A0A096MNV0_PAPAN Loading...

RNA-binding motif protein, X-linked 2

Involved in pre-mRNA splicing as component of the activated spliceosome. As a component of the minor spliceosome, involved in the splicing of U12-type introns in pre-mRNAs.

AlphaFold DB (A0A2K5KKM9), UniProt , Accession A0A096MNV0, Species PAPAN (Papio anubis, Olive baboon), Gene RBMX2, Length 322 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	57.5	Low	84.8	Confident	202 Å²	202	83.5 Å²	83.5	100%	0.995	43%	0.431	S	S	*	.				0	137.8	0	-83.6	-176.1	-174.8	0	0	109.5
2	N	80.8	Confident	85.6	Confident	86 Å²	86	82.8 Å²	82.8	46%	0.46	42%	0.424	S	S	.	.			trans	-68.4	132.3	177.6	-177.5	-21.1	0	0	0	109.8	L4 T5	N2-L4 PolarHBondContact O-N 2.92Å; N2-L4 PolarHBondContact OD1-N 3.11Å; N2-T5 HydrophobicContact CB-CG2 3.89Å; N2-T5 PolarHBondContact O-N 3.41Å; N2-T5 PolarHBondContact O-OG1 2.7Å
3	P	70.8	Confident	86.2	Confident	87 Å²	87	81.5 Å²	81.5	57%	0.565	42%	0.419	S	S	*	.	H	α-helix	trans	-61.6	-30.4	179.8	23.9	-34.8	0	0	0	113.2	K6	P3-K6 PolarHBondContact O-N 2.93Å
4	L	82.3	Confident	86.7	Confident	90 Å²	90	77.4 Å²	77.4	47%	0.471	40%	0.397	S	S	.	.	H	α-helix	trans	-74.1	-26.9	179.5	-63.7	173.4	0	0	0	112.7	N2 K6 V7 K8 T106	N2-L4 PolarHBondContact O-N 2.92Å; N2-L4 PolarHBondContact OD1-N 3.11Å; L4-K6 VanDerWaalsContact C-N 3.29Å; L4-V7 PolarHBondContact O-N 2.91Å; L4-K8 PolarHBondContact O-N 2.87Å; L4-T106 HydrophobicContact CD2-CG2 4.22Å
5	T	88.3	Confident	87.2	Confident	60 Å²	60	81.1 Å²	81.1	37%	0.368	41%	0.412	S	S	.	.	H	α-helix	trans	-70.1	-31.7	176	56.7	0	0	0	0	110.9	N2 K8 L9	N2-T5 HydrophobicContact CB-CG2 3.89Å; N2-T5 PolarHBondContact O-N 3.41Å; N2-T5 PolarHBondContact O-OG1 2.7Å; T5-K8 PolarHBondContact O-N 3.16Å; T5-L9 VanDerWaalsContact O-CG 3.25Å; T5-L9 WeakPolarHBondContact O-CG 3.2Å; T5-L9 PolarHBondContact O-N 3.07Å
6	K	88.9	Confident	87.6	Confident	76 Å²	76	84.8 Å²	84.8	33%	0.33	42%	0.42	S	S	.	.	H	α-helix	trans	-64.4	-41.8	175.5	-67.4	-169.9	174	-163.9	0	112.7	P3 L4 K8 L9 I10	P3-K6 PolarHBondContact O-N 2.93Å; L4-K6 VanDerWaalsContact C-N 3.29Å; K6-K8 VanDerWaalsContact C-N 3.32Å; K6-K8 PolarHBondContact O-N 2.87Å; K6-L9 PolarHBondContact O-N 2.81Å; K6-I10 WeakPolarHBondContact O-CG1 3.31Å; K6-I10 PolarHBondContact O-N 2.81Å; K6-I10 VanDerWaalsContact O-N 3.13Å
7	V	92.2	Very high	88	Confident	11 Å²	11	81.9 Å²	81.9	7%	0.067	41%	0.405	C	S	.	.	H	α-helix	trans	-57.2	-48.9	175.3	173.7	0	0	0	0	110.2	L4 L9 I10 N11 N98 R108	L4-V7 PolarHBondContact O-N 2.91Å; V7-L9 VanDerWaalsContact C-N 3.35Å; V7-L9 PolarHBondContact O-N 3.26Å; V7-I10 PolarHBondContact O-N 2.72Å; V7-N11 PolarHBondContact O-N 2.97Å; V7-N11 VanDerWaalsContact O-N 3.1Å; V7-N11 PolarHBondContact O-OD1 3.24Å; V7-N98 PolarHBondContact O-ND2 3.31Å; V7-R108 HydrophobicContact CG2-CB 3.68Å; V7-R108 HydrophobicContact CG2-CG 3.94Å
8	K	93.1	Very high	88.3	Confident	138 Å²	138	84.2 Å²	84.2	60%	0.6	42%	0.424	S	S	*	.	H	α-helix	trans	-59.7	-43.4	177.8	-67.8	-176.1	178.1	-170	0	112.5	L4 T5 K6 I10 N11 E12	L4-K8 PolarHBondContact O-N 2.87Å; T5-K8 PolarHBondContact O-N 3.16Å; K6-K8 VanDerWaalsContact C-N 3.32Å; K6-K8 PolarHBondContact O-N 2.87Å; K8-I10 PolarHBondContact O-N 3.42Å; K8-N11 PolarHBondContact O-N 3.02Å; K8-E12 WeakPolarHBondContact O-CB 3.06Å; K8-E12 WeakPolarHBondContact O-CG 3.3Å; K8-E12 PolarHBondContact O-N 2.84Å
9	L	93.4	Very high	88.6	Confident	101 Å²	101	88.3 Å²	88.3	53%	0.529	44%	0.442	S	S	.	.	H	α-helix	trans	-62.4	-40.5	-179.3	-71.4	170	0	0	0	112.8	T5 K6 V7 L13	T5-L9 VanDerWaalsContact O-CG 3.25Å; T5-L9 WeakPolarHBondContact O-CG 3.2Å; T5-L9 PolarHBondContact O-N 3.07Å; K6-L9 PolarHBondContact O-N 2.81Å; V7-L9 VanDerWaalsContact C-N 3.35Å; V7-L9 PolarHBondContact O-N 3.26Å; L9-L13 WeakPolarHBondContact O-CB 3.29Å; L9-L13 PolarHBondContact O-N 3.23Å
10	I	92.4	Very high	88.9	Confident	18 Å²	18	90.9 Å²	90.9	9%	0.092	46%	0.456	C	S	.	.	H	α-helix	trans	-68	-43	177	-64.8	166.8	0	0	0	110.1	K6 V7 K8 E12 L13 N14 W28 V94 N98	K6-I10 WeakPolarHBondContact O-CG1 3.31Å; K6-I10 PolarHBondContact O-N 2.81Å; K6-I10 VanDerWaalsContact O-N 3.13Å; V7-I10 PolarHBondContact O-N 2.72Å; K8-I10 PolarHBondContact O-N 3.42Å; I10-E12 PolarHBondContact O-N 3.29Å; I10-L13 WeakPolarHBondContact O-CB 3.39Å; I10-L13 PolarHBondContact O-N 3.18Å; I10-L13 VanDerWaalsContact O-N 3.12Å; I10-N14 PolarHBondContact O-N 3.44Å; I10-W28 HydrophobicContact CG2-CH2 4.29Å; I10-W28 HydrophobicContact CG2-CZ2 4.04Å; I10-V94 HydrophobicContact CG2-CG1 4.35Å; I10-N98 WeakPolarHBondContact CB-ND2 3.17Å; I10-N98 WeakPolarHBondContact CG2-ND2 3.34Å
11	N	93.3	Very high	89.1	Confident	50 Å²	50	89.6 Å²	89.6	27%	0.267	47%	0.466	S	S	.	.	H	α-helix	trans	-64	-43.3	177.5	-68.1	1.3	0	0	0	111.6	V7 K8 L13 N14 E15 N98	V7-N11 PolarHBondContact O-N 2.97Å; V7-N11 VanDerWaalsContact O-N 3.1Å; V7-N11 PolarHBondContact O-OD1 3.24Å; K8-N11 PolarHBondContact O-N 3.02Å; N11-L13 VanDerWaalsContact C-N 3.25Å; N11-L13 PolarHBondContact O-N 3.39Å; N11-N14 PolarHBondContact O-N 2.95Å; N11-E15 WeakPolarHBondContact O-CB 3.34Å; N11-E15 WeakPolarHBondContact O-CG 3.23Å; N11-E15 PolarHBondContact O-N 3.23Å; N11-N98 PolarHBondContact OD1-ND2 3.04Å
12	E	94.6	Very high	90.8	Very high	74 Å²	74	82.4 Å²	82.4	35%	0.346	43%	0.433	S	S	.	.	H	α-helix	trans	-63.9	-29.8	173.8	-76.8	-175.6	-150	0	0	112.8	K8 I10 R16	K8-E12 WeakPolarHBondContact O-CB 3.06Å; K8-E12 WeakPolarHBondContact O-CG 3.3Å; K8-E12 PolarHBondContact O-N 2.84Å; I10-E12 PolarHBondContact O-N 3.29Å; E12-R16 WeakPolarHBondContact O-CB 3.21Å; E12-R16 VanDerWaalsContact O-CG 3.29Å; E12-R16 WeakPolarHBondContact O-CG 3.34Å; E12-R16 PolarHBondContact O-N 3.49Å; E12-R16 VanDerWaalsContact O-N 3.12Å; E12-R16 PolarHBondContact O-NH1 3.26Å; E12-R16 IonicContact OE2-CZ 3.72Å; E12-R16 IonicContact OE2-NH1 3.27Å; E12-R16 PolarHBondContact OE2-NH1 3.26Å; E12-R16 IonicContact OE2-NH2 3.21Å; E12-R16 PolarHBondContact OE2-NH2 3.28Å
13	L	93.6	Very high	91.2	Very high	67 Å²	67	81 Å²	81	35%	0.351	43%	0.434	S	S	.	.	H	α-helix	trans	-67.5	-48.6	174.3	-177.4	62.9	0	0	0	109.9	L9 I10 N11 E15 R16 E17 W28	L9-L13 WeakPolarHBondContact O-CB 3.29Å; L9-L13 PolarHBondContact O-N 3.23Å; I10-L13 WeakPolarHBondContact O-CB 3.39Å; I10-L13 PolarHBondContact O-N 3.18Å; I10-L13 VanDerWaalsContact O-N 3.12Å; N11-L13 VanDerWaalsContact C-N 3.25Å; N11-L13 PolarHBondContact O-N 3.39Å; L13-E15 PolarHBondContact O-N 3.18Å; L13-R16 PolarHBondContact O-N 3.32Å; L13-E17 PolarHBondContact O-N 3.41Å; L13-W28 HydrophobicContact CD2-CB 4.08Å; L13-W28 HydrophobicContact CD2-CD2 3.71Å; L13-W28 HydrophobicContact CD2-CE3 4.37Å; L13-W28 HydrophobicContact CD2-CG 3.54Å; L13-W28 HydrophobicContact CG-CG 4.22Å
14	N	92.9	Very high	91.9	Very high	23 Å²	23	84 Å²	84	12%	0.123	45%	0.445	C	S	.	.	H	α-helix	trans	-61.4	-44.2	177.5	-70.4	2.3	0	0	0	111.8	I10 N11 R16 E17 V18 W28 D95	I10-N14 PolarHBondContact O-N 3.44Å; N11-N14 PolarHBondContact O-N 2.95Å; N14-R16 VanDerWaalsContact C-N 3.31Å; N14-R16 PolarHBondContact O-N 3.21Å; N14-E17 PolarHBondContact O-N 2.91Å; N14-V18 WeakPolarHBondContact O-CG2 3.09Å; N14-V18 PolarHBondContact O-N 2.8Å; N14-W28 PolarHBondContact OD1-NE1 3.39Å; N14-D95 PolarHBondContact ND2-OD1 2.92Å
15	E	93.6	Very high	92.3	Very high	133 Å²	133	88.2 Å²	88.2	62%	0.621	46%	0.459	S	S	*	.	H	α-helix	trans	-59.8	-40.6	175.5	-74.1	171.9	-166.8	0	0	112	N11 L13 Q19	N11-E15 WeakPolarHBondContact O-CB 3.34Å; N11-E15 WeakPolarHBondContact O-CG 3.23Å; N11-E15 PolarHBondContact O-N 3.23Å; L13-E15 PolarHBondContact O-N 3.18Å; E15-Q19 WeakPolarHBondContact O-CB 3.39Å; E15-Q19 PolarHBondContact O-N 3.19Å
16	R	94.6	Very high	92.4	Very high	141 Å²	141	90.6 Å²	90.6	53%	0.532	47%	0.473	S	S	.	.	H	α-helix	trans	-68	-39.3	176.4	-77.8	-174.6	-170.4	94.5	3.2	112.5	E12 L13 N14 Q19 L20	E12-R16 WeakPolarHBondContact O-CB 3.21Å; E12-R16 VanDerWaalsContact O-CG 3.29Å; E12-R16 WeakPolarHBondContact O-CG 3.34Å; E12-R16 PolarHBondContact O-N 3.49Å; E12-R16 VanDerWaalsContact O-N 3.12Å; E12-R16 PolarHBondContact O-NH1 3.26Å; E12-R16 IonicContact OE2-CZ 3.72Å; E12-R16 IonicContact OE2-NH1 3.27Å; E12-R16 PolarHBondContact OE2-NH1 3.26Å; E12-R16 IonicContact OE2-NH2 3.21Å; E12-R16 PolarHBondContact OE2-NH2 3.28Å; L13-R16 PolarHBondContact O-N 3.32Å; N14-R16 VanDerWaalsContact C-N 3.31Å; N14-R16 PolarHBondContact O-N 3.21Å; R16-Q19 PolarHBondContact O-N 3.34Å; R16-L20 WeakPolarHBondContact O-CB 3.26Å; R16-L20 WeakPolarHBondContact O-CG 3.41Å; R16-L20 PolarHBondContact O-N 2.84Å
17	E	93.9	Very high	92.6	Very high	35 Å²	35	87.4 Å²	87.4	16%	0.164	46%	0.461	C	S	.	.	H	α-helix	trans	-62.8	-43.1	176.3	-73.2	-159.5	159.4	0	0	111.9	L13 N14 L20 G21 V22 S27 W28	L13-E17 PolarHBondContact O-N 3.41Å; N14-E17 PolarHBondContact O-N 2.91Å; E17-L20 PolarHBondContact O-N 2.68Å; E17-G21 PolarHBondContact O-N 2.79Å; E17-V22 HydrophobicContact CB-CB 4.19Å; E17-V22 HydrophobicContact CB-CG2 4.23Å; E17-V22 HydrophobicContact CG-CB 4.4Å; E17-V22 HydrophobicContact CG-CG2 4.28Å; E17-V22 PolarHBondContact O-N 2.77Å; E17-S27 VanDerWaalsContact OE1-CA 3.32Å; E17-S27 WeakPolarHBondContact OE1-CA 3.42Å; E17-S27 PolarHBondContact OE1-OG 3.33Å; E17-S27 VanDerWaalsContact OE2-CB 3.31Å; E17-S27 WeakPolarHBondContact OE2-CB 3.43Å; E17-S27 PolarHBondContact OE2-OG 3.48Å; E17-W28 VanDerWaalsContact CD-CD1 3.45Å; E17-W28 VanDerWaalsContact OE1-CD1 3.26Å; E17-W28 PolarHBondContact OE1-N 2.82Å
18	V	93.1	Very high	92.6	Very high	123 Å²	123	88.4 Å²	88.4	75%	0.745	46%	0.463	S	S	*	.	H	α-helix	trans	-63	-43.9	174.8	174.2	0	0	0	0	110.8	N14 L20 G21	N14-V18 WeakPolarHBondContact O-CG2 3.09Å; N14-V18 PolarHBondContact O-N 2.8Å; V18-L20 VanDerWaalsContact C-N 3.3Å; V18-L20 PolarHBondContact O-N 2.99Å; V18-G21 PolarHBondContact O-N 2.84Å
19	Q	94.4	Very high	92.6	Very high	163 Å²	163	82.4 Å²	82.4	76%	0.762	44%	0.437	S	S	*	.	H	α-helix	trans	-63.3	-35	179.7	-173.2	62.8	35.5	0	0	113.1	E15 R16	E15-Q19 WeakPolarHBondContact O-CB 3.39Å; E15-Q19 PolarHBondContact O-N 3.19Å; R16-Q19 PolarHBondContact O-N 3.34Å
20	L	94.4	Very high	92.5	Very high	139 Å²	139	78.9 Å²	78.9	73%	0.728	42%	0.421	S	S	*	.	H	α-helix	trans	-87.1	-7.6	178.9	-67.4	174.4	0	0	0	113.1	R16 E17 V18 V22	R16-L20 WeakPolarHBondContact O-CB 3.26Å; R16-L20 WeakPolarHBondContact O-CG 3.41Å; R16-L20 PolarHBondContact O-N 2.84Å; E17-L20 PolarHBondContact O-N 2.68Å; V18-L20 VanDerWaalsContact C-N 3.3Å; V18-L20 PolarHBondContact O-N 2.99Å; L20-V22 VanDerWaalsContact C-N 3.33Å; L20-V22 HydrophobicContact CB-CG2 3.89Å
21	G	92.5	Very high	92.5	Very high	64 Å²	64	85.2 Å²	85.2	66%	0.66	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	38.6	-177.1	0	0	0	0	0	112.6	E17 V18 A23	E17-G21 PolarHBondContact O-N 2.79Å; V18-G21 PolarHBondContact O-N 2.84Å; G21-A23 PolarHBondContact O-N 3.17Å
22	V	93	Very high	92.4	Very high	51 Å²	51	85.2 Å²	85.2	31%	0.309	45%	0.447	S	S	.	.			trans	-64.1	131.1	-179.5	-179.3	0	0	0	0	109.4	E17 L20 V26	E17-V22 HydrophobicContact CB-CB 4.19Å; E17-V22 HydrophobicContact CB-CG2 4.23Å; E17-V22 HydrophobicContact CG-CB 4.4Å; E17-V22 HydrophobicContact CG-CG2 4.28Å; E17-V22 PolarHBondContact O-N 2.77Å; L20-V22 VanDerWaalsContact C-N 3.33Å; L20-V22 HydrophobicContact CB-CG2 3.89Å; V22-V26 HydrophobicContact CG1-CG2 3.68Å
23	A	90.9	Very high	92.2	Very high	58 Å²	58	86.4 Å²	86.4	48%	0.479	45%	0.451	S	S	.	.			trans	-74	147.1	176.7	0	0	0	0	0	111.5	G21 K25 V26 S27	G21-A23 PolarHBondContact O-N 3.17Å; A23-K25 PolarHBondContact O-N 3.29Å; A23-V26 HydrophobicContact CB-CG2 4.17Å; A23-V26 WeakPolarHBondContact O-CG2 3.27Å; A23-V26 PolarHBondContact O-N 3.35Å; A23-S27 PolarHBondContact O-N 2.82Å; A23-S27 VanDerWaalsContact O-N 3.15Å
24	D	85.6	Confident	91.9	Very high	148 Å²	148	90.4 Å²	90.4	79%	0.791	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-32.4	-177.5	-50.9	-12.3	0	0	0	114.1	V26 S30	D24-V26 VanDerWaalsContact C-N 3.27Å; D24-V26 PolarHBondContact O-N 3.46Å; D24-S30 PolarHBondContact O-OG 3.19Å
25	K	88.8	Confident	91.8	Very high	180 Å²	180	89.7 Å²	89.7	78%	0.783	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-25.2	-178.7	-68.9	-176.4	-179	179.4	0	114	A23 S30 K33	A23-K25 PolarHBondContact O-N 3.29Å; K25-S30 VanDerWaalsContact C-OG 3.31Å; K25-S30 PolarHBondContact O-OG 3.44Å; K25-K33 PolarHBondContact O-NZ 2.82Å; K25-K33 VanDerWaalsContact O-NZ 3.16Å
26	V	91.2	Very high	91.8	Very high	109 Å²	109	83.3 Å²	83.3	66%	0.661	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116	2	-176.9	-69.4	0	0	0	0	112.5	V22 A23 D24	V22-V26 HydrophobicContact CG1-CG2 3.68Å; A23-V26 HydrophobicContact CB-CG2 4.17Å; A23-V26 WeakPolarHBondContact O-CG2 3.27Å; A23-V26 PolarHBondContact O-N 3.35Å; D24-V26 VanDerWaalsContact C-N 3.27Å; D24-V26 PolarHBondContact O-N 3.46Å
27	S	93.2	Very high	91.8	Very high	9 Å²	9	78.1 Å²	78.1	6%	0.063	42%	0.42	C	S	.	.	S	Bend	trans	-61	150.9	169.1	169.9	0	0	0	0	110.9	E17 A23 H29 S30	E17-S27 VanDerWaalsContact OE1-CA 3.32Å; E17-S27 WeakPolarHBondContact OE1-CA 3.42Å; E17-S27 PolarHBondContact OE1-OG 3.33Å; E17-S27 VanDerWaalsContact OE2-CB 3.31Å; E17-S27 WeakPolarHBondContact OE2-CB 3.43Å; E17-S27 PolarHBondContact OE2-OG 3.48Å; A23-S27 PolarHBondContact O-N 2.82Å; A23-S27 VanDerWaalsContact O-N 3.15Å; S27-H29 PolarHBondContact O-N 3.43Å; S27-H29 VanDerWaalsContact O-N 3.1Å; S27-H29 PolarHBondContact OG-CD2 2.98Å; S27-H29 PolarHBondContact OG-N 3.1Å; S27-S30 WeakPolarHBondContact O-CB 3.41Å; S27-S30 PolarHBondContact O-N 3.21Å; S27-S30 PolarHBondContact O-OG 2.99Å
28	W	92.8	Very high	91.8	Very high	32 Å²	32	76.4 Å²	76.4	12%	0.121	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-54.6	-26.2	177.4	75.1	-87.2	0	0	0	113.8	I10 L13 N14 E17 S30 E31 Y32 V94 H111	I10-W28 HydrophobicContact CG2-CH2 4.29Å; I10-W28 HydrophobicContact CG2-CZ2 4.04Å; L13-W28 HydrophobicContact CD2-CB 4.08Å; L13-W28 HydrophobicContact CD2-CD2 3.71Å; L13-W28 HydrophobicContact CD2-CE3 4.37Å; L13-W28 HydrophobicContact CD2-CG 3.54Å; L13-W28 HydrophobicContact CG-CG 4.22Å; N14-W28 PolarHBondContact OD1-NE1 3.39Å; E17-W28 VanDerWaalsContact CD-CD1 3.45Å; E17-W28 VanDerWaalsContact OE1-CD1 3.26Å; E17-W28 PolarHBondContact OE1-N 2.82Å; W28-S30 PolarHBondContact O-N 3.27Å; W28-E31 PolarHBondContact O-N 3.37Å; W28-Y32 HydrophobicContact CE3-CD2 4.32Å; W28-Y32 AromaticContact CE3-CE2 3.91Å; W28-Y32 HydrophobicContact CE3-CE2 3.91Å; W28-Y32 HydrophobicContact CZ3-CD2 4.31Å; W28-Y32 AromaticContact CZ3-CE2 3.86Å; W28-Y32 HydrophobicContact CZ3-CE2 3.86Å; W28-V94 HydrophobicContact CH2-CG1 3.7Å; W28-V94 HydrophobicContact CZ2-CG1 3.81Å; W28-H111 AromaticContact CH2-CD2 3.59Å; W28-H111 AromaticContact CZ3-CD2 3.62Å
29	H	92.5	Very high	91.9	Very high	12 Å²	12	72.3 Å²	72.3	6%	0.056	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-57.4	-22.5	172	-60	-65.4	0	0	0	113.1	S27 E31 Y32 I91 D95 H111	S27-H29 PolarHBondContact O-N 3.43Å; S27-H29 VanDerWaalsContact O-N 3.1Å; S27-H29 PolarHBondContact OG-CD2 2.98Å; S27-H29 PolarHBondContact OG-N 3.1Å; H29-E31 PolarHBondContact O-N 3.21Å; H29-Y32 PolarHBondContact O-N 3.48Å; H29-I91 HydrophobicContact CB-CD1 4.02Å; H29-I91 HydrophobicContact CB-CG1 4.01Å; H29-I91 HydrophobicContact CB-CG2 4.43Å; H29-D95 IonicContact CE1-OD1 3.14Å; H29-D95 PolarHBondContact CE1-OD1 3.47Å; H29-D95 IonicContact NE2-OD1 3.17Å; H29-D95 PolarHBondContact NE2-OD1 3.45Å; H29-D95 IonicContact NE2-OD2 3.62Å; H29-H111 AromaticContact CE1-NE2 3.69Å; H29-H111 AromaticContact CG-NE2 3.95Å; H29-H111 AromaticContact ND1-CD2 3.62Å; H29-H111 AromaticContact ND1-CE1 3.96Å; H29-H111 AromaticContact ND1-NE2 2.89Å; H29-H111 PolarHBondContact ND1-NE2 3.22Å
30	S	91.4	Very high	92	Very high	27 Å²	27	64.5 Å²	64.5	19%	0.189	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-60.7	-28.1	179.4	-67.5	0	0	0	0	114.1	D24 K25 S27 W28 Y32 K33	D24-S30 PolarHBondContact O-OG 3.19Å; K25-S30 VanDerWaalsContact C-OG 3.31Å; K25-S30 PolarHBondContact O-OG 3.44Å; S27-S30 WeakPolarHBondContact O-CB 3.41Å; S27-S30 PolarHBondContact O-N 3.21Å; S27-S30 PolarHBondContact O-OG 2.99Å; W28-S30 PolarHBondContact O-N 3.27Å; S30-Y32 PolarHBondContact O-N 3.26Å; S30-K33 WeakPolarHBondContact O-CD 3.32Å; S30-K33 WeakPolarHBondContact O-CG 3.28Å; S30-K33 PolarHBondContact O-N 3.4Å; S30-K33 VanDerWaalsContact OG-CE 3.26Å; S30-K33 WeakPolarHBondContact OG-CE 3.5Å; S30-K33 PolarHBondContact OG-NZ 2.74Å
31	E	91.3	Very high	91.9	Very high	151 Å²	151	58.2 Å²	58.2	71%	0.706	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-67.9	-19.3	177.1	-61.7	-177	-179.5	0	0	112.3	W28 H29	W28-E31 PolarHBondContact O-N 3.37Å; H29-E31 PolarHBondContact O-N 3.21Å
32	Y	92.1	Very high	91.9	Very high	50 Å²	50	56.4 Å²	56.4	20%	0.196	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-109	7.8	-175.6	-59.7	-81.6	0	0	0	113.5	W28 H29 S30 D34 S35 Q87 H111	W28-Y32 HydrophobicContact CE3-CD2 4.32Å; W28-Y32 AromaticContact CE3-CE2 3.91Å; W28-Y32 HydrophobicContact CE3-CE2 3.91Å; W28-Y32 HydrophobicContact CZ3-CD2 4.31Å; W28-Y32 AromaticContact CZ3-CE2 3.86Å; W28-Y32 HydrophobicContact CZ3-CE2 3.86Å; H29-Y32 PolarHBondContact O-N 3.48Å; S30-Y32 PolarHBondContact O-N 3.26Å; Y32-D34 PolarHBondContact O-N 3.05Å; Y32-S35 PolarHBondContact O-N 3.18Å; Y32-Q87 PolarHBondContact O-NE2 2.77Å; Y32-H111 HydrophobicContact CD1-CB 3.44Å; Y32-H111 VanDerWaalsContact CD1-CB 3.44Å; Y32-H111 HydrophobicContact CD2-CB 3.63Å; Y32-H111 AromaticContact CD2-CG 3.93Å; Y32-H111 HydrophobicContact CE1-CB 3.76Å; Y32-H111 HydrophobicContact CE2-CB 3.95Å; Y32-H111 HydrophobicContact CG-CB 3.35Å; Y32-H111 AromaticContact CG-CG 3.83Å
33	K	89.5	Confident	92	Very high	100 Å²	100	54 Å²	54	44%	0.435	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.7	-33.3	-175.9	-82.6	165.8	179.6	157.2	0	114.7	K25 S30 S35	K25-K33 PolarHBondContact O-NZ 2.82Å; K25-K33 VanDerWaalsContact O-NZ 3.16Å; S30-K33 WeakPolarHBondContact O-CD 3.32Å; S30-K33 WeakPolarHBondContact O-CG 3.28Å; S30-K33 PolarHBondContact O-N 3.4Å; S30-K33 VanDerWaalsContact OG-CE 3.26Å; S30-K33 WeakPolarHBondContact OG-CE 3.5Å; S30-K33 PolarHBondContact OG-NZ 2.74Å; K33-S35 VanDerWaalsContact C-N 3.35Å
34	D	89.1	Confident	92.1	Very high	150 Å²	150	51.8 Å²	51.8	80%	0.802	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	4.4	-175.9	-56.1	-40	0	0	0	113.6	Y32	Y32-D34 PolarHBondContact O-N 3.05Å
35	S	89.9	Confident	92.4	Very high	8 Å²	8	51.2 Å²	51.2	6%	0.056	25%	0.252	C	S	.	.			trans	-137.2	111.6	-177.8	-177.3	0	0	0	0	113.7	Y32 K33 W37 Q87 V112 S113	Y32-S35 PolarHBondContact O-N 3.18Å; K33-S35 VanDerWaalsContact C-N 3.35Å; S35-W37 PolarHBondContact O-N 3.33Å; S35-W37 VanDerWaalsContact O-N 3.11Å; S35-W37 PolarHBondContact OG-N 2.83Å; S35-Q87 VanDerWaalsContact O-CD 3.31Å; S35-Q87 PolarHBondContact O-NE2 2.93Å; S35-Q87 VanDerWaalsContact O-NE2 3.08Å; S35-Q87 PolarHBondContact O-OE1 3.02Å; S35-V112 VanDerWaalsContact CB-O 3.29Å; S35-V112 WeakPolarHBondContact CB-O 3.34Å; S35-V112 PolarHBondContact OG-O 3.43Å; S35-S113 VanDerWaalsContact CB-O 3.3Å; S35-S113 WeakPolarHBondContact CB-O 3.45Å; S35-S113 PolarHBondContact OG-O 2.98Å
36	A	93.3	Very high	92.5	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.247	C	C	.	.			trans	-81.4	25.1	175.9	0	0	0	0	0	113.9	C83 Y84 T90 C136	A36-C83 VanDerWaalsContact O-CA 3.27Å; A36-C83 WeakPolarHBondContact O-CA 3.49Å; A36-Y84 WeakPolarHBondContact CB-O 3.21Å; A36-Y84 PolarHBondContact O-N 2.89Å; A36-T90 HydrophobicContact CB-CG2 4.16Å; A36-C136 HydrophobicContact CB-CB 4.01Å
37	W	93.9	Very high	92.4	Very high	31 Å²	31	45 Å²	45	12%	0.117	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	134.1	179.7	-70.7	92.1	0	0	0	112.2	S35 N64 F81 L82 C83 V112 Y115 A117	S35-W37 PolarHBondContact O-N 3.33Å; S35-W37 VanDerWaalsContact O-N 3.11Å; S35-W37 PolarHBondContact OG-N 2.83Å; W37-N64 HydrophobicContact CH2-CB 3.87Å; W37-F81 HydrophobicContact CE3-CB 4.11Å; W37-F81 HydrophobicContact CZ3-CB 4.14Å; W37-L82 WeakPolarHBondContact CA-O 3.33Å; W37-C83 HydrophobicContact CD2-CB 3.68Å; W37-C83 HydrophobicContact CE3-CB 3.66Å; W37-C83 HydrophobicContact CG-CB 4.45Å; W37-C83 HydrophobicContact CH2-CB 3.71Å; W37-C83 HydrophobicContact CZ2-CB 3.71Å; W37-C83 HydrophobicContact CZ3-CB 3.68Å; W37-V112 HydrophobicContact CB-CB 4.18Å; W37-V112 PolarHBondContact O-N 3.31Å; W37-Y115 AromaticContact CD2-CD1 3.51Å; W37-Y115 HydrophobicContact CD2-CD1 3.51Å; W37-Y115 HydrophobicContact CD2-CE1 4.46Å; W37-Y115 HydrophobicContact CD2-CG 4.11Å; W37-Y115 AromaticContact CE2-CD1 3.85Å; W37-Y115 AromaticContact CE3-CD1 3.25Å; W37-Y115 HydrophobicContact CE3-CD1 3.25Å; W37-Y115 AromaticContact CE3-CE1 3.84Å; W37-Y115 HydrophobicContact CE3-CE1 3.84Å; W37-Y115 HydrophobicContact CE3-CG 4.05Å; W37-Y115 HydrophobicContact CG-CD1 4.26Å; W37-Y115 HydrophobicContact CG-CG 4.42Å; W37-Y115 AromaticContact CH2-CD1 3.73Å; W37-Y115 HydrophobicContact CH2-CD1 3.73Å; W37-Y115 AromaticContact CH2-CE1 3.86Å; W37-Y115 HydrophobicContact CH2-CE1 3.86Å; W37-Y115 AromaticContact CZ2-CD1 3.97Å; W37-Y115 HydrophobicContact CZ2-CD1 3.97Å; W37-Y115 HydrophobicContact CZ2-CE1 4.49Å; W37-Y115 AromaticContact CZ3-CD1 3.37Å; W37-Y115 HydrophobicContact CZ3-CD1 3.37Å; W37-Y115 AromaticContact CZ3-CE1 3.5Å; W37-Y115 HydrophobicContact CZ3-CE1 3.5Å; W37-Y115 VanDerWaalsContact CZ3-CE1 3.5Å; W37-A117 HydrophobicContact CH2-CB 4.09Å
38	I	95.4	Very high	92.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	146.9	170.8	62.3	164	0	0	0	111.2	L40 F56 F81 L82 Y84 T90 A93 V94 V109 D110	I38-L40 HydrophobicContact CD1-CD2 3.82Å; I38-L40 HydrophobicContact CD1-CG 4.34Å; I38-L40 HydrophobicContact CG1-CD2 4.49Å; I38-F56 HydrophobicContact CD1-CD1 4.2Å; I38-F56 HydrophobicContact CD1-CE1 4.29Å; I38-F81 WeakPolarHBondContact O-CA 3.3Å; I38-L82 HydrophobicContact CD1-CB 4.33Å; I38-L82 HydrophobicContact CD1-CD2 4.1Å; I38-L82 HydrophobicContact CG1-CB 3.88Å; I38-L82 HydrophobicContact CG1-CD2 4.04Å; I38-L82 PolarHBondContact N-O 3.4Å; I38-L82 PolarHBondContact O-N 3.25Å; I38-Y84 HydrophobicContact CD1-CE2 3.69Å; I38-Y84 HydrophobicContact CG1-CE2 4.23Å; I38-T90 HydrophobicContact CG2-CG2 4.1Å; I38-A93 HydrophobicContact CD1-CB 4.12Å; I38-V94 HydrophobicContact CG2-CG2 4.11Å; I38-V109 HydrophobicContact CB-CG1 4.45Å; I38-V109 HydrophobicContact CD1-CG1 3.97Å; I38-D110 CarbonylContact C-O 3.49Å; I38-D110 VanDerWaalsContact CA-O 3.28Å; I38-D110 WeakPolarHBondContact CA-O 3.32Å
39	F	95.3	Very high	92.4	Very high	36 Å²	36	48.5 Å²	48.5	16%	0.158	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	127.2	170.4	169.2	-95.2	0	0	0	109.2	F79 F81 V109 D110 V112	F39-F79 HydrophobicContact CE2-CB 3.79Å; F39-F79 HydrophobicContact CE2-CD2 4.2Å; F39-F79 HydrophobicContact CE2-CG 4.28Å; F39-F79 HydrophobicContact CZ-CB 4.01Å; F39-F81 HydrophobicContact CB-CD1 4.4Å; F39-F81 HydrophobicContact CB-CE1 4.22Å; F39-F81 HydrophobicContact CD2-CD1 4.31Å; F39-F81 AromaticContact CD2-CE1 3.7Å; F39-F81 HydrophobicContact CD2-CE1 3.7Å; F39-F81 AromaticContact CD2-CZ 3.83Å; F39-F81 HydrophobicContact CD2-CZ 3.83Å; F39-F81 HydrophobicContact CE2-CZ 4.38Å; F39-F81 HydrophobicContact CG-CE1 4.45Å; F39-V109 WeakPolarHBondContact O-CA 3.3Å; F39-D110 HydrophobicContact CB-CB 4.31Å; F39-D110 HydrophobicContact CD1-CB 4.26Å; F39-D110 PolarHBondContact N-O 3.23Å; F39-D110 PolarHBondContact O-N 3.04Å; F39-V112 HydrophobicContact CB-CG2 3.49Å; F39-V112 VanDerWaalsContact CB-CG2 3.49Å
40	L	94.9	Very high	92.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	122.8	172.4	-57.1	179.4	0	0	0	108.4	I38 L43 I52 F56 F79 C80 L82 R108 V109	I38-L40 HydrophobicContact CD1-CD2 3.82Å; I38-L40 HydrophobicContact CD1-CG 4.34Å; I38-L40 HydrophobicContact CG1-CD2 4.49Å; L40-L43 HydrophobicContact CB-CD1 4.05Å; L40-L43 HydrophobicContact CB-CG 4.5Å; L40-I52 HydrophobicContact CD1-CG2 3.72Å; L40-F56 HydrophobicContact CD1-CD1 4.41Å; L40-F56 HydrophobicContact CD1-CD2 4.04Å; L40-F56 HydrophobicContact CD1-CE1 4.11Å; L40-F56 HydrophobicContact CD1-CE2 3.7Å; L40-F56 HydrophobicContact CD1-CG 4.39Å; L40-F56 HydrophobicContact CD1-CZ 3.75Å; L40-F56 HydrophobicContact CD2-CD1 4.26Å; L40-F56 HydrophobicContact CD2-CE1 3.38Å; L40-F56 HydrophobicContact CD2-CE2 4.15Å; L40-F56 HydrophobicContact CD2-CZ 3.31Å; L40-F56 HydrophobicContact CG-CE1 4.39Å; L40-F56 HydrophobicContact CG-CZ 4.15Å; L40-F79 CarbonylContact O-C 3.58Å; L40-F79 WeakPolarHBondContact O-CA 3.33Å; L40-F79 VanDerWaalsContact O-CB 3.28Å; L40-F79 WeakPolarHBondContact O-CB 3.44Å; L40-C80 HydrophobicContact CB-CB 4.1Å; L40-C80 HydrophobicContact CD1-CB 4.32Å; L40-C80 PolarHBondContact N-O 3.05Å; L40-C80 PolarHBondContact O-N 2.82Å; L40-L82 HydrophobicContact CD1-CB 4.27Å; L40-L82 HydrophobicContact CD1-CD1 4.32Å; L40-R108 CarbonylContact C-O 3.58Å; L40-R108 WeakPolarHBondContact CA-O 3.29Å; L40-V109 HydrophobicContact CD2-CB 4.22Å; L40-V109 HydrophobicContact CD2-CG1 3.85Å; L40-V109 HydrophobicContact CD2-CG2 3.63Å
41	G	94.4	Very high	92.5	Very high	7 Å²	7	51.8 Å²	51.8	7%	0.072	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	155.8	179.1	0	0	0	0	0	112.3	L43 I107 R108	G41-L43 VanDerWaalsContact C-N 3.32Å; G41-I107 CarbonylContact O-C 3.56Å; G41-I107 VanDerWaalsContact O-CA 3.23Å; G41-I107 WeakPolarHBondContact O-CA 3.43Å; G41-R108 PolarHBondContact N-O 2.87Å; G41-R108 PolarHBondContact O-N 3.21Å
42	G	92.4	Very high	92.6	Very high	25 Å²	25	44.6 Å²	44.6	26%	0.258	23%	0.23	S	C	.	.	S	Bend	trans	77.8	19.7	178.7	0	0	0	0	0	113.5	G78 R105	G42-G78 PolarHBondContact N-O 3.37Å; G42-R105 WeakPolarHBondContact O-CD 3.45Å; G42-R105 VanDerWaalsContact O-CG 3.31Å; G42-R105 WeakPolarHBondContact O-CG 3.46Å
43	L	93.5	Very high	92.7	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	24%	0.237	C	C	.	.			trans	-66.9	142.7	175.6	-62.2	169.4	0	0	0	110.4	L40 G41 L47 I52 L67 G78 C80 I107	L40-L43 HydrophobicContact CB-CD1 4.05Å; L40-L43 HydrophobicContact CB-CG 4.5Å; G41-L43 VanDerWaalsContact C-N 3.32Å; L43-L47 HydrophobicContact CB-CD2 4.43Å; L43-L47 HydrophobicContact CD2-CD2 3.83Å; L43-I52 HydrophobicContact CD1-CD1 3.78Å; L43-I52 HydrophobicContact CD1-CG1 4.39Å; L43-L67 HydrophobicContact CD1-CD1 4.35Å; L43-G78 PolarHBondContact N-O 3.05Å; L43-G78 WeakPolarHBondContact O-CA 3.38Å; L43-C80 HydrophobicContact CD1-CB 3.7Å; L43-I107 HydrophobicContact CD2-CG2 3.91Å
44	P	92.8	Very high	92.9	Very high	12 Å²	12	45.1 Å²	45.1	8%	0.078	25%	0.247	C	C	.	.			trans	-57.7	143.4	168.5	-22.4	33.2	0	0	0	111.5	E46 L47 I102 K103 R105	P44-E46 PolarHBondContact O-N 2.93Å; P44-L47 VanDerWaalsContact O-CB 3.29Å; P44-L47 WeakPolarHBondContact O-CB 3.29Å; P44-L47 PolarHBondContact O-N 3.13Å; P44-L47 VanDerWaalsContact O-N 3.16Å; P44-I102 HydrophobicContact CG-CB 4.44Å; P44-I102 HydrophobicContact CG-CG2 4.21Å; P44-I102 WeakPolarHBondContact CG-O 3.35Å; P44-K103 HydrophobicContact CB-CB 4.47Å; P44-K103 HydrophobicContact CB-CD 4.35Å; P44-K103 HydrophobicContact CG-CB 3.97Å; P44-K103 HydrophobicContact CG-CD 4.44Å; P44-R105 HydrophobicContact CG-CB 4.41Å
45	Y	92.1	Very high	93.1	Very high	135 Å²	135	40.6 Å²	40.6	53%	0.529	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-19.3	-177.6	-60.9	-62.2	0	0	0	114.1	L47 S76	Y45-L47 VanDerWaalsContact C-N 3.31Å; Y45-S76 WeakPolarHBondContact CD1-O 3.47Å
46	E	90.6	Very high	93.3	Very high	145 Å²	145	40.2 Å²	40.2	68%	0.678	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-9.9	177	-60.9	170.8	-174	0	0	113.1	P44 K103	P44-E46 PolarHBondContact O-N 2.93Å; E46-K103 IonicContact OE2-NZ 2.91Å; E46-K103 PolarHBondContact OE2-NZ 3.47Å
47	L	90.9	Very high	93.3	Very high	14 Å²	14	43 Å²	43	7%	0.073	24%	0.241	C	C	.	.			trans	-76.2	132	-175.5	-154.5	84.3	0	0	0	109.9	L43 P44 Y45 D51 I52 I102	L43-L47 HydrophobicContact CB-CD2 4.43Å; L43-L47 HydrophobicContact CD2-CD2 3.83Å; P44-L47 VanDerWaalsContact O-CB 3.29Å; P44-L47 WeakPolarHBondContact O-CB 3.29Å; P44-L47 PolarHBondContact O-N 3.13Å; P44-L47 VanDerWaalsContact O-N 3.16Å; Y45-L47 VanDerWaalsContact C-N 3.31Å; L47-D51 HydrophobicContact CD1-CB 3.91Å; L47-D51 HydrophobicContact CG-CB 3.91Å; L47-I52 HydrophobicContact CD2-CD1 4.08Å; L47-I52 HydrophobicContact CD2-CG1 3.35Å; L47-I52 HydrophobicContact CG-CG1 4.15Å; L47-I102 HydrophobicContact CD1-CG2 4.09Å
48	T	92.8	Very high	93.4	Very high	60 Å²	60	47.9 Å²	47.9	37%	0.368	27%	0.265	S	S	.	.			trans	-94.9	166.3	177.8	67.4	0	0	0	0	111.8	G50 D51 I52	T48-G50 VanDerWaalsContact C-N 3.25Å; T48-G50 PolarHBondContact O-N 3.33Å; T48-D51 PolarHBondContact N-OD2 3.44Å; T48-D51 PolarHBondContact O-N 2.78Å; T48-D51 PolarHBondContact OG1-N 2.94Å; T48-D51 PolarHBondContact OG1-OD2 3.04Å; T48-I52 WeakPolarHBondContact O-CG1 3.42Å; T48-I52 PolarHBondContact O-N 3.2Å
49	E	92	Very high	93.3	Very high	54 Å²	54	50.5 Å²	50.5	25%	0.252	28%	0.276	S	S	.	.	H	α-helix	trans	-58.3	-40.1	173.5	-62.7	79.8	-172.4	0	0	111.3	D51 I52 I53 I65 L67 R69	E49-D51 PolarHBondContact O-N 2.78Å; E49-I52 WeakPolarHBondContact O-CB 3.08Å; E49-I52 PolarHBondContact O-N 2.8Å; E49-I53 VanDerWaalsContact O-CG1 3.32Å; E49-I53 WeakPolarHBondContact O-CG1 3.28Å; E49-I53 PolarHBondContact O-N 3.12Å; E49-I65 HydrophobicContact CB-CD1 4.14Å; E49-I65 HydrophobicContact CB-CG2 4.4Å; E49-L67 HydrophobicContact CG-CB 3.67Å; E49-L67 HydrophobicContact CG-CD2 4.06Å; E49-L67 WeakPolarHBondContact OE1-CB 3.49Å; E49-L67 WeakPolarHBondContact OE1-CD2 3.5Å; E49-R69 IonicContact OE1-CZ 3.14Å; E49-R69 IonicContact OE1-NE 2.82Å; E49-R69 PolarHBondContact OE1-NE 3.38Å; E49-R69 IonicContact OE1-NH2 2.77Å; E49-R69 PolarHBondContact OE1-NH2 3.32Å; E49-R69 IonicContact OE2-CZ 3.76Å; E49-R69 IonicContact OE2-NH2 2.68Å; E49-R69 PolarHBondContact OE2-NH2 2.98Å
50	G	93.3	Very high	93.2	Very high	36 Å²	36	49.7 Å²	49.7	37%	0.371	28%	0.278	S	S	.	.	H	α-helix	trans	-61.1	-44.4	178	0	0	0	0	0	112.3	T48 I52 I53 C54	T48-G50 VanDerWaalsContact C-N 3.25Å; T48-G50 PolarHBondContact O-N 3.33Å; G50-I52 VanDerWaalsContact C-N 3.3Å; G50-I52 PolarHBondContact O-N 2.87Å; G50-I53 PolarHBondContact O-N 2.89Å; G50-C54 PolarHBondContact O-N 3.48Å; G50-C54 PolarHBondContact O-SG 2.93Å
51	D	93.1	Very high	93.1	Very high	72 Å²	72	55.9 Å²	55.9	39%	0.385	31%	0.306	S	S	.	.	H	α-helix	trans	-62.2	-39.4	176.8	-58.3	-46.7	0	0	0	111.8	L47 T48 E49 C54 V55	L47-D51 HydrophobicContact CD1-CB 3.91Å; L47-D51 HydrophobicContact CG-CB 3.91Å; T48-D51 PolarHBondContact N-OD2 3.44Å; T48-D51 PolarHBondContact O-N 2.78Å; T48-D51 PolarHBondContact OG1-N 2.94Å; T48-D51 PolarHBondContact OG1-OD2 3.04Å; E49-D51 PolarHBondContact O-N 2.78Å; D51-C54 PolarHBondContact O-N 3.27Å; D51-V55 WeakPolarHBondContact O-CG2 3.34Å; D51-V55 PolarHBondContact O-N 3.12Å
52	I	93	Very high	93.1	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-64	-46.8	176.5	-63.1	164.5	0	0	0	109.3	L40 L43 L47 T48 E49 G50 C54 V55 F56 I65 L67 C80 L82	L40-I52 HydrophobicContact CD1-CG2 3.72Å; L43-I52 HydrophobicContact CD1-CD1 3.78Å; L43-I52 HydrophobicContact CD1-CG1 4.39Å; L47-I52 HydrophobicContact CD2-CD1 4.08Å; L47-I52 HydrophobicContact CD2-CG1 3.35Å; L47-I52 HydrophobicContact CG-CG1 4.15Å; T48-I52 WeakPolarHBondContact O-CG1 3.42Å; T48-I52 PolarHBondContact O-N 3.2Å; E49-I52 WeakPolarHBondContact O-CB 3.08Å; E49-I52 PolarHBondContact O-N 2.8Å; G50-I52 VanDerWaalsContact C-N 3.3Å; G50-I52 PolarHBondContact O-N 2.87Å; I52-C54 VanDerWaalsContact C-N 3.32Å; I52-C54 PolarHBondContact O-N 2.98Å; I52-V55 PolarHBondContact O-N 3.4Å; I52-F56 HydrophobicContact CG2-CD2 3.66Å; I52-F56 HydrophobicContact CG2-CE2 4.13Å; I52-F56 HydrophobicContact CG2-CG 4.48Å; I52-F56 WeakPolarHBondContact O-CB 3.42Å; I52-F56 VanDerWaalsContact O-CD2 3.28Å; I52-F56 WeakPolarHBondContact O-CD2 3.37Å; I52-F56 PolarHBondContact O-N 3.19Å; I52-I65 HydrophobicContact CB-CD1 3.84Å; I52-I65 HydrophobicContact CD1-CD1 4.38Å; I52-I65 HydrophobicContact CG2-CD1 3.7Å; I52-L67 HydrophobicContact CD1-CD1 3.88Å; I52-L67 HydrophobicContact CD1-CD2 4.28Å; I52-C80 HydrophobicContact CD1-CB 4.18Å; I52-L82 HydrophobicContact CG2-CD1 4.19Å
53	I	94.6	Very high	93	Very high	66 Å²	66	56.5 Å²	56.5	34%	0.338	30%	0.303	S	S	.	.	H	α-helix	trans	-56.8	-48.2	177.9	-69.4	165.5	0	0	0	110.3	E49 G50 V55 F56 S57 I62 I65	E49-I53 VanDerWaalsContact O-CG1 3.32Å; E49-I53 WeakPolarHBondContact O-CG1 3.28Å; E49-I53 PolarHBondContact O-N 3.12Å; G50-I53 PolarHBondContact O-N 2.89Å; I53-V55 VanDerWaalsContact C-N 3.3Å; I53-V55 PolarHBondContact O-N 3.48Å; I53-F56 PolarHBondContact O-N 3.13Å; I53-S57 WeakPolarHBondContact O-CB 3.41Å; I53-S57 PolarHBondContact O-N 2.87Å; I53-S57 PolarHBondContact O-OG 2.84Å; I53-I62 HydrophobicContact CB-CD1 4.14Å; I53-I62 HydrophobicContact CG1-CD1 4.22Å; I53-I62 HydrophobicContact CG2-CD1 3.97Å; I53-I65 HydrophobicContact CD1-CG2 4.11Å; I53-I65 HydrophobicContact CG1-CD1 3.95Å
54	C	93.8	Very high	92.9	Very high	95 Å²	95	57.3 Å²	57.3	64%	0.642	31%	0.307	S	S	*	.	H	α-helix	trans	-60.6	-34.9	-179.2	-67.3	0	0	0	0	114	G50 D51 I52 S57	G50-C54 PolarHBondContact O-N 3.48Å; G50-C54 PolarHBondContact O-SG 2.93Å; D51-C54 PolarHBondContact O-N 3.27Å; I52-C54 VanDerWaalsContact C-N 3.32Å; I52-C54 PolarHBondContact O-N 2.98Å; C54-S57 PolarHBondContact O-OG 3.36Å
55	V	92.7	Very high	92.9	Very high	54 Å²	54	59 Å²	59	33%	0.327	32%	0.315	S	S	.	.	H	α-helix	trans	-78	-44.9	178.2	174.8	0	0	0	0	110.7	D51 I52 I53 F97	D51-V55 WeakPolarHBondContact O-CG2 3.34Å; D51-V55 PolarHBondContact O-N 3.12Å; I52-V55 PolarHBondContact O-N 3.4Å; I53-V55 VanDerWaalsContact C-N 3.3Å; I53-V55 PolarHBondContact O-N 3.48Å; V55-F97 HydrophobicContact CG1-CE1 4.41Å; V55-F97 HydrophobicContact CG1-CZ 4.31Å; V55-F97 VanDerWaalsContact O-CZ 3.27Å; V55-F97 WeakPolarHBondContact O-CZ 3.31Å
56	F	94.3	Very high	92.9	Very high	1 Å²	1	54 Å²	54	0%	0.004	30%	0.297	C	S	.	.	H	α-helix	trans	-81.9	-17.7	-172.6	-77.6	-89.2	0	0	0	113.4	I38 L40 I52 I53 Q58 Y59 I62 L82 Y84 F97 I107 V109	I38-F56 HydrophobicContact CD1-CD1 4.2Å; I38-F56 HydrophobicContact CD1-CE1 4.29Å; L40-F56 HydrophobicContact CD1-CD1 4.41Å; L40-F56 HydrophobicContact CD1-CD2 4.04Å; L40-F56 HydrophobicContact CD1-CE1 4.11Å; L40-F56 HydrophobicContact CD1-CE2 3.7Å; L40-F56 HydrophobicContact CD1-CG 4.39Å; L40-F56 HydrophobicContact CD1-CZ 3.75Å; L40-F56 HydrophobicContact CD2-CD1 4.26Å; L40-F56 HydrophobicContact CD2-CE1 3.38Å; L40-F56 HydrophobicContact CD2-CE2 4.15Å; L40-F56 HydrophobicContact CD2-CZ 3.31Å; L40-F56 HydrophobicContact CG-CE1 4.39Å; L40-F56 HydrophobicContact CG-CZ 4.15Å; I52-F56 HydrophobicContact CG2-CD2 3.66Å; I52-F56 HydrophobicContact CG2-CE2 4.13Å; I52-F56 HydrophobicContact CG2-CG 4.48Å; I52-F56 WeakPolarHBondContact O-CB 3.42Å; I52-F56 VanDerWaalsContact O-CD2 3.28Å; I52-F56 WeakPolarHBondContact O-CD2 3.37Å; I52-F56 PolarHBondContact O-N 3.19Å; I53-F56 PolarHBondContact O-N 3.13Å; F56-Q58 PolarHBondContact O-N 2.98Å; F56-Y59 PolarHBondContact O-N 3.31Å; F56-I62 HydrophobicContact CB-CD1 4.03Å; F56-L82 HydrophobicContact CB-CD1 3.75Å; F56-L82 HydrophobicContact CG-CD1 4.12Å; F56-Y84 WeakPolarHBondContact CB-OH 3.35Å; F56-Y84 PolarHBondContact O-OH 2.89Å; F56-F97 AromaticContact CD1-CD2 3.49Å; F56-F97 HydrophobicContact CD1-CD2 3.49Å; F56-F97 VanDerWaalsContact CD1-CD2 3.49Å; F56-F97 AromaticContact CD1-CE2 3.77Å; F56-F97 HydrophobicContact CD1-CE2 3.77Å; F56-F97 HydrophobicContact CD1-CG 4.46Å; F56-F97 HydrophobicContact CE1-CB 3.94Å; F56-F97 AromaticContact CE1-CD2 3.42Å; F56-F97 HydrophobicContact CE1-CD2 3.42Å; F56-F97 VanDerWaalsContact CE1-CD2 3.42Å; F56-F97 HydrophobicContact CE1-CE2 4.13Å; F56-F97 AromaticContact CE1-CG 3.99Å; F56-F97 HydrophobicContact CE1-CG 3.99Å; F56-F97 HydrophobicContact CG-CD2 4.37Å; F56-F97 HydrophobicContact CG-CE2 4.27Å; F56-F97 HydrophobicContact CZ-CB 4.34Å; F56-F97 HydrophobicContact CZ-CD2 4.25Å; F56-F97 HydrophobicContact CZ-CG 4.49Å; F56-I107 HydrophobicContact CE2-CD1 4.41Å; F56-I107 HydrophobicContact CZ-CD1 3.83Å; F56-V109 HydrophobicContact CE1-CG2 4.17Å; F56-V109 HydrophobicContact CZ-CG2 4.26Å
57	S	94.6	Very high	92.9	Very high	57 Å²	57	47.7 Å²	47.7	40%	0.399	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-9.2	174.9	65.5	0	0	0	0	113.9	I53 C54 Y59 G60	I53-S57 WeakPolarHBondContact O-CB 3.41Å; I53-S57 PolarHBondContact O-N 2.87Å; I53-S57 PolarHBondContact O-OG 2.84Å; C54-S57 PolarHBondContact O-OG 3.36Å; S57-Y59 VanDerWaalsContact C-N 3.25Å; S57-Y59 PolarHBondContact O-N 2.76Å; S57-G60 WeakPolarHBondContact CA-O 3.46Å
58	Q	94.1	Very high	93	Very high	135 Å²	135	48.4 Å²	48.4	63%	0.631	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-32.2	177.2	-174.2	178	4.9	0	0	113.2	F56 F97	F56-Q58 PolarHBondContact O-N 2.98Å; Q58-F97 HydrophobicContact CB-CZ 4.13Å
59	Y	93.8	Very high	92.9	Very high	55 Å²	55	50.7 Å²	50.7	22%	0.216	28%	0.275	C	S	.	.	S	Bend	trans	-107.5	-3.4	-174.9	-60.7	-53.7	0	0	0	114.3	F56 S57 S89 L92 A93 N96 F97	F56-Y59 PolarHBondContact O-N 3.31Å; S57-Y59 VanDerWaalsContact C-N 3.25Å; S57-Y59 PolarHBondContact O-N 2.76Å; Y59-S89 WeakPolarHBondContact O-CB 3.25Å; Y59-S89 PolarHBondContact O-OG 3.29Å; Y59-L92 HydrophobicContact CD1-CB 4.13Å; Y59-L92 HydrophobicContact CG-CB 4Å; Y59-A93 HydrophobicContact CD2-CB 4.3Å; Y59-N96 HydrophobicContact CE2-CB 3.72Å; Y59-N96 WeakPolarHBondContact OH-CB 3.17Å; Y59-F97 AromaticContact CD2-CD2 3.59Å; Y59-F97 HydrophobicContact CD2-CD2 3.59Å; Y59-F97 HydrophobicContact CD2-CE1 4.39Å; Y59-F97 AromaticContact CD2-CE2 3.11Å; Y59-F97 HydrophobicContact CD2-CE2 3.11Å; Y59-F97 HydrophobicContact CD2-CG 4.42Å; Y59-F97 AromaticContact CD2-CZ 3.59Å; Y59-F97 HydrophobicContact CD2-CZ 3.59Å; Y59-F97 AromaticContact CE2-CD1 3.87Å; Y59-F97 HydrophobicContact CE2-CD1 3.87Å; Y59-F97 AromaticContact CE2-CD2 3.47Å; Y59-F97 HydrophobicContact CE2-CD2 3.47Å; Y59-F97 VanDerWaalsContact CE2-CD2 3.47Å; Y59-F97 AromaticContact CE2-CE1 3.54Å; Y59-F97 HydrophobicContact CE2-CE1 3.54Å; Y59-F97 AromaticContact CE2-CE2 3.11Å; Y59-F97 HydrophobicContact CE2-CE2 3.11Å; Y59-F97 AromaticContact CE2-CG 3.87Å; Y59-F97 HydrophobicContact CE2-CG 3.87Å; Y59-F97 AromaticContact CE2-CZ 3.16Å; Y59-F97 HydrophobicContact CE2-CZ 3.16Å; Y59-F97 HydrophobicContact CG-CE2 4.33Å
60	G	93.4	Very high	92.9	Very high	19 Å²	19	50.8 Å²	50.8	20%	0.196	28%	0.277	C	S	.	.	S	Bend	trans	167.4	167.9	176.6	0	0	0	0	0	113.9	S57 S89	S57-G60 WeakPolarHBondContact CA-O 3.46Å; G60-S89 WeakPolarHBondContact CA-OG 3.44Å
61	E	93.6	Very high	92.6	Very high	129 Å²	129	58.9 Å²	58.9	60%	0.603	30%	0.302	S	S	*	.			trans	-73.2	135	175.4	-171.7	60.6	-155	0	0	110.7	Y84 E85	E61-Y84 WeakPolarHBondContact O-CA 3.21Å; E61-Y84 WeakPolarHBondContact O-CD1 3.29Å; E61-E85 HydrophobicContact CB-CB 4.45Å; E61-E85 PolarHBondContact O-N 3.38Å
62	I	93.6	Very high	92.5	Very high	20 Å²	20	64.9 Å²	64.9	10%	0.103	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	116.8	-174.7	-58.9	162.5	0	0	0	108.4	I53 F56 L82 Y84	I53-I62 HydrophobicContact CB-CD1 4.14Å; I53-I62 HydrophobicContact CG1-CD1 4.22Å; I53-I62 HydrophobicContact CG2-CD1 3.97Å; F56-I62 HydrophobicContact CB-CD1 4.03Å; I62-L82 HydrophobicContact CD1-CD1 3.89Å; I62-L82 HydrophobicContact CG1-CD1 4.16Å; I62-L82 HydrophobicContact CG1-CD2 4.18Å; I62-L82 HydrophobicContact CG1-CG 4.42Å; I62-L82 HydrophobicContact CG2-CD1 4.04Å; I62-L82 HydrophobicContact CG2-CD2 4.08Å; I62-L82 HydrophobicContact CG2-CG 3.75Å; I62-Y84 HydrophobicContact CG1-CD1 4.11Å; I62-Y84 HydrophobicContact CG1-CE1 3.85Å
63	V	91.6	Very high	92.3	Very high	26 Å²	26	68.8 Å²	68.8	16%	0.158	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-44.5	-178.1	177.7	0	0	0	0	111.5	C83 E85 L131	V63-C83 PolarHBondContact N-O 2.96Å; V63-E85 HydrophobicContact CG2-CB 3.78Å; V63-E85 HydrophobicContact CG2-CG 4.38Å; V63-L131 HydrophobicContact CG1-CB 3.95Å; V63-L131 HydrophobicContact CG1-CD2 3.67Å; V63-L131 HydrophobicContact CG1-CG 4.3Å; V63-L131 HydrophobicContact CG2-CD2 4.13Å
64	N	90.4	Very high	91.9	Very high	17 Å²	17	67.6 Å²	67.6	9%	0.091	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	142.5	-179.4	-70.7	-65.1	0	0	0	110.4	W37 C83	W37-N64 HydrophobicContact CH2-CB 3.87Å; N64-C83 HydrophobicContact CB-CB 3.93Å; N64-C83 PolarHBondContact N-O 3.08Å; N64-C83 PolarHBondContact O-N 3.17Å
65	I	92.1	Very high	91.7	Very high	47 Å²	47	70.2 Å²	70.2	24%	0.241	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	137.2	171.1	-170.8	168.6	0	0	0	109.3	E49 I52 I53 C80	E49-I65 HydrophobicContact CB-CD1 4.14Å; E49-I65 HydrophobicContact CB-CG2 4.4Å; I52-I65 HydrophobicContact CB-CD1 3.84Å; I52-I65 HydrophobicContact CD1-CD1 4.38Å; I52-I65 HydrophobicContact CG2-CD1 3.7Å; I53-I65 HydrophobicContact CD1-CG2 4.11Å; I53-I65 HydrophobicContact CG1-CD1 3.95Å; I65-C80 WeakPolarHBondContact CG1-SG 3.18Å
66	N	92.1	Very high	91.6	Very high	31 Å²	31	68.2 Å²	68.2	17%	0.166	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	97.7	171.3	-178.2	12.2	0	0	0	110	C80 F81 Y115 P118	N66-C80 CarbonylContact O-C 3.51Å; N66-C80 VanDerWaalsContact O-CA 3.3Å; N66-C80 WeakPolarHBondContact O-CA 3.4Å; N66-C80 PolarHBondContact O-SG 3.39Å; N66-C80 VanDerWaalsContact O-SG 3.33Å; N66-F81 PolarHBondContact N-O 2.94Å; N66-F81 PolarHBondContact O-N 2.62Å; N66-Y115 PolarHBondContact ND2-OH 2.94Å; N66-P118 WeakPolarHBondContact ND2-CD 3.02Å
67	L	92.1	Very high	91.5	Very high	12 Å²	12	73.1 Å²	73.1	6%	0.063	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	114.8	170.7	-179	62.6	0	0	0	109.3	L43 E49 I52 R69 C80	L43-L67 HydrophobicContact CD1-CD1 4.35Å; E49-L67 HydrophobicContact CG-CB 3.67Å; E49-L67 HydrophobicContact CG-CD2 4.06Å; E49-L67 WeakPolarHBondContact OE1-CB 3.49Å; E49-L67 WeakPolarHBondContact OE1-CD2 3.5Å; I52-L67 HydrophobicContact CD1-CD1 3.88Å; I52-L67 HydrophobicContact CD1-CD2 4.28Å; L67-R69 PolarHBondContact O-N 3.16Å; L67-C80 HydrophobicContact CD1-CB 3.81Å
68	V	91.3	Very high	91.3	Very high	30 Å²	30	70.7 Å²	70.7	18%	0.182	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	115.7	-175.9	-176.9	0	0	0	0	109.9	K77 F79 F81	V68-K77 HydrophobicContact CG1-CD 3.97Å; V68-K77 HydrophobicContact CG1-CG 4.45Å; V68-K77 WeakPolarHBondContact O-CB 3.36Å; V68-K77 PolarHBondContact O-N 2.96Å; V68-F79 HydrophobicContact CB-CD2 3.91Å; V68-F79 HydrophobicContact CB-CE1 4.41Å; V68-F79 HydrophobicContact CB-CE2 3.4Å; V68-F79 VanDerWaalsContact CB-CE2 3.4Å; V68-F79 HydrophobicContact CB-CZ 3.69Å; V68-F79 HydrophobicContact CG1-CE1 4.42Å; V68-F79 HydrophobicContact CG1-CE2 3.75Å; V68-F79 HydrophobicContact CG1-CZ 3.58Å; V68-F79 HydrophobicContact CG2-CD2 3.83Å; V68-F79 HydrophobicContact CG2-CE2 3.36Å; V68-F79 HydrophobicContact CG2-CZ 4.11Å; V68-F79 PolarHBondContact N-O 3.04Å; V68-F81 HydrophobicContact CG2-CD2 4.33Å; V68-F81 HydrophobicContact CG2-CE2 4.36Å
69	R	92.1	Very high	91.3	Very high	108 Å²	108	67.2 Å²	67.2	41%	0.408	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	154.3	176.5	-62.8	172.3	178.9	-138.7	2.6	110.8	E49 L67 K75	E49-R69 IonicContact OE1-CZ 3.14Å; E49-R69 IonicContact OE1-NE 2.82Å; E49-R69 PolarHBondContact OE1-NE 3.38Å; E49-R69 IonicContact OE1-NH2 2.77Å; E49-R69 PolarHBondContact OE1-NH2 3.32Å; E49-R69 IonicContact OE2-CZ 3.76Å; E49-R69 IonicContact OE2-NH2 2.68Å; E49-R69 PolarHBondContact OE2-NH2 2.98Å; L67-R69 PolarHBondContact O-N 3.16Å; R69-K75 CarbonylContact C-O 3.59Å; R69-K75 WeakPolarHBondContact CA-O 3.01Å
70	D	90.8	Very high	91.3	Very high	55 Å²	55	64.6 Å²	64.6	29%	0.294	32%	0.32	S	S	.	.			trans	-75.7	129	172.6	178.9	29.8	0	0	0	110.5	K72 T73 G74 K75	D70-K72 PolarHBondContact O-N 2.79Å; D70-T73 WeakPolarHBondContact CB-OG1 3.29Å; D70-T73 PolarHBondContact OD2-OG1 2.85Å; D70-G74 VanDerWaalsContact O-CA 3.26Å; D70-G74 WeakPolarHBondContact O-CA 3.45Å; D70-G74 PolarHBondContact O-N 3.18Å; D70-K75 PolarHBondContact N-O 3.33Å
71	K	88.3	Confident	91.4	Very high	207 Å²	207	65.2 Å²	65.2	90%	0.9	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-25.8	-173.1	-63.3	-170.5	176.9	-165	0	113.2
72	K	89.8	Confident	91.4	Very high	197 Å²	197	59 Å²	59	86%	0.857	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-43	-177.9	-64.2	-176.4	-179.9	-178.5	0	112.5	D70	D70-K72 PolarHBondContact O-N 2.79Å
73	T	89.8	Confident	91.4	Very high	83 Å²	83	58.1 Å²	58.1	51%	0.509	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-13.8	-173	60.7	0	0	0	0	113.5	D70 K75	D70-T73 WeakPolarHBondContact CB-OG1 3.29Å; D70-T73 PolarHBondContact OD2-OG1 2.85Å; T73-K75 PolarHBondContact O-N 3.04Å; T73-K75 VanDerWaalsContact O-N 3.07Å
74	G	85.6	Confident	91.6	Very high	41 Å²	41	56.9 Å²	56.9	42%	0.423	28%	0.276	S	S	.	.			trans	68	-2.2	-174	0	0	0	0	0	114.2	D70	D70-G74 VanDerWaalsContact O-CA 3.26Å; D70-G74 WeakPolarHBondContact O-CA 3.45Å; D70-G74 PolarHBondContact O-N 3.18Å
75	K	89.1	Confident	91.7	Very high	150 Å²	150	62.1 Å²	62.1	65%	0.652	30%	0.3	S	S	*	.			trans	-75.7	140.5	-177.4	-65.5	-175.8	179.4	-176.6	0	110.5	R69 D70 T73	R69-K75 CarbonylContact C-O 3.59Å; R69-K75 WeakPolarHBondContact CA-O 3.01Å; D70-K75 PolarHBondContact N-O 3.33Å; T73-K75 PolarHBondContact O-N 3.04Å; T73-K75 VanDerWaalsContact O-N 3.07Å
76	S	91.9	Very high	91.8	Very high	13 Å²	13	62.4 Å²	62.4	9%	0.091	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	140.6	174.2	-55.7	0	0	0	0	110.4	Y45	Y45-S76 WeakPolarHBondContact CD1-O 3.47Å
77	K	90.9	Very high	91.8	Very high	104 Å²	104	61.8 Å²	61.8	45%	0.452	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-2.6	172.9	-66	-168.6	-179.8	179.5	0	112.9	V68 F79	V68-K77 HydrophobicContact CG1-CD 3.97Å; V68-K77 HydrophobicContact CG1-CG 4.45Å; V68-K77 WeakPolarHBondContact O-CB 3.36Å; V68-K77 PolarHBondContact O-N 2.96Å; K77-F79 HydrophobicContact CB-CD1 3.63Å; K77-F79 HydrophobicContact CB-CE1 3.3Å; K77-F79 HydrophobicContact CB-CZ 4.15Å; K77-F79 HydrophobicContact CD-CE1 3.73Å; K77-F79 HydrophobicContact CD-CZ 3.99Å; K77-F79 HydrophobicContact CG-CE1 4.15Å
78	G	91.2	Very high	91.8	Very high	6 Å²	6	68.7 Å²	68.7	6%	0.062	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	79.9	21.3	-179.8	0	0	0	0	0	113.6	G42 L43	G42-G78 PolarHBondContact N-O 3.37Å; L43-G78 PolarHBondContact N-O 3.05Å; L43-G78 WeakPolarHBondContact O-CA 3.38Å
79	F	93.4	Very high	92	Very high	61 Å²	61	67.9 Å²	67.9	27%	0.268	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	149.2	170.2	65.1	-90.4	0	0	0	111.5	F39 L40 V68 K77 F81	F39-F79 HydrophobicContact CE2-CB 3.79Å; F39-F79 HydrophobicContact CE2-CD2 4.2Å; F39-F79 HydrophobicContact CE2-CG 4.28Å; F39-F79 HydrophobicContact CZ-CB 4.01Å; L40-F79 CarbonylContact O-C 3.58Å; L40-F79 WeakPolarHBondContact O-CA 3.33Å; L40-F79 VanDerWaalsContact O-CB 3.28Å; L40-F79 WeakPolarHBondContact O-CB 3.44Å; V68-F79 HydrophobicContact CB-CD2 3.91Å; V68-F79 HydrophobicContact CB-CE1 4.41Å; V68-F79 HydrophobicContact CB-CE2 3.4Å; V68-F79 VanDerWaalsContact CB-CE2 3.4Å; V68-F79 HydrophobicContact CB-CZ 3.69Å; V68-F79 HydrophobicContact CG1-CE1 4.42Å; V68-F79 HydrophobicContact CG1-CE2 3.75Å; V68-F79 HydrophobicContact CG1-CZ 3.58Å; V68-F79 HydrophobicContact CG2-CD2 3.83Å; V68-F79 HydrophobicContact CG2-CE2 3.36Å; V68-F79 HydrophobicContact CG2-CZ 4.11Å; V68-F79 PolarHBondContact N-O 3.04Å; K77-F79 HydrophobicContact CB-CD1 3.63Å; K77-F79 HydrophobicContact CB-CE1 3.3Å; K77-F79 HydrophobicContact CB-CZ 4.15Å; K77-F79 HydrophobicContact CD-CE1 3.73Å; K77-F79 HydrophobicContact CD-CZ 3.99Å; K77-F79 HydrophobicContact CG-CE1 4.15Å; F79-F81 HydrophobicContact CD2-CE2 4.06Å; F79-F81 HydrophobicContact CE2-CE2 4.14Å
80	C	94.3	Very high	92.1	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	150.3	-174.4	179.8	0	0	0	0	109.4	L40 L43 I52 I65 N66 L67	L40-C80 HydrophobicContact CB-CB 4.1Å; L40-C80 HydrophobicContact CD1-CB 4.32Å; L40-C80 PolarHBondContact N-O 3.05Å; L40-C80 PolarHBondContact O-N 2.82Å; L43-C80 HydrophobicContact CD1-CB 3.7Å; I52-C80 HydrophobicContact CD1-CB 4.18Å; I65-C80 WeakPolarHBondContact CG1-SG 3.18Å; N66-C80 CarbonylContact O-C 3.51Å; N66-C80 VanDerWaalsContact O-CA 3.3Å; N66-C80 WeakPolarHBondContact O-CA 3.4Å; N66-C80 PolarHBondContact O-SG 3.39Å; N66-C80 VanDerWaalsContact O-SG 3.33Å; L67-C80 HydrophobicContact CD1-CB 3.81Å
81	F	94.9	Very high	92.3	Very high	32 Å²	32	62.3 Å²	62.3	14%	0.14	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	131.9	167	-64.2	-88.3	0	0	0	108.4	W37 I38 F39 N66 V68 F79 V112 Y115	W37-F81 HydrophobicContact CE3-CB 4.11Å; W37-F81 HydrophobicContact CZ3-CB 4.14Å; I38-F81 WeakPolarHBondContact O-CA 3.3Å; F39-F81 HydrophobicContact CB-CD1 4.4Å; F39-F81 HydrophobicContact CB-CE1 4.22Å; F39-F81 HydrophobicContact CD2-CD1 4.31Å; F39-F81 AromaticContact CD2-CE1 3.7Å; F39-F81 HydrophobicContact CD2-CE1 3.7Å; F39-F81 AromaticContact CD2-CZ 3.83Å; F39-F81 HydrophobicContact CD2-CZ 3.83Å; F39-F81 HydrophobicContact CE2-CZ 4.38Å; F39-F81 HydrophobicContact CG-CE1 4.45Å; N66-F81 PolarHBondContact N-O 2.94Å; N66-F81 PolarHBondContact O-N 2.62Å; V68-F81 HydrophobicContact CG2-CD2 4.33Å; V68-F81 HydrophobicContact CG2-CE2 4.36Å; F79-F81 HydrophobicContact CD2-CE2 4.06Å; F79-F81 HydrophobicContact CE2-CE2 4.14Å; F81-V112 HydrophobicContact CD1-CG2 4.22Å; F81-V112 HydrophobicContact CE1-CG2 4.16Å; F81-Y115 HydrophobicContact CB-CD1 4.01Å; F81-Y115 HydrophobicContact CB-CD2 4.28Å; F81-Y115 HydrophobicContact CB-CE1 3.54Å; F81-Y115 HydrophobicContact CB-CE2 3.89Å; F81-Y115 HydrophobicContact CB-CG 4.33Å; F81-Y115 VanDerWaalsContact CB-CZ 3.47Å; F81-Y115 HydrophobicContact CD1-CD1 4.39Å; F81-Y115 AromaticContact CD1-CD2 3.3Å; F81-Y115 HydrophobicContact CD1-CD2 3.3Å; F81-Y115 HydrophobicContact CD1-CE1 4.39Å; F81-Y115 AromaticContact CD1-CE2 3.35Å; F81-Y115 HydrophobicContact CD1-CE2 3.35Å; F81-Y115 AromaticContact CD1-CG 3.86Å; F81-Y115 HydrophobicContact CD1-CG 3.86Å; F81-Y115 AromaticContact CD1-CZ 3.9Å; F81-Y115 HydrophobicContact CD2-CD2 4.13Å; F81-Y115 HydrophobicContact CD2-CE1 4.3Å; F81-Y115 AromaticContact CD2-CE2 3.26Å; F81-Y115 HydrophobicContact CD2-CE2 3.26Å; F81-Y115 AromaticContact CD2-CZ 3.34Å; F81-Y115 WeakPolarHBondContact CD2-OH 3.34Å; F81-Y115 AromaticContact CE1-CD2 3.46Å; F81-Y115 HydrophobicContact CE1-CD2 3.46Å; F81-Y115 VanDerWaalsContact CE1-CD2 3.46Å; F81-Y115 AromaticContact CE1-CE2 3.52Å; F81-Y115 HydrophobicContact CE1-CE2 3.52Å; F81-Y115 HydrophobicContact CE1-CG 4.38Å; F81-Y115 HydrophobicContact CE2-CD2 4.25Å; F81-Y115 AromaticContact CE2-CE2 3.43Å; F81-Y115 HydrophobicContact CE2-CE2 3.43Å; F81-Y115 VanDerWaalsContact CE2-CE2 3.43Å; F81-Y115 AromaticContact CE2-CZ 3.97Å; F81-Y115 HydrophobicContact CG-CD1 4.27Å; F81-Y115 AromaticContact CG-CD2 3.64Å; F81-Y115 HydrophobicContact CG-CD2 3.64Å; F81-Y115 AromaticContact CG-CE1 3.85Å; F81-Y115 HydrophobicContact CG-CE1 3.85Å; F81-Y115 AromaticContact CG-CE2 3.19Å; F81-Y115 HydrophobicContact CG-CE2 3.19Å; F81-Y115 HydrophobicContact CG-CG 4.15Å; F81-Y115 AromaticContact CG-CZ 3.28Å; F81-Y115 AromaticContact CZ-CD2 3.94Å; F81-Y115 HydrophobicContact CZ-CD2 3.94Å; F81-Y115 AromaticContact CZ-CE2 3.55Å; F81-Y115 HydrophobicContact CZ-CE2 3.55Å
82	L	94.9	Very high	92.6	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	136.2	-177.4	-177.4	155.2	0	0	0	108.6	W37 I38 L40 I52 F56 I62 Y84	W37-L82 WeakPolarHBondContact CA-O 3.33Å; I38-L82 HydrophobicContact CD1-CB 4.33Å; I38-L82 HydrophobicContact CD1-CD2 4.1Å; I38-L82 HydrophobicContact CG1-CB 3.88Å; I38-L82 HydrophobicContact CG1-CD2 4.04Å; I38-L82 PolarHBondContact N-O 3.4Å; I38-L82 PolarHBondContact O-N 3.25Å; L40-L82 HydrophobicContact CD1-CB 4.27Å; L40-L82 HydrophobicContact CD1-CD1 4.32Å; I52-L82 HydrophobicContact CG2-CD1 4.19Å; F56-L82 HydrophobicContact CB-CD1 3.75Å; F56-L82 HydrophobicContact CG-CD1 4.12Å; I62-L82 HydrophobicContact CD1-CD1 3.89Å; I62-L82 HydrophobicContact CG1-CD1 4.16Å; I62-L82 HydrophobicContact CG1-CD2 4.18Å; I62-L82 HydrophobicContact CG1-CG 4.42Å; I62-L82 HydrophobicContact CG2-CD1 4.04Å; I62-L82 HydrophobicContact CG2-CD2 4.08Å; I62-L82 HydrophobicContact CG2-CG 3.75Å; L82-Y84 HydrophobicContact CD2-CD1 4.13Å; L82-Y84 HydrophobicContact CD2-CD2 3.47Å; L82-Y84 VanDerWaalsContact CD2-CD2 3.47Å; L82-Y84 HydrophobicContact CD2-CE1 3.97Å; L82-Y84 HydrophobicContact CD2-CE2 3.33Å; L82-Y84 HydrophobicContact CD2-CG 3.91Å
83	C	93.7	Very high	92.9	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	122	176.2	-168.1	0	0	0	0	109.8	A36 W37 V63 N64 C136	A36-C83 VanDerWaalsContact O-CA 3.27Å; A36-C83 WeakPolarHBondContact O-CA 3.49Å; W37-C83 HydrophobicContact CD2-CB 3.68Å; W37-C83 HydrophobicContact CE3-CB 3.66Å; W37-C83 HydrophobicContact CG-CB 4.45Å; W37-C83 HydrophobicContact CH2-CB 3.71Å; W37-C83 HydrophobicContact CZ2-CB 3.71Å; W37-C83 HydrophobicContact CZ3-CB 3.68Å; V63-C83 PolarHBondContact N-O 2.96Å; N64-C83 HydrophobicContact CB-CB 3.93Å; N64-C83 PolarHBondContact N-O 3.08Å; N64-C83 PolarHBondContact O-N 3.17Å; C83-C136 VanDerWaalsContact SG-CB 3.56Å; C83-C136 PolarHBondContact SG-SG 3.14Å
84	Y	95.4	Very high	93.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	163.2	171.1	-73.2	-79	0	0	0	111.3	A36 I38 F56 E61 I62 L82 D86 T90 A93	A36-Y84 WeakPolarHBondContact CB-O 3.21Å; A36-Y84 PolarHBondContact O-N 2.89Å; I38-Y84 HydrophobicContact CD1-CE2 3.69Å; I38-Y84 HydrophobicContact CG1-CE2 4.23Å; F56-Y84 WeakPolarHBondContact CB-OH 3.35Å; F56-Y84 PolarHBondContact O-OH 2.89Å; E61-Y84 WeakPolarHBondContact O-CA 3.21Å; E61-Y84 WeakPolarHBondContact O-CD1 3.29Å; I62-Y84 HydrophobicContact CG1-CD1 4.11Å; I62-Y84 HydrophobicContact CG1-CE1 3.85Å; L82-Y84 HydrophobicContact CD2-CD1 4.13Å; L82-Y84 HydrophobicContact CD2-CD2 3.47Å; L82-Y84 VanDerWaalsContact CD2-CD2 3.47Å; L82-Y84 HydrophobicContact CD2-CE1 3.97Å; L82-Y84 HydrophobicContact CD2-CE2 3.33Å; L82-Y84 HydrophobicContact CD2-CG 3.91Å; Y84-D86 WeakPolarHBondContact CB-O 3.43Å; Y84-T90 HydrophobicContact CD2-CG2 3.73Å; Y84-T90 HydrophobicContact CG-CG2 4.4Å; Y84-A93 HydrophobicContact CE2-CB 3.83Å; Y84-A93 WeakPolarHBondContact OH-CB 3.49Å
85	E	92.7	Very high	93.5	Very high	127 Å²	127	43.7 Å²	43.7	59%	0.593	20%	0.203	S	C	*	.	S	Bend	trans	-66.7	-44.6	169.7	-172.4	178.7	-175.6	0	0	111.6	E61 V63	E61-E85 HydrophobicContact CB-CB 4.45Å; E61-E85 PolarHBondContact O-N 3.38Å; V63-E85 HydrophobicContact CG2-CB 3.78Å; V63-E85 HydrophobicContact CG2-CG 4.38Å
86	D	92.6	Very high	93.8	Very high	53 Å²	53	40.3 Å²	40.3	28%	0.283	19%	0.193	S	C	.	.	S	Bend	trans	-110.6	147.3	-179	-170.1	25.2	0	0	0	112.6	Y84 R88 S89 T140	Y84-D86 WeakPolarHBondContact CB-O 3.43Å; D86-R88 VanDerWaalsContact C-N 3.32Å; D86-R88 PolarHBondContact O-N 2.73Å; D86-R88 WeakPolarHBondContact OD2-CB 3.5Å; D86-R88 WeakPolarHBondContact OD2-CG 3.2Å; D86-S89 PolarHBondContact O-N 2.93Å; D86-T140 WeakPolarHBondContact OD1-CG2 3.18Å
87	Q	92.3	Very high	93.9	Very high	18 Å²	18	40.2 Å²	40.2	8%	0.084	19%	0.191	C	C	.	.	H	α-helix	trans	-65.8	-36.6	176.5	-176.2	60.1	14.6	0	0	111.9	Y32 S35 S89 T90 I91	Y32-Q87 PolarHBondContact O-NE2 2.77Å; S35-Q87 VanDerWaalsContact O-CD 3.31Å; S35-Q87 PolarHBondContact O-NE2 2.93Å; S35-Q87 VanDerWaalsContact O-NE2 3.08Å; S35-Q87 PolarHBondContact O-OE1 3.02Å; Q87-S89 PolarHBondContact O-N 3.35Å; Q87-T90 PolarHBondContact NE2-OG1 3.3Å; Q87-T90 VanDerWaalsContact NE2-OG1 3.13Å; Q87-T90 WeakPolarHBondContact O-CB 3.46Å; Q87-T90 PolarHBondContact O-N 3Å; Q87-T90 PolarHBondContact O-OG1 2.98Å; Q87-I91 PolarHBondContact O-N 3.3Å
88	R	93.2	Very high	94	Very high	157 Å²	157	35.7 Å²	35.7	59%	0.592	17%	0.171	S	C	*	.	H	α-helix	trans	-63.5	-33.7	-177.4	-60.9	177.4	177.3	160.8	0.7	111.9	D86 T90 I91 L92	D86-R88 VanDerWaalsContact C-N 3.32Å; D86-R88 PolarHBondContact O-N 2.73Å; D86-R88 WeakPolarHBondContact OD2-CB 3.5Å; D86-R88 WeakPolarHBondContact OD2-CG 3.2Å; R88-T90 PolarHBondContact O-N 2.96Å; R88-I91 WeakPolarHBondContact O-CB 3.27Å; R88-I91 PolarHBondContact O-N 2.96Å; R88-I91 VanDerWaalsContact O-N 3.16Å; R88-L92 WeakPolarHBondContact O-CG 3.49Å; R88-L92 PolarHBondContact O-N 2.61Å; R88-L92 VanDerWaalsContact O-N 3.08Å
89	S	95.4	Very high	94.1	Very high	14 Å²	14	36.5 Å²	36.5	10%	0.098	18%	0.18	C	C	.	.	H	α-helix	trans	-60.2	-33.2	173.2	-61.7	0	0	0	0	112.4	Y59 G60 D86 Q87 A93	Y59-S89 WeakPolarHBondContact O-CB 3.25Å; Y59-S89 PolarHBondContact O-OG 3.29Å; G60-S89 WeakPolarHBondContact CA-OG 3.44Å; D86-S89 PolarHBondContact O-N 2.93Å; Q87-S89 PolarHBondContact O-N 3.35Å; S89-A93 VanDerWaalsContact O-CB 3.29Å; S89-A93 WeakPolarHBondContact O-CB 3.35Å; S89-A93 PolarHBondContact O-N 3.13Å
90	T	94.8	Very high	94	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-68.4	-39	176.7	76.2	0	0	0	0	111.8	A36 I38 Y84 Q87 R88 A93 V94 H111	A36-T90 HydrophobicContact CB-CG2 4.16Å; I38-T90 HydrophobicContact CG2-CG2 4.1Å; Y84-T90 HydrophobicContact CD2-CG2 3.73Å; Y84-T90 HydrophobicContact CG-CG2 4.4Å; Q87-T90 PolarHBondContact NE2-OG1 3.3Å; Q87-T90 VanDerWaalsContact NE2-OG1 3.13Å; Q87-T90 WeakPolarHBondContact O-CB 3.46Å; Q87-T90 PolarHBondContact O-N 3Å; Q87-T90 PolarHBondContact O-OG1 2.98Å; R88-T90 PolarHBondContact O-N 2.96Å; T90-A93 PolarHBondContact O-N 3.23Å; T90-V94 WeakPolarHBondContact O-CB 3.48Å; T90-V94 VanDerWaalsContact O-CG2 3.27Å; T90-V94 WeakPolarHBondContact O-CG2 3.44Å; T90-V94 PolarHBondContact O-N 2.74Å; T90-H111 PolarHBondContact OG1-CE1 3.46Å; T90-H111 VanDerWaalsContact OG1-CE1 3.23Å
91	I	94.5	Very high	93.9	Very high	46 Å²	46	43.7 Å²	43.7	24%	0.236	21%	0.213	C	C	.	.	H	α-helix	trans	-62.8	-52.6	177.9	-59.9	174.6	0	0	0	108.8	H29 Q87 R88 A93 V94 D95	H29-I91 HydrophobicContact CB-CD1 4.02Å; H29-I91 HydrophobicContact CB-CG1 4.01Å; H29-I91 HydrophobicContact CB-CG2 4.43Å; Q87-I91 PolarHBondContact O-N 3.3Å; R88-I91 WeakPolarHBondContact O-CB 3.27Å; R88-I91 PolarHBondContact O-N 2.96Å; R88-I91 VanDerWaalsContact O-N 3.16Å; I91-A93 VanDerWaalsContact C-N 3.3Å; I91-A93 PolarHBondContact O-N 3.47Å; I91-V94 PolarHBondContact O-N 3.05Å; I91-V94 VanDerWaalsContact O-N 3.13Å; I91-D95 VanDerWaalsContact O-CG 3.29Å; I91-D95 PolarHBondContact O-N 3.13Å
92	L	94.7	Very high	93.7	Very high	79 Å²	79	43.5 Å²	43.5	41%	0.414	21%	0.213	S	C	.	.	H	α-helix	trans	-58	-41.1	177.4	-66.5	174.4	0	0	0	112.5	Y59 R88 N96	Y59-L92 HydrophobicContact CD1-CB 4.13Å; Y59-L92 HydrophobicContact CG-CB 4Å; R88-L92 WeakPolarHBondContact O-CG 3.49Å; R88-L92 PolarHBondContact O-N 2.61Å; R88-L92 VanDerWaalsContact O-N 3.08Å; L92-N96 WeakPolarHBondContact O-CB 3.27Å; L92-N96 PolarHBondContact O-N 3.06Å; L92-N96 PolarHBondContact O-ND2 2.86Å
93	A	95.2	Very high	93.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66.7	-41.2	178	0	0	0	0	0	112.1	I38 Y59 Y84 S89 T90 I91 F97	I38-A93 HydrophobicContact CD1-CB 4.12Å; Y59-A93 HydrophobicContact CD2-CB 4.3Å; Y84-A93 HydrophobicContact CE2-CB 3.83Å; Y84-A93 WeakPolarHBondContact OH-CB 3.49Å; S89-A93 VanDerWaalsContact O-CB 3.29Å; S89-A93 WeakPolarHBondContact O-CB 3.35Å; S89-A93 PolarHBondContact O-N 3.13Å; T90-A93 PolarHBondContact O-N 3.23Å; I91-A93 VanDerWaalsContact C-N 3.3Å; I91-A93 PolarHBondContact O-N 3.47Å; A93-F97 HydrophobicContact CB-CD2 4.14Å; A93-F97 WeakPolarHBondContact O-CA 3.4Å; A93-F97 WeakPolarHBondContact O-CB 3.38Å; A93-F97 PolarHBondContact O-N 3.07Å
94	V	95.1	Very high	93.2	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-64.6	-44.4	177	168.8	0	0	0	0	110.6	I10 W28 I38 T90 I91 N98 V109	I10-V94 HydrophobicContact CG2-CG1 4.35Å; W28-V94 HydrophobicContact CH2-CG1 3.7Å; W28-V94 HydrophobicContact CZ2-CG1 3.81Å; I38-V94 HydrophobicContact CG2-CG2 4.11Å; T90-V94 WeakPolarHBondContact O-CB 3.48Å; T90-V94 VanDerWaalsContact O-CG2 3.27Å; T90-V94 WeakPolarHBondContact O-CG2 3.44Å; T90-V94 PolarHBondContact O-N 2.74Å; I91-V94 PolarHBondContact O-N 3.05Å; I91-V94 VanDerWaalsContact O-N 3.13Å; V94-N98 WeakPolarHBondContact O-CB 3.28Å; V94-N98 PolarHBondContact O-N 3.48Å; V94-V109 HydrophobicContact CB-CG1 4.45Å; V94-V109 HydrophobicContact CG2-CG1 3.85Å
95	D	94	Very high	93	Very high	57 Å²	57	58.5 Å²	58.5	31%	0.305	30%	0.297	S	S	.	.	H	α-helix	trans	-69.8	-40.7	-176	-65.6	-20.3	0	0	0	113.1	N14 H29 I91	N14-D95 PolarHBondContact ND2-OD1 2.92Å; H29-D95 IonicContact CE1-OD1 3.14Å; H29-D95 PolarHBondContact CE1-OD1 3.47Å; H29-D95 IonicContact NE2-OD1 3.17Å; H29-D95 PolarHBondContact NE2-OD1 3.45Å; H29-D95 IonicContact NE2-OD2 3.62Å; I91-D95 VanDerWaalsContact O-CG 3.29Å; I91-D95 PolarHBondContact O-N 3.13Å
96	N	94.1	Very high	93	Very high	80 Å²	80	54.4 Å²	54.4	43%	0.428	28%	0.281	S	S	.	.	H	α-helix	trans	-96.6	-32.4	-172	-63.6	-71.9	0	0	0	113.6	Y59 L92	Y59-N96 HydrophobicContact CE2-CB 3.72Å; Y59-N96 WeakPolarHBondContact OH-CB 3.17Å; L92-N96 WeakPolarHBondContact O-CB 3.27Å; L92-N96 PolarHBondContact O-N 3.06Å; L92-N96 PolarHBondContact O-ND2 2.86Å
97	F	94.3	Very high	93.1	Very high	11 Å²	11	51.9 Å²	51.9	5%	0.048	27%	0.267	C	S	.	.	H	α-helix	trans	-95.5	-8.9	-177.7	-64.3	-43.3	0	0	0	114	V55 F56 Q58 Y59 A93 G99 I100 V109	V55-F97 HydrophobicContact CG1-CE1 4.41Å; V55-F97 HydrophobicContact CG1-CZ 4.31Å; V55-F97 VanDerWaalsContact O-CZ 3.27Å; V55-F97 WeakPolarHBondContact O-CZ 3.31Å; F56-F97 AromaticContact CD1-CD2 3.49Å; F56-F97 HydrophobicContact CD1-CD2 3.49Å; F56-F97 VanDerWaalsContact CD1-CD2 3.49Å; F56-F97 AromaticContact CD1-CE2 3.77Å; F56-F97 HydrophobicContact CD1-CE2 3.77Å; F56-F97 HydrophobicContact CD1-CG 4.46Å; F56-F97 HydrophobicContact CE1-CB 3.94Å; F56-F97 AromaticContact CE1-CD2 3.42Å; F56-F97 HydrophobicContact CE1-CD2 3.42Å; F56-F97 VanDerWaalsContact CE1-CD2 3.42Å; F56-F97 HydrophobicContact CE1-CE2 4.13Å; F56-F97 AromaticContact CE1-CG 3.99Å; F56-F97 HydrophobicContact CE1-CG 3.99Å; F56-F97 HydrophobicContact CG-CD2 4.37Å; F56-F97 HydrophobicContact CG-CE2 4.27Å; F56-F97 HydrophobicContact CZ-CB 4.34Å; F56-F97 HydrophobicContact CZ-CD2 4.25Å; F56-F97 HydrophobicContact CZ-CG 4.49Å; Q58-F97 HydrophobicContact CB-CZ 4.13Å; Y59-F97 AromaticContact CD2-CD2 3.59Å; Y59-F97 HydrophobicContact CD2-CD2 3.59Å; Y59-F97 HydrophobicContact CD2-CE1 4.39Å; Y59-F97 AromaticContact CD2-CE2 3.11Å; Y59-F97 HydrophobicContact CD2-CE2 3.11Å; Y59-F97 HydrophobicContact CD2-CG 4.42Å; Y59-F97 AromaticContact CD2-CZ 3.59Å; Y59-F97 HydrophobicContact CD2-CZ 3.59Å; Y59-F97 AromaticContact CE2-CD1 3.87Å; Y59-F97 HydrophobicContact CE2-CD1 3.87Å; Y59-F97 AromaticContact CE2-CD2 3.47Å; Y59-F97 HydrophobicContact CE2-CD2 3.47Å; Y59-F97 VanDerWaalsContact CE2-CD2 3.47Å; Y59-F97 AromaticContact CE2-CE1 3.54Å; Y59-F97 HydrophobicContact CE2-CE1 3.54Å; Y59-F97 AromaticContact CE2-CE2 3.11Å; Y59-F97 HydrophobicContact CE2-CE2 3.11Å; Y59-F97 AromaticContact CE2-CG 3.87Å; Y59-F97 HydrophobicContact CE2-CG 3.87Å; Y59-F97 AromaticContact CE2-CZ 3.16Å; Y59-F97 HydrophobicContact CE2-CZ 3.16Å; Y59-F97 HydrophobicContact CG-CE2 4.33Å; A93-F97 HydrophobicContact CB-CD2 4.14Å; A93-F97 WeakPolarHBondContact O-CA 3.4Å; A93-F97 WeakPolarHBondContact O-CB 3.38Å; A93-F97 PolarHBondContact O-N 3.07Å; F97-G99 PolarHBondContact O-N 3.42Å; F97-I100 HydrophobicContact CB-CD1 4.26Å; F97-I100 HydrophobicContact CD1-CD1 3.76Å; F97-I100 HydrophobicContact CD1-CG2 4.46Å; F97-I100 HydrophobicContact CE1-CD1 4.45Å; F97-I100 HydrophobicContact CG-CD1 4.32Å; F97-I100 WeakPolarHBondContact O-CG1 3.37Å; F97-I100 PolarHBondContact O-N 2.79Å; F97-V109 HydrophobicContact CB-CG2 3.86Å
98	N	94.3	Very high	93.2	Very high	8 Å²	8	53 Å²	53	4%	0.043	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	117.4	175.1	-175.9	44.5	0	0	0	111.6	V7 I10 N11 V94 V109	V7-N98 PolarHBondContact O-ND2 3.31Å; I10-N98 WeakPolarHBondContact CB-ND2 3.17Å; I10-N98 WeakPolarHBondContact CG2-ND2 3.34Å; N11-N98 PolarHBondContact OD1-ND2 3.04Å; V94-N98 WeakPolarHBondContact O-CB 3.28Å; V94-N98 PolarHBondContact O-N 3.48Å; N98-V109 HydrophobicContact CB-CB 4.2Å; N98-V109 PolarHBondContact OD1-N 3.1Å; N98-V109 PolarHBondContact OD1-O 3.2Å
99	G	91.3	Very high	93.3	Very high	24 Å²	24	45.6 Å²	45.6	25%	0.247	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.2	3.1	178.5	0	0	0	0	0	115.7	F97 I107	F97-G99 PolarHBondContact O-N 3.42Å; G99-I107 VanDerWaalsContact CA-O 3.29Å; G99-I107 WeakPolarHBondContact CA-O 3.42Å; G99-I107 PolarHBondContact N-O 2.57Å
100	I	92.8	Very high	93.2	Very high	49 Å²	49	46.4 Å²	46.4	25%	0.251	25%	0.246	S	C	.	.			trans	-66.2	154.5	173.6	71.6	171.7	0	0	0	111	F97 I102 T106 I107	F97-I100 HydrophobicContact CB-CD1 4.26Å; F97-I100 HydrophobicContact CD1-CD1 3.76Å; F97-I100 HydrophobicContact CD1-CG2 4.46Å; F97-I100 HydrophobicContact CE1-CD1 4.45Å; F97-I100 HydrophobicContact CG-CD1 4.32Å; F97-I100 WeakPolarHBondContact O-CG1 3.37Å; F97-I100 PolarHBondContact O-N 2.79Å; I100-I102 HydrophobicContact CD1-CD1 4.08Å; I100-I102 HydrophobicContact CD1-CG1 4.1Å; I100-I102 HydrophobicContact CG1-CG1 4.28Å; I100-T106 CarbonylContact O-C 3.56Å; I100-T106 WeakPolarHBondContact O-CA 3.43Å; I100-I107 HydrophobicContact CD1-CD1 3.61Å; I100-I107 HydrophobicContact CD1-CG1 4.25Å; I100-I107 HydrophobicContact CG1-CD1 3.37Å; I100-I107 HydrophobicContact CG1-CG1 3.43Å; I100-I107 VanDerWaalsContact CG1-CG1 3.43Å; I100-I107 PolarHBondContact O-N 3.08Å
101	K	92.6	Very high	93.2	Very high	163 Å²	163	46.8 Å²	46.8	71%	0.709	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	118	178.4	-67.1	178.1	-176.8	175.5	0	110	R105	K101-R105 CarbonylContact C-O 3.45Å; K101-R105 WeakPolarHBondContact CA-O 3.49Å
102	I	90.4	Very high	93.1	Very high	27 Å²	27	46 Å²	46	14%	0.138	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	124	174.1	-56.3	-176.5	0	0	0	108.2	P44 L47 I100 G104 R105 I107	P44-I102 HydrophobicContact CG-CB 4.44Å; P44-I102 HydrophobicContact CG-CG2 4.21Å; P44-I102 WeakPolarHBondContact CG-O 3.35Å; L47-I102 HydrophobicContact CD1-CG2 4.09Å; I100-I102 HydrophobicContact CD1-CD1 4.08Å; I100-I102 HydrophobicContact CD1-CG1 4.1Å; I100-I102 HydrophobicContact CG1-CG1 4.28Å; I102-G104 PolarHBondContact O-N 3.36Å; I102-G104 VanDerWaalsContact O-N 3.11Å; I102-R105 PolarHBondContact N-O 3.02Å; I102-R105 PolarHBondContact O-N 3.24Å; I102-I107 HydrophobicContact CB-CG2 4.34Å; I102-I107 HydrophobicContact CD1-CD1 3.9Å; I102-I107 HydrophobicContact CD1-CG2 4.03Å; I102-I107 HydrophobicContact CG1-CG2 4.11Å
103	K	88.5	Confident	92.8	Very high	135 Å²	135	45.1 Å²	45.1	59%	0.587	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.4	39.9	-177	-65.2	-178	162.1	-172.5	0	113.1	P44 E46 R105	P44-K103 HydrophobicContact CB-CB 4.47Å; P44-K103 HydrophobicContact CB-CD 4.35Å; P44-K103 HydrophobicContact CG-CB 3.97Å; P44-K103 HydrophobicContact CG-CD 4.44Å; E46-K103 IonicContact OE2-NZ 2.91Å; E46-K103 PolarHBondContact OE2-NZ 3.47Å; K103-R105 VanDerWaalsContact C-N 3.33Å; K103-R105 PolarHBondContact O-N 3.11Å
104	G	89.1	Confident	92.2	Very high	76 Å²	76	52.3 Å²	52.3	78%	0.784	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	-0.6	179.6	0	0	0	0	0	116.1	I102	I102-G104 PolarHBondContact O-N 3.36Å; I102-G104 VanDerWaalsContact O-N 3.11Å
105	R	90.9	Very high	91.6	Very high	104 Å²	104	54.2 Å²	54.2	39%	0.392	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	130.5	176.8	-157.1	170.3	-173.8	163.9	3.5	110.9	G42 P44 K101 I102 K103	G42-R105 WeakPolarHBondContact O-CD 3.45Å; G42-R105 VanDerWaalsContact O-CG 3.31Å; G42-R105 WeakPolarHBondContact O-CG 3.46Å; P44-R105 HydrophobicContact CG-CB 4.41Å; K101-R105 CarbonylContact C-O 3.45Å; K101-R105 WeakPolarHBondContact CA-O 3.49Å; I102-R105 PolarHBondContact N-O 3.02Å; I102-R105 PolarHBondContact O-N 3.24Å; K103-R105 VanDerWaalsContact C-N 3.33Å; K103-R105 PolarHBondContact O-N 3.11Å
106	T	93.1	Very high	90.7	Very high	41 Å²	41	60.6 Å²	60.6	25%	0.252	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	125.3	174.2	-63.6	0	0	0	0	110	L4 I100	L4-T106 HydrophobicContact CD2-CG2 4.22Å; I100-T106 CarbonylContact O-C 3.56Å; I100-T106 WeakPolarHBondContact O-CA 3.43Å
107	I	94.5	Very high	89.8	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.3	C	S	.	.			trans	-91.6	155.7	174.5	74.9	171.8	0	0	0	110.4	G41 L43 F56 G99 I100 I102 V109	G41-I107 CarbonylContact O-C 3.56Å; G41-I107 VanDerWaalsContact O-CA 3.23Å; G41-I107 WeakPolarHBondContact O-CA 3.43Å; L43-I107 HydrophobicContact CD2-CG2 3.91Å; F56-I107 HydrophobicContact CE2-CD1 4.41Å; F56-I107 HydrophobicContact CZ-CD1 3.83Å; G99-I107 VanDerWaalsContact CA-O 3.29Å; G99-I107 WeakPolarHBondContact CA-O 3.42Å; G99-I107 PolarHBondContact N-O 2.57Å; I100-I107 HydrophobicContact CD1-CD1 3.61Å; I100-I107 HydrophobicContact CD1-CG1 4.25Å; I100-I107 HydrophobicContact CG1-CD1 3.37Å; I100-I107 HydrophobicContact CG1-CG1 3.43Å; I100-I107 VanDerWaalsContact CG1-CG1 3.43Å; I100-I107 PolarHBondContact O-N 3.08Å; I102-I107 HydrophobicContact CB-CG2 4.34Å; I102-I107 HydrophobicContact CD1-CD1 3.9Å; I102-I107 HydrophobicContact CD1-CG2 4.03Å; I102-I107 HydrophobicContact CG1-CG2 4.11Å; I107-V109 HydrophobicContact CD1-CG2 4.17Å; I107-V109 HydrophobicContact CG1-CG2 4.46Å
108	R	94.1	Very high	88.9	Confident	43 Å²	43	60.9 Å²	60.9	16%	0.162	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	134.2	172.7	176.4	-179.8	135.5	-135.2	-9.8	108.3	V7 L40 G41 D110	V7-R108 HydrophobicContact CG2-CB 3.68Å; V7-R108 HydrophobicContact CG2-CG 3.94Å; L40-R108 CarbonylContact C-O 3.58Å; L40-R108 WeakPolarHBondContact CA-O 3.29Å; G41-R108 PolarHBondContact N-O 2.87Å; G41-R108 PolarHBondContact O-N 3.21Å; R108-D110 IonicContact CZ-OD2 3.61Å; R108-D110 IonicContact NE-OD2 3.51Å; R108-D110 IonicContact NH2-OD2 2.87Å; R108-D110 PolarHBondContact NH2-OD2 3.48Å
109	V	95.3	Very high	87.5	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	137.4	174.1	-171.5	0	0	0	0	108.1	I38 F39 L40 F56 V94 F97 N98 I107	I38-V109 HydrophobicContact CB-CG1 4.45Å; I38-V109 HydrophobicContact CD1-CG1 3.97Å; F39-V109 WeakPolarHBondContact O-CA 3.3Å; L40-V109 HydrophobicContact CD2-CB 4.22Å; L40-V109 HydrophobicContact CD2-CG1 3.85Å; L40-V109 HydrophobicContact CD2-CG2 3.63Å; F56-V109 HydrophobicContact CE1-CG2 4.17Å; F56-V109 HydrophobicContact CZ-CG2 4.26Å; V94-V109 HydrophobicContact CB-CG1 4.45Å; V94-V109 HydrophobicContact CG2-CG1 3.85Å; F97-V109 HydrophobicContact CB-CG2 3.86Å; N98-V109 HydrophobicContact CB-CB 4.2Å; N98-V109 PolarHBondContact OD1-N 3.1Å; N98-V109 PolarHBondContact OD1-O 3.2Å; I107-V109 HydrophobicContact CD1-CG2 4.17Å; I107-V109 HydrophobicContact CG1-CG2 4.46Å
110	D	94.8	Very high	85.9	Confident	32 Å²	32	73.8 Å²	73.8	17%	0.171	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	149.1	-171.5	-156.4	-10.5	0	0	0	109.9	I38 F39 R108	I38-D110 CarbonylContact C-O 3.49Å; I38-D110 VanDerWaalsContact CA-O 3.28Å; I38-D110 WeakPolarHBondContact CA-O 3.32Å; F39-D110 HydrophobicContact CB-CB 4.31Å; F39-D110 HydrophobicContact CD1-CB 4.26Å; F39-D110 PolarHBondContact N-O 3.23Å; F39-D110 PolarHBondContact O-N 3.04Å; R108-D110 IonicContact CZ-OD2 3.61Å; R108-D110 IonicContact NE-OD2 3.51Å; R108-D110 IonicContact NH2-OD2 2.87Å; R108-D110 PolarHBondContact NH2-OD2 3.48Å
111	H	94.2	Very high	84.1	Confident	8 Å²	8	76.5 Å²	76.5	4%	0.037	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	152.1	174.8	-71.6	-76.8	0	0	0	111.2	W28 H29 Y32 T90	W28-H111 AromaticContact CH2-CD2 3.59Å; W28-H111 AromaticContact CZ3-CD2 3.62Å; H29-H111 AromaticContact CE1-NE2 3.69Å; H29-H111 AromaticContact CG-NE2 3.95Å; H29-H111 AromaticContact ND1-CD2 3.62Å; H29-H111 AromaticContact ND1-CE1 3.96Å; H29-H111 AromaticContact ND1-NE2 2.89Å; H29-H111 PolarHBondContact ND1-NE2 3.22Å; Y32-H111 HydrophobicContact CD1-CB 3.44Å; Y32-H111 VanDerWaalsContact CD1-CB 3.44Å; Y32-H111 HydrophobicContact CD2-CB 3.63Å; Y32-H111 AromaticContact CD2-CG 3.93Å; Y32-H111 HydrophobicContact CE1-CB 3.76Å; Y32-H111 HydrophobicContact CE2-CB 3.95Å; Y32-H111 HydrophobicContact CG-CB 3.35Å; Y32-H111 AromaticContact CG-CG 3.83Å; T90-H111 PolarHBondContact OG1-CE1 3.46Å; T90-H111 VanDerWaalsContact OG1-CE1 3.23Å
112	V	92.9	Very high	82.3	Confident	28 Å²	28	78.2 Å²	78.2	17%	0.17	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	114.7	174.3	-170.5	0	0	0	0	109.2	S35 W37 F39 F81	S35-V112 VanDerWaalsContact CB-O 3.29Å; S35-V112 WeakPolarHBondContact CB-O 3.34Å; S35-V112 PolarHBondContact OG-O 3.43Å; W37-V112 HydrophobicContact CB-CB 4.18Å; W37-V112 PolarHBondContact O-N 3.31Å; F39-V112 HydrophobicContact CB-CG2 3.49Å; F39-V112 VanDerWaalsContact CB-CG2 3.49Å; F81-V112 HydrophobicContact CD1-CG2 4.22Å; F81-V112 HydrophobicContact CE1-CG2 4.16Å
113	S	87.4	Confident	80.6	Confident	62 Å²	62	86 Å²	86	43%	0.434	45%	0.445	S	S	.	.	S	Bend	trans	-74.7	-39.7	-178.2	49	0	0	0	0	113.6	S35	S35-S113 VanDerWaalsContact CB-O 3.3Å; S35-S113 WeakPolarHBondContact CB-O 3.45Å; S35-S113 PolarHBondContact OG-O 2.98Å
114	N	82.7	Confident	79	Confident	151 Å²	151	83.9 Å²	83.9	81%	0.807	44%	0.439	S	S	*	.	S	Bend	trans	-123.8	50.1	-171.6	-69.7	-38.5	0	0	0	112.1
115	Y	81.4	Confident	77.6	Confident	40 Å²	40	86 Å²	86	16%	0.157	43%	0.432	C	S	.	.			trans	-77.9	128.3	174.8	-168.7	-107.9	0	0	0	111.1	W37 N66 F81 A117	W37-Y115 AromaticContact CD2-CD1 3.51Å; W37-Y115 HydrophobicContact CD2-CD1 3.51Å; W37-Y115 HydrophobicContact CD2-CE1 4.46Å; W37-Y115 HydrophobicContact CD2-CG 4.11Å; W37-Y115 AromaticContact CE2-CD1 3.85Å; W37-Y115 AromaticContact CE3-CD1 3.25Å; W37-Y115 HydrophobicContact CE3-CD1 3.25Å; W37-Y115 AromaticContact CE3-CE1 3.84Å; W37-Y115 HydrophobicContact CE3-CE1 3.84Å; W37-Y115 HydrophobicContact CE3-CG 4.05Å; W37-Y115 HydrophobicContact CG-CD1 4.26Å; W37-Y115 HydrophobicContact CG-CG 4.42Å; W37-Y115 AromaticContact CH2-CD1 3.73Å; W37-Y115 HydrophobicContact CH2-CD1 3.73Å; W37-Y115 AromaticContact CH2-CE1 3.86Å; W37-Y115 HydrophobicContact CH2-CE1 3.86Å; W37-Y115 AromaticContact CZ2-CD1 3.97Å; W37-Y115 HydrophobicContact CZ2-CD1 3.97Å; W37-Y115 HydrophobicContact CZ2-CE1 4.49Å; W37-Y115 AromaticContact CZ3-CD1 3.37Å; W37-Y115 HydrophobicContact CZ3-CD1 3.37Å; W37-Y115 AromaticContact CZ3-CE1 3.5Å; W37-Y115 HydrophobicContact CZ3-CE1 3.5Å; W37-Y115 VanDerWaalsContact CZ3-CE1 3.5Å; N66-Y115 PolarHBondContact ND2-OH 2.94Å; F81-Y115 HydrophobicContact CB-CD1 4.01Å; F81-Y115 HydrophobicContact CB-CD2 4.28Å; F81-Y115 HydrophobicContact CB-CE1 3.54Å; F81-Y115 HydrophobicContact CB-CE2 3.89Å; F81-Y115 HydrophobicContact CB-CG 4.33Å; F81-Y115 VanDerWaalsContact CB-CZ 3.47Å; F81-Y115 HydrophobicContact CD1-CD1 4.39Å; F81-Y115 AromaticContact CD1-CD2 3.3Å; F81-Y115 HydrophobicContact CD1-CD2 3.3Å; F81-Y115 HydrophobicContact CD1-CE1 4.39Å; F81-Y115 AromaticContact CD1-CE2 3.35Å; F81-Y115 HydrophobicContact CD1-CE2 3.35Å; F81-Y115 AromaticContact CD1-CG 3.86Å; F81-Y115 HydrophobicContact CD1-CG 3.86Å; F81-Y115 AromaticContact CD1-CZ 3.9Å; F81-Y115 HydrophobicContact CD2-CD2 4.13Å; F81-Y115 HydrophobicContact CD2-CE1 4.3Å; F81-Y115 AromaticContact CD2-CE2 3.26Å; F81-Y115 HydrophobicContact CD2-CE2 3.26Å; F81-Y115 AromaticContact CD2-CZ 3.34Å; F81-Y115 WeakPolarHBondContact CD2-OH 3.34Å; F81-Y115 AromaticContact CE1-CD2 3.46Å; F81-Y115 HydrophobicContact CE1-CD2 3.46Å; F81-Y115 VanDerWaalsContact CE1-CD2 3.46Å; F81-Y115 AromaticContact CE1-CE2 3.52Å; F81-Y115 HydrophobicContact CE1-CE2 3.52Å; F81-Y115 HydrophobicContact CE1-CG 4.38Å; F81-Y115 HydrophobicContact CE2-CD2 4.25Å; F81-Y115 AromaticContact CE2-CE2 3.43Å; F81-Y115 HydrophobicContact CE2-CE2 3.43Å; F81-Y115 VanDerWaalsContact CE2-CE2 3.43Å; F81-Y115 AromaticContact CE2-CZ 3.97Å; F81-Y115 HydrophobicContact CG-CD1 4.27Å; F81-Y115 AromaticContact CG-CD2 3.64Å; F81-Y115 HydrophobicContact CG-CD2 3.64Å; F81-Y115 AromaticContact CG-CE1 3.85Å; F81-Y115 HydrophobicContact CG-CE1 3.85Å; F81-Y115 AromaticContact CG-CE2 3.19Å; F81-Y115 HydrophobicContact CG-CE2 3.19Å; F81-Y115 HydrophobicContact CG-CG 4.15Å; F81-Y115 AromaticContact CG-CZ 3.28Å; F81-Y115 AromaticContact CZ-CD2 3.94Å; F81-Y115 HydrophobicContact CZ-CD2 3.94Å; F81-Y115 AromaticContact CZ-CE2 3.55Å; F81-Y115 HydrophobicContact CZ-CE2 3.55Å; Y115-A117 HydrophobicContact CE1-CB 3.98Å
116	R	75.3	Confident	76.4	Confident	190 Å²	190	85.6 Å²	85.6	72%	0.717	44%	0.438	S	S	*	.			trans	-118.6	108.1	170.3	-164.6	169.1	-173.4	-116.8	9.4	108.2
117	A	75.3	Confident	75.1	Confident	24 Å²	24	88.5 Å²	88.5	20%	0.198	46%	0.455	C	S	.	.			trans	-53.8	132.3	174.3	0	0	0	0	0	109.1	W37 Y115 K119	W37-A117 HydrophobicContact CH2-CB 4.09Å; Y115-A117 HydrophobicContact CE1-CB 3.98Å; A117-K119 PolarHBondContact O-N 3.15Å
118	P	76.3	Confident	73.7	Confident	74 Å²	74	89.8 Å²	89.8	48%	0.481	46%	0.463	S	S	.	.			trans	-50.8	126.9	167	-23.7	34.2	0	0	0	108.7	N66 D120	N66-P118 WeakPolarHBondContact ND2-CD 3.02Å; P118-D120 PolarHBondContact O-N 2.83Å
119	K	64.8	Low	72.4	Confident	170 Å²	170	94 Å²	94	74%	0.739	48%	0.479	S	S	*	.			trans	-73.6	84.3	171.2	-71.7	-178.1	176.3	-168.1	0	107	A117 S121	A117-K119 PolarHBondContact O-N 3.15Å; K119-S121 PolarHBondContact O-N 2.75Å
120	D	57.8	Low	70.9	Confident	133 Å²	133	98.6 Å²	98.6	71%	0.711	50%	0.5	S	S	*	.			trans	-68.1	123.1	163.2	-75	-41.6	0	0	0	107.3	P118	P118-D120 PolarHBondContact O-N 2.83Å
121	S	54.2	Low	69.5	Low	105 Å²	105	100.3 Å²	100.3	73%	0.734	51%	0.509	S	S	*	.			trans	-69.2	123.8	-168.4	41.2	0	0	0	0	111.9	K119	K119-S121 PolarHBondContact O-N 2.75Å
122	E	54.4	Low	67.9	Low	199 Å²	199	104.2 Å²	104.2	93%	0.93	53%	0.528	S	S	*	.	S	Bend	trans	87.5	4.4	146.2	-58.8	-173.5	-178.3	0	0	121.4
123	E	56.5	Low	66.3	Low	190 Å²	190	110.5 Å²	110.5	89%	0.888	56%	0.555	S	S	*	*			trans	-133.8	48.6	177.9	-144.2	174.2	-151.5	0	0	113.5
124	M	53.2	Low	65.4	Low	92 Å²	92	115.2 Å²	115.2	45%	0.453	57%	0.568	S	S	.	*			trans	-105.4	125.8	168.3	-85	-99.1	69.4	0	0	109.8	T128	M124-T128 HydrophobicContact CE-CG2 3.58Å; M124-T128 HydrophobicContact SD-CG2 3.45Å; M124-T128 WeakPolarHBondContact SD-CG2 3.37Å
125	D	60.8	Low	64.2	Low	121 Å²	121	110.3 Å²	110.3	65%	0.647	55%	0.553	S	S	*	*			trans	-49.6	141.9	171.8	-66.6	-49.4	0	0	0	110.8	V127 T128 R129	D125-V127 PolarHBondContact O-N 3.31Å; D125-T128 PolarHBondContact O-N 3.16Å; D125-R129 PolarHBondContact O-N 3.37Å; D125-R129 VanDerWaalsContact O-N 3.13Å
126	D	65.9	Low	63.1	Low	95 Å²	95	109.8 Å²	109.8	51%	0.508	56%	0.555	S	S	.	*	H	α-helix	trans	-53.9	-25.7	-177.7	-76.8	-57.5	0	0	0	112.9	R129 Q130	D126-R129 IonicContact OD1-CZ 3.13Å; D126-R129 IonicContact OD1-NH1 2.75Å; D126-R129 PolarHBondContact OD1-NH1 3.42Å; D126-R129 IonicContact OD1-NH2 2.83Å; D126-R129 PolarHBondContact OD1-NH2 2.97Å; D126-Q130 VanDerWaalsContact O-CG 3.29Å; D126-Q130 WeakPolarHBondContact O-CG 3.29Å; D126-Q130 PolarHBondContact O-N 2.97Å; D126-Q130 VanDerWaalsContact O-N 3.15Å
127	V	65.4	Low	62.2	Low	101 Å²	101	102.2 Å²	102.2	61%	0.612	54%	0.535	S	S	*	.	H	α-helix	trans	-68.5	-49.1	176.4	-179.6	0	0	0	0	111.5	D125 R129 Q130 L131	D125-V127 PolarHBondContact O-N 3.31Å; V127-R129 VanDerWaalsContact C-N 3.32Å; V127-R129 PolarHBondContact O-N 3.48Å; V127-Q130 PolarHBondContact O-N 3.37Å; V127-L131 HydrophobicContact CG1-CD1 4.22Å; V127-L131 PolarHBondContact O-N 2.91Å
128	T	66.1	Low	60.6	Low	28 Å²	28	105.5 Å²	105.5	17%	0.172	56%	0.562	C	S	.	*	H	α-helix	trans	-70.1	-33.5	-178.9	-37.9	0	0	0	0	111.1	M124 D125 L131 Q132	M124-T128 HydrophobicContact CE-CG2 3.58Å; M124-T128 HydrophobicContact SD-CG2 3.45Å; M124-T128 WeakPolarHBondContact SD-CG2 3.37Å; D125-T128 PolarHBondContact O-N 3.16Å; T128-L131 PolarHBondContact O-N 2.89Å; T128-Q132 PolarHBondContact O-N 2.93Å
129	R	66.3	Low	59.1	Low	132 Å²	132	113.4 Å²	113.4	50%	0.498	58%	0.583	S	S	.	*	H	α-helix	trans	-61.5	-43.5	171.8	-165.5	175.1	77.3	-126.1	-4.7	111.6	D125 D126 V127 Q132 E133	D125-R129 PolarHBondContact O-N 3.37Å; D125-R129 VanDerWaalsContact O-N 3.13Å; D126-R129 IonicContact OD1-CZ 3.13Å; D126-R129 IonicContact OD1-NH1 2.75Å; D126-R129 PolarHBondContact OD1-NH1 3.42Å; D126-R129 IonicContact OD1-NH2 2.83Å; D126-R129 PolarHBondContact OD1-NH2 2.97Å; V127-R129 VanDerWaalsContact C-N 3.32Å; V127-R129 PolarHBondContact O-N 3.48Å; R129-Q132 PolarHBondContact O-N 2.91Å; R129-E133 WeakPolarHBondContact O-CB 3.47Å; R129-E133 PolarHBondContact O-N 3.42Å
130	Q	63.9	Low	58.2	Low	95 Å²	95	108.8 Å²	108.8	44%	0.444	57%	0.569	S	S	.	*	H	α-helix	trans	-66.3	-36	176.1	-75.9	175.7	38.8	0	0	112.9	D126 V127 E133 K134	D126-Q130 VanDerWaalsContact O-CG 3.29Å; D126-Q130 WeakPolarHBondContact O-CG 3.29Å; D126-Q130 PolarHBondContact O-N 2.97Å; D126-Q130 VanDerWaalsContact O-N 3.15Å; V127-Q130 PolarHBondContact O-N 3.37Å; Q130-E133 PolarHBondContact O-N 3.15Å; Q130-K134 WeakPolarHBondContact O-CB 3.18Å; Q130-K134 WeakPolarHBondContact O-CD 3.43Å; Q130-K134 WeakPolarHBondContact O-CG 3.38Å; Q130-K134 PolarHBondContact O-N 2.87Å
131	L	65.3	Low	57.7	Low	68 Å²	68	108.1 Å²	108.1	36%	0.356	57%	0.572	S	S	.	*	H	α-helix	trans	-66.1	-41.2	174.1	-94.4	138.3	0	0	0	112	V63 V127 T128	V63-L131 HydrophobicContact CG1-CB 3.95Å; V63-L131 HydrophobicContact CG1-CD2 3.67Å; V63-L131 HydrophobicContact CG1-CG 4.3Å; V63-L131 HydrophobicContact CG2-CD2 4.13Å; V127-L131 HydrophobicContact CG1-CD1 4.22Å; V127-L131 PolarHBondContact O-N 2.91Å; T128-L131 PolarHBondContact O-N 2.89Å
132	Q	60.9	Low	56.7	Low	91 Å²	91	107.9 Å²	107.9	43%	0.425	57%	0.57	S	S	.	*	H	α-helix	trans	-63.3	-39.3	172.4	-87.3	-174.7	-7.1	0	0	112.9	T128 R129 G135	T128-Q132 PolarHBondContact O-N 2.93Å; R129-Q132 PolarHBondContact O-N 2.91Å; Q132-G135 PolarHBondContact O-N 3.48Å
133	E	59.5	Low	56.5	Low	160 Å²	160	105 Å²	105	75%	0.748	57%	0.568	S	S	*	*	H	α-helix	trans	-73.5	-32.7	-178.7	-170.6	171.7	-162	0	0	112.8	R129 Q130 G135	R129-E133 WeakPolarHBondContact O-CB 3.47Å; R129-E133 PolarHBondContact O-N 3.42Å; Q130-E133 PolarHBondContact O-N 3.15Å; E133-G135 PolarHBondContact O-N 2.92Å
134	K	66.7	Low	55.5	Low	161 Å²	161	100.3 Å²	100.3	70%	0.7	56%	0.557	S	S	*	*	H	α-helix	trans	-68.2	-17	176.3	-76.2	169.7	-174.7	173.6	0	113.5	Q130	Q130-K134 WeakPolarHBondContact O-CB 3.18Å; Q130-K134 WeakPolarHBondContact O-CD 3.43Å; Q130-K134 WeakPolarHBondContact O-CG 3.38Å; Q130-K134 PolarHBondContact O-N 2.87Å
135	G	58	Low	54.6	Low	47 Å²	47	103.7 Å²	103.7	49%	0.485	58%	0.576	S	S	.	*			trans	69.5	116.6	-178.7	0	0	0	0	0	111.7	Q132 E133 G137	Q132-G135 PolarHBondContact O-N 3.48Å; E133-G135 PolarHBondContact O-N 2.92Å; G135-G137 PolarHBondContact O-N 2.98Å
136	C	59	Low	53.3	Low	30 Å²	30	102.5 Å²	102.5	20%	0.203	58%	0.577	C	S	.	*	T	Hydrogen-bonded Turn	trans	-70.2	118.8	171	-56.1	0	0	0	0	108.2	A36 C83	A36-C136 HydrophobicContact CB-CB 4.01Å; C83-C136 VanDerWaalsContact SG-CB 3.56Å; C83-C136 PolarHBondContact SG-SG 3.14Å
137	G	55	Low	51.7	Low	30 Å²	30	107.1 Å²	107.1	31%	0.309	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	141.4	7.9	167	0	0	0	0	0	120.4	G135	G135-G137 PolarHBondContact O-N 2.98Å
138	A	43.2	Very low	50	Low	93 Å²	93	107.8 Å²	107.8	77%	0.769	61%	0.605	S	S	*	*	S	Bend	trans	-131.7	5.7	-173.3	0	0	0	0	0	118.5
139	R	44.3	Very low	48.5	Very low	241 Å²	241	110.7 Å²	110.7	91%	0.909	63%	0.626	S	S	*	*			trans	-135.6	81.9	176.8	-68.3	-161	168	-140.7	-5.7	113.4	P141	R139-P141 VanDerWaalsContact O-CD 3.27Å; R139-P141 WeakPolarHBondContact O-CD 3.26Å
140	T	45	Very low	46.9	Very low	73 Å²	73	113 Å²	113	45%	0.448	64%	0.643	S	S	.	*			trans	-79.8	111.3	148.7	40.3	0	0	0	0	107.8	D86 S142	D86-T140 WeakPolarHBondContact OD1-CG2 3.18Å; T140-S142 PolarHBondContact O-N 3.3Å
141	P	48.4	Very low	45.5	Very low	119 Å²	119	115.6 Å²	115.6	77%	0.773	66%	0.66	S	S	*	*			trans	-65.4	129.2	167	25.4	-29.4	0	0	0	108.8	R139	R139-P141 VanDerWaalsContact O-CD 3.27Å; R139-P141 WeakPolarHBondContact O-CD 3.26Å
142	S	33.4	Very low	44.1	Very low	99 Å²	99	119.9 Å²	119.9	69%	0.692	68%	0.678	S	S	*	*			trans	-60	135.2	173.3	50.4	0	0	0	0	110.7	T140 S144	T140-S142 PolarHBondContact O-N 3.3Å; S142-S144 PolarHBondContact O-N 3.07Å; S142-S144 VanDerWaalsContact O-N 3.07Å
143	P	50.1	Low	42.8	Very low	138 Å²	138	124.3 Å²	124.3	90%	0.896	70%	0.696	S	S	*	*			trans	-79.3	98.5	178.9	31.6	-30.1	0	0	0	109.4
144	S	34.1	Very low	41.8	Very low	93 Å²	93	121.5 Å²	121.5	65%	0.65	69%	0.691	S	S	*	*			trans	-138.6	99.8	160.1	62.7	0	0	0	0	110.1	S142	S142-S144 PolarHBondContact O-N 3.07Å; S142-S144 VanDerWaalsContact O-N 3.07Å
145	L	35.4	Very low	40	Very low	162 Å²	162	120 Å²	120	85%	0.848	70%	0.696	S	S	*	*			trans	63.9	107.6	144.2	-63.6	167.8	0	0	0	120.1
146	S	32.6	Very low	38.7	Very low	97 Å²	97	127 Å²	127	68%	0.678	71%	0.713	S	S	*	*				73	107.1	124.7	67.7	0	0	0	0	121
147	E	32.8	Very low	37.2	Very low	192 Å²	192	134.4 Å²	134.4	90%	0.897	74%	0.741	S	S	*	*				65.8	123.4	120.9	-57.5	-156.2	127.6	0	0	121.6
148	S	29.1	Very low	36.3	Very low	115 Å²	115	141 Å²	141	80%	0.804	76%	0.764	S	S	*	*			trans	135.4	131.3	134	-160.5	0	0	0	0	109.2
149	S	34.8	Very low	35.7	Very low	88 Å²	88	146 Å²	146	62%	0.615	77%	0.768	S	S	*	*			cis	178.6	156.2	-16.3	48.7	0	0	0	0	105.1
150	E	33.8	Very low	34.8	Very low	182 Å²	182	143 Å²	143	85%	0.85	76%	0.762	S	S	*	*			trans	82.2	105.6	156.9	-45.5	-169.8	143.5	0	0	120.9
151	D	34.8	Very low	34.3	Very low	149 Å²	149	146.5 Å²	146.5	80%	0.797	78%	0.778	S	S	*	*				35.6	124.1	121.6	-90.6	-102.2	0	0	0	124
152	E	36	Very low	33.5	Very low	157 Å²	157	150 Å²	150	73%	0.734	78%	0.781	S	S	*	*			trans	66.9	109.8	135.3	-68.3	-68.1	128.8	0	0	123.5
153	K	32.5	Very low	33.3	Very low	185 Å²	185	154.3 Å²	154.3	80%	0.804	79%	0.787	S	S	*	*			trans	18.2	168	137	-95.4	-176.6	175.7	173.5	0	122.9
154	P	38.2	Very low	32.6	Very low	101 Å²	101	157 Å²	157	66%	0.656	79%	0.788	S	S	*	*			cis	-140.8	170	-18	34.6	-12.8	0	0	0	117.5
155	T	28.9	Very low	32.7	Very low	129 Å²	129	161.6 Å²	161.6	79%	0.791	80%	0.796	S	S	*	*			trans	67.4	122.4	147.8	50.9	0	0	0	0	125.6
156	K	30.8	Very low	32.8	Very low	195 Å²	195	164.4 Å²	164.4	85%	0.848	80%	0.802	S	S	*	*			trans	38.9	113.9	138.2	-86.7	-179.8	177.5	169.9	0	120.7
157	K	29.1	Very low	33.2	Very low	184 Å²	184	169.3 Å²	169.3	80%	0.8	81%	0.811	S	S	*	*				157.1	150.4	99.7	-106.8	178.2	179.8	-177.6	0	113.9
158	H	34.8	Very low	33.6	Very low	169 Å²	169	168.7 Å²	168.7	78%	0.782	81%	0.805	S	S	*	*			trans	84.3	102.4	156.6	-83.5	-78.6	0	0	0	122.8
159	K	30.6	Very low	33.9	Very low	197 Å²	197	173.4 Å²	173.4	86%	0.857	81%	0.811	S	S	*	*			trans	-30	144.3	144.8	-173.7	176	-175.8	174.5	0	115.7
160	K	25.7	Very low	34.1	Very low	179 Å²	179	178.5 Å²	178.5	78%	0.778	82%	0.822	S	S	*	*			trans	107	95.3	155.7	-159.8	-177.6	178.7	-170.3	0	114.1
161	D	33.8	Very low	34.3	Very low	146 Å²	146	178.2 Å²	178.2	78%	0.781	82%	0.821	S	S	*	*				-168.8	128.7	100.3	-95.3	-49.3	0	0	0	112.3
162	K	31.4	Very low	34.5	Very low	193 Å²	193	181.1 Å²	181.1	84%	0.839	83%	0.826	S	S	*	*			trans	-87.9	140.6	174.2	175.7	178.6	178.9	178.7	0	105.9
163	K	30.9	Very low	34.8	Very low	189 Å²	189	182.3 Å²	182.3	82%	0.822	83%	0.832	S	S	*	*			trans	75.1	84.8	154.7	-171.9	-172.1	-176.6	-173.1	0	115.8
164	E	34.8	Very low	35.2	Very low	194 Å²	194	183.3 Å²	183.3	91%	0.907	84%	0.836	S	S	*	*			trans	-179.2	88	135.5	-106.2	-169.3	140.5	0	0	111.8
165	K	35.5	Very low	35.2	Very low	191 Å²	191	182.9 Å²	182.9	83%	0.83	84%	0.841	S	S	*	*			trans	-168.3	22.8	149.1	-119.8	172.1	179.3	174.4	0	114.9	K167	K165-K167 PolarHBondContact O-N 3.4Å; K165-K167 VanDerWaalsContact O-N 3.15Å
166	K	38.6	Very low	35.4	Very low	221 Å²	221	185 Å²	185	96%	0.961	85%	0.847	S	S	*	*	S	Bend	trans	-84.9	52	163.4	-163.8	179.9	-179	178.3	0	109.6
167	K	40	Very low	35.6	Very low	200 Å²	200	187.2 Å²	187.2	87%	0.87	85%	0.85	S	S	*	*	S	Bend	trans	-167.8	50	175.1	-149.1	180	-178	-173.7	0	111.8	K165	K165-K167 PolarHBondContact O-N 3.4Å; K165-K167 VanDerWaalsContact O-N 3.15Å
168	K	40.9	Very low	35.7	Very low	179 Å²	179	187.6 Å²	187.6	78%	0.778	86%	0.855	S	S	*	*	S	Bend	trans	-166.7	52.7	164.4	-118.1	177.7	-179.3	-177.4	0	111.6
169	K	36.7	Very low	35.6	Very low	214 Å²	214	185.8 Å²	185.8	93%	0.93	86%	0.855	S	S	*	*	S	Bend	trans	-152	49.8	163.4	-159	177.5	-179.4	-178.1	0	108.3
170	K	37.5	Very low	35.8	Very low	195 Å²	195	185.5 Å²	185.5	85%	0.848	86%	0.857	S	S	*	*	S	Bend	trans	-141.5	24.1	173.9	-153.3	-175.4	178.2	-178.3	0	111
171	E	38.9	Very low	36.2	Very low	176 Å²	176	181.2 Å²	181.2	82%	0.822	86%	0.855	S	S	*	*	S	Bend	trans	-143.5	31.8	-178.5	-74.9	-169	138.8	0	0	112.2
172	K	39.2	Very low	36	Very low	210 Å²	210	183.5 Å²	183.5	91%	0.913	86%	0.861	S	S	*	*	S	Bend	trans	-138.2	44.1	167.5	-154.8	-179.3	-179.8	-176.7	0	111
173	E	41	Very low	36.2	Very low	181 Å²	181	182.8 Å²	182.8	85%	0.846	86%	0.861	S	S	*	*	S	Bend	trans	-133.4	25	177.1	-149.3	-177.5	179.2	0	0	110.6
174	K	41.1	Very low	36.6	Very low	207 Å²	207	178.7 Å²	178.7	90%	0.9	85%	0.854	S	S	*	*	S	Bend	trans	-150.5	78.9	177.2	-74.2	-166.7	176.8	-169.4	0	109.8
175	A	38.3	Very low	36.2	Very low	91 Å²	91	174.2 Å²	174.2	75%	0.752	84%	0.844	S	S	*	*	S	Bend	trans	178.9	78.5	157.4	0	0	0	0	0	106.7
176	D	34.4	Very low	35.9	Very low	173 Å²	173	170.1 Å²	170.1	93%	0.925	84%	0.839	S	S	*	*	S	Bend	trans	172.1	67.8	151	-92.3	-40.8	0	0	0	109
177	R	33.9	Very low	35.5	Very low	243 Å²	243	165.3 Å²	165.3	92%	0.917	83%	0.833	S	S	*	*			trans	-164.5	89.2	158	-144.6	174.8	-178.1	170.8	0.4	112.1
178	E	31.3	Very low	35.1	Very low	191 Å²	191	161.2 Å²	161.2	89%	0.893	83%	0.83	S	S	*	*			trans	-176.8	120.2	154.3	-106.3	172.1	169.5	0	0	104.1
179	V	33.4	Very low	35.2	Very low	131 Å²	131	158 Å²	158	79%	0.794	83%	0.827	S	S	*	*				-159.1	128.7	59.5	178.2	0	0	0	0	109.3
180	Q	34.3	Very low	34.7	Very low	192 Å²	192	158.4 Å²	158.4	90%	0.897	82%	0.823	S	S	*	*				178.6	113.2	118.1	-93.2	-172.4	13.1	0	0	109.2
181	A	34.3	Very low	34.2	Very low	89 Å²	89	153.9 Å²	153.9	74%	0.736	81%	0.814	S	S	*	*			trans	-92.8	153.5	165.2	0	0	0	0	0	108.7
182	E	29.9	Very low	33.9	Very low	193 Å²	193	153.7 Å²	153.7	90%	0.902	81%	0.811	S	S	*	*				-176.6	141.5	123.2	-79.9	-104.9	138.4	0	0	108.3
183	Q	34.2	Very low	33.5	Very low	178 Å²	178	148.5 Å²	148.5	83%	0.832	80%	0.797	S	S	*	*			trans	-98.1	-162.5	-170.9	-70.7	-91.7	-10.2	0	0	110.2
184	P	40.4	Very low	33.3	Very low	104 Å²	104	147.5 Å²	147.5	68%	0.675	80%	0.796	S	S	*	*			cis	-139.9	176.1	-12.3	21.1	5.6	0	0	0	116.8
185	S	27	Very low	33	Very low	100 Å²	100	145 Å²	145	70%	0.699	79%	0.785	S	S	*	*			trans	78.5	127.6	138.4	66.1	0	0	0	0	124.7
186	S	28.7	Very low	32.7	Very low	105 Å²	105	147 Å²	147	73%	0.734	78%	0.779	S	S	*	*			trans	55.1	119.9	136.6	67.1	0	0	0	0	121.8
187	S	29	Very low	32.7	Very low	119 Å²	119	145.6 Å²	145.6	83%	0.832	77%	0.765	S	S	*	*				169.1	131.9	118.3	47.4	0	0	0	0	111.9
188	S	32	Very low	32.8	Very low	114 Å²	114	139.7 Å²	139.7	80%	0.797	75%	0.751	S	S	*	*			trans	-73.3	157.3	150.2	-91.8	0	0	0	0	108.2
189	P	42.5	Very low	33.1	Very low	112 Å²	112	137.1 Å²	137.1	73%	0.727	74%	0.744	S	S	*	*				-160.3	171.5	66.7	41.6	-19.2	0	0	0	120
190	R	27.3	Very low	33.7	Very low	223 Å²	223	136 Å²	136	84%	0.842	74%	0.739	S	S	*	*			trans	81.1	115.7	140.9	-88.8	-177.5	172.6	-169.7	-0.4	119.6
191	C	27.4	Very low	33.5	Very low	99 Å²	99	130.3 Å²	130.3	67%	0.669	73%	0.732	S	S	*	*				95.3	142.2	96.9	-89.3	0	0	0	0	111.5
192	K	32.6	Very low	34.1	Very low	173 Å²	173	132 Å²	132	75%	0.752	74%	0.735	S	S	*	*			cis	-170	150.1	23.3	-118.1	159.8	-168.6	-174.8	0	108.8
193	T	29.5	Very low	34.2	Very low	101 Å²	101	131.6 Å²	131.6	62%	0.62	73%	0.73	S	S	*	*			trans	24.8	136.5	141.9	32.9	0	0	0	0	120.1
194	I	37.4	Very low	34	Very low	160 Å²	160	130.6 Å²	130.6	82%	0.821	72%	0.723	S	S	*	*				-148.6	118.6	74.2	-77.9	150.5	0	0	0	107.7
195	K	34.7	Very low	33.5	Very low	155 Å²	155	132.9 Å²	132.9	67%	0.674	72%	0.724	S	S	*	*				55.2	134.2	78.6	-96.3	-167.9	177.5	-171.4	0	111.4
196	E	32	Very low	33.6	Very low	133 Å²	133	132.5 Å²	132.5	62%	0.621	72%	0.722	S	S	*	*			cis	-164.3	159.4	21	-97.4	177	107.7	0	0	102.6
197	K	35.7	Very low	33.7	Very low	143 Å²	143	132.4 Å²	132.4	62%	0.622	72%	0.721	S	S	*	*			cis	164.7	171.5	8.5	-102	179	173	173.3	0	103.2
198	D	35	Very low	33.8	Very low	118 Å²	118	135.9 Å²	135.9	63%	0.631	72%	0.721	S	S	*	*			cis	176.1	161.4	-2.8	-103.2	-21.1	0	0	0	99.4
199	D	37.1	Very low	33.6	Very low	138 Å²	138	137.7 Å²	137.7	74%	0.738	72%	0.722	S	S	*	*			cis	-176.3	-171.4	-22.8	-134.3	-108.4	0	0	0	101.7
200	P	46.9	Very low	33.2	Very low	108 Å²	108	136.8 Å²	136.8	70%	0.701	72%	0.718	S	S	*	*			trans	-132.9	-173.5	-135.9	18.6	13.1	0	0	0	111.4
201	G	29.4	Very low	33.5	Very low	72 Å²	72	134.2 Å²	134.2	74%	0.742	72%	0.716	S	S	*	*			trans	76.3	174.2	156.7	0	0	0	0	0	116.9
202	P	46.4	Very low	33.5	Very low	124 Å²	124	140.3 Å²	140.3	81%	0.805	73%	0.725	S	S	*	*			cis	-121.8	154	12.8	17.6	8	0	0	0	113.7
203	K	33.5	Very low	33.4	Very low	185 Å²	185	135.7 Å²	135.7	80%	0.804	72%	0.719	S	S	*	*				62.4	117.3	82.8	-77.6	-175.2	-178.3	171.2	0	118.6
204	K	29.7	Very low	33.7	Very low	156 Å²	156	139 Å²	139	68%	0.678	73%	0.727	S	S	*	*				101	138.9	116.5	-87.5	177.9	165	-151.9	0	123.2
205	H	30.8	Very low	33.2	Very low	152 Å²	152	141.4 Å²	141.4	70%	0.704	73%	0.732	S	S	*	*			trans	71.7	152.3	149.2	-64.8	-51.9	0	0	0	117.7
206	S	28.1	Very low	33.1	Very low	93 Å²	93	138.7 Å²	138.7	65%	0.65	74%	0.738	S	S	*	*			cis	-177.2	152.2	-12.1	50.1	0	0	0	0	108.6
207	S	31	Very low	33.2	Very low	102 Å²	102	140.2 Å²	140.2	71%	0.713	75%	0.745	S	S	*	*			trans	65.3	130.9	141.7	59.6	0	0	0	0	124.6
208	K	30.6	Very low	33.6	Very low	193 Å²	193	139 Å²	139	84%	0.839	75%	0.752	S	S	*	*			trans	88.4	105.6	133.3	-90.1	-177.3	171.3	172.9	0	122.2
209	N	27.6	Very low	33.4	Very low	152 Å²	152	143.9 Å²	143.9	81%	0.813	76%	0.762	S	S	*	*				86.8	151.1	106.1	-142	24.7	0	0	0	122.9
210	S	33.8	Very low	33.2	Very low	92 Å²	92	146.3 Å²	146.3	64%	0.643	77%	0.769	S	S	*	*			trans	82.8	137.6	170.1	87.9	0	0	0	0	116.7
211	E	34	Very low	32.3	Very low	170 Å²	170	144.2 Å²	144.2	79%	0.794	77%	0.767	S	S	*	*			cis	-162.7	129.3	13	-126.6	162.8	116.7	0	0	108
212	R	27.6	Very low	32.4	Very low	227 Å²	227	148.6 Å²	148.6	86%	0.857	77%	0.768	S	S	*	*				32.2	121.1	112.1	-147.7	175	-174.5	-159.9	0.2	114.1
213	A	31	Very low	31.6	Very low	75 Å²	75	151.5 Å²	151.5	62%	0.62	77%	0.768	S	S	*	*				178.5	143	71.5	0	0	0	0	0	113.5
214	Q	34.6	Very low	31.5	Very low	172 Å²	172	149.6 Å²	149.6	80%	0.804	77%	0.766	S	S	*	*			trans	62.9	110.3	137.5	-59.7	171.4	43.6	0	0	118.9
215	K	28.5	Very low	31.9	Very low	209 Å²	209	148.2 Å²	148.2	91%	0.909	77%	0.773	S	S	*	*				74.3	104.7	58.1	-156.6	-168.6	-159.9	-163.3	0	113.6
216	A	31	Very low	32.2	Very low	98 Å²	98	150.1 Å²	150.1	81%	0.81	78%	0.779	S	S	*	*				165.4	123.5	126.8	0	0	0	0	0	113.5
217	E	34.1	Very low	32.3	Very low	165 Å²	165	151 Å²	151	77%	0.771	79%	0.785	S	S	*	*			trans	-62.2	167.6	153.5	-80	-77.7	142.9	0	0	111
218	P	44.3	Very low	32.2	Very low	119 Å²	119	157 Å²	157	77%	0.773	79%	0.792	S	S	*	*			cis	-154.6	176.9	45.8	39.2	-14.8	0	0	0	120.4
219	R	31.2	Very low	32.1	Very low	219 Å²	219	153.8 Å²	153.8	83%	0.826	79%	0.789	S	S	*	*			trans	-19	154.3	156.9	-59.8	178.1	172.5	173.9	-3.2	116.8
220	E	33.1	Very low	32.3	Very low	189 Å²	189	149.9 Å²	149.9	88%	0.883	78%	0.778	S	S	*	*			cis	-179.4	157.8	49.3	-152.3	175.2	-162.6	0	0	110.1
221	G	28.3	Very low	32	Very low	64 Å²	64	156.3 Å²	156.3	66%	0.66	79%	0.789	S	S	*	*			trans	117.9	108.7	138.6	0	0	0	0	0	122
222	Q	30.4	Very low	31.8	Very low	164 Å²	164	153.2 Å²	153.2	77%	0.766	79%	0.786	S	S	*	*				88.8	127.1	125.9	-67.3	-173.4	29.4	0	0	123.5
223	K	31.1	Very low	31.7	Very low	185 Å²	185	146.4 Å²	146.4	80%	0.804	79%	0.787	S	S	*	*			trans	106.3	115.4	134.7	-78.9	162.6	-178	173.9	0	120.8
224	L	31.1	Very low	31.6	Very low	146 Å²	146	147 Å²	147	76%	0.764	80%	0.801	S	S	*	*			trans	-56.5	155.7	150.3	-92.8	147	0	0	0	111.8
225	P	37.6	Very low	31.7	Very low	127 Å²	127	143.2 Å²	143.2	83%	0.825	80%	0.799	S	S	*	*				-145.8	165.2	91	33.9	-14.7	0	0	0	116.8
226	K	36.6	Very low	32.1	Very low	192 Å²	192	142.9 Å²	142.9	84%	0.835	80%	0.8	S	S	*	*			trans	-97.4	145.4	169.5	-72.9	174	173	173.8	0	110.8
227	S	30.2	Very low	32.4	Very low	110 Å²	110	145.2 Å²	145.2	77%	0.769	80%	0.8	S	S	*	*			trans	-172.8	113.5	146.8	49.4	0	0	0	0	108.8
228	R	30	Very low	32.8	Very low	228 Å²	228	145.8 Å²	145.8	86%	0.86	81%	0.807	S	S	*	*				76.8	129.8	84.6	-78.9	-174.5	82.1	119	-1.9	115.2
229	T	28.9	Very low	32.5	Very low	126 Å²	126	148.1 Å²	148.1	77%	0.773	81%	0.807	S	S	*	*			trans	70.4	145.1	148.5	38.3	0	0	0	0	117.9
230	A	31.7	Very low	32.7	Very low	71 Å²	71	149.3 Å²	149.3	59%	0.587	81%	0.812	S	S	*	*			cis	-176.4	173.3	-4.3	0	0	0	0	0	109.1
231	Y	25.8	Very low	32.9	Very low	226 Å²	226	146 Å²	146	89%	0.886	80%	0.796	S	S	*	*			trans	66.1	149.2	163.9	-73.7	-87.4	0	0	0	116.2
232	S	30.5	Very low	33.3	Very low	105 Å²	105	151.5 Å²	151.5	73%	0.734	81%	0.81	S	S	*	*			cis	-170.7	140.6	12	33.9	0	0	0	0	104.8
233	G	25.8	Very low	33.5	Very low	85 Å²	85	150 Å²	150	88%	0.876	80%	0.801	S	S	*	*				94.7	126.8	93.2	0	0	0	0	0	111.9
234	G	29.3	Very low	33.6	Very low	87 Å²	87	149 Å²	149	90%	0.897	80%	0.796	S	S	*	*			trans	156.5	87.6	172.4	0	0	0	0	0	113.1
235	A	35.5	Very low	33.7	Very low	93 Å²	93	149.4 Å²	149.4	77%	0.769	79%	0.794	S	S	*	*			trans	-83.9	150.4	175	0	0	0	0	0	111.3
236	E	38.4	Very low	33.7	Very low	201 Å²	201	152.6 Å²	152.6	94%	0.939	80%	0.795	S	S	*	*			trans	-145	127.3	141.1	-67.1	-162.1	161.6	0	0	110.4
237	D	37	Very low	34.1	Very low	148 Å²	148	149.4 Å²	149.4	79%	0.791	79%	0.794	S	S	*	*			trans	-77.8	149.6	-179.6	-104.8	-45.7	0	0	0	112.5
238	L	41.9	Very low	34.2	Very low	177 Å²	177	153.8 Å²	153.8	93%	0.927	80%	0.799	S	S	*	*			trans	-153.2	105.9	142	-123.5	149.5	0	0	0	110.9
239	E	37.8	Very low	34.3	Very low	167 Å²	167	150.4 Å²	150.4	78%	0.78	79%	0.793	S	S	*	*			trans	-61.7	147.2	173.7	-62.8	176.9	122.3	0	0	113.1
240	R	36.2	Very low	34.4	Very low	245 Å²	245	151.1 Å²	151.1	93%	0.925	79%	0.788	S	S	*	*				-165.3	119.2	116.1	-169.7	162.4	-72.5	-148.8	-2.3	111.9
241	E	36.4	Very low	34.6	Very low	118 Å²	118	154.4 Å²	154.4	55%	0.551	79%	0.791	S	S	*	*			trans	-67.6	161.4	172.1	-69	-155.2	141.2	0	0	114.3	K243	E241-K243 WeakPolarHBondContact OE1-CE 3.38Å; E241-K243 IonicContact OE1-NZ 2.92Å; E241-K243 PolarHBondContact OE1-NZ 3.29Å; E241-K243 VanDerWaalsContact OE2-CD 3.3Å; E241-K243 WeakPolarHBondContact OE2-CD 3.34Å; E241-K243 WeakPolarHBondContact OE2-CE 3.27Å; E241-K243 IonicContact OE2-NZ 2.7Å; E241-K243 PolarHBondContact OE2-NZ 3.15Å
242	L	36.9	Very low	34.9	Very low	181 Å²	181	152.4 Å²	152.4	95%	0.948	79%	0.786	S	S	*	*				-153	138	115.4	-100.5	164.7	0	0	0	111.4
243	K	33.9	Very low	34.9	Very low	131 Å²	131	152.2 Å²	152.2	57%	0.57	79%	0.785	S	S	*	*			trans	-95.4	154.2	-163.4	-79.7	168.9	164.2	126.4	0	113.7	E241	E241-K243 WeakPolarHBondContact OE1-CE 3.38Å; E241-K243 IonicContact OE1-NZ 2.92Å; E241-K243 PolarHBondContact OE1-NZ 3.29Å; E241-K243 VanDerWaalsContact OE2-CD 3.3Å; E241-K243 WeakPolarHBondContact OE2-CD 3.34Å; E241-K243 WeakPolarHBondContact OE2-CE 3.27Å; E241-K243 IonicContact OE2-NZ 2.7Å; E241-K243 PolarHBondContact OE2-NZ 3.15Å
244	K	34.7	Very low	35.3	Very low	165 Å²	165	153.3 Å²	153.3	72%	0.717	78%	0.78	S	S	*	*			trans	62.9	153.3	133.4	-74.8	171.6	155	-140.6	0	118.2
245	E	31.9	Very low	35.4	Very low	155 Å²	155	154.6 Å²	154.6	72%	0.724	78%	0.775	S	S	*	*			cis	-166.8	165.4	23.6	-131.4	161.6	-146	0	0	111.2
246	K	37.9	Very low	35.3	Very low	193 Å²	193	159.4 Å²	159.4	84%	0.839	77%	0.773	S	S	*	*			trans	-81.7	159.2	165.1	-71.6	178.2	173.2	178.2	0	110.8
247	P	44.6	Very low	35.1	Very low	125 Å²	125	158.4 Å²	158.4	81%	0.812	76%	0.76	S	S	*	*				-147.4	156.6	102.7	26.7	-4.5	0	0	0	112.8
248	K	33.5	Very low	35.2	Very low	202 Å²	202	158.1 Å²	158.1	88%	0.878	76%	0.755	S	S	*	*				85.9	106.9	56.5	-104.8	-169	-176.8	-174.8	0	117.4
249	H	30.7	Very low	34.9	Very low	157 Å²	157	154.2 Å²	154.2	73%	0.727	75%	0.747	S	S	*	*			trans	77.9	137	133.8	-119.6	-115.5	0	0	0	125.1
250	E	32.8	Very low	34.6	Very low	142 Å²	142	157.5 Å²	157.5	66%	0.664	75%	0.753	S	S	*	*			trans	78.4	149.1	151.3	-54.5	-163.5	173.3	0	0	121.8
251	H	34.8	Very low	34.8	Very low	140 Å²	140	153.1 Å²	153.1	65%	0.648	74%	0.743	S	S	*	*			cis	-168.4	159	-13.1	-108.6	-51	0	0	0	109.9
252	K	31.9	Very low	34.8	Very low	183 Å²	183	156.1 Å²	156.1	80%	0.796	76%	0.757	S	S	*	*			trans	79.2	107.2	144.2	-83.1	177.5	179.1	174.2	0	123.7
253	S	30.2	Very low	34.8	Very low	101 Å²	101	155 Å²	155	71%	0.706	74%	0.744	S	S	*	*				52.5	121	122.4	59.7	0	0	0	0	123.2
254	S	34.8	Very low	34.8	Very low	109 Å²	109	154 Å²	154	76%	0.762	75%	0.749	S	S	*	*				143.6	155.1	102	76.1	0	0	0	0	114.7
255	S	32.1	Very low	34.9	Very low	114 Å²	114	157 Å²	157	80%	0.797	76%	0.756	S	S	*	*			trans	91.2	143.7	160.6	88.8	0	0	0	0	117.5
256	R	32	Very low	35.3	Very low	193 Å²	193	156.6 Å²	156.6	73%	0.728	76%	0.757	S	S	*	*			cis	172.8	143.8	-11.2	171	167.5	-166.3	-177.4	7.6	106.1
257	R	36	Very low	35.1	Very low	180 Å²	180	158.4 Å²	158.4	68%	0.679	76%	0.759	S	S	*	*			trans	77.6	146.4	150.6	-86.8	-176.2	161.7	163.4	-0.3	119.9
258	E	38	Very low	34.7	Very low	143 Å²	143	158.5 Å²	158.5	67%	0.668	75%	0.752	S	S	*	*			cis	-156.8	140	-6.2	-85.5	-164.5	173.5	0	0	107.8
259	A	35.2	Very low	35	Very low	94 Å²	94	160.8 Å²	160.8	78%	0.777	76%	0.755	S	S	*	*				66.1	124.3	99.4	0	0	0	0	0	117.2
260	R	33	Very low	35.1	Very low	237 Å²	237	156.9 Å²	156.9	89%	0.894	76%	0.758	S	S	*	*				-164.9	130.9	124.8	-158.2	166.2	-176	-166.2	-1.6	113.1
261	E	40.2	Very low	35.3	Very low	152 Å²	152	162.2 Å²	162.2	71%	0.71	77%	0.772	S	S	*	*			trans	-80.1	157.2	170.9	-63.8	172.2	109.9	0	0	113.6	K263	E261-K263 IonicContact OE1-NZ 3.99Å
262	E	35.5	Very low	35.4	Very low	181 Å²	181	160.1 Å²	160.1	85%	0.846	77%	0.773	S	S	*	*			trans	179.5	119.2	133.3	-112.7	-178.9	151.8	0	0	107.4
263	K	37.4	Very low	35.8	Very low	158 Å²	158	156.5 Å²	156.5	69%	0.687	77%	0.771	S	S	*	*			cis	85.3	119.2	24	-127.5	180	-167.5	168.6	0	116.5	E261	E261-K263 IonicContact OE1-NZ 3.99Å
264	T	34.1	Very low	36.2	Very low	109 Å²	109	158.6 Å²	158.6	67%	0.669	77%	0.774	S	S	*	*			trans	88	136.2	159.1	76.1	0	0	0	0	117.1
265	R	36.8	Very low	36.4	Very low	230 Å²	230	160.4 Å²	160.4	87%	0.868	78%	0.781	S	S	*	*			cis	-150.3	126.2	45.2	-61.5	169	-178.8	169.1	-1.3	110.5
266	I	39	Very low	36.6	Very low	145 Å²	145	163.5 Å²	163.5	74%	0.744	78%	0.782	S	S	*	*				55.2	115.7	86.6	-56.9	173.9	0	0	0	115
267	R	33.7	Very low	36.6	Very low	231 Å²	231	159 Å²	159	87%	0.872	78%	0.781	S	S	*	*				-170.9	113.9	118.8	-145.8	163.3	-178.1	155.9	-2.3	115.7
268	D	36.9	Very low	37	Very low	127 Å²	127	155.3 Å²	155.3	68%	0.679	78%	0.782	S	S	*	*			trans	30.1	125.1	140.2	-58.8	-59.2	0	0	0	124.5
269	R	39.6	Very low	36.7	Very low	250 Å²	250	158.7 Å²	158.7	94%	0.943	79%	0.789	S	S	*	*				172.3	118.3	114.8	-95.2	174.2	-179.8	138.7	-2.1	106.5
270	G	32.9	Very low	36.6	Very low	76 Å²	76	162.4 Å²	162.4	78%	0.784	78%	0.784	S	S	*	*			cis	103.3	122	31.1	0	0	0	0	0	109.4
271	R	36.5	Very low	36.7	Very low	253 Å²	253	158.3 Å²	158.3	96%	0.955	78%	0.78	S	S	*	*			trans	110.1	131.6	163.8	-164.1	174.8	-106.9	-148.7	-7.5	115.4
272	S	36.7	Very low	36.2	Very low	96 Å²	96	154.5 Å²	154.5	67%	0.671	78%	0.782	S	S	*	*			cis	155.7	132.6	-23.4	162.7	0	0	0	0	105.9
273	S	41.4	Very low	36	Very low	107 Å²	107	158 Å²	158	75%	0.748	79%	0.787	S	S	*	*			trans	150.1	97.9	144.2	64.8	0	0	0	0	109
274	D	38.3	Very low	35.8	Very low	145 Å²	145	154.8 Å²	154.8	78%	0.775	79%	0.785	S	S	*	*				60	108.9	80.8	-72.9	-59.4	0	0	0	115
275	T	38.6	Very low	36.1	Very low	148 Å²	148	158.7 Å²	158.7	91%	0.908	80%	0.795	S	S	*	*			trans	-152.3	101.7	139	-31.8	0	0	0	0	110.5
276	H	36.6	Very low	35.8	Very low	178 Å²	178	150.8 Å²	150.8	82%	0.824	79%	0.786	S	S	*	*			trans	-55.4	149.2	157.1	-141.6	-129.6	0	0	0	108.8
277	S	32.2	Very low	35.8	Very low	99 Å²	99	155.7 Å²	155.7	69%	0.692	80%	0.795	S	S	*	*				177	141	55.1	48.7	0	0	0	0	109.8
278	S	43.5	Very low	35.8	Very low	102 Å²	102	148.3 Å²	148.3	71%	0.713	78%	0.779	S	S	*	*			trans	-75	146.4	157.6	71.1	0	0	0	0	110.5
279	W	31.9	Very low	35.9	Very low	215 Å²	215	150.6 Å²	150.6	81%	0.814	79%	0.785	S	S	*	*			trans	-171.3	147.5	137.5	-112.9	-9.2	0	0	0	116.6
280	Y	34.4	Very low	35.8	Very low	171 Å²	171	148.7 Å²	148.7	67%	0.671	78%	0.778	S	S	*	*			trans	87.4	100.2	156.5	-68.9	-69.5	0	0	0	123.3
281	N	34.5	Very low	36.1	Very low	152 Å²	152	150.4 Å²	150.4	81%	0.813	78%	0.778	S	S	*	*				38.4	119.8	117.6	-81	-11.8	0	0	0	122.1
282	G	29.5	Very low	36.2	Very low	72 Å²	72	146.9 Å²	146.9	74%	0.742	76%	0.764	S	S	*	*				99	130.2	95.7	0	0	0	0	0	121.1
283	R	32.2	Very low	36.2	Very low	253 Å²	253	147.6 Å²	147.6	96%	0.955	77%	0.77	S	S	*	*			trans	72.1	149.8	156.2	-84.2	-179.4	168.2	-154.4	-3	117.6
284	S	32.2	Very low	36.1	Very low	91 Å²	91	152.4 Å²	152.4	64%	0.636	77%	0.771	S	S	*	*			cis	-174.5	166.6	-2.9	178.5	0	0	0	0	107.3
285	E	39.7	Very low	36.1	Very low	192 Å²	192	150.6 Å²	150.6	90%	0.897	77%	0.77	S	S	*	*			trans	76.5	136.1	164.3	-46.2	-169.7	151.2	0	0	116.6
286	G	32.3	Very low	36.2	Very low	64 Å²	64	155.5 Å²	155.5	66%	0.66	77%	0.772	S	S	*	*			cis	151.2	143.4	8	0	0	0	0	0	108.4
287	R	37.1	Very low	36.4	Very low	247 Å²	247	153.9 Å²	153.9	93%	0.932	77%	0.769	S	S	*	*			trans	68.3	150.4	162.7	-58.5	-179.8	-180	-144.8	0.1	115.6
288	S	35	Very low	36.8	Very low	77 Å²	77	159.2 Å²	159.2	54%	0.538	78%	0.78	S	S	.	*			cis	180	129.8	-1.9	39.6	0	0	0	0	107.6
289	H	39.3	Very low	36.6	Very low	175 Å²	175	158.5 Å²	158.5	81%	0.81	78%	0.775	S	S	*	*			trans	11.3	124.6	143.1	35.9	-92.7	0	0	0	120
290	R	36.7	Very low	37	Very low	209 Å²	209	157.8 Å²	157.8	79%	0.789	78%	0.78	S	S	*	*				-162.3	112.2	129.7	-136.7	168.2	-167	170	8.2	114.4
291	S	40.4	Very low	37.1	Very low	113 Å²	113	159.1 Å²	159.1	79%	0.79	78%	0.784	S	S	*	*			trans	-71.5	143	155.8	37	0	0	0	0	110.6
292	R	37.6	Very low	37.5	Very low	178 Å²	178	160.6 Å²	160.6	67%	0.672	79%	0.786	S	S	*	*			trans	-157.5	109	158.2	-125	171.8	-174.8	142	2	113.4
293	S	37.6	Very low	38	Very low	112 Å²	112	163.7 Å²	163.7	78%	0.783	78%	0.779	S	S	*	*			trans	-70.3	149.9	160.6	-40.9	0	0	0	0	111.4
294	R	38.8	Very low	38.2	Very low	207 Å²	207	162.7 Å²	162.7	78%	0.781	78%	0.775	S	S	*	*			trans	-175.8	97.9	155.3	-100.7	162.9	-175	176.5	-0.5	107.4
295	S	38.2	Very low	38.6	Very low	107 Å²	107	163.1 Å²	163.1	75%	0.748	78%	0.784	S	S	*	*				49.4	109.9	88.2	75.2	0	0	0	0	115.3
296	R	41.4	Very low	38.6	Very low	251 Å²	251	165.5 Å²	165.5	95%	0.947	79%	0.785	S	S	*	*			trans	-164.7	119.1	137.6	-118.3	174.6	176.9	-173.2	-2	113.4
297	D	39.9	Very low	39	Very low	144 Å²	144	173 Å²	173	77%	0.77	79%	0.793	S	S	*	*			trans	-34	145.1	156.1	-98.1	-83.8	0	0	0	116.2
298	K	40.9	Very low	39	Very low	212 Å²	212	166.3 Å²	166.3	92%	0.922	78%	0.784	S	S	*	*			trans	-157.4	108.4	133.9	-112.6	175.3	-176.4	-178.3	0	111.1
299	S	39	Very low	39.3	Very low	86 Å²	86	173.1 Å²	173.1	60%	0.601	80%	0.798	S	S	*	*			trans	-73.1	145.4	162.4	49.2	0	0	0	0	110.8
300	H	39.5	Very low	39.2	Very low	200 Å²	200	173 Å²	173	93%	0.926	80%	0.798	S	S	*	*			trans	-167.5	141.8	132.9	-96.8	-62.6	0	0	0	110.9
301	R	38.3	Very low	39.3	Very low	199 Å²	199	175 Å²	175	75%	0.751	81%	0.806	S	S	*	*			trans	-119.6	138.9	-166.2	170.6	-168.1	-160.9	-170.7	8.8	108.1
302	H	41	Very low	39.2	Very low	183 Å²	183	177.8 Å²	177.8	85%	0.847	81%	0.806	S	S	*	*			trans	-169.9	107.6	145.3	-97.3	-76.1	0	0	0	107.7
303	K	40.4	Very low	39.3	Very low	137 Å²	137	174 Å²	174	60%	0.596	81%	0.807	S	S	*	*				74	118	81.1	-90.3	-170.5	-179.8	175.5	0	116.1
304	R	36	Very low	39.3	Very low	233 Å²	233	174.5 Å²	174.5	88%	0.879	81%	0.81	S	S	*	*			trans	76	142.5	150	-62.1	178.2	172.7	-170.5	-2.6	115.5
305	A	41.3	Very low	39.5	Very low	99 Å²	99	172.2 Å²	172.2	82%	0.818	81%	0.813	S	S	*	*			cis	-152	156.1	31.9	0	0	0	0	0	114.1
306	R	40.8	Very low	39.9	Very low	243 Å²	243	172.1 Å²	172.1	92%	0.917	81%	0.811	S	S	*	*			trans	-61.3	145.9	166.4	-64	170.6	168.3	172	-6.4	111.2
307	R	38.9	Very low	39.9	Very low	221 Å²	221	165.2 Å²	165.2	83%	0.834	80%	0.801	S	S	*	*			trans	-159.6	98.1	134.1	-112.5	176.6	-173.8	-159.2	1.4	111.1
308	S	38.8	Very low	39.9	Very low	107 Å²	107	164.6 Å²	164.6	75%	0.748	80%	0.797	S	S	*	*			trans	-58.9	136.6	150.6	-47	0	0	0	0	108.7
309	R	40.9	Very low	40.1	Very low	219 Å²	219	164.3 Å²	164.3	83%	0.826	79%	0.79	S	S	*	*			trans	-129.8	97.2	153.7	-106.6	-178.9	176.8	162.8	-3.2	107.3
310	E	36.5	Very low	40.3	Very low	172 Å²	172	171.6 Å²	171.6	80%	0.804	81%	0.805	S	S	*	*			trans	-52.2	142	152.5	-66.8	166.3	155.3	0	0	108.8
311	R	39.2	Very low	40.4	Very low	253 Å²	253	172.5 Å²	172.5	96%	0.955	80%	0.8	S	S	*	*			trans	-132.9	82	165.4	-153.9	178.4	-162.9	-142.6	2.8	106.9
312	E	37.4	Very low	40.8	Very low	170 Å²	170	173.9 Å²	173.9	79%	0.794	82%	0.815	S	S	*	*			trans	-83.1	132.6	165.9	-91.4	-172.6	136	0	0	110.6
313	S	39.7	Very low	40.8	Very low	99 Å²	99	173.5 Å²	173.5	69%	0.692	81%	0.813	S	S	*	*			trans	14.5	125.6	143.5	47.1	0	0	0	0	121.1
314	S	39.3	Very low	40.8	Very low	123 Å²	123	175.4 Å²	175.4	86%	0.86	82%	0.824	S	S	*	*				-174.3	116.6	125.6	21.9	0	0	0	0	112.2
315	N	42.4	Very low	41.1	Very low	158 Å²	158	172.2 Å²	172.2	85%	0.845	82%	0.821	S	S	*	*			trans	-67	166.8	147.4	-108.3	-4.1	0	0	0	108.4
316	P	47.3	Very low	41.1	Very low	106 Å²	106	176.5 Å²	176.5	69%	0.688	82%	0.822	S	S	*	*			cis	-147.4	175.2	33.3	37.3	-14.2	0	0	0	117.1
317	S	39.6	Very low	41.1	Very low	106 Å²	106	172.3 Å²	172.3	74%	0.741	82%	0.816	S	S	*	*			trans	44.9	123.5	145.8	56.8	0	0	0	0	121.3
318	D	41.1	Very low	41.2	Very low	131 Å²	131	169.1 Å²	169.1	70%	0.701	81%	0.814	S	S	*	*				156.7	147.8	108.5	-158	13.6	0	0	0	112.6
319	R	44.2	Very low	41.4	Very low	205 Å²	205	173.5 Å²	173.5	77%	0.774	82%	0.819	S	S	*	*			trans	79.3	105.9	159.5	-71.9	159.7	-162.2	-141.5	0.7	123
320	R	43.6	Very low	41.5	Very low	239 Å²	239	170 Å²	170	90%	0.902	82%	0.819	S	S	*	*				47.3	143.2	109.9	-77.7	-173	180	-164	0.4	120.6
321	R	41.6	Very low	41.9	Very low	220 Å²	220	169.8 Å²	169.8	83%	0.83	82%	0.82	S	S	*	*			trans	91.9	130.2	172	-69.9	178.6	172	-116.7	7.9	112.3
322	H	47.2	Very low	42.1	Very low	228 Å²	228	162.3 Å²	162.3	100%	1.056	81%	0.808	S	S	*	*			cis	-149.6	0	21.8	-127.7	-66.2	0	0	0	110.8

Retrieved 322 of 322 residues in 469.7 ms (Link to these results)

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