3 3.85Å; L322-W373 HydrophobicContact CD2-CH2 4.21Å; L322-W373 HydrophobicContact CD2-CZ3 3.85Å; G323-W373 WeakPolarHBondContact O-CH2 3.22Å; I364-W373 HydrophobicContact CG2-CZ3 4.48Å; A367-W373 HydrophobicContact CB-CE3 3.66Å; A367-W373 HydrophobicContact CB-CZ3 4.18Å; A367-W373 PolarHBondContact O-N 3.41Å; K368-W373 WeakPolarHBondContact CA-O 3.33Å; K368-W373 WeakPolarHBondContact CG-O 3.07Å; K368-W373 PolarHBondContact N-O 3.43Å; L371-W373 HydrophobicContact CB-CB 3.9Å; L371-W373 PolarHBondContact O-N 2.89Å
374	E	97.8	Very high	97	Very high	99 Å²	99	59.9 Å²	59.9	46%	0.463	31%	0.312	S	S	.	.			trans	-147.5	154.7	166	63.4	-173.9	165.1	0	0	109.9	K368 V376	K368-E374 HydrophobicContact CD-CB 4.45Å; K368-E374 WeakPolarHBondContact CE-OE2 3.28Å; K368-E374 HydrophobicContact CG-CB 4.23Å; K368-E374 IonicContact NZ-OE2 3.68Å; K368-E374 PolarHBondContact NZ-OE2 2.86Å; E374-V376 PolarHBondContact O-N 3.4Å
375	P	97.6	Very high	97	Very high	24 Å²	24	63.5 Å²	63.5	16%	0.156	33%	0.327	C	S	.	.			trans	-65.2	133.3	173.8	29.7	-37.3	0	0	0	110.2	D303 N324	D303-P375 HydrophobicContact CB-CB 4.18Å; N324-P375 HydrophobicContact CB-CB 4.25Å; N324-P375 HydrophobicContact CB-CG 4.07Å
376	V	97.9	Very high	96.9	Very high	106 Å²	106	55.7 Å²	55.7	64%	0.642	30%	0.298	S	S	*	.			trans	-117	-13.1	-177.8	-62.5	0	0	0	0	113.1	D303 E374 P378	D303-V376 WeakPolarHBondContact OD1-CG2 3.26Å; D303-V376 PolarHBondContact OD1-N 3.39Å; D303-V376 PolarHBondContact OD2-N 3.01Å; E374-V376 PolarHBondContact O-N 3.4Å; V376-P378 WeakPolarHBondContact O-CD 3.19Å
377	V	97.4	Very high	96.7	Very high	18 Å²	18	54.5 Å²	54.5	11%	0.109	29%	0.293	C	S	.	.	S	Bend	trans	-85.6	118.2	-179.1	-177.7	0	0	0	0	109.7	Y300 D303 E381	Y300-V377 HydrophobicContact CD1-CB 4.05Å; Y300-V377 HydrophobicContact CD1-CG1 3.74Å; Y300-V377 HydrophobicContact CD1-CG2 3.96Å; Y300-V377 HydrophobicContact CE1-CG1 4.45Å; Y300-V377 HydrophobicContact CG-CB 4.38Å; Y300-V377 HydrophobicContact CG-CG1 3.99Å; D303-V377 WeakPolarHBondContact OD2-CB 3.38Å; D303-V377 PolarHBondContact OD2-N 3.22Å; V377-E381 HydrophobicContact CG1-CB 4.22Å; V377-E381 HydrophobicContact CG1-CG 4.43Å
378	P	95.6	Very high	96.6	Very high	73 Å²	73	59.7 Å²	59.7	47%	0.474	32%	0.318	S	S	.	.			trans	-60.4	146.7	174.2	-22	34.3	0	0	0	111.5	V376 E380 E381 G382	V376-P378 WeakPolarHBondContact O-CD 3.19Å; P378-E380 VanDerWaalsContact C-N 3.3Å; P378-E380 PolarHBondContact O-N 3.5Å; P378-E381 HydrophobicContact CB-CB 4.5Å; P378-E381 PolarHBondContact O-N 3.43Å; P378-E381 VanDerWaalsContact O-N 3.15Å; P378-G382 PolarHBondContact O-N 2.98Å; P378-G382 VanDerWaalsContact O-N 3.12Å
379	L	92.8	Very high	96.5	Very high	13 Å²	13	57.2 Å²	57.2	7%	0.068	31%	0.306	C	S	.	.	H	α-helix	trans	-54.2	-46.3	-176.9	-179.1	62.8	0	0	0	112.4	F261 F298 H328 F333 L336 E381 G382 L383	F261-L379 HydrophobicContact CE1-CD1 3.74Å; F261-L379 HydrophobicContact CZ-CD1 3.72Å; F298-L379 HydrophobicContact CB-CD1 4.19Å; H328-L379 VanDerWaalsContact CD2-CD2 3.47Å; H328-L379 WeakPolarHBondContact CD2-CD2 3.42Å; H328-L379 WeakPolarHBondContact NE2-CD2 3.25Å; F333-L379 HydrophobicContact CD2-CD2 4.23Å; F333-L379 HydrophobicContact CE2-CD1 4.21Å; F333-L379 HydrophobicContact CE2-CD2 4.2Å; L336-L379 HydrophobicContact CD2-CD2 3.99Å; L336-L379 HydrophobicContact CD2-CG 4.41Å; L379-E381 PolarHBondContact O-N 2.75Å; L379-G382 PolarHBondContact O-N 3.14Å; L379-L383 HydrophobicContact CD1-CD1 4.29Å; L379-L383 HydrophobicContact CD1-CG 4.27Å; L379-L383 HydrophobicContact CD2-CD1 4.45Å; L379-L383 HydrophobicContact CG-CD1 3.93Å; L379-L383 HydrophobicContact CG-CG 4.33Å; L379-L383 WeakPolarHBondContact O-CB 3.17Å; L379-L383 WeakPolarHBondContact O-CG 3.21Å; L379-L383 PolarHBondContact O-N 3.01Å
380	E	93.8	Very high	96.3	Very high	109 Å²	109	49.5 Å²	49.5	51%	0.509	27%	0.268	S	S	.	.	H	α-helix	trans	-61.5	-41.3	-178.8	-168.3	178.7	171.8	0	0	112.6	L340 P378 L383 N384	L340-E380 HydrophobicContact CD1-CG 4.13Å; L340-E380 HydrophobicContact CD2-CG 3.8Å; P378-E380 VanDerWaalsContact C-N 3.3Å; P378-E380 PolarHBondContact O-N 3.5Å; E380-L383 PolarHBondContact O-N 3.02Å; E380-N384 WeakPolarHBondContact O-CB 3.32Å; E380-N384 PolarHBondContact O-N 3.38Å; E380-N384 PolarHBondContact O-ND2 3.16Å
381	E	96.1	Very high	96.1	Very high	87 Å²	87	46.4 Å²	46.4	41%	0.407	26%	0.257	S	S	.	.	H	α-helix	trans	-63.2	-47.3	176.7	-172.3	-167.9	144.5	0	0	110.8	V377 P378 L379 L383 N384 K385	V377-E381 HydrophobicContact CG1-CB 4.22Å; V377-E381 HydrophobicContact CG1-CG 4.43Å; P378-E381 HydrophobicContact CB-CB 4.5Å; P378-E381 PolarHBondContact O-N 3.43Å; P378-E381 VanDerWaalsContact O-N 3.15Å; L379-E381 PolarHBondContact O-N 2.75Å; E381-L383 VanDerWaalsContact C-N 3.31Å; E381-L383 PolarHBondContact O-N 3.28Å; E381-N384 PolarHBondContact O-N 3.1Å; E381-K385 PolarHBondContact O-N 3.41Å; E381-K385 VanDerWaalsContact OE1-CE 3.32Å; E381-K385 WeakPolarHBondContact OE1-CE 3.46Å; E381-K385 IonicContact OE1-NZ 2.7Å; E381-K385 PolarHBondContact OE1-NZ 3.29Å
382	G	96.3	Very high	95.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.2	-40.5	177	0	0	0	0	0	112.4	F261 Y300 P378 L379 T386	F261-G382 VanDerWaalsContact CE2-C 3.42Å; Y300-G382 VanDerWaalsContact CD2-CA 3.41Å; Y300-G382 WeakPolarHBondContact CE2-O 3.42Å; P378-G382 PolarHBondContact O-N 2.98Å; P378-G382 VanDerWaalsContact O-N 3.12Å; L379-G382 PolarHBondContact O-N 3.14Å; G382-T386 WeakPolarHBondContact O-CB 3.29Å; G382-T386 PolarHBondContact O-N 2.77Å; G382-T386 VanDerWaalsContact O-N 3.09Å; G382-T386 PolarHBondContact O-OG1 3.38Å
383	L	95.4	Very high	95.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.1	-46.1	177.9	-76.5	174.4	0	0	0	111.3	F261 V273 I277 F333 L336 I337 L340 L379 E380 E381 K385 T386 I387	F261-L383 HydrophobicContact CD2-CD2 4.26Å; F261-L383 HydrophobicContact CE2-CD2 3.8Å; F261-L383 HydrophobicContact CE2-CG 4.04Å; F261-L383 HydrophobicContact CZ-CD2 4.35Å; F261-L383 HydrophobicContact CZ-CG 4.28Å; V273-L383 HydrophobicContact CG1-CD2 4.09Å; I277-L383 HydrophobicContact CD1-CD2 4.36Å; F333-L383 HydrophobicContact CE2-CD1 4Å; F333-L383 HydrophobicContact CE2-CD2 4.03Å; F333-L383 HydrophobicContact CZ-CD2 3.79Å; L336-L383 HydrophobicContact CD2-CD1 3.57Å; L336-L383 HydrophobicContact CG-CD1 4.01Å; I337-L383 HydrophobicContact CD1-CD2 4.45Å; I337-L383 HydrophobicContact CG1-CD1 4.44Å; I337-L383 HydrophobicContact CG1-CD2 4.32Å; L340-L383 HydrophobicContact CD1-CB 3.74Å; L340-L383 HydrophobicContact CD1-CD1 3.96Å; L379-L383 HydrophobicContact CD1-CD1 4.29Å; L379-L383 HydrophobicContact CD1-CG 4.27Å; L379-L383 HydrophobicContact CD2-CD1 4.45Å; L379-L383 HydrophobicContact CG-CD1 3.93Å; L379-L383 HydrophobicContact CG-CG 4.33Å; L379-L383 WeakPolarHBondContact O-CB 3.17Å; L379-L383 WeakPolarHBondContact O-CG 3.21Å; L379-L383 PolarHBondContact O-N 3.01Å; E380-L383 PolarHBondContact O-N 3.02Å; E381-L383 VanDerWaalsContact C-N 3.31Å; E381-L383 PolarHBondContact O-N 3.28Å; L383-K385 VanDerWaalsContact C-N 3.33Å; L383-K385 PolarHBondContact O-N 2.85Å; L383-T386 CarbonylContact O-C 3.49Å; L383-T386 WeakPolarHBondContact O-CA 3.46Å; L383-T386 WeakPolarHBondContact O-CB 3.39Å; L383-T386 PolarHBondContact O-N 3.4Å; L383-I387 VanDerWaalsContact O-CG1 3.29Å; L383-I387 WeakPolarHBondContact O-CG1 3.19Å; L383-I387 PolarHBondContact O-N 2.9Å
384	N	96.3	Very high	95.1	Very high	57 Å²	57	50.5 Å²	50.5	31%	0.305	25%	0.252	S	S	.	.	H	α-helix	trans	-56.9	-45.6	177.5	-83.5	-43.1	0	0	0	112	E380 E381 T386 I387 Q388	E380-N384 WeakPolarHBondContact O-CB 3.32Å; E380-N384 PolarHBondContact O-N 3.38Å; E380-N384 PolarHBondContact O-ND2 3.16Å; E381-N384 PolarHBondContact O-N 3.1Å; N384-T386 VanDerWaalsContact C-N 3.28Å; N384-T386 PolarHBondContact O-N 2.78Å; N384-I387 PolarHBondContact O-N 3.49Å; N384-Q388 WeakPolarHBondContact O-CB 3.27Å; N384-Q388 VanDerWaalsContact O-CG 3.28Å; N384-Q388 WeakPolarHBondContact O-CG 3.33Å; N384-Q388 PolarHBondContact O-N 3.22Å
385	K	96.6	Very high	94.7	Very high	82 Å²	82	50.8 Å²	50.8	36%	0.357	25%	0.253	S	S	.	.	H	α-helix	trans	-61.5	-37.5	175.2	-68.5	176.2	-173.4	170.3	0	112.4	Y300 E381 L383 Y389	Y300-K385 HydrophobicContact CE1-CD 4.31Å; Y300-K385 HydrophobicContact CE2-CB 4.46Å; Y300-K385 VanDerWaalsContact OH-CD 3.26Å; Y300-K385 WeakPolarHBondContact OH-CD 3.5Å; E381-K385 PolarHBondContact O-N 3.41Å; E381-K385 VanDerWaalsContact OE1-CE 3.32Å; E381-K385 WeakPolarHBondContact OE1-CE 3.46Å; E381-K385 IonicContact OE1-NZ 2.7Å; E381-K385 PolarHBondContact OE1-NZ 3.29Å; L383-K385 VanDerWaalsContact C-N 3.33Å; L383-K385 PolarHBondContact O-N 2.85Å; K385-Y389 PolarHBondContact O-N 3.44Å; K385-Y389 VanDerWaalsContact O-N 3.17Å
386	T	95.9	Very high	94.1	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-71.6	-42.1	179.6	-54.3	0	0	0	0	111.7	F261 G262 I277 G382 L383 N384 Y389 F390	F261-T386 HydrophobicContact CD2-CG2 4.45Å; G262-T386 WeakPolarHBondContact CA-OG1 3.26Å; I277-T386 HydrophobicContact CD1-CG2 3.73Å; G382-T386 WeakPolarHBondContact O-CB 3.29Å; G382-T386 PolarHBondContact O-N 2.77Å; G382-T386 VanDerWaalsContact O-N 3.09Å; G382-T386 PolarHBondContact O-OG1 3.38Å; L383-T386 CarbonylContact O-C 3.49Å; L383-T386 WeakPolarHBondContact O-CA 3.46Å; L383-T386 WeakPolarHBondContact O-CB 3.39Å; L383-T386 PolarHBondContact O-N 3.4Å; N384-T386 VanDerWaalsContact C-N 3.28Å; N384-T386 PolarHBondContact O-N 2.78Å; T386-Y389 WeakPolarHBondContact O-CB 3.22Å; T386-Y389 PolarHBondContact O-N 3.24Å; T386-F390 HydrophobicContact CG2-CD2 3.82Å; T386-F390 HydrophobicContact CG2-CE2 3.61Å; T386-F390 WeakPolarHBondContact O-CD2 3.4Å; T386-F390 PolarHBondContact O-N 3.17Å
387	I	95.6	Very high	93.2	Very high	15 Å²	15	54.3 Å²	54.3	8%	0.077	26%	0.26	C	S	.	.	H	α-helix	trans	-61	-47.6	174.9	-69.5	163	0	0	0	110	I277 L281 L340 V341 L383 N384 Y389 F390 S391	I277-I387 HydrophobicContact CD1-CG1 3.97Å; I277-I387 HydrophobicContact CG1-CG1 3.98Å; I277-I387 HydrophobicContact CG2-CB 4.49Å; I277-I387 HydrophobicContact CG2-CG1 3.95Å; L281-I387 HydrophobicContact CD2-CG2 4.38Å; L340-I387 HydrophobicContact CB-CD1 3.63Å; L340-I387 HydrophobicContact CD1-CD1 4.2Å; V341-I387 HydrophobicContact CG2-CD1 3.82Å; V341-I387 HydrophobicContact CG2-CG1 4.05Å; V341-I387 HydrophobicContact CG2-CG2 3.98Å; L383-I387 VanDerWaalsContact O-CG1 3.29Å; L383-I387 WeakPolarHBondContact O-CG1 3.19Å; L383-I387 PolarHBondContact O-N 2.9Å; N384-I387 PolarHBondContact O-N 3.49Å; I387-Y389 PolarHBondContact O-N 2.9Å; I387-F390 PolarHBondContact O-N 3.4Å; I387-S391 WeakPolarHBondContact O-CB 3.3Å; I387-S391 PolarHBondContact O-N 3.27Å
388	Q	95.8	Very high	92.2	Very high	109 Å²	109	56.6 Å²	56.6	51%	0.509	28%	0.281	S	S	.	.	H	α-helix	trans	-59.5	-34.5	176.8	-73.4	175.6	7.8	0	0	113.1	N384 R392	N384-Q388 WeakPolarHBondContact O-CB 3.27Å; N384-Q388 VanDerWaalsContact O-CG 3.28Å; N384-Q388 WeakPolarHBondContact O-CG 3.33Å; N384-Q388 PolarHBondContact O-N 3.22Å; Q388-R392 PolarHBondContact O-N 3.38Å; Q388-R392 PolarHBondContact O-NE 3.49Å
389	Y	95.3	Very high	91.1	Very high	38 Å²	38	59.4 Å²	59.4	15%	0.149	29%	0.292	C	S	.	.	H	α-helix	trans	-66.9	-51.3	174.1	174	-98.7	0	0	0	111.2	R126 R264 K385 T386 I387 S391 R392 E393	R126-Y389 PolarHBondContact NH2-OH 3.27Å; R264-Y389 VanDerWaalsContact CA-CZ 3.5Å; R264-Y389 HydrophobicContact CG-CE2 4.24Å; R264-Y389 VanDerWaalsContact N-CZ 3.28Å; K385-Y389 PolarHBondContact O-N 3.44Å; K385-Y389 VanDerWaalsContact O-N 3.17Å; T386-Y389 WeakPolarHBondContact O-CB 3.22Å; T386-Y389 PolarHBondContact O-N 3.24Å; I387-Y389 PolarHBondContact O-N 2.9Å; Y389-S391 VanDerWaalsContact C-N 3.35Å; Y389-S391 PolarHBondContact O-N 2.98Å; Y389-R392 PolarHBondContact O-N 3.35Å; Y389-E393 HydrophobicContact CD1-CG 4.24Å; Y389-E393 HydrophobicContact CE1-CG 3.69Å; Y389-E393 HydrophobicContact CE2-CG 4.1Å; Y389-E393 WeakPolarHBondContact O-CG 3.25Å; Y389-E393 PolarHBondContact O-N 3.11Å
390	F	94.2	Very high	89.6	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.6	-33.5	-178.9	-77.2	-58.8	0	0	0	113.5	M265 M267 I277 L278 L281 T386 I387 E393 L394	M265-F390 HydrophobicContact CB-CZ 3.9Å; M267-F390 HydrophobicContact CB-CE1 4.46Å; M267-F390 HydrophobicContact CG-CD1 3.88Å; M267-F390 HydrophobicContact CG-CE1 3.8Å; I277-F390 HydrophobicContact CB-CD2 4.37Å; I277-F390 HydrophobicContact CD1-CD2 4.36Å; I277-F390 HydrophobicContact CG2-CB 4Å; I277-F390 HydrophobicContact CG2-CD2 3.81Å; I277-F390 HydrophobicContact CG2-CG 4.26Å; L278-F390 HydrophobicContact CD2-CB 4.35Å; L278-F390 HydrophobicContact CD2-CD1 4.08Å; L278-F390 HydrophobicContact CD2-CG 4.36Å; L281-F390 HydrophobicContact CD1-CB 3.84Å; T386-F390 HydrophobicContact CG2-CD2 3.82Å; T386-F390 HydrophobicContact CG2-CE2 3.61Å; T386-F390 WeakPolarHBondContact O-CD2 3.4Å; T386-F390 PolarHBondContact O-N 3.17Å; I387-F390 PolarHBondContact O-N 3.4Å; F390-E393 PolarHBondContact O-N 3.25Å; F390-L394 WeakPolarHBondContact O-CG 3.49Å; F390-L394 PolarHBondContact O-N 3.21Å
391	S	93.4	Very high	87.3	Confident	42 Å²	42	68 Å²	68	29%	0.294	34%	0.336	S	S	.	.	H	α-helix	trans	-57.7	-49.4	172.9	-168.4	0	0	0	0	111.1	I387 Y389 E393 L394 E395	I387-S391 WeakPolarHBondContact O-CB 3.3Å; I387-S391 PolarHBondContact O-N 3.27Å; Y389-S391 VanDerWaalsContact C-N 3.35Å; Y389-S391 PolarHBondContact O-N 2.98Å; S391-E393 VanDerWaalsContact C-N 3.33Å; S391-E393 PolarHBondContact O-N 2.82Å; S391-L394 PolarHBondContact O-N 3.05Å; S391-E395 WeakPolarHBondContact O-CG 3.46Å; S391-E395 PolarHBondContact O-N 3.49Å; S391-E395 VanDerWaalsContact O-N 3.07Å
392	R	92.8	Very high	84.6	Confident	143 Å²	143	73.1 Å²	73.1	54%	0.54	35%	0.353	S	S	.	.	H	α-helix	trans	-64.2	-36.4	176.7	-75.1	-174.9	-95	-170.4	-10.6	112.7	Q388 Y389 E395 H396	Q388-R392 PolarHBondContact O-N 3.38Å; Q388-R392 PolarHBondContact O-NE 3.49Å; Y389-R392 PolarHBondContact O-N 3.35Å; R392-E395 PolarHBondContact O-N 3.41Å; R392-H396 PolarHBondContact O-N 2.85Å
393	E	90.6	Very high	82.1	Confident	12 Å²	12	80 Å²	80	6%	0.056	39%	0.388	C	S	.	.	H	α-helix	trans	-64.2	-40.8	175.1	-75.5	-65.6	114.7	0	0	112.8	R126 M267 Y389 F390 S391 H396 Q397	R126-E393 IonicContact CZ-OE1 3.06Å; R126-E393 IonicContact CZ-OE2 3.8Å; R126-E393 VanDerWaalsContact CZ-OE2 3.24Å; R126-E393 VanDerWaalsContact NH1-CD 3.28Å; R126-E393 IonicContact NH1-OE1 3.09Å; R126-E393 PolarHBondContact NH1-OE1 3.02Å; R126-E393 IonicContact NH1-OE2 2.77Å; R126-E393 PolarHBondContact NH1-OE2 2.83Å; R126-E393 IonicContact NH2-OE1 2.76Å; R126-E393 PolarHBondContact NH2-OE1 2.82Å; R126-E393 VanDerWaalsContact NH2-OE1 3.09Å; R126-E393 IonicContact NH2-OE2 3.12Å; R126-E393 PolarHBondContact NH2-OE2 3.45Å; M267-E393 HydrophobicContact SD-CB 4.06Å; Y389-E393 HydrophobicContact CD1-CG 4.24Å; Y389-E393 HydrophobicContact CE1-CG 3.69Å; Y389-E393 HydrophobicContact CE2-CG 4.1Å; Y389-E393 WeakPolarHBondContact O-CG 3.25Å; Y389-E393 PolarHBondContact O-N 3.11Å; F390-E393 PolarHBondContact O-N 3.25Å; S391-E393 VanDerWaalsContact C-N 3.33Å; S391-E393 PolarHBondContact O-N 2.82Å; E393-H396 PolarHBondContact O-N 3.17Å; E393-H396 IonicContact OE1-ND1 2.83Å; E393-Q397 WeakPolarHBondContact O-CG 3.25Å; E393-Q397 PolarHBondContact O-N 3.12Å
394	L	89.7	Confident	79.2	Confident	33 Å²	33	84.4 Å²	84.4	17%	0.173	42%	0.417	C	S	.	.	H	α-helix	trans	-65.1	-40.5	175.3	-72.5	173.7	0	0	0	111.5	M267 L278 L281 Q282 F390 S391 Q397 A398	M267-L394 HydrophobicContact CE-CD2 4.26Å; L278-L394 HydrophobicContact CD2-CD1 4.21Å; L278-L394 HydrophobicContact CD2-CD2 4.19Å; L278-L394 HydrophobicContact CD2-CG 4.25Å; L281-L394 HydrophobicContact CB-CD1 3.72Å; L281-L394 HydrophobicContact CD1-CD1 4.01Å; L281-L394 HydrophobicContact CG-CD1 4.48Å; Q282-L394 HydrophobicContact CG-CD1 4.01Å; Q282-L394 HydrophobicContact CG-CD2 4.35Å; F390-L394 WeakPolarHBondContact O-CG 3.49Å; F390-L394 PolarHBondContact O-N 3.21Å; S391-L394 PolarHBondContact O-N 3.05Å; L394-Q397 PolarHBondContact O-N 3.41Å; L394-A398 WeakPolarHBondContact O-CB 3.09Å; L394-A398 PolarHBondContact O-N 2.7Å
395	E	89.4	Confident	76.3	Confident	106 Å²	106	90.5 Å²	90.5	50%	0.495	44%	0.441	S	S	.	.	H	α-helix	trans	-59.8	-45.9	173	-71.3	167.5	-162.4	0	0	111.7	S391 R392 Q397 A398 N399	S391-E395 WeakPolarHBondContact O-CG 3.46Å; S391-E395 PolarHBondContact O-N 3.49Å; S391-E395 VanDerWaalsContact O-N 3.07Å; R392-E395 PolarHBondContact O-N 3.41Å; E395-Q397 VanDerWaalsContact C-N 3.3Å; E395-Q397 PolarHBondContact O-N 3.14Å; E395-A398 PolarHBondContact O-N 2.65Å; E395-N399 WeakPolarHBondContact O-CB 3.47Å; E395-N399 VanDerWaalsContact O-CG 3.22Å; E395-N399 PolarHBondContact O-N 3.06Å; E395-N399 PolarHBondContact O-ND2 3.28Å
396	H	84.6	Confident	73.3	Confident	99 Å²	99	92.4 Å²	92.4	46%	0.458	46%	0.461	S	S	.	.	H	α-helix	trans	-60.8	-37.8	175.7	-72.4	167	0	0	0	112.7	R392 E393 N400	R392-H396 PolarHBondContact O-N 2.85Å; E393-H396 PolarHBondContact O-N 3.17Å; E393-H396 IonicContact OE1-ND1 2.83Å; H396-N400 VanDerWaalsContact O-CB 3.29Å; H396-N400 WeakPolarHBondContact O-CB 3.29Å; H396-N400 PolarHBondContact O-N 2.96Å; H396-N400 VanDerWaalsContact O-N 3.11Å
397	Q	80.2	Confident	70.4	Confident	104 Å²	104	102.1 Å²	102.1	49%	0.486	50%	0.504	S	S	.	.	H	α-helix	trans	-70	-42	175.7	-74.6	-164.3	-10	0	0	112.7	M267 E393 L394 E395 N399 N400	M267-Q397 VanDerWaalsContact CE-CD 3.45Å; M267-Q397 VanDerWaalsContact CE-OE1 3.29Å; M267-Q397 PolarHBondContact SD-NE2 2.8Å; M267-Q397 VanDerWaalsContact SD-NE2 3.44Å; E393-Q397 WeakPolarHBondContact O-CG 3.25Å; E393-Q397 PolarHBondContact O-N 3.12Å; L394-Q397 PolarHBondContact O-N 3.41Å; E395-Q397 VanDerWaalsContact C-N 3.3Å; E395-Q397 PolarHBondContact O-N 3.14Å; Q397-N399 VanDerWaalsContact C-N 3.26Å; Q397-N399 PolarHBondContact O-N 3.05Å; Q397-N400 PolarHBondContact O-N 3.16Å
398	A	76.3	Confident	67.5	Low	66 Å²	66	105.8 Å²	105.8	55%	0.545	54%	0.536	S	S	.	.	H	α-helix	trans	-60.9	-38.1	177	0	0	0	0	0	111.5	L394 E395	L394-A398 WeakPolarHBondContact O-CB 3.09Å; L394-A398 PolarHBondContact O-N 2.7Å; E395-A398 PolarHBondContact O-N 2.65Å
399	N	72.7	Confident	64.8	Low	132 Å²	132	105 Å²	105	71%	0.706	55%	0.548	S	S	*	.	H	α-helix	trans	-76.9	-25.2	179	-67.3	-16.9	0	0	0	113.5	E395 Q397	E395-N399 WeakPolarHBondContact O-CB 3.47Å; E395-N399 VanDerWaalsContact O-CG 3.22Å; E395-N399 PolarHBondContact O-N 3.06Å; E395-N399 PolarHBondContact O-ND2 3.28Å; Q397-N399 VanDerWaalsContact C-N 3.26Å; Q397-N399 PolarHBondContact O-N 3.05Å
400	N	60	Low	62.1	Low	126 Å²	126	114.8 Å²	114.8	67%	0.674	59%	0.585	S	S	*	*			trans	-99.5	49.9	-178.6	-81.8	-24.6	0	0	0	113.1	H396 Q397 Y402	H396-N400 VanDerWaalsContact O-CB 3.29Å; H396-N400 WeakPolarHBondContact O-CB 3.29Å; H396-N400 PolarHBondContact O-N 2.96Å; H396-N400 VanDerWaalsContact O-N 3.11Å; Q397-N400 PolarHBondContact O-N 3.16Å; N400-Y402 PolarHBondContact O-N 3.35Å
401	Q	46.1	Very low	59.3	Low	177 Å²	177	123.3 Å²	123.3	83%	0.827	63%	0.626	S	S	*	*			trans	-62	75.9	175.1	-76.9	-170.1	-2.4	0	0	113.5
402	Y	39.7	Very low	56.9	Low	195 Å²	195	131 Å²	131	77%	0.765	66%	0.655	S	S	*	*			trans	-131.6	97.7	150.5	-171.3	-96.2	0	0	0	106.8	N400 P404	N400-Y402 PolarHBondContact O-N 3.35Å; Y402-P404 HydrophobicContact CE1-CB 4.18Å; Y402-P404 WeakPolarHBondContact O-CD 3.21Å
403	I	43.4	Very low	54.4	Low	144 Å²	144	133.7 Å²	133.7	74%	0.738	67%	0.67	S	S	*	*			trans	-89.5	102.3	171.7	-58.2	172.8	0	0	0	106.3	K405	I403-K405 PolarHBondContact O-N 2.96Å
404	P	35.3	Very low	51.9	Low	92 Å²	92	136.3 Å²	136.3	60%	0.597	70%	0.701	S	S	*	*			trans	-63.1	108.6	164.2	24.9	-28.7	0	0	0	107	Y402	Y402-P404 HydrophobicContact CE1-CB 4.18Å; Y402-P404 WeakPolarHBondContact O-CD 3.21Å
405	K	33.8	Very low	49.6	Very low	186 Å²	186	146 Å²	146	81%	0.809	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-52.9	133.3	168.2	-69.5	-177.5	178.8	179.9	0	107.5	I403 K407	I403-K405 PolarHBondContact O-N 2.96Å; K405-K407 PolarHBondContact O-N 3Å
406	P	34.3	Very low	47.2	Very low	122 Å²	122	146 Å²	146	79%	0.792	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-54.1	121.3	171.8	19.7	-28.4	0	0	0	107.6	A408	P406-A408 PolarHBondContact O-N 3.03Å
407	K	35.7	Very low	45.3	Very low	204 Å²	204	153 Å²	153	89%	0.887	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-56.8	116.4	168.5	-90.2	-178.6	176.5	173.1	0	105.8	K405 A409	K405-K407 PolarHBondContact O-N 3Å; K407-A409 PolarHBondContact O-N 2.76Å
408	A	34.5	Very low	43.6	Very low	92 Å²	92	156.5 Å²	156.5	76%	0.76	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-47.5	127.8	172.2	0	0	0	0	0	107.9	P406 R410	P406-A408 PolarHBondContact O-N 3.03Å; A408-R410 PolarHBondContact O-N 2.97Å; A408-R410 VanDerWaalsContact O-N 3.08Å
409	A	38.5	Very low	42	Very low	91 Å²	91	164.7 Å²	164.7	75%	0.752	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-49.4	124.7	174.1	0	0	0	0	0	107.3	K407 M411	K407-A409 PolarHBondContact O-N 2.76Å; A409-M411 VanDerWaalsContact C-N 3.26Å; A409-M411 PolarHBondContact O-N 3.17Å
410	R	39.8	Very low	40.5	Very low	245 Å²	245	166.3 Å²	166.3	93%	0.925	82%	0.823	S	S	*	*			trans	-57.5	99.9	168.1	-101.1	-179.2	166.7	179.7	-3.9	106	A408 K412	A408-R410 PolarHBondContact O-N 2.97Å; A408-R410 VanDerWaalsContact O-N 3.08Å; R410-K412 PolarHBondContact O-N 3.08Å
411	M	34.4	Very low	39.5	Very low	178 Å²	178	168.4 Å²	168.4	88%	0.877	83%	0.831	S	S	*	*			trans	-54.4	112.3	164.3	-78.5	-173.8	172.9	0	0	105.7	A409 K413	A409-M411 VanDerWaalsContact C-N 3.26Å; A409-M411 PolarHBondContact O-N 3.17Å; M411-K413 VanDerWaalsContact C-N 3.32Å; M411-K413 PolarHBondContact O-N 2.91Å
412	K	42.4	Very low	39.1	Very low	203 Å²	203	167.9 Å²	167.9	88%	0.883	83%	0.831	S	S	*	*			trans	-58.9	105.3	162.8	-84.2	-177.3	175.4	177.4	0	105.1	R410 G414	R410-K412 PolarHBondContact O-N 3.08Å; K412-G414 PolarHBondContact O-N 2.97Å
413	K	40.5	Very low	39.1	Very low	200 Å²	200	166.4 Å²	166.4	87%	0.87	84%	0.835	S	S	*	*			trans	-52.8	112.9	164.9	-77.5	-174.2	176	-176.3	0	106	M411 R415	M411-K413 VanDerWaalsContact C-N 3.32Å; M411-K413 PolarHBondContact O-N 2.91Å; K413-R415 PolarHBondContact O-N 3.28Å
414	G	39.3	Very low	38.8	Very low	68 Å²	68	167.8 Å²	167.8	70%	0.701	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-53.3	128.8	172.3	0	0	0	0	0	108.1	K412	K412-G414 PolarHBondContact O-N 2.97Å
415	R	40.7	Very low	39.1	Very low	235 Å²	235	172.8 Å²	172.8	89%	0.887	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-61.2	126.7	165.5	-83.5	-179.4	173.1	174.1	-3.4	106.9	K413 R417	K413-R415 PolarHBondContact O-N 3.28Å; R415-R417 PolarHBondContact O-N 3.24Å
416	P	39.7	Very low	39.4	Very low	106 Å²	106	171.9 Å²	171.9	69%	0.688	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-61.6	125.3	168.3	25.4	-28.8	0	0	0	107.2	H418	P416-H418 PolarHBondContact O-N 3.2Å
417	R	43.5	Very low	39.8	Very low	246 Å²	246	175.7 Å²	175.7	93%	0.928	87%	0.866	S	S	*	*			trans	-66.2	112.5	164	-74.5	-177.7	174	179.4	-2.6	106	R415	R415-R417 PolarHBondContact O-N 3.24Å
418	H	44.8	Very low	40.2	Very low	178 Å²	178	173.3 Å²	173.3	82%	0.824	86%	0.864	S	S	*	*			trans	-74.2	137.3	159	-84.5	-51.6	0	0	0	108	P416	P416-H418 PolarHBondContact O-N 3.2Å
419	N	44	Very low	40.7	Very low	238 Å²	238	180.7 Å²	180.7	100%	1.273	87%	0.873	S	S	*	*			trans	-46.9	0	-179.5	-74.2	-17.4	0	0	0	113.8

Retrieved 419 of 419 residues in 200.6 ms (Link to these results)

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