A0A096NEC7_PAPAN Loading...

Forkhead box B1

AlphaFold DB (Q99853), UniProt , Accession A0A096NEC7, Species PAPAN (Papio anubis, Olive baboon), Gene FOXB1, Length 325 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	60.8	Low	62.5	Low	234 Å²	234	129.8 Å²	129.8	100%	1.153	66%	0.657	S	S	*	*				0	129.9	0	-70.6	-152.8	147.4	0	0	109	R3	M1-R3 PolarHBondContact O-N 3.47Å
2	P	70.5	Confident	64.4	Low	127 Å²	127	128.9 Å²	128.9	83%	0.825	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-58.5	135.2	174.2	-18.3	30.4	0	0	0	109.9
3	R	65.6	Low	66.3	Low	225 Å²	225	128.2 Å²	128.2	85%	0.849	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-67.9	126.6	174.3	-165.2	176	-172.3	170	2.4	107.5	M1 G5	M1-R3 PolarHBondContact O-N 3.47Å; R3-G5 PolarHBondContact O-N 3.37Å
4	P	63	Low	68	Low	79 Å²	79	120.1 Å²	120.1	51%	0.513	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-50.6	136.8	176.1	-27.5	34.5	0	0	0	110.7	Y9	P4-Y9 HydrophobicContact CB-CE2 4.41Å; P4-Y9 WeakPolarHBondContact O-CE2 3.33Å; P4-Y9 PolarHBondContact O-OH 3.06Å; P4-Y9 VanDerWaalsContact O-OH 3.08Å
5	G	60.5	Low	69.4	Low	38 Å²	38	119 Å²	119	39%	0.392	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-57.8	148.5	178.7	0	0	0	0	0	111.4	R3 N7 T8 Y9	R3-G5 PolarHBondContact O-N 3.37Å; G5-N7 PolarHBondContact O-N 2.88Å; G5-T8 PolarHBondContact O-N 3.08Å; G5-Y9 WeakPolarHBondContact O-CD2 3.36Å; G5-Y9 WeakPolarHBondContact O-CE2 3.19Å
6	R	58.2	Low	70.8	Confident	239 Å²	239	116.4 Å²	116.4	90%	0.902	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.3	-22.6	-175.2	-105.7	-174.5	-164.4	-165.3	5.4	114.9	Y9	R6-Y9 WeakPolarHBondContact O-CD2 3.47Å
7	N	57.3	Low	72.2	Confident	133 Å²	133	111.9 Å²	111.9	71%	0.711	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-17.6	-173.7	37.9	-37.8	0	0	0	113.9	G5 Y9 S10	G5-N7 PolarHBondContact O-N 2.88Å; N7-Y9 PolarHBondContact O-N 3.31Å; N7-S10 PolarHBondContact O-OG 3.11Å
8	T	54.2	Low	73.5	Confident	83 Å²	83	108.4 Å²	108.4	51%	0.509	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-77.7	-12.6	172.1	-42	0	0	0	0	112.1	G5 S10 Q12	G5-T8 PolarHBondContact O-N 3.08Å; T8-S10 VanDerWaalsContact C-N 3.32Å; T8-S10 PolarHBondContact O-N 2.88Å; T8-Q12 WeakPolarHBondContact O-CG 3.1Å
9	Y	56.3	Low	74.5	Confident	106 Å²	106	104.8 Å²	104.8	42%	0.416	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-80.4	-7.5	-178	-61.6	-84.2	0	0	0	114.1	P4 G5 R6 N7 D11 Q12	P4-Y9 HydrophobicContact CB-CE2 4.41Å; P4-Y9 WeakPolarHBondContact O-CE2 3.33Å; P4-Y9 PolarHBondContact O-OH 3.06Å; P4-Y9 VanDerWaalsContact O-OH 3.08Å; G5-Y9 WeakPolarHBondContact O-CD2 3.36Å; G5-Y9 WeakPolarHBondContact O-CE2 3.19Å; R6-Y9 WeakPolarHBondContact O-CD2 3.47Å; N7-Y9 PolarHBondContact O-N 3.31Å; Y9-D11 PolarHBondContact O-N 3.28Å; Y9-Q12 PolarHBondContact O-N 3.32Å
10	S	64.2	Low	75.5	Confident	51 Å²	51	99.7 Å²	99.7	36%	0.357	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-60.7	-35.9	179.9	57.3	0	0	0	0	112	N7 T8 Y49	N7-S10 PolarHBondContact O-OG 3.11Å; T8-S10 VanDerWaalsContact C-N 3.32Å; T8-S10 PolarHBondContact O-N 2.88Å; S10-Y49 PolarHBondContact O-N 2.9Å
11	D	76.5	Confident	76.5	Confident	113 Å²	113	95 Å²	95	60%	0.604	48%	0.48	S	S	*	.	S	Bend	trans	-107.4	-0.1	-172.4	-47.8	-21	0	0	0	111.8	Y9 Y49	Y9-D11 PolarHBondContact O-N 3.28Å; D11-Y49 VanDerWaalsContact O-CD2 3.26Å; D11-Y49 WeakPolarHBondContact O-CD2 3.31Å
12	Q	86	Confident	78.1	Confident	119 Å²	119	83.8 Å²	83.8	56%	0.556	43%	0.425	S	S	*	.	S	Bend	trans	-94.8	140.4	177.1	-67.1	-63.5	-42.9	0	0	110.2	T8 Y9 P14	T8-Q12 WeakPolarHBondContact O-CG 3.1Å; Y9-Q12 PolarHBondContact O-N 3.32Å; Q12-P14 VanDerWaalsContact O-CD 3.27Å; Q12-P14 WeakPolarHBondContact O-CD 3.41Å; Q12-P14 VanDerWaalsContact O-N 3.16Å
13	K	89.3	Confident	79.3	Confident	119 Å²	119	77.8 Å²	77.8	52%	0.517	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-57.2	120.5	177.8	-175.5	178.9	175.2	-174.5	0	110	Y49	K13-Y49 HydrophobicContact CB-CD1 4.23Å; K13-Y49 HydrophobicContact CB-CD2 4.43Å; K13-Y49 HydrophobicContact CB-CE1 3.79Å; K13-Y49 HydrophobicContact CB-CE2 3.98Å; K13-Y49 HydrophobicContact CD-CE1 4.34Å; K13-Y49 HydrophobicContact CG-CD1 4.28Å; K13-Y49 HydrophobicContact CG-CE1 3.74Å
14	P	89.7	Confident	80.7	Confident	15 Å²	15	67.9 Å²	67.9	10%	0.097	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-59.4	147.1	179.3	-24.6	33.5	0	0	0	112	Q12 Y16 F47 Y50	Q12-P14 VanDerWaalsContact O-CD 3.27Å; Q12-P14 WeakPolarHBondContact O-CD 3.41Å; Q12-P14 VanDerWaalsContact O-N 3.16Å; P14-Y16 HydrophobicContact CB-CD2 3.79Å; P14-Y16 HydrophobicContact CB-CE2 4.49Å; P14-Y16 PolarHBondContact O-N 3.03Å; P14-F47 HydrophobicContact CB-CD1 3.85Å; P14-F47 HydrophobicContact CB-CE1 3.93Å; P14-F47 HydrophobicContact CB-CG 4.42Å; P14-F47 HydrophobicContact CG-CB 3.85Å; P14-F47 HydrophobicContact CG-CD1 3.29Å; P14-F47 HydrophobicContact CG-CD2 4.48Å; P14-F47 HydrophobicContact CG-CE1 3.91Å; P14-F47 HydrophobicContact CG-CG 3.62Å; P14-Y50 HydrophobicContact CG-CE2 4.05Å
15	P	88.9	Confident	82.2	Confident	104 Å²	104	64.1 Å²	64.1	68%	0.675	33%	0.325	S	S	*	.	S	Bend	trans	-75.4	36	178.6	34.1	-37.6	0	0	0	112.8
16	Y	92.3	Very high	83.9	Confident	77 Å²	77	62.4 Å²	62.4	30%	0.302	31%	0.307	S	S	.	.			trans	-113.8	139	-179.4	-62.5	-56.3	0	0	0	110.7	P14 L21 M24 F47 F102	P14-Y16 HydrophobicContact CB-CD2 3.79Å; P14-Y16 HydrophobicContact CB-CE2 4.49Å; P14-Y16 PolarHBondContact O-N 3.03Å; Y16-L21 HydrophobicContact CD2-CD2 4.46Å; Y16-M24 HydrophobicContact CD1-CE 4.31Å; Y16-M24 HydrophobicContact CD2-CE 3.91Å; Y16-M24 HydrophobicContact CE2-CE 4.29Å; Y16-M24 HydrophobicContact CG-CE 3.92Å; Y16-F47 AromaticContact CD2-CE1 3.96Å; Y16-F47 HydrophobicContact CD2-CE1 3.96Å; Y16-F47 HydrophobicContact CD2-CE2 4.38Å; Y16-F47 AromaticContact CD2-CZ 3.59Å; Y16-F47 HydrophobicContact CD2-CZ 3.59Å; Y16-F47 AromaticContact CE2-CE1 3.87Å; Y16-F47 HydrophobicContact CE2-CE1 3.87Å; Y16-F47 AromaticContact CE2-CZ 3.63Å; Y16-F47 HydrophobicContact CE2-CZ 3.63Å; Y16-F102 HydrophobicContact CD1-CB 3.84Å; Y16-F102 HydrophobicContact CE1-CB 3.76Å
17	S	93.5	Very high	85.6	Confident	40 Å²	40	53.2 Å²	53.2	28%	0.28	27%	0.274	S	S	.	.			trans	-75.2	160.4	171.3	77.5	0	0	0	0	110.6	I19 S20 L21	S17-I19 PolarHBondContact O-N 2.82Å; S17-I19 PolarHBondContact OG-N 2.59Å; S17-S20 WeakPolarHBondContact O-CA 3.31Å; S17-S20 VanDerWaalsContact O-CB 3.31Å; S17-S20 WeakPolarHBondContact O-CB 3.38Å; S17-S20 PolarHBondContact O-N 3.32Å; S17-S20 PolarHBondContact OG-N 3.42Å; S17-S20 VanDerWaalsContact OG-N 3.16Å; S17-S20 PolarHBondContact OG-OG 3.22Å; S17-L21 WeakPolarHBondContact O-CG 3.17Å; S17-L21 PolarHBondContact O-N 2.96Å
18	Y	95.7	Very high	87.3	Confident	49 Å²	49	50 Å²	50	19%	0.192	26%	0.262	C	S	.	.	H	α-helix	trans	-58.1	-34.3	173.6	-65.5	-59	0	0	0	112.6	S20 L21 T22 Y50 W57 S60 N64	Y18-S20 VanDerWaalsContact C-N 3.32Å; Y18-S20 PolarHBondContact O-N 3.46Å; Y18-L21 HydrophobicContact CD1-CD1 4.08Å; Y18-L21 PolarHBondContact O-N 3.17Å; Y18-T22 PolarHBondContact O-N 3.47Å; Y18-T22 PolarHBondContact O-OG1 3.5Å; Y18-Y50 HydrophobicContact CE1-CE1 4.27Å; Y18-W57 HydrophobicContact CE1-CB 4.3Å; Y18-S60 VanDerWaalsContact CE2-CB 3.5Å; Y18-N64 WeakPolarHBondContact CB-ND2 3.23Å; Y18-N64 WeakPolarHBondContact CD2-ND2 3.45Å
19	I	94	Very high	89.2	Confident	40 Å²	40	46.6 Å²	46.6	21%	0.205	24%	0.241	C	C	.	.	H	α-helix	trans	-60.1	-46.5	173.6	-58	175	0	0	0	109.9	S17 T22 A23 F71 F97	S17-I19 PolarHBondContact O-N 2.82Å; S17-I19 PolarHBondContact OG-N 2.59Å; I19-T22 PolarHBondContact O-N 3Å; I19-A23 WeakPolarHBondContact O-CB 3.26Å; I19-A23 PolarHBondContact O-N 3.29Å; I19-F71 HydrophobicContact CB-CE2 4.39Å; I19-F71 HydrophobicContact CB-CZ 4.43Å; I19-F71 HydrophobicContact CG1-CE2 4.4Å; I19-F71 HydrophobicContact CG2-CE2 4.05Å; I19-F71 HydrophobicContact CG2-CZ 3.88Å; I19-F97 HydrophobicContact CG2-CE1 4.29Å; I19-F97 HydrophobicContact CG2-CZ 3.77Å
20	S	94	Very high	91.1	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-63.8	-42.8	179.5	-46.5	0	0	0	0	112.2	S17 Y18 A23 M24 F102	S17-S20 WeakPolarHBondContact O-CA 3.31Å; S17-S20 VanDerWaalsContact O-CB 3.31Å; S17-S20 WeakPolarHBondContact O-CB 3.38Å; S17-S20 PolarHBondContact O-N 3.32Å; S17-S20 PolarHBondContact OG-N 3.42Å; S17-S20 VanDerWaalsContact OG-N 3.16Å; S17-S20 PolarHBondContact OG-OG 3.22Å; Y18-S20 VanDerWaalsContact C-N 3.32Å; Y18-S20 PolarHBondContact O-N 3.46Å; S20-A23 PolarHBondContact O-N 3.31Å; S20-M24 WeakPolarHBondContact O-CG 3.18Å; S20-M24 PolarHBondContact O-N 2.79Å; S20-F102 WeakPolarHBondContact CB-O 3.09Å; S20-F102 PolarHBondContact OG-O 3.33Å
21	L	95.1	Very high	92.5	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.4	-47.8	177.5	-68.5	173.1	0	0	0	111.4	Y16 S17 Y18 M24 A25 I43 F47 Y50	Y16-L21 HydrophobicContact CD2-CD2 4.46Å; S17-L21 WeakPolarHBondContact O-CG 3.17Å; S17-L21 PolarHBondContact O-N 2.96Å; Y18-L21 HydrophobicContact CD1-CD1 4.08Å; Y18-L21 PolarHBondContact O-N 3.17Å; L21-M24 HydrophobicContact CD2-CE 3.8Å; L21-M24 PolarHBondContact O-N 3.17Å; L21-A25 PolarHBondContact O-N 3.16Å; L21-A25 VanDerWaalsContact O-N 3.1Å; L21-I43 HydrophobicContact CB-CD1 3.84Å; L21-I43 HydrophobicContact CB-CG1 4.14Å; L21-I43 HydrophobicContact CD1-CD1 4.44Å; L21-I43 HydrophobicContact CD1-CG2 4.43Å; L21-F47 HydrophobicContact CD2-CD2 3.66Å; L21-F47 HydrophobicContact CD2-CE2 3.35Å; L21-F47 HydrophobicContact CD2-CZ 4.18Å; L21-Y50 HydrophobicContact CD1-CE2 3.85Å
22	T	95.7	Very high	93.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.9	-42.7	177	-58.1	0	0	0	0	111.8	Y18 I19 M24 A25 I26 I39 L65 F71	Y18-T22 PolarHBondContact O-N 3.47Å; Y18-T22 PolarHBondContact O-OG1 3.5Å; I19-T22 PolarHBondContact O-N 3Å; T22-M24 PolarHBondContact O-N 2.79Å; T22-A25 WeakPolarHBondContact O-CB 3.45Å; T22-A25 PolarHBondContact O-N 3.32Å; T22-I26 HydrophobicContact CG2-CD1 3.81Å; T22-I26 HydrophobicContact CG2-CG1 4.4Å; T22-I26 WeakPolarHBondContact O-CG1 3.01Å; T22-I26 PolarHBondContact O-N 3.17Å; T22-I39 HydrophobicContact CG2-CD1 4.18Å; T22-I39 HydrophobicContact CG2-CG2 4.49Å; T22-L65 HydrophobicContact CG2-CD2 3.7Å; T22-F71 HydrophobicContact CG2-CD1 3.84Å; T22-F71 HydrophobicContact CG2-CE1 3.35Å; T22-F71 HydrophobicContact CG2-CE2 4.2Å; T22-F71 HydrophobicContact CG2-CG 4.45Å; T22-F71 HydrophobicContact CG2-CZ 3.56Å
23	A	94.6	Very high	93.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.6	-43.7	177.9	0	0	0	0	0	111.8	I19 S20 A25 I26 Q27 F97	I19-A23 WeakPolarHBondContact O-CB 3.26Å; I19-A23 PolarHBondContact O-N 3.29Å; S20-A23 PolarHBondContact O-N 3.31Å; A23-A25 VanDerWaalsContact C-N 3.31Å; A23-A25 PolarHBondContact O-N 3.45Å; A23-I26 PolarHBondContact O-N 2.91Å; A23-Q27 WeakPolarHBondContact O-CB 3.45Å; A23-Q27 VanDerWaalsContact O-CG 3.28Å; A23-Q27 WeakPolarHBondContact O-CG 3.47Å; A23-Q27 PolarHBondContact O-N 3.16Å; A23-F97 HydrophobicContact CB-CB 4.48Å; A23-F97 HydrophobicContact CB-CD1 3.88Å; A23-F97 HydrophobicContact CB-CD2 4.17Å; A23-F97 HydrophobicContact CB-CE1 4.08Å; A23-F97 HydrophobicContact CB-CE2 4.36Å; A23-F97 HydrophobicContact CB-CG 3.93Å; A23-F97 HydrophobicContact CB-CZ 4.31Å
24	M	94.8	Very high	94.1	Very high	18 Å²	18	44.1 Å²	44.1	9%	0.089	24%	0.237	C	C	.	.	H	α-helix	trans	-59.6	-41.3	174.3	-74.6	-173.4	-71.9	0	0	112.2	Y16 S20 L21 T22 S28 F42 F47 F102	Y16-M24 HydrophobicContact CD1-CE 4.31Å; Y16-M24 HydrophobicContact CD2-CE 3.91Å; Y16-M24 HydrophobicContact CE2-CE 4.29Å; Y16-M24 HydrophobicContact CG-CE 3.92Å; S20-M24 WeakPolarHBondContact O-CG 3.18Å; S20-M24 PolarHBondContact O-N 2.79Å; L21-M24 HydrophobicContact CD2-CE 3.8Å; L21-M24 PolarHBondContact O-N 3.17Å; T22-M24 PolarHBondContact O-N 2.79Å; M24-S28 WeakPolarHBondContact O-CB 3.27Å; M24-S28 PolarHBondContact O-N 3.19Å; M24-F42 HydrophobicContact CB-CE1 3.88Å; M24-F42 HydrophobicContact CB-CZ 4.09Å; M24-F47 HydrophobicContact CE-CE2 4.05Å; M24-F47 HydrophobicContact CE-CZ 4.11Å; M24-F102 HydrophobicContact CB-CE1 4.44Å; M24-F102 HydrophobicContact CG-CD1 3.45Å; M24-F102 VanDerWaalsContact CG-CD1 3.45Å; M24-F102 HydrophobicContact CG-CD2 4.1Å; M24-F102 HydrophobicContact CG-CE1 3.38Å; M24-F102 HydrophobicContact CG-CE2 4.04Å; M24-F102 HydrophobicContact CG-CG 3.82Å; M24-F102 HydrophobicContact CG-CZ 3.7Å; M24-F102 HydrophobicContact SD-CD1 4.26Å; M24-F102 HydrophobicContact SD-CD2 4.13Å; M24-F102 HydrophobicContact SD-CE2 4.45Å; M24-F102 HydrophobicContact SD-CG 4.03Å
25	A	96.2	Very high	94.5	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.3	-52.2	177.5	0	0	0	0	0	111	L21 T22 A23 Q27 S28 S29 L34 I39 F42	L21-A25 PolarHBondContact O-N 3.16Å; L21-A25 VanDerWaalsContact O-N 3.1Å; T22-A25 WeakPolarHBondContact O-CB 3.45Å; T22-A25 PolarHBondContact O-N 3.32Å; A23-A25 VanDerWaalsContact C-N 3.31Å; A23-A25 PolarHBondContact O-N 3.45Å; A25-Q27 VanDerWaalsContact C-N 3.35Å; A25-Q27 PolarHBondContact O-N 3.31Å; A25-S28 PolarHBondContact O-N 3.27Å; A25-S28 PolarHBondContact O-OG 3.03Å; A25-S29 PolarHBondContact O-N 2.89Å; A25-L34 HydrophobicContact CB-CD1 4.11Å; A25-L34 VanDerWaalsContact O-CD1 3.23Å; A25-L34 WeakPolarHBondContact O-CD1 3.15Å; A25-I39 HydrophobicContact CB-CG1 4.43Å; A25-I39 HydrophobicContact CB-CG2 4.36Å; A25-F42 HydrophobicContact CB-CB 4.02Å; A25-F42 HydrophobicContact CB-CD1 3.4Å; A25-F42 VanDerWaalsContact CB-CD1 3.4Å; A25-F42 HydrophobicContact CB-CD2 4.38Å; A25-F42 HydrophobicContact CB-CE1 3.88Å; A25-F42 HydrophobicContact CB-CG 3.67Å
26	I	95.2	Very high	94.9	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-63.4	-40	-178.5	-66.7	173.2	0	0	0	111.5	T22 A23 S28 S29 K32 F71 L89	T22-I26 HydrophobicContact CG2-CD1 3.81Å; T22-I26 HydrophobicContact CG2-CG1 4.4Å; T22-I26 WeakPolarHBondContact O-CG1 3.01Å; T22-I26 PolarHBondContact O-N 3.17Å; A23-I26 PolarHBondContact O-N 2.91Å; I26-S28 VanDerWaalsContact C-N 3.26Å; I26-S28 PolarHBondContact O-N 2.94Å; I26-S29 PolarHBondContact O-N 3.45Å; I26-S29 PolarHBondContact O-OG 3.25Å; I26-S29 VanDerWaalsContact O-OG 3.11Å; I26-K32 WeakPolarHBondContact CG2-O 3.5Å; I26-F71 HydrophobicContact CD1-CD1 3.95Å; I26-F71 HydrophobicContact CD1-CE1 4.1Å; I26-L89 HydrophobicContact CG2-CB 4.29Å
27	Q	93.1	Very high	95.1	Very high	46 Å²	46	40.4 Å²	40.4	22%	0.215	22%	0.221	C	C	.	.	H	α-helix	trans	-67.1	-29.1	178.9	-76.5	179.5	-8.5	0	0	113.4	A23 A25 S29 K32 F97 F102	A23-Q27 WeakPolarHBondContact O-CB 3.45Å; A23-Q27 VanDerWaalsContact O-CG 3.28Å; A23-Q27 WeakPolarHBondContact O-CG 3.47Å; A23-Q27 PolarHBondContact O-N 3.16Å; A25-Q27 VanDerWaalsContact C-N 3.35Å; A25-Q27 PolarHBondContact O-N 3.31Å; Q27-S29 VanDerWaalsContact C-N 3.3Å; Q27-K32 PolarHBondContact O-NZ 3.39Å; Q27-F97 VanDerWaalsContact NE2-C 3.31Å; Q27-F97 PolarHBondContact NE2-O 3.18Å; Q27-F102 VanDerWaalsContact OE1-CZ 3.26Å
28	S	93.9	Very high	95.2	Very high	64 Å²	64	41.8 Å²	41.8	45%	0.448	22%	0.223	S	C	.	.	H	α-helix	trans	-74.4	-18.9	178	76.1	0	0	0	0	113.6	M24 A25 I26 F42	M24-S28 WeakPolarHBondContact O-CB 3.27Å; M24-S28 PolarHBondContact O-N 3.19Å; A25-S28 PolarHBondContact O-N 3.27Å; A25-S28 PolarHBondContact O-OG 3.03Å; I26-S28 VanDerWaalsContact C-N 3.26Å; I26-S28 PolarHBondContact O-N 2.94Å; S28-F42 WeakPolarHBondContact OG-CE2 3.16Å
29	S	94.7	Very high	95.3	Very high	12 Å²	12	39.5 Å²	39.5	8%	0.084	21%	0.214	C	C	.	.	S	Bend	trans	-81.4	141.5	175.4	78.7	0	0	0	0	110.9	A25 I26 Q27 E31 K32 M33	A25-S29 PolarHBondContact O-N 2.89Å; I26-S29 PolarHBondContact O-N 3.45Å; I26-S29 PolarHBondContact O-OG 3.25Å; I26-S29 VanDerWaalsContact O-OG 3.11Å; Q27-S29 VanDerWaalsContact C-N 3.3Å; S29-E31 VanDerWaalsContact C-N 3.26Å; S29-E31 PolarHBondContact O-N 3.02Å; S29-K32 PolarHBondContact O-N 3.48Å; S29-K32 PolarHBondContact OG-N 2.99Å; S29-M33 PolarHBondContact OG-N 2.69Å; S29-M33 PolarHBondContact OG-O 3.36Å
30	P	95.3	Very high	95.5	Very high	127 Å²	127	39 Å²	39	83%	0.825	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-33.1	178.2	24.9	-33.2	0	0	0	111.9	K32	P30-K32 VanDerWaalsContact C-N 3.27Å; P30-K32 PolarHBondContact O-N 2.91Å
31	E	94.5	Very high	95.6	Very high	129 Å²	129	43.7 Å²	43.7	60%	0.603	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-2.9	-178.8	-59.2	-175.7	164.2	0	0	113.7	S29 M33	S29-E31 VanDerWaalsContact C-N 3.26Å; S29-E31 PolarHBondContact O-N 3.02Å; E31-M33 HydrophobicContact CB-CG 3.97Å; E31-M33 PolarHBondContact O-N 3.43Å
32	K	94.3	Very high	95.8	Very high	120 Å²	120	45 Å²	45	52%	0.522	24%	0.236	S	C	.	.	S	Bend	trans	52.9	24.4	-174.3	-56.2	-62.8	-178.8	-179.6	0	114	I26 Q27 S29 P30	I26-K32 WeakPolarHBondContact CG2-O 3.5Å; Q27-K32 PolarHBondContact O-NZ 3.39Å; S29-K32 PolarHBondContact O-N 3.48Å; S29-K32 PolarHBondContact OG-N 2.99Å; P30-K32 VanDerWaalsContact C-N 3.27Å; P30-K32 PolarHBondContact O-N 2.91Å
33	M	94.9	Very high	95.8	Very high	53 Å²	53	45 Å²	45	26%	0.261	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	149.6	172.5	68	-175.7	79.4	0	0	110	S29 E31 I74 F86 W87 A88	S29-M33 PolarHBondContact OG-N 2.69Å; S29-M33 PolarHBondContact OG-O 3.36Å; E31-M33 HydrophobicContact CB-CG 3.97Å; E31-M33 PolarHBondContact O-N 3.43Å; M33-I74 HydrophobicContact CE-CD1 4.12Å; M33-I74 HydrophobicContact SD-CD1 4.24Å; M33-F86 HydrophobicContact CB-CB 4.36Å; M33-F86 HydrophobicContact CG-CB 4.39Å; M33-F86 HydrophobicContact CG-CD1 4.19Å; M33-F86 HydrophobicContact CG-CG 4.41Å; M33-F86 HydrophobicContact SD-CB 4.13Å; M33-F86 HydrophobicContact SD-CD1 4.41Å; M33-F86 HydrophobicContact SD-CD2 4.48Å; M33-F86 HydrophobicContact SD-CG 4.12Å; M33-W87 WeakPolarHBondContact CA-O 3.32Å; M33-A88 HydrophobicContact CB-CB 3.93Å
34	L	96.7	Very high	95.8	Very high	27 Å²	27	47.1 Å²	47.1	14%	0.141	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	144.8	176.9	-76.1	178.1	0	0	0	110.6	A25 E38 I39 W87	A25-L34 HydrophobicContact CB-CD1 4.11Å; A25-L34 VanDerWaalsContact O-CD1 3.23Å; A25-L34 WeakPolarHBondContact O-CD1 3.15Å; L34-E38 HydrophobicContact CB-CB 4.38Å; L34-E38 HydrophobicContact CD1-CB 4.48Å; L34-E38 HydrophobicContact CD2-CB 3.96Å; L34-E38 HydrophobicContact CD2-CG 4.49Å; L34-I39 HydrophobicContact CB-CG1 4.08Å; L34-W87 PolarHBondContact N-O 3.39Å; L34-W87 PolarHBondContact O-N 3.02Å
35	P	96.8	Very high	95.9	Very high	14 Å²	14	51.5 Å²	51.5	9%	0.091	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	160.2	168.5	34.1	-35.5	0	0	0	110.6	S37 E38 I39 F86	P35-S37 PolarHBondContact O-N 2.96Å; P35-S37 VanDerWaalsContact O-N 3.12Å; P35-E38 HydrophobicContact CG-CB 4.17Å; P35-E38 HydrophobicContact CG-CG 3.7Å; P35-E38 PolarHBondContact O-N 3.1Å; P35-I39 PolarHBondContact O-N 3.42Å; P35-F86 HydrophobicContact CB-CD1 4.41Å; P35-F86 HydrophobicContact CG-CE1 4.47Å
36	L	97	Very high	95.8	Very high	45 Å²	45	58.7 Å²	58.7	24%	0.236	30%	0.297	C	S	.	.	H	α-helix	trans	-54.3	-35.8	-177.5	-178.9	59.9	0	0	0	113.8	E38 I39 Y40 L61 R62 L65	L36-E38 PolarHBondContact O-N 3.21Å; L36-I39 PolarHBondContact O-N 3.18Å; L36-Y40 HydrophobicContact CD1-CD1 4.33Å; L36-Y40 HydrophobicContact CD1-CE1 3.56Å; L36-Y40 HydrophobicContact CD1-CE2 4.24Å; L36-Y40 HydrophobicContact CD2-CE2 4.28Å; L36-Y40 WeakPolarHBondContact CD2-OH 3.39Å; L36-Y40 HydrophobicContact CG-CE1 4.03Å; L36-Y40 HydrophobicContact CG-CE2 3.76Å; L36-Y40 VanDerWaalsContact CG-CZ 3.49Å; L36-Y40 WeakPolarHBondContact CG-OH 3.37Å; L36-Y40 WeakPolarHBondContact O-CD2 3.34Å; L36-Y40 PolarHBondContact O-N 3.42Å; L36-L61 HydrophobicContact CD1-CD2 3.79Å; L36-R62 HydrophobicContact CD1-CG 4.32Å; L36-R62 HydrophobicContact CD2-CG 3.95Å; L36-L65 HydrophobicContact CD1-CD1 3.53Å
37	S	96.6	Very high	95.7	Very high	59 Å²	59	60.3 Å²	60.3	41%	0.413	30%	0.304	S	S	.	.	H	α-helix	trans	-61.9	-40.7	178.1	50.9	0	0	0	0	112.9	P35 Y40 K41	P35-S37 PolarHBondContact O-N 2.96Å; P35-S37 VanDerWaalsContact O-N 3.12Å; S37-Y40 PolarHBondContact O-N 3.49Å; S37-K41 PolarHBondContact O-N 3.12Å
38	E	97.1	Very high	95.6	Very high	70 Å²	70	60.5 Å²	60.5	33%	0.327	31%	0.309	S	S	.	.	H	α-helix	trans	-74.9	-32.9	-178.9	-64.9	-52.3	125.3	0	0	111.4	L34 P35 L36 Y40 K41 F42	L34-E38 HydrophobicContact CB-CB 4.38Å; L34-E38 HydrophobicContact CD1-CB 4.48Å; L34-E38 HydrophobicContact CD2-CB 3.96Å; L34-E38 HydrophobicContact CD2-CG 4.49Å; P35-E38 HydrophobicContact CG-CB 4.17Å; P35-E38 HydrophobicContact CG-CG 3.7Å; P35-E38 PolarHBondContact O-N 3.1Å; L36-E38 PolarHBondContact O-N 3.21Å; E38-Y40 VanDerWaalsContact C-N 3.27Å; E38-Y40 PolarHBondContact O-N 3.43Å; E38-K41 PolarHBondContact O-N 2.77Å; E38-K41 IonicContact OE1-NZ 3.82Å; E38-K41 PolarHBondContact OE1-NZ 2.97Å; E38-K41 IonicContact OE2-NZ 3.28Å; E38-F42 WeakPolarHBondContact O-CB 3.45Å; E38-F42 PolarHBondContact O-N 2.9Å
39	I	97.6	Very high	95.6	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60.4	-40.7	171.9	-60.8	166.5	0	0	0	110.4	T22 A25 L34 P35 L36 I43 L61 W87	T22-I39 HydrophobicContact CG2-CD1 4.18Å; T22-I39 HydrophobicContact CG2-CG2 4.49Å; A25-I39 HydrophobicContact CB-CG1 4.43Å; A25-I39 HydrophobicContact CB-CG2 4.36Å; L34-I39 HydrophobicContact CB-CG1 4.08Å; P35-I39 PolarHBondContact O-N 3.42Å; L36-I39 PolarHBondContact O-N 3.18Å; I39-I43 HydrophobicContact CG2-CD1 3.97Å; I39-I43 VanDerWaalsContact O-CG1 3.3Å; I39-I43 WeakPolarHBondContact O-CG1 3.49Å; I39-I43 PolarHBondContact O-N 3.37Å; I39-L61 HydrophobicContact CG2-CD1 4.02Å; I39-L61 HydrophobicContact CG2-CD2 4.03Å; I39-W87 HydrophobicContact CD1-CB 4.19Å
40	Y	97.3	Very high	95.6	Very high	30 Å²	30	61.4 Å²	61.4	12%	0.118	30%	0.302	C	S	.	.	H	α-helix	trans	-63.7	-47.5	176.4	-60.5	-29.8	0	0	0	112.4	L36 S37 E38 I43 M44 W57 Q58 L61 R62	L36-Y40 HydrophobicContact CD1-CD1 4.33Å; L36-Y40 HydrophobicContact CD1-CE1 3.56Å; L36-Y40 HydrophobicContact CD1-CE2 4.24Å; L36-Y40 HydrophobicContact CD2-CE2 4.28Å; L36-Y40 WeakPolarHBondContact CD2-OH 3.39Å; L36-Y40 HydrophobicContact CG-CE1 4.03Å; L36-Y40 HydrophobicContact CG-CE2 3.76Å; L36-Y40 VanDerWaalsContact CG-CZ 3.49Å; L36-Y40 WeakPolarHBondContact CG-OH 3.37Å; L36-Y40 WeakPolarHBondContact O-CD2 3.34Å; L36-Y40 PolarHBondContact O-N 3.42Å; S37-Y40 PolarHBondContact O-N 3.49Å; E38-Y40 VanDerWaalsContact C-N 3.27Å; E38-Y40 PolarHBondContact O-N 3.43Å; Y40-I43 PolarHBondContact O-N 3.38Å; Y40-M44 WeakPolarHBondContact O-CG 3.28Å; Y40-M44 PolarHBondContact O-N 3.29Å; Y40-M44 VanDerWaalsContact O-N 3.08Å; Y40-W57 AromaticContact CD1-CH2 3.83Å; Y40-W57 HydrophobicContact CD1-CH2 3.83Å; Y40-W57 AromaticContact CD1-CZ3 3.78Å; Y40-W57 HydrophobicContact CD1-CZ3 3.78Å; Y40-W57 HydrophobicContact CE1-CZ3 4.32Å; Y40-W57 HydrophobicContact CG-CH2 4.25Å; Y40-Q58 HydrophobicContact CD1-CG 3.88Å; Y40-Q58 HydrophobicContact CE1-CB 3.94Å; Y40-Q58 HydrophobicContact CE1-CG 3.65Å; Y40-Q58 HydrophobicContact CE2-CG 4.35Å; Y40-Q58 HydrophobicContact CG-CG 4.31Å; Y40-L61 HydrophobicContact CD1-CD2 4.38Å; Y40-L61 HydrophobicContact CE1-CD2 3.91Å; Y40-R62 WeakPolarHBondContact OH-CD 3.43Å; Y40-R62 VanDerWaalsContact OH-CG 3.27Å; Y40-R62 WeakPolarHBondContact OH-CG 3.39Å; Y40-R62 PolarHBondContact OH-NH1 3.22Å
41	K	97.3	Very high	95.6	Very high	101 Å²	101	62.1 Å²	62.1	44%	0.439	29%	0.288	S	S	.	.	H	α-helix	trans	-59.2	-50.8	178.5	-69.4	175.5	-177.5	169.5	0	111	S37 E38 I43 M44 D45	S37-K41 PolarHBondContact O-N 3.12Å; E38-K41 PolarHBondContact O-N 2.77Å; E38-K41 IonicContact OE1-NZ 3.82Å; E38-K41 PolarHBondContact OE1-NZ 2.97Å; E38-K41 IonicContact OE2-NZ 3.28Å; K41-I43 VanDerWaalsContact C-N 3.26Å; K41-I43 PolarHBondContact O-N 3.04Å; K41-M44 PolarHBondContact O-N 3.15Å; K41-D45 WeakPolarHBondContact O-CB 3.42Å; K41-D45 PolarHBondContact O-N 2.9Å
42	F	97.3	Very high	95.5	Very high	29 Å²	29	62.8 Å²	62.8	13%	0.127	29%	0.291	C	S	.	.	H	α-helix	trans	-52.3	-44.4	178.6	178.9	-89.8	0	0	0	112.7	M24 A25 S28 E38 R46	M24-F42 HydrophobicContact CB-CE1 3.88Å; M24-F42 HydrophobicContact CB-CZ 4.09Å; A25-F42 HydrophobicContact CB-CB 4.02Å; A25-F42 HydrophobicContact CB-CD1 3.4Å; A25-F42 VanDerWaalsContact CB-CD1 3.4Å; A25-F42 HydrophobicContact CB-CD2 4.38Å; A25-F42 HydrophobicContact CB-CE1 3.88Å; A25-F42 HydrophobicContact CB-CG 3.67Å; S28-F42 WeakPolarHBondContact OG-CE2 3.16Å; E38-F42 WeakPolarHBondContact O-CB 3.45Å; E38-F42 PolarHBondContact O-N 2.9Å; F42-R46 HydrophobicContact CD1-CG 4.38Å; F42-R46 HydrophobicContact CD2-CG 4.44Å; F42-R46 HydrophobicContact CE1-CG 4.14Å; F42-R46 HydrophobicContact CE2-CG 4.21Å; F42-R46 HydrophobicContact CZ-CG 4.07Å; F42-R46 WeakPolarHBondContact O-CB 3.45Å; F42-R46 WeakPolarHBondContact O-CG 3.28Å; F42-R46 PolarHBondContact O-N 3.2Å; F42-R46 VanDerWaalsContact O-N 3.1Å
43	I	96.6	Very high	95.3	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-68.7	-44.2	-179.7	-66.6	170.1	0	0	0	111.1	L21 I39 Y40 K41 D45 F47 Y50 W57 L61	L21-I43 HydrophobicContact CB-CD1 3.84Å; L21-I43 HydrophobicContact CB-CG1 4.14Å; L21-I43 HydrophobicContact CD1-CD1 4.44Å; L21-I43 HydrophobicContact CD1-CG2 4.43Å; I39-I43 HydrophobicContact CG2-CD1 3.97Å; I39-I43 VanDerWaalsContact O-CG1 3.3Å; I39-I43 WeakPolarHBondContact O-CG1 3.49Å; I39-I43 PolarHBondContact O-N 3.37Å; Y40-I43 PolarHBondContact O-N 3.38Å; K41-I43 VanDerWaalsContact C-N 3.26Å; K41-I43 PolarHBondContact O-N 3.04Å; I43-D45 VanDerWaalsContact C-N 3.31Å; I43-D45 PolarHBondContact O-N 2.92Å; I43-F47 WeakPolarHBondContact O-CA 3.35Å; I43-F47 WeakPolarHBondContact O-CB 3.43Å; I43-F47 PolarHBondContact O-N 2.85Å; I43-Y50 HydrophobicContact CG2-CD2 3.37Å; I43-Y50 HydrophobicContact CG2-CE2 4.02Å; I43-Y50 HydrophobicContact CG2-CG 3.73Å; I43-W57 HydrophobicContact CD1-CZ3 4.36Å; I43-L61 HydrophobicContact CD1-CD1 3.27Å
44	M	95.1	Very high	95.3	Very high	43 Å²	43	62.8 Å²	62.8	21%	0.212	30%	0.299	C	S	.	.	H	α-helix	trans	-68.2	-30.1	179.6	-69.6	-174.1	-59.2	0	0	113	Y40 K41 R51 T54 W57	Y40-M44 WeakPolarHBondContact O-CG 3.28Å; Y40-M44 PolarHBondContact O-N 3.29Å; Y40-M44 VanDerWaalsContact O-N 3.08Å; K41-M44 PolarHBondContact O-N 3.15Å; M44-R51 HydrophobicContact CB-CG 4.08Å; M44-R51 HydrophobicContact CG-CG 4.42Å; M44-R51 PolarHBondContact O-NE 3.35Å; M44-R51 PolarHBondContact O-NH2 3.13Å; M44-T54 HydrophobicContact SD-CG2 4.26Å; M44-W57 HydrophobicContact CG-CH2 4.32Å; M44-W57 HydrophobicContact CG-CZ2 3.9Å; M44-W57 HydrophobicContact SD-CZ2 4.13Å
45	D	95.6	Very high	95.2	Very high	111 Å²	111	67.8 Å²	67.8	59%	0.594	32%	0.322	S	S	*	.	H	α-helix	trans	-75.8	-42	178.7	-66.1	-17.8	0	0	0	111.1	K41 I43	K41-D45 WeakPolarHBondContact O-CB 3.42Å; K41-D45 PolarHBondContact O-N 2.9Å; I43-D45 VanDerWaalsContact C-N 3.31Å; I43-D45 PolarHBondContact O-N 2.92Å
46	R	94	Very high	95.2	Very high	150 Å²	150	76.7 Å²	76.7	57%	0.566	35%	0.354	S	S	*	.	H	α-helix	trans	-79.5	-34.6	-178.7	-66.2	-88.8	-105.3	-140.2	-5.4	113.2	F42	F42-R46 HydrophobicContact CD1-CG 4.38Å; F42-R46 HydrophobicContact CD2-CG 4.44Å; F42-R46 HydrophobicContact CE1-CG 4.14Å; F42-R46 HydrophobicContact CE2-CG 4.21Å; F42-R46 HydrophobicContact CZ-CG 4.07Å; F42-R46 WeakPolarHBondContact O-CB 3.45Å; F42-R46 WeakPolarHBondContact O-CG 3.28Å; F42-R46 PolarHBondContact O-N 3.2Å; F42-R46 VanDerWaalsContact O-N 3.1Å
47	F	93.4	Very high	95.1	Very high	36 Å²	36	75.1 Å²	75.1	16%	0.158	35%	0.345	C	S	.	.			trans	-131.3	92	-172.9	-57.6	-69	0	0	0	110.1	P14 Y16 L21 M24 I43 Y49 Y50	P14-F47 HydrophobicContact CB-CD1 3.85Å; P14-F47 HydrophobicContact CB-CE1 3.93Å; P14-F47 HydrophobicContact CB-CG 4.42Å; P14-F47 HydrophobicContact CG-CB 3.85Å; P14-F47 HydrophobicContact CG-CD1 3.29Å; P14-F47 HydrophobicContact CG-CD2 4.48Å; P14-F47 HydrophobicContact CG-CE1 3.91Å; P14-F47 HydrophobicContact CG-CG 3.62Å; Y16-F47 AromaticContact CD2-CE1 3.96Å; Y16-F47 HydrophobicContact CD2-CE1 3.96Å; Y16-F47 HydrophobicContact CD2-CE2 4.38Å; Y16-F47 AromaticContact CD2-CZ 3.59Å; Y16-F47 HydrophobicContact CD2-CZ 3.59Å; Y16-F47 AromaticContact CE2-CE1 3.87Å; Y16-F47 HydrophobicContact CE2-CE1 3.87Å; Y16-F47 AromaticContact CE2-CZ 3.63Å; Y16-F47 HydrophobicContact CE2-CZ 3.63Å; L21-F47 HydrophobicContact CD2-CD2 3.66Å; L21-F47 HydrophobicContact CD2-CE2 3.35Å; L21-F47 HydrophobicContact CD2-CZ 4.18Å; M24-F47 HydrophobicContact CE-CE2 4.05Å; M24-F47 HydrophobicContact CE-CZ 4.11Å; I43-F47 WeakPolarHBondContact O-CA 3.35Å; I43-F47 WeakPolarHBondContact O-CB 3.43Å; I43-F47 PolarHBondContact O-N 2.85Å; F47-Y49 PolarHBondContact O-N 3.06Å; F47-Y50 HydrophobicContact CB-CD2 3.77Å; F47-Y50 HydrophobicContact CB-CE2 4.16Å; F47-Y50 PolarHBondContact O-N 2.83Å
48	P	92.4	Very high	95.2	Very high	50 Å²	50	73.5 Å²	73.5	33%	0.325	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-53.6	-30.1	-177.3	-29.1	36.6	0	0	0	114.7	Y50 R51	P48-Y50 PolarHBondContact O-N 3.45Å; P48-R51 WeakPolarHBondContact O-CB 3.49Å; P48-R51 WeakPolarHBondContact O-CG 3.31Å; P48-R51 PolarHBondContact O-N 2.88Å
49	Y	93.6	Very high	95.2	Very high	93 Å²	93	74.6 Å²	74.6	37%	0.365	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-43.4	-35.2	170.8	175.6	-97.3	0	0	0	114.8	S10 D11 K13 F47	S10-Y49 PolarHBondContact O-N 2.9Å; D11-Y49 VanDerWaalsContact O-CD2 3.26Å; D11-Y49 WeakPolarHBondContact O-CD2 3.31Å; K13-Y49 HydrophobicContact CB-CD1 4.23Å; K13-Y49 HydrophobicContact CB-CD2 4.43Å; K13-Y49 HydrophobicContact CB-CE1 3.79Å; K13-Y49 HydrophobicContact CB-CE2 3.98Å; K13-Y49 HydrophobicContact CD-CE1 4.34Å; K13-Y49 HydrophobicContact CG-CD1 4.28Å; K13-Y49 HydrophobicContact CG-CE1 3.74Å; F47-Y49 PolarHBondContact O-N 3.06Å
50	Y	95.1	Very high	95.2	Very high	3 Å²	3	76 Å²	76	1%	0.012	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-88	2.4	-177.5	-66.6	-70.6	0	0	0	114.5	P14 Y18 L21 I43 F47 P48 E52 W57	P14-Y50 HydrophobicContact CG-CE2 4.05Å; Y18-Y50 HydrophobicContact CE1-CE1 4.27Å; L21-Y50 HydrophobicContact CD1-CE2 3.85Å; I43-Y50 HydrophobicContact CG2-CD2 3.37Å; I43-Y50 HydrophobicContact CG2-CE2 4.02Å; I43-Y50 HydrophobicContact CG2-CG 3.73Å; F47-Y50 HydrophobicContact CB-CD2 3.77Å; F47-Y50 HydrophobicContact CB-CE2 4.16Å; F47-Y50 PolarHBondContact O-N 2.83Å; P48-Y50 PolarHBondContact O-N 3.45Å; Y50-E52 VanDerWaalsContact C-N 3.29Å; Y50-W57 HydrophobicContact CD1-CB 4.1Å; Y50-W57 AromaticContact CD1-CD1 3.93Å; Y50-W57 AromaticContact CD1-CD2 3.97Å; Y50-W57 HydrophobicContact CD1-CD2 3.97Å; Y50-W57 AromaticContact CD1-CG 3.76Å; Y50-W57 HydrophobicContact CD1-CG 3.76Å; Y50-W57 HydrophobicContact CE1-CB 4.34Å; Y50-W57 HydrophobicContact CE1-CG 4.46Å; Y50-W57 WeakPolarHBondContact O-CZ2 3.4Å; Y50-W57 PolarHBondContact O-NE1 2.94Å
51	R	94.6	Very high	95.2	Very high	141 Å²	141	74.6 Å²	74.6	53%	0.532	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-71.8	-28.6	175.5	-66.4	177.5	-175.1	179.6	-0.4	111.9	M44 P48 T54	M44-R51 HydrophobicContact CB-CG 4.08Å; M44-R51 HydrophobicContact CG-CG 4.42Å; M44-R51 PolarHBondContact O-NE 3.35Å; M44-R51 PolarHBondContact O-NH2 3.13Å; P48-R51 WeakPolarHBondContact O-CB 3.49Å; P48-R51 WeakPolarHBondContact O-CG 3.31Å; P48-R51 PolarHBondContact O-N 2.88Å; R51-T54 WeakPolarHBondContact O-CG2 3.43Å
52	E	91.8	Very high	95.2	Very high	144 Å²	144	74 Å²	74	67%	0.673	34%	0.338	S	S	*	.	S	Bend	trans	-87.2	155.6	175.4	-61.2	-178.9	-171.6	0	0	111.8	Y50 T54	Y50-E52 VanDerWaalsContact C-N 3.29Å; E52-T54 VanDerWaalsContact C-N 3.28Å; E52-T54 PolarHBondContact O-N 3.31Å
53	N	90.8	Very high	95.1	Very high	126 Å²	126	76.8 Å²	76.8	67%	0.674	35%	0.351	S	S	*	.	S	Bend	trans	52.8	40.9	172.6	-64	-71.8	0	0	0	114.4	Q55 R56	N53-Q55 VanDerWaalsContact C-N 3.28Å; N53-Q55 PolarHBondContact O-N 2.85Å; N53-Q55 VanDerWaalsContact O-N 3.14Å; N53-R56 PolarHBondContact O-N 3.22Å; N53-R56 VanDerWaalsContact O-N 3.15Å
54	T	94.3	Very high	95.1	Very high	46 Å²	46	77.6 Å²	77.6	28%	0.282	36%	0.356	S	S	.	.	H	α-helix	trans	-51.9	-41.4	-170.4	55.6	0	0	0	0	114.4	M44 R51 E52 R56 Q58	M44-T54 HydrophobicContact SD-CG2 4.26Å; R51-T54 WeakPolarHBondContact O-CG2 3.43Å; E52-T54 VanDerWaalsContact C-N 3.28Å; E52-T54 PolarHBondContact O-N 3.31Å; T54-R56 VanDerWaalsContact C-N 3.34Å; T54-R56 PolarHBondContact O-N 3Å; T54-Q58 WeakPolarHBondContact O-CB 3.35Å; T54-Q58 WeakPolarHBondContact O-CG 3.22Å; T54-Q58 PolarHBondContact O-N 3Å
55	Q	96	Very high	95.1	Very high	133 Å²	133	75.7 Å²	75.7	62%	0.621	35%	0.346	S	S	*	.	H	α-helix	trans	-57.1	-43	-178.2	-68.9	-58.4	-47.8	0	0	113.5	N53 N59	N53-Q55 VanDerWaalsContact C-N 3.28Å; N53-Q55 PolarHBondContact O-N 2.85Å; N53-Q55 VanDerWaalsContact O-N 3.14Å; Q55-N59 WeakPolarHBondContact O-CB 3.42Å; Q55-N59 PolarHBondContact O-N 3.07Å
56	R	95.7	Very high	95	Very high	200 Å²	200	74.9 Å²	74.9	76%	0.755	35%	0.35	S	S	*	.	H	α-helix	trans	-65.8	-54.7	-173.8	-178.8	-176.5	-66.7	-85.4	1.5	111	N53 T54 N59 S60	N53-R56 PolarHBondContact O-N 3.22Å; N53-R56 VanDerWaalsContact O-N 3.15Å; T54-R56 VanDerWaalsContact C-N 3.34Å; T54-R56 PolarHBondContact O-N 3Å; R56-N59 PolarHBondContact O-N 2.89Å; R56-S60 PolarHBondContact O-N 3.05Å; R56-S60 PolarHBondContact O-OG 3.47Å
57	W	95.9	Very high	95	Very high	12 Å²	12	73.4 Å²	73.4	5%	0.045	35%	0.347	C	S	.	.	H	α-helix	trans	-74.8	-30.6	-176.5	70.8	-103.7	0	0	0	112	Y18 Y40 I43 M44 Y50 S60 L61	Y18-W57 HydrophobicContact CE1-CB 4.3Å; Y40-W57 AromaticContact CD1-CH2 3.83Å; Y40-W57 HydrophobicContact CD1-CH2 3.83Å; Y40-W57 AromaticContact CD1-CZ3 3.78Å; Y40-W57 HydrophobicContact CD1-CZ3 3.78Å; Y40-W57 HydrophobicContact CE1-CZ3 4.32Å; Y40-W57 HydrophobicContact CG-CH2 4.25Å; I43-W57 HydrophobicContact CD1-CZ3 4.36Å; M44-W57 HydrophobicContact CG-CH2 4.32Å; M44-W57 HydrophobicContact CG-CZ2 3.9Å; M44-W57 HydrophobicContact SD-CZ2 4.13Å; Y50-W57 HydrophobicContact CD1-CB 4.1Å; Y50-W57 AromaticContact CD1-CD1 3.93Å; Y50-W57 AromaticContact CD1-CD2 3.97Å; Y50-W57 HydrophobicContact CD1-CD2 3.97Å; Y50-W57 AromaticContact CD1-CG 3.76Å; Y50-W57 HydrophobicContact CD1-CG 3.76Å; Y50-W57 HydrophobicContact CE1-CB 4.34Å; Y50-W57 HydrophobicContact CE1-CG 4.46Å; Y50-W57 WeakPolarHBondContact O-CZ2 3.4Å; Y50-W57 PolarHBondContact O-NE1 2.94Å; W57-S60 CarbonylContact O-C 3.54Å; W57-S60 WeakPolarHBondContact O-CA 3.46Å; W57-S60 WeakPolarHBondContact O-CB 3.32Å; W57-S60 PolarHBondContact O-N 3.28Å; W57-S60 VanDerWaalsContact O-N 3.16Å; W57-L61 HydrophobicContact CE3-CB 4.47Å; W57-L61 HydrophobicContact CZ3-CD1 4.17Å; W57-L61 PolarHBondContact O-N 3.17Å
58	Q	97.6	Very high	94.9	Very high	26 Å²	26	72.1 Å²	72.1	12%	0.121	34%	0.342	C	S	.	.	H	α-helix	trans	-67.2	-38.4	175.1	-72.9	-180	5.4	0	0	111.4	Y40 T54 S60 L61 R62	Y40-Q58 HydrophobicContact CD1-CG 3.88Å; Y40-Q58 HydrophobicContact CE1-CB 3.94Å; Y40-Q58 HydrophobicContact CE1-CG 3.65Å; Y40-Q58 HydrophobicContact CE2-CG 4.35Å; Y40-Q58 HydrophobicContact CG-CG 4.31Å; T54-Q58 WeakPolarHBondContact O-CB 3.35Å; T54-Q58 WeakPolarHBondContact O-CG 3.22Å; T54-Q58 PolarHBondContact O-N 3Å; Q58-S60 PolarHBondContact O-N 3.38Å; Q58-L61 PolarHBondContact O-N 3.1Å; Q58-R62 WeakPolarHBondContact O-CG 3.3Å; Q58-R62 PolarHBondContact O-N 3.08Å; Q58-R62 PolarHBondContact O-NH1 3.05Å
59	N	97.3	Very high	94.9	Very high	92 Å²	92	73 Å²	73	49%	0.492	34%	0.344	S	S	.	.	H	α-helix	trans	-59	-43.8	170.8	-171.9	32.6	0	0	0	110.6	Q55 R56 L61 R62 H63	Q55-N59 WeakPolarHBondContact O-CB 3.42Å; Q55-N59 PolarHBondContact O-N 3.07Å; R56-N59 PolarHBondContact O-N 2.89Å; N59-L61 VanDerWaalsContact C-N 3.32Å; N59-L61 PolarHBondContact O-N 2.87Å; N59-R62 PolarHBondContact O-N 3.18Å; N59-H63 PolarHBondContact O-N 3.32Å; N59-H63 VanDerWaalsContact O-N 3.07Å
60	S	96.7	Very high	94.8	Very high	30 Å²	30	68.8 Å²	68.8	21%	0.21	33%	0.328	C	S	.	.	H	α-helix	trans	-60.2	-41.2	175	-66	0	0	0	0	113.3	Y18 R56 W57 Q58 H63 N64	Y18-S60 VanDerWaalsContact CE2-CB 3.5Å; R56-S60 PolarHBondContact O-N 3.05Å; R56-S60 PolarHBondContact O-OG 3.47Å; W57-S60 CarbonylContact O-C 3.54Å; W57-S60 WeakPolarHBondContact O-CA 3.46Å; W57-S60 WeakPolarHBondContact O-CB 3.32Å; W57-S60 PolarHBondContact O-N 3.28Å; W57-S60 VanDerWaalsContact O-N 3.16Å; Q58-S60 PolarHBondContact O-N 3.38Å; S60-H63 WeakPolarHBondContact CA-CD2 3.39Å; S60-H63 VanDerWaalsContact CA-NE2 3.32Å; S60-H63 WeakPolarHBondContact CA-NE2 3Å; S60-H63 PolarHBondContact O-CD2 3.08Å; S60-H63 PolarHBondContact O-CE1 3.08Å; S60-H63 PolarHBondContact O-N 3.46Å; S60-H63 PolarHBondContact O-ND1 3.18Å; S60-H63 PolarHBondContact O-NE2 3.22Å; S60-H63 VanDerWaalsContact O-NE2 3.08Å; S60-N64 PolarHBondContact O-N 3.07Å; S60-N64 PolarHBondContact O-ND2 3.18Å
61	L	97.3	Very high	94.8	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-67.9	-42.3	179	-168.4	140.3	0	0	0	111.9	L36 I39 Y40 I43 W57 Q58 N59 H63 N64 L65	L36-L61 HydrophobicContact CD1-CD2 3.79Å; I39-L61 HydrophobicContact CG2-CD1 4.02Å; I39-L61 HydrophobicContact CG2-CD2 4.03Å; Y40-L61 HydrophobicContact CD1-CD2 4.38Å; Y40-L61 HydrophobicContact CE1-CD2 3.91Å; I43-L61 HydrophobicContact CD1-CD1 3.27Å; W57-L61 HydrophobicContact CE3-CB 4.47Å; W57-L61 HydrophobicContact CZ3-CD1 4.17Å; W57-L61 PolarHBondContact O-N 3.17Å; Q58-L61 PolarHBondContact O-N 3.1Å; N59-L61 VanDerWaalsContact C-N 3.32Å; N59-L61 PolarHBondContact O-N 2.87Å; L61-H63 VanDerWaalsContact C-N 3.34Å; L61-H63 PolarHBondContact O-N 2.76Å; L61-N64 WeakPolarHBondContact O-CB 3.38Å; L61-N64 PolarHBondContact O-N 3.31Å; L61-L65 HydrophobicContact CD2-CD1 3.78Å; L61-L65 HydrophobicContact CD2-CG 4.23Å; L61-L65 PolarHBondContact O-N 3.11Å; L61-L65 VanDerWaalsContact O-N 3.12Å
62	R	97.7	Very high	94.8	Very high	88 Å²	88	65.3 Å²	65.3	33%	0.332	32%	0.319	S	S	.	.	H	α-helix	trans	-61.1	-41.7	177	-71.2	-170.5	-55.8	-91.9	8.4	112.2	L36 Y40 Q58 N59 N64 L65 S66	L36-R62 HydrophobicContact CD1-CG 4.32Å; L36-R62 HydrophobicContact CD2-CG 3.95Å; Y40-R62 WeakPolarHBondContact OH-CD 3.43Å; Y40-R62 VanDerWaalsContact OH-CG 3.27Å; Y40-R62 WeakPolarHBondContact OH-CG 3.39Å; Y40-R62 PolarHBondContact OH-NH1 3.22Å; Q58-R62 WeakPolarHBondContact O-CG 3.3Å; Q58-R62 PolarHBondContact O-N 3.08Å; Q58-R62 PolarHBondContact O-NH1 3.05Å; N59-R62 PolarHBondContact O-N 3.18Å; R62-N64 VanDerWaalsContact C-N 3.25Å; R62-N64 PolarHBondContact O-N 3.36Å; R62-L65 PolarHBondContact O-N 2.9Å; R62-S66 PolarHBondContact O-N 3.12Å; R62-S66 PolarHBondContact O-OG 2.93Å
63	H	96.6	Very high	95.1	Very high	88 Å²	88	65.1 Å²	65.1	41%	0.407	32%	0.316	S	S	.	.	H	α-helix	trans	-64.9	-32.4	174.8	81.3	57.6	0	0	0	111.7	N59 S60 L61 L65 S66 F67	N59-H63 PolarHBondContact O-N 3.32Å; N59-H63 VanDerWaalsContact O-N 3.07Å; S60-H63 WeakPolarHBondContact CA-CD2 3.39Å; S60-H63 VanDerWaalsContact CA-NE2 3.32Å; S60-H63 WeakPolarHBondContact CA-NE2 3Å; S60-H63 PolarHBondContact O-CD2 3.08Å; S60-H63 PolarHBondContact O-CE1 3.08Å; S60-H63 PolarHBondContact O-N 3.46Å; S60-H63 PolarHBondContact O-ND1 3.18Å; S60-H63 PolarHBondContact O-NE2 3.22Å; S60-H63 VanDerWaalsContact O-NE2 3.08Å; L61-H63 VanDerWaalsContact C-N 3.34Å; L61-H63 PolarHBondContact O-N 2.76Å; H63-L65 VanDerWaalsContact C-N 3.35Å; H63-S66 PolarHBondContact O-OG 3.5Å; H63-F67 WeakPolarHBondContact O-CB 3.38Å; H63-F67 PolarHBondContact O-N 3.22Å
64	N	94.8	Very high	95.3	Very high	17 Å²	17	61.4 Å²	61.4	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-68.8	-36.8	-179.8	-86.6	-79.3	0	0	0	111.8	Y18 S60 L61 R62 N68	Y18-N64 WeakPolarHBondContact CB-ND2 3.23Å; Y18-N64 WeakPolarHBondContact CD2-ND2 3.45Å; S60-N64 PolarHBondContact O-N 3.07Å; S60-N64 PolarHBondContact O-ND2 3.18Å; L61-N64 WeakPolarHBondContact O-CB 3.38Å; L61-N64 PolarHBondContact O-N 3.31Å; R62-N64 VanDerWaalsContact C-N 3.25Å; R62-N64 PolarHBondContact O-N 3.36Å; N64-N68 PolarHBondContact O-N 3.38Å; N64-N68 VanDerWaalsContact O-N 3.12Å; N64-N68 PolarHBondContact O-ND2 2.97Å; N64-N68 PolarHBondContact OD1-ND2 2.91Å
65	L	95.7	Very high	95.3	Very high	4 Å²	4	64 Å²	64	2%	0.021	31%	0.314	C	S	.	.	H	α-helix	trans	-64	-41.1	178.1	-71.5	171.9	0	0	0	112	T22 L36 L61 R62 H63 F71 W87	T22-L65 HydrophobicContact CG2-CD2 3.7Å; L36-L65 HydrophobicContact CD1-CD1 3.53Å; L61-L65 HydrophobicContact CD2-CD1 3.78Å; L61-L65 HydrophobicContact CD2-CG 4.23Å; L61-L65 PolarHBondContact O-N 3.11Å; L61-L65 VanDerWaalsContact O-N 3.12Å; R62-L65 PolarHBondContact O-N 2.9Å; H63-L65 VanDerWaalsContact C-N 3.35Å; L65-F71 HydrophobicContact CD2-CB 4.05Å; L65-F71 HydrophobicContact CD2-CD1 4.37Å; L65-F71 HydrophobicContact CD2-CD2 3.99Å; L65-F71 HydrophobicContact CD2-CG 3.87Å; L65-W87 HydrophobicContact CB-CD2 4.18Å; L65-W87 HydrophobicContact CB-CE3 4.05Å; L65-W87 HydrophobicContact CB-CH2 3.75Å; L65-W87 HydrophobicContact CB-CZ2 3.9Å; L65-W87 HydrophobicContact CB-CZ3 3.83Å; L65-W87 HydrophobicContact CD1-CD2 4.12Å; L65-W87 HydrophobicContact CD1-CG 4.27Å; L65-W87 HydrophobicContact CD1-CZ2 4.35Å; L65-W87 HydrophobicContact CD2-CB 4.38Å; L65-W87 HydrophobicContact CD2-CD2 3.93Å; L65-W87 HydrophobicContact CD2-CE3 4Å; L65-W87 HydrophobicContact CD2-CG 4.11Å; L65-W87 HydrophobicContact CG-CD2 4.32Å; L65-W87 HydrophobicContact CG-CE3 4.49Å; L65-W87 VanDerWaalsContact O-CZ3 3.28Å; L65-W87 WeakPolarHBondContact O-CZ3 3.39Å
66	S	94.8	Very high	95.1	Very high	94 Å²	94	60.7 Å²	60.7	66%	0.657	30%	0.295	S	S	*	.	H	α-helix	trans	-81.8	-28.1	177.7	58.2	0	0	0	0	113.7	R62 H63	R62-S66 PolarHBondContact O-N 3.12Å; R62-S66 PolarHBondContact O-OG 2.93Å; H63-S66 PolarHBondContact O-OG 3.5Å
67	F	92.7	Very high	94.9	Very high	118 Å²	118	59.2 Å²	59.2	52%	0.518	29%	0.29	S	S	.	.	H	α-helix	trans	-81.8	-32.8	-175.6	-178.3	-106.4	0	0	0	113.7	H63 R108	H63-F67 WeakPolarHBondContact O-CB 3.38Å; H63-F67 PolarHBondContact O-N 3.22Å; F67-R108 VanDerWaalsContact CD1-NH2 3.29Å; F67-R108 PolarHBondContact O-NH2 2.94Å
68	N	92.1	Very high	94.6	Very high	10 Å²	10	65 Å²	65	5%	0.053	33%	0.329	C	S	.	.			trans	-101.9	124.4	-173.9	-62.8	-76	0	0	0	111.5	N64 C70 F71	N64-N68 PolarHBondContact O-N 3.38Å; N64-N68 VanDerWaalsContact O-N 3.12Å; N64-N68 PolarHBondContact O-ND2 2.97Å; N64-N68 PolarHBondContact OD1-ND2 2.91Å; N68-C70 PolarHBondContact O-N 2.67Å; N68-F71 HydrophobicContact CB-CD2 4.29Å; N68-F71 PolarHBondContact O-N 3.39Å; N68-F71 VanDerWaalsContact O-N 3.07Å
69	D	91.7	Very high	94.2	Very high	68 Å²	68	67.9 Å²	67.9	36%	0.364	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-9.6	176.9	-51.2	-31.2	0	0	0	113.6	F71 F109 V111	D69-F71 PolarHBondContact O-N 3.21Å; D69-F109 HydrophobicContact CB-CD1 4.35Å; D69-F109 HydrophobicContact CB-CE1 4.25Å; D69-V111 HydrophobicContact CB-CB 4.37Å; D69-V111 HydrophobicContact CB-CG2 3.85Å
70	C	92.1	Very high	93.5	Very high	5 Å²	5	68.5 Å²	68.5	3%	0.034	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-30.1	171.8	-55.9	0	0	0	0	112	N68 L89 H90 C93 F109	N68-C70 PolarHBondContact O-N 2.67Å; C70-L89 HydrophobicContact CB-CD1 4.33Å; C70-L89 CarbonylContact O-C 3.55Å; C70-L89 WeakPolarHBondContact O-CA 3.28Å; C70-H90 PolarHBondContact O-N 3.46Å; C70-C93 PolarHBondContact O-SG 3.29Å; C70-F109 HydrophobicContact CB-CD1 4.22Å; C70-F109 WeakPolarHBondContact SG-CD1 3.16Å
71	F	94.8	Very high	93	Very high	10 Å²	10	73.4 Å²	73.4	4%	0.044	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	121.9	-174.9	-56.9	-60.2	0	0	0	110	I19 T22 I26 L65 N68 D69 W87 A88 L89	I19-F71 HydrophobicContact CB-CE2 4.39Å; I19-F71 HydrophobicContact CB-CZ 4.43Å; I19-F71 HydrophobicContact CG1-CE2 4.4Å; I19-F71 HydrophobicContact CG2-CE2 4.05Å; I19-F71 HydrophobicContact CG2-CZ 3.88Å; T22-F71 HydrophobicContact CG2-CD1 3.84Å; T22-F71 HydrophobicContact CG2-CE1 3.35Å; T22-F71 HydrophobicContact CG2-CE2 4.2Å; T22-F71 HydrophobicContact CG2-CG 4.45Å; T22-F71 HydrophobicContact CG2-CZ 3.56Å; I26-F71 HydrophobicContact CD1-CD1 3.95Å; I26-F71 HydrophobicContact CD1-CE1 4.1Å; L65-F71 HydrophobicContact CD2-CB 4.05Å; L65-F71 HydrophobicContact CD2-CD1 4.37Å; L65-F71 HydrophobicContact CD2-CD2 3.99Å; L65-F71 HydrophobicContact CD2-CG 3.87Å; N68-F71 HydrophobicContact CB-CD2 4.29Å; N68-F71 PolarHBondContact O-N 3.39Å; N68-F71 VanDerWaalsContact O-N 3.07Å; D69-F71 PolarHBondContact O-N 3.21Å; F71-W87 HydrophobicContact CB-CE3 3.98Å; F71-W87 HydrophobicContact CB-CZ3 4.3Å; F71-A88 WeakPolarHBondContact CA-O 3.49Å; F71-L89 HydrophobicContact CD1-CD1 4.27Å; F71-L89 HydrophobicContact CE1-CD1 3.98Å
72	I	95.5	Very high	92.5	Very high	60 Å²	60	75.5 Å²	75.5	31%	0.308	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	138.2	177.2	60.4	173.6	0	0	0	109.6	I74 W87 A88 H90	I72-I74 HydrophobicContact CD1-CD1 4.43Å; I72-I74 HydrophobicContact CD1-CG1 4.43Å; I72-I74 HydrophobicContact CG1-CG1 4.39Å; I72-W87 WeakPolarHBondContact O-CA 3.36Å; I72-A88 HydrophobicContact CD1-CB 4.21Å; I72-A88 HydrophobicContact CG1-CB 3.86Å; I72-A88 WeakPolarHBondContact CG1-O 3.42Å; I72-A88 PolarHBondContact N-O 3.39Å; I72-A88 PolarHBondContact O-N 2.98Å; I72-H90 HydrophobicContact CG2-CB 4.17Å
73	K	96.8	Very high	92.2	Very high	140 Å²	140	80.8 Å²	80.8	61%	0.609	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	114.6	176.4	-171.1	-175.5	73.6	175.7	0	109.1	S85 W87	K73-S85 VanDerWaalsContact CG-CB 3.4Å; K73-W87 HydrophobicContact CB-CE3 4.27Å; K73-W87 HydrophobicContact CB-CH2 4.07Å; K73-W87 HydrophobicContact CB-CZ2 4.47Å; K73-W87 HydrophobicContact CB-CZ3 3.95Å; K73-W87 HydrophobicContact CD-CZ2 4.46Å; K73-W87 HydrophobicContact CG-CH2 4.37Å; K73-W87 HydrophobicContact CG-CZ2 4.31Å
74	I	95.1	Very high	92	Very high	49 Å²	49	79 Å²	79	25%	0.251	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	120.8	179.1	-59.5	176.6	0	0	0	108.9	M33 I72 S85 F86 A88	M33-I74 HydrophobicContact CE-CD1 4.12Å; M33-I74 HydrophobicContact SD-CD1 4.24Å; I72-I74 HydrophobicContact CD1-CD1 4.43Å; I72-I74 HydrophobicContact CD1-CG1 4.43Å; I72-I74 HydrophobicContact CG1-CG1 4.39Å; I74-S85 WeakPolarHBondContact O-CB 3.36Å; I74-F86 HydrophobicContact CB-CB 4.07Å; I74-F86 PolarHBondContact N-O 3.39Å; I74-F86 PolarHBondContact O-N 3.29Å; I74-A88 HydrophobicContact CD1-CB 3.49Å; I74-A88 VanDerWaalsContact CD1-CB 3.49Å; I74-A88 HydrophobicContact CG1-CB 4.35Å
75	P	94.3	Very high	92	Very high	101 Å²	101	79.8 Å²	79.8	66%	0.656	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-64.5	146.4	175.7	28.2	-33.5	0	0	0	110.6
76	R	93	Very high	92	Very high	62 Å²	62	81.1 Å²	81.1	23%	0.234	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-71.9	148.4	172.3	-67.2	-174.3	-179.2	-93.2	1.9	109.5	G82 K83 G84 F86	R76-G82 WeakPolarHBondContact CD-O 3.49Å; R76-K83 PolarHBondContact NE-O 3.42Å; R76-K83 PolarHBondContact NH2-O 3.07Å; R76-G84 WeakPolarHBondContact CD-O 3.35Å; R76-G84 WeakPolarHBondContact CG-O 3.42Å; R76-G84 PolarHBondContact NE-O 3.28Å; R76-F86 HydrophobicContact CG-CD2 3.93Å; R76-F86 HydrophobicContact CG-CE2 3.82Å
77	R	90.7	Very high	92.2	Very high	169 Å²	169	78.5 Å²	78.5	64%	0.638	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-68.1	147.1	170.9	-55.1	175.6	49.5	164.3	0.8	109.9	D79 Q80	R77-D79 WeakPolarHBondContact CB-OD1 3.32Å; R77-D79 IonicContact CZ-OD1 3.45Å; R77-D79 IonicContact CZ-OD2 3.51Å; R77-D79 IonicContact NE-OD1 2.78Å; R77-D79 PolarHBondContact NE-OD1 2.9Å; R77-D79 IonicContact NE-OD2 2.82Å; R77-D79 PolarHBondContact NE-OD2 3.04Å; R77-D79 IonicContact NH2-OD1 3.37Å; R77-D79 PolarHBondContact NH2-OD1 3.11Å; R77-D79 IonicContact NH2-OD2 3.66Å; R77-D79 PolarHBondContact O-N 2.96Å; R77-Q80 PolarHBondContact O-N 3.34Å; R77-Q80 VanDerWaalsContact O-N 3.1Å
78	P	88.5	Confident	92.3	Very high	134 Å²	134	73.2 Å²	73.2	87%	0.87	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-21.1	-179	26.2	-35	0	0	0	113.4	Q80	P78-Q80 VanDerWaalsContact C-N 3.3Å; P78-Q80 PolarHBondContact O-N 3.28Å
79	D	89.9	Confident	92.4	Very high	87 Å²	87	74 Å²	74	47%	0.465	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-17.2	175.2	50.5	-70.6	0	0	0	114.3	R77 P81	R77-D79 WeakPolarHBondContact CB-OD1 3.32Å; R77-D79 IonicContact CZ-OD1 3.45Å; R77-D79 IonicContact CZ-OD2 3.51Å; R77-D79 IonicContact NE-OD1 2.78Å; R77-D79 PolarHBondContact NE-OD1 2.9Å; R77-D79 IonicContact NE-OD2 2.82Å; R77-D79 PolarHBondContact NE-OD2 3.04Å; R77-D79 IonicContact NH2-OD1 3.37Å; R77-D79 PolarHBondContact NH2-OD1 3.11Å; R77-D79 IonicContact NH2-OD2 3.66Å; R77-D79 PolarHBondContact O-N 2.96Å; D79-P81 VanDerWaalsContact O-CD 3.31Å; D79-P81 WeakPolarHBondContact O-CD 3.1Å
80	Q	83.2	Confident	92.5	Very high	104 Å²	104	72.8 Å²	72.8	49%	0.486	39%	0.392	S	S	.	.	S	Bend	trans	-114.3	91.6	-179.4	-68.4	-170	31.7	0	0	111.3	R77 P78 G82	R77-Q80 PolarHBondContact O-N 3.34Å; R77-Q80 VanDerWaalsContact O-N 3.1Å; P78-Q80 VanDerWaalsContact C-N 3.3Å; P78-Q80 PolarHBondContact O-N 3.28Å; Q80-G82 PolarHBondContact O-N 3.32Å; Q80-G82 VanDerWaalsContact O-N 3.1Å
81	P	85.3	Confident	92.4	Very high	133 Å²	133	77.2 Å²	77.2	86%	0.864	42%	0.421	S	S	*	.			trans	-63.5	115.3	174.2	26.5	-32.9	0	0	0	109.4	D79	D79-P81 VanDerWaalsContact O-CD 3.31Å; D79-P81 WeakPolarHBondContact O-CD 3.1Å
82	G	88.2	Confident	91.9	Very high	45 Å²	45	79.5 Å²	79.5	46%	0.464	44%	0.438	S	S	.	.			trans	-158.4	152	-176.5	0	0	0	0	0	113	R76 Q80 G84	R76-G82 WeakPolarHBondContact CD-O 3.49Å; Q80-G82 PolarHBondContact O-N 3.32Å; Q80-G82 VanDerWaalsContact O-N 3.1Å; G82-G84 PolarHBondContact O-N 2.94Å
83	K	90	Very high	91.4	Very high	198 Å²	198	76.7 Å²	76.7	86%	0.861	42%	0.423	S	S	*	.	S	Bend	trans	-73	129.7	179.8	-172	173.5	-178.4	174.4	0	111	R76	R76-K83 PolarHBondContact NE-O 3.42Å; R76-K83 PolarHBondContact NH2-O 3.07Å
84	G	92.4	Very high	90.5	Very high	52 Å²	52	70.9 Å²	70.9	54%	0.536	40%	0.403	S	S	.	.	S	Bend	trans	72.4	-171.7	170.8	0	0	0	0	0	114.3	R76 G82	R76-G84 WeakPolarHBondContact CD-O 3.35Å; R76-G84 WeakPolarHBondContact CG-O 3.42Å; R76-G84 PolarHBondContact NE-O 3.28Å; G82-G84 PolarHBondContact O-N 2.94Å
85	S	95.5	Very high	89.8	Confident	33 Å²	33	73.7 Å²	73.7	23%	0.231	42%	0.419	C	S	.	.			trans	-101.4	161.2	177.8	-56	0	0	0	0	111.1	K73 I74	K73-S85 VanDerWaalsContact CG-CB 3.4Å; I74-S85 WeakPolarHBondContact O-CB 3.36Å
86	F	96.5	Very high	88.9	Confident	31 Å²	31	72.2 Å²	72.2	14%	0.136	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	147	165.2	-69.6	-77.1	0	0	0	109.8	M33 P35 I74 R76	M33-F86 HydrophobicContact CB-CB 4.36Å; M33-F86 HydrophobicContact CG-CB 4.39Å; M33-F86 HydrophobicContact CG-CD1 4.19Å; M33-F86 HydrophobicContact CG-CG 4.41Å; M33-F86 HydrophobicContact SD-CB 4.13Å; M33-F86 HydrophobicContact SD-CD1 4.41Å; M33-F86 HydrophobicContact SD-CD2 4.48Å; M33-F86 HydrophobicContact SD-CG 4.12Å; P35-F86 HydrophobicContact CB-CD1 4.41Å; P35-F86 HydrophobicContact CG-CE1 4.47Å; I74-F86 HydrophobicContact CB-CB 4.07Å; I74-F86 PolarHBondContact N-O 3.39Å; I74-F86 PolarHBondContact O-N 3.29Å; R76-F86 HydrophobicContact CG-CD2 3.93Å; R76-F86 HydrophobicContact CG-CE2 3.82Å
87	W	97.4	Very high	88.2	Confident	39 Å²	39	69.5 Å²	69.5	15%	0.148	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	127.5	171.7	-68.9	93.6	0	0	0	108.5	M33 L34 I39 L65 F71 I72 K73	M33-W87 WeakPolarHBondContact CA-O 3.32Å; L34-W87 PolarHBondContact N-O 3.39Å; L34-W87 PolarHBondContact O-N 3.02Å; I39-W87 HydrophobicContact CD1-CB 4.19Å; L65-W87 HydrophobicContact CB-CD2 4.18Å; L65-W87 HydrophobicContact CB-CE3 4.05Å; L65-W87 HydrophobicContact CB-CH2 3.75Å; L65-W87 HydrophobicContact CB-CZ2 3.9Å; L65-W87 HydrophobicContact CB-CZ3 3.83Å; L65-W87 HydrophobicContact CD1-CD2 4.12Å; L65-W87 HydrophobicContact CD1-CG 4.27Å; L65-W87 HydrophobicContact CD1-CZ2 4.35Å; L65-W87 HydrophobicContact CD2-CB 4.38Å; L65-W87 HydrophobicContact CD2-CD2 3.93Å; L65-W87 HydrophobicContact CD2-CE3 4Å; L65-W87 HydrophobicContact CD2-CG 4.11Å; L65-W87 HydrophobicContact CG-CD2 4.32Å; L65-W87 HydrophobicContact CG-CE3 4.49Å; L65-W87 VanDerWaalsContact O-CZ3 3.28Å; L65-W87 WeakPolarHBondContact O-CZ3 3.39Å; F71-W87 HydrophobicContact CB-CE3 3.98Å; F71-W87 HydrophobicContact CB-CZ3 4.3Å; I72-W87 WeakPolarHBondContact O-CA 3.36Å; K73-W87 HydrophobicContact CB-CE3 4.27Å; K73-W87 HydrophobicContact CB-CH2 4.07Å; K73-W87 HydrophobicContact CB-CZ2 4.47Å; K73-W87 HydrophobicContact CB-CZ3 3.95Å; K73-W87 HydrophobicContact CD-CZ2 4.46Å; K73-W87 HydrophobicContact CG-CH2 4.37Å; K73-W87 HydrophobicContact CG-CZ2 4.31Å
88	A	96.1	Very high	87.5	Confident	7 Å²	7	68.4 Å²	68.4	6%	0.058	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	164.8	176.3	0	0	0	0	0	110.4	M33 F71 I72 I74	M33-A88 HydrophobicContact CB-CB 3.93Å; F71-A88 WeakPolarHBondContact CA-O 3.49Å; I72-A88 HydrophobicContact CD1-CB 4.21Å; I72-A88 HydrophobicContact CG1-CB 3.86Å; I72-A88 WeakPolarHBondContact CG1-O 3.42Å; I72-A88 PolarHBondContact N-O 3.39Å; I72-A88 PolarHBondContact O-N 2.98Å; I74-A88 HydrophobicContact CD1-CB 3.49Å; I74-A88 VanDerWaalsContact CD1-CB 3.49Å; I74-A88 HydrophobicContact CG1-CB 4.35Å
89	L	94.1	Very high	86.7	Confident	27 Å²	27	69 Å²	69	14%	0.141	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	135	174.1	-165.6	66.3	0	0	0	109	I26 C70 F71 C93 F97	I26-L89 HydrophobicContact CG2-CB 4.29Å; C70-L89 HydrophobicContact CB-CD1 4.33Å; C70-L89 CarbonylContact O-C 3.55Å; C70-L89 WeakPolarHBondContact O-CA 3.28Å; F71-L89 HydrophobicContact CD1-CD1 4.27Å; F71-L89 HydrophobicContact CE1-CD1 3.98Å; L89-C93 WeakPolarHBondContact CD1-SG 3.43Å; L89-C93 WeakPolarHBondContact CG-SG 3.44Å; L89-F97 HydrophobicContact CD1-CD2 4.19Å; L89-F97 HydrophobicContact CD1-CE2 4.02Å; L89-F97 HydrophobicContact CD2-CD2 3.95Å
90	H	92.9	Very high	85.7	Confident	42 Å²	42	67 Å²	67	19%	0.194	39%	0.392	C	S	.	.			trans	-61	134.9	173.9	-171.1	-82	0	0	0	108.9	C70 I72 S92 C93 G94 F109	C70-H90 PolarHBondContact O-N 3.46Å; I72-H90 HydrophobicContact CG2-CB 4.17Å; H90-S92 VanDerWaalsContact C-N 3.26Å; H90-S92 PolarHBondContact CE1-OG 3.44Å; H90-S92 PolarHBondContact ND1-N 3.45Å; H90-S92 PolarHBondContact ND1-OG 3.22Å; H90-S92 PolarHBondContact O-N 2.99Å; H90-S92 VanDerWaalsContact O-N 3.15Å; H90-C93 PolarHBondContact O-N 2.9Å; H90-C93 PolarHBondContact O-SG 3.38Å; H90-G94 PolarHBondContact O-N 2.95Å; H90-F109 HydrophobicContact CB-CE1 4.21Å; H90-F109 HydrophobicContact CB-CZ 4.43Å; H90-F109 AromaticContact ND1-CZ 3.78Å
91	P	89.7	Confident	85.5	Confident	99 Å²	99	64.7 Å²	64.7	64%	0.643	39%	0.387	S	S	*	.	H	α-helix	trans	-53.8	-42.3	-173.7	18.3	-32.3	0	0	0	112.6	C93 G94	P91-C93 PolarHBondContact O-N 3.48Å; P91-C93 VanDerWaalsContact O-N 3.17Å; P91-G94 PolarHBondContact O-N 3.46Å; P91-G94 VanDerWaalsContact O-N 3.16Å
92	S	85.5	Confident	85.2	Confident	58 Å²	58	60 Å²	60	41%	0.406	35%	0.353	S	S	.	.	H	α-helix	trans	-73.7	-3.6	180	71.4	0	0	0	0	115.7	H90 F109	H90-S92 VanDerWaalsContact C-N 3.26Å; H90-S92 PolarHBondContact CE1-OG 3.44Å; H90-S92 PolarHBondContact ND1-N 3.45Å; H90-S92 PolarHBondContact ND1-OG 3.22Å; H90-S92 PolarHBondContact O-N 2.99Å; H90-S92 VanDerWaalsContact O-N 3.15Å; S92-F109 WeakPolarHBondContact OG-CE2 3.47Å; S92-F109 WeakPolarHBondContact OG-CZ 3.48Å
93	C	84	Confident	84.7	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-108.4	-6.3	171.5	75.2	0	0	0	0	112.8	C70 L89 H90 P91 M96 F97 F109	C70-C93 PolarHBondContact O-SG 3.29Å; L89-C93 WeakPolarHBondContact CD1-SG 3.43Å; L89-C93 WeakPolarHBondContact CG-SG 3.44Å; H90-C93 PolarHBondContact O-N 2.9Å; H90-C93 PolarHBondContact O-SG 3.38Å; P91-C93 PolarHBondContact O-N 3.48Å; P91-C93 VanDerWaalsContact O-N 3.17Å; C93-M96 HydrophobicContact CB-SD 4.34Å; C93-M96 WeakPolarHBondContact O-CB 3.11Å; C93-M96 PolarHBondContact O-N 3.32Å; C93-M96 VanDerWaalsContact O-N 3.17Å; C93-F97 WeakPolarHBondContact O-CD2 3.35Å; C93-F109 HydrophobicContact CB-CD1 3.94Å; C93-F109 HydrophobicContact CB-CD2 3.95Å; C93-F109 HydrophobicContact CB-CE1 3.96Å; C93-F109 HydrophobicContact CB-CE2 3.99Å; C93-F109 HydrophobicContact CB-CG 3.93Å; C93-F109 HydrophobicContact CB-CZ 4Å
94	G	78.9	Confident	83.6	Confident	18 Å²	18	64.6 Å²	64.6	19%	0.186	36%	0.359	C	S	.	.	H	α-helix	trans	-51.8	-54.8	173.8	0	0	0	0	0	112.7	H90 P91 M96 F97 E98	H90-G94 PolarHBondContact O-N 2.95Å; P91-G94 PolarHBondContact O-N 3.46Å; P91-G94 VanDerWaalsContact O-N 3.16Å; G94-M96 PolarHBondContact O-N 3.05Å; G94-F97 PolarHBondContact O-N 2.93Å; G94-E98 PolarHBondContact O-N 3.46Å; G94-E98 VanDerWaalsContact O-N 3.17Å
95	D	78.8	Confident	82.8	Confident	109 Å²	109	66.4 Å²	66.4	58%	0.583	35%	0.35	S	S	*	.	H	α-helix	trans	-54.4	-29	-179.6	-51	-14	0	0	0	112.5	F97 N99	D95-F97 PolarHBondContact O-N 3.47Å; D95-N99 PolarHBondContact O-OD1 3.04Å
96	M	76.5	Confident	81.6	Confident	69 Å²	69	77.2 Å²	77.2	34%	0.34	39%	0.386	S	S	.	.	H	α-helix	trans	-72.5	-16.9	-177.7	-49	-172.2	172	0	0	113.8	C93 G94 R105 F109	C93-M96 HydrophobicContact CB-SD 4.34Å; C93-M96 WeakPolarHBondContact O-CB 3.11Å; C93-M96 PolarHBondContact O-N 3.32Å; C93-M96 VanDerWaalsContact O-N 3.17Å; G94-M96 PolarHBondContact O-N 3.05Å; M96-R105 PolarHBondContact O-NH2 3.37Å; M96-R105 PolarHBondContact SD-NH1 2.88Å; M96-F109 HydrophobicContact CE-CB 4.44Å; M96-F109 HydrophobicContact CE-CD2 3.59Å; M96-F109 HydrophobicContact CE-CE2 4.35Å; M96-F109 HydrophobicContact CE-CG 4.41Å; M96-F109 HydrophobicContact SD-CB 4.29Å; M96-F109 HydrophobicContact SD-CD2 4.27Å
97	F	79	Confident	80.6	Confident	5 Å²	5	84 Å²	84	2%	0.022	42%	0.415	C	S	.	.	H	α-helix	trans	-117.8	-13.7	-177.2	-60	-76	0	0	0	112.7	I19 A23 Q27 L89 C93 G94 D95 G100 F102	I19-F97 HydrophobicContact CG2-CE1 4.29Å; I19-F97 HydrophobicContact CG2-CZ 3.77Å; A23-F97 HydrophobicContact CB-CB 4.48Å; A23-F97 HydrophobicContact CB-CD1 3.88Å; A23-F97 HydrophobicContact CB-CD2 4.17Å; A23-F97 HydrophobicContact CB-CE1 4.08Å; A23-F97 HydrophobicContact CB-CE2 4.36Å; A23-F97 HydrophobicContact CB-CG 3.93Å; A23-F97 HydrophobicContact CB-CZ 4.31Å; Q27-F97 VanDerWaalsContact NE2-C 3.31Å; Q27-F97 PolarHBondContact NE2-O 3.18Å; L89-F97 HydrophobicContact CD1-CD2 4.19Å; L89-F97 HydrophobicContact CD1-CE2 4.02Å; L89-F97 HydrophobicContact CD2-CD2 3.95Å; C93-F97 WeakPolarHBondContact O-CD2 3.35Å; G94-F97 PolarHBondContact O-N 2.93Å; D95-F97 PolarHBondContact O-N 3.47Å; F97-G100 PolarHBondContact O-N 2.96Å; F97-F102 HydrophobicContact CB-CE1 4.18Å; F97-F102 HydrophobicContact CD1-CD1 4.27Å; F97-F102 HydrophobicContact CD1-CE1 4.5Å
98	E	74.5	Confident	79.7	Confident	147 Å²	147	87.1 Å²	87.1	69%	0.687	43%	0.427	S	S	*	.	H	α-helix	trans	-66.1	-37.6	-177.8	-169.6	167.9	178.2	0	0	112.3	G94 G100	G94-E98 PolarHBondContact O-N 3.46Å; G94-E98 VanDerWaalsContact O-N 3.17Å; E98-G100 PolarHBondContact O-N 3.4Å
99	N	71.7	Confident	78.8	Confident	147 Å²	147	87.8 Å²	87.8	79%	0.786	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	17.7	177.5	-52.4	68.5	0	0	0	113.9	D95 S101	D95-N99 PolarHBondContact O-OD1 3.04Å; N99-S101 VanDerWaalsContact C-N 3.31Å; N99-S101 PolarHBondContact O-N 2.99Å
100	G	69.9	Low	78	Confident	45 Å²	45	92.9 Å²	92.9	46%	0.464	45%	0.45	S	S	.	.	S	Bend	trans	76.7	6.8	175.5	0	0	0	0	0	115.8	F97 E98 F102	F97-G100 PolarHBondContact O-N 2.96Å; E98-G100 PolarHBondContact O-N 3.4Å; G100-F102 VanDerWaalsContact C-N 3.28Å; G100-F102 VanDerWaalsContact O-CD2 3.31Å; G100-F102 WeakPolarHBondContact O-CD2 3.45Å; G100-F102 PolarHBondContact O-N 2.91Å
101	S	79	Confident	77.3	Confident	54 Å²	54	93.1 Å²	93.1	38%	0.378	45%	0.454	S	S	.	.			trans	-75.9	75.7	176.5	175.2	0	0	0	0	111.8	N99 L103	N99-S101 VanDerWaalsContact C-N 3.31Å; N99-S101 PolarHBondContact O-N 2.99Å; S101-L103 VanDerWaalsContact C-N 3.3Å
102	F	79.2	Confident	76.6	Confident	34 Å²	34	96.1 Å²	96.1	15%	0.149	46%	0.463	C	S	.	.			trans	-86.3	0.4	172.8	-59.8	-66.8	0	0	0	113.4	Y16 S20 M24 Q27 F97 G100	Y16-F102 HydrophobicContact CD1-CB 3.84Å; Y16-F102 HydrophobicContact CE1-CB 3.76Å; S20-F102 WeakPolarHBondContact CB-O 3.09Å; S20-F102 PolarHBondContact OG-O 3.33Å; M24-F102 HydrophobicContact CB-CE1 4.44Å; M24-F102 HydrophobicContact CG-CD1 3.45Å; M24-F102 VanDerWaalsContact CG-CD1 3.45Å; M24-F102 HydrophobicContact CG-CD2 4.1Å; M24-F102 HydrophobicContact CG-CE1 3.38Å; M24-F102 HydrophobicContact CG-CE2 4.04Å; M24-F102 HydrophobicContact CG-CG 3.82Å; M24-F102 HydrophobicContact CG-CZ 3.7Å; M24-F102 HydrophobicContact SD-CD1 4.26Å; M24-F102 HydrophobicContact SD-CD2 4.13Å; M24-F102 HydrophobicContact SD-CE2 4.45Å; M24-F102 HydrophobicContact SD-CG 4.03Å; Q27-F102 VanDerWaalsContact OE1-CZ 3.26Å; F97-F102 HydrophobicContact CB-CE1 4.18Å; F97-F102 HydrophobicContact CD1-CD1 4.27Å; F97-F102 HydrophobicContact CD1-CE1 4.5Å; G100-F102 VanDerWaalsContact C-N 3.28Å; G100-F102 VanDerWaalsContact O-CD2 3.31Å; G100-F102 WeakPolarHBondContact O-CD2 3.45Å; G100-F102 PolarHBondContact O-N 2.91Å
103	L	76.2	Confident	75.6	Confident	119 Å²	119	101.5 Å²	101.5	62%	0.623	48%	0.48	S	S	*	.	S	Bend	trans	-74	156.5	176.1	-74.4	156.5	0	0	0	111.7	S101 R105	S101-L103 VanDerWaalsContact C-N 3.3Å; L103-R105 PolarHBondContact O-N 3.02Å; L103-R105 VanDerWaalsContact O-N 3.11Å
104	R	67.8	Low	74.2	Confident	221 Å²	221	106.8 Å²	106.8	83%	0.834	52%	0.516	S	S	*	.			trans	-59.7	114	-177.9	-168.9	-179.1	97.9	-148.4	8.3	110.9
105	R	74.9	Confident	72.9	Confident	90 Å²	90	111.7 Å²	111.7	34%	0.34	54%	0.539	S	S	.	.			trans	-76.6	149.2	176.3	-159.8	176.2	-61.2	116.7	10.8	111.5	M96 L103	M96-R105 PolarHBondContact O-NH2 3.37Å; M96-R105 PolarHBondContact SD-NH1 2.88Å; L103-R105 PolarHBondContact O-N 3.02Å; L103-R105 VanDerWaalsContact O-N 3.11Å
106	R	70.8	Confident	71.4	Confident	260 Å²	260	113.7 Å²	113.7	98%	0.981	54%	0.544	S	S	*	.	S	Bend	trans	-75.6	-30	176.6	-66.9	-176	-179.6	141.5	-0.6	113.8
107	K	76.4	Confident	70.1	Confident	173 Å²	173	119 Å²	119	75%	0.752	57%	0.573	S	S	*	*	S	Bend	trans	-111	131.6	-177.4	-169.5	175.2	-179	-179.9	0	111
108	R	76.9	Confident	68.8	Low	105 Å²	105	121.6 Å²	121.6	40%	0.396	60%	0.595	S	S	.	*			trans	-77.6	133.8	176.7	-178.2	171.8	177.3	-171.5	0.5	110.4	F67	F67-R108 VanDerWaalsContact CD1-NH2 3.29Å; F67-R108 PolarHBondContact O-NH2 2.94Å
109	F	77.2	Confident	67.4	Low	22 Å²	22	120.1 Å²	120.1	10%	0.096	60%	0.599	C	S	.	*			trans	-69.6	132.3	168.8	173.6	-102.7	0	0	0	109.6	D69 C70 H90 S92 C93 M96 V111	D69-F109 HydrophobicContact CB-CD1 4.35Å; D69-F109 HydrophobicContact CB-CE1 4.25Å; C70-F109 HydrophobicContact CB-CD1 4.22Å; C70-F109 WeakPolarHBondContact SG-CD1 3.16Å; H90-F109 HydrophobicContact CB-CE1 4.21Å; H90-F109 HydrophobicContact CB-CZ 4.43Å; H90-F109 AromaticContact ND1-CZ 3.78Å; S92-F109 WeakPolarHBondContact OG-CE2 3.47Å; S92-F109 WeakPolarHBondContact OG-CZ 3.48Å; C93-F109 HydrophobicContact CB-CD1 3.94Å; C93-F109 HydrophobicContact CB-CD2 3.95Å; C93-F109 HydrophobicContact CB-CE1 3.96Å; C93-F109 HydrophobicContact CB-CE2 3.99Å; C93-F109 HydrophobicContact CB-CG 3.93Å; C93-F109 HydrophobicContact CB-CZ 4Å; M96-F109 HydrophobicContact CE-CB 4.44Å; M96-F109 HydrophobicContact CE-CD2 3.59Å; M96-F109 HydrophobicContact CE-CE2 4.35Å; M96-F109 HydrophobicContact CE-CG 4.41Å; M96-F109 HydrophobicContact SD-CB 4.29Å; M96-F109 HydrophobicContact SD-CD2 4.27Å; F109-V111 HydrophobicContact CE1-CG2 3.48Å; F109-V111 VanDerWaalsContact CE1-CG2 3.48Å; F109-V111 HydrophobicContact CZ-CG2 3.52Å
110	K	78.4	Confident	66.2	Low	134 Å²	134	116.2 Å²	116.2	58%	0.583	58%	0.583	S	S	*	*			trans	-135.5	124.6	176.5	-72.2	173.2	169.7	-79.8	0	106	L112	K110-L112 PolarHBondContact O-N 2.95Å
111	V	78.5	Confident	65.6	Low	47 Å²	47	120.9 Å²	120.9	29%	0.285	59%	0.59	S	S	.	*			trans	-71.4	118.6	169.4	178.3	0	0	0	0	106	D69 F109 K113	D69-V111 HydrophobicContact CB-CB 4.37Å; D69-V111 HydrophobicContact CB-CG2 3.85Å; F109-V111 HydrophobicContact CE1-CG2 3.48Å; F109-V111 VanDerWaalsContact CE1-CG2 3.48Å; F109-V111 HydrophobicContact CZ-CG2 3.52Å; V111-K113 VanDerWaalsContact C-N 3.29Å; V111-K113 PolarHBondContact O-N 2.94Å
112	L	74.1	Confident	64.6	Low	161 Å²	161	123.9 Å²	123.9	84%	0.843	61%	0.609	S	S	*	*			trans	-65.4	100	164.8	-90.3	96.9	0	0	0	106.3	K110 S114	K110-L112 PolarHBondContact O-N 2.95Å; L112-S114 PolarHBondContact O-N 3.32Å
113	K	64.2	Low	63.9	Low	172 Å²	172	125.3 Å²	125.3	75%	0.748	63%	0.627	S	S	*	*			trans	-64.6	106.7	160.7	-73.7	175.8	167.8	179.1	0	106	V111 D115	V111-K113 VanDerWaalsContact C-N 3.29Å; V111-K113 PolarHBondContact O-N 2.94Å; K113-D115 PolarHBondContact O-N 3.41Å
114	S	56.2	Low	63.3	Low	110 Å²	110	123.3 Å²	123.3	77%	0.769	62%	0.617	S	S	*	*			trans	-69.2	65.8	167.7	24.4	0	0	0	0	109.2	L112 H116	L112-S114 PolarHBondContact O-N 3.32Å; S114-H116 PolarHBondContact O-N 3.05Å
115	D	49.9	Very low	63.3	Low	122 Å²	122	115.6 Å²	115.6	65%	0.652	60%	0.6	S	S	*	*			trans	-75.5	36.2	163.1	-76.9	-40.4	0	0	0	110.5	K113 A118	K113-D115 PolarHBondContact O-N 3.41Å; D115-A118 WeakPolarHBondContact O-CB 3.39Å; D115-A118 PolarHBondContact O-N 3.3Å
116	H	48.5	Very low	63.4	Low	150 Å²	150	114.2 Å²	114.2	69%	0.694	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	17.5	-178.3	-127	-64.3	0	0	0	113.9	S114 A118	S114-H116 PolarHBondContact O-N 3.05Å; H116-A118 VanDerWaalsContact C-N 3.29Å
117	L	49	Very low	63.8	Low	180 Å²	180	107.2 Å²	107.2	94%	0.942	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	5.2	149.5	-69.6	174.6	0	0	0	112.3
118	A	51.5	Low	64	Low	60 Å²	60	105.8 Å²	105.8	50%	0.496	58%	0.577	S	S	.	*	S	Bend	trans	-84.5	125.1	157.4	0	0	0	0	0	108.7	D115 H116 S120	D115-A118 WeakPolarHBondContact O-CB 3.39Å; D115-A118 PolarHBondContact O-N 3.3Å; H116-A118 VanDerWaalsContact C-N 3.29Å; A118-S120 PolarHBondContact O-N 3.15Å
119	P	44.7	Very low	64.3	Low	117 Å²	117	106.6 Å²	106.6	76%	0.76	59%	0.588	S	S	*	*			trans	-71.1	120.6	-174.8	28.4	-31.1	0	0	0	109.4
120	S	47	Very low	64.7	Low	64 Å²	64	112.2 Å²	112.2	45%	0.448	62%	0.615	S	S	.	*	S	Bend	trans	56.6	138.1	157.2	57.7	0	0	0	0	118.4	A118	A118-S120 PolarHBondContact O-N 3.15Å
121	K	57.6	Low	64.9	Low	143 Å²	143	111.4 Å²	111.4	62%	0.622	61%	0.613	S	S	*	*			trans	-24.4	132.7	165.9	-61.7	157.9	-177.8	169.9	0	112.2	A123 D124	K121-A123 HydrophobicContact CB-CB 4.47Å; K121-A123 PolarHBondContact O-N 2.89Å; K121-D124 PolarHBondContact O-N 3.18Å
122	P	58.6	Low	65.1	Low	118 Å²	118	113.3 Å²	113.3	77%	0.766	62%	0.619	S	S	*	*	H	α-helix	trans	-57.6	-17.6	177.7	23.5	-33.6	0	0	0	113.4	A126	P122-A126 PolarHBondContact O-N 3.14Å
123	A	63.5	Low	65.7	Low	64 Å²	64	108.5 Å²	108.5	53%	0.529	60%	0.602	S	S	.	*	H	α-helix	trans	-62.7	-39.9	170.6	0	0	0	0	0	113.2	K121 Q127	K121-A123 HydrophobicContact CB-CB 4.47Å; K121-A123 PolarHBondContact O-N 2.89Å; A123-Q127 WeakPolarHBondContact O-CG 3.34Å; A123-Q127 PolarHBondContact O-N 3.15Å; A123-Q127 VanDerWaalsContact O-N 3.13Å
124	D	64.5	Low	66.7	Low	77 Å²	77	108.1 Å²	108.1	41%	0.412	60%	0.601	S	S	.	*	H	α-helix	trans	-74.6	-36.3	-178.9	-66.1	-34.4	0	0	0	111.1	K121 Q127 Y128	K121-D124 PolarHBondContact O-N 3.18Å; D124-Q127 PolarHBondContact O-N 3.16Å; D124-Y128 WeakPolarHBondContact O-CB 3.22Å; D124-Y128 PolarHBondContact O-N 3.47Å
125	A	67.7	Low	68	Low	58 Å²	58	108.7 Å²	108.7	48%	0.479	59%	0.594	S	S	.	*	H	α-helix	trans	-64.4	-41.1	175.6	0	0	0	0	0	112.3	Y128 L129	A125-Y128 PolarHBondContact O-N 3.02Å; A125-L129 PolarHBondContact O-N 2.8Å
126	A	75.8	Confident	69.3	Low	61 Å²	61	112.8 Å²	112.8	50%	0.504	60%	0.601	S	S	.	*	H	α-helix	trans	-65	-41.3	174.7	0	0	0	0	0	111.8	P122 L129 Q130	P122-A126 PolarHBondContact O-N 3.14Å; A126-L129 PolarHBondContact O-N 2.98Å; A126-Q130 WeakPolarHBondContact O-CB 3.41Å; A126-Q130 PolarHBondContact O-N 2.91Å
127	Q	79	Confident	70.7	Confident	113 Å²	113	111.7 Å²	111.7	53%	0.528	60%	0.599	S	S	.	*	H	α-helix	trans	-66.8	-38.9	176.3	-73.4	-149.8	-23.3	0	0	112.7	A123 D124 Q130 Q131	A123-Q127 WeakPolarHBondContact O-CG 3.34Å; A123-Q127 PolarHBondContact O-N 3.15Å; A123-Q127 VanDerWaalsContact O-N 3.13Å; D124-Q127 PolarHBondContact O-N 3.16Å; Q127-Q130 PolarHBondContact O-N 3.19Å; Q127-Q131 WeakPolarHBondContact O-CB 3.33Å; Q127-Q131 VanDerWaalsContact O-CG 3.31Å; Q127-Q131 WeakPolarHBondContact O-CG 3.27Å; Q127-Q131 PolarHBondContact O-N 3.44Å
128	Y	81.4	Confident	72.1	Confident	144 Å²	144	106 Å²	106	57%	0.565	58%	0.575	S	S	*	*	H	α-helix	trans	-63.7	-44.6	175.7	-175.2	-102.4	0	0	0	111.8	D124 A125 Q130 Q131 Q132	D124-Y128 WeakPolarHBondContact O-CB 3.22Å; D124-Y128 PolarHBondContact O-N 3.47Å; A125-Y128 PolarHBondContact O-N 3.02Å; Y128-Q130 VanDerWaalsContact C-N 3.34Å; Y128-Q130 PolarHBondContact O-N 2.94Å; Y128-Q131 PolarHBondContact O-N 3.43Å; Y128-Q132 HydrophobicContact CD1-CG 4.33Å; Y128-Q132 HydrophobicContact CE1-CG 3.98Å; Y128-Q132 WeakPolarHBondContact O-CG 3.34Å; Y128-Q132 PolarHBondContact O-N 3.07Å; Y128-Q132 PolarHBondContact OH-NE2 3.34Å
129	L	82.9	Confident	73.2	Confident	121 Å²	121	105.7 Å²	105.7	63%	0.634	57%	0.572	S	S	*	*	H	α-helix	trans	-63.5	-40.4	176	-165.4	75.6	0	0	0	111.5	A125 A126 Q132 A133	A125-L129 PolarHBondContact O-N 2.8Å; A126-L129 PolarHBondContact O-N 2.98Å; L129-Q132 PolarHBondContact O-N 2.75Å; L129-A133 WeakPolarHBondContact O-CB 3.41Å; L129-A133 PolarHBondContact O-N 2.89Å
130	Q	84.8	Confident	74.2	Confident	140 Å²	140	106.4 Å²	106.4	65%	0.654	57%	0.569	S	S	*	*	H	α-helix	trans	-65.5	-39.5	176.2	-169	178.8	9.2	0	0	112	A126 Q127 Y128 A133 K134	A126-Q130 WeakPolarHBondContact O-CB 3.41Å; A126-Q130 PolarHBondContact O-N 2.91Å; Q127-Q130 PolarHBondContact O-N 3.19Å; Y128-Q130 VanDerWaalsContact C-N 3.34Å; Y128-Q130 PolarHBondContact O-N 2.94Å; Q130-A133 PolarHBondContact O-N 3.12Å; Q130-K134 WeakPolarHBondContact O-CB 3.38Å; Q130-K134 PolarHBondContact O-N 3.49Å
131	Q	84	Confident	75.1	Confident	118 Å²	118	107.4 Å²	107.4	55%	0.551	58%	0.581	S	S	*	*	H	α-helix	trans	-65.9	-43.1	174.4	-75.6	177.8	16.7	0	0	111.6	Q127 Y128 A133 K134 L135	Q127-Q131 WeakPolarHBondContact O-CB 3.33Å; Q127-Q131 VanDerWaalsContact O-CG 3.31Å; Q127-Q131 WeakPolarHBondContact O-CG 3.27Å; Q127-Q131 PolarHBondContact O-N 3.44Å; Y128-Q131 PolarHBondContact O-N 3.43Å; Q131-A133 PolarHBondContact O-N 3.03Å; Q131-K134 PolarHBondContact O-N 3.21Å; Q131-L135 PolarHBondContact O-N 3.36Å
132	Q	82.7	Confident	75.3	Confident	87 Å²	87	104.5 Å²	104.5	41%	0.407	58%	0.584	S	S	.	*	H	α-helix	trans	-61.9	-41.6	174.4	-76	-163.4	-10	0	0	112.2	Y128 L129 K134 L135 R136	Y128-Q132 HydrophobicContact CD1-CG 4.33Å; Y128-Q132 HydrophobicContact CE1-CG 3.98Å; Y128-Q132 WeakPolarHBondContact O-CG 3.34Å; Y128-Q132 PolarHBondContact O-N 3.07Å; Y128-Q132 PolarHBondContact OH-NE2 3.34Å; L129-Q132 PolarHBondContact O-N 2.75Å; Q132-K134 VanDerWaalsContact C-N 3.31Å; Q132-K134 PolarHBondContact O-N 3.3Å; Q132-L135 PolarHBondContact O-N 3.22Å; Q132-R136 WeakPolarHBondContact O-CG 3.43Å; Q132-R136 PolarHBondContact O-N 3.49Å
133	A	85.7	Confident	75.3	Confident	59 Å²	59	102.5 Å²	102.5	49%	0.488	57%	0.572	S	S	.	*	H	α-helix	trans	-61.8	-39.8	175.3	0	0	0	0	0	111.7	L129 Q130 Q131 R136 L137	L129-A133 WeakPolarHBondContact O-CB 3.41Å; L129-A133 PolarHBondContact O-N 2.89Å; Q130-A133 PolarHBondContact O-N 3.12Å; Q131-A133 PolarHBondContact O-N 3.03Å; A133-R136 PolarHBondContact O-N 3.4Å; A133-L137 WeakPolarHBondContact O-CB 3.47Å; A133-L137 PolarHBondContact O-N 3.2Å
134	K	85.5	Confident	74.7	Confident	164 Å²	164	103 Å²	103	71%	0.713	58%	0.584	S	S	*	*	H	α-helix	trans	-64.3	-42.2	176.8	-166.1	173.6	-178	-179.8	0	112.1	Q130 Q131 Q132 L137 S138	Q130-K134 WeakPolarHBondContact O-CB 3.38Å; Q130-K134 PolarHBondContact O-N 3.49Å; Q131-K134 PolarHBondContact O-N 3.21Å; Q132-K134 VanDerWaalsContact C-N 3.31Å; Q132-K134 PolarHBondContact O-N 3.3Å; K134-L137 PolarHBondContact O-N 3.42Å; K134-S138 PolarHBondContact O-N 3.04Å; K134-S138 PolarHBondContact O-OG 2.83Å
135	L	83	Confident	74.2	Confident	122 Å²	122	104.3 Å²	104.3	64%	0.639	60%	0.595	S	S	*	*	H	α-helix	trans	-66.1	-39.8	176.3	-71.5	172.8	0	0	0	112.5	Q131 Q132 S138 A139	Q131-L135 PolarHBondContact O-N 3.36Å; Q132-L135 PolarHBondContact O-N 3.22Å; L135-S138 WeakPolarHBondContact CA-OG 3.37Å; L135-S138 PolarHBondContact O-N 3.12Å; L135-S138 PolarHBondContact O-OG 2.8Å; L135-A139 VanDerWaalsContact O-CB 3.32Å; L135-A139 WeakPolarHBondContact O-CB 3.49Å; L135-A139 PolarHBondContact O-N 3.39Å
136	R	78.3	Confident	73.3	Confident	208 Å²	208	109.7 Å²	109.7	79%	0.785	61%	0.61	S	S	*	*	H	α-helix	trans	-62.2	-44.4	174.5	-76.7	-88.3	176.7	106.9	-3.2	111.4	Q132 A133 A139 L140	Q132-R136 WeakPolarHBondContact O-CG 3.43Å; Q132-R136 PolarHBondContact O-N 3.49Å; A133-R136 PolarHBondContact O-N 3.4Å; R136-A139 PolarHBondContact O-N 3.39Å; R136-L140 PolarHBondContact O-N 3.32Å; R136-L140 VanDerWaalsContact O-N 3.08Å
137	L	77	Confident	72	Confident	127 Å²	127	114.4 Å²	114.4	67%	0.665	63%	0.626	S	S	*	*	H	α-helix	trans	-67.2	-40.4	178.7	-165.9	70.1	0	0	0	111.7	A133 K134 L140 A141	A133-L137 WeakPolarHBondContact O-CB 3.47Å; A133-L137 PolarHBondContact O-N 3.2Å; K134-L137 PolarHBondContact O-N 3.42Å; L137-L140 PolarHBondContact O-N 3.29Å; L137-A141 PolarHBondContact O-N 3.49Å
138	S	79.1	Confident	70.8	Confident	62 Å²	62	114 Å²	114	43%	0.434	63%	0.633	S	S	.	*	H	α-helix	trans	-67.8	-34.5	175.2	59.2	0	0	0	0	112.8	K134 L135 L140 A141 A142	K134-S138 PolarHBondContact O-N 3.04Å; K134-S138 PolarHBondContact O-OG 2.83Å; L135-S138 WeakPolarHBondContact CA-OG 3.37Å; L135-S138 PolarHBondContact O-N 3.12Å; L135-S138 PolarHBondContact O-OG 2.8Å; S138-L140 VanDerWaalsContact C-N 3.35Å; S138-A141 PolarHBondContact O-N 3.08Å; S138-A142 WeakPolarHBondContact O-CB 3.21Å; S138-A142 PolarHBondContact O-N 3.38Å
139	A	73.8	Confident	69	Low	53 Å²	53	116.3 Å²	116.3	44%	0.438	65%	0.649	S	S	.	*	H	α-helix	trans	-66.4	-37.6	175.3	0	0	0	0	0	112	L135 R136 A142 S143	L135-A139 VanDerWaalsContact O-CB 3.32Å; L135-A139 WeakPolarHBondContact O-CB 3.49Å; L135-A139 PolarHBondContact O-N 3.39Å; R136-A139 PolarHBondContact O-N 3.39Å; A139-A142 PolarHBondContact O-N 3.3Å; A139-S143 PolarHBondContact O-N 3.17Å; A139-S143 VanDerWaalsContact O-N 3.17Å; A139-S143 PolarHBondContact O-OG 2.87Å
140	L	66.7	Low	67.5	Low	132 Å²	132	118.3 Å²	118.3	69%	0.691	66%	0.657	S	S	*	*	H	α-helix	trans	-67.3	-37.9	173.9	-164.2	69.7	0	0	0	111.6	R136 L137 S138 S143	R136-L140 PolarHBondContact O-N 3.32Å; R136-L140 VanDerWaalsContact O-N 3.08Å; L137-L140 PolarHBondContact O-N 3.29Å; S138-L140 VanDerWaalsContact C-N 3.35Å; L140-S143 PolarHBondContact O-N 3.34Å
141	A	66.4	Low	66	Low	84 Å²	84	117 Å²	117	69%	0.694	66%	0.661	S	S	*	*	H	α-helix	trans	-69.6	-30.2	175.6	0	0	0	0	0	113.6	L137 S138 S143	L137-A141 PolarHBondContact O-N 3.49Å; S138-A141 PolarHBondContact O-N 3.08Å; A141-S143 VanDerWaalsContact C-N 3.33Å
142	A	62	Low	64	Low	83 Å²	83	116.8 Å²	116.8	69%	0.686	68%	0.679	S	S	*	*	H	α-helix	trans	-78.1	-18.5	175.7	0	0	0	0	0	113.1	S138 A139 G144	S138-A142 WeakPolarHBondContact O-CB 3.21Å; S138-A142 PolarHBondContact O-N 3.38Å; A139-A142 PolarHBondContact O-N 3.3Å; A142-G144 PolarHBondContact O-N 2.78Å
143	S	57.3	Low	62.4	Low	75 Å²	75	116.4 Å²	116.4	52%	0.524	69%	0.69	S	S	.	*			trans	-82	70.5	173.7	-54.4	0	0	0	0	108.4	A139 L140 A141 T145	A139-S143 PolarHBondContact O-N 3.17Å; A139-S143 VanDerWaalsContact O-N 3.17Å; A139-S143 PolarHBondContact O-OG 2.87Å; L140-S143 PolarHBondContact O-N 3.34Å; A141-S143 VanDerWaalsContact C-N 3.33Å; S143-T145 PolarHBondContact O-N 3.19Å
144	G	50.9	Low	60.3	Low	75 Å²	75	118.8 Å²	118.8	77%	0.773	71%	0.71	S	S	*	*			trans	-67.4	47.1	-178.2	0	0	0	0	0	114.6	A142 H146	A142-G144 PolarHBondContact O-N 2.78Å; G144-H146 PolarHBondContact O-N 3.46Å
145	T	53.4	Low	58.5	Low	105 Å²	105	120.3 Å²	120.3	64%	0.644	71%	0.713	S	S	*	*			trans	-86	98.2	169.1	51.1	0	0	0	0	108.8	S143 L147	S143-T145 PolarHBondContact O-N 3.19Å; T145-L147 PolarHBondContact O-N 2.83Å
146	H	48.8	Very low	56.4	Low	170 Å²	170	122.4 Å²	122.4	79%	0.787	73%	0.725	S	S	*	*			trans	-15.9	116.8	157	71.5	-54.4	0	0	0	113.9	G144	G144-H146 PolarHBondContact O-N 3.46Å
147	L	49.5	Very low	55.1	Low	160 Å²	160	119.7 Å²	119.7	84%	0.838	73%	0.725	S	S	*	*			trans	-119.6	127.8	163.4	-112.3	143.4	0	0	0	106.7	T145 Q149	T145-L147 PolarHBondContact O-N 2.83Å; L147-Q149 PolarHBondContact O-N 3.18Å
148	P	53.9	Low	53.2	Low	105 Å²	105	117.1 Å²	117.1	68%	0.682	73%	0.729	S	S	*	*			trans	-64.4	129.5	-178.4	24	-31.6	0	0	0	110.8	M150	P148-M150 PolarHBondContact O-N 3.31Å
149	Q	42.6	Very low	51.3	Low	193 Å²	193	117.6 Å²	117.6	90%	0.902	74%	0.744	S	S	*	*			trans	-50.6	111.9	166	177.1	166.7	-22.3	0	0	110.5	L147	L147-Q149 PolarHBondContact O-N 3.18Å
150	M	52.4	Low	50	Low	163 Å²	163	120.8 Å²	120.8	80%	0.803	76%	0.758	S	S	*	*			trans	-105.6	140.8	167.5	-70.9	-70.7	-85.1	0	0	109.1	P148	P148-M150 PolarHBondContact O-N 3.31Å
151	P	52	Low	49.1	Very low	113 Å²	113	119.1 Å²	119.1	73%	0.734	76%	0.763	S	S	*	*			trans	-72.6	145.6	-168.4	28.6	-32.8	0	0	0	112.1	A153	P151-A153 PolarHBondContact O-N 2.7Å
152	A	43.8	Very low	48	Very low	113 Å²	113	122.7 Å²	122.7	93%	0.934	77%	0.765	S	S	*	*			trans	-59.4	98.4	173.7	0	0	0	0	0	110.8
153	A	47.7	Very low	47.6	Very low	78 Å²	78	123.8 Å²	123.8	65%	0.645	77%	0.765	S	S	*	*			trans	-106.6	113.2	163	0	0	0	0	0	107.9	P151 Y155	P151-A153 PolarHBondContact O-N 2.7Å; A153-Y155 PolarHBondContact O-N 3.14Å; A153-Y155 VanDerWaalsContact O-N 3.17Å
154	A	43.3	Very low	47.5	Very low	109 Å²	109	126 Å²	126	90%	0.901	78%	0.781	S	S	*	*			trans	-54.8	114.4	172.1	0	0	0	0	0	110.4
155	Y	47.4	Very low	48	Very low	197 Å²	197	125.4 Å²	125.4	77%	0.773	78%	0.775	S	S	*	*			trans	-127.2	109.4	150.8	57.1	-87.6	0	0	0	107.9	A153 L157	A153-Y155 PolarHBondContact O-N 3.14Å; A153-Y155 VanDerWaalsContact O-N 3.17Å; Y155-L157 HydrophobicContact CD2-CB 4.33Å; Y155-L157 PolarHBondContact O-N 3.27Å; Y155-L157 VanDerWaalsContact O-N 3.16Å
156	N	39.2	Very low	48.4	Very low	166 Å²	166	128.5 Å²	128.5	89%	0.888	78%	0.779	S	S	*	*			trans	-64.7	100.7	164.7	-166.5	19.8	0	0	0	106.9
157	L	49.7	Very low	49.4	Very low	150 Å²	150	126.5 Å²	126.5	79%	0.785	77%	0.768	S	S	*	*			trans	-119.2	104.2	167.1	-166.7	66.2	0	0	0	108.3	Y155	Y155-L157 HydrophobicContact CD2-CB 4.33Å; Y155-L157 PolarHBondContact O-N 3.27Å; Y155-L157 VanDerWaalsContact O-N 3.16Å
158	G	37	Very low	50.3	Low	73 Å²	73	123.7 Å²	123.7	75%	0.753	75%	0.751	S	S	*	*			trans	-58.6	133.4	174.8	0	0	0	0	0	111.5
159	G	40.6	Very low	51.4	Low	72 Å²	72	122.7 Å²	122.7	74%	0.742	74%	0.744	S	S	*	*			trans	-145.8	72.5	174.7	0	0	0	0	0	109.4	A161	G159-A161 PolarHBondContact O-N 2.78Å
160	V	45.8	Very low	53.1	Low	121 Å²	121	121 Å²	121	73%	0.733	73%	0.734	S	S	*	*			trans	14.6	91.4	159.7	-168.5	0	0	0	0	115.8	Q162	V160-Q162 HydrophobicContact CG1-CG 4.33Å; V160-Q162 PolarHBondContact O-N 2.96Å
161	A	46.9	Very low	54.3	Low	96 Å²	96	114.6 Å²	114.6	79%	0.793	71%	0.707	S	S	*	*			trans	-70	109.4	151.5	0	0	0	0	0	107.2	G159 P163	G159-A161 PolarHBondContact O-N 2.78Å; A161-P163 WeakPolarHBondContact O-CD 3.44Å
162	Q	44.4	Very low	55.4	Low	159 Å²	159	115.4 Å²	115.4	74%	0.743	70%	0.704	S	S	*	*			trans	-65.5	113.1	168.1	-79.2	-76.3	-12.3	0	0	108.4	V160 S164	V160-Q162 HydrophobicContact CG1-CG 4.33Å; V160-Q162 PolarHBondContact O-N 2.96Å; Q162-S164 PolarHBondContact O-N 2.79Å
163	P	53.1	Low	57.1	Low	106 Å²	106	116.4 Å²	116.4	69%	0.688	69%	0.689	S	S	*	*			trans	-69.8	119.4	159.6	30.1	-29	0	0	0	106.2	A161 G165	A161-P163 WeakPolarHBondContact O-CD 3.44Å; P163-G165 PolarHBondContact O-N 3.34Å
164	S	56.2	Low	58.3	Low	122 Å²	122	114.9 Å²	114.9	85%	0.853	67%	0.67	S	S	*	*			trans	-61.5	80.4	169.9	46.9	0	0	0	0	109.6	Q162 F166	Q162-S164 PolarHBondContact O-N 2.79Å; S164-F166 PolarHBondContact O-N 2.93Å; S164-F166 VanDerWaalsContact O-N 3.14Å
165	G	60.4	Low	59.7	Low	63 Å²	63	115.1 Å²	115.1	65%	0.649	66%	0.655	S	S	*	*			trans	-78.4	16.8	-175.5	0	0	0	0	0	114.5	P163 K167	P163-G165 PolarHBondContact O-N 3.34Å; G165-K167 PolarHBondContact O-N 2.82Å
166	F	62.3	Low	60.9	Low	169 Å²	169	111.3 Å²	111.3	74%	0.741	65%	0.647	S	S	*	*			trans	-76.7	75.7	173.8	-163.5	-99.1	0	0	0	109.8	S164 H168	S164-F166 PolarHBondContact O-N 2.93Å; S164-F166 VanDerWaalsContact O-N 3.14Å; F166-H168 AromaticContact CE1-CD2 3.83Å; F166-H168 PolarHBondContact O-N 3.28Å
167	K	69.8	Low	62	Low	128 Å²	128	106.6 Å²	106.6	56%	0.557	63%	0.631	S	S	*	*			trans	-74.1	104.3	169.3	-58	-166.3	172.4	-151	0	107.5	G165 N174	G165-K167 PolarHBondContact O-N 2.82Å; K167-N174 VanDerWaalsContact CB-ND2 3.34Å; K167-N174 WeakPolarHBondContact CB-ND2 3.48Å
168	H	69	Low	62.5	Low	102 Å²	102	110.1 Å²	110.1	47%	0.472	63%	0.634	S	S	.	*			trans	-50	136	175.9	-124.8	-73.4	0	0	0	109.4	F166 F170 A171 N174	F166-H168 AromaticContact CE1-CD2 3.83Å; F166-H168 PolarHBondContact O-N 3.28Å; H168-F170 AromaticContact ND1-CD2 3.7Å; H168-F170 PolarHBondContact O-N 3.34Å; H168-A171 HydrophobicContact CB-CB 4.16Å; H168-A171 WeakPolarHBondContact O-CB 3.13Å; H168-A171 PolarHBondContact O-N 3.35Å; H168-N174 PolarHBondContact O-ND2 3.1Å
169	P	76.7	Confident	63.1	Low	83 Å²	83	115.2 Å²	115.2	54%	0.539	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.2	-14.3	176.9	21.5	-32.8	0	0	0	113.1
170	F	78	Confident	63.5	Low	159 Å²	159	121.1 Å²	121.1	70%	0.697	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	11.5	178.1	-35.2	-65	0	0	0	113.2	H168	H168-F170 AromaticContact ND1-CD2 3.7Å; H168-F170 PolarHBondContact O-N 3.34Å
171	A	77.1	Confident	63.3	Low	28 Å²	28	124.9 Å²	124.9	23%	0.231	65%	0.646	C	S	.	*			trans	-67	135.9	173.8	0	0	0	0	0	109.6	H168 E173 N174 I175	H168-A171 HydrophobicContact CB-CB 4.16Å; H168-A171 WeakPolarHBondContact O-CB 3.13Å; H168-A171 PolarHBondContact O-N 3.35Å; A171-E173 PolarHBondContact O-N 3.27Å; A171-E173 VanDerWaalsContact O-N 3.11Å; A171-N174 PolarHBondContact O-N 3.49Å; A171-I175 PolarHBondContact O-N 2.95Å; A171-I175 VanDerWaalsContact O-N 3.15Å
172	I	75.1	Confident	63.3	Low	130 Å²	130	128.5 Å²	128.5	67%	0.667	65%	0.648	S	S	*	*	H	α-helix	trans	-52.7	-37.6	-177.2	-67.1	165.3	0	0	0	111	N174 I175 I176	I172-N174 VanDerWaalsContact C-N 3.34Å; I172-N174 PolarHBondContact O-N 3.43Å; I172-I175 PolarHBondContact O-N 3.3Å; I172-I176 HydrophobicContact CG2-CD1 3.41Å; I172-I176 VanDerWaalsContact CG2-CD1 3.41Å; I172-I176 HydrophobicContact CG2-CG1 4.26Å; I172-I176 VanDerWaalsContact O-CG1 3.22Å; I172-I176 WeakPolarHBondContact O-CG1 2.91Å; I172-I176 PolarHBondContact O-N 3.17Å
173	E	80.3	Confident	63.2	Low	134 Å²	134	126.9 Å²	126.9	63%	0.626	65%	0.652	S	S	*	*	H	α-helix	trans	-58.3	-41	175.7	-56.3	172.8	-149.1	0	0	113.2	A171 A177	A171-E173 PolarHBondContact O-N 3.27Å; A171-E173 VanDerWaalsContact O-N 3.11Å; E173-A177 WeakPolarHBondContact O-CB 3.31Å; E173-A177 PolarHBondContact O-N 3.19Å
174	N	71.8	Confident	62.7	Low	46 Å²	46	125.7 Å²	125.7	25%	0.246	66%	0.659	C	S	.	*	H	α-helix	trans	-79.9	-26.1	-179.2	-78.8	-9.2	0	0	0	112.9	K167 H168 A171 I172	K167-N174 VanDerWaalsContact CB-ND2 3.34Å; K167-N174 WeakPolarHBondContact CB-ND2 3.48Å; H168-N174 PolarHBondContact O-ND2 3.1Å; A171-N174 PolarHBondContact O-N 3.49Å; I172-N174 VanDerWaalsContact C-N 3.34Å; I172-N174 PolarHBondContact O-N 3.43Å
175	I	72.8	Confident	61.9	Low	114 Å²	114	123.8 Å²	123.8	59%	0.585	66%	0.658	S	S	*	*	H	α-helix	trans	-73.9	-38.8	175.8	-62.4	170.5	0	0	0	109.8	A171 I172	A171-I175 PolarHBondContact O-N 2.95Å; A171-I175 VanDerWaalsContact O-N 3.15Å; I172-I175 PolarHBondContact O-N 3.3Å
176	I	72.4	Confident	60.8	Low	116 Å²	116	129.2 Å²	129.2	60%	0.595	67%	0.672	S	S	*	*	H	α-helix	trans	-83.3	-32.6	-176.9	-58.3	169.3	0	0	0	111.8	I172 R178	I172-I176 HydrophobicContact CG2-CD1 3.41Å; I172-I176 VanDerWaalsContact CG2-CD1 3.41Å; I172-I176 HydrophobicContact CG2-CG1 4.26Å; I172-I176 VanDerWaalsContact O-CG1 3.22Å; I172-I176 WeakPolarHBondContact O-CG1 2.91Å; I172-I176 PolarHBondContact O-N 3.17Å; I176-R178 VanDerWaalsContact C-N 3.25Å; I176-R178 PolarHBondContact O-N 3.37Å
177	A	61.7	Low	59.8	Low	67 Å²	67	126 Å²	126	55%	0.554	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-8.2	-172.6	0	0	0	0	0	115.6	E173 E179	E173-A177 WeakPolarHBondContact O-CB 3.31Å; E173-A177 PolarHBondContact O-N 3.19Å; A177-E179 VanDerWaalsContact C-N 3.27Å; A177-E179 PolarHBondContact O-N 3.1Å
178	R	60.6	Low	58.5	Low	225 Å²	225	128.9 Å²	128.9	85%	0.849	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-1.2	-175.8	-94.6	-168.7	-178	117.9	-0.2	115.6	I176	I176-R178 VanDerWaalsContact C-N 3.25Å; I176-R178 PolarHBondContact O-N 3.37Å
179	E	49.2	Very low	57.2	Low	179 Å²	179	128.1 Å²	128.1	84%	0.836	70%	0.695	S	S	*	*	S	Bend	trans	-144.5	74.1	-168.3	-147.1	177.4	-162.6	0	0	112.9	A177	A177-E179 VanDerWaalsContact C-N 3.27Å; A177-E179 PolarHBondContact O-N 3.1Å
180	Y	50.7	Low	55.5	Low	197 Å²	197	128 Å²	128	77%	0.773	70%	0.701	S	S	*	*			trans	-165.1	135	146.8	57.2	-81.1	0	0	0	111.5
181	K	41.2	Very low	54.3	Low	199 Å²	199	128.1 Å²	128.1	87%	0.865	71%	0.705	S	S	*	*			trans	98.7	84.7	159.5	-147.5	149	-177.8	173.1	0	118.3
182	M	46.5	Very low	52.9	Low	172 Å²	172	135.7 Å²	135.7	85%	0.847	74%	0.736	S	S	*	*			trans	-64.8	171.8	155.1	-84	-66.8	153.5	0	0	112.6
183	P	42.3	Very low	51.9	Low	125 Å²	125	134 Å²	134	81%	0.812	73%	0.734	S	S	*	*				-107.7	170.4	-125.8	41.7	-38.6	0	0	0	115.4
184	G	42.1	Very low	50.7	Low	81 Å²	81	134 Å²	134	84%	0.835	74%	0.742	S	S	*	*			trans	153.2	133.6	162.4	0	0	0	0	0	113.1
185	G	40	Very low	49.5	Very low	82 Å²	82	137.1 Å²	137.1	85%	0.845	77%	0.765	S	S	*	*			trans	140.7	100.1	164.5	0	0	0	0	0	114.6
186	L	37.2	Very low	48.2	Very low	178 Å²	178	136.4 Å²	136.4	93%	0.932	78%	0.776	S	S	*	*			trans	-76.1	148.8	177	-55	161	0	0	0	111.4
187	A	41.6	Very low	47	Very low	100 Å²	100	135.3 Å²	135.3	83%	0.826	78%	0.784	S	S	*	*			trans	161.9	145.3	148.6	0	0	0	0	0	109.4
188	F	41.5	Very low	46.3	Very low	189 Å²	189	142.8 Å²	142.8	83%	0.829	80%	0.8	S	S	*	*			cis	-175.7	141.3	-12.4	-171	-103.6	0	0	0	105.6
189	S	41.5	Very low	46.1	Very low	87 Å²	87	137.7 Å²	137.7	61%	0.608	80%	0.796	S	S	*	*			trans	66.7	145.5	161.7	-76.3	0	0	0	0	119
190	A	41.9	Very low	46.2	Very low	79 Å²	79	136.7 Å²	136.7	65%	0.653	80%	0.796	S	S	*	*			cis	-161.4	133.6	12.1	0	0	0	0	0	111.3
191	M	52.2	Low	46	Very low	162 Å²	162	132.1 Å²	132.1	80%	0.798	79%	0.79	S	S	*	*			trans	59.8	111.7	134.4	-44.8	-56.2	134.6	0	0	121.8
192	Q	47.6	Very low	46.1	Very low	187 Å²	187	129.3 Å²	129.3	87%	0.874	79%	0.785	S	S	*	*				-163.2	143.9	116.2	-98.1	-81.5	-27.2	0	0	110.5
193	P	53.6	Low	46.1	Very low	95 Å²	95	128.6 Å²	128.6	62%	0.617	78%	0.779	S	S	*	*			trans	-94.6	143.7	-161.3	5	17.8	0	0	0	113.5
194	V	56	Low	46.1	Very low	133 Å²	133	129.5 Å²	129.5	81%	0.806	78%	0.776	S	S	*	*				72.2	147.8	75.2	-179.4	0	0	0	0	112.8
195	P	47.1	Very low	46.1	Very low	112 Å²	112	130.1 Å²	130.1	73%	0.727	76%	0.764	S	S	*	*			cis	-139.7	-178.2	-4.3	27.4	-3.6	0	0	0	117.3
196	A	46.2	Very low	46.2	Very low	99 Å²	99	131.8 Å²	131.8	82%	0.818	76%	0.758	S	S	*	*			trans	82.8	129.5	139	0	0	0	0	0	117.6
197	A	46.7	Very low	46.6	Very low	93 Å²	93	131.1 Å²	131.1	77%	0.769	75%	0.752	S	S	*	*			cis	-158.3	148.8	14.9	0	0	0	0	0	110.4
198	Y	47.5	Very low	46.5	Very low	225 Å²	225	129.6 Å²	129.6	88%	0.882	75%	0.746	S	S	*	*			trans	-100.8	154.4	156.1	-70	-82.5	0	0	0	108.1
199	P	55.2	Low	46.5	Very low	118 Å²	118	126.2 Å²	126.2	77%	0.766	75%	0.746	S	S	*	*				-144.6	146.2	85.3	26.5	-3.9	0	0	0	113.3
200	L	50.7	Low	46.6	Very low	158 Å²	158	127.1 Å²	127.1	83%	0.827	75%	0.752	S	S	*	*				58.5	154.8	80.1	-127.2	88.1	0	0	0	115.3
201	P	47.4	Very low	46.8	Very low	100 Å²	100	132 Å²	132	65%	0.649	77%	0.766	S	S	*	*				-132.5	-169.9	-77.9	41.6	-25.5	0	0	0	113.6
202	N	44.3	Very low	46.3	Very low	141 Å²	141	127.7 Å²	127.7	75%	0.754	76%	0.763	S	S	*	*			trans	92	151.8	148.1	-111.8	38.2	0	0	0	121.3
203	Q	45	Very low	46.3	Very low	157 Å²	157	125.7 Å²	125.7	73%	0.734	76%	0.764	S	S	*	*			trans	88.7	138.5	173.1	-50.8	-66.3	18.9	0	0	114.7
204	L	42.4	Very low	45.7	Very low	143 Å²	143	124.5 Å²	124.5	75%	0.749	77%	0.769	S	S	*	*			cis	177.9	159.6	-5.2	-179.6	69.4	0	0	0	105
205	T	42.8	Very low	44.8	Very low	94 Å²	94	130.2 Å²	130.2	58%	0.577	78%	0.776	S	S	*	*			trans	82.4	108.1	156.9	-15.4	0	0	0	0	116.4	M207	T205-M207 HydrophobicContact CG2-CE 3.76Å; T205-M207 HydrophobicContact CG2-SD 4.43Å
206	T	41.9	Very low	45.1	Very low	118 Å²	118	130.7 Å²	130.7	72%	0.724	78%	0.779	S	S	*	*				47.9	116.4	85.1	-46	0	0	0	0	110.3
207	M	44.7	Very low	44.8	Very low	164 Å²	164	133.8 Å²	133.8	81%	0.808	78%	0.777	S	S	*	*				-172.7	134.7	68.9	8.4	-94.2	163.4	0	0	105.6	T205	T205-M207 HydrophobicContact CG2-CE 3.76Å; T205-M207 HydrophobicContact CG2-SD 4.43Å
208	G	40.3	Very low	45.1	Very low	68 Å²	68	136.1 Å²	136.1	70%	0.701	78%	0.781	S	S	*	*				124.5	135.7	87.4	0	0	0	0	0	111.7
209	S	42.3	Very low	44.7	Very low	117 Å²	117	135.1 Å²	135.1	82%	0.818	78%	0.777	S	S	*	*			trans	69.6	110	149.6	-46.8	0	0	0	0	118
210	S	43.2	Very low	43.9	Very low	106 Å²	106	133 Å²	133	74%	0.741	78%	0.777	S	S	*	*				109.3	124.7	63.1	63.6	0	0	0	0	109.7
211	L	45.1	Very low	43.5	Very low	182 Å²	182	131.1 Å²	131.1	95%	0.953	78%	0.777	S	S	*	*			trans	153.5	106.2	160.4	-84.2	170.7	0	0	0	104.3
212	G	41.5	Very low	43.2	Very low	71 Å²	71	131 Å²	131	73%	0.732	79%	0.785	S	S	*	*			cis	108.2	80.5	26.2	0	0	0	0	0	109.2
213	T	49.2	Very low	43	Very low	146 Å²	146	127.3 Å²	127.3	90%	0.896	78%	0.779	S	S	*	*			trans	-156.2	112.4	158	-21.4	0	0	0	0	110.5
214	G	40.1	Very low	43.1	Very low	70 Å²	70	127.9 Å²	127.9	72%	0.722	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-88.9	166.8	-176.5	0	0	0	0	0	114.1
215	W	36.3	Very low	43.5	Very low	252 Å²	252	128.8 Å²	128.8	96%	0.955	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-96.3	134.5	167.8	-74.9	50.6	0	0	0	109.3
216	P	54	Low	43.4	Very low	122 Å²	122	130.7 Å²	130.7	79%	0.792	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-100.6	133.4	164	32.8	-25.4	0	0	0	111.7
217	H	41.2	Very low	43.5	Very low	164 Å²	164	129.6 Å²	129.6	76%	0.759	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-95	128.7	166.3	-155.5	76.9	0	0	0	107.1	Y219	H217-Y219 AromaticContact NE2-CD2 3.98Å; H217-Y219 AromaticContact NE2-CE2 3.83Å
218	V	51.8	Low	43.4	Very low	142 Å²	142	125.8 Å²	125.8	86%	0.861	79%	0.787	S	S	*	*			trans	-143	128	163.4	177.8	0	0	0	0	110.8
219	Y	38.6	Very low	43.7	Very low	204 Å²	204	128.9 Å²	128.9	80%	0.8	79%	0.792	S	S	*	*			trans	-90.1	157.7	175.5	-109.8	-107.2	0	0	0	111.7	H217	H217-Y219 AromaticContact NE2-CD2 3.98Å; H217-Y219 AromaticContact NE2-CE2 3.83Å
220	G	39.8	Very low	43.9	Very low	74 Å²	74	128.6 Å²	128.6	76%	0.763	79%	0.787	S	S	*	*			trans	85.4	155.6	153.6	0	0	0	0	0	116
221	S	42	Very low	44	Very low	118 Å²	118	130.8 Å²	130.8	83%	0.825	79%	0.789	S	S	*	*			cis	-173.8	151.9	-4	-174.2	0	0	0	0	107
222	A	40.2	Very low	43.7	Very low	99 Å²	99	127.3 Å²	127.3	82%	0.818	78%	0.78	S	S	*	*			trans	61.8	126.9	151.3	0	0	0	0	0	121.7
223	G	40.8	Very low	43.8	Very low	62 Å²	62	133.2 Å²	133.2	64%	0.639	79%	0.791	S	S	*	*				144.4	96.9	129.8	0	0	0	0	0	120.1
224	M	47.6	Very low	43.4	Very low	169 Å²	169	130.7 Å²	130.7	83%	0.833	79%	0.785	S	S	*	*				76.5	118.4	126.7	-24.6	-160.8	-163.7	0	0	121.9
225	I	49.6	Very low	43.5	Very low	162 Å²	162	133.1 Å²	133.1	83%	0.831	79%	0.791	S	S	*	*			trans	63.3	147.1	136.4	73.3	156.5	0	0	0	119.1
226	D	41.1	Very low	44	Very low	135 Å²	135	124.5 Å²	124.5	72%	0.722	78%	0.781	S	S	*	*			cis	-162.5	161.1	9.1	-155.6	-11	0	0	0	109.2
227	S	43.4	Very low	43.4	Very low	95 Å²	95	125.8 Å²	125.8	66%	0.664	78%	0.781	S	S	*	*			trans	27	143.4	144.4	57.4	0	0	0	0	121.9
228	A	42.8	Very low	43.3	Very low	84 Å²	84	128.2 Å²	128.2	69%	0.694	79%	0.785	S	S	*	*			cis	-169.6	143	12.3	0	0	0	0	0	110.9
229	T	47.5	Very low	42.7	Very low	132 Å²	132	126.2 Å²	126.2	81%	0.81	78%	0.777	S	S	*	*			trans	13.6	170.5	139	68.3	0	0	0	0	123.3
230	P	47.1	Very low	43	Very low	111 Å²	111	120.1 Å²	120.1	72%	0.721	77%	0.769	S	S	*	*				-136.3	-158.3	-86	37.7	-13	0	0	0	112.4
231	I	45.4	Very low	43.2	Very low	153 Å²	153	127.7 Å²	127.7	79%	0.785	78%	0.776	S	S	*	*			trans	123	106.2	163.7	-67.3	162.7	0	0	0	111.8
232	S	37.3	Very low	43.4	Very low	109 Å²	109	125.6 Å²	125.6	76%	0.762	77%	0.773	S	S	*	*				73.7	103.7	75.9	-97.4	0	0	0	0	116
233	M	43.6	Very low	43.9	Very low	194 Å²	194	127.5 Å²	127.5	96%	0.956	77%	0.774	S	S	*	*			trans	174.2	143.3	149.2	41.2	-154.3	-159.4	0	0	108
234	A	41.2	Very low	44.7	Very low	93 Å²	93	129.6 Å²	129.6	77%	0.769	78%	0.777	S	S	*	*			cis	-160.2	168.3	4.8	0	0	0	0	0	109.4
235	S	42.2	Very low	44.7	Very low	121 Å²	121	129.7 Å²	129.7	85%	0.846	78%	0.779	S	S	*	*			trans	-14.8	153.3	165.5	-58.8	0	0	0	0	120.8
236	G	46.1	Very low	44.6	Very low	72 Å²	72	131.1 Å²	131.1	74%	0.742	78%	0.78	S	S	*	*			trans	163.2	73	156.4	0	0	0	0	0	115
237	D	43	Very low	44.8	Very low	148 Å²	148	130.4 Å²	130.4	79%	0.791	78%	0.782	S	S	*	*			trans	-3.4	143	156.1	-58.5	-66.4	0	0	0	122.4
238	Y	38.9	Very low	44.5	Very low	215 Å²	215	133.1 Å²	133.1	84%	0.843	79%	0.788	S	S	*	*			trans	70.3	99.3	138.9	-109.8	-105.6	0	0	0	121.9
239	S	38.6	Very low	44.4	Very low	100 Å²	100	134.9 Å²	134.9	70%	0.699	79%	0.794	S	S	*	*				79	149.5	115.1	-141.9	0	0	0	0	122.2
240	A	45.6	Very low	44.1	Very low	76 Å²	76	136.9 Å²	136.9	63%	0.628	79%	0.794	S	S	*	*			trans	89.2	95.4	151.8	0	0	0	0	0	119.5
241	Y	43.6	Very low	43.9	Very low	234 Å²	234	136.5 Å²	136.5	92%	0.918	80%	0.8	S	S	*	*			trans	42.8	109.1	141.4	-51.1	-79	0	0	0	119.5
242	G	45	Very low	43.8	Very low	74 Å²	74	134.6 Å²	134.6	76%	0.763	81%	0.807	S	S	*	*			trans	-169.2	102.5	161.8	0	0	0	0	0	111.7	P244	G242-P244 WeakPolarHBondContact O-CD 3.47Å
243	V	51.6	Low	44.1	Very low	139 Å²	139	132.6 Å²	132.6	84%	0.842	80%	0.804	S	S	*	*			trans	-86.3	120.8	169.1	-170.6	0	0	0	0	107.6
244	P	57	Low	44.2	Very low	106 Å²	106	132 Å²	132	69%	0.688	80%	0.799	S	S	*	*			trans	-88.2	110	167.5	-0.2	19.7	0	0	0	109.1	G242 K246	G242-P244 WeakPolarHBondContact O-CD 3.47Å; P244-K246 PolarHBondContact O-N 3.47Å
245	L	48.6	Very low	44.5	Very low	170 Å²	170	133.4 Å²	133.4	89%	0.89	80%	0.798	S	S	*	*			trans	-55.7	125.8	155.1	-75.2	158.5	0	0	0	108.1
246	K	47	Very low	44.9	Very low	193 Å²	193	135.6 Å²	135.6	84%	0.839	80%	0.8	S	S	*	*			trans	-108.1	140.2	167.9	-80.8	179	177.3	177.4	0	110.5	P244	P244-K246 PolarHBondContact O-N 3.47Å
247	P	44.7	Very low	45.2	Very low	119 Å²	119	137.8 Å²	137.8	77%	0.773	80%	0.801	S	S	*	*			trans	-90.7	157.9	-161.2	0.4	21.9	0	0	0	112.4	C249	P247-C249 PolarHBondContact O-N 3.23Å
248	L	37.6	Very low	45.7	Very low	152 Å²	152	135.5 Å²	135.5	80%	0.796	80%	0.802	S	S	*	*			trans	-49.8	122.8	165.3	-174.6	70.7	0	0	0	112
249	C	41	Very low	46.7	Very low	121 Å²	121	132.5 Å²	132.5	82%	0.818	80%	0.799	S	S	*	*			trans	-136.6	119.4	151.6	58.5	0	0	0	0	109.3	P247	P247-C249 PolarHBondContact O-N 3.23Å
250	H	42	Very low	48.1	Very low	175 Å²	175	133.3 Å²	133.3	81%	0.81	80%	0.802	S	S	*	*			trans	-96.6	130.3	167.6	-78	5.4	0	0	0	107.6
251	A	42	Very low	49.2	Very low	103 Å²	103	135.7 Å²	135.7	85%	0.851	81%	0.809	S	S	*	*			trans	-121.2	129.5	164.7	0	0	0	0	0	108.3
252	A	42.9	Very low	50.1	Low	112 Å²	112	130.7 Å²	130.7	93%	0.926	80%	0.804	S	S	*	*			trans	-73.7	150.5	-171.1	0	0	0	0	0	113.3
253	G	43.2	Very low	51	Low	68 Å²	68	135 Å²	135	70%	0.701	81%	0.808	S	S	*	*			trans	170.9	87.6	167.9	0	0	0	0	0	114.8
254	Q	46.8	Very low	51.5	Low	182 Å²	182	136.8 Å²	136.8	85%	0.85	81%	0.805	S	S	*	*			trans	58.8	92.3	142.1	-55.1	-169.7	57.1	0	0	118
255	T	46.9	Very low	51.9	Low	121 Å²	121	137.2 Å²	137.2	74%	0.742	81%	0.808	S	S	*	*				61.8	104.5	94.9	62.7	0	0	0	0	115.6
256	L	51.1	Low	52.7	Low	168 Å²	168	135.4 Å²	135.4	88%	0.88	80%	0.804	S	S	*	*				-160.3	135.6	123.5	-78.4	-165.7	0	0	0	108.9
257	P	51.6	Low	53.4	Low	118 Å²	118	131.6 Å²	131.6	77%	0.766	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-87.5	122.9	175.9	33.1	-27.3	0	0	0	109.9	I259	P257-I259 PolarHBondContact O-N 3.42Å
258	A	53.9	Low	54	Low	99 Å²	99	130.7 Å²	130.7	82%	0.818	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-77.3	118.5	173	0	0	0	0	0	110.2
259	I	59.7	Low	54.7	Low	152 Å²	152	128 Å²	128	78%	0.779	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-63.8	126.2	179	-61.7	165.7	0	0	0	110.2	P257 V261	P257-I259 PolarHBondContact O-N 3.42Å; I259-V261 PolarHBondContact O-N 3.16Å
260	P	67.5	Low	56	Low	118 Å²	118	128.6 Å²	128.6	77%	0.766	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-73.1	120.1	166	-14.6	30	0	0	0	110.2
261	V	69.6	Low	57.1	Low	126 Å²	126	126.2 Å²	126.2	76%	0.764	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-67.7	133.6	171.6	-94.9	0	0	0	0	111	I259 I263	I259-V261 PolarHBondContact O-N 3.16Å; V261-I263 PolarHBondContact O-N 3.42Å
262	P	61.7	Low	57.3	Low	128 Å²	128	126.2 Å²	126.2	83%	0.831	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-74.2	121.7	175	-10.9	26	0	0	0	111
263	I	64.5	Low	58	Low	164 Å²	164	128.9 Å²	128.9	84%	0.841	80%	0.798	S	S	*	*			trans	-91.8	115.8	166.6	-54.6	176.3	0	0	0	107.6	V261	V261-I263 PolarHBondContact O-N 3.42Å
264	K	61.6	Low	58.6	Low	178 Å²	178	131.3 Å²	131.3	77%	0.774	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-62.7	133.2	-179.1	-176.5	166.1	-179.5	167	0	111.8
265	P	66	Low	58.7	Low	115 Å²	115	126.8 Å²	126.8	75%	0.747	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-75	123.6	163.9	-6.9	23.4	0	0	0	109.4
266	T	65.4	Low	59.2	Low	132 Å²	132	129 Å²	129	81%	0.81	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-77.4	124.7	170.4	-46.9	0	0	0	0	109.4
267	P	61.4	Low	59.7	Low	112 Å²	112	125.9 Å²	125.9	73%	0.727	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-86.1	120	169.2	31.6	-26.9	0	0	0	109.5	A269	P267-A269 PolarHBondContact O-N 3.48Å
268	A	58.1	Low	60.4	Low	100 Å²	100	124.5 Å²	124.5	83%	0.826	79%	0.791	S	S	*	*			trans	-83.4	102.6	164.6	0	0	0	0	0	108.2
269	A	52.3	Low	60.7	Low	97 Å²	97	125.2 Å²	125.2	80%	0.802	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-81.8	118.7	167.4	0	0	0	0	0	108.8	P267	P267-A269 PolarHBondContact O-N 3.48Å
270	V	68.5	Low	60.6	Low	133 Å²	133	126.1 Å²	126.1	81%	0.806	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-93.7	129.1	165.5	-83.3	0	0	0	0	108.6
271	P	64.3	Low	60	Low	125 Å²	125	125.2 Å²	125.2	81%	0.812	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-80.4	126.3	170.9	8.9	6	0	0	0	110
272	A	47.2	Very low	58.9	Low	102 Å²	102	125 Å²	125	84%	0.843	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-73.7	136.7	164	0	0	0	0	0	109.7
273	L	57.9	Low	58.4	Low	168 Å²	168	126.4 Å²	126.4	88%	0.88	78%	0.784	S	S	*	*			trans	-116.4	151.8	166.1	-84.1	173.8	0	0	0	110.2
274	P	55.2	Low	57.6	Low	119 Å²	119	125.8 Å²	125.8	77%	0.773	78%	0.782	S	S	*	*			trans	-94.9	164.2	-152	36.9	-34.8	0	0	0	114.8
275	A	48.3	Very low	57.1	Low	88 Å²	88	121.4 Å²	121.4	73%	0.727	77%	0.774	S	S	*	*			trans	-44.3	157	170	0	0	0	0	0	116.6
276	L	57.4	Low	56.1	Low	166 Å²	166	123 Å²	123	87%	0.869	78%	0.776	S	S	*	*				176.8	159.3	126.7	-93.2	163.9	0	0	0	110.3
277	P	60.8	Low	55.7	Low	104 Å²	104	121.3 Å²	121.3	68%	0.675	77%	0.77	S	S	*	*				-134.4	165.2	-118.5	42.5	-24.9	0	0	0	116.2
278	A	66.2	Low	55.4	Low	89 Å²	89	121.5 Å²	121.5	74%	0.736	77%	0.771	S	S	*	*			trans	65.4	178.4	135.7	0	0	0	0	0	119.7
279	P	60.9	Low	55.3	Low	113 Å²	113	122.5 Å²	122.5	73%	0.734	77%	0.769	S	S	*	*				-140	161.4	-60.4	37.7	-23.8	0	0	0	112.6
280	I	57.8	Low	55.1	Low	171 Å²	171	122.9 Å²	122.9	88%	0.877	77%	0.766	S	S	*	*			trans	-152.3	136.2	143	-49.5	-178.2	0	0	0	110
281	P	55.6	Low	54.6	Low	100 Å²	100	124.9 Å²	124.9	65%	0.649	77%	0.771	S	S	*	*			trans	-114.9	166.1	-169.5	41.1	-29.7	0	0	0	116.5
282	T	46.3	Very low	54.4	Low	121 Å²	121	124 Å²	124	74%	0.742	77%	0.768	S	S	*	*			trans	74.7	145.2	138.6	47.6	0	0	0	0	123.8
283	L	50.2	Low	54.9	Low	157 Å²	157	124.8 Å²	124.8	82%	0.822	76%	0.764	S	S	*	*			trans	96.1	139.3	161.2	-57.4	171	0	0	0	115.4
284	L	48.4	Very low	54.7	Low	151 Å²	151	123.2 Å²	123.2	79%	0.791	76%	0.762	S	S	*	*			cis	-175.4	152.2	-15.9	-176.6	72.8	0	0	0	105.2
285	S	50.6	Low	54.3	Low	87 Å²	87	122.9 Å²	122.9	61%	0.608	76%	0.762	S	S	*	*			trans	85.6	123.3	144.6	-129	0	0	0	0	121.7
286	N	44.9	Very low	54.5	Low	147 Å²	147	124.3 Å²	124.3	79%	0.786	77%	0.767	S	S	*	*			trans	63.8	150.9	140.5	-78.5	11.4	0	0	0	119.6
287	S	58	Low	54	Low	98 Å²	98	125.6 Å²	125.6	69%	0.685	77%	0.769	S	S	*	*			cis	177.9	165.3	-18.6	-91	0	0	0	0	104.8
288	P	54.8	Low	53.8	Low	116 Å²	116	127 Å²	127	75%	0.753	78%	0.776	S	S	*	*			trans	-105.5	-152	-148.5	38.7	-26.8	0	0	0	113.5
289	P	56.6	Low	52.9	Low	120 Å²	120	127.1 Å²	127.1	78%	0.779	78%	0.776	S	S	*	*				-122.1	-165	-67	33.7	-14.2	0	0	0	112.3
290	S	46.9	Very low	52.8	Low	105 Å²	105	128.3 Å²	128.3	73%	0.734	78%	0.782	S	S	*	*			trans	95	109.2	160.6	-167.4	0	0	0	0	117.2
291	L	57.5	Low	52.5	Low	175 Å²	175	124.6 Å²	124.6	92%	0.916	77%	0.771	S	S	*	*			trans	-156	149	140.5	-78	-171.1	0	0	0	110.1
292	S	60.8	Low	52.2	Low	107 Å²	107	128.8 Å²	128.8	75%	0.748	78%	0.782	S	S	*	*			trans	-107.4	-146.5	-155.9	45.5	0	0	0	0	112.8
293	P	58.3	Low	52.6	Low	118 Å²	118	128.5 Å²	128.5	77%	0.766	79%	0.785	S	S	*	*				-117	178.2	-115.3	35	-14.3	0	0	0	113.8
294	T	52.3	Low	53	Low	136 Å²	136	126.4 Å²	126.4	83%	0.834	78%	0.784	S	S	*	*			trans	-160.1	143.1	148.7	-149.5	0	0	0	0	113.3
295	S	47	Very low	53.3	Low	111 Å²	111	125.4 Å²	125.4	78%	0.776	79%	0.786	S	S	*	*			trans	-102.7	148.4	-178.2	-57.7	0	0	0	0	110.6
296	S	53.2	Low	53.3	Low	119 Å²	119	125.5 Å²	125.5	83%	0.832	79%	0.792	S	S	*	*			trans	-147.7	123	157.8	12.1	0	0	0	0	111.5
297	Q	46.8	Very low	54	Low	192 Å²	192	125.4 Å²	125.4	90%	0.897	80%	0.797	S	S	*	*			trans	-79.6	144.7	172.5	-62	168	61.9	0	0	109.4
298	T	56.7	Low	53.9	Low	135 Å²	135	126.4 Å²	126.4	83%	0.828	80%	0.801	S	S	*	*			trans	-142.3	112	152.4	-45.3	0	0	0	0	109
299	A	47.6	Very low	53.6	Low	90 Å²	90	126.4 Å²	126.4	74%	0.744	80%	0.804	S	S	*	*			trans	-91.7	139.1	166.1	0	0	0	0	0	108.8
300	T	58.8	Low	53.5	Low	139 Å²	139	130.1 Å²	130.1	85%	0.853	81%	0.811	S	S	*	*			trans	-139.1	126.1	163.2	-1.7	0	0	0	0	108.9
301	S	50.7	Low	53.7	Low	92 Å²	92	130.4 Å²	130.4	64%	0.643	81%	0.808	S	S	*	*			trans	-104	163	-173.9	-45.2	0	0	0	0	111
302	Q	50.2	Low	53.6	Low	189 Å²	189	129.8 Å²	129.8	88%	0.883	81%	0.805	S	S	*	*			trans	73.7	140.5	156.6	-59	168.4	47.5	0	0	114.8
303	S	54	Low	53.1	Low	115 Å²	115	130.7 Å²	130.7	80%	0.804	81%	0.806	S	S	*	*			cis	-166.9	154.4	25.2	44.7	0	0	0	0	110.8
304	S	58.4	Low	52.5	Low	113 Å²	113	130.1 Å²	130.1	79%	0.79	81%	0.805	S	S	*	*			trans	-61.3	-165	172.8	-39.3	0	0	0	0	114.8
305	P	55.6	Low	52.6	Low	129 Å²	129	129.4 Å²	129.4	84%	0.838	80%	0.803	S	S	*	*			cis	-142.6	-169.3	-3.7	33.7	-8	0	0	0	116.5
306	A	50.6	Low	52.7	Low	90 Å²	90	128.6 Å²	128.6	74%	0.744	80%	0.803	S	S	*	*			trans	-64.1	168.6	-174	0	0	0	0	0	119.8
307	T	59.3	Low	52.7	Low	144 Å²	144	128.6 Å²	128.6	88%	0.883	80%	0.802	S	S	*	*			trans	-175.4	162.8	143.9	17.2	0	0	0	0	111.7
308	P	56	Low	52.9	Low	120 Å²	120	123.6 Å²	123.6	78%	0.779	79%	0.794	S	S	*	*				-126.5	-178	-119.9	39.8	-21.4	0	0	0	116.3
309	S	49.1	Very low	52.7	Low	115 Å²	115	124.7 Å²	124.7	80%	0.804	79%	0.794	S	S	*	*			trans	-55.7	143.5	173	-44.7	0	0	0	0	115.4
310	E	54.6	Low	53.4	Low	198 Å²	198	129.3 Å²	129.3	93%	0.925	80%	0.8	S	S	*	*			trans	-122.6	140.3	153.3	-81.9	-154	119.2	0	0	111.7
311	T	49.4	Very low	53.4	Low	111 Å²	111	128.1 Å²	128.1	68%	0.681	80%	0.797	S	S	*	*			trans	-94.9	149.7	-176.1	-64.1	0	0	0	0	109.1
312	L	55.5	Low	54.1	Low	163 Å²	163	130.3 Å²	130.3	85%	0.853	81%	0.806	S	S	*	*			trans	169	98.3	134.4	-89.8	151.5	0	0	0	113.3
313	T	51.7	Low	54.6	Low	126 Å²	126	125.4 Å²	125.4	77%	0.773	80%	0.798	S	S	*	*				31.2	122.6	120.5	-48.9	0	0	0	0	121.7
314	S	45.4	Very low	55.1	Low	105 Å²	105	126.1 Å²	126.1	73%	0.734	80%	0.798	S	S	*	*			trans	-54.1	172.6	160.6	-135.5	0	0	0	0	113.8
315	P	55.1	Low	55.2	Low	122 Å²	122	133 Å²	133	79%	0.792	82%	0.817	S	S	*	*			cis	-151.8	-172.6	38.4	38.9	-13.1	0	0	0	118.5
316	A	47.4	Very low	55.2	Low	94 Å²	94	133.2 Å²	133.2	78%	0.777	82%	0.816	S	S	*	*			trans	-29	143.6	175.8	0	0	0	0	0	122
317	S	53.5	Low	55.4	Low	118 Å²	118	135.5 Å²	135.5	83%	0.825	82%	0.819	S	S	*	*			trans	-169.6	111.1	144.7	-78.8	0	0	0	0	107.7
318	A	51.8	Low	55.2	Low	87 Å²	87	135 Å²	135	72%	0.719	82%	0.816	S	S	*	*				73.3	125.3	83.7	0	0	0	0	0	114.5
319	L	53	Low	55.2	Low	158 Å²	158	135.9 Å²	135.9	83%	0.827	82%	0.818	S	S	*	*			trans	82.4	116.6	161	-47.8	178.7	0	0	0	117.7
320	H	61.6	Low	55.6	Low	188 Å²	188	137.2 Å²	137.2	87%	0.87	82%	0.819	S	S	*	*				-165.6	110.6	114	-92.7	96.3	0	0	0	109.5
321	S	58.5	Low	55.6	Low	113 Å²	113	133.1 Å²	133.1	79%	0.79	81%	0.812	S	S	*	*			trans	-89.3	132	163.9	-178.3	0	0	0	0	107.7
322	V	66.5	Low	56.1	Low	138 Å²	138	134.7 Å²	134.7	84%	0.836	82%	0.821	S	S	*	*			trans	-140.5	114.9	163	172.5	0	0	0	0	107.9
323	A	59	Low	56.1	Low	87 Å²	87	132.5 Å²	132.5	72%	0.719	82%	0.819	S	S	*	*			trans	-133.6	114.6	162.9	0	0	0	0	0	106.9
324	V	66	Low	56.5	Low	130 Å²	130	133.1 Å²	133.1	79%	0.788	82%	0.822	S	S	*	*			trans	-161.6	93.8	156.5	-172.8	0	0	0	0	109.9
325	H	60	Low	57.5	Low	257 Å²	257	135.6 Å²	135.6	100%	1.19	83%	0.83	S	S	*	*				-178.6	0	127.6	-113	79.4	0	0	0	109.9

Retrieved 325 of 325 residues in 130.9 ms (Link to these results)

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