A0A077Z7P0_TRITR Loading...

rRNA-processing protein CGR1

AlphaFold DB , UniProt , Accession A0A077Z7P0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 246 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	48.9	Very low	58.3	Low	242 Å²	242	121.5 Å²	121.5	100%	1.192	68%	0.684	S	S	*	*				0	95.7	0	-70	-68.1	166.5	0	0	107.5	S3	M1-S3 PolarHBondContact O-N 3.4Å
2	S	54.4	Low	59.1	Low	126 Å²	126	120.1 Å²	120.1	88%	0.881	67%	0.674	S	S	*	*			trans	-76.5	110.5	-179.4	-63.7	0	0	0	0	109	S4	S2-S4 PolarHBondContact O-N 3.37Å
3	S	51.3	Low	60	Low	107 Å²	107	114.7 Å²	114.7	75%	0.748	65%	0.654	S	S	*	*			trans	-67.7	97.3	171.2	172	0	0	0	0	108.9	M1 T5	M1-S3 PolarHBondContact O-N 3.4Å; S3-T5 PolarHBondContact O-N 3Å
4	S	56.6	Low	61.1	Low	108 Å²	108	113 Å²	113	76%	0.755	64%	0.637	S	S	*	*			trans	-73.5	103.7	163.6	45.9	0	0	0	0	107.7	S2	S2-S4 PolarHBondContact O-N 3.37Å
5	T	55.1	Low	62.3	Low	82 Å²	82	110.3 Å²	110.3	50%	0.503	62%	0.624	S	S	.	*			trans	-65.2	133.9	176.1	32	0	0	0	0	110.2	S3 E7 A8	S3-T5 PolarHBondContact O-N 3Å; T5-E7 PolarHBondContact O-N 3.41Å; T5-A8 PolarHBondContact O-N 3.27Å
6	P	61.5	Low	63.5	Low	96 Å²	96	107.3 Å²	107.3	62%	0.623	61%	0.613	S	S	*	*	H	α-helix	trans	-63	-13	-179.1	25	-34.3	0	0	0	113.7	S9	P6-S9 PolarHBondContact O-OG 2.86Å; P6-S9 VanDerWaalsContact O-OG 3.1Å
7	E	60	Low	64.9	Low	135 Å²	135	109.1 Å²	109.1	63%	0.631	61%	0.614	S	S	*	*	H	α-helix	trans	-73.2	-27.6	174	-67.6	-165.8	155.9	0	0	113.7	T5 K11	T5-E7 PolarHBondContact O-N 3.41Å; E7-K11 PolarHBondContact O-N 2.89Å
8	A	59	Low	66.1	Low	48 Å²	48	108.1 Å²	108.1	40%	0.397	60%	0.599	S	S	.	*	H	α-helix	trans	-69	-44.8	178.7	0	0	0	0	0	110.7	T5 R10 K11 D12	T5-A8 PolarHBondContact O-N 3.27Å; A8-R10 VanDerWaalsContact C-N 3.35Å; A8-R10 PolarHBondContact O-N 3.15Å; A8-K11 PolarHBondContact O-N 2.76Å; A8-D12 VanDerWaalsContact O-CG 3.27Å; A8-D12 PolarHBondContact O-N 3.14Å; A8-D12 VanDerWaalsContact O-N 3.08Å
9	S	61.8	Low	67.3	Low	73 Å²	73	106.4 Å²	106.4	51%	0.51	59%	0.589	S	S	.	*	H	α-helix	trans	-66	-33.8	-179.4	61.5	0	0	0	0	113.4	P6 D12 A13	P6-S9 PolarHBondContact O-OG 2.86Å; P6-S9 VanDerWaalsContact O-OG 3.1Å; S9-D12 PolarHBondContact O-N 2.89Å; S9-A13 WeakPolarHBondContact O-CB 3.24Å; S9-A13 PolarHBondContact O-N 3.11Å
10	R	65.2	Low	68.5	Low	187 Å²	187	104.7 Å²	104.7	71%	0.706	58%	0.579	S	S	*	*	H	α-helix	trans	-65.6	-42.7	175.5	-73.5	-175.8	179.5	-175.6	-0.1	112.2	A8 A13 E14	A8-R10 VanDerWaalsContact C-N 3.35Å; A8-R10 PolarHBondContact O-N 3.15Å; R10-A13 PolarHBondContact O-N 3.41Å; R10-E14 WeakPolarHBondContact O-CG 3.39Å; R10-E14 PolarHBondContact O-N 3.21Å
11	K	67.8	Low	69.6	Low	132 Å²	132	101.6 Å²	101.6	57%	0.574	57%	0.567	S	S	*	*	H	α-helix	trans	-66.3	-40.5	178	-73	177.2	-178.5	167.9	0	111.4	E7 A8 E14 T15	E7-K11 PolarHBondContact O-N 2.89Å; A8-K11 PolarHBondContact O-N 2.76Å; K11-E14 PolarHBondContact O-N 3.23Å; K11-T15 VanDerWaalsContact O-CG2 3.31Å; K11-T15 WeakPolarHBondContact O-CG2 2.97Å; K11-T15 PolarHBondContact O-N 3.48Å; K11-T15 PolarHBondContact O-OG1 3.49Å
12	D	67.7	Low	71.7	Confident	105 Å²	105	91 Å²	91	56%	0.561	51%	0.513	S	S	*	.	H	α-helix	trans	-62.9	-43.9	177	-64.7	-24.1	0	0	0	111.1	A8 S9 T15 S16	A8-D12 VanDerWaalsContact O-CG 3.27Å; A8-D12 PolarHBondContact O-N 3.14Å; A8-D12 VanDerWaalsContact O-N 3.08Å; S9-D12 PolarHBondContact O-N 2.89Å; D12-T15 PolarHBondContact O-N 3.42Å; D12-T15 PolarHBondContact O-OG1 2.73Å; D12-S16 PolarHBondContact O-N 2.96Å
13	A	71.3	Confident	73.5	Confident	50 Å²	50	88.5 Å²	88.5	41%	0.413	49%	0.49	S	S	.	.	H	α-helix	trans	-60.7	-48.3	175.6	0	0	0	0	0	112.6	S9 R10 T15 S16 E17	S9-A13 WeakPolarHBondContact O-CB 3.24Å; S9-A13 PolarHBondContact O-N 3.11Å; R10-A13 PolarHBondContact O-N 3.41Å; A13-T15 VanDerWaalsContact C-N 3.27Å; A13-T15 PolarHBondContact O-N 3.35Å; A13-S16 WeakPolarHBondContact O-CB 3.45Å; A13-S16 PolarHBondContact O-N 3.39Å; A13-S16 VanDerWaalsContact O-N 3.11Å; A13-E17 PolarHBondContact O-N 2.85Å
14	E	75.7	Confident	75.6	Confident	91 Å²	91	92.5 Å²	92.5	43%	0.425	49%	0.489	S	S	.	.	H	α-helix	trans	-59.6	-37.5	176.7	-76.1	-177.2	-153.9	0	0	112.4	R10 K11 R18	R10-E14 WeakPolarHBondContact O-CG 3.39Å; R10-E14 PolarHBondContact O-N 3.21Å; K11-E14 PolarHBondContact O-N 3.23Å; E14-R18 WeakPolarHBondContact O-CB 3.43Å; E14-R18 WeakPolarHBondContact O-CG 3.43Å; E14-R18 PolarHBondContact O-N 3.01Å; E14-R18 IonicContact OE2-CZ 3.71Å; E14-R18 IonicContact OE2-NH2 2.86Å; E14-R18 PolarHBondContact OE2-NH2 3.31Å
15	T	78.2	Confident	77.4	Confident	72 Å²	72	89.5 Å²	89.5	44%	0.442	46%	0.461	S	S	.	.	H	α-helix	trans	-69.7	-35.5	176.9	59.3	0	0	0	0	112.3	K11 D12 A13 L19	K11-T15 VanDerWaalsContact O-CG2 3.31Å; K11-T15 WeakPolarHBondContact O-CG2 2.97Å; K11-T15 PolarHBondContact O-N 3.48Å; K11-T15 PolarHBondContact O-OG1 3.49Å; D12-T15 PolarHBondContact O-N 3.42Å; D12-T15 PolarHBondContact O-OG1 2.73Å; A13-T15 VanDerWaalsContact C-N 3.27Å; A13-T15 PolarHBondContact O-N 3.35Å; T15-L19 WeakPolarHBondContact O-CB 3.45Å; T15-L19 PolarHBondContact O-N 3.34Å
16	S	82	Confident	79.2	Confident	63 Å²	63	87.9 Å²	87.9	44%	0.441	45%	0.448	S	S	.	.	H	α-helix	trans	-63.9	-49.1	175.4	-166.1	0	0	0	0	111.3	D12 A13 R18 L19 D20	D12-S16 PolarHBondContact O-N 2.96Å; A13-S16 WeakPolarHBondContact O-CB 3.45Å; A13-S16 PolarHBondContact O-N 3.39Å; A13-S16 VanDerWaalsContact O-N 3.11Å; S16-R18 VanDerWaalsContact C-N 3.32Å; S16-R18 PolarHBondContact O-N 3.3Å; S16-L19 WeakPolarHBondContact O-CB 3.48Å; S16-L19 PolarHBondContact O-N 3.06Å; S16-L19 VanDerWaalsContact O-N 3.12Å; S16-D20 PolarHBondContact O-N 3.43Å
17	E	86.6	Confident	80.8	Confident	137 Å²	137	87 Å²	87	64%	0.64	44%	0.444	S	S	*	.	H	α-helix	trans	-61	-40.4	179.1	-69.4	-179	-179.2	0	0	112.4	A13 L19 D20 A21	A13-E17 PolarHBondContact O-N 2.85Å; E17-L19 VanDerWaalsContact C-N 3.34Å; E17-L19 PolarHBondContact O-N 3.33Å; E17-D20 PolarHBondContact O-N 3.16Å; E17-A21 PolarHBondContact O-N 2.77Å
18	R	86.9	Confident	82.4	Confident	91 Å²	91	82.9 Å²	82.9	34%	0.343	43%	0.433	S	S	.	.	H	α-helix	trans	-64.2	-38.9	175.9	-73.4	176.2	-169.7	154.1	13.8	112	E14 S16 W22 L52 L56	E14-R18 WeakPolarHBondContact O-CB 3.43Å; E14-R18 WeakPolarHBondContact O-CG 3.43Å; E14-R18 PolarHBondContact O-N 3.01Å; E14-R18 IonicContact OE2-CZ 3.71Å; E14-R18 IonicContact OE2-NH2 2.86Å; E14-R18 PolarHBondContact OE2-NH2 3.31Å; S16-R18 VanDerWaalsContact C-N 3.32Å; S16-R18 PolarHBondContact O-N 3.3Å; R18-W22 WeakPolarHBondContact O-CB 3.28Å; R18-W22 PolarHBondContact O-N 2.77Å; R18-W22 VanDerWaalsContact O-N 3.1Å; R18-L52 HydrophobicContact CB-CD2 3.71Å; R18-L52 HydrophobicContact CG-CD2 3.69Å; R18-L56 HydrophobicContact CB-CD2 4.47Å
19	L	89	Confident	84.2	Confident	77 Å²	77	81.5 Å²	81.5	40%	0.403	42%	0.418	S	S	.	.	H	α-helix	trans	-68.9	-39.1	177	-172	64.5	0	0	0	111.4	T15 S16 E17 W22 N23 L56	T15-L19 WeakPolarHBondContact O-CB 3.45Å; T15-L19 PolarHBondContact O-N 3.34Å; S16-L19 WeakPolarHBondContact O-CB 3.48Å; S16-L19 PolarHBondContact O-N 3.06Å; S16-L19 VanDerWaalsContact O-N 3.12Å; E17-L19 VanDerWaalsContact C-N 3.34Å; E17-L19 PolarHBondContact O-N 3.33Å; L19-W22 WeakPolarHBondContact O-CB 3.31Å; L19-W22 PolarHBondContact O-N 3.39Å; L19-N23 WeakPolarHBondContact O-CB 3.34Å; L19-N23 PolarHBondContact O-N 2.79Å; L19-N23 PolarHBondContact O-ND2 2.8Å; L19-L56 HydrophobicContact CD1-CD1 4.25Å
20	D	91.5	Very high	85.8	Confident	72 Å²	72	83.7 Å²	83.7	39%	0.385	42%	0.418	S	S	.	.	H	α-helix	trans	-64.1	-44.1	175.9	-72.3	-22.9	0	0	0	111.8	S16 E17 W22 N23 R24	S16-D20 PolarHBondContact O-N 3.43Å; E17-D20 PolarHBondContact O-N 3.16Å; D20-W22 VanDerWaalsContact C-N 3.32Å; D20-W22 PolarHBondContact O-N 2.97Å; D20-N23 PolarHBondContact O-N 2.97Å; D20-R24 VanDerWaalsContact O-CG 3.3Å; D20-R24 WeakPolarHBondContact O-CG 3.45Å; D20-R24 PolarHBondContact O-N 3.31Å
21	A	91.2	Very high	87.3	Confident	39 Å²	39	78.8 Å²	78.8	32%	0.322	41%	0.413	S	S	.	.	H	α-helix	trans	-60.3	-41.9	174.6	0	0	0	0	0	112	E17 W25 L52	E17-A21 PolarHBondContact O-N 2.77Å; A21-W25 PolarHBondContact O-N 3.06Å; A21-L52 HydrophobicContact CB-CD1 3.92Å
22	W	92.5	Very high	88.6	Confident	20 Å²	20	78.3 Å²	78.3	8%	0.076	42%	0.415	C	S	.	.	H	α-helix	trans	-61.3	-46.4	174.1	172.4	-99.5	0	0	0	112.1	R18 L19 D20 R24 W25 H26 I42 I49 H53 L56 F57	R18-W22 WeakPolarHBondContact O-CB 3.28Å; R18-W22 PolarHBondContact O-N 2.77Å; R18-W22 VanDerWaalsContact O-N 3.1Å; L19-W22 WeakPolarHBondContact O-CB 3.31Å; L19-W22 PolarHBondContact O-N 3.39Å; D20-W22 VanDerWaalsContact C-N 3.32Å; D20-W22 PolarHBondContact O-N 2.97Å; W22-R24 PolarHBondContact O-N 2.81Å; W22-W25 HydrophobicContact CH2-CE3 4.45Å; W22-W25 HydrophobicContact CH2-CZ3 4.16Å; W22-W25 HydrophobicContact CZ3-CE3 4.27Å; W22-W25 HydrophobicContact CZ3-CZ3 4.33Å; W22-W25 PolarHBondContact O-N 2.89Å; W22-H26 WeakPolarHBondContact O-CB 3.42Å; W22-H26 PolarHBondContact O-N 3.08Å; W22-I42 HydrophobicContact CH2-CD1 4.04Å; W22-I42 HydrophobicContact CH2-CG1 4.16Å; W22-I42 HydrophobicContact CH2-CG2 4.42Å; W22-I49 HydrophobicContact CE3-CG2 3.97Å; W22-I49 HydrophobicContact CZ3-CG2 3.59Å; W22-H53 HydrophobicContact CE3-CB 4.24Å; W22-H53 HydrophobicContact CH2-CB 3.91Å; W22-H53 AromaticContact CH2-CD2 3.34Å; W22-H53 WeakPolarHBondContact CH2-CD2 3.5Å; W22-H53 AromaticContact CH2-CG 3.94Å; W22-H53 AromaticContact CZ2-CD2 3.82Å; W22-H53 HydrophobicContact CZ3-CB 3.55Å; W22-H53 AromaticContact CZ3-CD2 3.94Å; W22-L56 HydrophobicContact CB-CD1 3.72Å; W22-L56 HydrophobicContact CD2-CD1 4.48Å; W22-L56 HydrophobicContact CG-CD1 3.91Å; W22-F57 HydrophobicContact CD2-CE2 4.23Å; W22-F57 AromaticContact CE2-CE2 3.69Å; W22-F57 AromaticContact CZ2-CE2 3.87Å; W22-F57 HydrophobicContact CZ2-CE2 3.87Å; W22-F57 AromaticContact NE1-CE2 3.81Å; W22-F57 AromaticContact NE1-CZ 3.85Å
23	N	93.1	Very high	89.9	Confident	73 Å²	73	77.8 Å²	77.8	39%	0.39	41%	0.409	S	S	.	.	H	α-helix	trans	-65.7	-37.8	-179.9	-72.2	-25	0	0	0	112.5	L19 D20 H26 S27	L19-N23 WeakPolarHBondContact O-CB 3.34Å; L19-N23 PolarHBondContact O-N 2.79Å; L19-N23 PolarHBondContact O-ND2 2.8Å; D20-N23 PolarHBondContact O-N 2.97Å; N23-H26 PolarHBondContact O-N 3.02Å; N23-S27 VanDerWaalsContact O-CB 3.31Å; N23-S27 WeakPolarHBondContact O-CB 3.31Å; N23-S27 PolarHBondContact O-N 3.42Å; N23-S27 PolarHBondContact O-OG 3.08Å
24	R	94.2	Very high	91	Very high	192 Å²	192	83.4 Å²	83.4	73%	0.725	43%	0.427	S	S	*	.	H	α-helix	trans	-60.7	-47.8	174.3	-73.9	175.1	-169.7	-178.1	5.2	111.4	D20 W22 S27 A28	D20-R24 VanDerWaalsContact O-CG 3.3Å; D20-R24 WeakPolarHBondContact O-CG 3.45Å; D20-R24 PolarHBondContact O-N 3.31Å; W22-R24 PolarHBondContact O-N 2.81Å; R24-S27 PolarHBondContact O-N 3.29Å; R24-A28 WeakPolarHBondContact O-CB 3.47Å; R24-A28 PolarHBondContact O-N 2.77Å
25	W	95	Very high	91.8	Very high	44 Å²	44	83.9 Å²	83.9	17%	0.167	42%	0.424	C	S	.	.	H	α-helix	trans	-63	-45	176.6	177.5	82	0	0	0	112	A21 W22 S27 A28 F29 A37 I42 A45 I49	A21-W25 PolarHBondContact O-N 3.06Å; W22-W25 HydrophobicContact CH2-CE3 4.45Å; W22-W25 HydrophobicContact CH2-CZ3 4.16Å; W22-W25 HydrophobicContact CZ3-CE3 4.27Å; W22-W25 HydrophobicContact CZ3-CZ3 4.33Å; W22-W25 PolarHBondContact O-N 2.89Å; W25-S27 VanDerWaalsContact C-N 3.27Å; W25-S27 PolarHBondContact O-N 3.11Å; W25-A28 PolarHBondContact O-N 2.79Å; W25-F29 HydrophobicContact CH2-CB 4.49Å; W25-F29 HydrophobicContact CH2-CD2 4.04Å; W25-F29 HydrophobicContact CH2-CG 4.31Å; W25-F29 HydrophobicContact CZ2-CB 4.42Å; W25-F29 AromaticContact CZ2-CD2 3.84Å; W25-F29 HydrophobicContact CZ2-CD2 3.84Å; W25-F29 HydrophobicContact CZ2-CG 4.38Å; W25-F29 WeakPolarHBondContact O-CB 3.47Å; W25-F29 PolarHBondContact O-N 2.92Å; W25-A37 HydrophobicContact CH2-CB 3.84Å; W25-A37 HydrophobicContact CZ3-CB 3.91Å; W25-I42 HydrophobicContact CH2-CG1 4.39Å; W25-I42 HydrophobicContact CZ3-CG1 4.49Å; W25-A45 HydrophobicContact CH2-CB 4.12Å; W25-A45 HydrophobicContact CZ2-CB 3.51Å; W25-I49 HydrophobicContact CB-CD1 3.51Å; W25-I49 HydrophobicContact CB-CG1 4.09Å; W25-I49 HydrophobicContact CD2-CB 4.46Å; W25-I49 HydrophobicContact CD2-CD1 4.5Å; W25-I49 HydrophobicContact CD2-CG1 4.2Å; W25-I49 HydrophobicContact CD2-CG2 3.54Å; W25-I49 HydrophobicContact CE3-CG2 3.69Å; W25-I49 HydrophobicContact CG-CB 4.42Å; W25-I49 HydrophobicContact CG-CD1 3.69Å; W25-I49 HydrophobicContact CG-CG1 3.68Å; W25-I49 HydrophobicContact CG-CG2 3.91Å; W25-I49 HydrophobicContact CH2-CG2 4.47Å; W25-I49 HydrophobicContact CZ2-CG2 4.34Å; W25-I49 HydrophobicContact CZ3-CG2 4.16Å
26	H	94	Very high	92.5	Very high	49 Å²	49	89.7 Å²	89.7	23%	0.227	44%	0.438	C	S	.	.	H	α-helix	trans	-64.9	-33.9	-179.6	-164.4	-83.1	0	0	0	111.9	W22 N23 K30	W22-H26 WeakPolarHBondContact O-CB 3.42Å; W22-H26 PolarHBondContact O-N 3.08Å; N23-H26 PolarHBondContact O-N 3.02Å; H26-K30 WeakPolarHBondContact O-CB 3.3Å; H26-K30 PolarHBondContact O-N 3.45Å
27	S	94.3	Very high	93	Very high	77 Å²	77	87.4 Å²	87.4	54%	0.538	42%	0.423	S	S	.	.	H	α-helix	trans	-69	-44.8	174.3	-58.7	0	0	0	0	111.8	N23 R24 W25 K30 S31	N23-S27 VanDerWaalsContact O-CB 3.31Å; N23-S27 WeakPolarHBondContact O-CB 3.31Å; N23-S27 PolarHBondContact O-N 3.42Å; N23-S27 PolarHBondContact O-OG 3.08Å; R24-S27 PolarHBondContact O-N 3.29Å; W25-S27 VanDerWaalsContact C-N 3.27Å; W25-S27 PolarHBondContact O-N 3.11Å; S27-K30 PolarHBondContact O-N 3.26Å; S27-S31 WeakPolarHBondContact O-CB 3.41Å; S27-S31 PolarHBondContact O-N 3.22Å
28	A	94.5	Very high	93.3	Very high	49 Å²	49	85.8 Å²	85.8	41%	0.405	42%	0.419	S	S	.	.	H	α-helix	trans	-61.4	-44.4	174.4	0	0	0	0	0	111.7	R24 W25 K30 S31 I32	R24-A28 WeakPolarHBondContact O-CB 3.47Å; R24-A28 PolarHBondContact O-N 2.77Å; W25-A28 PolarHBondContact O-N 2.79Å; A28-K30 PolarHBondContact O-N 2.96Å; A28-S31 WeakPolarHBondContact O-CB 3.37Å; A28-S31 PolarHBondContact O-N 3.4Å; A28-I32 WeakPolarHBondContact O-CG1 3.49Å; A28-I32 PolarHBondContact O-N 3.31Å
29	F	96.2	Very high	93.5	Very high	18 Å²	18	90.2 Å²	90.2	8%	0.079	44%	0.441	C	S	.	.	H	α-helix	trans	-59.6	-46.1	175.7	-176	-83.2	0	0	0	111.6	W25 S31 I32 H33 R35 A37 D41	W25-F29 HydrophobicContact CH2-CB 4.49Å; W25-F29 HydrophobicContact CH2-CD2 4.04Å; W25-F29 HydrophobicContact CH2-CG 4.31Å; W25-F29 HydrophobicContact CZ2-CB 4.42Å; W25-F29 AromaticContact CZ2-CD2 3.84Å; W25-F29 HydrophobicContact CZ2-CD2 3.84Å; W25-F29 HydrophobicContact CZ2-CG 4.38Å; W25-F29 WeakPolarHBondContact O-CB 3.47Å; W25-F29 PolarHBondContact O-N 2.92Å; F29-S31 VanDerWaalsContact C-N 3.29Å; F29-S31 PolarHBondContact O-N 3.46Å; F29-I32 PolarHBondContact O-N 2.89Å; F29-H33 HydrophobicContact CD1-CB 4.42Å; F29-H33 AromaticContact CD2-CD2 3.44Å; F29-H33 VanDerWaalsContact CD2-CD2 3.44Å; F29-H33 WeakPolarHBondContact CD2-CD2 3.45Å; F29-H33 AromaticContact CD2-NE2 3.95Å; F29-H33 HydrophobicContact CE1-CB 3.99Å; F29-H33 AromaticContact CE1-CD2 3.87Å; F29-H33 AromaticContact CE2-CD2 3.22Å; F29-H33 WeakPolarHBondContact CE2-CD2 3.41Å; F29-H33 AromaticContact CE2-NE2 3.6Å; F29-H33 AromaticContact CG-CD2 3.85Å; F29-H33 HydrophobicContact CZ-CB 4.18Å; F29-H33 AromaticContact CZ-CD2 3.45Å; F29-H33 VanDerWaalsContact CZ-CD2 3.45Å; F29-H33 WeakPolarHBondContact CZ-CD2 3.46Å; F29-H33 AromaticContact CZ-CG 3.91Å; F29-H33 WeakPolarHBondContact O-CB 3.4Å; F29-H33 PolarHBondContact O-N 3.09Å; F29-R35 HydrophobicContact CE1-CG 4.36Å; F29-A37 HydrophobicContact CD1-CB 3.73Å; F29-A37 VanDerWaalsContact CE1-CA 3.48Å; F29-A37 HydrophobicContact CE1-CB 3.75Å; F29-A37 HydrophobicContact CG-CB 4.17Å; F29-A37 HydrophobicContact CZ-CB 4.19Å; F29-D41 HydrophobicContact CE2-CB 3.75Å; F29-D41 HydrophobicContact CZ-CB 3.64Å; F29-D41 VanDerWaalsContact CZ-CG 3.49Å
30	K	96	Very high	93.8	Very high	119 Å²	119	93.5 Å²	93.5	52%	0.517	45%	0.454	S	S	.	.	H	α-helix	trans	-63.5	-36.6	177.9	-172.6	-174.4	176	-165.5	0	111.7	H26 S27 A28 H34	H26-K30 WeakPolarHBondContact O-CB 3.3Å; H26-K30 PolarHBondContact O-N 3.45Å; S27-K30 PolarHBondContact O-N 3.26Å; A28-K30 PolarHBondContact O-N 2.96Å; K30-H34 WeakPolarHBondContact O-CA 3.49Å; K30-H34 PolarHBondContact O-N 2.95Å
31	S	95.6	Very high	93.9	Very high	85 Å²	85	91.3 Å²	91.3	59%	0.594	44%	0.442	S	S	*	.	H	α-helix	trans	-64	-45.1	176.3	-170.4	0	0	0	0	111.8	S27 A28 F29 H34	S27-S31 WeakPolarHBondContact O-CB 3.41Å; S27-S31 PolarHBondContact O-N 3.22Å; A28-S31 WeakPolarHBondContact O-CB 3.37Å; A28-S31 PolarHBondContact O-N 3.4Å; F29-S31 VanDerWaalsContact C-N 3.29Å; F29-S31 PolarHBondContact O-N 3.46Å; S31-H34 PolarHBondContact O-CE1 3.1Å; S31-H34 PolarHBondContact O-ND1 2.95Å
32	I	95.2	Very high	94	Very high	121 Å²	121	90.5 Å²	90.5	62%	0.621	43%	0.432	S	S	*	.	H	α-helix	trans	-76.4	-42.4	-176.5	-64.5	165.4	0	0	0	112.3	A28 F29	A28-I32 WeakPolarHBondContact O-CG1 3.49Å; A28-I32 PolarHBondContact O-N 3.31Å; F29-I32 PolarHBondContact O-N 2.89Å
33	H	94.6	Very high	94	Very high	94 Å²	94	92.5 Å²	92.5	44%	0.435	45%	0.453	S	S	.	.	H	α-helix	trans	-102.2	-3.5	-172	-64.3	-69.1	0	0	0	114.1	F29 R35	F29-H33 HydrophobicContact CD1-CB 4.42Å; F29-H33 AromaticContact CD2-CD2 3.44Å; F29-H33 VanDerWaalsContact CD2-CD2 3.44Å; F29-H33 WeakPolarHBondContact CD2-CD2 3.45Å; F29-H33 AromaticContact CD2-NE2 3.95Å; F29-H33 HydrophobicContact CE1-CB 3.99Å; F29-H33 AromaticContact CE1-CD2 3.87Å; F29-H33 AromaticContact CE2-CD2 3.22Å; F29-H33 WeakPolarHBondContact CE2-CD2 3.41Å; F29-H33 AromaticContact CE2-NE2 3.6Å; F29-H33 AromaticContact CG-CD2 3.85Å; F29-H33 HydrophobicContact CZ-CB 4.18Å; F29-H33 AromaticContact CZ-CD2 3.45Å; F29-H33 VanDerWaalsContact CZ-CD2 3.45Å; F29-H33 WeakPolarHBondContact CZ-CD2 3.46Å; F29-H33 AromaticContact CZ-CG 3.91Å; F29-H33 WeakPolarHBondContact O-CB 3.4Å; F29-H33 PolarHBondContact O-N 3.09Å; H33-R35 HydrophobicContact CB-CG 4.04Å; H33-R35 WeakPolarHBondContact O-CG 3.17Å; H33-R35 PolarHBondContact O-N 3.06Å
34	H	93.9	Very high	94	Very high	169 Å²	169	99 Å²	99	78%	0.782	47%	0.472	S	S	*	.	S	Bend	trans	52.8	23.8	-177.7	-53.1	-59.9	0	0	0	114.8	K30 S31	K30-H34 WeakPolarHBondContact O-CA 3.49Å; K30-H34 PolarHBondContact O-N 2.95Å; S31-H34 PolarHBondContact O-CE1 3.1Å; S31-H34 PolarHBondContact O-ND1 2.95Å
35	R	93.5	Very high	93.9	Very high	100 Å²	100	90.3 Å²	90.3	38%	0.377	44%	0.441	S	S	.	.	S	Bend	trans	-146.5	164.6	-180	68.5	-176.8	-179.9	78.5	-1	111.5	F29 H33 D41	F29-R35 HydrophobicContact CE1-CG 4.36Å; H33-R35 HydrophobicContact CB-CG 4.04Å; H33-R35 WeakPolarHBondContact O-CG 3.17Å; H33-R35 PolarHBondContact O-N 3.06Å; R35-D41 IonicContact CZ-OD1 3.73Å; R35-D41 IonicContact CZ-OD2 3.39Å; R35-D41 IonicContact NH1-OD1 3.77Å; R35-D41 IonicContact NH1-OD2 2.68Å; R35-D41 PolarHBondContact NH1-OD2 3.03Å; R35-D41 VanDerWaalsContact NH2-CG 3.31Å; R35-D41 IonicContact NH2-OD1 3.22Å; R35-D41 PolarHBondContact NH2-OD1 2.93Å; R35-D41 IonicContact NH2-OD2 2.78Å; R35-D41 PolarHBondContact NH2-OD2 3.24Å
36	R	92.8	Very high	93.9	Very high	194 Å²	194	91.8 Å²	91.8	73%	0.732	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-72.2	147.3	171.2	-66.2	-175.1	176.7	179.7	-1	110.4	N38	R36-N38 PolarHBondContact O-N 3.3Å
37	A	92.3	Very high	93.8	Very high	15 Å²	15	93.7 Å²	93.7	12%	0.124	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-70.2	124.9	176.5	0	0	0	0	0	110.1	W25 F29 D41 I42	W25-A37 HydrophobicContact CH2-CB 3.84Å; W25-A37 HydrophobicContact CZ3-CB 3.91Å; F29-A37 HydrophobicContact CD1-CB 3.73Å; F29-A37 VanDerWaalsContact CE1-CA 3.48Å; F29-A37 HydrophobicContact CE1-CB 3.75Å; F29-A37 HydrophobicContact CG-CB 4.17Å; F29-A37 HydrophobicContact CZ-CB 4.19Å; A37-D41 HydrophobicContact CB-CB 4.22Å; A37-I42 HydrophobicContact CB-CG1 4.32Å
38	N	93.2	Very high	93.7	Very high	103 Å²	103	94.5 Å²	94.5	55%	0.551	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-86.6	169.9	172.6	-70.7	-20.4	0	0	0	110.2	R36 Q40 D41 I42	R36-N38 PolarHBondContact O-N 3.3Å; N38-Q40 PolarHBondContact O-N 3.39Å; N38-Q40 VanDerWaalsContact O-N 3.11Å; N38-D41 WeakPolarHBondContact CB-OD2 3.21Å; N38-D41 PolarHBondContact N-OD2 3.49Å; N38-D41 WeakPolarHBondContact O-CB 3.34Å; N38-D41 PolarHBondContact O-N 3.01Å; N38-I42 WeakPolarHBondContact O-CG1 3.28Å; N38-I42 PolarHBondContact O-N 2.83Å; N38-I42 VanDerWaalsContact O-N 3.08Å
39	K	91.9	Very high	93.7	Very high	184 Å²	184	92.9 Å²	92.9	80%	0.8	45%	0.454	S	S	*	.	H	α-helix	trans	-54.1	-34.5	178.6	-171.9	-179.1	177.6	-171.3	0	113.4	A43	K39-A43 PolarHBondContact O-N 3.46Å; K39-A43 VanDerWaalsContact O-N 3.12Å
40	Q	94	Very high	93.5	Very high	147 Å²	147	97 Å²	97	69%	0.687	47%	0.469	S	S	*	.	H	α-helix	trans	-69.6	-37.5	177.3	-66.8	-177.5	-1.1	0	0	112.3	N38 A43 R44	N38-Q40 PolarHBondContact O-N 3.39Å; N38-Q40 VanDerWaalsContact O-N 3.11Å; Q40-A43 PolarHBondContact O-N 2.97Å; Q40-R44 PolarHBondContact O-N 3.24Å
41	D	95	Very high	93.3	Very high	25 Å²	25	98.8 Å²	98.8	13%	0.134	47%	0.472	C	S	.	.	H	α-helix	trans	-67.7	-42.6	177.6	-54.2	-56.1	0	0	0	110.7	F29 R35 A37 N38 A43 R44 A45	F29-D41 HydrophobicContact CE2-CB 3.75Å; F29-D41 HydrophobicContact CZ-CB 3.64Å; F29-D41 VanDerWaalsContact CZ-CG 3.49Å; R35-D41 IonicContact CZ-OD1 3.73Å; R35-D41 IonicContact CZ-OD2 3.39Å; R35-D41 IonicContact NH1-OD1 3.77Å; R35-D41 IonicContact NH1-OD2 2.68Å; R35-D41 PolarHBondContact NH1-OD2 3.03Å; R35-D41 VanDerWaalsContact NH2-CG 3.31Å; R35-D41 IonicContact NH2-OD1 3.22Å; R35-D41 PolarHBondContact NH2-OD1 2.93Å; R35-D41 IonicContact NH2-OD2 2.78Å; R35-D41 PolarHBondContact NH2-OD2 3.24Å; A37-D41 HydrophobicContact CB-CB 4.22Å; N38-D41 WeakPolarHBondContact CB-OD2 3.21Å; N38-D41 PolarHBondContact N-OD2 3.49Å; N38-D41 WeakPolarHBondContact O-CB 3.34Å; N38-D41 PolarHBondContact O-N 3.01Å; D41-A43 VanDerWaalsContact C-N 3.27Å; D41-A43 PolarHBondContact O-N 3.31Å; D41-R44 CarbonylContact O-C 3.55Å; D41-R44 PolarHBondContact O-N 3.22Å; D41-A45 PolarHBondContact O-N 3.26Å
42	I	93	Very high	93.1	Very high	23 Å²	23	95.8 Å²	95.8	12%	0.118	45%	0.449	C	S	.	.	H	α-helix	trans	-59.7	-40.9	174.9	-60.7	168.9	0	0	0	110	W22 W25 A37 N38 R44 A45 R50 H53	W22-I42 HydrophobicContact CH2-CD1 4.04Å; W22-I42 HydrophobicContact CH2-CG1 4.16Å; W22-I42 HydrophobicContact CH2-CG2 4.42Å; W25-I42 HydrophobicContact CH2-CG1 4.39Å; W25-I42 HydrophobicContact CZ3-CG1 4.49Å; A37-I42 HydrophobicContact CB-CG1 4.32Å; N38-I42 WeakPolarHBondContact O-CG1 3.28Å; N38-I42 PolarHBondContact O-N 2.83Å; N38-I42 VanDerWaalsContact O-N 3.08Å; I42-R44 PolarHBondContact O-N 3.17Å; I42-A45 VanDerWaalsContact O-CB 3.31Å; I42-A45 WeakPolarHBondContact O-CB 3.47Å; I42-A45 PolarHBondContact O-N 2.75Å; I42-R50 WeakPolarHBondContact O-CD 3.38Å; I42-R50 WeakPolarHBondContact O-CG 3.33Å; I42-H53 HydrophobicContact CG2-CB 4.01Å
43	A	92	Very high	92.9	Very high	61 Å²	61	92.5 Å²	92.5	50%	0.504	43%	0.431	S	S	.	.	H	α-helix	trans	-64.9	-26	177.6	0	0	0	0	0	114	K39 Q40 D41 R50	K39-A43 PolarHBondContact O-N 3.46Å; K39-A43 VanDerWaalsContact O-N 3.12Å; Q40-A43 PolarHBondContact O-N 2.97Å; D41-A43 VanDerWaalsContact C-N 3.27Å; D41-A43 PolarHBondContact O-N 3.31Å; A43-R50 VanDerWaalsContact O-CD 3.26Å; A43-R50 WeakPolarHBondContact O-CD 3.34Å; A43-R50 PolarHBondContact O-NH1 2.99Å; A43-R50 VanDerWaalsContact O-NH1 3.11Å
44	R	93.1	Very high	92.5	Very high	211 Å²	211	90.5 Å²	90.5	80%	0.796	43%	0.428	S	S	*	.	H	α-helix	trans	-91.6	-10.7	176.3	-67.7	179.6	179.2	-177	-0	113.7	Q40 D41 I42	Q40-R44 PolarHBondContact O-N 3.24Å; D41-R44 CarbonylContact O-C 3.55Å; D41-R44 PolarHBondContact O-N 3.22Å; I42-R44 PolarHBondContact O-N 3.17Å
45	A	92.4	Very high	92.2	Very high	8 Å²	8	86.5 Å²	86.5	7%	0.066	41%	0.41	C	S	.	.	S	Bend	trans	-63.7	162.5	-179.7	0	0	0	0	0	112.5	W25 D41 I42 I49 R50	W25-A45 HydrophobicContact CH2-CB 4.12Å; W25-A45 HydrophobicContact CZ2-CB 3.51Å; D41-A45 PolarHBondContact O-N 3.26Å; I42-A45 VanDerWaalsContact O-CB 3.31Å; I42-A45 WeakPolarHBondContact O-CB 3.47Å; I42-A45 PolarHBondContact O-N 2.75Å; A45-I49 HydrophobicContact CB-CB 4.09Å; A45-I49 HydrophobicContact CB-CG2 3.92Å; A45-R50 HydrophobicContact CB-CG 4.3Å; A45-R50 WeakPolarHBondContact O-CD 3.49Å; A45-R50 PolarHBondContact O-NE 3.27Å
46	P	94.3	Very high	91.8	Very high	75 Å²	75	84 Å²	84	49%	0.487	40%	0.403	S	S	.	.			trans	-50.3	148.4	172.3	-27.6	35.7	0	0	0	112.5	T48 I49 R50	P46-T48 PolarHBondContact O-N 3.01Å; P46-T48 VanDerWaalsContact O-N 3.15Å; P46-I49 HydrophobicContact CB-CG1 4.41Å; P46-I49 PolarHBondContact O-N 3.42Å; P46-R50 PolarHBondContact O-N 3.4Å
47	L	91.9	Very high	91.3	Very high	90 Å²	90	79.2 Å²	79.2	47%	0.471	39%	0.388	S	S	.	.	H	α-helix	trans	-55.2	-36.1	-176.4	-177.4	63.8	0	0	0	112.8	R50 R51	L47-R50 PolarHBondContact O-N 3.5Å; L47-R51 WeakPolarHBondContact O-CG 3.4Å; L47-R51 PolarHBondContact O-N 3.41Å
48	T	92.7	Very high	90.6	Very high	93 Å²	93	81.3 Å²	81.3	57%	0.571	40%	0.397	S	S	*	.	H	α-helix	trans	-58.4	-49.6	176.2	50.5	0	0	0	0	111.7	P46 R50 R51 L52	P46-T48 PolarHBondContact O-N 3.01Å; P46-T48 VanDerWaalsContact O-N 3.15Å; T48-R50 PolarHBondContact O-N 3.08Å; T48-R51 PolarHBondContact O-N 3.02Å; T48-L52 WeakPolarHBondContact O-CG 3.46Å; T48-L52 PolarHBondContact O-N 3.33Å
49	I	93.7	Very high	89.2	Confident	15 Å²	15	83.2 Å²	83.2	8%	0.077	40%	0.403	C	S	.	.	H	α-helix	trans	-65.3	-39.7	178.1	-58.2	-54.7	0	0	0	111.6	W22 W25 A45 P46 R51 L52 H53	W22-I49 HydrophobicContact CE3-CG2 3.97Å; W22-I49 HydrophobicContact CZ3-CG2 3.59Å; W25-I49 HydrophobicContact CB-CD1 3.51Å; W25-I49 HydrophobicContact CB-CG1 4.09Å; W25-I49 HydrophobicContact CD2-CB 4.46Å; W25-I49 HydrophobicContact CD2-CD1 4.5Å; W25-I49 HydrophobicContact CD2-CG1 4.2Å; W25-I49 HydrophobicContact CD2-CG2 3.54Å; W25-I49 HydrophobicContact CE3-CG2 3.69Å; W25-I49 HydrophobicContact CG-CB 4.42Å; W25-I49 HydrophobicContact CG-CD1 3.69Å; W25-I49 HydrophobicContact CG-CG1 3.68Å; W25-I49 HydrophobicContact CG-CG2 3.91Å; W25-I49 HydrophobicContact CH2-CG2 4.47Å; W25-I49 HydrophobicContact CZ2-CG2 4.34Å; W25-I49 HydrophobicContact CZ3-CG2 4.16Å; A45-I49 HydrophobicContact CB-CB 4.09Å; A45-I49 HydrophobicContact CB-CG2 3.92Å; P46-I49 HydrophobicContact CB-CG1 4.41Å; P46-I49 PolarHBondContact O-N 3.42Å; I49-R51 VanDerWaalsContact C-N 3.35Å; I49-R51 PolarHBondContact O-N 3.38Å; I49-L52 HydrophobicContact CD1-CD1 4.17Å; I49-L52 PolarHBondContact O-N 3.03Å; I49-H53 WeakPolarHBondContact O-CB 3.43Å; I49-H53 PolarHBondContact O-N 3.44Å
50	R	93	Very high	87.3	Confident	106 Å²	106	80.5 Å²	80.5	40%	0.4	39%	0.393	S	S	.	.	H	α-helix	trans	-63	-41.2	176	-70.7	-174.1	-64.9	173.5	3.1	112.2	I42 A43 A45 P46 L47 T48 S54	I42-R50 WeakPolarHBondContact O-CD 3.38Å; I42-R50 WeakPolarHBondContact O-CG 3.33Å; A43-R50 VanDerWaalsContact O-CD 3.26Å; A43-R50 WeakPolarHBondContact O-CD 3.34Å; A43-R50 PolarHBondContact O-NH1 2.99Å; A43-R50 VanDerWaalsContact O-NH1 3.11Å; A45-R50 HydrophobicContact CB-CG 4.3Å; A45-R50 WeakPolarHBondContact O-CD 3.49Å; A45-R50 PolarHBondContact O-NE 3.27Å; P46-R50 PolarHBondContact O-N 3.4Å; L47-R50 PolarHBondContact O-N 3.5Å; T48-R50 PolarHBondContact O-N 3.08Å; R50-S54 PolarHBondContact O-N 3.46Å; R50-S54 VanDerWaalsContact O-N 3.1Å
51	R	91.1	Very high	85.5	Confident	155 Å²	155	81.2 Å²	81.2	59%	0.585	39%	0.393	S	S	*	.	H	α-helix	trans	-65.4	-46	174.1	-73.4	177.6	178.9	-178.3	-0.2	111.2	L47 T48 I49 H53 S54 Q55	L47-R51 WeakPolarHBondContact O-CG 3.4Å; L47-R51 PolarHBondContact O-N 3.41Å; T48-R51 PolarHBondContact O-N 3.02Å; I49-R51 VanDerWaalsContact C-N 3.35Å; I49-R51 PolarHBondContact O-N 3.38Å; R51-H53 PolarHBondContact O-N 2.96Å; R51-S54 PolarHBondContact O-N 3.25Å; R51-Q55 WeakPolarHBondContact O-CB 3.43Å; R51-Q55 VanDerWaalsContact O-CG 3.31Å; R51-Q55 WeakPolarHBondContact O-CG 3.31Å; R51-Q55 PolarHBondContact O-N 2.94Å
52	L	91.3	Very high	83.4	Confident	23 Å²	23	88 Å²	88	12%	0.12	42%	0.422	C	S	.	.	H	α-helix	trans	-58	-46.2	175.9	-73.9	170.5	0	0	0	111.6	R18 A21 T48 I49 S54 Q55 L56	R18-L52 HydrophobicContact CB-CD2 3.71Å; R18-L52 HydrophobicContact CG-CD2 3.69Å; A21-L52 HydrophobicContact CB-CD1 3.92Å; T48-L52 WeakPolarHBondContact O-CG 3.46Å; T48-L52 PolarHBondContact O-N 3.33Å; I49-L52 HydrophobicContact CD1-CD1 4.17Å; I49-L52 PolarHBondContact O-N 3.03Å; L52-S54 VanDerWaalsContact C-N 3.34Å; L52-S54 PolarHBondContact O-N 2.97Å; L52-Q55 PolarHBondContact O-N 3.36Å; L52-L56 WeakPolarHBondContact O-CB 3.27Å; L52-L56 VanDerWaalsContact O-CG 3.28Å; L52-L56 WeakPolarHBondContact O-CG 3.3Å; L52-L56 PolarHBondContact O-N 2.95Å
53	H	90.6	Very high	81.4	Confident	52 Å²	52	89.5 Å²	89.5	24%	0.241	44%	0.443	C	S	.	.	H	α-helix	trans	-57.7	-46	175.5	-179.1	-96.1	0	0	0	112	W22 I42 I49 R51 F57	W22-H53 HydrophobicContact CE3-CB 4.24Å; W22-H53 HydrophobicContact CH2-CB 3.91Å; W22-H53 AromaticContact CH2-CD2 3.34Å; W22-H53 WeakPolarHBondContact CH2-CD2 3.5Å; W22-H53 AromaticContact CH2-CG 3.94Å; W22-H53 AromaticContact CZ2-CD2 3.82Å; W22-H53 HydrophobicContact CZ3-CB 3.55Å; W22-H53 AromaticContact CZ3-CD2 3.94Å; I42-H53 HydrophobicContact CG2-CB 4.01Å; I49-H53 WeakPolarHBondContact O-CB 3.43Å; I49-H53 PolarHBondContact O-N 3.44Å; R51-H53 PolarHBondContact O-N 2.96Å; H53-F57 AromaticContact CD2-CD2 3.38Å; H53-F57 WeakPolarHBondContact CD2-CD2 3.43Å; H53-F57 AromaticContact CD2-CE2 3.85Å; H53-F57 AromaticContact NE2-CD2 3.79Å; H53-F57 WeakPolarHBondContact O-CB 3.34Å; H53-F57 VanDerWaalsContact O-CD2 3.3Å; H53-F57 WeakPolarHBondContact O-CD2 3.47Å; H53-F57 PolarHBondContact O-N 3.44Å
54	S	87.9	Confident	79.4	Confident	51 Å²	51	95.1 Å²	95.1	36%	0.357	46%	0.456	S	S	.	.	I	π-helix	trans	-63.2	-45.3	177.4	-173.5	0	0	0	0	111.5	R50 R51 L52 L56 D58	R50-S54 PolarHBondContact O-N 3.46Å; R50-S54 VanDerWaalsContact O-N 3.1Å; R51-S54 PolarHBondContact O-N 3.25Å; L52-S54 VanDerWaalsContact C-N 3.34Å; L52-S54 PolarHBondContact O-N 2.97Å; S54-L56 PolarHBondContact O-N 2.99Å; S54-D58 VanDerWaalsContact CA-OD2 3.27Å; S54-D58 WeakPolarHBondContact CA-OD2 3.45Å; S54-D58 VanDerWaalsContact CB-OD2 3.25Å; S54-D58 WeakPolarHBondContact CB-OD2 3.43Å; S54-D58 WeakPolarHBondContact O-CA 3.31Å; S54-D58 WeakPolarHBondContact O-CB 3.19Å; S54-D58 PolarHBondContact O-N 2.88Å; S54-D58 PolarHBondContact OG-OD2 3.26Å
55	Q	86.5	Confident	77.2	Confident	86 Å²	86	88.3 Å²	88.3	40%	0.402	45%	0.451	S	S	.	.	I	π-helix	trans	-63.2	-42.1	179.3	-73	174.2	-14.7	0	0	112.8	R51 L52 Q59	R51-Q55 WeakPolarHBondContact O-CB 3.43Å; R51-Q55 VanDerWaalsContact O-CG 3.31Å; R51-Q55 WeakPolarHBondContact O-CG 3.31Å; R51-Q55 PolarHBondContact O-N 2.94Å; L52-Q55 PolarHBondContact O-N 3.36Å; Q55-Q59 WeakPolarHBondContact O-CG 3.25Å; Q55-Q59 PolarHBondContact O-NE2 3.41Å
56	L	85.2	Confident	74.8	Confident	48 Å²	48	93.8 Å²	93.8	25%	0.251	48%	0.476	S	S	.	.	I	π-helix	trans	-76.7	-38.9	-178.1	-67.6	171.9	0	0	0	112.5	R18 L19 W22 L52 S54	R18-L56 HydrophobicContact CB-CD2 4.47Å; L19-L56 HydrophobicContact CD1-CD1 4.25Å; W22-L56 HydrophobicContact CB-CD1 3.72Å; W22-L56 HydrophobicContact CD2-CD1 4.48Å; W22-L56 HydrophobicContact CG-CD1 3.91Å; L52-L56 WeakPolarHBondContact O-CB 3.27Å; L52-L56 VanDerWaalsContact O-CG 3.28Å; L52-L56 WeakPolarHBondContact O-CG 3.3Å; L52-L56 PolarHBondContact O-N 2.95Å; S54-L56 PolarHBondContact O-N 2.99Å
57	F	82.8	Confident	72.5	Confident	93 Å²	93	95.6 Å²	95.6	41%	0.408	49%	0.49	S	S	.	.	I	π-helix	trans	-113.6	-26.5	-168.2	-57.7	-73.3	0	0	0	115.2	W22 H53 Q59 H60	W22-F57 HydrophobicContact CD2-CE2 4.23Å; W22-F57 AromaticContact CE2-CE2 3.69Å; W22-F57 AromaticContact CZ2-CE2 3.87Å; W22-F57 HydrophobicContact CZ2-CE2 3.87Å; W22-F57 AromaticContact NE1-CE2 3.81Å; W22-F57 AromaticContact NE1-CZ 3.85Å; H53-F57 AromaticContact CD2-CD2 3.38Å; H53-F57 WeakPolarHBondContact CD2-CD2 3.43Å; H53-F57 AromaticContact CD2-CE2 3.85Å; H53-F57 AromaticContact NE2-CD2 3.79Å; H53-F57 WeakPolarHBondContact O-CB 3.34Å; H53-F57 VanDerWaalsContact O-CD2 3.3Å; H53-F57 WeakPolarHBondContact O-CD2 3.47Å; H53-F57 PolarHBondContact O-N 3.44Å; F57-Q59 VanDerWaalsContact C-N 3.28Å; F57-Q59 PolarHBondContact O-N 3.36Å; F57-H60 WeakPolarHBondContact O-CB 3.45Å; F57-H60 PolarHBondContact O-N 3.03Å
58	D	76.1	Confident	70.2	Confident	58 Å²	58	100.8 Å²	100.8	31%	0.31	50%	0.504	S	S	.	.	I	π-helix	trans	-73.3	-23.3	177.8	-69.3	-37.1	0	0	0	112	S54 H60 K61 F62	S54-D58 VanDerWaalsContact CA-OD2 3.27Å; S54-D58 WeakPolarHBondContact CA-OD2 3.45Å; S54-D58 VanDerWaalsContact CB-OD2 3.25Å; S54-D58 WeakPolarHBondContact CB-OD2 3.43Å; S54-D58 WeakPolarHBondContact O-CA 3.31Å; S54-D58 WeakPolarHBondContact O-CB 3.19Å; S54-D58 PolarHBondContact O-N 2.88Å; S54-D58 PolarHBondContact OG-OD2 3.26Å; D58-H60 PolarHBondContact O-N 3.5Å; D58-K61 WeakPolarHBondContact O-CB 3.5Å; D58-K61 PolarHBondContact O-N 3.12Å; D58-F62 WeakPolarHBondContact O-CD2 3.48Å
59	Q	64	Low	67.9	Low	143 Å²	143	101.5 Å²	101.5	67%	0.668	51%	0.512	S	S	*	.	H	α-helix	trans	-59.2	-30.7	171.9	-67.3	-168.7	9	0	0	112	Q55 F57 K61 F62 G63	Q55-Q59 WeakPolarHBondContact O-CG 3.25Å; Q55-Q59 PolarHBondContact O-NE2 3.41Å; F57-Q59 VanDerWaalsContact C-N 3.28Å; F57-Q59 PolarHBondContact O-N 3.36Å; Q59-K61 PolarHBondContact O-N 2.87Å; Q59-F62 PolarHBondContact O-N 2.9Å; Q59-F62 VanDerWaalsContact O-N 3.17Å; Q59-G63 PolarHBondContact O-N 3.29Å
60	H	52.9	Low	65.7	Low	128 Å²	128	108.3 Å²	108.3	59%	0.593	54%	0.541	S	S	*	.	H	α-helix	trans	-69	-18.8	177	-155.3	-58.6	0	0	0	112.9	F57 D58	F57-H60 WeakPolarHBondContact O-CB 3.45Å; F57-H60 PolarHBondContact O-N 3.03Å; D58-H60 PolarHBondContact O-N 3.5Å
61	K	55.3	Low	63.7	Low	162 Å²	162	112.1 Å²	112.1	70%	0.704	56%	0.561	S	S	*	*	H	α-helix	trans	-80.8	-22.2	174.6	-66.7	-162.6	178	-178.4	0	113.3	D58 Q59	D58-K61 WeakPolarHBondContact O-CB 3.5Å; D58-K61 PolarHBondContact O-N 3.12Å; Q59-K61 PolarHBondContact O-N 2.87Å
62	F	51.8	Low	61.7	Low	166 Å²	166	111.1 Å²	111.1	73%	0.728	57%	0.567	S	S	*	*	H	α-helix	trans	-79.2	-22	172.5	-67.8	-78.5	0	0	0	112.2	D58 Q59	D58-F62 WeakPolarHBondContact O-CD2 3.48Å; Q59-F62 PolarHBondContact O-N 2.9Å; Q59-F62 VanDerWaalsContact O-N 3.17Å
63	G	50.2	Low	60	Low	55 Å²	55	119.7 Å²	119.7	57%	0.567	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-15.8	177.7	0	0	0	0	0	116.4	Q59	Q59-G63 PolarHBondContact O-N 3.29Å
64	K	50.6	Low	58	Low	180 Å²	180	121.9 Å²	121.9	78%	0.783	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	4.9	178.2	-68.2	-167.2	178.2	-174.3	0	114.3
65	G	46.1	Very low	56.1	Low	67 Å²	67	123.4 Å²	123.4	69%	0.691	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.9	-10.1	178.6	0	0	0	0	0	115.2
66	E	43.4	Very low	54.3	Low	123 Å²	123	129.1 Å²	129.1	58%	0.575	66%	0.663	S	S	*	*			trans	-105.1	82.6	168.3	-81.9	-168.7	-174.6	0	0	109.3	R68	E66-R68 HydrophobicContact CB-CG 4.37Å; E66-R68 PolarHBondContact O-N 3.49Å; E66-R68 IonicContact OE2-CZ 3.68Å; E66-R68 IonicContact OE2-NE 2.95Å; E66-R68 PolarHBondContact OE2-NE 3.35Å; E66-R68 IonicContact OE2-NH2 3.59Å
67	S	44.5	Very low	52.5	Low	113 Å²	113	131.2 Å²	131.2	79%	0.79	68%	0.678	S	S	*	*			trans	-63.7	79.4	148.6	56.6	0	0	0	0	107.2	S69	S67-S69 PolarHBondContact O-N 3.17Å
68	R	44.9	Very low	50.9	Low	200 Å²	200	130.4 Å²	130.4	76%	0.755	68%	0.682	S	S	*	*			trans	-63.2	86.8	158.7	-77	-177.1	-178.9	-158.2	-4.3	105.5	E66 F70	E66-R68 HydrophobicContact CB-CG 4.37Å; E66-R68 PolarHBondContact O-N 3.49Å; E66-R68 IonicContact OE2-CZ 3.68Å; E66-R68 IonicContact OE2-NE 2.95Å; E66-R68 PolarHBondContact OE2-NE 3.35Å; E66-R68 IonicContact OE2-NH2 3.59Å; R68-F70 PolarHBondContact O-N 3.02Å
69	S	44.2	Very low	50	Low	107 Å²	107	137.1 Å²	137.1	75%	0.748	71%	0.708	S	S	*	*			trans	-62.8	85	160	50.8	0	0	0	0	106.2	S67 K71	S67-S69 PolarHBondContact O-N 3.17Å; S69-K71 PolarHBondContact O-N 3.31Å
70	F	47.9	Very low	49.7	Very low	158 Å²	158	134.1 Å²	134.1	69%	0.693	71%	0.708	S	S	*	*			trans	-69.8	95.4	158.5	77.1	-78	0	0	0	104.4	R68 L72	R68-F70 PolarHBondContact O-N 3.02Å; F70-L72 HydrophobicContact CD2-CD1 4.43Å; F70-L72 HydrophobicContact CD2-CD2 4.12Å; F70-L72 HydrophobicContact CD2-CG 3.69Å; F70-L72 HydrophobicContact CE2-CD1 3.79Å; F70-L72 HydrophobicContact CE2-CD2 4.15Å; F70-L72 HydrophobicContact CE2-CG 3.55Å; F70-L72 PolarHBondContact O-N 3.11Å
71	K	49.9	Very low	49.6	Very low	187 Å²	187	134.4 Å²	134.4	81%	0.813	71%	0.713	S	S	*	*			trans	-64.7	102.8	152.3	-79.6	-172.9	176.5	-176.9	0	103.9	S69 K73	S69-K71 PolarHBondContact O-N 3.31Å; K71-K73 VanDerWaalsContact C-N 3.28Å; K71-K73 PolarHBondContact O-N 3.21Å
72	L	50.5	Low	49.3	Very low	134 Å²	134	133.4 Å²	133.4	70%	0.702	72%	0.715	S	S	*	*			trans	-49.2	111.5	150.4	-75	167.4	0	0	0	104	F70 S74	F70-L72 HydrophobicContact CD2-CD1 4.43Å; F70-L72 HydrophobicContact CD2-CD2 4.12Å; F70-L72 HydrophobicContact CD2-CG 3.69Å; F70-L72 HydrophobicContact CE2-CD1 3.79Å; F70-L72 HydrophobicContact CE2-CD2 4.15Å; F70-L72 HydrophobicContact CE2-CG 3.55Å; F70-L72 PolarHBondContact O-N 3.11Å; L72-S74 PolarHBondContact O-N 2.97Å
73	K	55.6	Low	49.2	Very low	203 Å²	203	129.4 Å²	129.4	88%	0.883	71%	0.713	S	S	*	*			trans	-61.8	89	152	-72.4	-174.4	178.6	-178.8	0	102.5	K71 A75	K71-K73 VanDerWaalsContact C-N 3.28Å; K71-K73 PolarHBondContact O-N 3.21Å; K73-A75 PolarHBondContact O-N 3.48Å
74	S	47.4	Very low	49.6	Very low	97 Å²	97	135.6 Å²	135.6	68%	0.678	72%	0.724	S	S	*	*			trans	-54.8	97.8	158.5	53.3	0	0	0	0	103.2	L72 F76	L72-S74 PolarHBondContact O-N 2.97Å; S74-F76 PolarHBondContact O-N 2.9Å; S74-F76 VanDerWaalsContact O-N 3.16Å
75	A	49.2	Very low	49.7	Very low	83 Å²	83	133 Å²	133	69%	0.686	73%	0.726	S	S	*	*			trans	-46.1	126.8	162.2	0	0	0	0	0	104.8	K73 V77	K73-A75 PolarHBondContact O-N 3.48Å; A75-V77 VanDerWaalsContact C-N 3.34Å; A75-V77 PolarHBondContact O-N 3.35Å
76	F	47.3	Very low	49.9	Very low	206 Å²	206	135.7 Å²	135.7	90%	0.904	73%	0.729	S	S	*	*			trans	-31.4	96.3	179.5	-90	-110.1	0	0	0	110.3	S74 P78	S74-F76 PolarHBondContact O-N 2.9Å; S74-F76 VanDerWaalsContact O-N 3.16Å; F76-P78 VanDerWaalsContact O-CD 3.24Å; F76-P78 WeakPolarHBondContact O-CD 3.42Å
77	V	47.1	Very low	50.4	Low	93 Å²	93	139.5 Å²	139.5	56%	0.564	74%	0.738	S	S	*	*			trans	-78.5	111	160.6	178.6	0	0	0	0	102.5	A75 K79 L81	A75-V77 VanDerWaalsContact C-N 3.34Å; A75-V77 PolarHBondContact O-N 3.35Å; V77-K79 PolarHBondContact O-N 3.09Å; V77-L81 HydrophobicContact CG1-CB 3.94Å; V77-L81 HydrophobicContact CG1-CD1 4.37Å
78	P	50.8	Low	50.8	Low	75 Å²	75	145.1 Å²	145.1	49%	0.487	74%	0.741	S	S	.	*			trans	-54.9	132.6	177	-17.8	30.7	0	0	0	106.8	F76 A80 L81	F76-P78 VanDerWaalsContact O-CD 3.24Å; F76-P78 WeakPolarHBondContact O-CD 3.42Å; P78-A80 PolarHBondContact O-N 2.76Å; P78-L81 PolarHBondContact O-N 2.88Å
79	K	56.7	Low	50.9	Low	199 Å²	199	145 Å²	145	87%	0.865	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-53.2	-6.8	177.5	-78.3	177.4	173.3	177.6	0	113.9	V77	V77-K79 PolarHBondContact O-N 3.09Å
80	A	56.7	Low	51.1	Low	81 Å²	81	148.3 Å²	148.3	67%	0.669	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-72.3	-21.9	169.2	0	0	0	0	0	115.2	P78	P78-A80 PolarHBondContact O-N 2.76Å
81	L	51.3	Low	50.7	Low	133 Å²	133	148.9 Å²	148.9	70%	0.696	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-91.2	1.7	179.4	-68.1	174.4	0	0	0	114.1	V77 P78	V77-L81 HydrophobicContact CG1-CB 3.94Å; V77-L81 HydrophobicContact CG1-CD1 4.37Å; P78-L81 PolarHBondContact O-N 2.88Å
82	L	48.7	Very low	50.4	Low	141 Å²	141	148.9 Å²	148.9	74%	0.738	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-92.2	25.5	167.7	-68.1	171.5	0	0	0	111.7	K84	L82-K84 PolarHBondContact O-N 3.35Å
83	A	49.4	Very low	50.1	Low	83 Å²	83	150.9 Å²	150.9	69%	0.686	76%	0.764	S	S	*	*			trans	-60.1	121.2	165.8	0	0	0	0	0	108
84	K	58.9	Low	49.4	Very low	184 Å²	184	145.5 Å²	145.5	80%	0.8	76%	0.758	S	S	*	*			trans	-44	141	179.6	-63.3	174	179.7	177.4	0	109.8	L82 V86	L82-K84 PolarHBondContact O-N 3.35Å; K84-V86 PolarHBondContact O-N 3.36Å
85	P	52.6	Low	49.2	Very low	127 Å²	127	145.8 Å²	145.8	83%	0.825	76%	0.76	S	S	*	*			trans	-57.6	110.8	168.4	25.1	-30.8	0	0	0	107.2	R87	P85-R87 PolarHBondContact O-N 3.39Å
86	V	51.4	Low	48.9	Very low	123 Å²	123	150.6 Å²	150.6	75%	0.745	77%	0.768	S	S	*	*			trans	-64	105.8	167.3	174.3	0	0	0	0	104.7	K84 R88	K84-V86 PolarHBondContact O-N 3.36Å; V86-R88 VanDerWaalsContact C-N 3.33Å; V86-R88 PolarHBondContact O-N 3.24Å
87	R	54.2	Low	48.6	Very low	203 Å²	203	146.7 Å²	146.7	77%	0.766	77%	0.766	S	S	*	*			trans	-55.8	100.9	166.5	-85.2	-179.4	161.9	139.7	-5.2	107.1	P85 Y89	P85-R87 PolarHBondContact O-N 3.39Å; R87-Y89 HydrophobicContact CB-CE2 4.27Å; R87-Y89 PolarHBondContact O-N 2.88Å
88	R	52.9	Low	48.2	Very low	230 Å²	230	148 Å²	148	87%	0.868	78%	0.78	S	S	*	*			trans	-81.1	104.8	160.5	-74.6	-172.5	171.4	176.2	-2.3	105.9	V86 L90	V86-R88 VanDerWaalsContact C-N 3.33Å; V86-R88 PolarHBondContact O-N 3.24Å; R88-L90 PolarHBondContact O-N 2.95Å; R88-L90 VanDerWaalsContact O-N 3.15Å
89	Y	46.7	Very low	47.9	Very low	199 Å²	199	150 Å²	150	78%	0.78	80%	0.796	S	S	*	*			trans	-61.9	109.8	168.7	-61.8	-87	0	0	0	107.1	R87 Q91	R87-Y89 HydrophobicContact CB-CE2 4.27Å; R87-Y89 PolarHBondContact O-N 2.88Å; Y89-Q91 PolarHBondContact O-N 3.34Å
90	L	46.8	Very low	47.2	Very low	175 Å²	175	147.9 Å²	147.9	92%	0.916	79%	0.794	S	S	*	*			trans	-77.6	98.4	158.7	-95.7	159.5	0	0	0	105.4	R88 E92	R88-L90 PolarHBondContact O-N 2.95Å; R88-L90 VanDerWaalsContact O-N 3.15Å; L90-E92 PolarHBondContact O-N 3.49Å
91	Q	40.1	Very low	46.6	Very low	170 Å²	170	151 Å²	151	79%	0.794	80%	0.798	S	S	*	*			trans	-76.3	104.6	167.7	-170.2	177	8.9	0	0	105.8	Y89	Y89-Q91 PolarHBondContact O-N 3.34Å
92	E	44.8	Very low	46	Very low	187 Å²	187	150.5 Å²	150.5	87%	0.874	80%	0.803	S	S	*	*			trans	-115.3	118.1	165	-147.4	170.7	-155.8	0	0	106.1	L90 A94	L90-E92 PolarHBondContact O-N 3.49Å; E92-A94 PolarHBondContact O-N 3.1Å
93	E	42.5	Very low	45.7	Very low	176 Å²	176	152 Å²	152	82%	0.822	81%	0.806	S	S	*	*			trans	-69.9	119.4	-175	-59	-160.9	156.1	0	0	110.1
94	A	41.4	Very low	45.1	Very low	90 Å²	90	153.2 Å²	153.2	74%	0.744	81%	0.81	S	S	*	*			trans	-143.7	83.9	162.4	0	0	0	0	0	108.5	E92	E92-A94 PolarHBondContact O-N 3.1Å
95	S	43.5	Very low	44	Very low	104 Å²	104	152.5 Å²	152.5	73%	0.727	81%	0.814	S	S	*	*				38.4	114.2	129.5	-51.8	0	0	0	0	118.6
96	Q	42.7	Very low	43.4	Very low	184 Å²	184	152.9 Å²	152.9	86%	0.86	81%	0.814	S	S	*	*			trans	85.8	117.4	135.9	-65.4	176.1	-9.3	0	0	119.5
97	S	41.7	Very low	42.7	Very low	124 Å²	124	151.5 Å²	151.5	87%	0.867	82%	0.815	S	S	*	*			trans	93.3	122.2	140.5	75.7	0	0	0	0	118.6
98	S	39.2	Very low	41.8	Very low	121 Å²	121	146.1 Å²	146.1	85%	0.846	81%	0.814	S	S	*	*			trans	-83.9	136.4	179.4	49.2	0	0	0	0	111.8
99	S	44.7	Very low	40.9	Very low	117 Å²	117	142.1 Å²	142.1	82%	0.818	82%	0.816	S	S	*	*			trans	-155.5	133.2	143.2	77.7	0	0	0	0	111.4
100	D	42.1	Very low	40.5	Very low	154 Å²	154	137.4 Å²	137.4	82%	0.824	82%	0.818	S	S	*	*			trans	-59.3	135.6	-179.7	-57.8	-61.1	0	0	0	114.6
101	L	44.1	Very low	40.1	Very low	146 Å²	146	133.5 Å²	133.5	76%	0.764	81%	0.811	S	S	*	*			trans	-175.1	122.7	144.8	-111.5	136.1	0	0	0	111	Q103	L101-Q103 HydrophobicContact CD2-CG 4.31Å
102	P	36.9	Very low	39.9	Very low	123 Å²	123	130.9 Å²	130.9	80%	0.799	81%	0.81	S	S	*	*			trans	-111.4	103.9	164.9	33.7	-20.3	0	0	0	109.8
103	Q	43.6	Very low	39.7	Very low	172 Å²	172	130.9 Å²	130.9	80%	0.804	81%	0.81	S	S	*	*			trans	-143.7	127.2	169.1	-75.4	-169.4	-10	0	0	113.5	L101	L101-Q103 HydrophobicContact CD2-CG 4.31Å
104	S	35.6	Very low	39.4	Very low	109 Å²	109	130.6 Å²	130.6	76%	0.762	81%	0.814	S	S	*	*			trans	79.5	92.1	139.2	-165.6	0	0	0	0	119.6
105	L	35.7	Very low	39.4	Very low	169 Å²	169	131.5 Å²	131.5	89%	0.885	82%	0.815	S	S	*	*			trans	-50.6	130.3	135.7	-80.1	153.8	0	0	0	109.4
106	T	40.7	Very low	39.1	Very low	135 Å²	135	134.5 Å²	134.5	83%	0.828	82%	0.823	S	S	*	*			trans	166.6	149.7	137.5	-65.3	0	0	0	0	109.9
107	A	36.9	Very low	38.8	Very low	93 Å²	93	131.5 Å²	131.5	77%	0.769	82%	0.817	S	S	*	*			trans	102.1	92.6	160.2	0	0	0	0	0	116.9
108	A	34.7	Very low	38.7	Very low	91 Å²	91	131.9 Å²	131.9	75%	0.752	81%	0.814	S	S	*	*			trans	-60.3	165.5	147.9	0	0	0	0	0	111.6
109	T	34.4	Very low	38.7	Very low	146 Å²	146	131.7 Å²	131.7	90%	0.896	81%	0.807	S	S	*	*			trans	99.2	99.7	162.4	-17.5	0	0	0	0	116.6
110	A	39.4	Very low	38.5	Very low	99 Å²	99	134.4 Å²	134.4	82%	0.818	81%	0.807	S	S	*	*			trans	-134.8	109.1	151.8	0	0	0	0	0	105.2
111	A	37.8	Very low	38.7	Very low	94 Å²	94	132.9 Å²	132.9	78%	0.777	80%	0.803	S	S	*	*				92.1	115.2	74.9	0	0	0	0	0	111.9
112	C	34.8	Very low	38.5	Very low	115 Å²	115	130.9 Å²	130.9	78%	0.777	80%	0.801	S	S	*	*			trans	-179.9	83.9	146.5	-151	0	0	0	0	107.5
113	E	41.3	Very low	38.8	Very low	187 Å²	187	136.8 Å²	136.8	87%	0.874	81%	0.808	S	S	*	*				85.1	117.1	98.4	-82.1	-174.9	162.6	0	0	114.9
114	N	37.1	Very low	38.8	Very low	170 Å²	170	137.2 Å²	137.2	91%	0.909	81%	0.81	S	S	*	*			trans	-83.4	145.4	178.4	-73.2	-31.9	0	0	0	111.2
115	S	41.8	Very low	39.1	Very low	109 Å²	109	139 Å²	139	76%	0.762	81%	0.806	S	S	*	*			trans	-160.1	84.8	156.2	165.2	0	0	0	0	110.5
116	N	37.1	Very low	39.2	Very low	166 Å²	166	139.3 Å²	139.3	89%	0.888	80%	0.8	S	S	*	*			trans	-103.9	110.1	159.1	-81.3	-30.5	0	0	0	107
117	V	36.4	Very low	38.7	Very low	122 Å²	122	136.7 Å²	136.7	74%	0.739	80%	0.8	S	S	*	*			trans	-112.3	106.3	167.6	178.1	0	0	0	0	107.1	V119	V117-V119 HydrophobicContact CG1-CG2 4.13Å
118	V	38.1	Very low	38.6	Very low	132 Å²	132	137.6 Å²	137.6	80%	0.8	80%	0.801	S	S	*	*			trans	-83.6	123.3	166.4	173.5	0	0	0	0	106.4
119	V	39.1	Very low	38.6	Very low	116 Å²	116	139.6 Å²	139.6	70%	0.703	80%	0.804	S	S	*	*			trans	-104.7	109.5	167.1	179.7	0	0	0	0	107.4	V117 V121	V117-V119 HydrophobicContact CG1-CG2 4.13Å; V119-V121 HydrophobicContact CG1-CG2 4.16Å
120	E	41.4	Very low	39.1	Very low	174 Å²	174	137.2 Å²	137.2	81%	0.813	79%	0.791	S	S	*	*			trans	-80.1	121.3	170.7	-165.1	173.6	-157.2	0	0	107.8
121	V	46.3	Very low	38.8	Very low	123 Å²	123	140.4 Å²	140.4	75%	0.745	79%	0.794	S	S	*	*			trans	-118.6	100.2	166.3	-179.2	0	0	0	0	107.3	V119	V119-V121 HydrophobicContact CG1-CG2 4.16Å
122	S	39.8	Very low	39	Very low	104 Å²	104	144 Å²	144	73%	0.727	79%	0.792	S	S	*	*			trans	-66.2	130.3	162.7	22.7	0	0	0	0	109.6
123	R	43.2	Very low	39	Very low	247 Å²	247	145.1 Å²	145.1	93%	0.932	79%	0.791	S	S	*	*			trans	-146.6	124.1	154.5	-139.6	175.6	-177.2	-179.2	-0.2	110.7
124	E	42.7	Very low	38.8	Very low	181 Å²	181	140.9 Å²	140.9	85%	0.846	79%	0.788	S	S	*	*			trans	-69.5	152.6	-175	-57.8	170.9	146.2	0	0	112.7
125	E	43.2	Very low	38.8	Very low	146 Å²	146	137.9 Å²	137.9	68%	0.682	78%	0.775	S	S	*	*				132.7	118.8	123.5	-104.2	-160	139.4	0	0	115.5
126	K	38	Very low	38.5	Very low	176 Å²	176	144.1 Å²	144.1	77%	0.765	78%	0.782	S	S	*	*			trans	56.8	117.4	143.3	-72.5	176	-179	149.8	0	119.7
127	G	29.2	Very low	38.8	Very low	80 Å²	80	144.7 Å²	144.7	83%	0.825	77%	0.773	S	S	*	*			trans	-62.5	154	168.9	0	0	0	0	0	114.1
128	S	34.1	Very low	38.9	Very low	112 Å²	112	148.2 Å²	148.2	78%	0.783	78%	0.781	S	S	*	*			trans	-168.4	113.7	156.7	169.7	0	0	0	0	106	P130	S128-P130 WeakPolarHBondContact O-CD 3.48Å
129	T	35.3	Very low	39.1	Very low	133 Å²	133	148.1 Å²	148.1	82%	0.816	77%	0.772	S	S	*	*			trans	-58.1	123.8	171.4	44.7	0	0	0	0	110.1	N131	T129-N131 PolarHBondContact O-N 3.4Å
130	P	45.2	Very low	39.3	Very low	96 Å²	96	150.6 Å²	150.6	62%	0.623	78%	0.782	S	S	*	*			trans	-86.3	110	165.8	31.1	-26.6	0	0	0	109.1	S128 F132	S128-P130 WeakPolarHBondContact O-CD 3.48Å; P130-F132 HydrophobicContact CB-CD2 4.11Å; P130-F132 HydrophobicContact CB-CE2 3.87Å; P130-F132 HydrophobicContact CG-CD2 4.12Å; P130-F132 HydrophobicContact CG-CE2 3.7Å; P130-F132 PolarHBondContact O-N 3.19Å; P130-F132 VanDerWaalsContact O-N 3.14Å
131	N	33.9	Very low	39.6	Very low	165 Å²	165	150 Å²	150	88%	0.882	78%	0.777	S	S	*	*			trans	-50.3	109.9	149.6	-98.9	-31.4	0	0	0	107.6	T129 D133	T129-N131 PolarHBondContact O-N 3.4Å; N131-D133 VanDerWaalsContact C-N 3.29Å; N131-D133 PolarHBondContact O-N 2.84Å
132	F	40	Very low	39.7	Very low	170 Å²	170	151.8 Å²	151.8	75%	0.746	78%	0.78	S	S	*	*			trans	-88.1	81.2	167.2	-89.3	-84.4	0	0	0	108.3	P130	P130-F132 HydrophobicContact CB-CD2 4.11Å; P130-F132 HydrophobicContact CB-CE2 3.87Å; P130-F132 HydrophobicContact CG-CD2 4.12Å; P130-F132 HydrophobicContact CG-CE2 3.7Å; P130-F132 PolarHBondContact O-N 3.19Å; P130-F132 VanDerWaalsContact O-N 3.14Å
133	D	35.9	Very low	39.8	Very low	139 Å²	139	154 Å²	154	74%	0.743	78%	0.777	S	S	*	*			trans	-62.9	148.6	158.5	-140	-13.7	0	0	0	109.1	N131 V135	N131-D133 VanDerWaalsContact C-N 3.29Å; N131-D133 PolarHBondContact O-N 2.84Å; D133-V135 PolarHBondContact O-N 3.45Å
134	A	36.5	Very low	40.6	Very low	98 Å²	98	147 Å²	147	81%	0.81	76%	0.763	S	S	*	*			trans	-54.7	104.2	-165.5	0	0	0	0	0	114.3
135	V	37.7	Very low	40.9	Very low	107 Å²	107	145.8 Å²	145.8	65%	0.648	76%	0.756	S	S	*	*			trans	-118.2	117.8	168.7	-178.3	0	0	0	0	109.6	D133 Y137	D133-V135 PolarHBondContact O-N 3.45Å; V135-Y137 WeakPolarHBondContact O-CD2 3.37Å; V135-Y137 PolarHBondContact O-N 2.6Å
136	R	35.6	Very low	41.3	Very low	239 Å²	239	147.7 Å²	147.7	90%	0.902	77%	0.765	S	S	*	*			trans	-51.8	115.2	175.8	-61.3	176.9	171.2	-156.8	-3	110.7
137	Y	42.3	Very low	41.8	Very low	179 Å²	179	149 Å²	149	70%	0.702	77%	0.771	S	S	*	*			trans	-102.6	95.4	163.3	-81.6	-85.9	0	0	0	108.8	V135 Q139	V135-Y137 WeakPolarHBondContact O-CD2 3.37Å; V135-Y137 PolarHBondContact O-N 2.6Å; Y137-Q139 PolarHBondContact O-N 3.47Å
138	E	38.4	Very low	43	Very low	195 Å²	195	146.7 Å²	146.7	91%	0.911	74%	0.742	S	S	*	*			trans	-71.8	95.4	150	-74.5	-176.8	169.2	0	0	107
139	Q	43.4	Very low	44	Very low	131 Å²	131	151.2 Å²	151.2	61%	0.612	74%	0.742	S	S	*	*			trans	-153	111.5	166.8	-158.1	161.3	29.8	0	0	108.3	Y137 F141	Y137-Q139 PolarHBondContact O-N 3.47Å; Q139-F141 PolarHBondContact O-N 3.43Å
140	D	44.1	Very low	45.1	Very low	168 Å²	168	153.4 Å²	153.4	90%	0.898	74%	0.74	S	S	*	*			trans	-62.8	74.9	-178.6	-67.5	-38	0	0	0	111.6	I142	D140-I142 PolarHBondContact O-N 2.89Å; D140-I142 VanDerWaalsContact O-N 3.12Å
141	F	47.3	Very low	45.5	Very low	162 Å²	162	154.9 Å²	154.9	71%	0.711	74%	0.742	S	S	*	*			trans	-70.3	101.3	162	-92.1	-91.9	0	0	0	107.4	Q139 F143	Q139-F141 PolarHBondContact O-N 3.43Å; F141-F143 PolarHBondContact O-N 3.1Å
142	I	47.8	Very low	46.8	Very low	159 Å²	159	152 Å²	152	82%	0.815	73%	0.727	S	S	*	*			trans	-60.7	92.1	164.3	-62.1	164	0	0	0	106.8	D140 P144	D140-I142 PolarHBondContact O-N 2.89Å; D140-I142 VanDerWaalsContact O-N 3.12Å; I142-P144 WeakPolarHBondContact O-CD 3.38Å
143	F	42.7	Very low	47.7	Very low	150 Å²	150	147.2 Å²	147.2	66%	0.658	71%	0.708	S	S	*	*			trans	-65.8	122.7	167.6	-122	-94.5	0	0	0	106.5	F141 F145	F141-F143 PolarHBondContact O-N 3.1Å; F143-F145 PolarHBondContact O-N 2.99Å
144	P	58.3	Low	48.9	Very low	100 Å²	100	146.3 Å²	146.3	65%	0.649	70%	0.703	S	S	*	*	S	Bend	trans	-69.1	6.8	-176.7	24.5	-30.4	0	0	0	113.8	I142	I142-P144 WeakPolarHBondContact O-CD 3.38Å
145	F	50.8	Low	50.3	Low	157 Å²	157	145.6 Å²	145.6	69%	0.689	69%	0.691	S	S	*	*	S	Bend	trans	-137.4	87.1	179.3	-51.8	-71.9	0	0	0	108	F143 F147	F143-F145 PolarHBondContact O-N 2.99Å; F145-F147 PolarHBondContact O-N 3.24Å
146	E	50.4	Low	51.7	Low	186 Å²	186	146.2 Å²	146.2	87%	0.869	68%	0.682	S	S	*	*			trans	-54	127.2	162.4	-71.9	-174.4	165.2	0	0	108.3	S148	E146-S148 PolarHBondContact O-N 2.86Å
147	F	49.5	Very low	53.4	Low	204 Å²	204	142.1 Å²	142.1	90%	0.895	67%	0.668	S	S	*	*			trans	-61.8	87.5	170.7	-86.7	-90.9	0	0	0	108.8	F145 R149	F145-F147 PolarHBondContact O-N 3.24Å; F147-R149 PolarHBondContact O-N 2.86Å
148	S	53.6	Low	54.7	Low	31 Å²	31	135.9 Å²	135.9	22%	0.217	65%	0.651	C	S	.	*			trans	-62.1	127.5	170.6	167	0	0	0	0	109.2	E146 D152 R156	E146-S148 PolarHBondContact O-N 2.86Å; S148-D152 WeakPolarHBondContact OG-CB 3.43Å; S148-R156 PolarHBondContact OG-NH2 3.16Å
149	R	54.7	Low	56.4	Low	206 Å²	206	129.4 Å²	129.4	78%	0.777	63%	0.627	S	S	*	*			trans	-52.4	143.2	173.6	-70	-176.7	175.8	-173.1	-0.2	109.1	F147 D151 D152 M153	F147-R149 PolarHBondContact O-N 2.86Å; R149-D151 PolarHBondContact O-N 3.41Å; R149-D152 PolarHBondContact O-N 3Å; R149-M153 PolarHBondContact O-N 2.95Å
150	K	58.1	Low	57.9	Low	179 Å²	179	127.9 Å²	127.9	78%	0.778	62%	0.622	S	S	*	*	H	α-helix	trans	-51.7	-30.1	-174.5	-70.4	-179.9	178.6	176	0	112.9	M153 L154	K150-M153 PolarHBondContact O-N 3.43Å; K150-L154 PolarHBondContact O-N 2.68Å
151	D	54.4	Low	59.2	Low	127 Å²	127	122.3 Å²	122.3	68%	0.679	60%	0.596	S	S	*	*	H	α-helix	trans	-73.2	-35.2	-179.7	-54.6	-35.1	0	0	0	113.1	R149 L154 S155	R149-D151 PolarHBondContact O-N 3.41Å; D151-L154 PolarHBondContact O-N 3.22Å; D151-S155 PolarHBondContact O-N 2.97Å
152	D	60.4	Low	60.4	Low	105 Å²	105	122.8 Å²	122.8	56%	0.561	59%	0.593	S	S	*	*	H	α-helix	trans	-73.1	-30	174.6	-98.6	-7	0	0	0	112.4	S148 R149 R156	S148-D152 WeakPolarHBondContact OG-CB 3.43Å; R149-D152 PolarHBondContact O-N 3Å; D152-R156 WeakPolarHBondContact O-CG 3.31Å; D152-R156 PolarHBondContact O-N 3.11Å; D152-R156 PolarHBondContact O-NE 2.92Å
153	M	59.9	Low	61.6	Low	69 Å²	69	119.7 Å²	119.7	34%	0.34	58%	0.578	S	S	.	*	H	α-helix	trans	-65.5	-41.8	174.5	-75.9	-64.8	-132.3	0	0	111.2	R149 K150 S155 R156 Y157	R149-M153 PolarHBondContact O-N 2.95Å; K150-M153 PolarHBondContact O-N 3.43Å; M153-S155 PolarHBondContact O-N 3.08Å; M153-R156 PolarHBondContact O-N 3.12Å; M153-R156 PolarHBondContact SD-NH2 2.78Å; M153-Y157 HydrophobicContact CB-CD2 4.14Å; M153-Y157 HydrophobicContact CB-CE2 3.98Å; M153-Y157 WeakPolarHBondContact O-CB 3.49Å; M153-Y157 WeakPolarHBondContact O-CD2 3.36Å; M153-Y157 PolarHBondContact O-N 3.46Å; M153-Y157 HydrophobicContact SD-CE2 4.07Å
154	L	60.3	Low	62.8	Low	121 Å²	121	116.3 Å²	116.3	63%	0.634	57%	0.572	S	S	*	*	H	α-helix	trans	-60.3	-43.1	178.4	-90.9	145.5	0	0	0	112.5	K150 D151 S158	K150-L154 PolarHBondContact O-N 2.68Å; D151-L154 PolarHBondContact O-N 3.22Å; L154-S158 VanDerWaalsContact O-CB 3.24Å; L154-S158 WeakPolarHBondContact O-CB 3.12Å; L154-S158 PolarHBondContact O-N 3.31Å
155	S	66.7	Low	62.9	Low	82 Å²	82	118.3 Å²	118.3	57%	0.573	57%	0.57	S	S	*	*	H	α-helix	trans	-62.6	-44.4	176.1	-174.1	0	0	0	0	111.8	D151 M153 S158 S159	D151-S155 PolarHBondContact O-N 2.97Å; M153-S155 PolarHBondContact O-N 3.08Å; S155-S158 PolarHBondContact O-N 3.33Å; S155-S159 PolarHBondContact O-N 2.83Å
156	R	67.3	Low	63.5	Low	121 Å²	121	116.3 Å²	116.3	46%	0.457	56%	0.563	S	S	.	*	H	α-helix	trans	-68.9	-39.4	178.6	-69	-172.7	-67.2	167.7	2.4	113.3	S148 D152 M153 S158 S159 L160	S148-R156 PolarHBondContact OG-NH2 3.16Å; D152-R156 WeakPolarHBondContact O-CG 3.31Å; D152-R156 PolarHBondContact O-N 3.11Å; D152-R156 PolarHBondContact O-NE 2.92Å; M153-R156 PolarHBondContact O-N 3.12Å; M153-R156 PolarHBondContact SD-NH2 2.78Å; R156-S158 VanDerWaalsContact C-N 3.35Å; R156-S159 PolarHBondContact O-OG 3.44Å; R156-L160 WeakPolarHBondContact O-CB 3.46Å; R156-L160 PolarHBondContact O-N 3.21Å
157	Y	71.7	Confident	63.9	Low	152 Å²	152	111.3 Å²	111.3	60%	0.596	55%	0.548	S	S	*	.	H	α-helix	trans	-67.8	-36.4	174.2	-75.4	-61.5	0	0	0	111.9	M153 S161	M153-Y157 HydrophobicContact CB-CD2 4.14Å; M153-Y157 HydrophobicContact CB-CE2 3.98Å; M153-Y157 WeakPolarHBondContact O-CB 3.49Å; M153-Y157 WeakPolarHBondContact O-CD2 3.36Å; M153-Y157 PolarHBondContact O-N 3.46Å; M153-Y157 HydrophobicContact SD-CE2 4.07Å; Y157-S161 VanDerWaalsContact O-CB 3.31Å; Y157-S161 WeakPolarHBondContact O-CB 3.22Å; Y157-S161 PolarHBondContact O-N 3.03Å; Y157-S161 PolarHBondContact O-OG 3.47Å
158	S	69.9	Low	64.3	Low	49 Å²	49	105 Å²	105	34%	0.343	53%	0.529	S	S	.	.	H	α-helix	trans	-63.4	-48.4	174	-177.6	0	0	0	0	111.3	L154 S155 R156 S161 R162	L154-S158 VanDerWaalsContact O-CB 3.24Å; L154-S158 WeakPolarHBondContact O-CB 3.12Å; L154-S158 PolarHBondContact O-N 3.31Å; S155-S158 PolarHBondContact O-N 3.33Å; R156-S158 VanDerWaalsContact C-N 3.35Å; S158-S161 PolarHBondContact O-N 3.36Å; S158-S161 PolarHBondContact O-OG 3.34Å; S158-R162 WeakPolarHBondContact O-CG 3.26Å; S158-R162 PolarHBondContact O-N 3.04Å
159	S	72.5	Confident	64.5	Low	59 Å²	59	109.7 Å²	109.7	41%	0.413	55%	0.552	S	S	.	*	H	α-helix	trans	-64.3	-43.3	178.2	79.1	0	0	0	0	112.4	S155 R156 S161 R162 I163	S155-S159 PolarHBondContact O-N 2.83Å; R156-S159 PolarHBondContact O-OG 3.44Å; S159-S161 VanDerWaalsContact C-N 3.3Å; S159-S161 PolarHBondContact O-N 3.29Å; S159-R162 PolarHBondContact O-N 2.95Å; S159-I163 WeakPolarHBondContact O-CG1 3.35Å; S159-I163 PolarHBondContact O-N 3.49Å
160	L	75	Confident	64.4	Low	99 Å²	99	106.5 Å²	106.5	52%	0.518	55%	0.546	S	S	.	.	H	α-helix	trans	-59.9	-40.8	174.5	-101.8	149.5	0	0	0	111.8	R156 I163 C164	R156-L160 WeakPolarHBondContact O-CB 3.46Å; R156-L160 PolarHBondContact O-N 3.21Å; L160-I163 PolarHBondContact O-N 3.3Å; L160-C164 WeakPolarHBondContact O-CB 3.47Å; L160-C164 PolarHBondContact O-N 3.29Å; L160-C164 PolarHBondContact O-SG 3.46Å
161	S	72.3	Confident	64.1	Low	50 Å²	50	107 Å²	107	35%	0.35	55%	0.551	S	S	.	*	H	α-helix	trans	-64	-44.1	178	74	0	0	0	0	111.6	Y157 S158 S159 I163 C164 F165	Y157-S161 VanDerWaalsContact O-CB 3.31Å; Y157-S161 WeakPolarHBondContact O-CB 3.22Å; Y157-S161 PolarHBondContact O-N 3.03Å; Y157-S161 PolarHBondContact O-OG 3.47Å; S158-S161 PolarHBondContact O-N 3.36Å; S158-S161 PolarHBondContact O-OG 3.34Å; S159-S161 VanDerWaalsContact C-N 3.3Å; S159-S161 PolarHBondContact O-N 3.29Å; S161-I163 PolarHBondContact O-N 2.95Å; S161-C164 PolarHBondContact O-N 3.48Å; S161-F165 WeakPolarHBondContact O-CD2 3.44Å; S161-F165 PolarHBondContact O-N 3.19Å
162	R	72.6	Confident	63.9	Low	172 Å²	172	110.1 Å²	110.1	65%	0.649	56%	0.561	S	S	*	*	H	α-helix	trans	-60.8	-45.6	177.4	-70.9	179.6	-175.3	-173.7	-0.4	112	S158 S159 C164 F165 Q166	S158-R162 WeakPolarHBondContact O-CG 3.26Å; S158-R162 PolarHBondContact O-N 3.04Å; S159-R162 PolarHBondContact O-N 2.95Å; R162-C164 PolarHBondContact O-N 3.43Å; R162-F165 PolarHBondContact O-N 3.26Å; R162-Q166 PolarHBondContact O-N 3.2Å
163	I	73.1	Confident	63.1	Low	95 Å²	95	110.2 Å²	110.2	49%	0.487	57%	0.57	S	S	.	*	H	α-helix	trans	-61.5	-45.4	176.8	-64.6	164.7	0	0	0	110.6	S159 L160 S161 F165 Q166 C167	S159-I163 WeakPolarHBondContact O-CG1 3.35Å; S159-I163 PolarHBondContact O-N 3.49Å; L160-I163 PolarHBondContact O-N 3.3Å; S161-I163 PolarHBondContact O-N 2.95Å; I163-F165 VanDerWaalsContact C-N 3.28Å; I163-F165 PolarHBondContact O-N 3.06Å; I163-Q166 PolarHBondContact O-N 3.49Å; I163-C167 WeakPolarHBondContact O-CB 3.49Å; I163-C167 PolarHBondContact O-N 3.35Å; I163-C167 PolarHBondContact O-SG 3.33Å
164	C	67.3	Low	62.2	Low	79 Å²	79	114.4 Å²	114.4	53%	0.534	59%	0.594	S	S	.	*	H	α-helix	trans	-62.6	-33.9	178.7	-66.9	0	0	0	0	112.9	L160 S161 R162 S168	L160-C164 WeakPolarHBondContact O-CB 3.47Å; L160-C164 PolarHBondContact O-N 3.29Å; L160-C164 PolarHBondContact O-SG 3.46Å; S161-C164 PolarHBondContact O-N 3.48Å; R162-C164 PolarHBondContact O-N 3.43Å; C164-S168 PolarHBondContact O-N 2.9Å
165	F	61.1	Low	61.2	Low	141 Å²	141	116.2 Å²	116.2	62%	0.618	60%	0.603	S	S	*	*	H	α-helix	trans	-77.3	-38.6	177.4	-77.7	-64.9	0	0	0	112.6	S161 R162 I163 S168 N169	S161-F165 WeakPolarHBondContact O-CD2 3.44Å; S161-F165 PolarHBondContact O-N 3.19Å; R162-F165 PolarHBondContact O-N 3.26Å; I163-F165 VanDerWaalsContact C-N 3.28Å; I163-F165 PolarHBondContact O-N 3.06Å; F165-S168 WeakPolarHBondContact CA-OG 3.45Å; F165-S168 PolarHBondContact O-N 2.78Å; F165-S168 PolarHBondContact O-OG 3.3Å; F165-N169 PolarHBondContact O-N 2.9Å
166	Q	63.5	Low	60.1	Low	116 Å²	116	117.3 Å²	117.3	54%	0.542	61%	0.608	S	S	.	*	H	α-helix	trans	-62.4	-47.3	172.7	-89.4	171.7	-46.1	0	0	111.6	R162 I163 S168 N169 E170	R162-Q166 PolarHBondContact O-N 3.2Å; I163-Q166 PolarHBondContact O-N 3.49Å; Q166-S168 PolarHBondContact O-N 3.23Å; Q166-S168 VanDerWaalsContact O-N 3.09Å; Q166-N169 PolarHBondContact O-N 2.98Å; Q166-E170 WeakPolarHBondContact O-CG 3.34Å; Q166-E170 PolarHBondContact O-N 3.07Å
167	C	58.1	Low	58.7	Low	81 Å²	81	119 Å²	119	55%	0.547	63%	0.626	S	S	.	*	H	α-helix	trans	-63.3	-19.3	176.5	-62.1	0	0	0	0	113.7	I163	I163-C167 WeakPolarHBondContact O-CB 3.49Å; I163-C167 PolarHBondContact O-N 3.35Å; I163-C167 PolarHBondContact O-SG 3.33Å
168	S	58	Low	57.1	Low	71 Å²	71	117.1 Å²	117.1	50%	0.497	63%	0.631	S	S	.	*	H	α-helix	trans	-86.6	-14.3	176.8	71.2	0	0	0	0	114.3	C164 F165 Q166	C164-S168 PolarHBondContact O-N 2.9Å; F165-S168 WeakPolarHBondContact CA-OG 3.45Å; F165-S168 PolarHBondContact O-N 2.78Å; F165-S168 PolarHBondContact O-OG 3.3Å; Q166-S168 PolarHBondContact O-N 3.23Å; Q166-S168 VanDerWaalsContact O-N 3.09Å
169	N	56.7	Low	55.6	Low	129 Å²	129	121.9 Å²	121.9	69%	0.69	65%	0.653	S	S	*	*	H	α-helix	trans	-105.1	-13.7	-179.3	-72.4	-16.6	0	0	0	113	F165 Q166	F165-N169 PolarHBondContact O-N 2.9Å; Q166-N169 PolarHBondContact O-N 2.98Å
170	E	52.7	Low	54.3	Low	140 Å²	140	128.7 Å²	128.7	65%	0.654	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	8.5	-175.7	-71.1	-176.9	-170.5	0	0	114.7	Q166	Q166-E170 WeakPolarHBondContact O-CG 3.34Å; Q166-E170 PolarHBondContact O-N 3.07Å
171	E	53.5	Low	52.3	Low	190 Å²	190	129.7 Å²	129.7	89%	0.888	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	10.1	177.7	-98	-172.6	164.4	0	0	114.5
172	E	49.1	Very low	50.9	Low	191 Å²	191	132.6 Å²	132.6	89%	0.893	71%	0.709	S	S	*	*	S	Bend	trans	-135.4	37.5	-172.9	-151.1	168.1	-158.6	0	0	115.5
173	S	44	Very low	49.3	Very low	107 Å²	107	131.2 Å²	131.2	75%	0.748	71%	0.714	S	S	*	*			trans	-136.5	90.9	168.2	43.3	0	0	0	0	113.1	L175	S173-L175 PolarHBondContact O-N 3.11Å
174	D	40.9	Very low	47.8	Very low	157 Å²	157	134.3 Å²	134.3	84%	0.84	73%	0.727	S	S	*	*			trans	-65.6	120.7	161.3	-81	-45.3	0	0	0	110.9
175	L	38.9	Very low	46.3	Very low	159 Å²	159	137 Å²	137	83%	0.832	74%	0.736	S	S	*	*			trans	80.3	154.9	140.3	-68.3	175.5	0	0	0	120.6	S173	S173-L175 PolarHBondContact O-N 3.11Å
176	P	44.1	Very low	45.1	Very low	105 Å²	105	139.2 Å²	139.2	68%	0.682	75%	0.748	S	S	*	*				-106.8	148.9	-126.5	38.8	-34.5	0	0	0	113
177	N	37.7	Very low	43.8	Very low	156 Å²	156	142 Å²	142	83%	0.834	77%	0.766	S	S	*	*			trans	-173	145.5	145.8	-127.4	-23.1	0	0	0	114.9
178	V	39	Very low	42.7	Very low	114 Å²	114	142.8 Å²	142.8	69%	0.691	77%	0.772	S	S	*	*			trans	77.3	102.4	149.4	-174	0	0	0	0	118.4	K180	V178-K180 PolarHBondContact O-N 3Å
179	D	38.6	Very low	41.8	Very low	149 Å²	149	145.3 Å²	145.3	80%	0.797	79%	0.787	S	S	*	*			trans	-22.3	120.7	138.3	-81.5	-42.7	0	0	0	112.9
180	K	43.2	Very low	41	Very low	202 Å²	202	144.9 Å²	144.9	88%	0.878	79%	0.789	S	S	*	*				-175.5	120.2	126.2	-100.6	165.1	-172	-166.5	0	112.7	V178	V178-K180 PolarHBondContact O-N 3Å
181	C	34.6	Very low	40.4	Very low	119 Å²	119	145.7 Å²	145.7	80%	0.804	79%	0.793	S	S	*	*			trans	-44.3	131.4	153.7	-177.9	0	0	0	0	112.7
182	S	42.7	Very low	39.6	Very low	112 Å²	112	144.4 Å²	144.4	78%	0.783	79%	0.787	S	S	*	*			trans	-168.7	124	133.7	52.3	0	0	0	0	110.2
183	D	37.9	Very low	39	Very low	142 Å²	142	143.1 Å²	143.1	76%	0.759	79%	0.786	S	S	*	*			trans	-55.4	173.7	163.6	-83.2	-47.6	0	0	0	113.3
184	E	42.8	Very low	39	Very low	160 Å²	160	145.2 Å²	145.2	75%	0.748	79%	0.787	S	S	*	*			trans	102.6	100.6	160.1	-52.3	-79.3	125	0	0	115.8
185	D	36.1	Very low	39.2	Very low	135 Å²	135	146.8 Å²	146.8	72%	0.722	79%	0.789	S	S	*	*				51.8	113.7	118.4	-72.2	-4.5	0	0	0	119
186	Q	35.7	Very low	39.6	Very low	188 Å²	188	148.8 Å²	148.8	88%	0.879	79%	0.791	S	S	*	*				167	142.5	97.6	-80.8	-155.7	43.9	0	0	112.3
187	L	34.7	Very low	39.6	Very low	175 Å²	175	147.7 Å²	147.7	92%	0.916	78%	0.784	S	S	*	*			trans	-59.4	135.9	174.3	-68	150.4	0	0	0	111.9
188	S	36.6	Very low	40	Very low	98 Å²	98	146.5 Å²	146.5	69%	0.685	78%	0.776	S	S	*	*			trans	-134.5	114.2	159.4	172.9	0	0	0	0	108.7	V190	S188-V190 PolarHBondContact O-N 3.15Å
189	P	37.6	Very low	40.3	Very low	123 Å²	123	146.5 Å²	146.5	80%	0.799	78%	0.777	S	S	*	*			trans	-87.1	101.6	171.5	32.5	-24.1	0	0	0	108.1
190	V	40.7	Very low	40.6	Very low	120 Å²	120	147.3 Å²	147.3	73%	0.727	77%	0.773	S	S	*	*			trans	-113.1	96.9	168.3	177.6	0	0	0	0	108	S188	S188-V190 PolarHBondContact O-N 3.15Å
191	E	39.5	Very low	40.7	Very low	158 Å²	158	144.5 Å²	144.5	74%	0.738	77%	0.765	S	S	*	*				22.1	134.2	128.8	-70	-177.3	159.3	0	0	119
192	E	37.2	Very low	41.2	Very low	163 Å²	163	148.2 Å²	148.2	76%	0.762	76%	0.762	S	S	*	*			trans	83.9	97.4	140.8	-70.2	174.9	169.3	0	0	120.3
193	D	37.2	Very low	41.4	Very low	163 Å²	163	153.1 Å²	153.1	87%	0.872	76%	0.763	S	S	*	*				79.3	53.9	111.7	-132	19.9	0	0	0	120.2
194	I	44.4	Very low	42	Very low	151 Å²	151	154 Å²	154	77%	0.774	76%	0.761	S	S	*	*			trans	-137.1	-14.8	173.8	-53.9	178.7	0	0	0	117.2	K196	I194-K196 PolarHBondContact O-N 3.07Å
195	E	44.5	Very low	42.4	Very low	191 Å²	191	149.5 Å²	149.5	89%	0.893	75%	0.751	S	S	*	*			trans	-98.6	39.1	-161.8	-64.6	-163.5	153.7	0	0	118.4
196	K	46.6	Very low	43.1	Very low	201 Å²	201	153 Å²	153	87%	0.874	75%	0.754	S	S	*	*	S	Bend	trans	-141.3	92.1	164.1	-68.9	-179.9	-175.8	166.1	0	110	I194	I194-K196 PolarHBondContact O-N 3.07Å
197	P	43.8	Very low	44.1	Very low	81 Å²	81	147.9 Å²	147.9	53%	0.526	74%	0.738	S	S	.	*	S	Bend		-161.5	31.3	96.6	40.1	-17.7	0	0	0	116.6	T199 K200	P197-T199 VanDerWaalsContact C-N 3.28Å; P197-T199 PolarHBondContact O-N 3.43Å; P197-K200 PolarHBondContact O-N 3.25Å
198	I	46.2	Very low	45.3	Very low	131 Å²	131	144.5 Å²	144.5	67%	0.672	72%	0.721	S	S	*	*	H	α-helix	trans	-67.3	-27.3	-169.2	-60.5	174.8	0	0	0	113.2	R202	I198-R202 PolarHBondContact O-N 3.34Å
199	T	46.7	Very low	46.7	Very low	115 Å²	115	144.4 Å²	144.4	71%	0.706	71%	0.713	S	S	*	*	H	α-helix	trans	-80.2	-23.6	-175.5	59.1	0	0	0	0	114.4	P197	P197-T199 VanDerWaalsContact C-N 3.28Å; P197-T199 PolarHBondContact O-N 3.43Å
200	K	43.6	Very low	48.1	Very low	166 Å²	166	144.1 Å²	144.1	72%	0.722	71%	0.705	S	S	*	*	H	α-helix	trans	-81.7	-29.9	172.9	-70.6	-175.6	-179.1	175.7	0	112.2	P197 K204	P197-K200 PolarHBondContact O-N 3.25Å; K200-K204 PolarHBondContact O-N 3.44Å
201	M	45.6	Very low	49.6	Very low	142 Å²	142	145 Å²	145	70%	0.7	70%	0.696	S	S	*	*	H	α-helix	trans	-67	-44.1	177.1	-104.9	-172.7	68	0	0	112.7	R203 K204 A205	M201-R203 VanDerWaalsContact C-N 3.33Å; M201-R203 PolarHBondContact O-N 3.12Å; M201-K204 PolarHBondContact O-N 3.46Å; M201-A205 PolarHBondContact O-N 3.2Å; M201-A205 VanDerWaalsContact O-N 3.12Å
202	R	45.7	Very low	51	Low	197 Å²	197	145.6 Å²	145.6	74%	0.743	69%	0.692	S	S	*	*	H	α-helix	trans	-63.8	-33.1	-179.5	-90	-179.3	143.4	178.1	-5.4	113.6	I198 R206	I198-R202 PolarHBondContact O-N 3.34Å; R202-R206 PolarHBondContact O-N 3.36Å
203	R	47.1	Very low	52.7	Low	215 Å²	215	144 Å²	144	81%	0.811	68%	0.682	S	S	*	*	H	α-helix	trans	-72	-36.5	176.2	-70.2	-174.4	-178.2	175.1	2.8	112.6	M201	M201-R203 VanDerWaalsContact C-N 3.33Å; M201-R203 PolarHBondContact O-N 3.12Å
204	K	49.6	Very low	54.5	Low	162 Å²	162	140.6 Å²	140.6	70%	0.704	66%	0.663	S	S	*	*	H	α-helix	trans	-67.7	-37.5	174.9	-72.5	-170.4	175.9	-176.4	0	112.2	K200 M201 R206 S207 N208	K200-K204 PolarHBondContact O-N 3.44Å; M201-K204 PolarHBondContact O-N 3.46Å; K204-R206 PolarHBondContact O-N 2.74Å; K204-S207 PolarHBondContact O-N 3.22Å; K204-S207 PolarHBondContact O-OG 3.09Å; K204-N208 PolarHBondContact O-N 3.37Å
205	A	51.3	Low	55.9	Low	65 Å²	65	137.7 Å²	137.7	54%	0.537	65%	0.647	S	S	.	*	H	α-helix	trans	-62.8	-37.3	179.2	0	0	0	0	0	113.7	M201 N208	M201-A205 PolarHBondContact O-N 3.2Å; M201-A205 VanDerWaalsContact O-N 3.12Å; A205-N208 PolarHBondContact O-N 3.23Å
206	R	51.7	Low	57.1	Low	209 Å²	209	133.5 Å²	133.5	79%	0.789	63%	0.63	S	S	*	*	H	α-helix	trans	-71	-31.7	177.2	-71.4	-172.9	176	-175.7	-0.1	113.3	R202 K204	R202-R206 PolarHBondContact O-N 3.36Å; K204-R206 PolarHBondContact O-N 2.74Å
207	S	56.3	Low	58.4	Low	79 Å²	79	130.4 Å²	130.4	55%	0.552	62%	0.616	S	S	*	*	H	α-helix	trans	-69.6	-34	176.2	86	0	0	0	0	112.4	K204 Y211	K204-S207 PolarHBondContact O-N 3.22Å; K204-S207 PolarHBondContact O-OG 3.09Å; S207-Y211 WeakPolarHBondContact O-CB 3.46Å; S207-Y211 PolarHBondContact O-N 3.04Å; S207-Y211 VanDerWaalsContact O-N 3.09Å
208	N	60.4	Low	59.5	Low	105 Å²	105	133 Å²	133	56%	0.561	62%	0.619	S	S	*	*	H	α-helix	trans	-68.9	-37.8	-179.2	-164.2	-9.1	0	0	0	112.2	K204 A205 Y211 R212	K204-N208 PolarHBondContact O-N 3.37Å; A205-N208 PolarHBondContact O-N 3.23Å; N208-Y211 PolarHBondContact O-N 3.38Å; N208-R212 WeakPolarHBondContact O-CB 3.36Å; N208-R212 PolarHBondContact O-N 3.1Å
209	N	65.7	Low	60.2	Low	95 Å²	95	133.5 Å²	133.5	51%	0.508	62%	0.617	S	S	.	*	H	α-helix	trans	-69.1	-38	179.7	-157.6	-6.9	0	0	0	112.5	R212 K213	N209-R212 PolarHBondContact O-N 3.24Å; N209-K213 PolarHBondContact O-N 3.48Å
210	N	67.3	Low	60.8	Low	118 Å²	118	135.1 Å²	135.1	63%	0.631	61%	0.614	S	S	*	*	H	α-helix	trans	-67.8	-39.8	173.7	-91	-18.2	0	0	0	112.2	K213 L214	N210-K213 PolarHBondContact O-N 3.27Å; N210-L214 WeakPolarHBondContact O-CB 3.04Å; N210-L214 PolarHBondContact O-N 2.99Å
211	Y	71.6	Confident	61.3	Low	139 Å²	139	134.4 Å²	134.4	55%	0.545	61%	0.607	S	S	.	*	H	α-helix	trans	-63.3	-43	174.9	-171.1	-107.8	0	0	0	112	S207 N208 L214 Q215	S207-Y211 WeakPolarHBondContact O-CB 3.46Å; S207-Y211 PolarHBondContact O-N 3.04Å; S207-Y211 VanDerWaalsContact O-N 3.09Å; N208-Y211 PolarHBondContact O-N 3.38Å; Y211-L214 PolarHBondContact O-N 3.2Å; Y211-Q215 HydrophobicContact CD1-CG 4.49Å; Y211-Q215 HydrophobicContact CE1-CG 4.22Å; Y211-Q215 PolarHBondContact O-N 3.33Å; Y211-Q215 PolarHBondContact OH-NE2 3.48Å
212	R	68.5	Low	61.7	Low	170 Å²	170	131.7 Å²	131.7	64%	0.642	60%	0.599	S	S	*	*	H	α-helix	trans	-62	-44.3	174.8	-172.2	177.4	176.8	-174.9	-1.3	112.3	N208 N209 L214 Q215 L216	N208-R212 WeakPolarHBondContact O-CB 3.36Å; N208-R212 PolarHBondContact O-N 3.1Å; N209-R212 PolarHBondContact O-N 3.24Å; R212-L214 VanDerWaalsContact C-N 3.34Å; R212-L214 PolarHBondContact O-N 2.95Å; R212-Q215 PolarHBondContact O-N 3.49Å; R212-L216 HydrophobicContact CG-CD1 4.36Å; R212-L216 WeakPolarHBondContact O-CG 3.44Å; R212-L216 PolarHBondContact O-N 3.04Å
213	K	73.4	Confident	62.1	Low	130 Å²	130	127.2 Å²	127.2	57%	0.565	59%	0.593	S	S	*	*	H	α-helix	trans	-60.9	-40.7	174.1	-81.3	-177.4	178.9	178.8	0	112.2	N209 N210 L216 K217	N209-K213 PolarHBondContact O-N 3.48Å; N210-K213 PolarHBondContact O-N 3.27Å; K213-L216 PolarHBondContact O-N 2.93Å; K213-K217 PolarHBondContact O-N 3.24Å
214	L	74.1	Confident	62.4	Low	90 Å²	90	122.6 Å²	122.6	47%	0.471	58%	0.581	S	S	.	*	H	α-helix	trans	-65.5	-42.2	176.9	-172.9	66.6	0	0	0	111.8	N210 Y211 R212 K217 K218	N210-L214 WeakPolarHBondContact O-CB 3.04Å; N210-L214 PolarHBondContact O-N 2.99Å; Y211-L214 PolarHBondContact O-N 3.2Å; R212-L214 VanDerWaalsContact C-N 3.34Å; R212-L214 PolarHBondContact O-N 2.95Å; L214-K217 PolarHBondContact O-N 3.35Å; L214-K218 PolarHBondContact O-N 2.85Å
215	Q	73.7	Confident	62.6	Low	91 Å²	91	124 Å²	124	43%	0.425	59%	0.587	S	S	.	*	H	α-helix	trans	-64.4	-40.5	175.1	-73.6	-153.8	3	0	0	112.7	Y211 R212 K218 K219	Y211-Q215 HydrophobicContact CD1-CG 4.49Å; Y211-Q215 HydrophobicContact CE1-CG 4.22Å; Y211-Q215 PolarHBondContact O-N 3.33Å; Y211-Q215 PolarHBondContact OH-NE2 3.48Å; R212-Q215 PolarHBondContact O-N 3.49Å; Q215-K218 PolarHBondContact O-N 2.85Å; Q215-K219 PolarHBondContact O-N 2.99Å
216	L	71.1	Confident	62.9	Low	103 Å²	103	129 Å²	129	54%	0.539	60%	0.596	S	S	.	*	H	α-helix	trans	-63.8	-40.6	175.4	-71.7	170.4	0	0	0	111.7	R212 K213 K219 K220	R212-L216 HydrophobicContact CG-CD1 4.36Å; R212-L216 WeakPolarHBondContact O-CG 3.44Å; R212-L216 PolarHBondContact O-N 3.04Å; K213-L216 PolarHBondContact O-N 2.93Å; L216-K219 PolarHBondContact O-N 3.15Å; L216-K220 WeakPolarHBondContact O-CB 3.48Å; L216-K220 PolarHBondContact O-N 3.39Å
217	K	72.2	Confident	63.1	Low	135 Å²	135	127 Å²	127	59%	0.587	59%	0.593	S	S	*	*	H	α-helix	trans	-59.8	-51.7	171.2	-82	-174.6	177.4	-178	0	110.9	K213 L214 K219 K220 Y221	K213-K217 PolarHBondContact O-N 3.24Å; L214-K217 PolarHBondContact O-N 3.35Å; K217-K219 PolarHBondContact O-N 3.01Å; K217-K220 WeakPolarHBondContact O-CB 3.31Å; K217-K220 PolarHBondContact O-N 2.69Å; K217-K220 VanDerWaalsContact O-N 3.09Å; K217-Y221 HydrophobicContact CB-CD2 4.43Å; K217-Y221 HydrophobicContact CB-CE2 4.2Å; K217-Y221 WeakPolarHBondContact O-CD2 3.48Å; K217-Y221 PolarHBondContact O-N 3.39Å
218	K	67.8	Low	63.2	Low	136 Å²	136	132.4 Å²	132.4	59%	0.591	61%	0.607	S	S	*	*	H	α-helix	trans	-57.4	-44.2	177.7	-75	-174.6	177.6	-176.2	0	112.1	L214 Q215 K220 Y221 V222	L214-K218 PolarHBondContact O-N 2.85Å; Q215-K218 PolarHBondContact O-N 2.85Å; K218-K220 PolarHBondContact O-N 2.91Å; K218-Y221 PolarHBondContact O-N 3.23Å; K218-V222 VanDerWaalsContact O-CG2 3.31Å; K218-V222 WeakPolarHBondContact O-CG2 3.4Å; K218-V222 PolarHBondContact O-N 3.36Å
219	K	61.5	Low	63.2	Low	142 Å²	142	137.2 Å²	137.2	62%	0.617	62%	0.623	S	S	*	*	H	α-helix	trans	-59.4	-43.7	173.6	-84.3	-171.8	175.1	-177.7	0	112	Q215 L216 K217 Y221 V222 V223	Q215-K219 PolarHBondContact O-N 2.99Å; L216-K219 PolarHBondContact O-N 3.15Å; K217-K219 PolarHBondContact O-N 3.01Å; K219-Y221 VanDerWaalsContact C-N 3.31Å; K219-Y221 PolarHBondContact O-N 2.92Å; K219-V222 PolarHBondContact O-N 3.26Å; K219-V223 WeakPolarHBondContact O-CB 3.2Å; K219-V223 VanDerWaalsContact O-CG2 3.28Å; K219-V223 WeakPolarHBondContact O-CG2 2.99Å; K219-V223 PolarHBondContact O-N 3.04Å
220	K	59.4	Low	62.7	Low	148 Å²	148	138 Å²	138	64%	0.643	63%	0.627	S	S	*	*	H	α-helix	trans	-61.5	-38.7	177	-154.1	175.2	-174.8	179.8	0	111.7	L216 K217 K218 Q224	L216-K220 WeakPolarHBondContact O-CB 3.48Å; L216-K220 PolarHBondContact O-N 3.39Å; K217-K220 WeakPolarHBondContact O-CB 3.31Å; K217-K220 PolarHBondContact O-N 2.69Å; K217-K220 VanDerWaalsContact O-N 3.09Å; K218-K220 PolarHBondContact O-N 2.91Å; K220-Q224 WeakPolarHBondContact O-CB 3.4Å; K220-Q224 WeakPolarHBondContact O-CG 3.24Å; K220-Q224 PolarHBondContact O-N 2.94Å; K220-Q224 VanDerWaalsContact O-N 3.08Å
221	Y	52.8	Low	62.4	Low	151 Å²	151	135.5 Å²	135.5	59%	0.592	62%	0.618	S	S	*	*	H	α-helix	trans	-71.2	-37	175.2	-71.8	-66.8	0	0	0	113.5	K217 K218 K219 K225	K217-Y221 HydrophobicContact CB-CD2 4.43Å; K217-Y221 HydrophobicContact CB-CE2 4.2Å; K217-Y221 WeakPolarHBondContact O-CD2 3.48Å; K217-Y221 PolarHBondContact O-N 3.39Å; K218-Y221 PolarHBondContact O-N 3.23Å; K219-Y221 VanDerWaalsContact C-N 3.31Å; K219-Y221 PolarHBondContact O-N 2.92Å; Y221-K225 PolarHBondContact O-N 3.44Å; Y221-K225 VanDerWaalsContact O-N 3.11Å
222	V	54.3	Low	61.8	Low	86 Å²	86	134.2 Å²	134.2	52%	0.521	63%	0.625	S	S	.	*	H	α-helix	trans	-70.7	-38.2	177	173.4	0	0	0	0	111.5	K218 K219 K226	K218-V222 VanDerWaalsContact O-CG2 3.31Å; K218-V222 WeakPolarHBondContact O-CG2 3.4Å; K218-V222 PolarHBondContact O-N 3.36Å; K219-V222 PolarHBondContact O-N 3.26Å; V222-K226 PolarHBondContact O-N 3.14Å
223	V	53.7	Low	61.3	Low	102 Å²	102	128.6 Å²	128.6	62%	0.618	62%	0.615	S	S	*	*	H	α-helix	trans	-72	-34.1	177.3	175.8	0	0	0	0	111.6	K219	K219-V223 WeakPolarHBondContact O-CB 3.2Å; K219-V223 VanDerWaalsContact O-CG2 3.28Å; K219-V223 WeakPolarHBondContact O-CG2 2.99Å; K219-V223 PolarHBondContact O-N 3.04Å
224	Q	54.1	Low	60.6	Low	119 Å²	119	125.9 Å²	125.9	56%	0.556	61%	0.609	S	S	*	*	H	α-helix	trans	-72.6	-36.4	175.7	-79.7	-175.2	-14.4	0	0	113.4	K220 K226 K227	K220-Q224 WeakPolarHBondContact O-CB 3.4Å; K220-Q224 WeakPolarHBondContact O-CG 3.24Å; K220-Q224 PolarHBondContact O-N 2.94Å; K220-Q224 VanDerWaalsContact O-N 3.08Å; Q224-K226 VanDerWaalsContact C-N 3.28Å; Q224-K226 PolarHBondContact O-N 2.72Å; Q224-K227 PolarHBondContact O-N 3.12Å
225	K	54.4	Low	59.9	Low	192 Å²	192	129 Å²	129	84%	0.835	62%	0.615	S	S	*	*	H	α-helix	trans	-69.9	-23.1	174.9	-77.1	-167.7	175.4	-172	0	113.5	Y221	Y221-K225 PolarHBondContact O-N 3.44Å; Y221-K225 VanDerWaalsContact O-N 3.11Å
226	K	55.9	Low	59.2	Low	169 Å²	169	129.9 Å²	129.9	74%	0.735	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	16.8	177.2	-74.3	-167	176.4	-175.7	0	114.8	V222 Q224 K228	V222-K226 PolarHBondContact O-N 3.14Å; Q224-K226 VanDerWaalsContact C-N 3.28Å; Q224-K226 PolarHBondContact O-N 2.72Å; K226-K228 PolarHBondContact O-N 2.79Å
227	K	56.2	Low	58.6	Low	167 Å²	167	134.1 Å²	134.1	73%	0.726	63%	0.631	S	S	*	*			trans	-68.6	84.8	159.6	-73	-168.3	177.4	-174.1	0	107.9	Q224 K229	Q224-K227 PolarHBondContact O-N 3.12Å; K227-K229 PolarHBondContact O-N 3.26Å; K227-K229 VanDerWaalsContact O-N 3.08Å
228	K	59.9	Low	58.1	Low	193 Å²	193	135.9 Å²	135.9	84%	0.839	64%	0.638	S	S	*	*			trans	-44.7	119.8	167	-71.3	-174.7	176.4	-176.7	0	106.3	K226 L230	K226-K228 PolarHBondContact O-N 2.79Å; K228-L230 VanDerWaalsContact C-N 3.28Å; K228-L230 PolarHBondContact O-N 2.76Å
229	K	59.2	Low	57.6	Low	205 Å²	205	137.7 Å²	137.7	89%	0.891	64%	0.641	S	S	*	*			trans	-54	103.8	164.8	-71.5	-176.7	178.9	-179.3	0	104.8	K227 S231	K227-K229 PolarHBondContact O-N 3.26Å; K227-K229 VanDerWaalsContact O-N 3.08Å; K229-S231 PolarHBondContact O-N 3.09Å
230	L	56.4	Low	57.5	Low	113 Å²	113	137.3 Å²	137.3	59%	0.592	64%	0.642	S	S	*	*			trans	-53.7	114.8	169.5	-84.5	157.7	0	0	0	105	K228 T232 V234	K228-L230 VanDerWaalsContact C-N 3.28Å; K228-L230 PolarHBondContact O-N 2.76Å; L230-T232 PolarHBondContact O-N 3.22Å; L230-V234 HydrophobicContact CD2-CB 4.19Å; L230-V234 HydrophobicContact CD2-CG1 3.72Å
231	S	59.2	Low	57.4	Low	65 Å²	65	132.4 Å²	132.4	46%	0.455	63%	0.633	S	S	.	*			trans	-48.2	137.5	174.5	166.3	0	0	0	0	108.2	K229 A233 V234 R235	K229-S231 PolarHBondContact O-N 3.09Å; S231-A233 PolarHBondContact O-N 2.77Å; S231-A233 PolarHBondContact OG-N 3.45Å; S231-V234 PolarHBondContact O-N 3.48Å; S231-R235 PolarHBondContact O-N 3.27Å
232	T	60	Low	57.6	Low	111 Å²	111	128.3 Å²	128.3	68%	0.681	63%	0.631	S	S	*	*	H	α-helix	trans	-47.5	-32	175.3	29.5	0	0	0	0	111.6	L230 R235 L236	L230-T232 PolarHBondContact O-N 3.22Å; T232-R235 PolarHBondContact O-N 3.46Å; T232-L236 PolarHBondContact O-N 3.48Å
233	A	57.9	Low	57.7	Low	53 Å²	53	131.9 Å²	131.9	44%	0.438	64%	0.639	S	S	.	*	H	α-helix	trans	-64.4	-37.1	174.7	0	0	0	0	0	114.7	S231 R237	S231-A233 PolarHBondContact O-N 2.77Å; S231-A233 PolarHBondContact OG-N 3.45Å; A233-R237 PolarHBondContact O-N 3.47Å
234	V	59.7	Low	57.8	Low	73 Å²	73	132.3 Å²	132.3	44%	0.442	64%	0.642	S	S	.	*	H	α-helix	trans	-75.4	-29.8	177.1	-179.8	0	0	0	0	111	L230 S231	L230-V234 HydrophobicContact CD2-CB 4.19Å; L230-V234 HydrophobicContact CD2-CG1 3.72Å; S231-V234 PolarHBondContact O-N 3.48Å
235	R	58.6	Low	57.8	Low	156 Å²	156	133.4 Å²	133.4	59%	0.589	65%	0.651	S	S	*	*	H	α-helix	trans	-68.7	-46.4	175.1	-162.4	175.4	-75	177.9	-3.5	110.5	S231 T232 R237 K238 W239	S231-R235 PolarHBondContact O-N 3.27Å; T232-R235 PolarHBondContact O-N 3.46Å; R235-R237 PolarHBondContact O-N 2.95Å; R235-K238 PolarHBondContact O-N 3.21Å; R235-W239 VanDerWaalsContact O-CD1 3.26Å; R235-W239 PolarHBondContact O-N 3.04Å
236	L	58.4	Low	57.2	Low	108 Å²	108	138.3 Å²	138.3	57%	0.565	67%	0.666	S	S	*	*	H	α-helix	trans	-64.2	-38.7	179.8	-85.8	153.7	0	0	0	114.1	T232 K238 W239 Q240	T232-L236 PolarHBondContact O-N 3.48Å; L236-K238 VanDerWaalsContact C-N 3.35Å; L236-K238 PolarHBondContact O-N 3.29Å; L236-W239 PolarHBondContact O-N 3.32Å; L236-W239 VanDerWaalsContact O-N 3.14Å; L236-Q240 PolarHBondContact O-N 3.32Å
237	R	59.3	Low	57.3	Low	193 Å²	193	136.8 Å²	136.8	73%	0.728	66%	0.663	S	S	*	*	H	α-helix	trans	-68.1	-31.8	-179.7	-148.5	-176.4	-68.4	172.9	-4.4	113.3	A233 R235 W239 G241	A233-R237 PolarHBondContact O-N 3.47Å; R235-R237 PolarHBondContact O-N 2.95Å; R237-W239 VanDerWaalsContact C-N 3.34Å; R237-G241 PolarHBondContact O-N 3.28Å; R237-G241 VanDerWaalsContact O-N 3.11Å
238	K	60.7	Low	57.3	Low	171 Å²	171	135.2 Å²	135.2	74%	0.743	66%	0.659	S	S	*	*	H	α-helix	trans	-70.2	-30	171.9	-82	-164.4	173.4	-165.5	0	113.1	R235 L236	R235-K238 PolarHBondContact O-N 3.21Å; L236-K238 VanDerWaalsContact C-N 3.35Å; L236-K238 PolarHBondContact O-N 3.29Å
239	W	57.6	Low	57.2	Low	175 Å²	175	132 Å²	132	66%	0.663	65%	0.649	S	S	*	*	H	α-helix	trans	-74.6	-40.4	173.5	-82	88.2	0	0	0	111.1	R235 L236 R237 A242 F243	R235-W239 VanDerWaalsContact O-CD1 3.26Å; R235-W239 PolarHBondContact O-N 3.04Å; L236-W239 PolarHBondContact O-N 3.32Å; L236-W239 VanDerWaalsContact O-N 3.14Å; R237-W239 VanDerWaalsContact C-N 3.34Å; W239-A242 PolarHBondContact O-N 2.96Å; W239-F243 HydrophobicContact CE3-CE2 4.14Å; W239-F243 HydrophobicContact CZ3-CE2 4.46Å; W239-F243 WeakPolarHBondContact O-CD2 3.44Å
240	Q	59	Low	57.1	Low	133 Å²	133	127.7 Å²	127.7	62%	0.621	64%	0.635	S	S	*	*	H	α-helix	trans	-69.8	-32.9	178.6	-74.8	173.5	-25.2	0	0	114.1	L236 A242	L236-Q240 PolarHBondContact O-N 3.32Å; Q240-A242 VanDerWaalsContact C-N 3.28Å; Q240-A242 PolarHBondContact O-N 3.32Å
241	G	58	Low	57.1	Low	45 Å²	45	128.6 Å²	128.6	46%	0.464	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.5	-8.5	175.6	0	0	0	0	0	115.2	R237 T244	R237-G241 PolarHBondContact O-N 3.28Å; R237-G241 VanDerWaalsContact O-N 3.11Å; G241-T244 PolarHBondContact O-OG1 3.48Å
242	A	57.8	Low	57	Low	66 Å²	66	132.9 Å²	132.9	55%	0.545	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.1	-9.3	176.9	0	0	0	0	0	113	W239 Q240	W239-A242 PolarHBondContact O-N 2.96Å; Q240-A242 VanDerWaalsContact C-N 3.28Å; Q240-A242 PolarHBondContact O-N 3.32Å
243	F	55.5	Low	56.8	Low	160 Å²	160	134.4 Å²	134.4	70%	0.702	65%	0.648	S	S	*	*	S	Bend	trans	-103.9	6.3	179.5	-84	-82.6	0	0	0	113.8	W239	W239-F243 HydrophobicContact CE3-CE2 4.14Å; W239-F243 HydrophobicContact CZ3-CE2 4.46Å; W239-F243 WeakPolarHBondContact O-CD2 3.44Å
244	T	56.1	Low	56.7	Low	111 Å²	111	140.7 Å²	140.7	68%	0.681	66%	0.664	S	S	*	*	S	Bend	trans	-105.5	24.7	-179.6	47.7	0	0	0	0	113.7	G241	G241-T244 PolarHBondContact O-OG1 3.48Å
245	I	53.7	Low	56.4	Low	142 Å²	142	146.3 Å²	146.3	73%	0.728	68%	0.683	S	S	*	*			trans	-126.8	34.3	177.2	-42.9	179.3	0	0	0	110.9
246	Y	42.6	Very low	56.2	Low	296 Å²	296	145.5 Å²	145.5	100%	1.161	69%	0.691	S	S	*	*			trans	-134.5	0	165.8	-83	-77.2	0	0	0	109.6

Retrieved 246 of 246 residues in 90.4 ms (Link to these results)

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