A0A096NYK5_PAPAN Loading...

Ras-related GTP-binding protein

Guanine nucleotide-binding protein that plays a crucial role in the cellular response to amino acid availability through regulation of the mTORC1 signaling cascade.

AlphaFold DB (Q80X95), UniProt , Accession A0A096NYK5, Species PAPAN (Papio anubis, Olive baboon), Gene RRAGA, Length 313 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	36	Very low	76.3	Confident	232 Å²	232	74.4 Å²	74.4	100%	1.143	40%	0.401	S	S	*	.				0	140.4	0	-62.5	-160.8	-179.2	0	0	107.8	N3	M1-N3 PolarHBondContact O-N 2.63Å; M1-N3 VanDerWaalsContact O-N 3.1Å
2	P	45.7	Very low	78.1	Confident	119 Å²	119	68.2 Å²	68.2	77%	0.773	37%	0.367	S	S	*	.			trans	-60.5	120.7	173.9	26.2	-30	0	0	0	106.9	T4	P2-T4 PolarHBondContact O-N 3.43Å
3	N	53.6	Low	79.7	Confident	72 Å²	72	62.9 Å²	62.9	39%	0.385	34%	0.339	S	S	.	.			trans	-53.6	107.9	-179.3	-162.9	-14.5	0	0	0	107.6	M1 A5 N55 R302 D304	M1-N3 PolarHBondContact O-N 2.63Å; M1-N3 VanDerWaalsContact O-N 3.1Å; N3-A5 PolarHBondContact O-N 3.19Å; N3-N55 PolarHBondContact OD1-ND2 3.33Å; N3-N55 VanDerWaalsContact OD1-ND2 3.09Å; N3-R302 PolarHBondContact ND2-O 2.95Å; N3-D304 PolarHBondContact ND2-OD1 2.77Å; N3-D304 PolarHBondContact OD1-OD1 2.87Å
4	T	65.1	Low	81	Confident	119 Å²	119	58.4 Å²	58.4	73%	0.73	32%	0.315	S	S	*	.			trans	-64.4	125.9	-174.9	37.5	0	0	0	0	107.9	P2 M6	P2-T4 PolarHBondContact O-N 3.43Å; T4-M6 PolarHBondContact O-N 3.31Å
5	A	72.5	Confident	82	Confident	39 Å²	39	57.1 Å²	57.1	32%	0.322	31%	0.305	S	S	.	.			trans	-59.8	124.3	-179.3	0	0	0	0	0	110	N3 K7 N55 V57	N3-A5 PolarHBondContact O-N 3.19Å; A5-K7 PolarHBondContact O-N 3.37Å; A5-K7 VanDerWaalsContact O-N 3.12Å; A5-N55 CarbonylContact C-O 3.51Å; A5-N55 VanDerWaalsContact CA-O 3.3Å; A5-N55 WeakPolarHBondContact CA-O 3.27Å; A5-V57 HydrophobicContact CB-CG2 3.87Å
6	M	83	Confident	82.9	Confident	40 Å²	40	57.1 Å²	57.1	20%	0.197	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	100.1	173.4	-173.6	-176.4	-61.2	0	0	107.8	T4 N55 V57 P182	T4-M6 PolarHBondContact O-N 3.31Å; M6-N55 PolarHBondContact N-O 3.01Å; M6-V57 PolarHBondContact O-N 2.97Å; M6-P182 HydrophobicContact CE-CG 4.16Å; M6-P182 HydrophobicContact SD-CG 4.14Å
7	K	91.6	Very high	83.7	Confident	139 Å²	139	56.7 Å²	56.7	60%	0.604	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	120.3	-178.9	-66.5	-178.8	-178.2	-178.4	0	109.9	A5 V57	A5-K7 PolarHBondContact O-N 3.37Å; A5-K7 VanDerWaalsContact O-N 3.12Å; K7-V57 CarbonylContact C-O 3.53Å; K7-V57 WeakPolarHBondContact CA-O 3.37Å; K7-V57 HydrophobicContact CG-CB 4.33Å
8	K	96.3	Very high	84.5	Confident	39 Å²	39	53.6 Å²	53.6	17%	0.17	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	119.1	174.5	-65.8	-66.7	-174.8	174.7	0	109.4	L56 V57 L58 N59 E86 L180	K8-L56 HydrophobicContact CB-CD1 4.28Å; K8-L56 HydrophobicContact CG-CD1 3.52Å; K8-V57 PolarHBondContact N-O 3.03Å; K8-L58 HydrophobicContact CB-CD2 4.29Å; K8-N59 PolarHBondContact O-N 2.92Å; K8-E86 HydrophobicContact CB-CB 4.4Å; K8-E86 HydrophobicContact CB-CG 4.25Å; K8-E86 HydrophobicContact CD-CB 4.16Å; K8-E86 HydrophobicContact CD-CG 3.52Å; K8-E86 WeakPolarHBondContact CD-OE1 3.44Å; K8-E86 WeakPolarHBondContact CD-OE2 3.42Å; K8-E86 IonicContact NZ-OE1 3.5Å; K8-E86 PolarHBondContact NZ-OE1 2.98Å; K8-E86 IonicContact NZ-OE2 3.39Å; K8-E86 PolarHBondContact NZ-OE2 3.35Å; K8-L180 HydrophobicContact CB-CD1 4.5Å; K8-L180 HydrophobicContact CB-CD2 4.16Å; K8-L180 HydrophobicContact CD-CD2 4.36Å; K8-L180 HydrophobicContact CG-CD2 4.26Å
9	K	97.9	Very high	85.2	Confident	19 Å²	19	51.4 Å²	51.4	8%	0.083	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	122.5	179.7	-176.8	175.7	172.9	178.5	0	109.8	N59 W61 N80 I81 R83 N84 V85 E86 V87	K9-N59 WeakPolarHBondContact CA-O 3.42Å; K9-W61 HydrophobicContact CD-CD2 4.44Å; K9-W61 HydrophobicContact CD-CZ2 4.41Å; K9-W61 VanDerWaalsContact CE-CE2 3.49Å; K9-W61 HydrophobicContact CG-CG 4.37Å; K9-N80 PolarHBondContact NZ-O 3.06Å; K9-I81 WeakPolarHBondContact CE-O 3.31Å; K9-I81 PolarHBondContact NZ-O 3.05Å; K9-R83 WeakPolarHBondContact CD-O 3.49Å; K9-R83 PolarHBondContact NZ-O 3.41Å; K9-N84 VanDerWaalsContact CB-O 3.25Å; K9-N84 WeakPolarHBondContact CB-O 3.47Å; K9-V85 HydrophobicContact CD-CG2 4.05Å; K9-V85 HydrophobicContact CG-CG2 4.49Å; K9-E86 WeakPolarHBondContact O-CB 3.36Å; K9-E86 PolarHBondContact O-N 3.21Å; K9-V87 PolarHBondContact O-N 3.13Å
10	V	98.6	Very high	85.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	116.1	176.7	-177.1	0	0	0	0	107.5	L58 N59 L60 W61 V87 I89 W173 L180	V10-L58 HydrophobicContact CG2-CD2 4.5Å; V10-N59 PolarHBondContact N-O 3.19Å; V10-L60 HydrophobicContact CB-CD2 3.75Å; V10-L60 HydrophobicContact CG1-CD2 4.14Å; V10-L60 HydrophobicContact CG2-CD2 4.11Å; V10-L60 WeakPolarHBondContact O-CA 3.29Å; V10-W61 PolarHBondContact O-N 3.34Å; V10-V87 WeakPolarHBondContact CA-O 3.48Å; V10-V87 HydrophobicContact CG1-CB 4.27Å; V10-V87 HydrophobicContact CG1-CG1 4.09Å; V10-V87 HydrophobicContact CG2-CB 4.43Å; V10-I89 HydrophobicContact CG1-CD1 3.56Å; V10-I89 HydrophobicContact CG1-CG1 4.07Å; V10-W173 HydrophobicContact CG1-CH2 4.44Å; V10-W173 HydrophobicContact CG1-CZ3 4.4Å; V10-L180 HydrophobicContact CG2-CD1 3.8Å
11	L	98.6	Very high	86.4	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	122.5	-176.6	-173	59.7	0	0	0	109.9	M13 W61 I81 F82 V85 V87 L88 I89	L11-M13 HydrophobicContact CD1-CE 4.03Å; L11-M13 HydrophobicContact CD1-CG 4.5Å; L11-M13 HydrophobicContact CD2-CE 3.99Å; L11-M13 HydrophobicContact CD2-CG 4.19Å; L11-M13 HydrophobicContact CG-CE 4.18Å; L11-M13 HydrophobicContact CG-CG 3.93Å; L11-W61 HydrophobicContact CD1-CB 3.63Å; L11-W61 HydrophobicContact CD1-CG 4.47Å; L11-I81 HydrophobicContact CD1-CG2 3.94Å; L11-I81 HydrophobicContact CD2-CG2 3.98Å; L11-F82 HydrophobicContact CD2-CD1 3.86Å; L11-F82 HydrophobicContact CD2-CE1 3.83Å; L11-V85 HydrophobicContact CB-CG1 3.97Å; L11-V85 HydrophobicContact CB-CG2 4.32Å; L11-V85 HydrophobicContact CD2-CG2 4.07Å; L11-V87 PolarHBondContact N-O 3.29Å; L11-L88 HydrophobicContact CB-CD1 4.16Å; L11-L88 HydrophobicContact CD2-CD1 4.03Å; L11-L88 HydrophobicContact CG-CD1 4.06Å; L11-I89 PolarHBondContact O-N 3.49Å
12	L	98.7	Very high	89.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	112.2	177.1	-72.8	147.3	0	0	0	109	R24 L60 W61 D62 C63 I89 W173	L12-R24 HydrophobicContact CD1-CB 4.48Å; L12-L60 HydrophobicContact CD1-CB 4.5Å; L12-W61 WeakPolarHBondContact CB-O 3Å; L12-W61 PolarHBondContact N-O 2.88Å; L12-D62 HydrophobicContact CD1-CB 4.35Å; L12-C63 WeakPolarHBondContact O-CB 3.41Å; L12-C63 PolarHBondContact O-N 3.18Å; L12-C63 VanDerWaalsContact O-N 3.17Å; L12-I89 WeakPolarHBondContact CA-O 3.37Å; L12-I89 HydrophobicContact CD2-CB 3.99Å; L12-I89 HydrophobicContact CD2-CD1 3.9Å; L12-I89 HydrophobicContact CD2-CG2 4.09Å; L12-I89 HydrophobicContact CG-CD1 4.44Å; L12-W173 HydrophobicContact CD1-CH2 4.42Å; L12-W173 HydrophobicContact CD2-CH2 4.14Å; L12-W173 HydrophobicContact CD2-CZ2 3.94Å
13	M	98.5	Very high	91.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	162.4	-176.5	-76	-73.3	-171.6	0	0	111.6	L11 K20 C63 M70 Y73 I81 F82 L88 I89 Y90 V91	L11-M13 HydrophobicContact CD1-CE 4.03Å; L11-M13 HydrophobicContact CD1-CG 4.5Å; L11-M13 HydrophobicContact CD2-CE 3.99Å; L11-M13 HydrophobicContact CD2-CG 4.19Å; L11-M13 HydrophobicContact CG-CE 4.18Å; L11-M13 HydrophobicContact CG-CG 3.93Å; M13-K20 WeakPolarHBondContact O-CD 3.48Å; M13-C63 HydrophobicContact CE-CB 3.89Å; M13-C63 VanDerWaalsContact CE-SG 3.5Å; M13-C63 HydrophobicContact SD-CB 3.61Å; M13-M70 HydrophobicContact SD-CE 4.45Å; M13-M70 HydrophobicContact SD-SD 4.2Å; M13-Y73 HydrophobicContact CE-CD2 3.98Å; M13-Y73 HydrophobicContact CE-CG 4.48Å; M13-Y73 HydrophobicContact SD-CD2 4.28Å; M13-I81 HydrophobicContact CE-CG2 3.57Å; M13-F82 HydrophobicContact CE-CE1 4.21Å; M13-F82 HydrophobicContact CE-CE2 4.37Å; M13-F82 HydrophobicContact CE-CZ 3.71Å; M13-L88 HydrophobicContact CB-CD1 4.02Å; M13-L88 HydrophobicContact CG-CD1 3.93Å; M13-I89 PolarHBondContact N-O 3.19Å; M13-Y90 HydrophobicContact CB-CD2 3.59Å; M13-Y90 HydrophobicContact CB-CE2 3.97Å; M13-Y90 HydrophobicContact CB-CG 4.46Å; M13-Y90 CarbonylContact O-C 3.58Å; M13-Y90 WeakPolarHBondContact O-CA 3.38Å; M13-V91 PolarHBondContact O-N 3.27Å
14	G	97.7	Very high	93.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.177	C	C	.	.			trans	136.7	166.1	-179.7	0	0	0	0	0	112.3	K20 G65	G14-K20 WeakPolarHBondContact O-CE 3.3Å; G14-K20 PolarHBondContact O-NZ 3.17Å; G14-G65 VanDerWaalsContact O-CA 3.3Å; G14-G65 WeakPolarHBondContact O-CA 3.39Å
15	K	96.6	Very high	95.5	Very high	39 Å²	39	24.5 Å²	24.5	17%	0.17	14%	0.144	C	C	.	.			trans	-58.6	155	-175.4	-177.8	163	172.3	171	0	113.5	G17 S18 K20 E98 D102	K15-G17 PolarHBondContact O-N 3.04Å; K15-S18 VanDerWaalsContact O-CB 3.29Å; K15-S18 WeakPolarHBondContact O-CB 3.2Å; K15-S18 PolarHBondContact O-N 2.86Å; K15-S18 PolarHBondContact O-OG 3.25Å; K15-K20 PolarHBondContact O-NZ 2.56Å; K15-K20 VanDerWaalsContact O-NZ 3.09Å; K15-E98 IonicContact NZ-OE1 3.73Å; K15-E98 PolarHBondContact NZ-OE1 3.18Å; K15-E98 IonicContact NZ-OE2 3.68Å; K15-E98 PolarHBondContact NZ-OE2 2.88Å; K15-D102 WeakPolarHBondContact CD-OD1 3.43Å
16	S	96.5	Very high	96.6	Very high	56 Å²	56	23 Å²	23	39%	0.392	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	137.2	172.2	-172.4	0	0	0	0	110.4	S18 G65	S16-S18 VanDerWaalsContact C-N 3.27Å; S16-S18 PolarHBondContact O-N 3.38Å; S16-G65 WeakPolarHBondContact CB-O 3.43Å; S16-G65 VanDerWaalsContact N-C 3.34Å; S16-G65 PolarHBondContact N-O 3.4Å
17	G	96.1	Very high	97.2	Very high	51 Å²	51	21 Å²	21	53%	0.526	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.2	-2.3	-178.6	0	0	0	0	0	115.8	K15 G19 K128	K15-G17 PolarHBondContact O-N 3.04Å; G17-G19 PolarHBondContact O-N 3.18Å; G17-K128 VanDerWaalsContact O-CE 3.28Å; G17-K128 WeakPolarHBondContact O-CE 3.49Å; G17-K128 PolarHBondContact O-NZ 3.03Å
18	S	97.3	Very high	97.5	Very high	1 Å²	1	16 Å²	16	1%	0.007	10%	0.099	C	C	.	.	S	Bend	trans	-68.7	-14.7	-178.6	71.9	0	0	0	0	115.1	K15 S16 V91 H127	K15-S18 VanDerWaalsContact O-CB 3.29Å; K15-S18 WeakPolarHBondContact O-CB 3.2Å; K15-S18 PolarHBondContact O-N 2.86Å; K15-S18 PolarHBondContact O-OG 3.25Å; S16-S18 VanDerWaalsContact C-N 3.27Å; S16-S18 PolarHBondContact O-N 3.38Å; S18-V91 WeakPolarHBondContact CB-O 3.25Å; S18-V91 WeakPolarHBondContact O-CG1 3.47Å; S18-V91 PolarHBondContact OG-O 2.76Å; S18-H127 PolarHBondContact O-CD2 2.94Å
19	G	97.8	Very high	97.3	Very high	11 Å²	11	16.5 Å²	16.5	11%	0.113	11%	0.111	C	C	.	.	S	Bend	trans	109.9	4.1	173.4	0	0	0	0	0	116.4	G17 T21 S22 M23	G17-G19 PolarHBondContact O-N 3.18Å; G19-T21 PolarHBondContact O-N 3.06Å; G19-S22 WeakPolarHBondContact O-CB 3.28Å; G19-S22 PolarHBondContact O-N 3.41Å; G19-S22 VanDerWaalsContact O-N 3.14Å; G19-M23 WeakPolarHBondContact O-CG 3.5Å; G19-M23 PolarHBondContact O-N 3.21Å
20	K	98	Very high	97.1	Very high	9 Å²	9	19 Å²	19	4%	0.039	13%	0.125	C	C	.	.	H	α-helix	trans	-46.8	-60.1	-179.1	-56.8	-176.5	-58.8	-72.5	0	113.9	M13 G14 K15 S22 M23 R24 D62 C63 V91	M13-K20 WeakPolarHBondContact O-CD 3.48Å; G14-K20 WeakPolarHBondContact O-CE 3.3Å; G14-K20 PolarHBondContact O-NZ 3.17Å; K15-K20 PolarHBondContact O-NZ 2.56Å; K15-K20 VanDerWaalsContact O-NZ 3.09Å; K20-S22 VanDerWaalsContact C-N 3.31Å; K20-S22 PolarHBondContact O-N 3.49Å; K20-M23 PolarHBondContact O-N 3.42Å; K20-R24 PolarHBondContact O-N 2.83Å; K20-D62 WeakPolarHBondContact CB-OD1 3.47Å; K20-C63 WeakPolarHBondContact CE-O 3.36Å; K20-V91 HydrophobicContact CG-CB 3.87Å; K20-V91 HydrophobicContact CG-CG1 4.46Å; K20-V91 HydrophobicContact CG-CG2 3.78Å
21	T	98.3	Very high	96.9	Very high	17 Å²	17	23 Å²	23	10%	0.104	14%	0.141	C	C	.	.	H	α-helix	trans	-65.5	-35.1	-178.8	-47.4	0	0	0	0	112	G19 R24 S25 L39 T42 D62	G19-T21 PolarHBondContact O-N 3.06Å; T21-R24 PolarHBondContact O-N 2.99Å; T21-S25 VanDerWaalsContact O-CB 3.27Å; T21-S25 WeakPolarHBondContact O-CB 3.3Å; T21-S25 PolarHBondContact O-N 3.37Å; T21-S25 PolarHBondContact O-OG 3.17Å; T21-L39 HydrophobicContact CG2-CD1 4.19Å; T21-T42 PolarHBondContact OG1-OG1 3.17Å; T21-D62 WeakPolarHBondContact CA-OD2 3.22Å; T21-D62 WeakPolarHBondContact CB-OD2 3.41Å; T21-D62 WeakPolarHBondContact CG2-OD2 3.16Å; T21-D62 PolarHBondContact OG1-OD1 3.42Å; T21-D62 PolarHBondContact OG1-OD2 2.96Å
22	S	98.4	Very high	96.7	Very high	25 Å²	25	23.8 Å²	23.8	18%	0.175	15%	0.145	C	C	.	.	H	α-helix	trans	-63	-48	176	-66.9	0	0	0	0	111.3	G19 K20 S25 I26 T36	G19-S22 WeakPolarHBondContact O-CB 3.28Å; G19-S22 PolarHBondContact O-N 3.41Å; G19-S22 VanDerWaalsContact O-N 3.14Å; K20-S22 VanDerWaalsContact C-N 3.31Å; K20-S22 PolarHBondContact O-N 3.49Å; S22-S25 PolarHBondContact O-N 2.99Å; S22-I26 WeakPolarHBondContact O-CG1 3.29Å; S22-I26 PolarHBondContact O-N 3.21Å; S22-T36 WeakPolarHBondContact OG-CB 2.92Å
23	M	98.1	Very high	96.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.7	-48.9	176	-73.2	-169.8	-72.5	0	0	111.9	G19 K20 S25 I26 I27 V91 L125 H127 I164 L169	G19-M23 WeakPolarHBondContact O-CG 3.5Å; G19-M23 PolarHBondContact O-N 3.21Å; K20-M23 PolarHBondContact O-N 3.42Å; M23-S25 VanDerWaalsContact C-N 3.32Å; M23-S25 PolarHBondContact O-N 3.34Å; M23-I26 PolarHBondContact O-N 2.77Å; M23-I27 PolarHBondContact O-N 3.14Å; M23-I27 VanDerWaalsContact O-N 3.13Å; M23-V91 HydrophobicContact CE-CB 4.06Å; M23-V91 HydrophobicContact CE-CG1 3.42Å; M23-V91 VanDerWaalsContact CE-CG1 3.42Å; M23-V91 HydrophobicContact CE-CG2 3.41Å; M23-V91 VanDerWaalsContact CE-CG2 3.41Å; M23-L125 HydrophobicContact CE-CD1 3.97Å; M23-L125 HydrophobicContact SD-CD1 3.82Å; M23-H127 VanDerWaalsContact CG-CE1 3.49Å; M23-H127 WeakPolarHBondContact CG-CE1 3.25Å; M23-H127 PolarHBondContact SD-CE1 2.82Å; M23-H127 PolarHBondContact SD-ND1 2.89Å; M23-H127 VanDerWaalsContact SD-ND1 3.41Å; M23-I164 HydrophobicContact CG-CG2 4.09Å; M23-L169 HydrophobicContact CB-CD1 3.86Å; M23-L169 HydrophobicContact CB-CD2 4.29Å; M23-L169 HydrophobicContact CG-CD1 3.5Å; M23-L169 HydrophobicContact CG-CD2 4.12Å; M23-L169 HydrophobicContact CG-CG 4.48Å; M23-L169 HydrophobicContact SD-CD1 3.4Å; M23-L169 WeakPolarHBondContact SD-CD1 3.36Å
24	R	97.1	Very high	96.3	Very high	24 Å²	24	31.8 Å²	31.8	9%	0.091	18%	0.178	C	C	.	.	H	α-helix	trans	-55.1	-48.8	176.4	-177.9	-166.6	65.8	162.5	-8.4	110.9	L12 K20 T21 I26 I27 F28 E46 S48 L60 D62	L12-R24 HydrophobicContact CD1-CB 4.48Å; K20-R24 PolarHBondContact O-N 2.83Å; T21-R24 PolarHBondContact O-N 2.99Å; R24-I26 VanDerWaalsContact C-N 3.34Å; R24-I26 PolarHBondContact O-N 3.46Å; R24-I27 PolarHBondContact O-N 2.94Å; R24-F28 HydrophobicContact CG-CD2 4.23Å; R24-F28 WeakPolarHBondContact O-CB 3.49Å; R24-F28 PolarHBondContact O-N 2.84Å; R24-E46 IonicContact CZ-OE2 3.89Å; R24-E46 IonicContact NH1-OE2 3.68Å; R24-E46 PolarHBondContact NH1-OE2 2.71Å; R24-E46 IonicContact NH2-OE2 2.72Å; R24-E46 PolarHBondContact NH2-OE2 3.45Å; R24-S48 PolarHBondContact NH1-OG 3.27Å; R24-L60 HydrophobicContact CG-CD1 4Å; R24-D62 IonicContact CZ-OD2 3.07Å; R24-D62 IonicContact NE-OD2 2.76Å; R24-D62 PolarHBondContact NE-OD2 2.91Å; R24-D62 IonicContact NH2-OD2 2.72Å
25	S	97.2	Very high	96.1	Very high	6 Å²	6	33.8 Å²	33.8	4%	0.042	19%	0.189	C	C	.	.	H	α-helix	trans	-65.2	-36.1	-176.5	-67.3	0	0	0	0	112.7	T21 S22 M23 A29 N30 Y31	T21-S25 VanDerWaalsContact O-CB 3.27Å; T21-S25 WeakPolarHBondContact O-CB 3.3Å; T21-S25 PolarHBondContact O-N 3.37Å; T21-S25 PolarHBondContact O-OG 3.17Å; S22-S25 PolarHBondContact O-N 2.99Å; M23-S25 VanDerWaalsContact C-N 3.32Å; M23-S25 PolarHBondContact O-N 3.34Å; S25-A29 CarbonylContact O-C 3.42Å; S25-A29 WeakPolarHBondContact O-CA 3.49Å; S25-A29 VanDerWaalsContact O-CB 3.31Å; S25-A29 WeakPolarHBondContact O-CB 3.3Å; S25-A29 PolarHBondContact O-N 3.44Å; S25-N30 PolarHBondContact O-N 3.01Å; S25-N30 VanDerWaalsContact O-N 3.09Å; S25-Y31 PolarHBondContact O-N 2.75Å
26	I	96.3	Very high	96.1	Very high	6 Å²	6	32.6 Å²	32.6	3%	0.031	19%	0.185	C	C	.	.	H	α-helix	trans	-67.1	-49.6	177	-71.4	169.3	0	0	0	111	S22 M23 R24 Y31 A33 T36 I164 L169	S22-I26 WeakPolarHBondContact O-CG1 3.29Å; S22-I26 PolarHBondContact O-N 3.21Å; M23-I26 PolarHBondContact O-N 2.77Å; R24-I26 VanDerWaalsContact C-N 3.34Å; R24-I26 PolarHBondContact O-N 3.46Å; I26-Y31 WeakPolarHBondContact CA-O 3.49Å; I26-A33 HydrophobicContact CD1-CB 4.47Å; I26-T36 HydrophobicContact CD1-CG2 3.82Å; I26-T36 HydrophobicContact CG1-CG2 3.85Å; I26-I164 HydrophobicContact CD1-CB 3.43Å; I26-I164 VanDerWaalsContact CD1-CB 3.43Å; I26-I164 HydrophobicContact CD1-CD1 4.38Å; I26-I164 HydrophobicContact CD1-CG1 4.46Å; I26-I164 HydrophobicContact CD1-CG2 3.56Å; I26-L169 HydrophobicContact CB-CD2 4.38Å; I26-L169 HydrophobicContact CG2-CD2 4.16Å
27	I	96.4	Very high	95.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-69.9	-52	-176.3	-62.8	-58.9	0	0	0	110.9	M23 R24 L169 Y170 W173 T210 L212 K236	M23-I27 PolarHBondContact O-N 3.14Å; M23-I27 VanDerWaalsContact O-N 3.13Å; R24-I27 PolarHBondContact O-N 2.94Å; I27-L169 HydrophobicContact CD1-CD2 4.13Å; I27-L169 HydrophobicContact CD1-CG 4.05Å; I27-L169 HydrophobicContact CG1-CD2 4.1Å; I27-L169 HydrophobicContact CG1-CG 4.15Å; I27-Y170 HydrophobicContact CD1-CD1 4.08Å; I27-Y170 HydrophobicContact CD1-CD2 4.28Å; I27-Y170 HydrophobicContact CD1-CE1 3.93Å; I27-Y170 HydrophobicContact CD1-CE2 4.13Å; I27-Y170 HydrophobicContact CD1-CG 4.24Å; I27-W173 HydrophobicContact CG1-CG 4.08Å; I27-W173 HydrophobicContact CG2-CG 4.44Å; I27-T210 HydrophobicContact CG2-CG2 4.13Å; I27-T210 WeakPolarHBondContact O-CG2 3.17Å; I27-L212 HydrophobicContact CD1-CD2 4.39Å; I27-L212 HydrophobicContact CG2-CD1 3.93Å; I27-L212 HydrophobicContact CG2-CD2 4.37Å; I27-L212 HydrophobicContact CG2-CG 4.25Å; I27-K236 PolarHBondContact O-NZ 2.84Å
28	F	96.1	Very high	95.8	Very high	32 Å²	32	47 Å²	47	14%	0.14	22%	0.215	C	C	.	.	H	α-helix	trans	-103.8	-21.2	-166.6	-59.8	-72.1	0	0	0	114.9	R24 V50 L58 L60 W173 T210 L212	R24-F28 HydrophobicContact CG-CD2 4.23Å; R24-F28 WeakPolarHBondContact O-CB 3.49Å; R24-F28 PolarHBondContact O-N 2.84Å; F28-V50 HydrophobicContact CB-CG2 4.19Å; F28-V50 HydrophobicContact CD1-CB 4.34Å; F28-V50 HydrophobicContact CD1-CG1 3.88Å; F28-V50 HydrophobicContact CD1-CG2 4.01Å; F28-V50 HydrophobicContact CE1-CG1 4.37Å; F28-V50 HydrophobicContact CG-CG2 4.25Å; F28-L58 HydrophobicContact CE1-CD1 4.2Å; F28-L58 HydrophobicContact CZ-CD1 4.32Å; F28-L60 HydrophobicContact CB-CD1 4.42Å; F28-L60 HydrophobicContact CD1-CD1 4.38Å; F28-L60 HydrophobicContact CD2-CD1 3.45Å; F28-L60 VanDerWaalsContact CD2-CD1 3.45Å; F28-L60 HydrophobicContact CE2-CD1 3.7Å; F28-L60 HydrophobicContact CG-CD1 3.82Å; F28-L60 HydrophobicContact CZ-CD1 4.24Å; F28-W173 HydrophobicContact CE2-CD2 4Å; F28-W173 AromaticContact CE2-CE3 3.69Å; F28-W173 HydrophobicContact CE2-CE3 3.69Å; F28-W173 AromaticContact CE2-CH2 3.6Å; F28-W173 HydrophobicContact CE2-CH2 3.6Å; F28-W173 AromaticContact CE2-CZ2 3.91Å; F28-W173 HydrophobicContact CE2-CZ2 3.91Å; F28-W173 AromaticContact CE2-CZ3 3.49Å; F28-W173 HydrophobicContact CE2-CZ3 3.49Å; F28-W173 VanDerWaalsContact CE2-CZ3 3.49Å; F28-W173 HydrophobicContact CZ-CD2 4.27Å; F28-W173 AromaticContact CZ-CE3 3.65Å; F28-W173 HydrophobicContact CZ-CE3 3.65Å; F28-W173 HydrophobicContact CZ-CH2 4.23Å; F28-W173 AromaticContact CZ-CZ3 3.63Å; F28-W173 HydrophobicContact CZ-CZ3 3.63Å; F28-T210 HydrophobicContact CD1-CG2 3.54Å; F28-T210 HydrophobicContact CE1-CG2 3.78Å; F28-T210 HydrophobicContact CG-CG2 4.5Å; F28-L212 HydrophobicContact CZ-CD1 4.5Å
29	A	94.1	Very high	95.7	Very high	50 Å²	50	49.4 Å²	49.4	41%	0.413	23%	0.227	S	C	.	.	S	Bend	trans	-112.6	10.6	-177.7	0	0	0	0	0	114	S25 Y31	S25-A29 CarbonylContact O-C 3.42Å; S25-A29 WeakPolarHBondContact O-CA 3.49Å; S25-A29 VanDerWaalsContact O-CB 3.31Å; S25-A29 WeakPolarHBondContact O-CB 3.3Å; S25-A29 PolarHBondContact O-N 3.44Å; A29-Y31 HydrophobicContact CB-CD2 4.06Å; A29-Y31 HydrophobicContact CB-CE2 4.32Å; A29-Y31 PolarHBondContact O-N 3.09Å
30	N	93.3	Very high	95.6	Very high	73 Å²	73	52 Å²	52	39%	0.39	25%	0.253	S	S	.	.			trans	62.6	25.2	175.7	-63.3	-42.7	0	0	0	114.6	S25 K236 L240	S25-N30 PolarHBondContact O-N 3.01Å; S25-N30 VanDerWaalsContact O-N 3.09Å; N30-K236 WeakPolarHBondContact OD1-CE 3.21Å; N30-K236 PolarHBondContact OD1-NZ 2.89Å; N30-L240 HydrophobicContact CB-CD2 3.62Å
31	Y	94.6	Very high	95.4	Very high	84 Å²	84	54.7 Å²	54.7	33%	0.329	28%	0.278	S	S	.	.			trans	-71.9	145.9	171.9	-82.7	-129.7	0	0	0	110	S25 I26 A29 D35 T36 L39	S25-Y31 PolarHBondContact O-N 2.75Å; I26-Y31 WeakPolarHBondContact CA-O 3.49Å; A29-Y31 HydrophobicContact CB-CD2 4.06Å; A29-Y31 HydrophobicContact CB-CE2 4.32Å; A29-Y31 PolarHBondContact O-N 3.09Å; Y31-D35 HydrophobicContact CD1-CB 3.72Å; Y31-D35 HydrophobicContact CE1-CB 4.28Å; Y31-D35 HydrophobicContact CG-CB 4.36Å; Y31-T36 HydrophobicContact CD1-CG2 4.44Å; Y31-L39 HydrophobicContact CE1-CD2 3.85Å; Y31-L39 HydrophobicContact CE1-CG 4.29Å
32	I	93.3	Very high	95.3	Very high	16 Å²	16	54.4 Å²	54.4	8%	0.082	28%	0.276	C	S	.	.			trans	-92.1	156.3	161.2	54.2	176.7	0	0	0	109.3	R34 D35 Q237 L240	I32-R34 HydrophobicContact CD1-CG 3.62Å; I32-R34 HydrophobicContact CG1-CG 3.83Å; I32-R34 PolarHBondContact O-N 2.98Å; I32-R34 VanDerWaalsContact O-N 3.07Å; I32-D35 HydrophobicContact CG1-CB 4.14Å; I32-D35 WeakPolarHBondContact CG1-OD2 3.37Å; I32-D35 WeakPolarHBondContact O-CB 3.4Å; I32-D35 PolarHBondContact O-N 3.2Å; I32-Q237 VanDerWaalsContact CG2-OE1 3.3Å; I32-L240 HydrophobicContact CG2-CD1 3.65Å
33	A	94.4	Very high	95.1	Very high	14 Å²	14	58.7 Å²	58.7	12%	0.116	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-51.9	-37.8	-174.3	0	0	0	0	0	113.9	I26 D35 T36 I164 W165	I26-A33 HydrophobicContact CD1-CB 4.47Å; A33-D35 VanDerWaalsContact C-N 3.3Å; A33-D35 PolarHBondContact O-N 3.49Å; A33-T36 PolarHBondContact O-N 3.13Å; A33-T36 PolarHBondContact O-OG1 2.86Å; A33-I164 HydrophobicContact CB-CD1 4.21Å; A33-I164 HydrophobicContact CB-CG1 4.33Å; A33-I164 WeakPolarHBondContact CB-O 3.43Å; A33-W165 HydrophobicContact CB-CD2 4Å; A33-W165 HydrophobicContact CB-CE3 3.55Å; A33-W165 HydrophobicContact CB-CH2 4.01Å; A33-W165 HydrophobicContact CB-CZ2 4.43Å; A33-W165 HydrophobicContact CB-CZ3 3.56Å
34	R	94.1	Very high	94.8	Very high	153 Å²	153	61.5 Å²	61.5	58%	0.577	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-68.8	-25.1	177.8	68.3	-178.4	-172.5	-161.3	-2.7	114.4	I32 T36	I32-R34 HydrophobicContact CD1-CG 3.62Å; I32-R34 HydrophobicContact CG1-CG 3.83Å; I32-R34 PolarHBondContact O-N 2.98Å; I32-R34 VanDerWaalsContact O-N 3.07Å; R34-T36 VanDerWaalsContact C-N 3.3Å
35	D	94.1	Very high	94.8	Very high	43 Å²	43	61.4 Å²	61.4	23%	0.23	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-77.2	-22.5	-177.8	-66.3	-9.5	0	0	0	111.2	Y31 I32 A33 R37 R38	Y31-D35 HydrophobicContact CD1-CB 3.72Å; Y31-D35 HydrophobicContact CE1-CB 4.28Å; Y31-D35 HydrophobicContact CG-CB 4.36Å; I32-D35 HydrophobicContact CG1-CB 4.14Å; I32-D35 WeakPolarHBondContact CG1-OD2 3.37Å; I32-D35 WeakPolarHBondContact O-CB 3.4Å; I32-D35 PolarHBondContact O-N 3.2Å; A33-D35 VanDerWaalsContact C-N 3.3Å; A33-D35 PolarHBondContact O-N 3.49Å; D35-R37 PolarHBondContact O-N 3.28Å; D35-R38 WeakPolarHBondContact O-CB 3.21Å; D35-R38 PolarHBondContact O-N 3.42Å; D35-R38 VanDerWaalsContact O-N 3.13Å
36	T	95.8	Very high	94.8	Very high	13 Å²	13	65 Å²	65	8%	0.08	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-66	-20.4	179.5	67.7	0	0	0	0	113	S22 I26 Y31 A33 R34 R38 L39	S22-T36 WeakPolarHBondContact OG-CB 2.92Å; I26-T36 HydrophobicContact CD1-CG2 3.82Å; I26-T36 HydrophobicContact CG1-CG2 3.85Å; Y31-T36 HydrophobicContact CD1-CG2 4.44Å; A33-T36 PolarHBondContact O-N 3.13Å; A33-T36 PolarHBondContact O-OG1 2.86Å; R34-T36 VanDerWaalsContact C-N 3.3Å; T36-R38 PolarHBondContact O-N 3.4Å; T36-L39 HydrophobicContact CG2-CD1 4.28Å; T36-L39 VanDerWaalsContact O-CB 3.31Å; T36-L39 WeakPolarHBondContact O-CB 3.33Å; T36-L39 WeakPolarHBondContact O-CG 3.38Å; T36-L39 PolarHBondContact O-N 3.07Å
37	R	93.9	Very high	94.8	Very high	201 Å²	201	69.3 Å²	69.3	76%	0.758	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-58.1	-19.5	172.8	-64.6	-177.1	179.4	-173	-0.3	113.5	D35	D35-R37 PolarHBondContact O-N 3.28Å
38	R	94	Very high	94.7	Very high	210 Å²	210	70.9 Å²	70.9	79%	0.792	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-89.6	-8.3	179.4	-56.3	176.8	-177	176	0.2	112.9	D35 T36 G40	D35-R38 WeakPolarHBondContact O-CB 3.21Å; D35-R38 PolarHBondContact O-N 3.42Å; D35-R38 VanDerWaalsContact O-N 3.13Å; T36-R38 PolarHBondContact O-N 3.4Å; R38-G40 PolarHBondContact O-N 3.39Å
39	L	95.5	Very high	94.6	Very high	50 Å²	50	75.1 Å²	75.1	26%	0.262	38%	0.38	S	S	.	.			trans	-72.5	128.6	-179.5	-63.8	172.3	0	0	0	109.7	T21 Y31 T36	T21-L39 HydrophobicContact CG2-CD1 4.19Å; Y31-L39 HydrophobicContact CE1-CD2 3.85Å; Y31-L39 HydrophobicContact CE1-CG 4.29Å; T36-L39 HydrophobicContact CG2-CD1 4.28Å; T36-L39 VanDerWaalsContact O-CB 3.31Å; T36-L39 WeakPolarHBondContact O-CB 3.33Å; T36-L39 WeakPolarHBondContact O-CG 3.38Å; T36-L39 PolarHBondContact O-N 3.07Å
40	G	94	Very high	94.5	Very high	65 Å²	65	74 Å²	74	67%	0.67	37%	0.368	S	S	*	.			trans	-76.5	177	170.2	0	0	0	0	0	112	R38	R38-G40 PolarHBondContact O-N 3.39Å
41	A	94.9	Very high	94.4	Very high	66 Å²	66	77.2 Å²	77.2	55%	0.545	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-70.6	130.2	172.6	0	0	0	0	0	110.2	I43	A41-I43 PolarHBondContact O-N 2.98Å
42	T	94.9	Very high	94.2	Very high	11 Å²	11	73.2 Å²	73.2	7%	0.067	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-63.2	129.2	175.5	-45.2	0	0	0	0	109.7	T21 E46 Q66	T21-T42 PolarHBondContact OG1-OG1 3.17Å; T42-E46 HydrophobicContact CG2-CB 4.19Å; T42-E46 HydrophobicContact CG2-CG 3.79Å; T42-Q66 PolarHBondContact O-NE2 3.43Å; T42-Q66 PolarHBondContact O-OE1 3.25Å; T42-Q66 VanDerWaalsContact O-OE1 3.14Å
43	I	94.3	Very high	94	Very high	115 Å²	115	72.9 Å²	72.9	59%	0.59	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-103.5	124.2	178.4	-59.6	-57.8	0	0	0	107.8	A41 F69	A41-I43 PolarHBondContact O-N 2.98Å; I43-F69 HydrophobicContact CD1-CE2 4.14Å; I43-F69 HydrophobicContact CD1-CZ 4.35Å; I43-F69 HydrophobicContact CG2-CE2 4.34Å; I43-F69 HydrophobicContact CG2-CZ 3.83Å
44	D	93.4	Very high	93.6	Very high	60 Å²	60	72.9 Å²	72.9	32%	0.321	36%	0.359	S	S	.	.	S	Bend	trans	53.1	-135.6	-175.3	-160.2	12.2	0	0	0	111.9	G64 Y73	D44-G64 PolarHBondContact O-N 3.2Å; D44-Y73 WeakPolarHBondContact CA-OH 3.45Å; D44-Y73 PolarHBondContact O-OH 3.42Å; D44-Y73 VanDerWaalsContact OD1-CE1 3.31Å; D44-Y73 WeakPolarHBondContact OD1-CE1 3.42Å
45	V	96.3	Very high	93.2	Very high	21 Å²	21	66.3 Å²	66.3	13%	0.127	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	122.8	-177.4	-172.6	0	0	0	0	111.1	W61 Y73 I81	V45-W61 HydrophobicContact CG1-CB 4.15Å; V45-W61 HydrophobicContact CG1-CD2 4.33Å; V45-W61 HydrophobicContact CG1-CE3 3.89Å; V45-W61 HydrophobicContact CG1-CG 4.49Å; V45-Y73 HydrophobicContact CG2-CE1 3.76Å; V45-I81 HydrophobicContact CG2-CD1 4.07Å
46	E	96.8	Very high	93.1	Very high	81 Å²	81	64.5 Å²	64.5	38%	0.379	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	122.8	169.6	-78.4	-170.8	-167.6	0	0	111.5	R24 T42 D62	R24-E46 IonicContact CZ-OE2 3.89Å; R24-E46 IonicContact NH1-OE2 3.68Å; R24-E46 PolarHBondContact NH1-OE2 2.71Å; R24-E46 IonicContact NH2-OE2 2.72Å; R24-E46 PolarHBondContact NH2-OE2 3.45Å; T42-E46 HydrophobicContact CG2-CB 4.19Å; T42-E46 HydrophobicContact CG2-CG 3.79Å; E46-D62 HydrophobicContact CB-CB 4.29Å; E46-D62 PolarHBondContact N-O 3.5Å; E46-D62 PolarHBondContact O-N 3.44Å
47	H	95.8	Very high	93	Very high	97 Å²	97	64.4 Å²	64.4	45%	0.449	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	139.6	177.4	-59.2	-68.4	0	0	0	112	L60 W61	H47-L60 WeakPolarHBondContact CA-O 3.39Å; H47-W61 AromaticContact CE1-CD2 3.41Å; H47-W61 VanDerWaalsContact CE1-CD2 3.41Å; H47-W61 AromaticContact CE1-CE2 3.43Å; H47-W61 VanDerWaalsContact CE1-CE2 3.43Å; H47-W61 AromaticContact CE1-CE3 3.5Å; H47-W61 AromaticContact CE1-CH2 3.64Å; H47-W61 AromaticContact CE1-CZ2 3.57Å; H47-W61 AromaticContact CE1-CZ3 3.61Å; H47-W61 AromaticContact ND1-CD1 3.81Å; H47-W61 AromaticContact ND1-CD2 3.5Å; H47-W61 AromaticContact ND1-CE2 3.42Å; H47-W61 AromaticContact ND1-CG 3.74Å; H47-W61 AromaticContact ND1-CZ2 3.91Å; H47-W61 AromaticContact ND1-NE1 3.61Å
48	S	95.2	Very high	93.1	Very high	33 Å²	33	54.9 Å²	54.9	23%	0.231	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	131.4	171.5	-54.6	0	0	0	0	111.1	R24 L60	R24-S48 PolarHBondContact NH1-OG 3.27Å; S48-L60 PolarHBondContact N-O 2.94Å; S48-L60 PolarHBondContact O-N 3.37Å
49	H	94.4	Very high	93.2	Very high	122 Å²	122	46.1 Å²	46.1	57%	0.565	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	111.1	176.7	-62.7	-60.4	0	0	0	110.1	V57 N59	H49-V57 HydrophobicContact CB-CG1 4.35Å; H49-N59 PolarHBondContact CE1-OD1 2.97Å; H49-N59 PolarHBondContact ND1-OD1 3.28Å; H49-N59 VanDerWaalsContact ND1-OD1 3.17Å
50	V	92.7	Very high	93.4	Very high	26 Å²	26	43.7 Å²	43.7	16%	0.158	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	116.8	-179.2	-177.2	0	0	0	0	109	F28 F52 V57 L58 L60	F28-V50 HydrophobicContact CB-CG2 4.19Å; F28-V50 HydrophobicContact CD1-CB 4.34Å; F28-V50 HydrophobicContact CD1-CG1 3.88Å; F28-V50 HydrophobicContact CD1-CG2 4.01Å; F28-V50 HydrophobicContact CE1-CG1 4.37Å; F28-V50 HydrophobicContact CG-CG2 4.25Å; V50-F52 PolarHBondContact O-N 3.07Å; V50-V57 CarbonylContact O-C 3.54Å; V50-V57 WeakPolarHBondContact O-CA 3.46Å; V50-L58 PolarHBondContact N-O 3.03Å; V50-L58 PolarHBondContact O-N 2.97Å; V50-L60 HydrophobicContact CG2-CD1 4.11Å
51	R	90.4	Very high	93.6	Very high	141 Å²	141	41.7 Å²	41.7	53%	0.532	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	118.9	165.6	-178.7	177.2	-60.8	-80.6	-2.5	107.9	G54	R51-G54 PolarHBondContact NH1-O 3.03Å
52	F	91	Very high	93.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-64.5	-174.1	-169.7	-101.2	0	0	0	111.1	V50 L56 L58 V177 I181 E207 L212 I214	V50-F52 PolarHBondContact O-N 3.07Å; F52-L56 HydrophobicContact CD1-CD2 4.17Å; F52-L56 PolarHBondContact N-O 2.67Å; F52-L58 HydrophobicContact CB-CD1 4.14Å; F52-L58 HydrophobicContact CB-CG 4.01Å; F52-L58 HydrophobicContact CD2-CD1 3.94Å; F52-L58 HydrophobicContact CG-CD1 4.05Å; F52-L58 HydrophobicContact CG-CG 4.4Å; F52-V177 HydrophobicContact CE1-CB 3.91Å; F52-V177 HydrophobicContact CE1-CG1 4.44Å; F52-V177 HydrophobicContact CE1-CG2 3.93Å; F52-V177 HydrophobicContact CE2-CB 4.41Å; F52-V177 HydrophobicContact CE2-CG1 4.13Å; F52-V177 HydrophobicContact CE2-CG2 4.37Å; F52-V177 HydrophobicContact CZ-CB 3.79Å; F52-V177 HydrophobicContact CZ-CG1 4.01Å; F52-V177 HydrophobicContact CZ-CG2 3.53Å; F52-I181 HydrophobicContact CE1-CD1 4.06Å; F52-I181 HydrophobicContact CE1-CG1 4.46Å; F52-E207 HydrophobicContact CD1-CG 4.28Å; F52-E207 HydrophobicContact CD2-CB 4.36Å; F52-E207 HydrophobicContact CD2-CG 3.71Å; F52-E207 HydrophobicContact CE1-CB 4.2Å; F52-E207 HydrophobicContact CE1-CG 4.18Å; F52-E207 HydrophobicContact CE2-CB 3.7Å; F52-E207 HydrophobicContact CE2-CG 3.57Å; F52-E207 HydrophobicContact CG-CG 4.06Å; F52-E207 HydrophobicContact CZ-CB 3.6Å; F52-E207 HydrophobicContact CZ-CG 3.82Å; F52-E207 WeakPolarHBondContact O-CG 3.3Å; F52-L212 HydrophobicContact CE2-CB 4.32Å; F52-L212 HydrophobicContact CE2-CD1 3.93Å; F52-L212 HydrophobicContact CZ-CB 4.15Å; F52-L212 HydrophobicContact CZ-CD1 4.29Å; F52-I214 HydrophobicContact CE1-CG1 4.25Å
53	L	89.1	Confident	93.9	Very high	8 Å²	8	38 Å²	38	4%	0.042	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	114.2	-177.6	-169.8	64.6	0	0	0	110.5	N55 L56 I181 L187 I214 N269 T270 E301	L53-N55 PolarHBondContact O-N 3.23Å; L53-N55 VanDerWaalsContact O-N 3.1Å; L53-L56 VanDerWaalsContact O-CB 3.23Å; L53-L56 WeakPolarHBondContact O-CB 3.45Å; L53-L56 PolarHBondContact O-N 3.19Å; L53-I181 HydrophobicContact CD2-CG2 4.2Å; L53-L187 HydrophobicContact CD2-CD1 3.99Å; L53-I214 HydrophobicContact CD1-CD1 3.85Å; L53-I214 HydrophobicContact CD2-CD1 4.13Å; L53-I214 HydrophobicContact CD2-CG2 4.36Å; L53-N269 HydrophobicContact CD1-CB 3.98Å; L53-T270 HydrophobicContact CD1-CG2 3.44Å; L53-T270 VanDerWaalsContact CD1-CG2 3.44Å; L53-E301 HydrophobicContact CD1-CG 3.8Å; L53-E301 HydrophobicContact CG-CG 4.21Å
54	G	85.4	Confident	94	Very high	15 Å²	15	32.6 Å²	32.6	16%	0.155	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	-114.6	-179.3	0	0	0	0	0	112.8	R51 N269	R51-G54 PolarHBondContact NH1-O 3.03Å; G54-N269 PolarHBondContact N-ND2 3.28Å
55	N	84.9	Confident	94.1	Very high	15 Å²	15	29.9 Å²	29.9	8%	0.08	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-5.3	177	66.6	-9.2	0	0	0	113.7	N3 A5 M6 L53 V57	N3-N55 PolarHBondContact OD1-ND2 3.33Å; N3-N55 VanDerWaalsContact OD1-ND2 3.09Å; A5-N55 CarbonylContact C-O 3.51Å; A5-N55 VanDerWaalsContact CA-O 3.3Å; A5-N55 WeakPolarHBondContact CA-O 3.27Å; M6-N55 PolarHBondContact N-O 3.01Å; L53-N55 PolarHBondContact O-N 3.23Å; L53-N55 VanDerWaalsContact O-N 3.1Å; N55-V57 PolarHBondContact O-N 3.33Å
56	L	91.5	Very high	94.1	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.021	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	120.5	176	-179.1	61.8	0	0	0	110.5	K8 F52 L53 L58 I181	K8-L56 HydrophobicContact CB-CD1 4.28Å; K8-L56 HydrophobicContact CG-CD1 3.52Å; F52-L56 HydrophobicContact CD1-CD2 4.17Å; F52-L56 PolarHBondContact N-O 2.67Å; L53-L56 VanDerWaalsContact O-CB 3.23Å; L53-L56 WeakPolarHBondContact O-CB 3.45Å; L53-L56 PolarHBondContact O-N 3.19Å; L56-L58 HydrophobicContact CD1-CD2 4.5Å; L56-L58 HydrophobicContact CG-CD2 4.41Å; L56-I181 HydrophobicContact CD2-CG1 4.07Å
57	V	93.9	Very high	94	Very high	12 Å²	12	29.8 Å²	29.8	7%	0.073	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	122.3	175.6	176.2	0	0	0	0	108.8	A5 M6 K7 K8 H49 V50 N55	A5-V57 HydrophobicContact CB-CG2 3.87Å; M6-V57 PolarHBondContact O-N 2.97Å; K7-V57 CarbonylContact C-O 3.53Å; K7-V57 WeakPolarHBondContact CA-O 3.37Å; K7-V57 HydrophobicContact CG-CB 4.33Å; K8-V57 PolarHBondContact N-O 3.03Å; H49-V57 HydrophobicContact CB-CG1 4.35Å; V50-V57 CarbonylContact O-C 3.54Å; V50-V57 WeakPolarHBondContact O-CA 3.46Å; N55-V57 PolarHBondContact O-N 3.33Å
58	L	96.1	Very high	93.9	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	122.9	171.8	-53.8	-177.7	0	0	0	108.6	K8 V10 F28 V50 F52 L56 L60 V177 L180	K8-L58 HydrophobicContact CB-CD2 4.29Å; V10-L58 HydrophobicContact CG2-CD2 4.5Å; F28-L58 HydrophobicContact CE1-CD1 4.2Å; F28-L58 HydrophobicContact CZ-CD1 4.32Å; V50-L58 PolarHBondContact N-O 3.03Å; V50-L58 PolarHBondContact O-N 2.97Å; F52-L58 HydrophobicContact CB-CD1 4.14Å; F52-L58 HydrophobicContact CB-CG 4.01Å; F52-L58 HydrophobicContact CD2-CD1 3.94Å; F52-L58 HydrophobicContact CG-CD1 4.05Å; F52-L58 HydrophobicContact CG-CG 4.4Å; L56-L58 HydrophobicContact CD1-CD2 4.5Å; L56-L58 HydrophobicContact CG-CD2 4.41Å; L58-L60 HydrophobicContact CB-CD2 4.02Å; L58-V177 HydrophobicContact CD1-CG1 3.95Å; L58-L180 HydrophobicContact CD2-CD1 3.66Å
59	N	97.2	Very high	93.9	Very high	26 Å²	26	30.5 Å²	30.5	14%	0.139	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	92.5	172.7	-172	17.6	0	0	0	107.9	K8 K9 V10 H49 W61	K8-N59 PolarHBondContact O-N 2.92Å; K9-N59 WeakPolarHBondContact CA-O 3.42Å; V10-N59 PolarHBondContact N-O 3.19Å; H49-N59 PolarHBondContact CE1-OD1 2.97Å; H49-N59 PolarHBondContact ND1-OD1 3.28Å; H49-N59 VanDerWaalsContact ND1-OD1 3.17Å; N59-W61 PolarHBondContact ND2-NE1 3.17Å; N59-W61 PolarHBondContact OD1-NE1 2.95Å
60	L	98.2	Very high	93.9	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	124.8	-178.3	-49.8	-179.8	0	0	0	109	V10 L12 R24 F28 H47 S48 V50 L58 W173	V10-L60 HydrophobicContact CB-CD2 3.75Å; V10-L60 HydrophobicContact CG1-CD2 4.14Å; V10-L60 HydrophobicContact CG2-CD2 4.11Å; V10-L60 WeakPolarHBondContact O-CA 3.29Å; L12-L60 HydrophobicContact CD1-CB 4.5Å; R24-L60 HydrophobicContact CG-CD1 4Å; F28-L60 HydrophobicContact CB-CD1 4.42Å; F28-L60 HydrophobicContact CD1-CD1 4.38Å; F28-L60 HydrophobicContact CD2-CD1 3.45Å; F28-L60 VanDerWaalsContact CD2-CD1 3.45Å; F28-L60 HydrophobicContact CE2-CD1 3.7Å; F28-L60 HydrophobicContact CG-CD1 3.82Å; F28-L60 HydrophobicContact CZ-CD1 4.24Å; H47-L60 WeakPolarHBondContact CA-O 3.39Å; S48-L60 PolarHBondContact N-O 2.94Å; S48-L60 PolarHBondContact O-N 3.37Å; V50-L60 HydrophobicContact CG2-CD1 4.11Å; L58-L60 HydrophobicContact CB-CD2 4.02Å; L60-W173 HydrophobicContact CD2-CH2 4.39Å; L60-W173 HydrophobicContact CD2-CZ3 4.42Å
61	W	98.2	Very high	94	Very high	23 Å²	23	28.7 Å²	28.7	9%	0.087	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	100.2	174.7	-73	48.2	0	0	0	107.2	K9 V10 L11 L12 V45 H47 N59 I81	K9-W61 HydrophobicContact CD-CD2 4.44Å; K9-W61 HydrophobicContact CD-CZ2 4.41Å; K9-W61 VanDerWaalsContact CE-CE2 3.49Å; K9-W61 HydrophobicContact CG-CG 4.37Å; V10-W61 PolarHBondContact O-N 3.34Å; L11-W61 HydrophobicContact CD1-CB 3.63Å; L11-W61 HydrophobicContact CD1-CG 4.47Å; L12-W61 WeakPolarHBondContact CB-O 3Å; L12-W61 PolarHBondContact N-O 2.88Å; V45-W61 HydrophobicContact CG1-CB 4.15Å; V45-W61 HydrophobicContact CG1-CD2 4.33Å; V45-W61 HydrophobicContact CG1-CE3 3.89Å; V45-W61 HydrophobicContact CG1-CG 4.49Å; H47-W61 AromaticContact CE1-CD2 3.41Å; H47-W61 VanDerWaalsContact CE1-CD2 3.41Å; H47-W61 AromaticContact CE1-CE2 3.43Å; H47-W61 VanDerWaalsContact CE1-CE2 3.43Å; H47-W61 AromaticContact CE1-CE3 3.5Å; H47-W61 AromaticContact CE1-CH2 3.64Å; H47-W61 AromaticContact CE1-CZ2 3.57Å; H47-W61 AromaticContact CE1-CZ3 3.61Å; H47-W61 AromaticContact ND1-CD1 3.81Å; H47-W61 AromaticContact ND1-CD2 3.5Å; H47-W61 AromaticContact ND1-CE2 3.42Å; H47-W61 AromaticContact ND1-CG 3.74Å; H47-W61 AromaticContact ND1-CZ2 3.91Å; H47-W61 AromaticContact ND1-NE1 3.61Å; N59-W61 PolarHBondContact ND2-NE1 3.17Å; N59-W61 PolarHBondContact OD1-NE1 2.95Å; W61-I81 HydrophobicContact CE3-CG1 4.47Å; W61-I81 HydrophobicContact CZ3-CG1 4.13Å
62	D	98.1	Very high	94.2	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	101.1	178	-171.7	12.9	0	0	0	109.3	L12 K20 T21 R24 E46	L12-D62 HydrophobicContact CD1-CB 4.35Å; K20-D62 WeakPolarHBondContact CB-OD1 3.47Å; T21-D62 WeakPolarHBondContact CA-OD2 3.22Å; T21-D62 WeakPolarHBondContact CB-OD2 3.41Å; T21-D62 WeakPolarHBondContact CG2-OD2 3.16Å; T21-D62 PolarHBondContact OG1-OD1 3.42Å; T21-D62 PolarHBondContact OG1-OD2 2.96Å; R24-D62 IonicContact CZ-OD2 3.07Å; R24-D62 IonicContact NE-OD2 2.76Å; R24-D62 PolarHBondContact NE-OD2 2.91Å; R24-D62 IonicContact NH2-OD2 2.72Å; E46-D62 HydrophobicContact CB-CB 4.29Å; E46-D62 PolarHBondContact N-O 3.5Å; E46-D62 PolarHBondContact O-N 3.44Å
63	C	98.2	Very high	94.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	136.2	-174	-67.5	0	0	0	0	111.7	L12 M13 K20 G65 Y73	L12-C63 WeakPolarHBondContact O-CB 3.41Å; L12-C63 PolarHBondContact O-N 3.18Å; L12-C63 VanDerWaalsContact O-N 3.17Å; M13-C63 HydrophobicContact CE-CB 3.89Å; M13-C63 VanDerWaalsContact CE-SG 3.5Å; M13-C63 HydrophobicContact SD-CB 3.61Å; K20-C63 WeakPolarHBondContact CE-O 3.36Å; C63-G65 PolarHBondContact O-N 2.87Å; C63-Y73 HydrophobicContact CB-CD2 4.39Å; C63-Y73 HydrophobicContact CB-CE2 3.69Å
64	G	97.2	Very high	94.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.134	C	C	.	.			trans	-58.3	130.9	171.4	0	0	0	0	0	111.1	D44 Q66 Y73	D44-G64 PolarHBondContact O-N 3.2Å; G64-Q66 VanDerWaalsContact C-OE1 3.23Å; G64-Q66 VanDerWaalsContact CA-OE1 3.32Å; G64-Y73 PolarHBondContact N-OH 3.38Å; G64-Y73 VanDerWaalsContact O-CE2 3.3Å; G64-Y73 WeakPolarHBondContact O-CE2 3.44Å
65	G	95.8	Very high	94.9	Very high	3 Å²	3	29.5 Å²	29.5	3%	0.031	16%	0.157	C	C	.	.			trans	-93.6	10.8	-175.6	0	0	0	0	0	114.7	G14 S16 C63	G14-G65 VanDerWaalsContact O-CA 3.3Å; G14-G65 WeakPolarHBondContact O-CA 3.39Å; S16-G65 WeakPolarHBondContact CB-O 3.43Å; S16-G65 VanDerWaalsContact N-C 3.34Å; S16-G65 PolarHBondContact N-O 3.4Å; C63-G65 PolarHBondContact O-N 2.87Å
66	Q	95.8	Very high	95.2	Very high	39 Å²	39	33.4 Å²	33.4	18%	0.182	19%	0.185	C	C	.	.	S	Bend	trans	-74.2	141.2	178	-58.4	83.6	-22	0	0	109.6	T42 G64 T68 F69 M70	T42-Q66 PolarHBondContact O-NE2 3.43Å; T42-Q66 PolarHBondContact O-OE1 3.25Å; T42-Q66 VanDerWaalsContact O-OE1 3.14Å; G64-Q66 VanDerWaalsContact C-OE1 3.23Å; G64-Q66 VanDerWaalsContact CA-OE1 3.32Å; Q66-T68 VanDerWaalsContact C-N 3.29Å; Q66-T68 PolarHBondContact O-N 3.4Å; Q66-F69 HydrophobicContact CB-CD2 3.81Å; Q66-F69 HydrophobicContact CB-CE2 4.27Å; Q66-F69 HydrophobicContact CG-CD2 4.19Å; Q66-F69 HydrophobicContact CG-CE2 4.29Å; Q66-F69 PolarHBondContact O-N 3.35Å; Q66-F69 VanDerWaalsContact OE1-CD2 3.25Å; Q66-M70 PolarHBondContact O-N 3.49Å
67	D	94.7	Very high	95.2	Very high	61 Å²	61	35.3 Å²	35.3	33%	0.326	19%	0.194	S	C	.	.	H	α-helix	trans	-52	-45.5	-173.1	-62.2	-21.4	0	0	0	113	F69 M70 E71 K101 Y105	D67-F69 VanDerWaalsContact C-N 3.27Å; D67-F69 PolarHBondContact O-N 3.38Å; D67-M70 PolarHBondContact O-N 3.32Å; D67-E71 WeakPolarHBondContact O-CB 3.44Å; D67-E71 WeakPolarHBondContact O-CG 3.32Å; D67-E71 PolarHBondContact O-N 3.06Å; D67-K101 WeakPolarHBondContact OD1-CE 3.27Å; D67-K101 IonicContact OD1-NZ 2.64Å; D67-K101 PolarHBondContact OD1-NZ 3.11Å; D67-K101 IonicContact OD2-NZ 3.53Å; D67-K101 PolarHBondContact OD2-NZ 3.26Å; D67-Y105 PolarHBondContact OD1-OH 3.12Å
68	T	94.7	Very high	95.1	Very high	98 Å²	98	36.6 Å²	36.6	60%	0.601	20%	0.197	S	C	*	.	H	α-helix	trans	-60.8	-34.5	179.6	54	0	0	0	0	113	Q66 N72	Q66-T68 VanDerWaalsContact C-N 3.29Å; Q66-T68 PolarHBondContact O-N 3.4Å; T68-N72 WeakPolarHBondContact O-CB 3.29Å; T68-N72 PolarHBondContact O-N 3.44Å
69	F	95.1	Very high	94.9	Very high	47 Å²	47	41.9 Å²	41.9	21%	0.206	23%	0.226	C	C	.	.	H	α-helix	trans	-77.8	-43.5	176.4	-62.8	-45.2	0	0	0	111.1	I43 Q66 D67 E71 N72 Y73	I43-F69 HydrophobicContact CD1-CE2 4.14Å; I43-F69 HydrophobicContact CD1-CZ 4.35Å; I43-F69 HydrophobicContact CG2-CE2 4.34Å; I43-F69 HydrophobicContact CG2-CZ 3.83Å; Q66-F69 HydrophobicContact CB-CD2 3.81Å; Q66-F69 HydrophobicContact CB-CE2 4.27Å; Q66-F69 HydrophobicContact CG-CD2 4.19Å; Q66-F69 HydrophobicContact CG-CE2 4.29Å; Q66-F69 PolarHBondContact O-N 3.35Å; Q66-F69 VanDerWaalsContact OE1-CD2 3.25Å; D67-F69 VanDerWaalsContact C-N 3.27Å; D67-F69 PolarHBondContact O-N 3.38Å; F69-E71 VanDerWaalsContact C-N 3.33Å; F69-E71 PolarHBondContact O-N 3.19Å; F69-N72 CarbonylContact O-C 3.52Å; F69-N72 WeakPolarHBondContact O-CA 3.22Å; F69-N72 WeakPolarHBondContact O-CB 3.31Å; F69-N72 PolarHBondContact O-N 2.74Å; F69-N72 VanDerWaalsContact O-N 3.07Å; F69-Y73 HydrophobicContact CB-CE1 4.22Å; F69-Y73 HydrophobicContact CB-CE2 3.99Å; F69-Y73 WeakPolarHBondContact O-CD1 3.45Å; F69-Y73 WeakPolarHBondContact O-CD2 3.47Å; F69-Y73 PolarHBondContact O-N 2.99Å
70	M	93.9	Very high	94.7	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-55.9	-48	176.4	-68.6	-65.1	-68.9	0	0	111.2	M13 Q66 D67 N72 Y73 F74 Y105	M13-M70 HydrophobicContact SD-CE 4.45Å; M13-M70 HydrophobicContact SD-SD 4.2Å; Q66-M70 PolarHBondContact O-N 3.49Å; D67-M70 PolarHBondContact O-N 3.32Å; M70-N72 VanDerWaalsContact C-N 3.32Å; M70-N72 PolarHBondContact O-N 3.13Å; M70-Y73 WeakPolarHBondContact O-CB 3.44Å; M70-Y73 PolarHBondContact O-N 3.07Å; M70-Y73 VanDerWaalsContact O-N 3.13Å; M70-Y73 HydrophobicContact SD-CD2 3.98Å; M70-Y73 HydrophobicContact SD-CE2 4.19Å; M70-F74 HydrophobicContact CB-CE2 4.21Å; M70-F74 HydrophobicContact CE-CE2 3.96Å; M70-F74 HydrophobicContact CE-CZ 3.8Å; M70-F74 WeakPolarHBondContact O-CD2 3.31Å; M70-F74 WeakPolarHBondContact O-CE2 3.42Å; M70-F74 PolarHBondContact O-N 2.86Å; M70-Y105 HydrophobicContact CB-CD1 4.42Å; M70-Y105 HydrophobicContact CB-CE1 4.17Å; M70-Y105 HydrophobicContact CE-CD2 4.49Å; M70-Y105 HydrophobicContact CE-CG 4.09Å
71	E	94.1	Very high	94.7	Very high	110 Å²	110	45.4 Å²	45.4	51%	0.514	24%	0.244	S	C	.	.	H	α-helix	trans	-58.7	-43.1	175.2	-72.6	172.2	-170.7	0	0	112	D67 F69 Y73 F74 T75	D67-E71 WeakPolarHBondContact O-CB 3.44Å; D67-E71 WeakPolarHBondContact O-CG 3.32Å; D67-E71 PolarHBondContact O-N 3.06Å; F69-E71 VanDerWaalsContact C-N 3.33Å; F69-E71 PolarHBondContact O-N 3.19Å; E71-Y73 VanDerWaalsContact C-N 3.3Å; E71-Y73 PolarHBondContact O-N 2.81Å; E71-F74 PolarHBondContact O-N 2.64Å; E71-T75 WeakPolarHBondContact O-CB 3.47Å; E71-T75 WeakPolarHBondContact O-CG2 2.88Å; E71-T75 PolarHBondContact O-N 2.84Å; E71-T75 VanDerWaalsContact O-N 3.07Å; E71-T75 PolarHBondContact O-OG1 2.86Å
72	N	94.3	Very high	94.7	Very high	52 Å²	52	44.3 Å²	44.3	28%	0.278	24%	0.24	S	C	.	.	H	α-helix	trans	-64.8	-34.1	176.9	-166.1	34.9	0	0	0	112.6	T68 F69 M70 F74 T75 S76 Q77	T68-N72 WeakPolarHBondContact O-CB 3.29Å; T68-N72 PolarHBondContact O-N 3.44Å; F69-N72 CarbonylContact O-C 3.52Å; F69-N72 WeakPolarHBondContact O-CA 3.22Å; F69-N72 WeakPolarHBondContact O-CB 3.31Å; F69-N72 PolarHBondContact O-N 2.74Å; F69-N72 VanDerWaalsContact O-N 3.07Å; M70-N72 VanDerWaalsContact C-N 3.32Å; M70-N72 PolarHBondContact O-N 3.13Å; N72-F74 VanDerWaalsContact C-N 3.32Å; N72-F74 PolarHBondContact O-N 3.43Å; N72-T75 WeakPolarHBondContact CA-OG1 3.34Å; N72-T75 PolarHBondContact O-N 3.18Å; N72-S76 PolarHBondContact O-N 2.77Å; N72-S76 WeakPolarHBondContact OD1-CB 3.32Å; N72-S76 PolarHBondContact OD1-OG 3.46Å; N72-Q77 PolarHBondContact ND2-NE2 3.21Å; N72-Q77 PolarHBondContact O-N 3.06Å
73	Y	95.7	Very high	94.6	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.3	-36.2	176.3	-57.4	-25.9	0	0	0	112.5	M13 D44 V45 C63 G64 F69 M70 E71 Q77 R78 I81	M13-Y73 HydrophobicContact CE-CD2 3.98Å; M13-Y73 HydrophobicContact CE-CG 4.48Å; M13-Y73 HydrophobicContact SD-CD2 4.28Å; D44-Y73 WeakPolarHBondContact CA-OH 3.45Å; D44-Y73 PolarHBondContact O-OH 3.42Å; D44-Y73 VanDerWaalsContact OD1-CE1 3.31Å; D44-Y73 WeakPolarHBondContact OD1-CE1 3.42Å; V45-Y73 HydrophobicContact CG2-CE1 3.76Å; C63-Y73 HydrophobicContact CB-CD2 4.39Å; C63-Y73 HydrophobicContact CB-CE2 3.69Å; G64-Y73 PolarHBondContact N-OH 3.38Å; G64-Y73 VanDerWaalsContact O-CE2 3.3Å; G64-Y73 WeakPolarHBondContact O-CE2 3.44Å; F69-Y73 HydrophobicContact CB-CE1 4.22Å; F69-Y73 HydrophobicContact CB-CE2 3.99Å; F69-Y73 WeakPolarHBondContact O-CD1 3.45Å; F69-Y73 WeakPolarHBondContact O-CD2 3.47Å; F69-Y73 PolarHBondContact O-N 2.99Å; M70-Y73 WeakPolarHBondContact O-CB 3.44Å; M70-Y73 PolarHBondContact O-N 3.07Å; M70-Y73 VanDerWaalsContact O-N 3.13Å; M70-Y73 HydrophobicContact SD-CD2 3.98Å; M70-Y73 HydrophobicContact SD-CE2 4.19Å; E71-Y73 VanDerWaalsContact C-N 3.3Å; E71-Y73 PolarHBondContact O-N 2.81Å; Y73-Q77 CarbonylContact O-C 3.21Å; Y73-R78 WeakPolarHBondContact O-CA 3.47Å; Y73-R78 PolarHBondContact O-N 3.4Å; Y73-I81 HydrophobicContact CD1-CD1 3.07Å; Y73-I81 HydrophobicContact CD2-CD1 4.45Å; Y73-I81 HydrophobicContact CE1-CD1 3.68Å; Y73-I81 HydrophobicContact CG-CD1 3.52Å
74	F	93.4	Very high	94.5	Very high	26 Å²	26	57.1 Å²	57.1	11%	0.114	30%	0.297	C	S	.	.	H	α-helix	trans	-83.9	-21.5	179.9	-58	-53.5	0	0	0	113.7	M70 E71 N72 F82 Y105 C109	M70-F74 HydrophobicContact CB-CE2 4.21Å; M70-F74 HydrophobicContact CE-CE2 3.96Å; M70-F74 HydrophobicContact CE-CZ 3.8Å; M70-F74 WeakPolarHBondContact O-CD2 3.31Å; M70-F74 WeakPolarHBondContact O-CE2 3.42Å; M70-F74 PolarHBondContact O-N 2.86Å; E71-F74 PolarHBondContact O-N 2.64Å; N72-F74 VanDerWaalsContact C-N 3.32Å; N72-F74 PolarHBondContact O-N 3.43Å; F74-F82 HydrophobicContact CD1-CE2 4.06Å; F74-F82 HydrophobicContact CD1-CZ 4.03Å; F74-F82 HydrophobicContact CE1-CE2 4.17Å; F74-F82 AromaticContact CE1-CZ 3.66Å; F74-F82 HydrophobicContact CE1-CZ 3.66Å; F74-Y105 AromaticContact CE2-CD1 3.75Å; F74-Y105 HydrophobicContact CE2-CD1 3.75Å; F74-Y105 HydrophobicContact CE2-CE1 4.41Å; F74-C109 HydrophobicContact CE1-CB 4.33Å; F74-C109 VanDerWaalsContact CE1-SG 3.58Å; F74-C109 VanDerWaalsContact CZ-SG 3.54Å
75	T	92.2	Very high	94.6	Very high	104 Å²	104	57.4 Å²	57.4	64%	0.638	30%	0.299	S	S	*	.	H	α-helix	trans	-100.8	-75.5	-177.3	53.9	0	0	0	0	111.4	E71 N72	E71-T75 WeakPolarHBondContact O-CB 3.47Å; E71-T75 WeakPolarHBondContact O-CG2 2.88Å; E71-T75 PolarHBondContact O-N 2.84Å; E71-T75 VanDerWaalsContact O-N 3.07Å; E71-T75 PolarHBondContact O-OG1 2.86Å; N72-T75 WeakPolarHBondContact CA-OG1 3.34Å; N72-T75 PolarHBondContact O-N 3.18Å
76	S	91.8	Very high	94.7	Very high	96 Å²	96	60.6 Å²	60.6	67%	0.671	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-30.3	-169.6	-42.4	0	0	0	0	114	N72	N72-S76 PolarHBondContact O-N 2.77Å; N72-S76 WeakPolarHBondContact OD1-CB 3.32Å; N72-S76 PolarHBondContact OD1-OG 3.46Å
77	Q	91.4	Very high	94.9	Very high	44 Å²	44	58.8 Å²	58.8	21%	0.206	30%	0.304	C	S	.	.	S	Bend	trans	-106.6	8.9	-175.3	-58.7	-163.6	26.2	0	0	114.2	N72 Y73 D79 N80 I81	N72-Q77 PolarHBondContact ND2-NE2 3.21Å; N72-Q77 PolarHBondContact O-N 3.06Å; Y73-Q77 CarbonylContact O-C 3.21Å; Q77-D79 PolarHBondContact O-N 3.14Å; Q77-N80 PolarHBondContact O-N 2.92Å; Q77-N80 VanDerWaalsContact O-N 3.1Å; Q77-I81 HydrophobicContact CB-CD1 3.69Å; Q77-I81 HydrophobicContact CB-CG1 4.07Å; Q77-I81 PolarHBondContact O-N 2.6Å
78	R	91.8	Very high	95	Very high	40 Å²	40	55.9 Å²	55.9	15%	0.151	29%	0.289	C	S	.	.	H	α-helix	trans	-52.1	-53.2	-170.8	-168.1	-175.9	-177.8	95.8	-6.7	112.4	Y73 N80 I81 F82 E111 A112	Y73-R78 WeakPolarHBondContact O-CA 3.47Å; Y73-R78 PolarHBondContact O-N 3.4Å; R78-N80 VanDerWaalsContact C-N 3.33Å; R78-N80 PolarHBondContact O-N 3.17Å; R78-I81 PolarHBondContact O-N 3.14Å; R78-F82 HydrophobicContact CG-CD2 4.21Å; R78-F82 WeakPolarHBondContact O-CB 3.09Å; R78-F82 WeakPolarHBondContact O-CD2 3.5Å; R78-F82 PolarHBondContact O-N 3.44Å; R78-E111 IonicContact NH2-OE1 3.58Å; R78-A112 HydrophobicContact CG-CB 4.16Å; R78-A112 VanDerWaalsContact NH2-CA 3.33Å
79	D	90.8	Very high	95.2	Very high	111 Å²	111	51.2 Å²	51.2	59%	0.594	26%	0.26	S	S	*	.	H	α-helix	trans	-65.1	-37.1	-177.3	-62.3	-14.8	0	0	0	112.1	Q77 R83	Q77-D79 PolarHBondContact O-N 3.14Å; D79-R83 WeakPolarHBondContact O-CB 3.36Å; D79-R83 PolarHBondContact O-N 3.4Å
80	N	93.9	Very high	95.4	Very high	99 Å²	99	49 Å²	49	53%	0.529	25%	0.25	S	S	.	.	H	α-helix	trans	-72	-45	-179.2	-177.2	45.7	0	0	0	111.9	K9 Q77 R78	K9-N80 PolarHBondContact NZ-O 3.06Å; Q77-N80 PolarHBondContact O-N 2.92Å; Q77-N80 VanDerWaalsContact O-N 3.1Å; R78-N80 VanDerWaalsContact C-N 3.33Å; R78-N80 PolarHBondContact O-N 3.17Å
81	I	96.9	Very high	95.7	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-74.4	-41.4	-175.4	-69.7	177.7	0	0	0	111.4	K9 L11 M13 V45 W61 Y73 Q77 R78	K9-I81 WeakPolarHBondContact CE-O 3.31Å; K9-I81 PolarHBondContact NZ-O 3.05Å; L11-I81 HydrophobicContact CD1-CG2 3.94Å; L11-I81 HydrophobicContact CD2-CG2 3.98Å; M13-I81 HydrophobicContact CE-CG2 3.57Å; V45-I81 HydrophobicContact CG2-CD1 4.07Å; W61-I81 HydrophobicContact CE3-CG1 4.47Å; W61-I81 HydrophobicContact CZ3-CG1 4.13Å; Y73-I81 HydrophobicContact CD1-CD1 3.07Å; Y73-I81 HydrophobicContact CD2-CD1 4.45Å; Y73-I81 HydrophobicContact CE1-CD1 3.68Å; Y73-I81 HydrophobicContact CG-CD1 3.52Å; Q77-I81 HydrophobicContact CB-CD1 3.69Å; Q77-I81 HydrophobicContact CB-CG1 4.07Å; Q77-I81 PolarHBondContact O-N 2.6Å; R78-I81 PolarHBondContact O-N 3.14Å
82	F	98.2	Very high	95.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-96.2	-2.8	-172.3	-64.4	-85.7	0	0	0	114.2	L11 M13 F74 R78 C109 A112 I113 N116 S117	L11-F82 HydrophobicContact CD2-CD1 3.86Å; L11-F82 HydrophobicContact CD2-CE1 3.83Å; M13-F82 HydrophobicContact CE-CE1 4.21Å; M13-F82 HydrophobicContact CE-CE2 4.37Å; M13-F82 HydrophobicContact CE-CZ 3.71Å; F74-F82 HydrophobicContact CD1-CE2 4.06Å; F74-F82 HydrophobicContact CD1-CZ 4.03Å; F74-F82 HydrophobicContact CE1-CE2 4.17Å; F74-F82 AromaticContact CE1-CZ 3.66Å; F74-F82 HydrophobicContact CE1-CZ 3.66Å; R78-F82 HydrophobicContact CG-CD2 4.21Å; R78-F82 WeakPolarHBondContact O-CB 3.09Å; R78-F82 WeakPolarHBondContact O-CD2 3.5Å; R78-F82 PolarHBondContact O-N 3.44Å; F82-C109 HydrophobicContact CE1-CB 4.17Å; F82-A112 HydrophobicContact CB-CB 4.06Å; F82-A112 HydrophobicContact CD1-CB 3.61Å; F82-A112 HydrophobicContact CD2-CB 3.62Å; F82-A112 HydrophobicContact CE1-CB 3.88Å; F82-A112 HydrophobicContact CE2-CB 3.89Å; F82-A112 HydrophobicContact CG-CB 3.47Å; F82-A112 VanDerWaalsContact CG-CB 3.47Å; F82-A112 HydrophobicContact CZ-CB 4.02Å; F82-I113 HydrophobicContact CD1-CD1 3.79Å; F82-I113 HydrophobicContact CD1-CG1 3.92Å; F82-I113 HydrophobicContact CE1-CG1 4.45Å; F82-N116 HydrophobicContact CB-CB 4.01Å; F82-N116 VanDerWaalsContact O-CB 3.25Å; F82-N116 WeakPolarHBondContact O-CB 3.34Å; F82-S117 PolarHBondContact O-OG 2.98Å
83	R	97.5	Very high	96	Very high	157 Å²	157	43.1 Å²	43.1	59%	0.592	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	143.2	173.9	-179.9	176.9	-176.9	-174.7	4.3	113.1	K9 D79 V85	K9-R83 WeakPolarHBondContact CD-O 3.49Å; K9-R83 PolarHBondContact NZ-O 3.41Å; D79-R83 WeakPolarHBondContact O-CB 3.36Å; D79-R83 PolarHBondContact O-N 3.4Å; R83-V85 PolarHBondContact O-N 2.82Å
84	N	96.4	Very high	96.1	Very high	113 Å²	113	44.3 Å²	44.3	60%	0.604	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.3	33.4	178.2	-56.4	-28.7	0	0	0	113.1	K9 S117	K9-N84 VanDerWaalsContact CB-O 3.25Å; K9-N84 WeakPolarHBondContact CB-O 3.47Å; N84-S117 PolarHBondContact N-OG 2.82Å
85	V	98.5	Very high	96.2	Very high	6 Å²	6	48.7 Å²	48.7	4%	0.036	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	128.5	174.3	177.7	0	0	0	0	108.1	K9 L11 R83 V87 I113 S117 A120	K9-V85 HydrophobicContact CD-CG2 4.05Å; K9-V85 HydrophobicContact CG-CG2 4.49Å; L11-V85 HydrophobicContact CB-CG1 3.97Å; L11-V85 HydrophobicContact CB-CG2 4.32Å; L11-V85 HydrophobicContact CD2-CG2 4.07Å; R83-V85 PolarHBondContact O-N 2.82Å; V85-V87 VanDerWaalsContact CG1-O 3.29Å; V85-V87 WeakPolarHBondContact CG1-O 3.43Å; V85-I113 HydrophobicContact CB-CD1 3.77Å; V85-I113 HydrophobicContact CG1-CD1 3.76Å; V85-I113 HydrophobicContact CG2-CD1 3.95Å; V85-S117 PolarHBondContact N-OG 2.95Å; V85-S117 WeakPolarHBondContact O-CB 3.45Å; V85-A120 HydrophobicContact CB-CB 4.43Å; V85-A120 HydrophobicContact CG1-CB 4.2Å; V85-A120 WeakPolarHBondContact O-CB 3.39Å
86	E	98.1	Very high	96.4	Very high	70 Å²	70	45 Å²	45	33%	0.327	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	-34.6	177.3	-67.5	-90.3	-176.8	0	0	110.6	K8 K9 K121 L180	K8-E86 HydrophobicContact CB-CB 4.4Å; K8-E86 HydrophobicContact CB-CG 4.25Å; K8-E86 HydrophobicContact CD-CB 4.16Å; K8-E86 HydrophobicContact CD-CG 3.52Å; K8-E86 WeakPolarHBondContact CD-OE1 3.44Å; K8-E86 WeakPolarHBondContact CD-OE2 3.42Å; K8-E86 IonicContact NZ-OE1 3.5Å; K8-E86 PolarHBondContact NZ-OE1 2.98Å; K8-E86 IonicContact NZ-OE2 3.39Å; K8-E86 PolarHBondContact NZ-OE2 3.35Å; K9-E86 WeakPolarHBondContact O-CB 3.36Å; K9-E86 PolarHBondContact O-N 3.21Å; E86-K121 PolarHBondContact O-N 2.91Å; E86-L180 HydrophobicContact CB-CD2 3.96Å
87	V	98.7	Very high	96.5	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	129.2	176.3	167.4	0	0	0	0	109.2	K9 V10 L11 V85 I89 K121 F123 I176 L180	K9-V87 PolarHBondContact O-N 3.13Å; V10-V87 WeakPolarHBondContact CA-O 3.48Å; V10-V87 HydrophobicContact CG1-CB 4.27Å; V10-V87 HydrophobicContact CG1-CG1 4.09Å; V10-V87 HydrophobicContact CG2-CB 4.43Å; L11-V87 PolarHBondContact N-O 3.29Å; V85-V87 VanDerWaalsContact CG1-O 3.29Å; V85-V87 WeakPolarHBondContact CG1-O 3.43Å; V87-I89 HydrophobicContact CG1-CD1 4.4Å; V87-I89 HydrophobicContact CG1-CG1 3.71Å; V87-K121 WeakPolarHBondContact CA-O 3.4Å; V87-K121 HydrophobicContact CG2-CB 4.19Å; V87-F123 HydrophobicContact CG1-CD2 3.8Å; V87-F123 HydrophobicContact CG1-CE2 4.25Å; V87-F123 HydrophobicContact CG2-CE2 4.38Å; V87-I176 HydrophobicContact CG1-CG2 3.9Å; V87-I176 HydrophobicContact CG2-CG2 4.4Å; V87-L180 HydrophobicContact CG2-CD1 4.09Å; V87-L180 HydrophobicContact CG2-CD2 3.67Å; V87-L180 HydrophobicContact CG2-CG 3.98Å
88	L	98.7	Very high	96.6	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.7	161.6	173.9	66.2	0	0	0	108.7	L11 M13 C109 L110 I113 K121 I122 F123	L11-L88 HydrophobicContact CB-CD1 4.16Å; L11-L88 HydrophobicContact CD2-CD1 4.03Å; L11-L88 HydrophobicContact CG-CD1 4.06Å; M13-L88 HydrophobicContact CB-CD1 4.02Å; M13-L88 HydrophobicContact CG-CD1 3.93Å; L88-C109 HydrophobicContact CD2-CB 4.23Å; L88-L110 HydrophobicContact CD2-CD2 4.5Å; L88-I113 HydrophobicContact CB-CD1 4.4Å; L88-I113 HydrophobicContact CB-CG1 4.44Å; L88-I113 HydrophobicContact CD2-CG1 3.98Å; L88-K121 PolarHBondContact N-O 2.83Å; L88-I122 HydrophobicContact CB-CD1 3.95Å; L88-I122 HydrophobicContact CD2-CD1 4.25Å; L88-I122 HydrophobicContact CD2-CG2 4.49Å; L88-F123 PolarHBondContact O-N 3.37Å
89	I	98.8	Very high	96.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	108.5	168.4	-52.2	172	0	0	0	107.2	V10 L11 L12 M13 V87 V91 F123 L125 W173 I176	V10-I89 HydrophobicContact CG1-CD1 3.56Å; V10-I89 HydrophobicContact CG1-CG1 4.07Å; L11-I89 PolarHBondContact O-N 3.49Å; L12-I89 WeakPolarHBondContact CA-O 3.37Å; L12-I89 HydrophobicContact CD2-CB 3.99Å; L12-I89 HydrophobicContact CD2-CD1 3.9Å; L12-I89 HydrophobicContact CD2-CG2 4.09Å; L12-I89 HydrophobicContact CG-CD1 4.44Å; M13-I89 PolarHBondContact N-O 3.19Å; V87-I89 HydrophobicContact CG1-CD1 4.4Å; V87-I89 HydrophobicContact CG1-CG1 3.71Å; I89-V91 HydrophobicContact CG2-CG2 4.18Å; I89-F123 CarbonylContact C-O 3.57Å; I89-F123 WeakPolarHBondContact CA-O 3.4Å; I89-F123 HydrophobicContact CG1-CB 4.46Å; I89-L125 HydrophobicContact CG2-CD1 3.56Å; I89-L125 HydrophobicContact CG2-CG 3.71Å; I89-W173 HydrophobicContact CD1-CE3 4.38Å; I89-W173 HydrophobicContact CD1-CH2 3.35Å; I89-W173 HydrophobicContact CD1-CZ2 3.82Å; I89-W173 HydrophobicContact CD1-CZ3 3.68Å; I89-I176 HydrophobicContact CD1-CD1 3.73Å; I89-I176 HydrophobicContact CD1-CG2 4.3Å; I89-I176 HydrophobicContact CG1-CD1 3.98Å
90	Y	98.8	Very high	96.8	Very high	1 Å²	1	57.4 Å²	57.4	0%	0.004	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	126.7	173.5	-158.1	-80.3	0	0	0	110.5	M13 F92 D102 Y105 Y106 C109 F123 C124 L125	M13-Y90 HydrophobicContact CB-CD2 3.59Å; M13-Y90 HydrophobicContact CB-CE2 3.97Å; M13-Y90 HydrophobicContact CB-CG 4.46Å; M13-Y90 CarbonylContact O-C 3.58Å; M13-Y90 WeakPolarHBondContact O-CA 3.38Å; Y90-F92 HydrophobicContact CD1-CD1 4.43Å; Y90-F92 AromaticContact CD1-CD2 3.75Å; Y90-F92 HydrophobicContact CD1-CD2 3.75Å; Y90-F92 HydrophobicContact CD1-CE1 4.03Å; Y90-F92 AromaticContact CD1-CE2 3.26Å; Y90-F92 HydrophobicContact CD1-CE2 3.26Å; Y90-F92 HydrophobicContact CD1-CG 4.32Å; Y90-F92 AromaticContact CD1-CZ 3.42Å; Y90-F92 HydrophobicContact CD1-CZ 3.42Å; Y90-F92 VanDerWaalsContact CD1-CZ 3.42Å; Y90-F92 HydrophobicContact CE1-CD1 4.15Å; Y90-F92 HydrophobicContact CE1-CD2 4.29Å; Y90-F92 AromaticContact CE1-CE1 3.65Å; Y90-F92 HydrophobicContact CE1-CE1 3.65Å; Y90-F92 AromaticContact CE1-CE2 3.8Å; Y90-F92 HydrophobicContact CE1-CE2 3.8Å; Y90-F92 HydrophobicContact CE1-CG 4.46Å; Y90-F92 AromaticContact CE1-CZ 3.45Å; Y90-F92 HydrophobicContact CE1-CZ 3.45Å; Y90-F92 VanDerWaalsContact CE1-CZ 3.45Å; Y90-F92 HydrophobicContact CG-CE2 4.19Å; Y90-F92 HydrophobicContact CG-CZ 4.45Å; Y90-D102 PolarHBondContact OH-O 3.25Å; Y90-Y105 VanDerWaalsContact OH-CB 3.29Å; Y90-Y105 WeakPolarHBondContact OH-CB 3.41Å; Y90-Y106 AromaticContact CD1-CD2 3.89Å; Y90-Y106 HydrophobicContact CD1-CD2 3.89Å; Y90-Y106 HydrophobicContact CD1-CG 4.38Å; Y90-Y106 AromaticContact CD2-CD2 3.63Å; Y90-Y106 HydrophobicContact CD2-CD2 3.63Å; Y90-Y106 HydrophobicContact CD2-CE2 4.44Å; Y90-Y106 HydrophobicContact CE1-CD2 4.31Å; Y90-Y106 HydrophobicContact CE1-CG 4.46Å; Y90-Y106 HydrophobicContact CE2-CD2 4.11Å; Y90-Y106 AromaticContact CG-CD2 3.48Å; Y90-Y106 HydrophobicContact CG-CD2 3.48Å; Y90-Y106 VanDerWaalsContact CG-CD2 3.48Å; Y90-Y106 HydrophobicContact CG-CE2 4.09Å; Y90-Y106 HydrophobicContact CG-CG 4.37Å; Y90-Y106 PolarHBondContact OH-N 3.46Å; Y90-C109 HydrophobicContact CD2-CB 4.36Å; Y90-C109 HydrophobicContact CE2-CB 4.36Å; Y90-F123 PolarHBondContact N-O 3.1Å; Y90-C124 CarbonylContact O-C 3.58Å; Y90-C124 WeakPolarHBondContact O-CA 3.3Å; Y90-L125 PolarHBondContact O-N 3.01Å
91	V	98.8	Very high	96.9	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	114.1	-171.8	-175.3	0	0	0	0	110.1	M13 S18 K20 M23 I89 L125 H127	M13-V91 PolarHBondContact O-N 3.27Å; S18-V91 WeakPolarHBondContact CB-O 3.25Å; S18-V91 WeakPolarHBondContact O-CG1 3.47Å; S18-V91 PolarHBondContact OG-O 2.76Å; K20-V91 HydrophobicContact CG-CB 3.87Å; K20-V91 HydrophobicContact CG-CG1 4.46Å; K20-V91 HydrophobicContact CG-CG2 3.78Å; M23-V91 HydrophobicContact CE-CB 4.06Å; M23-V91 HydrophobicContact CE-CG1 3.42Å; M23-V91 VanDerWaalsContact CE-CG1 3.42Å; M23-V91 HydrophobicContact CE-CG2 3.41Å; M23-V91 VanDerWaalsContact CE-CG2 3.41Å; I89-V91 HydrophobicContact CG2-CG2 4.18Å; V91-L125 HydrophobicContact CG2-CB 4.45Å; V91-L125 HydrophobicContact CG2-CD1 4.42Å; V91-H127 HydrophobicContact CG1-CB 3.73Å
92	F	98.6	Very high	96.8	Very high	10 Å²	10	55.9 Å²	55.9	4%	0.044	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	132.8	173.9	-68.3	-86.9	0	0	0	110	Y90 D102 M103 Y106 C124 L125 H127 L148	Y90-F92 HydrophobicContact CD1-CD1 4.43Å; Y90-F92 AromaticContact CD1-CD2 3.75Å; Y90-F92 HydrophobicContact CD1-CD2 3.75Å; Y90-F92 HydrophobicContact CD1-CE1 4.03Å; Y90-F92 AromaticContact CD1-CE2 3.26Å; Y90-F92 HydrophobicContact CD1-CE2 3.26Å; Y90-F92 HydrophobicContact CD1-CG 4.32Å; Y90-F92 AromaticContact CD1-CZ 3.42Å; Y90-F92 HydrophobicContact CD1-CZ 3.42Å; Y90-F92 VanDerWaalsContact CD1-CZ 3.42Å; Y90-F92 HydrophobicContact CE1-CD1 4.15Å; Y90-F92 HydrophobicContact CE1-CD2 4.29Å; Y90-F92 AromaticContact CE1-CE1 3.65Å; Y90-F92 HydrophobicContact CE1-CE1 3.65Å; Y90-F92 AromaticContact CE1-CE2 3.8Å; Y90-F92 HydrophobicContact CE1-CE2 3.8Å; Y90-F92 HydrophobicContact CE1-CG 4.46Å; Y90-F92 AromaticContact CE1-CZ 3.45Å; Y90-F92 HydrophobicContact CE1-CZ 3.45Å; Y90-F92 VanDerWaalsContact CE1-CZ 3.45Å; Y90-F92 HydrophobicContact CG-CE2 4.19Å; Y90-F92 HydrophobicContact CG-CZ 4.45Å; F92-D102 HydrophobicContact CD1-CB 4.27Å; F92-D102 HydrophobicContact CE1-CB 4.19Å; F92-M103 HydrophobicContact CE1-CE 4.27Å; F92-M103 HydrophobicContact CE1-SD 3.84Å; F92-M103 HydrophobicContact CZ-SD 4.08Å; F92-Y106 HydrophobicContact CE2-CD2 4.38Å; F92-Y106 HydrophobicContact CE2-CG 4.31Å; F92-Y106 AromaticContact CZ-CD1 3.96Å; F92-Y106 HydrophobicContact CZ-CD1 3.96Å; F92-Y106 HydrophobicContact CZ-CD2 4.15Å; F92-Y106 AromaticContact CZ-CG 3.68Å; F92-Y106 HydrophobicContact CZ-CG 3.68Å; F92-C124 HydrophobicContact CD2-CB 4.48Å; F92-C124 HydrophobicContact CE2-CB 4.34Å; F92-L125 PolarHBondContact N-O 2.89Å; F92-H127 WeakPolarHBondContact O-CA 3.4Å; F92-H127 WeakPolarHBondContact O-CB 3.34Å; F92-H127 PolarHBondContact O-N 3.06Å; F92-L148 HydrophobicContact CD2-CD1 4.1Å; F92-L148 HydrophobicContact CD2-CD2 4.11Å; F92-L148 HydrophobicContact CE1-CD2 4.13Å; F92-L148 HydrophobicContact CE2-CD1 4.05Å; F92-L148 HydrophobicContact CE2-CD2 3.33Å; F92-L148 HydrophobicContact CE2-CG 4.35Å; F92-L148 HydrophobicContact CZ-CD2 3.35Å
93	D	97.9	Very high	96.8	Very high	28 Å²	28	56.9 Å²	56.9	15%	0.15	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	124.6	168.8	-168.7	-21.7	0	0	0	109	E95 S96 K128	D93-E95 PolarHBondContact O-N 2.87Å; D93-E95 PolarHBondContact OD1-N 3.43Å; D93-S96 VanDerWaalsContact O-CB 3.3Å; D93-S96 WeakPolarHBondContact O-CB 3.34Å; D93-S96 PolarHBondContact O-N 2.86Å; D93-K128 IonicContact OD1-NZ 2.77Å; D93-K128 WeakPolarHBondContact OD2-CE 3.32Å; D93-K128 IonicContact OD2-NZ 2.63Å; D93-K128 PolarHBondContact OD2-NZ 3.12Å
94	V	97.4	Very high	96.7	Very high	24 Å²	24	54.8 Å²	54.8	15%	0.145	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-25.6	179.5	74.3	0	0	0	0	113	V126 H127 K128 M129 V132 I140	V94-V126 HydrophobicContact CB-CG1 4.24Å; V94-V126 HydrophobicContact CG2-CG1 4.23Å; V94-H127 WeakPolarHBondContact CB-O 3.49Å; V94-H127 WeakPolarHBondContact CG1-O 3.46Å; V94-H127 PolarHBondContact N-O 2.9Å; V94-K128 HydrophobicContact CG1-CB 4.26Å; V94-K128 VanDerWaalsContact CG1-O 3.22Å; V94-K128 WeakPolarHBondContact CG1-O 3.24Å; V94-M129 HydrophobicContact CB-SD 4.08Å; V94-M129 HydrophobicContact CG2-SD 3.7Å; V94-V132 HydrophobicContact CB-CG2 4.35Å; V94-V132 HydrophobicContact CG1-CG2 3.88Å; V94-V132 HydrophobicContact CG2-CG2 3.52Å; V94-I140 HydrophobicContact CG2-CG2 4.14Å
95	E	95.5	Very high	96.7	Very high	119 Å²	119	50.2 Å²	50.2	56%	0.556	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.5	8.6	176	-67.1	-162.9	144.1	0	0	113.4	D93 R97 L131	D93-E95 PolarHBondContact O-N 2.87Å; D93-E95 PolarHBondContact OD1-N 3.43Å; E95-R97 PolarHBondContact O-N 2.86Å; E95-R97 VanDerWaalsContact O-N 3.17Å; E95-L131 VanDerWaalsContact CD-CD1 3.44Å; E95-L131 HydrophobicContact CG-CB 4.14Å; E95-L131 HydrophobicContact CG-CD1 3.85Å; E95-L131 WeakPolarHBondContact OE2-CD1 3.37Å
96	S	95.9	Very high	96.7	Very high	25 Å²	25	49.9 Å²	49.9	18%	0.175	23%	0.228	C	C	.	.			trans	-58.9	124	-179.6	-172.8	0	0	0	0	111.6	D93 E98 D102	D93-S96 VanDerWaalsContact O-CB 3.3Å; D93-S96 WeakPolarHBondContact O-CB 3.34Å; D93-S96 PolarHBondContact O-N 2.86Å; S96-E98 VanDerWaalsContact C-N 3.35Å; S96-E98 PolarHBondContact OG-N 3.15Å; S96-D102 WeakPolarHBondContact CB-OD2 3.39Å; S96-D102 PolarHBondContact OG-OD2 2.93Å
97	R	94.3	Very high	96.6	Very high	244 Å²	244	50.6 Å²	50.6	92%	0.921	23%	0.231	S	C	*	.	S	Bend	trans	-85	-8.7	176.6	-60.6	-176.4	-176.7	179	0.2	113.4	E95	E95-R97 PolarHBondContact O-N 2.86Å; E95-R97 VanDerWaalsContact O-N 3.17Å
98	E	93.9	Very high	96.6	Very high	88 Å²	88	51.7 Å²	51.7	41%	0.411	24%	0.238	S	C	.	.			trans	-119.1	47.2	-177.8	-68.6	169.4	-125.1	0	0	110.3	K15 S96 E100 K101 D102	K15-E98 IonicContact NZ-OE1 3.73Å; K15-E98 PolarHBondContact NZ-OE1 3.18Å; K15-E98 IonicContact NZ-OE2 3.68Å; K15-E98 PolarHBondContact NZ-OE2 2.88Å; S96-E98 VanDerWaalsContact C-N 3.35Å; S96-E98 PolarHBondContact OG-N 3.15Å; E98-E100 PolarHBondContact O-N 3.49Å; E98-K101 HydrophobicContact CB-CB 4.2Å; E98-K101 WeakPolarHBondContact O-CB 3.34Å; E98-K101 PolarHBondContact O-N 2.91Å; E98-K101 VanDerWaalsContact OE2-CD 3.27Å; E98-K101 WeakPolarHBondContact OE2-CD 3.5Å; E98-K101 IonicContact OE2-NZ 3.49Å; E98-D102 PolarHBondContact O-N 3.48Å
99	L	91.9	Very high	96.5	Very high	44 Å²	44	51.7 Å²	51.7	23%	0.23	24%	0.238	C	C	.	.	H	α-helix	trans	-55.1	-40.9	-174.4	-173.1	75	0	0	0	112.7	K101 D102 M103	L99-K101 VanDerWaalsContact C-N 3.3Å; L99-K101 PolarHBondContact O-N 3.27Å; L99-D102 WeakPolarHBondContact O-CB 3.49Å; L99-D102 PolarHBondContact O-N 2.66Å; L99-M103 HydrophobicContact CD1-CE 3.97Å; L99-M103 HydrophobicContact CD2-CE 4.48Å; L99-M103 HydrophobicContact CG-CE 4.21Å; L99-M103 HydrophobicContact CG-CG 4.33Å; L99-M103 WeakPolarHBondContact O-CB 3.14Å; L99-M103 VanDerWaalsContact O-CG 3.25Å; L99-M103 WeakPolarHBondContact O-CG 3.34Å; L99-M103 PolarHBondContact O-N 3.42Å
100	E	94.5	Very high	96.5	Very high	176 Å²	176	52.2 Å²	52.2	82%	0.822	24%	0.241	S	C	*	.	H	α-helix	trans	-59.5	-41.8	179.1	-65.7	-179.8	175.4	0	0	112.1	E98 M103 H104	E98-E100 PolarHBondContact O-N 3.49Å; E100-M103 PolarHBondContact O-N 3.08Å; E100-H104 PolarHBondContact O-N 3.49Å
101	K	95.6	Very high	96.4	Very high	65 Å²	65	57.1 Å²	57.1	28%	0.283	26%	0.264	S	S	.	.	H	α-helix	trans	-67.4	-41.6	176.2	-169.3	-174.3	-175.9	-175.2	0	111.2	D67 E98 L99 M103 H104 Y105	D67-K101 WeakPolarHBondContact OD1-CE 3.27Å; D67-K101 IonicContact OD1-NZ 2.64Å; D67-K101 PolarHBondContact OD1-NZ 3.11Å; D67-K101 IonicContact OD2-NZ 3.53Å; D67-K101 PolarHBondContact OD2-NZ 3.26Å; E98-K101 HydrophobicContact CB-CB 4.2Å; E98-K101 WeakPolarHBondContact O-CB 3.34Å; E98-K101 PolarHBondContact O-N 2.91Å; E98-K101 VanDerWaalsContact OE2-CD 3.27Å; E98-K101 WeakPolarHBondContact OE2-CD 3.5Å; E98-K101 IonicContact OE2-NZ 3.49Å; L99-K101 VanDerWaalsContact C-N 3.3Å; L99-K101 PolarHBondContact O-N 3.27Å; K101-M103 VanDerWaalsContact C-N 3.29Å; K101-M103 PolarHBondContact O-N 3.14Å; K101-H104 WeakPolarHBondContact O-CB 3.25Å; K101-H104 PolarHBondContact O-N 3.46Å; K101-Y105 HydrophobicContact CD-CE2 4.18Å; K101-Y105 WeakPolarHBondContact CE-OH 3.39Å; K101-Y105 HydrophobicContact CG-CD2 4.29Å; K101-Y105 HydrophobicContact CG-CE2 3.92Å; K101-Y105 PolarHBondContact O-N 3.27Å
102	D	96	Very high	96.3	Very high	3 Å²	3	57.1 Å²	57.1	2%	0.016	26%	0.264	C	S	.	.	H	α-helix	trans	-61.9	-39.4	176.9	-67.1	-11.4	0	0	0	111.7	K15 Y90 F92 S96 E98 L99 Y106	K15-D102 WeakPolarHBondContact CD-OD1 3.43Å; Y90-D102 PolarHBondContact OH-O 3.25Å; F92-D102 HydrophobicContact CD1-CB 4.27Å; F92-D102 HydrophobicContact CE1-CB 4.19Å; S96-D102 WeakPolarHBondContact CB-OD2 3.39Å; S96-D102 PolarHBondContact OG-OD2 2.93Å; E98-D102 PolarHBondContact O-N 3.48Å; L99-D102 WeakPolarHBondContact O-CB 3.49Å; L99-D102 PolarHBondContact O-N 2.66Å; D102-Y106 WeakPolarHBondContact O-CB 3.48Å; D102-Y106 PolarHBondContact O-N 2.81Å
103	M	96.3	Very high	96.3	Very high	21 Å²	21	56.6 Å²	56.6	10%	0.103	26%	0.262	C	S	.	.	H	α-helix	trans	-67	-38.7	174.4	-69.1	-61.3	-177.7	0	0	111.7	F92 L99 E100 K101 Y106 Q107 L148 L151	F92-M103 HydrophobicContact CE1-CE 4.27Å; F92-M103 HydrophobicContact CE1-SD 3.84Å; F92-M103 HydrophobicContact CZ-SD 4.08Å; L99-M103 HydrophobicContact CD1-CE 3.97Å; L99-M103 HydrophobicContact CD2-CE 4.48Å; L99-M103 HydrophobicContact CG-CE 4.21Å; L99-M103 HydrophobicContact CG-CG 4.33Å; L99-M103 WeakPolarHBondContact O-CB 3.14Å; L99-M103 VanDerWaalsContact O-CG 3.25Å; L99-M103 WeakPolarHBondContact O-CG 3.34Å; L99-M103 PolarHBondContact O-N 3.42Å; E100-M103 PolarHBondContact O-N 3.08Å; K101-M103 VanDerWaalsContact C-N 3.29Å; K101-M103 PolarHBondContact O-N 3.14Å; M103-Y106 WeakPolarHBondContact O-CB 3.16Å; M103-Y106 PolarHBondContact O-N 3.47Å; M103-Q107 WeakPolarHBondContact O-CG 3.32Å; M103-Q107 PolarHBondContact O-N 3.47Å; M103-L148 HydrophobicContact CE-CD2 3.81Å; M103-L148 HydrophobicContact CE-CG 4.34Å; M103-L148 HydrophobicContact SD-CD2 3.74Å; M103-L151 HydrophobicContact CB-CD1 4.28Å; M103-L151 HydrophobicContact CG-CD1 4.17Å; M103-L151 HydrophobicContact SD-CD1 3.51Å; M103-L151 VanDerWaalsContact SD-CD1 3.51Å
104	H	95.7	Very high	96.2	Very high	112 Å²	112	59.1 Å²	59.1	52%	0.519	28%	0.275	S	S	.	.	H	α-helix	trans	-62.8	-47.8	175.8	-171.3	58.1	0	0	0	111.6	E100 K101 Y106 Q107 S108	E100-H104 PolarHBondContact O-N 3.49Å; K101-H104 WeakPolarHBondContact O-CB 3.25Å; K101-H104 PolarHBondContact O-N 3.46Å; H104-Y106 VanDerWaalsContact C-N 3.28Å; H104-Y106 PolarHBondContact O-N 2.96Å; H104-Q107 PolarHBondContact O-N 2.86Å; H104-S108 PolarHBondContact O-N 2.89Å; H104-S108 PolarHBondContact O-OG 3.47Å
105	Y	96.9	Very high	96.1	Very high	17 Å²	17	63.2 Å²	63.2	7%	0.067	29%	0.292	C	S	.	.	H	α-helix	trans	-61.9	-36.6	174.6	-73.2	-38.4	0	0	0	112.7	D67 M70 F74 Y90 K101 S108 C109	D67-Y105 PolarHBondContact OD1-OH 3.12Å; M70-Y105 HydrophobicContact CB-CD1 4.42Å; M70-Y105 HydrophobicContact CB-CE1 4.17Å; M70-Y105 HydrophobicContact CE-CD2 4.49Å; M70-Y105 HydrophobicContact CE-CG 4.09Å; F74-Y105 AromaticContact CE2-CD1 3.75Å; F74-Y105 HydrophobicContact CE2-CD1 3.75Å; F74-Y105 HydrophobicContact CE2-CE1 4.41Å; Y90-Y105 VanDerWaalsContact OH-CB 3.29Å; Y90-Y105 WeakPolarHBondContact OH-CB 3.41Å; K101-Y105 HydrophobicContact CD-CE2 4.18Å; K101-Y105 WeakPolarHBondContact CE-OH 3.39Å; K101-Y105 HydrophobicContact CG-CD2 4.29Å; K101-Y105 HydrophobicContact CG-CE2 3.92Å; K101-Y105 PolarHBondContact O-N 3.27Å; Y105-S108 PolarHBondContact O-N 2.98Å; Y105-C109 PolarHBondContact O-N 3.08Å; Y105-C109 PolarHBondContact O-SG 3.38Å
106	Y	98.2	Very high	96.1	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61.3	-46.6	173.8	177.2	-124.6	0	0	0	111.7	Y90 F92 D102 M103 H104 S108 C109 L110 I122 C124 L148 L151 S152	Y90-Y106 AromaticContact CD1-CD2 3.89Å; Y90-Y106 HydrophobicContact CD1-CD2 3.89Å; Y90-Y106 HydrophobicContact CD1-CG 4.38Å; Y90-Y106 AromaticContact CD2-CD2 3.63Å; Y90-Y106 HydrophobicContact CD2-CD2 3.63Å; Y90-Y106 HydrophobicContact CD2-CE2 4.44Å; Y90-Y106 HydrophobicContact CE1-CD2 4.31Å; Y90-Y106 HydrophobicContact CE1-CG 4.46Å; Y90-Y106 HydrophobicContact CE2-CD2 4.11Å; Y90-Y106 AromaticContact CG-CD2 3.48Å; Y90-Y106 HydrophobicContact CG-CD2 3.48Å; Y90-Y106 VanDerWaalsContact CG-CD2 3.48Å; Y90-Y106 HydrophobicContact CG-CE2 4.09Å; Y90-Y106 HydrophobicContact CG-CG 4.37Å; Y90-Y106 PolarHBondContact OH-N 3.46Å; F92-Y106 HydrophobicContact CE2-CD2 4.38Å; F92-Y106 HydrophobicContact CE2-CG 4.31Å; F92-Y106 AromaticContact CZ-CD1 3.96Å; F92-Y106 HydrophobicContact CZ-CD1 3.96Å; F92-Y106 HydrophobicContact CZ-CD2 4.15Å; F92-Y106 AromaticContact CZ-CG 3.68Å; F92-Y106 HydrophobicContact CZ-CG 3.68Å; D102-Y106 WeakPolarHBondContact O-CB 3.48Å; D102-Y106 PolarHBondContact O-N 2.81Å; M103-Y106 WeakPolarHBondContact O-CB 3.16Å; M103-Y106 PolarHBondContact O-N 3.47Å; H104-Y106 VanDerWaalsContact C-N 3.28Å; H104-Y106 PolarHBondContact O-N 2.96Å; Y106-S108 VanDerWaalsContact C-N 3.34Å; Y106-S108 PolarHBondContact O-N 3.3Å; Y106-C109 WeakPolarHBondContact O-CB 3.43Å; Y106-C109 PolarHBondContact O-N 3.24Å; Y106-C109 VanDerWaalsContact O-N 3.15Å; Y106-L110 HydrophobicContact CD1-CD1 3.96Å; Y106-L110 HydrophobicContact CD2-CD1 4.48Å; Y106-L110 HydrophobicContact CD2-CG 4.28Å; Y106-L110 HydrophobicContact CE1-CD1 3.49Å; Y106-L110 VanDerWaalsContact CE1-CD1 3.49Å; Y106-L110 HydrophobicContact CE1-CG 4.24Å; Y106-L110 HydrophobicContact CE2-CD1 4.07Å; Y106-L110 HydrophobicContact CE2-CD2 3.89Å; Y106-L110 HydrophobicContact CE2-CG 3.89Å; Y106-L110 HydrophobicContact CG-CD1 4.43Å; Y106-L110 WeakPolarHBondContact O-CG 3.48Å; Y106-L110 PolarHBondContact O-N 2.94Å; Y106-I122 HydrophobicContact CE2-CG2 4.42Å; Y106-I122 WeakPolarHBondContact OH-CG2 3.48Å; Y106-C124 PolarHBondContact OH-SG 3.32Å; Y106-L148 HydrophobicContact CD1-CD2 4.07Å; Y106-L148 HydrophobicContact CE1-CD2 3.97Å; Y106-L151 HydrophobicContact CE1-CB 4.46Å; Y106-S152 PolarHBondContact OH-OG 3.43Å
107	Q	97.2	Very high	96.2	Very high	85 Å²	85	58.8 Å²	58.8	40%	0.397	27%	0.271	S	S	.	.	H	α-helix	trans	-60.8	-41.7	175.6	-71	-179.8	-60.2	0	0	112.1	M103 H104 C109 L110 E111 L151	M103-Q107 WeakPolarHBondContact O-CG 3.32Å; M103-Q107 PolarHBondContact O-N 3.47Å; H104-Q107 PolarHBondContact O-N 2.86Å; Q107-C109 VanDerWaalsContact C-N 3.31Å; Q107-C109 PolarHBondContact O-N 2.91Å; Q107-L110 PolarHBondContact O-N 3.43Å; Q107-E111 PolarHBondContact O-N 2.71Å; Q107-L151 HydrophobicContact CG-CD2 4.47Å
108	S	96.9	Very high	96.3	Very high	22 Å²	22	50.5 Å²	50.5	15%	0.154	25%	0.249	C	C	.	.	H	α-helix	trans	-61.3	-38.6	174.4	-57.1	0	0	0	0	112.3	H104 Y105 Y106 A112	H104-S108 PolarHBondContact O-N 2.89Å; H104-S108 PolarHBondContact O-OG 3.47Å; Y105-S108 PolarHBondContact O-N 2.98Å; Y106-S108 VanDerWaalsContact C-N 3.34Å; Y106-S108 PolarHBondContact O-N 3.3Å; S108-A112 WeakPolarHBondContact O-CB 3.27Å; S108-A112 PolarHBondContact O-N 3.4Å; S108-A112 VanDerWaalsContact O-N 3.08Å
109	C	97.9	Very high	96.4	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-62.3	-46.1	171.9	-76.2	0	0	0	0	111.9	F74 F82 L88 Y90 Y105 Y106 Q107 E111 A112 I113	F74-C109 HydrophobicContact CE1-CB 4.33Å; F74-C109 VanDerWaalsContact CE1-SG 3.58Å; F74-C109 VanDerWaalsContact CZ-SG 3.54Å; F82-C109 HydrophobicContact CE1-CB 4.17Å; L88-C109 HydrophobicContact CD2-CB 4.23Å; Y90-C109 HydrophobicContact CD2-CB 4.36Å; Y90-C109 HydrophobicContact CE2-CB 4.36Å; Y105-C109 PolarHBondContact O-N 3.08Å; Y105-C109 PolarHBondContact O-SG 3.38Å; Y106-C109 WeakPolarHBondContact O-CB 3.43Å; Y106-C109 PolarHBondContact O-N 3.24Å; Y106-C109 VanDerWaalsContact O-N 3.15Å; Q107-C109 VanDerWaalsContact C-N 3.31Å; Q107-C109 PolarHBondContact O-N 2.91Å; C109-E111 VanDerWaalsContact C-N 3.35Å; C109-E111 PolarHBondContact O-N 2.94Å; C109-A112 PolarHBondContact O-N 3.25Å; C109-I113 WeakPolarHBondContact O-CG1 3.2Å; C109-I113 PolarHBondContact O-N 2.98Å
110	L	97.9	Very high	96.7	Very high	12 Å²	12	51.9 Å²	51.9	6%	0.063	26%	0.26	C	S	.	.	H	α-helix	trans	-62.8	-41.9	179.9	-68.5	173	0	0	0	112.1	L88 Y106 Q107 A112 I113 L114 I122 L151 L155	L88-L110 HydrophobicContact CD2-CD2 4.5Å; Y106-L110 HydrophobicContact CD1-CD1 3.96Å; Y106-L110 HydrophobicContact CD2-CD1 4.48Å; Y106-L110 HydrophobicContact CD2-CG 4.28Å; Y106-L110 HydrophobicContact CE1-CD1 3.49Å; Y106-L110 VanDerWaalsContact CE1-CD1 3.49Å; Y106-L110 HydrophobicContact CE1-CG 4.24Å; Y106-L110 HydrophobicContact CE2-CD1 4.07Å; Y106-L110 HydrophobicContact CE2-CD2 3.89Å; Y106-L110 HydrophobicContact CE2-CG 3.89Å; Y106-L110 HydrophobicContact CG-CD1 4.43Å; Y106-L110 WeakPolarHBondContact O-CG 3.48Å; Y106-L110 PolarHBondContact O-N 2.94Å; Q107-L110 PolarHBondContact O-N 3.43Å; L110-A112 VanDerWaalsContact C-N 3.33Å; L110-A112 PolarHBondContact O-N 3.36Å; L110-I113 PolarHBondContact O-N 2.88Å; L110-L114 WeakPolarHBondContact O-CB 3.15Å; L110-L114 PolarHBondContact O-N 3.2Å; L110-I122 HydrophobicContact CD2-CD1 4.34Å; L110-I122 HydrophobicContact CD2-CG1 4.27Å; L110-I122 HydrophobicContact CD2-CG2 3.93Å; L110-L151 WeakPolarHBondContact CD1-O 3.45Å; L110-L155 HydrophobicContact CD2-CD1 3.97Å
111	E	96.3	Very high	96.9	Very high	104 Å²	104	47.2 Å²	47.2	49%	0.486	24%	0.238	S	C	.	.	H	α-helix	trans	-62.2	-43.3	175.9	-167.3	-166.4	161.7	0	0	111.2	R78 Q107 C109 L114 Q115	R78-E111 IonicContact NH2-OE1 3.58Å; Q107-E111 PolarHBondContact O-N 2.71Å; C109-E111 VanDerWaalsContact C-N 3.35Å; C109-E111 PolarHBondContact O-N 2.94Å; E111-L114 PolarHBondContact O-N 3.48Å; E111-Q115 WeakPolarHBondContact O-CG 3.42Å; E111-Q115 PolarHBondContact O-N 2.88Å; E111-Q115 VanDerWaalsContact O-N 3.16Å; E111-Q115 PolarHBondContact OE1-NE2 3.4Å; E111-Q115 VanDerWaalsContact OE1-NE2 3.14Å
112	A	97.4	Very high	97	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.9	-39.7	177.4	0	0	0	0	0	112.1	R78 F82 S108 C109 L110 N116	R78-A112 HydrophobicContact CG-CB 4.16Å; R78-A112 VanDerWaalsContact NH2-CA 3.33Å; F82-A112 HydrophobicContact CB-CB 4.06Å; F82-A112 HydrophobicContact CD1-CB 3.61Å; F82-A112 HydrophobicContact CD2-CB 3.62Å; F82-A112 HydrophobicContact CE1-CB 3.88Å; F82-A112 HydrophobicContact CE2-CB 3.89Å; F82-A112 HydrophobicContact CG-CB 3.47Å; F82-A112 VanDerWaalsContact CG-CB 3.47Å; F82-A112 HydrophobicContact CZ-CB 4.02Å; S108-A112 WeakPolarHBondContact O-CB 3.27Å; S108-A112 PolarHBondContact O-N 3.4Å; S108-A112 VanDerWaalsContact O-N 3.08Å; C109-A112 PolarHBondContact O-N 3.25Å; L110-A112 VanDerWaalsContact C-N 3.33Å; L110-A112 PolarHBondContact O-N 3.36Å; A112-N116 WeakPolarHBondContact O-CB 3.46Å; A112-N116 PolarHBondContact O-N 3.03Å; A112-N116 VanDerWaalsContact O-N 3.1Å; A112-N116 PolarHBondContact O-ND2 3.29Å
113	I	98	Very high	97.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.9	-48.6	173.6	-72.3	-65.7	0	0	0	111.2	F82 V85 L88 C109 L110 Q115 N116 S117 A120 I122 L155	F82-I113 HydrophobicContact CD1-CD1 3.79Å; F82-I113 HydrophobicContact CD1-CG1 3.92Å; F82-I113 HydrophobicContact CE1-CG1 4.45Å; V85-I113 HydrophobicContact CB-CD1 3.77Å; V85-I113 HydrophobicContact CG1-CD1 3.76Å; V85-I113 HydrophobicContact CG2-CD1 3.95Å; L88-I113 HydrophobicContact CB-CD1 4.4Å; L88-I113 HydrophobicContact CB-CG1 4.44Å; L88-I113 HydrophobicContact CD2-CG1 3.98Å; C109-I113 WeakPolarHBondContact O-CG1 3.2Å; C109-I113 PolarHBondContact O-N 2.98Å; L110-I113 PolarHBondContact O-N 2.88Å; I113-Q115 PolarHBondContact O-N 2.9Å; I113-N116 PolarHBondContact O-N 3.13Å; I113-N116 VanDerWaalsContact O-N 3.12Å; I113-S117 WeakPolarHBondContact CG2-O 3.47Å; I113-S117 CarbonylContact O-C 3.59Å; I113-S117 WeakPolarHBondContact O-CA 3.19Å; I113-S117 PolarHBondContact O-N 3.49Å; I113-A120 HydrophobicContact CD1-CB 4.47Å; I113-A120 HydrophobicContact CG2-CB 3.74Å; I113-I122 HydrophobicContact CG2-CD1 3.98Å; I113-L155 HydrophobicContact CG2-CD1 4.26Å
114	L	96.3	Very high	97.3	Very high	80 Å²	80	43.6 Å²	43.6	42%	0.419	22%	0.221	S	C	.	.	H	α-helix	trans	-59.8	-33.5	-177.4	-174.3	64.4	0	0	0	111.9	L110 E111 P154 L155	L110-L114 WeakPolarHBondContact O-CB 3.15Å; L110-L114 PolarHBondContact O-N 3.2Å; E111-L114 PolarHBondContact O-N 3.48Å; L114-P154 HydrophobicContact CD1-CG 4.44Å; L114-P154 HydrophobicContact CD2-CG 4.25Å; L114-L155 HydrophobicContact CD1-CD2 4.06Å; L114-L155 HydrophobicContact CD1-CG 4.42Å
115	Q	95.3	Very high	97.4	Very high	110 Å²	110	38.2 Å²	38.2	51%	0.514	20%	0.196	S	C	.	.	H	α-helix	trans	-77.5	-36.2	177.1	-70.2	167	0.7	0	0	113.4	E111 I113	E111-Q115 WeakPolarHBondContact O-CG 3.42Å; E111-Q115 PolarHBondContact O-N 2.88Å; E111-Q115 VanDerWaalsContact O-N 3.16Å; E111-Q115 PolarHBondContact OE1-NE2 3.4Å; E111-Q115 VanDerWaalsContact OE1-NE2 3.14Å; I113-Q115 PolarHBondContact O-N 2.9Å
116	N	96.7	Very high	97.5	Very high	42 Å²	42	37.6 Å²	37.6	23%	0.225	19%	0.194	C	C	.	.	H	α-helix	trans	-111.9	-19	-167.2	-69.2	-80.2	0	0	0	115	F82 A112 I113	F82-N116 HydrophobicContact CB-CB 4.01Å; F82-N116 VanDerWaalsContact O-CB 3.25Å; F82-N116 WeakPolarHBondContact O-CB 3.34Å; A112-N116 WeakPolarHBondContact O-CB 3.46Å; A112-N116 PolarHBondContact O-N 3.03Å; A112-N116 VanDerWaalsContact O-N 3.1Å; A112-N116 PolarHBondContact O-ND2 3.29Å; I113-N116 PolarHBondContact O-N 3.13Å; I113-N116 VanDerWaalsContact O-N 3.12Å
117	S	97.7	Very high	97.5	Very high	10 Å²	10	37.8 Å²	37.8	7%	0.07	20%	0.195	C	C	.	.			trans	-157.1	64.6	-177.2	-66.2	0	0	0	0	110.4	F82 N84 V85 I113 D119 A120	F82-S117 PolarHBondContact O-OG 2.98Å; N84-S117 PolarHBondContact N-OG 2.82Å; V85-S117 PolarHBondContact N-OG 2.95Å; V85-S117 WeakPolarHBondContact O-CB 3.45Å; I113-S117 WeakPolarHBondContact CG2-O 3.47Å; I113-S117 CarbonylContact O-C 3.59Å; I113-S117 WeakPolarHBondContact O-CA 3.19Å; I113-S117 PolarHBondContact O-N 3.49Å; S117-D119 PolarHBondContact O-N 2.69Å; S117-D119 VanDerWaalsContact O-N 3.15Å; S117-A120 WeakPolarHBondContact O-CB 3.18Å; S117-A120 PolarHBondContact O-N 3.46Å
118	P	95.9	Very high	97.6	Very high	70 Å²	70	36.3 Å²	36.3	46%	0.455	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-25.2	-173.9	24.8	-35.3	0	0	0	114.1	A120	P118-A120 VanDerWaalsContact C-N 3.28Å; P118-A120 PolarHBondContact O-N 2.95Å
119	D	96.1	Very high	97.6	Very high	153 Å²	153	35.5 Å²	35.5	82%	0.818	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	1.9	177.8	-56.5	-49.6	0	0	0	113.4	S117	S117-D119 PolarHBondContact O-N 2.69Å; S117-D119 VanDerWaalsContact O-N 3.15Å
120	A	98.1	Very high	97.6	Very high	7 Å²	7	37.9 Å²	37.9	6%	0.058	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-65.1	137.3	179.9	0	0	0	0	0	111.2	V85 I113 S117 P118	V85-A120 HydrophobicContact CB-CB 4.43Å; V85-A120 HydrophobicContact CG1-CB 4.2Å; V85-A120 WeakPolarHBondContact O-CB 3.39Å; I113-A120 HydrophobicContact CD1-CB 4.47Å; I113-A120 HydrophobicContact CG2-CB 3.74Å; S117-A120 WeakPolarHBondContact O-CB 3.18Å; S117-A120 PolarHBondContact O-N 3.46Å; P118-A120 VanDerWaalsContact C-N 3.28Å; P118-A120 PolarHBondContact O-N 2.95Å
121	K	98.2	Very high	97.6	Very high	79 Å²	79	41.1 Å²	41.1	34%	0.343	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	131.2	177	-59.2	178.4	-177.4	-176.9	0	110	E86 V87 L88 F123 Q179	E86-K121 PolarHBondContact O-N 2.91Å; V87-K121 WeakPolarHBondContact CA-O 3.4Å; V87-K121 HydrophobicContact CG2-CB 4.19Å; L88-K121 PolarHBondContact N-O 2.83Å; K121-F123 HydrophobicContact CB-CD2 4.45Å; K121-F123 HydrophobicContact CB-CE2 3.92Å; K121-Q179 HydrophobicContact CD-CB 3.64Å; K121-Q179 HydrophobicContact CD-CG 4.13Å; K121-Q179 PolarHBondContact NZ-O 3.39Å
122	I	98.6	Very high	97.6	Very high	4 Å²	4	37 Å²	37	2%	0.021	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	126.3	-174.9	-45.6	-55.1	0	0	0	110.5	L88 Y106 L110 I113 L155 E156 C157 A158	L88-I122 HydrophobicContact CB-CD1 3.95Å; L88-I122 HydrophobicContact CD2-CD1 4.25Å; L88-I122 HydrophobicContact CD2-CG2 4.49Å; Y106-I122 HydrophobicContact CE2-CG2 4.42Å; Y106-I122 WeakPolarHBondContact OH-CG2 3.48Å; L110-I122 HydrophobicContact CD2-CD1 4.34Å; L110-I122 HydrophobicContact CD2-CG1 4.27Å; L110-I122 HydrophobicContact CD2-CG2 3.93Å; I113-I122 HydrophobicContact CG2-CD1 3.98Å; I122-L155 HydrophobicContact CD1-CD1 4.16Å; I122-L155 HydrophobicContact CG1-CB 4.01Å; I122-L155 HydrophobicContact CG1-CD1 4.09Å; I122-E156 WeakPolarHBondContact CB-O 2.89Å; I122-C157 HydrophobicContact CB-CB 4.29Å; I122-C157 HydrophobicContact CG2-CB 4.21Å; I122-C157 WeakPolarHBondContact O-CA 3.42Å; I122-A158 PolarHBondContact O-N 2.72Å
123	F	98.8	Very high	97.6	Very high	8 Å²	8	43 Å²	43	4%	0.035	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	126.7	175.9	-72.6	-96.6	0	0	0	110	V87 L88 I89 Y90 K121 A158 F160 I176 Q179	V87-F123 HydrophobicContact CG1-CD2 3.8Å; V87-F123 HydrophobicContact CG1-CE2 4.25Å; V87-F123 HydrophobicContact CG2-CE2 4.38Å; L88-F123 PolarHBondContact O-N 3.37Å; I89-F123 CarbonylContact C-O 3.57Å; I89-F123 WeakPolarHBondContact CA-O 3.4Å; I89-F123 HydrophobicContact CG1-CB 4.46Å; Y90-F123 PolarHBondContact N-O 3.1Å; K121-F123 HydrophobicContact CB-CD2 4.45Å; K121-F123 HydrophobicContact CB-CE2 3.92Å; F123-A158 CarbonylContact C-O 3.57Å; F123-A158 WeakPolarHBondContact CA-O 3.32Å; F123-A158 HydrophobicContact CD1-CB 3.93Å; F123-A158 HydrophobicContact CE1-CB 3.93Å; F123-F160 HydrophobicContact CD1-CD2 4.1Å; F123-F160 AromaticContact CD1-CE2 3.55Å; F123-F160 HydrophobicContact CD1-CE2 3.55Å; F123-F160 AromaticContact CE1-CE2 3.72Å; F123-F160 HydrophobicContact CE1-CE2 3.72Å; F123-F160 HydrophobicContact CE1-CZ 4.36Å; F123-I176 HydrophobicContact CB-CD1 4.32Å; F123-I176 HydrophobicContact CB-CG1 4.26Å; F123-I176 HydrophobicContact CD1-CD1 4.12Å; F123-I176 HydrophobicContact CD1-CG1 3.38Å; F123-I176 HydrophobicContact CD2-CG1 3.93Å; F123-I176 HydrophobicContact CE1-CB 4.42Å; F123-I176 HydrophobicContact CE1-CG1 3.52Å; F123-I176 HydrophobicContact CE2-CG1 4.03Å; F123-I176 HydrophobicContact CG-CD1 4.18Å; F123-I176 HydrophobicContact CG-CG1 3.59Å; F123-I176 HydrophobicContact CZ-CB 4.36Å; F123-I176 HydrophobicContact CZ-CG1 3.83Å; F123-Q179 HydrophobicContact CZ-CG 4.02Å
124	C	98.8	Very high	97.4	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	125.2	170.8	-73.3	0	0	0	0	110.5	Y90 F92 Y106 L148 C157 A158 C159 F160	Y90-C124 CarbonylContact O-C 3.58Å; Y90-C124 WeakPolarHBondContact O-CA 3.3Å; F92-C124 HydrophobicContact CD2-CB 4.48Å; F92-C124 HydrophobicContact CE2-CB 4.34Å; Y106-C124 PolarHBondContact OH-SG 3.32Å; C124-L148 HydrophobicContact CB-CD1 3.83Å; C124-C157 PolarHBondContact SG-SG 3.33Å; C124-A158 PolarHBondContact N-O 3.27Å; C124-C159 CarbonylContact O-C 3.51Å; C124-C159 VanDerWaalsContact O-CA 3.27Å; C124-C159 WeakPolarHBondContact O-CA 3.42Å; C124-F160 PolarHBondContact O-N 3.3Å
125	L	98.8	Very high	97.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	111	174.4	-52.8	-172.6	0	0	0	108.7	M23 I89 Y90 V91 F92 H127 F160 T162 A172	M23-L125 HydrophobicContact CE-CD1 3.97Å; M23-L125 HydrophobicContact SD-CD1 3.82Å; I89-L125 HydrophobicContact CG2-CD1 3.56Å; I89-L125 HydrophobicContact CG2-CG 3.71Å; Y90-L125 PolarHBondContact O-N 3.01Å; V91-L125 HydrophobicContact CG2-CB 4.45Å; V91-L125 HydrophobicContact CG2-CD1 4.42Å; F92-L125 PolarHBondContact N-O 2.89Å; L125-H127 PolarHBondContact O-N 3.48Å; L125-F160 CarbonylContact C-O 3.53Å; L125-F160 WeakPolarHBondContact CA-O 3.43Å; L125-F160 HydrophobicContact CD2-CB 3.75Å; L125-F160 HydrophobicContact CD2-CD2 4.12Å; L125-F160 HydrophobicContact CD2-CG 4.3Å; L125-T162 HydrophobicContact CB-CG2 4.37Å; L125-T162 HydrophobicContact CD1-CG2 4.35Å; L125-T162 HydrophobicContact CD2-CG2 4.08Å; L125-T162 HydrophobicContact CG-CG2 4.5Å; L125-A172 HydrophobicContact CD2-CB 3.78Å
126	V	98.6	Very high	97.5	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.018	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	102.1	165.3	-172.9	0	0	0	0	106.1	V94 M129 F141 R144 L148 F160 R161 T162	V94-V126 HydrophobicContact CB-CG1 4.24Å; V94-V126 HydrophobicContact CG2-CG1 4.23Å; V126-M129 HydrophobicContact CB-SD 4.43Å; V126-M129 HydrophobicContact CG1-CG 4.39Å; V126-M129 HydrophobicContact CG1-SD 3.64Å; V126-M129 VanDerWaalsContact O-CG 3.3Å; V126-M129 WeakPolarHBondContact O-CG 3.23Å; V126-F141 HydrophobicContact CB-CD2 4.09Å; V126-F141 HydrophobicContact CB-CE2 4.33Å; V126-F141 HydrophobicContact CG2-CD2 4Å; V126-F141 HydrophobicContact CG2-CE2 4.05Å; V126-R144 HydrophobicContact CG2-CB 4.13Å; V126-L148 HydrophobicContact CG2-CD1 4.27Å; V126-F160 PolarHBondContact N-O 2.77Å; V126-R161 WeakPolarHBondContact O-CA 3.42Å; V126-T162 PolarHBondContact O-N 2.88Å; V126-T162 PolarHBondContact O-OG1 2.5Å
127	H	98.7	Very high	97.5	Very high	4 Å²	4	52.2 Å²	52.2	2%	0.019	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	163.4	-167	-162.7	56.8	0	0	0	112.5	S18 M23 V91 F92 V94 L125 M129 T162	S18-H127 PolarHBondContact O-CD2 2.94Å; M23-H127 VanDerWaalsContact CG-CE1 3.49Å; M23-H127 WeakPolarHBondContact CG-CE1 3.25Å; M23-H127 PolarHBondContact SD-CE1 2.82Å; M23-H127 PolarHBondContact SD-ND1 2.89Å; M23-H127 VanDerWaalsContact SD-ND1 3.41Å; V91-H127 HydrophobicContact CG1-CB 3.73Å; F92-H127 WeakPolarHBondContact O-CA 3.4Å; F92-H127 WeakPolarHBondContact O-CB 3.34Å; F92-H127 PolarHBondContact O-N 3.06Å; V94-H127 WeakPolarHBondContact CB-O 3.49Å; V94-H127 WeakPolarHBondContact CG1-O 3.46Å; V94-H127 PolarHBondContact N-O 2.9Å; L125-H127 PolarHBondContact O-N 3.48Å; H127-M129 VanDerWaalsContact C-N 3.27Å; H127-M129 PolarHBondContact O-N 3.1Å; H127-T162 CarbonylContact C-O 3.52Å; H127-T162 WeakPolarHBondContact CA-O 3.33Å; H127-T162 WeakPolarHBondContact CA-OG1 3.34Å; H127-T162 PolarHBondContact ND1-O 2.9Å; H127-T162 PolarHBondContact ND1-OG1 2.83Å
128	K	98.4	Very high	97.5	Very high	54 Å²	54	55.9 Å²	55.9	24%	0.235	28%	0.281	C	S	.	.			trans	60.6	33.5	-174.9	-48.9	-172.6	-169.6	164.7	0	113.5	G17 D93 V94 D130 L131 T162	G17-K128 VanDerWaalsContact O-CE 3.28Å; G17-K128 WeakPolarHBondContact O-CE 3.49Å; G17-K128 PolarHBondContact O-NZ 3.03Å; D93-K128 IonicContact OD1-NZ 2.77Å; D93-K128 WeakPolarHBondContact OD2-CE 3.32Å; D93-K128 IonicContact OD2-NZ 2.63Å; D93-K128 PolarHBondContact OD2-NZ 3.12Å; V94-K128 HydrophobicContact CG1-CB 4.26Å; V94-K128 VanDerWaalsContact CG1-O 3.22Å; V94-K128 WeakPolarHBondContact CG1-O 3.24Å; K128-D130 VanDerWaalsContact C-OD1 3.27Å; K128-D130 VanDerWaalsContact CA-OD1 3.31Å; K128-D130 WeakPolarHBondContact CA-OD1 3.27Å; K128-D130 PolarHBondContact O-N 2.84Å; K128-L131 HydrophobicContact CB-CD1 3.8Å; K128-L131 HydrophobicContact CB-CG 4.19Å; K128-L131 HydrophobicContact CD-CD1 4.04Å; K128-L131 WeakPolarHBondContact O-CB 3.33Å; K128-L131 WeakPolarHBondContact O-CG 3.38Å; K128-L131 PolarHBondContact O-N 2.73Å; K128-T162 PolarHBondContact N-O 3.32Å
129	M	98	Very high	97.5	Very high	5 Å²	5	58.4 Å²	58.4	3%	0.025	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-62.6	-13.5	179.5	-71.1	-68.4	-58.7	0	0	113.4	V94 V126 H127 L131 V132 R137 F141 R161 T162	V94-M129 HydrophobicContact CB-SD 4.08Å; V94-M129 HydrophobicContact CG2-SD 3.7Å; V126-M129 HydrophobicContact CB-SD 4.43Å; V126-M129 HydrophobicContact CG1-CG 4.39Å; V126-M129 HydrophobicContact CG1-SD 3.64Å; V126-M129 VanDerWaalsContact O-CG 3.3Å; V126-M129 WeakPolarHBondContact O-CG 3.23Å; H127-M129 VanDerWaalsContact C-N 3.27Å; H127-M129 PolarHBondContact O-N 3.1Å; M129-L131 PolarHBondContact O-N 2.64Å; M129-V132 PolarHBondContact O-N 2.59Å; M129-V132 HydrophobicContact SD-CG2 4.49Å; M129-R137 HydrophobicContact CE-CB 3.85Å; M129-R137 HydrophobicContact CE-CG 4.01Å; M129-R137 WeakPolarHBondContact CE-O 3.34Å; M129-R137 PolarHBondContact O-NE 3.16Å; M129-F141 HydrophobicContact CE-CB 4.26Å; M129-R161 HydrophobicContact CG-CB 3.89Å; M129-T162 PolarHBondContact N-O 3.18Å
130	D	97.1	Very high	97.5	Very high	50 Å²	50	53.2 Å²	53.2	27%	0.267	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-60.1	-26.3	169.1	53.9	-71.6	0	0	0	113.5	K128 V132 R137 S163 W165	K128-D130 VanDerWaalsContact C-OD1 3.27Å; K128-D130 VanDerWaalsContact CA-OD1 3.31Å; K128-D130 WeakPolarHBondContact CA-OD1 3.27Å; K128-D130 PolarHBondContact O-N 2.84Å; D130-V132 VanDerWaalsContact C-N 3.29Å; D130-R137 PolarHBondContact O-NH2 3.39Å; D130-S163 WeakPolarHBondContact CB-OG 3.42Å; D130-S163 WeakPolarHBondContact OD1-CB 3.48Å; D130-S163 PolarHBondContact OD1-OG 3.35Å; D130-W165 VanDerWaalsContact CG-CD1 3.48Å; D130-W165 PolarHBondContact OD2-NE1 3.06Å
131	L	97.6	Very high	97.5	Very high	81 Å²	81	54.2 Å²	54.2	42%	0.424	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-77.8	-15.2	178.5	-55.8	178.9	0	0	0	112.9	E95 K128 M129	E95-L131 VanDerWaalsContact CD-CD1 3.44Å; E95-L131 HydrophobicContact CG-CB 4.14Å; E95-L131 HydrophobicContact CG-CD1 3.85Å; E95-L131 WeakPolarHBondContact OE2-CD1 3.37Å; K128-L131 HydrophobicContact CB-CD1 3.8Å; K128-L131 HydrophobicContact CB-CG 4.19Å; K128-L131 HydrophobicContact CD-CD1 4.04Å; K128-L131 WeakPolarHBondContact O-CB 3.33Å; K128-L131 WeakPolarHBondContact O-CG 3.38Å; K128-L131 PolarHBondContact O-N 2.73Å; M129-L131 PolarHBondContact O-N 2.64Å
132	V	97.4	Very high	97.5	Very high	17 Å²	17	56.4 Å²	56.4	10%	0.103	27%	0.274	C	S	.	.	S	Bend	trans	-90.3	137.4	175.2	178.5	0	0	0	0	109.8	V94 M129 D130 E134 Q136 R137 I140	V94-V132 HydrophobicContact CB-CG2 4.35Å; V94-V132 HydrophobicContact CG1-CG2 3.88Å; V94-V132 HydrophobicContact CG2-CG2 3.52Å; M129-V132 PolarHBondContact O-N 2.59Å; M129-V132 HydrophobicContact SD-CG2 4.49Å; D130-V132 VanDerWaalsContact C-N 3.29Å; V132-E134 PolarHBondContact O-N 3.04Å; V132-Q136 HydrophobicContact CG1-CB 4.03Å; V132-R137 HydrophobicContact CB-CG 3.98Å; V132-R137 HydrophobicContact CG1-CB 4.5Å; V132-R137 HydrophobicContact CG1-CG 3.81Å; V132-R137 PolarHBondContact O-NE 2.84Å; V132-R137 PolarHBondContact O-NH2 3.42Å; V132-I140 HydrophobicContact CG1-CD1 3.61Å; V132-I140 HydrophobicContact CG2-CD1 4.44Å
133	Q	96.4	Very high	97.4	Very high	126 Å²	126	61.1 Å²	61.1	59%	0.589	30%	0.296	S	S	*	.			trans	-57.5	135.9	173.9	-65.9	-176.7	82.1	0	0	110.8	D135 Q136 R137	Q133-D135 VanDerWaalsContact C-N 3.27Å; Q133-D135 WeakPolarHBondContact CB-OD1 3.38Å; Q133-D135 PolarHBondContact O-N 2.93Å; Q133-Q136 HydrophobicContact CB-CG 4.38Å; Q133-Q136 PolarHBondContact O-N 3.14Å; Q133-R137 WeakPolarHBondContact O-CG 3.36Å; Q133-R137 PolarHBondContact O-N 3.28Å
134	E	94.5	Very high	97.3	Very high	157 Å²	157	63.4 Å²	63.4	73%	0.734	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-56.9	-38.5	-167.2	-169.8	172.4	178.7	0	0	113.6	V132 Q136 R137	V132-E134 PolarHBondContact O-N 3.04Å; E134-Q136 VanDerWaalsContact C-N 3.28Å; E134-Q136 PolarHBondContact O-N 3.09Å; E134-R137 PolarHBondContact O-N 3.31Å
135	D	96.8	Very high	97.2	Very high	128 Å²	128	65.4 Å²	65.4	68%	0.684	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-69.1	-21.8	177.4	65.1	-37.2	0	0	0	113.8	Q133	Q133-D135 VanDerWaalsContact C-N 3.27Å; Q133-D135 WeakPolarHBondContact CB-OD1 3.38Å; Q133-D135 PolarHBondContact O-N 2.93Å
136	Q	96.6	Very high	97.2	Very high	84 Å²	84	71.5 Å²	71.5	39%	0.393	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-96.5	-14.4	179.1	-61.1	-173.3	-39.9	0	0	113.5	V132 Q133 E134 D138 L139 I140	V132-Q136 HydrophobicContact CG1-CB 4.03Å; Q133-Q136 HydrophobicContact CB-CG 4.38Å; Q133-Q136 PolarHBondContact O-N 3.14Å; E134-Q136 VanDerWaalsContact C-N 3.28Å; E134-Q136 PolarHBondContact O-N 3.09Å; Q136-D138 VanDerWaalsContact C-N 3.34Å; Q136-D138 PolarHBondContact O-N 2.96Å; Q136-L139 PolarHBondContact O-N 2.86Å; Q136-I140 HydrophobicContact CB-CD1 4.07Å; Q136-I140 PolarHBondContact O-N 3.43Å
137	R	97	Very high	97	Very high	57 Å²	57	73.2 Å²	73.2	22%	0.215	35%	0.351	C	S	.	.	H	α-helix	trans	-57.8	-43.9	-173.2	-71.8	179.4	-175.5	170.9	0.3	112.9	M129 D130 V132 Q133 E134 F141	M129-R137 HydrophobicContact CE-CB 3.85Å; M129-R137 HydrophobicContact CE-CG 4.01Å; M129-R137 WeakPolarHBondContact CE-O 3.34Å; M129-R137 PolarHBondContact O-NE 3.16Å; D130-R137 PolarHBondContact O-NH2 3.39Å; V132-R137 HydrophobicContact CB-CG 3.98Å; V132-R137 HydrophobicContact CG1-CB 4.5Å; V132-R137 HydrophobicContact CG1-CG 3.81Å; V132-R137 PolarHBondContact O-NE 2.84Å; V132-R137 PolarHBondContact O-NH2 3.42Å; Q133-R137 WeakPolarHBondContact O-CG 3.36Å; Q133-R137 PolarHBondContact O-N 3.28Å; E134-R137 PolarHBondContact O-N 3.31Å; R137-F141 WeakPolarHBondContact O-CB 3.34Å; R137-F141 PolarHBondContact O-N 3.05Å
138	D	96.6	Very high	97	Very high	87 Å²	87	73 Å²	73	47%	0.465	35%	0.351	S	S	.	.	H	α-helix	trans	-68.5	-38.9	-177.8	-77.8	-8.1	0	0	0	112.1	Q136 K142 R161	Q136-D138 VanDerWaalsContact C-N 3.34Å; Q136-D138 PolarHBondContact O-N 2.96Å; D138-K142 WeakPolarHBondContact O-CB 3.24Å; D138-K142 VanDerWaalsContact O-CG 3.25Å; D138-K142 WeakPolarHBondContact O-CG 3.43Å; D138-K142 PolarHBondContact O-N 3.17Å; D138-K142 VanDerWaalsContact O-N 3.08Å; D138-R161 IonicContact OD1-CZ 2.87Å; D138-R161 IonicContact OD1-NH1 2.98Å; D138-R161 PolarHBondContact OD1-NH1 3.07Å
139	L	97.5	Very high	96.9	Very high	122 Å²	122	75.7 Å²	75.7	64%	0.639	36%	0.359	S	S	*	.	H	α-helix	trans	-65.2	-53.9	178.6	178	63.4	0	0	0	110.7	Q136 F141 K142 E143	Q136-L139 PolarHBondContact O-N 2.86Å; L139-F141 VanDerWaalsContact C-N 3.31Å; L139-F141 PolarHBondContact O-N 2.91Å; L139-K142 PolarHBondContact O-N 2.83Å; L139-E143 PolarHBondContact O-N 3.46Å; L139-E143 VanDerWaalsContact O-N 3.12Å
140	I	96.4	Very high	96.8	Very high	45 Å²	45	82.6 Å²	82.6	23%	0.231	39%	0.385	C	S	.	.	H	α-helix	trans	-62.2	-41.5	-178.5	-69.1	168.4	0	0	0	110.6	V94 V132 Q136 R144	V94-I140 HydrophobicContact CG2-CG2 4.14Å; V132-I140 HydrophobicContact CG1-CD1 3.61Å; V132-I140 HydrophobicContact CG2-CD1 4.44Å; Q136-I140 HydrophobicContact CB-CD1 4.07Å; Q136-I140 PolarHBondContact O-N 3.43Å; I140-R144 VanDerWaalsContact O-CG 3.27Å; I140-R144 WeakPolarHBondContact O-CG 3.29Å; I140-R144 PolarHBondContact O-N 3.03Å; I140-R144 VanDerWaalsContact O-N 3.11Å
141	F	98.2	Very high	96.7	Very high	28 Å²	28	82.3 Å²	82.3	12%	0.123	38%	0.383	C	S	.	.	H	α-helix	trans	-63.9	-43	178.3	177.7	-103.7	0	0	0	112.4	V126 M129 R137 L139 R144 E145 C159 F160 R161	V126-F141 HydrophobicContact CB-CD2 4.09Å; V126-F141 HydrophobicContact CB-CE2 4.33Å; V126-F141 HydrophobicContact CG2-CD2 4Å; V126-F141 HydrophobicContact CG2-CE2 4.05Å; M129-F141 HydrophobicContact CE-CB 4.26Å; R137-F141 WeakPolarHBondContact O-CB 3.34Å; R137-F141 PolarHBondContact O-N 3.05Å; L139-F141 VanDerWaalsContact C-N 3.31Å; L139-F141 PolarHBondContact O-N 2.91Å; F141-R144 PolarHBondContact O-N 2.93Å; F141-E145 HydrophobicContact CE1-CB 4.43Å; F141-E145 HydrophobicContact CZ-CB 4.46Å; F141-E145 WeakPolarHBondContact O-CB 3.31Å; F141-E145 PolarHBondContact O-N 3.01Å; F141-C159 HydrophobicContact CE2-CB 4.13Å; F141-C159 HydrophobicContact CZ-CB 3.82Å; F141-F160 VanDerWaalsContact CE2-C 3.41Å; F141-R161 HydrophobicContact CD2-CB 3.91Å; F141-R161 HydrophobicContact CE2-CB 4.18Å; F141-R161 VanDerWaalsContact CE2-N 3.27Å; F141-R161 HydrophobicContact CG-CB 4.35Å
142	K	98	Very high	96.7	Very high	125 Å²	125	78.5 Å²	78.5	54%	0.543	36%	0.364	S	S	.	.	H	α-helix	trans	-63	-45	179	-77.9	174.8	-180	178	0	112.2	D138 L139 R144 E145 E146	D138-K142 WeakPolarHBondContact O-CB 3.24Å; D138-K142 VanDerWaalsContact O-CG 3.25Å; D138-K142 WeakPolarHBondContact O-CG 3.43Å; D138-K142 PolarHBondContact O-N 3.17Å; D138-K142 VanDerWaalsContact O-N 3.08Å; L139-K142 PolarHBondContact O-N 2.83Å; K142-R144 VanDerWaalsContact C-N 3.33Å; K142-R144 PolarHBondContact O-N 3.23Å; K142-E145 PolarHBondContact O-N 2.97Å; K142-E146 WeakPolarHBondContact O-CG 3.47Å; K142-E146 PolarHBondContact O-N 3.45Å
143	E	96.4	Very high	96.6	Very high	102 Å²	102	86.8 Å²	86.8	48%	0.477	39%	0.393	S	S	.	.	H	α-helix	trans	-57	-48.3	175.7	-175.1	-172.7	152.6	0	0	111	L139 E145 E146 D147	L139-E143 PolarHBondContact O-N 3.46Å; L139-E143 VanDerWaalsContact O-N 3.12Å; E143-E145 PolarHBondContact O-N 3.47Å; E143-E146 PolarHBondContact O-N 2.85Å; E143-D147 PolarHBondContact O-N 2.89Å
144	R	95.6	Very high	96.5	Very high	57 Å²	57	85.9 Å²	85.9	22%	0.215	40%	0.398	C	S	.	.	H	α-helix	trans	-63.7	-42.2	177.1	-67	-66.5	-177.9	-122.9	-1.6	112.5	V126 I140 F141 K142 E146 D147 L148	V126-R144 HydrophobicContact CG2-CB 4.13Å; I140-R144 VanDerWaalsContact O-CG 3.27Å; I140-R144 WeakPolarHBondContact O-CG 3.29Å; I140-R144 PolarHBondContact O-N 3.03Å; I140-R144 VanDerWaalsContact O-N 3.11Å; F141-R144 PolarHBondContact O-N 2.93Å; K142-R144 VanDerWaalsContact C-N 3.33Å; K142-R144 PolarHBondContact O-N 3.23Å; R144-E146 VanDerWaalsContact C-N 3.33Å; R144-E146 PolarHBondContact O-N 3.48Å; R144-D147 PolarHBondContact O-N 3.08Å; R144-L148 WeakPolarHBondContact O-CB 3.44Å; R144-L148 WeakPolarHBondContact O-CD1 3.44Å; R144-L148 WeakPolarHBondContact O-CG 3.21Å; R144-L148 PolarHBondContact O-N 3.45Å
145	E	97.9	Very high	96.5	Very high	42 Å²	42	79.5 Å²	79.5	20%	0.196	37%	0.369	C	S	.	.	H	α-helix	trans	-61.4	-42	178.6	178.9	179.4	-116.4	0	0	111.6	F141 K142 E143 L148 R149 C159	F141-E145 HydrophobicContact CE1-CB 4.43Å; F141-E145 HydrophobicContact CZ-CB 4.46Å; F141-E145 WeakPolarHBondContact O-CB 3.31Å; F141-E145 PolarHBondContact O-N 3.01Å; K142-E145 PolarHBondContact O-N 2.97Å; E143-E145 PolarHBondContact O-N 3.47Å; E145-L148 PolarHBondContact O-N 2.92Å; E145-R149 WeakPolarHBondContact O-CB 3.37Å; E145-R149 PolarHBondContact O-N 3.18Å; E145-R149 IonicContact OE1-NH2 3.97Å; E145-R149 PolarHBondContact OE1-NH2 3.06Å; E145-R149 VanDerWaalsContact OE1-NH2 3.14Å; E145-R149 IonicContact OE2-CZ 3.41Å; E145-R149 IonicContact OE2-NH1 2.88Å; E145-R149 IonicContact OE2-NH2 2.67Å; E145-R149 PolarHBondContact OE2-NH2 3.26Å; E145-C159 HydrophobicContact CB-CB 4.19Å; E145-C159 HydrophobicContact CG-CB 3.81Å
146	E	96.9	Very high	96.4	Very high	127 Å²	127	82.1 Å²	82.1	59%	0.593	38%	0.377	S	S	*	.	H	α-helix	trans	-62.8	-47.3	178.2	-74.2	177	-171.3	0	0	111.8	K142 E143 R144 R149 R150	K142-E146 WeakPolarHBondContact O-CG 3.47Å; K142-E146 PolarHBondContact O-N 3.45Å; E143-E146 PolarHBondContact O-N 2.85Å; R144-E146 VanDerWaalsContact C-N 3.33Å; R144-E146 PolarHBondContact O-N 3.48Å; E146-R149 PolarHBondContact O-N 3.15Å; E146-R150 WeakPolarHBondContact O-CB 3.5Å; E146-R150 PolarHBondContact O-N 2.92Å
147	D	95.8	Very high	96.4	Very high	39 Å²	39	78.9 Å²	78.9	21%	0.209	36%	0.363	C	S	.	.	H	α-helix	trans	-60.6	-47.9	176.2	-81.4	-29.3	0	0	0	111.7	E143 R144 R150 L151	E143-D147 PolarHBondContact O-N 2.89Å; R144-D147 PolarHBondContact O-N 3.08Å; D147-R150 WeakPolarHBondContact O-CB 3.49Å; D147-R150 PolarHBondContact O-N 2.85Å; D147-R150 IonicContact OD1-CZ 3.14Å; D147-R150 IonicContact OD1-NH1 2.93Å; D147-R150 IonicContact OD1-NH2 3.7Å; D147-R150 PolarHBondContact OD1-NH2 3.26Å; D147-L151 WeakPolarHBondContact O-CB 3.31Å; D147-L151 VanDerWaalsContact O-CG 3.29Å; D147-L151 WeakPolarHBondContact O-CG 3.33Å; D147-L151 PolarHBondContact O-N 3.29Å
148	L	97.3	Very high	96.5	Very high	1 Å²	1	78 Å²	78	1%	0.005	37%	0.368	C	S	.	.	H	α-helix	trans	-64.6	-43.4	-179.3	-69.3	171.3	0	0	0	111.5	F92 M103 Y106 C124 V126 R144 E145 R150 L151 S152	F92-L148 HydrophobicContact CD2-CD1 4.1Å; F92-L148 HydrophobicContact CD2-CD2 4.11Å; F92-L148 HydrophobicContact CE1-CD2 4.13Å; F92-L148 HydrophobicContact CE2-CD1 4.05Å; F92-L148 HydrophobicContact CE2-CD2 3.33Å; F92-L148 HydrophobicContact CE2-CG 4.35Å; F92-L148 HydrophobicContact CZ-CD2 3.35Å; M103-L148 HydrophobicContact CE-CD2 3.81Å; M103-L148 HydrophobicContact CE-CG 4.34Å; M103-L148 HydrophobicContact SD-CD2 3.74Å; Y106-L148 HydrophobicContact CD1-CD2 4.07Å; Y106-L148 HydrophobicContact CE1-CD2 3.97Å; C124-L148 HydrophobicContact CB-CD1 3.83Å; V126-L148 HydrophobicContact CG2-CD1 4.27Å; R144-L148 WeakPolarHBondContact O-CB 3.44Å; R144-L148 WeakPolarHBondContact O-CD1 3.44Å; R144-L148 WeakPolarHBondContact O-CG 3.21Å; R144-L148 PolarHBondContact O-N 3.45Å; E145-L148 PolarHBondContact O-N 2.92Å; L148-R150 VanDerWaalsContact C-N 3.29Å; L148-R150 PolarHBondContact O-N 2.9Å; L148-L151 PolarHBondContact O-N 2.87Å; L148-S152 VanDerWaalsContact O-CB 3.31Å; L148-S152 WeakPolarHBondContact O-CB 3.34Å; L148-S152 PolarHBondContact O-N 2.97Å; L148-S152 PolarHBondContact O-OG 3.15Å
149	R	97	Very high	96.6	Very high	109 Å²	109	74.4 Å²	74.4	41%	0.411	35%	0.35	S	S	.	.	H	α-helix	trans	-62.7	-37	176.3	-170.9	-178.2	-68.3	130.7	-2.1	111.6	E145 E146	E145-R149 WeakPolarHBondContact O-CB 3.37Å; E145-R149 PolarHBondContact O-N 3.18Å; E145-R149 IonicContact OE1-NH2 3.97Å; E145-R149 PolarHBondContact OE1-NH2 3.06Å; E145-R149 VanDerWaalsContact OE1-NH2 3.14Å; E145-R149 IonicContact OE2-CZ 3.41Å; E145-R149 IonicContact OE2-NH1 2.88Å; E145-R149 IonicContact OE2-NH2 2.67Å; E145-R149 PolarHBondContact OE2-NH2 3.26Å; E146-R149 PolarHBondContact O-N 3.15Å
150	R	96.1	Very high	96.6	Very high	151 Å²	151	70.1 Å²	70.1	57%	0.57	33%	0.326	S	S	*	.	H	α-helix	trans	-65.7	-49.2	174.5	-177.9	-176.5	64.8	-155.3	-12.2	111.3	E146 D147 L148 S152 R153	E146-R150 WeakPolarHBondContact O-CB 3.5Å; E146-R150 PolarHBondContact O-N 2.92Å; D147-R150 WeakPolarHBondContact O-CB 3.49Å; D147-R150 PolarHBondContact O-N 2.85Å; D147-R150 IonicContact OD1-CZ 3.14Å; D147-R150 IonicContact OD1-NH1 2.93Å; D147-R150 IonicContact OD1-NH2 3.7Å; D147-R150 PolarHBondContact OD1-NH2 3.26Å; L148-R150 VanDerWaalsContact C-N 3.29Å; L148-R150 PolarHBondContact O-N 2.9Å; R150-S152 VanDerWaalsContact C-N 3.25Å; R150-S152 PolarHBondContact O-N 2.99Å; R150-R153 PolarHBondContact O-N 2.95Å
151	L	95.3	Very high	96.7	Very high	43 Å²	43	71.7 Å²	71.7	23%	0.225	33%	0.329	C	S	.	.	H	α-helix	trans	-68	-24.3	-178.6	-68.4	172.3	0	0	0	113.1	M103 Y106 Q107 L110 D147 L148 R153	M103-L151 HydrophobicContact CB-CD1 4.28Å; M103-L151 HydrophobicContact CG-CD1 4.17Å; M103-L151 HydrophobicContact SD-CD1 3.51Å; M103-L151 VanDerWaalsContact SD-CD1 3.51Å; Y106-L151 HydrophobicContact CE1-CB 4.46Å; Q107-L151 HydrophobicContact CG-CD2 4.47Å; L110-L151 WeakPolarHBondContact CD1-O 3.45Å; D147-L151 WeakPolarHBondContact O-CB 3.31Å; D147-L151 VanDerWaalsContact O-CG 3.29Å; D147-L151 WeakPolarHBondContact O-CG 3.33Å; D147-L151 PolarHBondContact O-N 3.29Å; L148-L151 PolarHBondContact O-N 2.87Å; L151-R153 VanDerWaalsContact C-N 3.31Å; L151-R153 PolarHBondContact O-N 2.92Å
152	S	96.8	Very high	96.7	Very high	2 Å²	2	70.3 Å²	70.3	1%	0.014	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-18.2	-179.4	-57.1	0	0	0	0	114.1	Y106 L148 R150 L155 C157	Y106-S152 PolarHBondContact OH-OG 3.43Å; L148-S152 VanDerWaalsContact O-CB 3.31Å; L148-S152 WeakPolarHBondContact O-CB 3.34Å; L148-S152 PolarHBondContact O-N 2.97Å; L148-S152 PolarHBondContact O-OG 3.15Å; R150-S152 VanDerWaalsContact C-N 3.25Å; R150-S152 PolarHBondContact O-N 2.99Å; S152-L155 CarbonylContact C-O 3.58Å; S152-L155 WeakPolarHBondContact O-CA 3.45Å; S152-L155 VanDerWaalsContact O-CB 3.29Å; S152-L155 WeakPolarHBondContact O-CB 3.47Å; S152-L155 PolarHBondContact O-N 3.49Å; S152-L155 VanDerWaalsContact O-O 3.09Å; S152-C157 VanDerWaalsContact OG-CB 3.24Å; S152-C157 WeakPolarHBondContact OG-CB 3.47Å
153	R	95.4	Very high	96.7	Very high	191 Å²	191	64.4 Å²	64.4	72%	0.721	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	137.8	-177.4	-66.6	-178.8	-179.6	-176.5	0.1	111	R150 L151	R150-R153 PolarHBondContact O-N 2.95Å; L151-R153 VanDerWaalsContact C-N 3.31Å; L151-R153 PolarHBondContact O-N 2.92Å
154	P	95	Very high	96.8	Very high	106 Å²	106	60.8 Å²	60.8	69%	0.688	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	cis	-84.8	-0.7	10.5	35.2	-37.3	0	0	0	115.3	L114	L114-P154 HydrophobicContact CD1-CG 4.44Å; L114-P154 HydrophobicContact CD2-CG 4.25Å
155	L	94.7	Very high	96.8	Very high	24 Å²	24	64.3 Å²	64.3	13%	0.126	29%	0.294	C	S	.	.	S	Bend	trans	-75.8	145.6	179.9	-59.2	165.7	0	0	0	111	L110 I113 L114 I122 S152	L110-L155 HydrophobicContact CD2-CD1 3.97Å; I113-L155 HydrophobicContact CG2-CD1 4.26Å; L114-L155 HydrophobicContact CD1-CD2 4.06Å; L114-L155 HydrophobicContact CD1-CG 4.42Å; I122-L155 HydrophobicContact CD1-CD1 4.16Å; I122-L155 HydrophobicContact CG1-CB 4.01Å; I122-L155 HydrophobicContact CG1-CD1 4.09Å; S152-L155 CarbonylContact C-O 3.58Å; S152-L155 WeakPolarHBondContact O-CA 3.45Å; S152-L155 VanDerWaalsContact O-CB 3.29Å; S152-L155 WeakPolarHBondContact O-CB 3.47Å; S152-L155 PolarHBondContact O-N 3.49Å; S152-L155 VanDerWaalsContact O-O 3.09Å
156	E	95	Very high	96.7	Very high	182 Å²	182	64 Å²	64	85%	0.85	29%	0.294	S	S	*	.			trans	-79.8	135.6	169.8	-66.7	-172.5	171	0	0	110.3	I122	I122-E156 WeakPolarHBondContact CB-O 2.89Å
157	C	96.3	Very high	96.6	Very high	17 Å²	17	59.8 Å²	59.8	12%	0.115	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	129.6	-179.8	175.6	0	0	0	0	111.3	I122 C124 S152	I122-C157 HydrophobicContact CB-CB 4.29Å; I122-C157 HydrophobicContact CG2-CB 4.21Å; I122-C157 WeakPolarHBondContact O-CA 3.42Å; C124-C157 PolarHBondContact SG-SG 3.33Å; S152-C157 VanDerWaalsContact OG-CB 3.24Å; S152-C157 WeakPolarHBondContact OG-CB 3.47Å
158	A	98.2	Very high	96.7	Very high	38 Å²	38	58.5 Å²	58.5	31%	0.314	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	128.3	170.2	0	0	0	0	0	110.3	I122 F123 C124 F160	I122-A158 PolarHBondContact O-N 2.72Å; F123-A158 CarbonylContact C-O 3.57Å; F123-A158 WeakPolarHBondContact CA-O 3.32Å; F123-A158 HydrophobicContact CD1-CB 3.93Å; F123-A158 HydrophobicContact CE1-CB 3.93Å; C124-A158 PolarHBondContact N-O 3.27Å; A158-F160 HydrophobicContact CB-CE2 3.94Å
159	C	98.5	Very high	96.7	Very high	12 Å²	12	58.6 Å²	58.6	8%	0.081	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	143.2	-179.8	-62.8	0	0	0	0	111.5	C124 F141 E145	C124-C159 CarbonylContact O-C 3.51Å; C124-C159 VanDerWaalsContact O-CA 3.27Å; C124-C159 WeakPolarHBondContact O-CA 3.42Å; F141-C159 HydrophobicContact CE2-CB 4.13Å; F141-C159 HydrophobicContact CZ-CB 3.82Å; E145-C159 HydrophobicContact CB-CB 4.19Å; E145-C159 HydrophobicContact CG-CB 3.81Å
160	F	98.6	Very high	96.8	Very high	31 Å²	31	53.6 Å²	53.6	14%	0.136	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	136.1	174.3	-64.2	-94.9	0	0	0	110.9	F123 C124 L125 V126 F141 A158 T162 K171 A172 S175	F123-F160 HydrophobicContact CD1-CD2 4.1Å; F123-F160 AromaticContact CD1-CE2 3.55Å; F123-F160 HydrophobicContact CD1-CE2 3.55Å; F123-F160 AromaticContact CE1-CE2 3.72Å; F123-F160 HydrophobicContact CE1-CE2 3.72Å; F123-F160 HydrophobicContact CE1-CZ 4.36Å; C124-F160 PolarHBondContact O-N 3.3Å; L125-F160 CarbonylContact C-O 3.53Å; L125-F160 WeakPolarHBondContact CA-O 3.43Å; L125-F160 HydrophobicContact CD2-CB 3.75Å; L125-F160 HydrophobicContact CD2-CD2 4.12Å; L125-F160 HydrophobicContact CD2-CG 4.3Å; V126-F160 PolarHBondContact N-O 2.77Å; F141-F160 VanDerWaalsContact CE2-C 3.41Å; A158-F160 HydrophobicContact CB-CE2 3.94Å; F160-T162 HydrophobicContact CB-CG2 4.16Å; F160-K171 HydrophobicContact CE1-CG 4.47Å; F160-A172 HydrophobicContact CB-CB 3.8Å; F160-A172 HydrophobicContact CD1-CB 4.04Å; F160-A172 HydrophobicContact CD2-CB 4.32Å; F160-A172 HydrophobicContact CG-CB 3.78Å; F160-S175 VanDerWaalsContact CZ-CB 3.48Å; F160-S175 WeakPolarHBondContact CZ-OG 3.29Å
161	R	97.8	Very high	96.8	Very high	78 Å²	78	49.4 Å²	49.4	29%	0.294	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	133.9	159.8	59.7	-177.6	-174.5	-170.4	-1.9	108.8	V126 M129 D138 F141 T168	V126-R161 WeakPolarHBondContact O-CA 3.42Å; M129-R161 HydrophobicContact CG-CB 3.89Å; D138-R161 IonicContact OD1-CZ 2.87Å; D138-R161 IonicContact OD1-NH1 2.98Å; D138-R161 PolarHBondContact OD1-NH1 3.07Å; F141-R161 HydrophobicContact CD2-CB 3.91Å; F141-R161 HydrophobicContact CE2-CB 4.18Å; F141-R161 VanDerWaalsContact CE2-N 3.27Å; F141-R161 HydrophobicContact CG-CB 4.35Å; R161-T168 WeakPolarHBondContact O-CB 3.33Å; R161-T168 PolarHBondContact O-OG1 2.92Å
162	T	98.5	Very high	96.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	145.2	-179.1	54.3	0	0	0	0	112.1	L125 V126 H127 K128 M129 F160 T168 A172	L125-T162 HydrophobicContact CB-CG2 4.37Å; L125-T162 HydrophobicContact CD1-CG2 4.35Å; L125-T162 HydrophobicContact CD2-CG2 4.08Å; L125-T162 HydrophobicContact CG-CG2 4.5Å; V126-T162 PolarHBondContact O-N 2.88Å; V126-T162 PolarHBondContact O-OG1 2.5Å; H127-T162 CarbonylContact C-O 3.52Å; H127-T162 WeakPolarHBondContact CA-O 3.33Å; H127-T162 WeakPolarHBondContact CA-OG1 3.34Å; H127-T162 PolarHBondContact ND1-O 2.9Å; H127-T162 PolarHBondContact ND1-OG1 2.83Å; K128-T162 PolarHBondContact N-O 3.32Å; M129-T162 PolarHBondContact N-O 3.18Å; F160-T162 HydrophobicContact CB-CG2 4.16Å; T162-T168 VanDerWaalsContact CA-OG1 3.24Å; T162-T168 WeakPolarHBondContact CA-OG1 3.32Å; T162-A172 HydrophobicContact CG2-CB 3.62Å
163	S	98.4	Very high	97	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.224	C	C	.	.			trans	-138.9	147.3	163.9	-178.2	0	0	0	0	109.7	D130 W165 T168 L169	D130-S163 WeakPolarHBondContact CB-OG 3.42Å; D130-S163 WeakPolarHBondContact OD1-CB 3.48Å; D130-S163 PolarHBondContact OD1-OG 3.35Å; S163-W165 PolarHBondContact O-N 3.47Å; S163-W165 PolarHBondContact OG-N 3.01Å; S163-W165 VanDerWaalsContact OG-N 3.14Å; S163-T168 PolarHBondContact N-OG1 3.26Å; S163-L169 WeakPolarHBondContact O-CB 3.47Å
164	I	97.5	Very high	97.1	Very high	27 Å²	27	38.6 Å²	38.6	14%	0.138	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-9.7	170.7	61.4	167.3	0	0	0	113	M23 I26 A33 L169	M23-I164 HydrophobicContact CG-CG2 4.09Å; I26-I164 HydrophobicContact CD1-CB 3.43Å; I26-I164 VanDerWaalsContact CD1-CB 3.43Å; I26-I164 HydrophobicContact CD1-CD1 4.38Å; I26-I164 HydrophobicContact CD1-CG1 4.46Å; I26-I164 HydrophobicContact CD1-CG2 3.56Å; A33-I164 HydrophobicContact CB-CD1 4.21Å; A33-I164 HydrophobicContact CB-CG1 4.33Å; A33-I164 WeakPolarHBondContact CB-O 3.43Å; I164-L169 HydrophobicContact CG2-CD2 4.34Å
165	W	96.2	Very high	97.2	Very high	130 Å²	130	35.4 Å²	35.4	49%	0.492	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-12.4	-175.4	-60.5	105.7	0	0	0	113.7	A33 D130 S163	A33-W165 HydrophobicContact CB-CD2 4Å; A33-W165 HydrophobicContact CB-CE3 3.55Å; A33-W165 HydrophobicContact CB-CH2 4.01Å; A33-W165 HydrophobicContact CB-CZ2 4.43Å; A33-W165 HydrophobicContact CB-CZ3 3.56Å; D130-W165 VanDerWaalsContact CG-CD1 3.48Å; D130-W165 PolarHBondContact OD2-NE1 3.06Å; S163-W165 PolarHBondContact O-N 3.47Å; S163-W165 PolarHBondContact OG-N 3.01Å; S163-W165 VanDerWaalsContact OG-N 3.14Å
166	D	95.2	Very high	97.3	Very high	36 Å²	36	34.3 Å²	34.3	19%	0.193	17%	0.167	C	C	.	.	S	Bend	trans	-135.4	178.7	-176.1	67.6	32.4	0	0	0	112.5	T168	D166-T168 PolarHBondContact O-N 2.94Å; D166-T168 VanDerWaalsContact OD1-CB 3.23Å; D166-T168 WeakPolarHBondContact OD1-CB 2.85Å; D166-T168 WeakPolarHBondContact OD1-CG2 3.49Å; D166-T168 PolarHBondContact OD1-N 3.34Å; D166-T168 PolarHBondContact OD1-OG1 3.28Å
167	E	95.4	Very high	97.3	Very high	39 Å²	39	25.7 Å²	25.7	18%	0.182	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-11.6	-177.3	67.6	-87.2	-165.1	0	0	114.6	L169 Y170 K171 H226 E229 K230	E167-L169 PolarHBondContact O-N 3.46Å; E167-Y170 WeakPolarHBondContact O-CB 3.39Å; E167-Y170 PolarHBondContact O-N 3.46Å; E167-K171 PolarHBondContact O-N 3.26Å; E167-K171 VanDerWaalsContact O-N 3.15Å; E167-H226 HydrophobicContact CG-CB 4Å; E167-E229 HydrophobicContact CB-CB 3.86Å; E167-E229 HydrophobicContact CG-CB 4.23Å; E167-K230 HydrophobicContact CB-CG 4.05Å; E167-K230 HydrophobicContact CG-CG 3.7Å; E167-K230 WeakPolarHBondContact OE1-CE 3.45Å; E167-K230 IonicContact OE1-NZ 3.04Å
168	T	97.2	Very high	97.3	Very high	12 Å²	12	28.6 Å²	28.6	7%	0.074	14%	0.136	C	C	.	.	H	α-helix	trans	-63.8	-27.7	-174.8	64.4	0	0	0	0	112.1	R161 T162 S163 D166 K171 A172	R161-T168 WeakPolarHBondContact O-CB 3.33Å; R161-T168 PolarHBondContact O-OG1 2.92Å; T162-T168 VanDerWaalsContact CA-OG1 3.24Å; T162-T168 WeakPolarHBondContact CA-OG1 3.32Å; S163-T168 PolarHBondContact N-OG1 3.26Å; D166-T168 PolarHBondContact O-N 2.94Å; D166-T168 VanDerWaalsContact OD1-CB 3.23Å; D166-T168 WeakPolarHBondContact OD1-CB 2.85Å; D166-T168 WeakPolarHBondContact OD1-CG2 3.49Å; D166-T168 PolarHBondContact OD1-N 3.34Å; D166-T168 PolarHBondContact OD1-OG1 3.28Å; T168-K171 WeakPolarHBondContact O-CB 3.25Å; T168-K171 PolarHBondContact O-N 3.01Å; T168-A172 PolarHBondContact O-N 3.4Å
169	L	97.9	Very high	97.1	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-63.2	-41.9	172.2	-177.1	61.7	0	0	0	112.4	M23 I26 I27 S163 I164 E167 K171 A172 W173	M23-L169 HydrophobicContact CB-CD1 3.86Å; M23-L169 HydrophobicContact CB-CD2 4.29Å; M23-L169 HydrophobicContact CG-CD1 3.5Å; M23-L169 HydrophobicContact CG-CD2 4.12Å; M23-L169 HydrophobicContact CG-CG 4.48Å; M23-L169 HydrophobicContact SD-CD1 3.4Å; M23-L169 WeakPolarHBondContact SD-CD1 3.36Å; I26-L169 HydrophobicContact CB-CD2 4.38Å; I26-L169 HydrophobicContact CG2-CD2 4.16Å; I27-L169 HydrophobicContact CD1-CD2 4.13Å; I27-L169 HydrophobicContact CD1-CG 4.05Å; I27-L169 HydrophobicContact CG1-CD2 4.1Å; I27-L169 HydrophobicContact CG1-CG 4.15Å; S163-L169 WeakPolarHBondContact O-CB 3.47Å; I164-L169 HydrophobicContact CG2-CD2 4.34Å; E167-L169 PolarHBondContact O-N 3.46Å; L169-K171 VanDerWaalsContact C-N 3.29Å; L169-K171 PolarHBondContact O-N 3.31Å; L169-A172 PolarHBondContact O-N 3.21Å; L169-W173 PolarHBondContact O-N 3.36Å; L169-W173 VanDerWaalsContact O-N 3.08Å
170	Y	97.9	Very high	96.9	Very high	4 Å²	4	30.6 Å²	30.6	2%	0.016	14%	0.138	C	C	.	.	H	α-helix	trans	-65.3	-36.8	175.8	-73.9	-97.9	0	0	0	110.7	I27 E167 W173 S174 L212 N233 K236	I27-Y170 HydrophobicContact CD1-CD1 4.08Å; I27-Y170 HydrophobicContact CD1-CD2 4.28Å; I27-Y170 HydrophobicContact CD1-CE1 3.93Å; I27-Y170 HydrophobicContact CD1-CE2 4.13Å; I27-Y170 HydrophobicContact CD1-CG 4.24Å; E167-Y170 WeakPolarHBondContact O-CB 3.39Å; E167-Y170 PolarHBondContact O-N 3.46Å; Y170-W173 PolarHBondContact O-N 2.97Å; Y170-S174 WeakPolarHBondContact O-CB 3.48Å; Y170-S174 PolarHBondContact O-N 2.92Å; Y170-S174 PolarHBondContact O-OG 3.41Å; Y170-L212 HydrophobicContact CD1-CD2 3.97Å; Y170-N233 HydrophobicContact CD2-CB 4.05Å; Y170-N233 HydrophobicContact CE2-CB 3.89Å; Y170-K236 WeakPolarHBondContact OH-CG 3.39Å
171	K	96.9	Very high	96.6	Very high	63 Å²	63	29.5 Å²	29.5	27%	0.274	13%	0.133	S	C	.	.	H	α-helix	trans	-60.3	-50.6	176.4	-174.6	169.6	-179.5	169.3	0	111.7	F160 E167 T168 L169 S174 S175 H226 E229	F160-K171 HydrophobicContact CE1-CG 4.47Å; E167-K171 PolarHBondContact O-N 3.26Å; E167-K171 VanDerWaalsContact O-N 3.15Å; T168-K171 WeakPolarHBondContact O-CB 3.25Å; T168-K171 PolarHBondContact O-N 3.01Å; L169-K171 VanDerWaalsContact C-N 3.29Å; L169-K171 PolarHBondContact O-N 3.31Å; K171-S174 PolarHBondContact O-N 3.22Å; K171-S175 WeakPolarHBondContact O-CB 3.16Å; K171-S175 PolarHBondContact O-N 3.39Å; K171-H226 VanDerWaalsContact CD-CE1 3.48Å; K171-H226 WeakPolarHBondContact CD-CE1 3.33Å; K171-H226 WeakPolarHBondContact CD-ND1 3.12Å; K171-H226 PolarHBondContact NZ-CE1 2.76Å; K171-E229 HydrophobicContact CB-CG 3.75Å; K171-E229 HydrophobicContact CG-CG 4.45Å
172	A	98.3	Very high	96.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.3	-51.2	179.1	0	0	0	0	0	111	L125 F160 T162 T168 L169 S174 S175 I176	L125-A172 HydrophobicContact CD2-CB 3.78Å; F160-A172 HydrophobicContact CB-CB 3.8Å; F160-A172 HydrophobicContact CD1-CB 4.04Å; F160-A172 HydrophobicContact CD2-CB 4.32Å; F160-A172 HydrophobicContact CG-CB 3.78Å; T162-A172 HydrophobicContact CG2-CB 3.62Å; T168-A172 PolarHBondContact O-N 3.4Å; L169-A172 PolarHBondContact O-N 3.21Å; A172-S174 PolarHBondContact O-N 2.86Å; A172-S175 PolarHBondContact O-N 2.84Å; A172-I176 WeakPolarHBondContact O-CD1 3.43Å; A172-I176 VanDerWaalsContact O-CG1 3.25Å; A172-I176 WeakPolarHBondContact O-CG1 3.47Å; A172-I176 PolarHBondContact O-N 3.02Å
173	W	98.1	Very high	95.6	Very high	1 Å²	1	30.2 Å²	30.2	0%	0.004	15%	0.147	C	C	.	.	H	α-helix	trans	-67.1	-37.1	-178.9	-83.4	99.8	0	0	0	113.5	V10 L12 I27 F28 L60 I89 L169 Y170 S175 I176 V177 L212	V10-W173 HydrophobicContact CG1-CH2 4.44Å; V10-W173 HydrophobicContact CG1-CZ3 4.4Å; L12-W173 HydrophobicContact CD1-CH2 4.42Å; L12-W173 HydrophobicContact CD2-CH2 4.14Å; L12-W173 HydrophobicContact CD2-CZ2 3.94Å; I27-W173 HydrophobicContact CG1-CG 4.08Å; I27-W173 HydrophobicContact CG2-CG 4.44Å; F28-W173 HydrophobicContact CE2-CD2 4Å; F28-W173 AromaticContact CE2-CE3 3.69Å; F28-W173 HydrophobicContact CE2-CE3 3.69Å; F28-W173 AromaticContact CE2-CH2 3.6Å; F28-W173 HydrophobicContact CE2-CH2 3.6Å; F28-W173 AromaticContact CE2-CZ2 3.91Å; F28-W173 HydrophobicContact CE2-CZ2 3.91Å; F28-W173 AromaticContact CE2-CZ3 3.49Å; F28-W173 HydrophobicContact CE2-CZ3 3.49Å; F28-W173 VanDerWaalsContact CE2-CZ3 3.49Å; F28-W173 HydrophobicContact CZ-CD2 4.27Å; F28-W173 AromaticContact CZ-CE3 3.65Å; F28-W173 HydrophobicContact CZ-CE3 3.65Å; F28-W173 HydrophobicContact CZ-CH2 4.23Å; F28-W173 AromaticContact CZ-CZ3 3.63Å; F28-W173 HydrophobicContact CZ-CZ3 3.63Å; L60-W173 HydrophobicContact CD2-CH2 4.39Å; L60-W173 HydrophobicContact CD2-CZ3 4.42Å; I89-W173 HydrophobicContact CD1-CE3 4.38Å; I89-W173 HydrophobicContact CD1-CH2 3.35Å; I89-W173 HydrophobicContact CD1-CZ2 3.82Å; I89-W173 HydrophobicContact CD1-CZ3 3.68Å; L169-W173 PolarHBondContact O-N 3.36Å; L169-W173 VanDerWaalsContact O-N 3.08Å; Y170-W173 PolarHBondContact O-N 2.97Å; W173-S175 VanDerWaalsContact C-N 3.34Å; W173-I176 HydrophobicContact CE3-CG2 4.42Å; W173-I176 PolarHBondContact O-N 3.39Å; W173-V177 WeakPolarHBondContact O-CG1 3.44Å; W173-V177 VanDerWaalsContact O-CG2 3.3Å; W173-V177 WeakPolarHBondContact O-CG2 3.45Å; W173-V177 PolarHBondContact O-N 3.29Å; W173-L212 HydrophobicContact CB-CD1 3.83Å; W173-L212 HydrophobicContact CB-CD2 3.6Å; W173-L212 HydrophobicContact CB-CG 4.4Å
174	S	97.1	Very high	95.2	Very high	8 Å²	8	30.9 Å²	30.9	6%	0.056	15%	0.151	C	C	.	.	H	α-helix	trans	-61.1	-43.3	173.1	-87.5	0	0	0	0	111.5	Y170 K171 A172 I176 V177 Y178 V213	Y170-S174 WeakPolarHBondContact O-CB 3.48Å; Y170-S174 PolarHBondContact O-N 2.92Å; Y170-S174 PolarHBondContact O-OG 3.41Å; K171-S174 PolarHBondContact O-N 3.22Å; A172-S174 PolarHBondContact O-N 2.86Å; S174-I176 PolarHBondContact O-N 2.8Å; S174-V177 WeakPolarHBondContact O-CG2 3.34Å; S174-Y178 WeakPolarHBondContact O-CB 3.5Å; S174-Y178 PolarHBondContact O-N 3.39Å; S174-V213 PolarHBondContact OG-N 2.88Å; S174-V213 PolarHBondContact OG-O 2.69Å
175	S	97.2	Very high	95	Very high	40 Å²	40	36.9 Å²	36.9	28%	0.28	18%	0.179	S	C	.	.	H	α-helix	trans	-64.3	-40	175.2	-171.4	0	0	0	0	112.4	F160 K171 A172 W173 Q179	F160-S175 VanDerWaalsContact CZ-CB 3.48Å; F160-S175 WeakPolarHBondContact CZ-OG 3.29Å; K171-S175 WeakPolarHBondContact O-CB 3.16Å; K171-S175 PolarHBondContact O-N 3.39Å; A172-S175 PolarHBondContact O-N 2.84Å; W173-S175 VanDerWaalsContact C-N 3.34Å; S175-Q179 WeakPolarHBondContact O-CG 3.37Å; S175-Q179 PolarHBondContact O-N 3.25Å
176	I	97.2	Very high	94.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.4	-51.5	176.8	-70.5	159.3	0	0	0	111.3	V87 I89 F123 A172 W173 S174 Y178 Q179	V87-I176 HydrophobicContact CG1-CG2 3.9Å; V87-I176 HydrophobicContact CG2-CG2 4.4Å; I89-I176 HydrophobicContact CD1-CD1 3.73Å; I89-I176 HydrophobicContact CD1-CG2 4.3Å; I89-I176 HydrophobicContact CG1-CD1 3.98Å; F123-I176 HydrophobicContact CB-CD1 4.32Å; F123-I176 HydrophobicContact CB-CG1 4.26Å; F123-I176 HydrophobicContact CD1-CD1 4.12Å; F123-I176 HydrophobicContact CD1-CG1 3.38Å; F123-I176 HydrophobicContact CD2-CG1 3.93Å; F123-I176 HydrophobicContact CE1-CB 4.42Å; F123-I176 HydrophobicContact CE1-CG1 3.52Å; F123-I176 HydrophobicContact CE2-CG1 4.03Å; F123-I176 HydrophobicContact CG-CD1 4.18Å; F123-I176 HydrophobicContact CG-CG1 3.59Å; F123-I176 HydrophobicContact CZ-CB 4.36Å; F123-I176 HydrophobicContact CZ-CG1 3.83Å; A172-I176 WeakPolarHBondContact O-CD1 3.43Å; A172-I176 VanDerWaalsContact O-CG1 3.25Å; A172-I176 WeakPolarHBondContact O-CG1 3.47Å; A172-I176 PolarHBondContact O-N 3.02Å; W173-I176 HydrophobicContact CE3-CG2 4.42Å; W173-I176 PolarHBondContact O-N 3.39Å; S174-I176 PolarHBondContact O-N 2.8Å; I176-Y178 VanDerWaalsContact C-N 3.33Å; I176-Y178 PolarHBondContact O-N 3.37Å; I176-Q179 WeakPolarHBondContact O-CB 3.32Å; I176-Q179 PolarHBondContact O-N 2.9Å
177	V	95.2	Very high	94.7	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-70.6	-31.4	-177.6	-59.8	0	0	0	0	111.8	F52 L58 W173 S174 Q179 L180 I181 L212	F52-V177 HydrophobicContact CE1-CB 3.91Å; F52-V177 HydrophobicContact CE1-CG1 4.44Å; F52-V177 HydrophobicContact CE1-CG2 3.93Å; F52-V177 HydrophobicContact CE2-CB 4.41Å; F52-V177 HydrophobicContact CE2-CG1 4.13Å; F52-V177 HydrophobicContact CE2-CG2 4.37Å; F52-V177 HydrophobicContact CZ-CB 3.79Å; F52-V177 HydrophobicContact CZ-CG1 4.01Å; F52-V177 HydrophobicContact CZ-CG2 3.53Å; L58-V177 HydrophobicContact CD1-CG1 3.95Å; W173-V177 WeakPolarHBondContact O-CG1 3.44Å; W173-V177 VanDerWaalsContact O-CG2 3.3Å; W173-V177 WeakPolarHBondContact O-CG2 3.45Å; W173-V177 PolarHBondContact O-N 3.29Å; S174-V177 WeakPolarHBondContact O-CG2 3.34Å; V177-Q179 PolarHBondContact O-N 2.87Å; V177-L180 WeakPolarHBondContact O-CA 3.5Å; V177-L180 WeakPolarHBondContact O-CB 3.05Å; V177-L180 PolarHBondContact O-N 3.24Å; V177-I181 WeakPolarHBondContact O-CG1 3.26Å; V177-I181 PolarHBondContact O-N 3.39Å; V177-L212 HydrophobicContact CG1-CD1 3.92Å; V177-L212 HydrophobicContact CG2-CB 4.35Å; V177-L212 HydrophobicContact CG2-CD1 4.11Å
178	Y	95.2	Very high	94.7	Very high	79 Å²	79	34.5 Å²	34.5	31%	0.31	17%	0.172	S	C	.	.	H	α-helix	trans	-52.4	-43.1	172.1	176.7	-86.1	0	0	0	111.2	S174 I176 L180 I181 V184 E188	S174-Y178 WeakPolarHBondContact O-CB 3.5Å; S174-Y178 PolarHBondContact O-N 3.39Å; I176-Y178 VanDerWaalsContact C-N 3.33Å; I176-Y178 PolarHBondContact O-N 3.37Å; Y178-L180 PolarHBondContact O-N 2.89Å; Y178-I181 PolarHBondContact O-N 2.6Å; Y178-V184 HydrophobicContact CD2-CG2 3.62Å; Y178-V184 HydrophobicContact CE1-CG1 4.47Å; Y178-V184 HydrophobicContact CE2-CB 4.39Å; Y178-V184 HydrophobicContact CE2-CG1 4.22Å; Y178-V184 HydrophobicContact CE2-CG2 3.32Å; Y178-V184 HydrophobicContact CG-CG2 4.49Å; Y178-E188 WeakPolarHBondContact CE2-OE1 3.48Å; Y178-E188 PolarHBondContact OH-OE1 2.94Å
179	Q	94.7	Very high	94.7	Very high	83 Å²	83	38.6 Å²	38.6	39%	0.388	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-14.8	177.7	-69.2	-64	-19.3	0	0	114.3	K121 F123 S175 I176 V177	K121-Q179 HydrophobicContact CD-CB 3.64Å; K121-Q179 HydrophobicContact CD-CG 4.13Å; K121-Q179 PolarHBondContact NZ-O 3.39Å; F123-Q179 HydrophobicContact CZ-CG 4.02Å; S175-Q179 WeakPolarHBondContact O-CG 3.37Å; S175-Q179 PolarHBondContact O-N 3.25Å; I176-Q179 WeakPolarHBondContact O-CB 3.32Å; I176-Q179 PolarHBondContact O-N 2.9Å; V177-Q179 PolarHBondContact O-N 2.87Å
180	L	94.2	Very high	94.6	Very high	8 Å²	8	40.1 Å²	40.1	4%	0.042	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-11.5	-178.8	-66	176.6	0	0	0	113.3	K8 V10 L58 E86 V87 V177 Y178 P182	K8-L180 HydrophobicContact CB-CD1 4.5Å; K8-L180 HydrophobicContact CB-CD2 4.16Å; K8-L180 HydrophobicContact CD-CD2 4.36Å; K8-L180 HydrophobicContact CG-CD2 4.26Å; V10-L180 HydrophobicContact CG2-CD1 3.8Å; L58-L180 HydrophobicContact CD2-CD1 3.66Å; E86-L180 HydrophobicContact CB-CD2 3.96Å; V87-L180 HydrophobicContact CG2-CD1 4.09Å; V87-L180 HydrophobicContact CG2-CD2 3.67Å; V87-L180 HydrophobicContact CG2-CG 3.98Å; V177-L180 WeakPolarHBondContact O-CA 3.5Å; V177-L180 WeakPolarHBondContact O-CB 3.05Å; V177-L180 PolarHBondContact O-N 3.24Å; Y178-L180 PolarHBondContact O-N 2.89Å; L180-P182 WeakPolarHBondContact O-CD 3.44Å
181	I	92.2	Very high	94.5	Very high	8 Å²	8	40 Å²	40	4%	0.041	20%	0.199	C	C	.	.			trans	-85.5	113.1	-177.5	-63.7	164.2	0	0	0	109.3	F52 L53 L56 V177 Y178 N183 V184 L187 I214	F52-I181 HydrophobicContact CE1-CD1 4.06Å; F52-I181 HydrophobicContact CE1-CG1 4.46Å; L53-I181 HydrophobicContact CD2-CG2 4.2Å; L56-I181 HydrophobicContact CD2-CG1 4.07Å; V177-I181 WeakPolarHBondContact O-CG1 3.26Å; V177-I181 PolarHBondContact O-N 3.39Å; Y178-I181 PolarHBondContact O-N 2.6Å; I181-N183 PolarHBondContact O-N 3.23Å; I181-V184 HydrophobicContact CB-CB 4.14Å; I181-V184 HydrophobicContact CG2-CB 3.93Å; I181-L187 HydrophobicContact CG2-CD1 4.21Å; I181-I214 HydrophobicContact CD1-CB 4.35Å; I181-I214 HydrophobicContact CD1-CG1 4.2Å; I181-I214 HydrophobicContact CD1-CG2 3.79Å
182	P	87.9	Confident	94.5	Very high	76 Å²	76	42.4 Å²	42.4	49%	0.494	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-29.5	-170.3	26.8	-35.3	0	0	0	114	M6 L180	M6-P182 HydrophobicContact CE-CG 4.16Å; M6-P182 HydrophobicContact SD-CG 4.14Å; L180-P182 WeakPolarHBondContact O-CD 3.44Å
183	N	86.7	Confident	94.4	Very high	18 Å²	18	45.6 Å²	45.6	10%	0.096	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	25.4	-174.7	66.1	-34.6	0	0	0	112.8	I181 Q185 Q186 L187 L300	I181-N183 PolarHBondContact O-N 3.23Å; N183-Q185 VanDerWaalsContact C-N 3.29Å; N183-Q185 PolarHBondContact O-N 2.82Å; N183-Q186 WeakPolarHBondContact O-CB 3.25Å; N183-Q186 PolarHBondContact O-N 3.32Å; N183-L187 PolarHBondContact O-N 3.03Å; N183-L300 PolarHBondContact ND2-O 2.89Å
184	V	91.4	Very high	94.4	Very high	14 Å²	14	46.3 Å²	46.3	9%	0.085	23%	0.227	C	C	.	.	H	α-helix	trans	-58.1	-40.1	-174.4	70	0	0	0	0	112.7	Y178 I181 Q186 L187 E188	Y178-V184 HydrophobicContact CD2-CG2 3.62Å; Y178-V184 HydrophobicContact CE1-CG1 4.47Å; Y178-V184 HydrophobicContact CE2-CB 4.39Å; Y178-V184 HydrophobicContact CE2-CG1 4.22Å; Y178-V184 HydrophobicContact CE2-CG2 3.32Å; Y178-V184 HydrophobicContact CG-CG2 4.49Å; I181-V184 HydrophobicContact CB-CB 4.14Å; I181-V184 HydrophobicContact CG2-CB 3.93Å; V184-Q186 VanDerWaalsContact C-N 3.32Å; V184-Q186 PolarHBondContact O-N 3.27Å; V184-L187 WeakPolarHBondContact O-CB 3.42Å; V184-L187 PolarHBondContact O-N 2.85Å; V184-L187 VanDerWaalsContact O-N 3.13Å; V184-E188 WeakPolarHBondContact O-CG 3.48Å; V184-E188 PolarHBondContact O-N 3.33Å
185	Q	92.5	Very high	94.4	Very high	152 Å²	152	46 Å²	46	71%	0.71	22%	0.224	S	C	*	.	H	α-helix	trans	-62.5	-37	176.6	-66.3	178.8	-18.6	0	0	112.8	N183 M189	N183-Q185 VanDerWaalsContact C-N 3.29Å; N183-Q185 PolarHBondContact O-N 2.82Å; Q185-M189 WeakPolarHBondContact O-CB 3.29Å; Q185-M189 PolarHBondContact O-N 3.2Å
186	Q	92.7	Very high	94.3	Very high	99 Å²	99	49.3 Å²	49.3	46%	0.463	24%	0.236	S	C	.	.	H	α-helix	trans	-69.3	-41.4	175.8	-65	-179	17.1	0	0	110.3	N183 V184 E188 M189 N190	N183-Q186 WeakPolarHBondContact O-CB 3.25Å; N183-Q186 PolarHBondContact O-N 3.32Å; V184-Q186 VanDerWaalsContact C-N 3.32Å; V184-Q186 PolarHBondContact O-N 3.27Å; Q186-E188 VanDerWaalsContact C-N 3.35Å; Q186-E188 PolarHBondContact O-N 3.22Å; Q186-M189 PolarHBondContact O-N 2.89Å; Q186-N190 WeakPolarHBondContact O-CB 3.25Å; Q186-N190 PolarHBondContact O-N 3.33Å; Q186-N190 PolarHBondContact O-ND2 2.87Å
187	L	92.8	Very high	94.3	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-59.3	-46.8	175	-71	169.4	0	0	0	110.9	L53 I181 N183 V184 M189 N190 L191 L205 I214 F297 L300	L53-L187 HydrophobicContact CD2-CD1 3.99Å; I181-L187 HydrophobicContact CG2-CD1 4.21Å; N183-L187 PolarHBondContact O-N 3.03Å; V184-L187 WeakPolarHBondContact O-CB 3.42Å; V184-L187 PolarHBondContact O-N 2.85Å; V184-L187 VanDerWaalsContact O-N 3.13Å; L187-M189 PolarHBondContact O-N 3.28Å; L187-N190 PolarHBondContact O-N 2.64Å; L187-L191 VanDerWaalsContact O-CB 3.25Å; L187-L191 WeakPolarHBondContact O-CB 3.43Å; L187-L191 PolarHBondContact O-N 2.81Å; L187-L205 HydrophobicContact CD2-CD2 4.4Å; L187-I214 HydrophobicContact CD1-CG2 4.03Å; L187-F297 HydrophobicContact CD2-CD1 4.22Å; L187-L300 HydrophobicContact CD2-CB 3.84Å; L187-L300 HydrophobicContact CD2-CD1 4.23Å
188	E	95.1	Very high	94.3	Very high	55 Å²	55	56.1 Å²	56.1	26%	0.257	27%	0.27	S	S	.	.	H	α-helix	trans	-59.1	-47.5	177.5	-74.4	175.6	157.8	0	0	112.8	Y178 V184 Q186 N190 L191 R192 S215	Y178-E188 WeakPolarHBondContact CE2-OE1 3.48Å; Y178-E188 PolarHBondContact OH-OE1 2.94Å; V184-E188 WeakPolarHBondContact O-CG 3.48Å; V184-E188 PolarHBondContact O-N 3.33Å; Q186-E188 VanDerWaalsContact C-N 3.35Å; Q186-E188 PolarHBondContact O-N 3.22Å; E188-N190 VanDerWaalsContact C-N 3.32Å; E188-N190 PolarHBondContact O-N 2.86Å; E188-L191 PolarHBondContact O-N 3.48Å; E188-R192 WeakPolarHBondContact O-CB 3.39Å; E188-R192 PolarHBondContact O-N 2.87Å; E188-S215 WeakPolarHBondContact CG-OG 3.34Å
189	M	96.4	Very high	94.2	Very high	99 Å²	99	59.1 Å²	59.1	49%	0.488	29%	0.287	S	S	.	.	H	α-helix	trans	-60.3	-44.8	178.1	-173.9	68.6	76.4	0	0	111.2	Q185 Q186 L187 R192 N193	Q185-M189 WeakPolarHBondContact O-CB 3.29Å; Q185-M189 PolarHBondContact O-N 3.2Å; Q186-M189 PolarHBondContact O-N 2.89Å; L187-M189 PolarHBondContact O-N 3.28Å; M189-R192 PolarHBondContact O-N 3.28Å; M189-N193 VanDerWaalsContact O-CG 3.26Å; M189-N193 PolarHBondContact O-N 2.72Å; M189-N193 PolarHBondContact O-OD1 2.98Å
190	N	96.1	Very high	94.3	Very high	34 Å²	34	55.5 Å²	55.5	18%	0.182	27%	0.272	C	S	.	.	H	α-helix	trans	-71.6	-32.9	179.9	-75.9	-84.5	0	0	0	112.3	Q186 L187 E188 N193 F194 H296 F297 L300	Q186-N190 WeakPolarHBondContact O-CB 3.25Å; Q186-N190 PolarHBondContact O-N 3.33Å; Q186-N190 PolarHBondContact O-ND2 2.87Å; L187-N190 PolarHBondContact O-N 2.64Å; E188-N190 VanDerWaalsContact C-N 3.32Å; E188-N190 PolarHBondContact O-N 2.86Å; N190-N193 PolarHBondContact O-N 3.36Å; N190-F194 WeakPolarHBondContact O-CB 3.48Å; N190-F194 PolarHBondContact O-N 3.33Å; N190-H296 PolarHBondContact OD1-NE2 3.47Å; N190-F297 HydrophobicContact CB-CE1 4.2Å; N190-F297 HydrophobicContact CB-CZ 4.07Å; N190-L300 HydrophobicContact CB-CD1 3.58Å
191	L	96.1	Very high	94.4	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-66.5	-41.7	174.6	-160.9	69.9	0	0	0	111.1	L187 E188 F194 A195 V203 L205 F297	L187-L191 VanDerWaalsContact O-CB 3.25Å; L187-L191 WeakPolarHBondContact O-CB 3.43Å; L187-L191 PolarHBondContact O-N 2.81Å; E188-L191 PolarHBondContact O-N 3.48Å; L191-F194 PolarHBondContact O-N 3.49Å; L191-A195 WeakPolarHBondContact O-CB 3.18Å; L191-A195 PolarHBondContact O-N 2.92Å; L191-V203 HydrophobicContact CD1-CB 4.42Å; L191-V203 HydrophobicContact CD1-CG1 3.54Å; L191-V203 HydrophobicContact CD2-CG1 4.42Å; L191-V203 HydrophobicContact CG-CB 4.29Å; L191-V203 HydrophobicContact CG-CG1 3.93Å; L191-L205 HydrophobicContact CD1-CB 4.39Å; L191-L205 HydrophobicContact CD2-CB 4.23Å; L191-F297 HydrophobicContact CB-CE1 4.45Å; L191-F297 HydrophobicContact CB-CZ 4.49Å; L191-F297 HydrophobicContact CD1-CE1 4.05Å; L191-F297 HydrophobicContact CD1-CZ 4.06Å
192	R	97.2	Very high	94.6	Very high	114 Å²	114	57.1 Å²	57.1	43%	0.43	28%	0.28	S	S	.	.	H	α-helix	trans	-60	-49	172.1	-180	-179.1	-61.6	144.8	2.8	111.7	E188 M189 F194 A195 Q196 Y217	E188-R192 WeakPolarHBondContact O-CB 3.39Å; E188-R192 PolarHBondContact O-N 2.87Å; M189-R192 PolarHBondContact O-N 3.28Å; R192-F194 VanDerWaalsContact C-N 3.31Å; R192-F194 PolarHBondContact O-N 3.35Å; R192-A195 PolarHBondContact O-N 3.25Å; R192-Q196 WeakPolarHBondContact O-CG 3.42Å; R192-Q196 PolarHBondContact O-N 3.48Å; R192-Y217 HydrophobicContact CB-CD2 3.97Å; R192-Y217 HydrophobicContact CB-CE2 4.46Å; R192-Y217 HydrophobicContact CG-CD2 3.82Å; R192-Y217 HydrophobicContact CG-CE2 3.81Å
193	N	97.3	Very high	95	Very high	68 Å²	68	53.5 Å²	53.5	36%	0.364	26%	0.257	S	S	.	.	H	α-helix	trans	-61	-42.6	178.5	-68.9	-12.6	0	0	0	111.4	M189 N190 Q196 I197	M189-N193 VanDerWaalsContact O-CG 3.26Å; M189-N193 PolarHBondContact O-N 2.72Å; M189-N193 PolarHBondContact O-OD1 2.98Å; N190-N193 PolarHBondContact O-N 3.36Å; N193-Q196 PolarHBondContact O-N 3.18Å; N193-I197 WeakPolarHBondContact O-CD1 3.12Å; N193-I197 VanDerWaalsContact O-CG1 3.25Å; N193-I197 WeakPolarHBondContact O-CG1 3.26Å; N193-I197 PolarHBondContact O-N 3.41Å
194	F	97.3	Very high	95.5	Very high	15 Å²	15	52.6 Å²	52.6	7%	0.066	25%	0.252	C	S	.	.	H	α-helix	trans	-60.8	-48.3	175.5	173.5	-116.9	0	0	0	111.6	N190 L191 R192 Q196 I197 I198 V203 V274 N289 I290 A293 F297	N190-F194 WeakPolarHBondContact O-CB 3.48Å; N190-F194 PolarHBondContact O-N 3.33Å; L191-F194 PolarHBondContact O-N 3.49Å; R192-F194 VanDerWaalsContact C-N 3.31Å; R192-F194 PolarHBondContact O-N 3.35Å; F194-Q196 VanDerWaalsContact C-N 3.29Å; F194-Q196 PolarHBondContact O-N 3.01Å; F194-I197 PolarHBondContact O-N 3.5Å; F194-I198 HydrophobicContact CD1-CD1 4.28Å; F194-I198 HydrophobicContact CD2-CG2 4.02Å; F194-I198 HydrophobicContact CE1-CD1 3.7Å; F194-I198 HydrophobicContact CE2-CD1 4.15Å; F194-I198 HydrophobicContact CE2-CG2 3.61Å; F194-I198 HydrophobicContact CZ-CD1 3.63Å; F194-I198 HydrophobicContact CZ-CG2 4.14Å; F194-I198 WeakPolarHBondContact O-CG1 3.42Å; F194-I198 PolarHBondContact O-N 3.4Å; F194-I198 VanDerWaalsContact O-N 3.13Å; F194-V203 HydrophobicContact CD1-CG1 4.2Å; F194-V203 HydrophobicContact CE1-CG1 4.31Å; F194-V274 HydrophobicContact CE1-CG2 4.19Å; F194-N289 HydrophobicContact CE2-CB 4.47Å; F194-I290 HydrophobicContact CZ-CG1 4.09Å; F194-A293 HydrophobicContact CD2-CB 3.58Å; F194-A293 HydrophobicContact CE2-CB 3.41Å; F194-A293 VanDerWaalsContact CE2-CB 3.41Å; F194-A293 HydrophobicContact CG-CB 4.35Å; F194-A293 HydrophobicContact CZ-CB 4.07Å; F194-F297 HydrophobicContact CB-CE2 4.21Å; F194-F297 HydrophobicContact CB-CZ 4.26Å; F194-F297 HydrophobicContact CG-CE2 4.46Å
195	A	97.1	Very high	95.8	Very high	1 Å²	1	52 Å²	52	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-58.3	-40.7	178.4	0	0	0	0	0	112.3	L191 R192 E199 A200 V203 Y217	L191-A195 WeakPolarHBondContact O-CB 3.18Å; L191-A195 PolarHBondContact O-N 2.92Å; R192-A195 PolarHBondContact O-N 3.25Å; A195-E199 WeakPolarHBondContact O-CA 3.3Å; A195-E199 PolarHBondContact O-N 3.36Å; A195-A200 HydrophobicContact CB-CB 4.48Å; A195-A200 PolarHBondContact O-N 3.03Å; A195-V203 HydrophobicContact CB-CB 4.34Å; A195-V203 HydrophobicContact CB-CG2 3.55Å; A195-Y217 HydrophobicContact CB-CD1 3.18Å; A195-Y217 HydrophobicContact CB-CD2 4.49Å; A195-Y217 HydrophobicContact CB-CE1 3.56Å; A195-Y217 HydrophobicContact CB-CG 3.7Å
196	Q	96	Very high	96	Very high	111 Å²	111	44.9 Å²	44.9	52%	0.519	22%	0.215	S	C	.	.	H	α-helix	trans	-66.7	-42.5	176.6	-72	173.8	-19.6	0	0	112.8	R192 N193 F194 I198 E199	R192-Q196 WeakPolarHBondContact O-CG 3.42Å; R192-Q196 PolarHBondContact O-N 3.48Å; N193-Q196 PolarHBondContact O-N 3.18Å; F194-Q196 VanDerWaalsContact C-N 3.29Å; F194-Q196 PolarHBondContact O-N 3.01Å; Q196-I198 VanDerWaalsContact C-N 3.28Å; Q196-I198 PolarHBondContact O-N 3.05Å; Q196-E199 PolarHBondContact O-N 3.11Å
197	I	95.3	Very high	96.2	Very high	134 Å²	134	40.5 Å²	40.5	69%	0.687	19%	0.194	S	C	*	.	H	α-helix	trans	-62.9	-36.5	179.6	-71.6	164.2	0	0	0	111.7	N193 F194	N193-I197 WeakPolarHBondContact O-CD1 3.12Å; N193-I197 VanDerWaalsContact O-CG1 3.25Å; N193-I197 WeakPolarHBondContact O-CG1 3.26Å; N193-I197 PolarHBondContact O-N 3.41Å; F194-I197 PolarHBondContact O-N 3.5Å
198	I	95.3	Very high	96.3	Very high	9 Å²	9	44.9 Å²	44.9	5%	0.046	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	0.5	-178.5	73.7	175.5	0	0	0	113	F194 Q196 A200 V274 M276 N289	F194-I198 HydrophobicContact CD1-CD1 4.28Å; F194-I198 HydrophobicContact CD2-CG2 4.02Å; F194-I198 HydrophobicContact CE1-CD1 3.7Å; F194-I198 HydrophobicContact CE2-CD1 4.15Å; F194-I198 HydrophobicContact CE2-CG2 3.61Å; F194-I198 HydrophobicContact CZ-CD1 3.63Å; F194-I198 HydrophobicContact CZ-CG2 4.14Å; F194-I198 WeakPolarHBondContact O-CG1 3.42Å; F194-I198 PolarHBondContact O-N 3.4Å; F194-I198 VanDerWaalsContact O-N 3.13Å; Q196-I198 VanDerWaalsContact C-N 3.28Å; Q196-I198 PolarHBondContact O-N 3.05Å; I198-A200 VanDerWaalsContact C-N 3.27Å; I198-A200 HydrophobicContact CD1-CB 3.71Å; I198-A200 HydrophobicContact CG1-CB 3.62Å; I198-A200 PolarHBondContact O-N 3.18Å; I198-V274 HydrophobicContact CD1-CG1 3.66Å; I198-V274 HydrophobicContact CD1-CG2 4.18Å; I198-M276 VanDerWaalsContact O-CE 3.31Å; I198-M276 WeakPolarHBondContact O-CE 3.44Å; I198-N289 HydrophobicContact CG2-CB 3.56Å
199	E	94.3	Very high	96.2	Very high	142 Å²	142	44.3 Å²	44.3	66%	0.664	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.9	37.8	-176.6	-57.6	178.6	-170.7	0	0	113.4	A195 Q196 M276	A195-E199 WeakPolarHBondContact O-CA 3.3Å; A195-E199 PolarHBondContact O-N 3.36Å; Q196-E199 PolarHBondContact O-N 3.11Å; E199-M276 WeakPolarHBondContact O-CE 3.4Å
200	A	96.6	Very high	96.1	Very high	7 Å²	7	39.7 Å²	39.7	6%	0.058	19%	0.193	C	C	.	.			trans	-78.8	141.4	178.6	0	0	0	0	0	112.7	A195 I198 V203 V274 M276	A195-A200 HydrophobicContact CB-CB 4.48Å; A195-A200 PolarHBondContact O-N 3.03Å; I198-A200 VanDerWaalsContact C-N 3.27Å; I198-A200 HydrophobicContact CD1-CB 3.71Å; I198-A200 HydrophobicContact CG1-CB 3.62Å; I198-A200 PolarHBondContact O-N 3.18Å; A200-V203 HydrophobicContact CB-CG2 3.72Å; A200-V274 HydrophobicContact CB-CG1 3.77Å; A200-M276 VanDerWaalsContact CA-SD 3.5Å; A200-M276 HydrophobicContact CB-SD 3.62Å
201	D	95.7	Very high	96.1	Very high	46 Å²	46	38.1 Å²	38.1	25%	0.246	18%	0.184	C	C	.	.	S	Bend	trans	-73.5	-37.1	173.3	-64.5	-71.6	0	0	0	112.1	Q218 C219 V275 S277	D201-Q218 WeakPolarHBondContact O-CA 3.13Å; D201-C219 WeakPolarHBondContact O-CB 3.43Å; D201-C219 PolarHBondContact O-N 3.39Å; D201-V275 PolarHBondContact N-O 3.42Å; D201-S277 VanDerWaalsContact CG-OG 3.26Å; D201-S277 PolarHBondContact OD1-OG 3.18Å; D201-S277 WeakPolarHBondContact OD2-CA 3.45Å; D201-S277 WeakPolarHBondContact OD2-CB 3.39Å; D201-S277 PolarHBondContact OD2-N 3.34Å; D201-S277 PolarHBondContact OD2-OG 3.18Å
202	E	96.1	Very high	96.2	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.019	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	135.3	-175.5	-163	-174.1	158.3	0	0	109.2	L204 Y217 Q218 R227 F228 V274 V275	E202-L204 HydrophobicContact CG-CD2 4.3Å; E202-L204 HydrophobicContact CG-CG 4.44Å; E202-Y217 CarbonylContact C-O 3.57Å; E202-Y217 WeakPolarHBondContact CA-O 3.47Å; E202-Q218 HydrophobicContact CG-CB 4.48Å; E202-R227 IonicContact OE1-NE 3.64Å; E202-R227 PolarHBondContact OE1-NE 2.97Å; E202-R227 IonicContact OE2-CZ 3.2Å; E202-R227 IonicContact OE2-NE 3.4Å; E202-R227 PolarHBondContact OE2-NE 3.43Å; E202-R227 IonicContact OE2-NH2 3.84Å; E202-R227 PolarHBondContact OE2-NH2 3.43Å; E202-F228 HydrophobicContact CG-CE1 4.49Å; E202-F228 WeakPolarHBondContact OE1-CD1 3.35Å; E202-F228 WeakPolarHBondContact OE1-CE1 3.44Å; E202-V274 CarbonylContact O-C 3.6Å; E202-V274 WeakPolarHBondContact O-CA 3.23Å; E202-V275 HydrophobicContact CB-CB 3.83Å; E202-V275 HydrophobicContact CB-CG2 3.94Å; E202-V275 PolarHBondContact N-O 3.19Å; E202-V275 PolarHBondContact O-N 3.24Å
203	V	97.7	Very high	96.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	124	169.9	-174.9	0	0	0	0	109.1	L191 F194 A195 A200 H216 Y217 V272 M273 V274	L191-V203 HydrophobicContact CD1-CB 4.42Å; L191-V203 HydrophobicContact CD1-CG1 3.54Å; L191-V203 HydrophobicContact CD2-CG1 4.42Å; L191-V203 HydrophobicContact CG-CB 4.29Å; L191-V203 HydrophobicContact CG-CG1 3.93Å; F194-V203 HydrophobicContact CD1-CG1 4.2Å; F194-V203 HydrophobicContact CE1-CG1 4.31Å; A195-V203 HydrophobicContact CB-CB 4.34Å; A195-V203 HydrophobicContact CB-CG2 3.55Å; A200-V203 HydrophobicContact CB-CG2 3.72Å; V203-H216 CarbonylContact O-C 3.43Å; V203-H216 VanDerWaalsContact O-CA 3.24Å; V203-H216 WeakPolarHBondContact O-CA 3.28Å; V203-Y217 PolarHBondContact N-O 3.13Å; V203-Y217 PolarHBondContact O-N 2.81Å; V203-V272 HydrophobicContact CG1-CG2 3.7Å; V203-M273 CarbonylContact C-O 3.56Å; V203-M273 VanDerWaalsContact CA-O 3.23Å; V203-M273 WeakPolarHBondContact CA-O 3.47Å; V203-V274 HydrophobicContact CG1-CG2 4.31Å; V203-V274 HydrophobicContact CG2-CG2 4.35Å
204	L	97.4	Very high	96	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	136.4	176.2	-51.6	176.1	0	0	0	110	E202 F206 H216 F228 I231 V272 M273	E202-L204 HydrophobicContact CG-CD2 4.3Å; E202-L204 HydrophobicContact CG-CG 4.44Å; L204-F206 HydrophobicContact CB-CD2 4.23Å; L204-F206 HydrophobicContact CB-CE1 4.35Å; L204-F206 HydrophobicContact CB-CE2 3.49Å; L204-F206 VanDerWaalsContact CB-CE2 3.49Å; L204-F206 HydrophobicContact CB-CZ 3.57Å; L204-F206 HydrophobicContact CD1-CE1 4.31Å; L204-F206 HydrophobicContact CD1-CE2 4.05Å; L204-F206 HydrophobicContact CD1-CZ 3.44Å; L204-F206 VanDerWaalsContact CD1-CZ 3.44Å; L204-F206 HydrophobicContact CG-CE2 4.39Å; L204-F206 HydrophobicContact CG-CZ 4.13Å; L204-H216 HydrophobicContact CD2-CB 3.33Å; L204-F228 HydrophobicContact CD1-CD1 3.78Å; L204-F228 HydrophobicContact CD1-CE1 4.48Å; L204-F228 HydrophobicContact CD1-CG 4.41Å; L204-F228 HydrophobicContact CD2-CD1 3.47Å; L204-F228 VanDerWaalsContact CD2-CD1 3.47Å; L204-F228 HydrophobicContact CD2-CD2 4.41Å; L204-F228 HydrophobicContact CD2-CE1 3.62Å; L204-F228 HydrophobicContact CD2-CG 3.91Å; L204-F228 HydrophobicContact CD2-CZ 4.13Å; L204-F228 HydrophobicContact CG-CD1 4.28Å; L204-I231 HydrophobicContact CD1-CD1 3.89Å; L204-V272 CarbonylContact O-C 3.5Å; L204-V272 VanDerWaalsContact O-CA 3.3Å; L204-V272 WeakPolarHBondContact O-CA 3.4Å; L204-M273 HydrophobicContact CB-CB 4.13Å; L204-M273 HydrophobicContact CD1-SD 4.07Å; L204-M273 PolarHBondContact N-O 2.81Å; L204-M273 PolarHBondContact O-N 2.82Å
205	L	97.2	Very high	95.9	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	119.7	172.1	-171.3	69.6	0	0	0	108.8	L187 L191 I214 S215 F266 T270	L187-L205 HydrophobicContact CD2-CD2 4.4Å; L191-L205 HydrophobicContact CD1-CB 4.39Å; L191-L205 HydrophobicContact CD2-CB 4.23Å; L205-I214 HydrophobicContact CD2-CB 4.41Å; L205-I214 HydrophobicContact CD2-CG2 4.09Å; L205-I214 HydrophobicContact CG-CB 4.43Å; L205-I214 PolarHBondContact O-N 3.36Å; L205-S215 PolarHBondContact N-O 3.32Å; L205-S215 PolarHBondContact O-N 2.81Å; L205-F266 HydrophobicContact CD1-CD1 3.57Å; L205-F266 HydrophobicContact CD1-CE1 4.09Å; L205-T270 HydrophobicContact CD1-CG2 4.1Å; L205-T270 HydrophobicContact CG-CG2 4.22Å
206	F	97.2	Very high	95.8	Very high	3 Å²	3	33 Å²	33	1%	0.013	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	147.6	-179.7	-54.8	-85.5	0	0	0	111.3	L204 F211 L212 V213 I231 S232 T270 Y271 M273	L204-F206 HydrophobicContact CB-CD2 4.23Å; L204-F206 HydrophobicContact CB-CE1 4.35Å; L204-F206 HydrophobicContact CB-CE2 3.49Å; L204-F206 VanDerWaalsContact CB-CE2 3.49Å; L204-F206 HydrophobicContact CB-CZ 3.57Å; L204-F206 HydrophobicContact CD1-CE1 4.31Å; L204-F206 HydrophobicContact CD1-CE2 4.05Å; L204-F206 HydrophobicContact CD1-CZ 3.44Å; L204-F206 VanDerWaalsContact CD1-CZ 3.44Å; L204-F206 HydrophobicContact CG-CE2 4.39Å; L204-F206 HydrophobicContact CG-CZ 4.13Å; F206-F211 HydrophobicContact CB-CD1 4.33Å; F206-F211 WeakPolarHBondContact CD1-O 3.45Å; F206-L212 CarbonylContact C-O 3.59Å; F206-L212 WeakPolarHBondContact CA-O 3.41Å; F206-V213 HydrophobicContact CD1-CG2 3.94Å; F206-V213 HydrophobicContact CE1-CG2 3.73Å; F206-I231 HydrophobicContact CE1-CG2 4.48Å; F206-I231 HydrophobicContact CE2-CG2 4.49Å; F206-I231 HydrophobicContact CZ-CG2 3.76Å; F206-S232 WeakPolarHBondContact CD1-OG 3.07Å; F206-S232 VanDerWaalsContact CE1-OG 3.26Å; F206-S232 WeakPolarHBondContact CE1-OG 3.45Å; F206-T270 CarbonylContact O-C 3.47Å; F206-T270 WeakPolarHBondContact O-CA 3.23Å; F206-T270 VanDerWaalsContact O-CB 3.23Å; F206-T270 WeakPolarHBondContact O-CB 3.25Å; F206-Y271 PolarHBondContact N-O 3.03Å; F206-Y271 PolarHBondContact O-N 3.43Å; F206-M273 HydrophobicContact CE2-CB 3.75Å
207	E	96	Very high	95.8	Very high	6 Å²	6	29.8 Å²	29.8	3%	0.028	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	137.3	166.2	-166.4	-78.8	130.3	0	0	110.6	F52 A209 T210 F211 L212 I214	F52-E207 HydrophobicContact CD1-CG 4.28Å; F52-E207 HydrophobicContact CD2-CB 4.36Å; F52-E207 HydrophobicContact CD2-CG 3.71Å; F52-E207 HydrophobicContact CE1-CB 4.2Å; F52-E207 HydrophobicContact CE1-CG 4.18Å; F52-E207 HydrophobicContact CE2-CB 3.7Å; F52-E207 HydrophobicContact CE2-CG 3.57Å; F52-E207 HydrophobicContact CG-CG 4.06Å; F52-E207 HydrophobicContact CZ-CB 3.6Å; F52-E207 HydrophobicContact CZ-CG 3.82Å; F52-E207 WeakPolarHBondContact O-CG 3.3Å; E207-A209 VanDerWaalsContact CD-N 3.27Å; E207-A209 WeakPolarHBondContact OE1-CB 3.5Å; E207-A209 PolarHBondContact OE1-N 2.86Å; E207-A209 PolarHBondContact OE2-N 2.94Å; E207-A209 VanDerWaalsContact OE2-N 3.13Å; E207-T210 VanDerWaalsContact OE2-CB 3.25Å; E207-T210 WeakPolarHBondContact OE2-CB 3.46Å; E207-T210 VanDerWaalsContact OE2-CG2 3.29Å; E207-T210 WeakPolarHBondContact OE2-CG2 3.43Å; E207-T210 PolarHBondContact OE2-N 2.88Å; E207-T210 PolarHBondContact OE2-OG1 3.42Å; E207-F211 WeakPolarHBondContact O-CA 3.36Å; E207-F211 PolarHBondContact O-N 2.83Å; E207-L212 PolarHBondContact N-O 2.73Å; E207-I214 HydrophobicContact CB-CD1 3.89Å; E207-I214 HydrophobicContact CB-CG1 4.23Å
208	R	94.3	Very high	95.7	Very high	94 Å²	94	26.2 Å²	26.2	36%	0.355	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-35.9	-165.2	-175.2	-178.7	-176.7	-168.7	-0.2	115.3	F211 K239 S268 N269 Y271	R208-F211 WeakPolarHBondContact O-CE2 3.2Å; R208-K239 PolarHBondContact O-NZ 3.36Å; R208-S268 WeakPolarHBondContact CD-O 3.45Å; R208-S268 PolarHBondContact NH1-O 3.02Å; R208-N269 WeakPolarHBondContact CB-O 3.44Å; R208-N269 PolarHBondContact N-O 2.81Å; R208-Y271 HydrophobicContact CB-CD2 4.19Å; R208-Y271 HydrophobicContact CB-CE2 4.41Å; R208-Y271 HydrophobicContact CG-CD2 3.85Å; R208-Y271 HydrophobicContact CG-CE2 3.6Å
209	A	93.4	Very high	95.5	Very high	43 Å²	43	29.3 Å²	29.3	36%	0.355	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-50	-179.2	0	0	0	0	0	110.8	E207 K236 K239	E207-A209 VanDerWaalsContact CD-N 3.27Å; E207-A209 WeakPolarHBondContact OE1-CB 3.5Å; E207-A209 PolarHBondContact OE1-N 2.86Å; E207-A209 PolarHBondContact OE2-N 2.94Å; E207-A209 VanDerWaalsContact OE2-N 3.13Å; A209-K236 PolarHBondContact O-NZ 2.85Å; A209-K239 PolarHBondContact O-NZ 3.4Å
210	T	94.8	Very high	95	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.006	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-23.5	-168.6	64.5	0	0	0	0	113.9	I27 F28 E207 L212	I27-T210 HydrophobicContact CG2-CG2 4.13Å; I27-T210 WeakPolarHBondContact O-CG2 3.17Å; F28-T210 HydrophobicContact CD1-CG2 3.54Å; F28-T210 HydrophobicContact CE1-CG2 3.78Å; F28-T210 HydrophobicContact CG-CG2 4.5Å; E207-T210 VanDerWaalsContact OE2-CB 3.25Å; E207-T210 WeakPolarHBondContact OE2-CB 3.46Å; E207-T210 VanDerWaalsContact OE2-CG2 3.29Å; E207-T210 WeakPolarHBondContact OE2-CG2 3.43Å; E207-T210 PolarHBondContact OE2-N 2.88Å; E207-T210 PolarHBondContact OE2-OG1 3.42Å; T210-L212 PolarHBondContact O-N 2.88Å; T210-L212 WeakPolarHBondContact OG1-CG 3.25Å; T210-L212 PolarHBondContact OG1-N 3.33Å
211	F	96.3	Very high	94.4	Very high	1 Å²	1	37.8 Å²	37.8	0%	0.004	19%	0.186	C	C	.	.			trans	60.1	20	-167.7	-70.5	-94.3	0	0	0	114.1	F206 E207 R208 V213 S232 I235 K236 K239 F249 Y271	F206-F211 HydrophobicContact CB-CD1 4.33Å; F206-F211 WeakPolarHBondContact CD1-O 3.45Å; E207-F211 WeakPolarHBondContact O-CA 3.36Å; E207-F211 PolarHBondContact O-N 2.83Å; R208-F211 WeakPolarHBondContact O-CE2 3.2Å; F211-V213 PolarHBondContact O-N 3.24Å; F211-S232 WeakPolarHBondContact O-CB 3.31Å; F211-S232 PolarHBondContact O-OG 2.82Å; F211-I235 HydrophobicContact CD1-CB 4.19Å; F211-I235 HydrophobicContact CD1-CG2 3.66Å; F211-I235 HydrophobicContact CE1-CB 4.29Å; F211-I235 HydrophobicContact CE1-CG2 3.28Å; F211-I235 HydrophobicContact CG-CG2 4.44Å; F211-I235 HydrophobicContact CZ-CG2 3.79Å; F211-K236 HydrophobicContact CD2-CD 4Å; F211-K239 HydrophobicContact CD2-CD 4.37Å; F211-K239 HydrophobicContact CE2-CD 3.39Å; F211-K239 HydrophobicContact CZ-CD 4.04Å; F211-F249 HydrophobicContact CZ-CD1 4.26Å; F211-F249 HydrophobicContact CZ-CE1 4.4Å; F211-Y271 HydrophobicContact CE1-CD1 4.38Å; F211-Y271 AromaticContact CE1-CD2 3.6Å; F211-Y271 HydrophobicContact CE1-CD2 3.6Å; F211-Y271 AromaticContact CE1-CE2 4Å; F211-Y271 HydrophobicContact CE1-CE2 4Å; F211-Y271 AromaticContact CE1-CG 3.84Å; F211-Y271 HydrophobicContact CE1-CG 3.84Å; F211-Y271 HydrophobicContact CE2-CD2 4.47Å; F211-Y271 HydrophobicContact CE2-CE2 4.33Å; F211-Y271 AromaticContact CZ-CD2 3.56Å; F211-Y271 HydrophobicContact CZ-CD2 3.56Å; F211-Y271 AromaticContact CZ-CE2 3.48Å; F211-Y271 HydrophobicContact CZ-CE2 3.48Å; F211-Y271 VanDerWaalsContact CZ-CE2 3.48Å; F211-Y271 HydrophobicContact CZ-CG 4.19Å
212	L	97.6	Very high	93.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.194	C	C	.	.			trans	-63.9	133.4	168.8	-67.2	178.6	0	0	0	109.6	I27 F28 F52 Y170 W173 V177 F206 E207 T210 I214	I27-L212 HydrophobicContact CD1-CD2 4.39Å; I27-L212 HydrophobicContact CG2-CD1 3.93Å; I27-L212 HydrophobicContact CG2-CD2 4.37Å; I27-L212 HydrophobicContact CG2-CG 4.25Å; F28-L212 HydrophobicContact CZ-CD1 4.5Å; F52-L212 HydrophobicContact CE2-CB 4.32Å; F52-L212 HydrophobicContact CE2-CD1 3.93Å; F52-L212 HydrophobicContact CZ-CB 4.15Å; F52-L212 HydrophobicContact CZ-CD1 4.29Å; Y170-L212 HydrophobicContact CD1-CD2 3.97Å; W173-L212 HydrophobicContact CB-CD1 3.83Å; W173-L212 HydrophobicContact CB-CD2 3.6Å; W173-L212 HydrophobicContact CB-CG 4.4Å; V177-L212 HydrophobicContact CG1-CD1 3.92Å; V177-L212 HydrophobicContact CG2-CB 4.35Å; V177-L212 HydrophobicContact CG2-CD1 4.11Å; F206-L212 CarbonylContact C-O 3.59Å; F206-L212 WeakPolarHBondContact CA-O 3.41Å; E207-L212 PolarHBondContact N-O 2.73Å; T210-L212 PolarHBondContact O-N 2.88Å; T210-L212 WeakPolarHBondContact OG1-CG 3.25Å; T210-L212 PolarHBondContact OG1-N 3.33Å; L212-I214 PolarHBondContact O-N 2.89Å
213	V	96.5	Very high	93.4	Very high	12 Å²	12	51.6 Å²	51.6	7%	0.073	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	124.3	172.5	-174.9	0	0	0	0	108.5	S174 F206 F211 F228	S174-V213 PolarHBondContact OG-N 2.88Å; S174-V213 PolarHBondContact OG-O 2.69Å; F206-V213 HydrophobicContact CD1-CG2 3.94Å; F206-V213 HydrophobicContact CE1-CG2 3.73Å; F211-V213 PolarHBondContact O-N 3.24Å; V213-F228 HydrophobicContact CG2-CB 3.82Å
214	I	95	Very high	93	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-47.9	173	-70.1	163.5	0	0	0	109.8	F52 L53 I181 L187 L205 E207 L212 T270	F52-I214 HydrophobicContact CE1-CG1 4.25Å; L53-I214 HydrophobicContact CD1-CD1 3.85Å; L53-I214 HydrophobicContact CD2-CD1 4.13Å; L53-I214 HydrophobicContact CD2-CG2 4.36Å; I181-I214 HydrophobicContact CD1-CB 4.35Å; I181-I214 HydrophobicContact CD1-CG1 4.2Å; I181-I214 HydrophobicContact CD1-CG2 3.79Å; L187-I214 HydrophobicContact CD1-CG2 4.03Å; L205-I214 HydrophobicContact CD2-CB 4.41Å; L205-I214 HydrophobicContact CD2-CG2 4.09Å; L205-I214 HydrophobicContact CG-CB 4.43Å; L205-I214 PolarHBondContact O-N 3.36Å; E207-I214 HydrophobicContact CB-CD1 3.89Å; E207-I214 HydrophobicContact CB-CG1 4.23Å; L212-I214 PolarHBondContact O-N 2.89Å; I214-T270 HydrophobicContact CD1-CG2 3.59Å
215	S	94.8	Very high	92.5	Very high	2 Å²	2	59.8 Å²	59.8	1%	0.014	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	157.5	-174.3	179.8	0	0	0	0	109.3	E188 L205	E188-S215 WeakPolarHBondContact CG-OG 3.34Å; L205-S215 PolarHBondContact N-O 3.32Å; L205-S215 PolarHBondContact O-N 2.81Å
216	H	95.3	Very high	92.2	Very high	75 Å²	75	61.1 Å²	61.1	35%	0.347	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	159.9	176.2	64.5	-80.9	0	0	0	111.9	V203 L204 F228	V203-H216 CarbonylContact O-C 3.43Å; V203-H216 VanDerWaalsContact O-CA 3.24Å; V203-H216 WeakPolarHBondContact O-CA 3.28Å; L204-H216 HydrophobicContact CD2-CB 3.33Å; H216-F228 HydrophobicContact CB-CE2 4.28Å; H216-F228 HydrophobicContact CB-CZ 4.48Å; H216-F228 AromaticContact CD2-CE2 3.3Å; H216-F228 WeakPolarHBondContact CD2-CE2 3.33Å; H216-F228 AromaticContact CD2-CZ 3.57Å; H216-F228 AromaticContact CE1-CE2 3.76Å; H216-F228 AromaticContact CG-CE2 3.57Å; H216-F228 AromaticContact ND1-CE2 3.84Å; H216-F228 AromaticContact NE2-CE2 3.45Å; H216-F228 WeakPolarHBondContact NE2-CE2 3.39Å
217	Y	95.6	Very high	92.1	Very high	44 Å²	44	64.2 Å²	64.2	17%	0.173	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	138.2	164.4	171.2	-93.4	0	0	0	108.2	R192 A195 E202 V203 C219	R192-Y217 HydrophobicContact CB-CD2 3.97Å; R192-Y217 HydrophobicContact CB-CE2 4.46Å; R192-Y217 HydrophobicContact CG-CD2 3.82Å; R192-Y217 HydrophobicContact CG-CE2 3.81Å; A195-Y217 HydrophobicContact CB-CD1 3.18Å; A195-Y217 HydrophobicContact CB-CD2 4.49Å; A195-Y217 HydrophobicContact CB-CE1 3.56Å; A195-Y217 HydrophobicContact CB-CG 3.7Å; E202-Y217 CarbonylContact C-O 3.57Å; E202-Y217 WeakPolarHBondContact CA-O 3.47Å; V203-Y217 PolarHBondContact N-O 3.13Å; V203-Y217 PolarHBondContact O-N 2.81Å; Y217-C219 HydrophobicContact CE1-CB 4.45Å
218	Q	93.6	Very high	92	Very high	58 Å²	58	65 Å²	65	27%	0.271	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	135.8	170.2	61.1	-178.1	-2.1	0	0	109.2	D201 E202	D201-Q218 WeakPolarHBondContact O-CA 3.13Å; E202-Q218 HydrophobicContact CG-CB 4.48Å
219	C	89.3	Confident	92.1	Very high	75 Å²	75	61.6 Å²	61.6	51%	0.507	30%	0.295	S	S	.	.	S	Bend	trans	-72.8	-36.8	176.1	-174.4	0	0	0	0	111.4	D201 Y217	D201-C219 WeakPolarHBondContact O-CB 3.43Å; D201-C219 PolarHBondContact O-N 3.39Å; Y217-C219 HydrophobicContact CE1-CB 4.45Å
220	K	85.5	Confident	92.3	Very high	151 Å²	151	62.8 Å²	62.8	66%	0.657	29%	0.292	S	S	*	.	S	Bend	trans	-130.6	140.6	-179	-63.8	176.4	-175.8	168.4	0	110
221	E	84.2	Confident	92.3	Very high	176 Å²	176	63.8 Å²	63.8	82%	0.822	30%	0.297	S	S	*	.			trans	-61.7	137.3	169.6	-69.8	-170.7	168	0	0	110.4
222	Q	83.5	Confident	92.3	Very high	88 Å²	88	63.8 Å²	63.8	41%	0.411	30%	0.297	S	S	.	.			trans	-95.4	150.9	-179.7	-63.9	-65.1	-24.2	0	0	110.5	D224	Q222-D224 VanDerWaalsContact C-N 3.25Å; Q222-D224 PolarHBondContact O-N 3.25Å
223	R	86.1	Confident	92.2	Very high	251 Å²	251	65.2 Å²	65.2	95%	0.947	31%	0.305	S	S	*	.	S	Bend	trans	-62.7	-34.2	177.9	-64.8	-177.7	-178.6	178.5	0.1	112.6
224	D	90.4	Very high	92.1	Very high	62 Å²	62	69.9 Å²	69.9	33%	0.332	33%	0.328	S	S	.	.			trans	-90.8	104.3	-178	-174	-1.3	0	0	0	110.6	Q222 H226 R227 K230	Q222-D224 VanDerWaalsContact C-N 3.25Å; Q222-D224 PolarHBondContact O-N 3.25Å; D224-H226 PolarHBondContact O-N 2.76Å; D224-H226 PolarHBondContact OD1-N 2.88Å; D224-R227 HydrophobicContact CB-CB 4.19Å; D224-R227 VanDerWaalsContact O-CB 3.25Å; D224-R227 WeakPolarHBondContact O-CB 3.45Å; D224-R227 PolarHBondContact O-N 3.04Å; D224-K230 VanDerWaalsContact CG-NZ 3.25Å; D224-K230 IonicContact OD1-NZ 3.87Å; D224-K230 PolarHBondContact OD1-NZ 2.92Å; D224-K230 VanDerWaalsContact OD1-NZ 3.07Å; D224-K230 VanDerWaalsContact OD2-CD 3.32Å; D224-K230 WeakPolarHBondContact OD2-CD 3.47Å; D224-K230 WeakPolarHBondContact OD2-CE 3.3Å; D224-K230 IonicContact OD2-NZ 2.74Å; D224-K230 PolarHBondContact OD2-NZ 2.85Å
225	V	86.6	Confident	92.1	Very high	111 Å²	111	70.1 Å²	70.1	67%	0.673	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-20.2	-179.2	-177.5	0	0	0	0	112.5
226	H	91	Very high	92.1	Very high	29 Å²	29	70.1 Å²	70.1	13%	0.134	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	15.4	-178.2	-67.9	-72.1	0	0	0	112.8	E167 K171 D224 F228 E229 K230	E167-H226 HydrophobicContact CG-CB 4Å; K171-H226 VanDerWaalsContact CD-CE1 3.48Å; K171-H226 WeakPolarHBondContact CD-CE1 3.33Å; K171-H226 WeakPolarHBondContact CD-ND1 3.12Å; K171-H226 PolarHBondContact NZ-CE1 2.76Å; D224-H226 PolarHBondContact O-N 2.76Å; D224-H226 PolarHBondContact OD1-N 2.88Å; H226-F228 PolarHBondContact O-N 2.86Å; H226-E229 WeakPolarHBondContact CA-OE2 3.47Å; H226-E229 PolarHBondContact O-N 3.22Å; H226-K230 WeakPolarHBondContact O-CG 3.42Å; H226-K230 PolarHBondContact O-N 3.24Å
227	R	94	Very high	92	Very high	67 Å²	67	69.7 Å²	69.7	25%	0.253	33%	0.328	S	S	.	.	H	α-helix	trans	-54.4	-47.6	-173.5	176.1	179.7	170.9	77.3	-3.9	112.9	E202 D224 E229 K230 I231	E202-R227 IonicContact OE1-NE 3.64Å; E202-R227 PolarHBondContact OE1-NE 2.97Å; E202-R227 IonicContact OE2-CZ 3.2Å; E202-R227 IonicContact OE2-NE 3.4Å; E202-R227 PolarHBondContact OE2-NE 3.43Å; E202-R227 IonicContact OE2-NH2 3.84Å; E202-R227 PolarHBondContact OE2-NH2 3.43Å; D224-R227 HydrophobicContact CB-CB 4.19Å; D224-R227 VanDerWaalsContact O-CB 3.25Å; D224-R227 WeakPolarHBondContact O-CB 3.45Å; D224-R227 PolarHBondContact O-N 3.04Å; R227-E229 VanDerWaalsContact C-N 3.35Å; R227-E229 PolarHBondContact O-N 3.34Å; R227-K230 PolarHBondContact O-N 3.01Å; R227-I231 HydrophobicContact CG-CD1 3.95Å; R227-I231 VanDerWaalsContact O-CG1 3.3Å; R227-I231 WeakPolarHBondContact O-CG1 3.4Å; R227-I231 PolarHBondContact O-N 3.12Å
228	F	95	Very high	92	Very high	23 Å²	23	72 Å²	72	10%	0.101	34%	0.338	C	S	.	.	H	α-helix	trans	-68.5	-38.7	-173.5	-50.9	-33.5	0	0	0	111.4	E202 L204 V213 H216 H226 I231 S232	E202-F228 HydrophobicContact CG-CE1 4.49Å; E202-F228 WeakPolarHBondContact OE1-CD1 3.35Å; E202-F228 WeakPolarHBondContact OE1-CE1 3.44Å; L204-F228 HydrophobicContact CD1-CD1 3.78Å; L204-F228 HydrophobicContact CD1-CE1 4.48Å; L204-F228 HydrophobicContact CD1-CG 4.41Å; L204-F228 HydrophobicContact CD2-CD1 3.47Å; L204-F228 VanDerWaalsContact CD2-CD1 3.47Å; L204-F228 HydrophobicContact CD2-CD2 4.41Å; L204-F228 HydrophobicContact CD2-CE1 3.62Å; L204-F228 HydrophobicContact CD2-CG 3.91Å; L204-F228 HydrophobicContact CD2-CZ 4.13Å; L204-F228 HydrophobicContact CG-CD1 4.28Å; V213-F228 HydrophobicContact CG2-CB 3.82Å; H216-F228 HydrophobicContact CB-CE2 4.28Å; H216-F228 HydrophobicContact CB-CZ 4.48Å; H216-F228 AromaticContact CD2-CE2 3.3Å; H216-F228 WeakPolarHBondContact CD2-CE2 3.33Å; H216-F228 AromaticContact CD2-CZ 3.57Å; H216-F228 AromaticContact CE1-CE2 3.76Å; H216-F228 AromaticContact CG-CE2 3.57Å; H216-F228 AromaticContact ND1-CE2 3.84Å; H216-F228 AromaticContact NE2-CE2 3.45Å; H216-F228 WeakPolarHBondContact NE2-CE2 3.39Å; H226-F228 PolarHBondContact O-N 2.86Å; F228-I231 WeakPolarHBondContact O-CB 3.44Å; F228-I231 PolarHBondContact O-N 3.27Å; F228-S232 PolarHBondContact O-N 3.2Å; F228-S232 PolarHBondContact O-OG 2.94Å
229	E	95.7	Very high	92	Very high	22 Å²	22	71 Å²	71	10%	0.103	33%	0.334	C	S	.	.	H	α-helix	trans	-72.7	-34.5	178.7	-62	88	174.1	0	0	112.4	E167 K171 H226 R227 I231 S232 N233	E167-E229 HydrophobicContact CB-CB 3.86Å; E167-E229 HydrophobicContact CG-CB 4.23Å; K171-E229 HydrophobicContact CB-CG 3.75Å; K171-E229 HydrophobicContact CG-CG 4.45Å; H226-E229 WeakPolarHBondContact CA-OE2 3.47Å; H226-E229 PolarHBondContact O-N 3.22Å; R227-E229 VanDerWaalsContact C-N 3.35Å; R227-E229 PolarHBondContact O-N 3.34Å; E229-I231 VanDerWaalsContact C-N 3.32Å; E229-S232 WeakPolarHBondContact O-CB 3.45Å; E229-S232 PolarHBondContact O-N 2.8Å; E229-N233 WeakPolarHBondContact O-CB 3.42Å; E229-N233 PolarHBondContact O-N 2.89Å
230	K	96.7	Very high	92.2	Very high	69 Å²	69	68.3 Å²	68.3	30%	0.3	31%	0.314	S	S	.	.	H	α-helix	trans	-60.1	-45.1	168.9	-73.7	175.1	-173.6	169.2	0	110.7	E167 D224 H226 R227 N233 I234	E167-K230 HydrophobicContact CB-CG 4.05Å; E167-K230 HydrophobicContact CG-CG 3.7Å; E167-K230 WeakPolarHBondContact OE1-CE 3.45Å; E167-K230 IonicContact OE1-NZ 3.04Å; D224-K230 VanDerWaalsContact CG-NZ 3.25Å; D224-K230 IonicContact OD1-NZ 3.87Å; D224-K230 PolarHBondContact OD1-NZ 2.92Å; D224-K230 VanDerWaalsContact OD1-NZ 3.07Å; D224-K230 VanDerWaalsContact OD2-CD 3.32Å; D224-K230 WeakPolarHBondContact OD2-CD 3.47Å; D224-K230 WeakPolarHBondContact OD2-CE 3.3Å; D224-K230 IonicContact OD2-NZ 2.74Å; D224-K230 PolarHBondContact OD2-NZ 2.85Å; H226-K230 WeakPolarHBondContact O-CG 3.42Å; H226-K230 PolarHBondContact O-N 3.24Å; R227-K230 PolarHBondContact O-N 3.01Å; K230-N233 PolarHBondContact O-N 2.87Å; K230-I234 WeakPolarHBondContact O-CB 3.1Å; K230-I234 WeakPolarHBondContact O-CD1 3.3Å; K230-I234 WeakPolarHBondContact O-CG1 3.19Å; K230-I234 PolarHBondContact O-N 3.02Å
231	I	96.2	Very high	92.6	Very high	22 Å²	22	63.8 Å²	63.8	11%	0.113	30%	0.301	C	S	.	.	H	α-helix	trans	-60.1	-49.1	175.1	-67.5	162.4	0	0	0	110.2	L204 F206 R227 F228 E229 N233 I234 I235 M273	L204-I231 HydrophobicContact CD1-CD1 3.89Å; F206-I231 HydrophobicContact CE1-CG2 4.48Å; F206-I231 HydrophobicContact CE2-CG2 4.49Å; F206-I231 HydrophobicContact CZ-CG2 3.76Å; R227-I231 HydrophobicContact CG-CD1 3.95Å; R227-I231 VanDerWaalsContact O-CG1 3.3Å; R227-I231 WeakPolarHBondContact O-CG1 3.4Å; R227-I231 PolarHBondContact O-N 3.12Å; F228-I231 WeakPolarHBondContact O-CB 3.44Å; F228-I231 PolarHBondContact O-N 3.27Å; E229-I231 VanDerWaalsContact C-N 3.32Å; I231-N233 VanDerWaalsContact C-N 3.31Å; I231-N233 PolarHBondContact O-N 3.14Å; I231-I234 PolarHBondContact O-N 2.91Å; I231-I235 HydrophobicContact CG2-CG1 4.09Å; I231-I235 WeakPolarHBondContact O-CB 3.34Å; I231-I235 VanDerWaalsContact O-CG1 3.28Å; I231-I235 WeakPolarHBondContact O-CG1 3.25Å; I231-I235 PolarHBondContact O-N 3.1Å; I231-M273 HydrophobicContact CD1-CE 3.84Å; I231-M273 HydrophobicContact CD1-SD 4.1Å; I231-M273 HydrophobicContact CG2-SD 3.7Å
232	S	96	Very high	93.1	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-52.3	-48.2	175.6	-69.5	0	0	0	0	112.3	F206 F211 F228 E229 K236	F206-S232 WeakPolarHBondContact CD1-OG 3.07Å; F206-S232 VanDerWaalsContact CE1-OG 3.26Å; F206-S232 WeakPolarHBondContact CE1-OG 3.45Å; F211-S232 WeakPolarHBondContact O-CB 3.31Å; F211-S232 PolarHBondContact O-OG 2.82Å; F228-S232 PolarHBondContact O-N 3.2Å; F228-S232 PolarHBondContact O-OG 2.94Å; E229-S232 WeakPolarHBondContact O-CB 3.45Å; E229-S232 PolarHBondContact O-N 2.8Å; S232-K236 VanDerWaalsContact O-CB 3.26Å; S232-K236 WeakPolarHBondContact O-CB 3.34Å; S232-K236 PolarHBondContact O-N 2.76Å
233	N	94.6	Very high	93.5	Very high	30 Å²	30	55.4 Å²	55.4	16%	0.16	27%	0.271	C	S	.	.	H	α-helix	trans	-66	-48.8	179.8	-167.4	9.2	0	0	0	111.2	Y170 E229 K230 I231 I235 K236 Q237	Y170-N233 HydrophobicContact CD2-CB 4.05Å; Y170-N233 HydrophobicContact CE2-CB 3.89Å; E229-N233 WeakPolarHBondContact O-CB 3.42Å; E229-N233 PolarHBondContact O-N 2.89Å; K230-N233 PolarHBondContact O-N 2.87Å; I231-N233 VanDerWaalsContact C-N 3.31Å; I231-N233 PolarHBondContact O-N 3.14Å; N233-I235 PolarHBondContact O-N 2.86Å; N233-K236 PolarHBondContact O-N 2.85Å; N233-Q237 WeakPolarHBondContact O-CG 3.23Å; N233-Q237 PolarHBondContact O-N 3.41Å; N233-Q237 PolarHBondContact OD1-NE2 3.41Å
234	I	94.7	Very high	93.8	Very high	110 Å²	110	49.9 Å²	49.9	56%	0.564	25%	0.254	S	S	*	.	H	α-helix	trans	-56.1	-49.9	178.4	-70.7	164	0	0	0	111	K230 I231 Q237 F238	K230-I234 WeakPolarHBondContact O-CB 3.1Å; K230-I234 WeakPolarHBondContact O-CD1 3.3Å; K230-I234 WeakPolarHBondContact O-CG1 3.19Å; K230-I234 PolarHBondContact O-N 3.02Å; I231-I234 PolarHBondContact O-N 2.91Å; I234-Q237 PolarHBondContact O-N 2.8Å; I234-F238 WeakPolarHBondContact O-CB 3.1Å; I234-F238 PolarHBondContact O-N 2.94Å
235	I	95.2	Very high	93.9	Very high	8 Å²	8	53.8 Å²	53.8	4%	0.041	27%	0.274	C	S	.	.	H	α-helix	trans	-69.6	-36.1	-177.8	-60.2	-60.4	0	0	0	111.2	F211 I231 N233 F238 K239 F249 M252 I263	F211-I235 HydrophobicContact CD1-CB 4.19Å; F211-I235 HydrophobicContact CD1-CG2 3.66Å; F211-I235 HydrophobicContact CE1-CB 4.29Å; F211-I235 HydrophobicContact CE1-CG2 3.28Å; F211-I235 HydrophobicContact CG-CG2 4.44Å; F211-I235 HydrophobicContact CZ-CG2 3.79Å; I231-I235 HydrophobicContact CG2-CG1 4.09Å; I231-I235 WeakPolarHBondContact O-CB 3.34Å; I231-I235 VanDerWaalsContact O-CG1 3.28Å; I231-I235 WeakPolarHBondContact O-CG1 3.25Å; I231-I235 PolarHBondContact O-N 3.1Å; N233-I235 PolarHBondContact O-N 2.86Å; I235-F238 PolarHBondContact O-N 2.9Å; I235-K239 WeakPolarHBondContact O-CB 3.23Å; I235-K239 PolarHBondContact O-N 2.89Å; I235-F249 HydrophobicContact CG2-CD1 4.36Å; I235-F249 HydrophobicContact CG2-CE1 3.71Å; I235-F249 HydrophobicContact CG2-CZ 4.27Å; I235-M252 HydrophobicContact CD1-CE 4.36Å; I235-M252 HydrophobicContact CD1-SD 4.22Å; I235-I263 HydrophobicContact CD1-CD1 3.29Å; I235-I263 HydrophobicContact CG1-CD1 3.7Å
236	K	94.5	Very high	94.2	Very high	1 Å²	1	53.3 Å²	53.3	0%	0.004	28%	0.282	C	S	.	.	H	α-helix	trans	-59.5	-51.2	171.1	-172.7	86.6	178.4	-159.6	0	110.7	I27 N30 Y170 A209 F211 S232 N233 F238 K239 L240	I27-K236 PolarHBondContact O-NZ 2.84Å; N30-K236 WeakPolarHBondContact OD1-CE 3.21Å; N30-K236 PolarHBondContact OD1-NZ 2.89Å; Y170-K236 WeakPolarHBondContact OH-CG 3.39Å; A209-K236 PolarHBondContact O-NZ 2.85Å; F211-K236 HydrophobicContact CD2-CD 4Å; S232-K236 VanDerWaalsContact O-CB 3.26Å; S232-K236 WeakPolarHBondContact O-CB 3.34Å; S232-K236 PolarHBondContact O-N 2.76Å; N233-K236 PolarHBondContact O-N 2.85Å; K236-F238 VanDerWaalsContact C-N 3.3Å; K236-F238 PolarHBondContact O-N 3.39Å; K236-K239 WeakPolarHBondContact O-CB 3.4Å; K236-K239 PolarHBondContact O-N 3.13Å; K236-L240 HydrophobicContact CG-CD1 4.34Å; K236-L240 WeakPolarHBondContact O-CG 3.33Å; K236-L240 PolarHBondContact O-N 2.81Å
237	Q	93.8	Very high	94.4	Very high	67 Å²	67	54.3 Å²	54.3	31%	0.313	30%	0.295	S	S	.	.	H	α-helix	trans	-61.6	-39.3	179.7	-65.1	-51.4	-39	0	0	112	I32 N233 I234 L240 S241	I32-Q237 VanDerWaalsContact CG2-OE1 3.3Å; N233-Q237 WeakPolarHBondContact O-CG 3.23Å; N233-Q237 PolarHBondContact O-N 3.41Å; N233-Q237 PolarHBondContact OD1-NE2 3.41Å; I234-Q237 PolarHBondContact O-N 2.8Å; Q237-L240 PolarHBondContact O-N 3.3Å; Q237-S241 WeakPolarHBondContact O-CB 3.3Å; Q237-S241 PolarHBondContact O-N 3.1Å; Q237-S241 PolarHBondContact O-OG 3.1Å
238	F	94.7	Very high	94.3	Very high	91 Å²	91	55.3 Å²	55.3	40%	0.399	31%	0.313	S	S	.	.	H	α-helix	trans	-62.1	-48.6	174.3	-175.1	-106.1	0	0	0	111.4	I234 I235 K236 L240 S241 C242 F249 M252	I234-F238 WeakPolarHBondContact O-CB 3.1Å; I234-F238 PolarHBondContact O-N 2.94Å; I235-F238 PolarHBondContact O-N 2.9Å; K236-F238 VanDerWaalsContact C-N 3.3Å; K236-F238 PolarHBondContact O-N 3.39Å; F238-L240 VanDerWaalsContact C-N 3.33Å; F238-L240 PolarHBondContact O-N 2.84Å; F238-S241 WeakPolarHBondContact O-CA 3.15Å; F238-S241 WeakPolarHBondContact O-CB 3.4Å; F238-S241 PolarHBondContact O-N 2.78Å; F238-C242 PolarHBondContact O-N 2.89Å; F238-C242 PolarHBondContact O-SG 2.54Å; F238-C242 VanDerWaalsContact O-SG 3.39Å; F238-F249 AromaticContact CD1-CD2 3.76Å; F238-F249 HydrophobicContact CD1-CD2 3.76Å; F238-F249 AromaticContact CD1-CE2 3.88Å; F238-F249 HydrophobicContact CD1-CE2 3.88Å; F238-F249 HydrophobicContact CD1-CG 4.41Å; F238-F249 AromaticContact CE1-CD2 3.59Å; F238-F249 HydrophobicContact CE1-CD2 3.59Å; F238-F249 AromaticContact CE1-CE2 3.74Å; F238-F249 HydrophobicContact CE1-CE2 3.74Å; F238-M252 HydrophobicContact CD1-CE 3.39Å; F238-M252 HydrophobicContact CD2-CE 4.31Å; F238-M252 HydrophobicContact CE1-CE 3.31Å; F238-M252 HydrophobicContact CE2-CE 4.26Å; F238-M252 HydrophobicContact CG-CE 3.91Å; F238-M252 HydrophobicContact CZ-CE 3.78Å
239	K	94.3	Very high	94.2	Very high	39 Å²	39	55 Å²	55	17%	0.17	31%	0.311	C	S	.	.	H	α-helix	trans	-56.4	-44.7	175.1	174.1	-179.9	174.2	-171.2	0	112.1	R208 A209 F211 I235 K236 S241 C242 S243 F249	R208-K239 PolarHBondContact O-NZ 3.36Å; A209-K239 PolarHBondContact O-NZ 3.4Å; F211-K239 HydrophobicContact CD2-CD 4.37Å; F211-K239 HydrophobicContact CE2-CD 3.39Å; F211-K239 HydrophobicContact CZ-CD 4.04Å; I235-K239 WeakPolarHBondContact O-CB 3.23Å; I235-K239 PolarHBondContact O-N 2.89Å; K236-K239 WeakPolarHBondContact O-CB 3.4Å; K236-K239 PolarHBondContact O-N 3.13Å; K239-S241 VanDerWaalsContact C-N 3.25Å; K239-S241 PolarHBondContact O-N 3.35Å; K239-C242 WeakPolarHBondContact O-CB 3.36Å; K239-C242 PolarHBondContact O-N 3.08Å; K239-S243 PolarHBondContact O-N 3.38Å; K239-S243 PolarHBondContact O-OG 3.22Å; K239-F249 HydrophobicContact CB-CB 4.11Å; K239-F249 HydrophobicContact CB-CD1 4.49Å; K239-F249 HydrophobicContact CG-CB 4.14Å
240	L	93	Very high	94.1	Very high	17 Å²	17	59.7 Å²	59.7	9%	0.089	33%	0.333	C	S	.	.	H	α-helix	trans	-64.8	-32.1	177.2	-64	-180	0	0	0	112.1	N30 I32 K236 Q237 F238 S243 K244	N30-L240 HydrophobicContact CB-CD2 3.62Å; I32-L240 HydrophobicContact CG2-CD1 3.65Å; K236-L240 HydrophobicContact CG-CD1 4.34Å; K236-L240 WeakPolarHBondContact O-CG 3.33Å; K236-L240 PolarHBondContact O-N 2.81Å; Q237-L240 PolarHBondContact O-N 3.3Å; F238-L240 VanDerWaalsContact C-N 3.33Å; F238-L240 PolarHBondContact O-N 2.84Å; L240-S243 PolarHBondContact O-N 2.85Å; L240-K244 WeakPolarHBondContact O-CG 3.42Å; L240-K244 PolarHBondContact O-N 3.27Å
241	S	94.1	Very high	94	Very high	56 Å²	56	59.7 Å²	59.7	39%	0.392	34%	0.342	S	S	.	.	H	α-helix	trans	-69.4	-41.1	174.4	-57.7	0	0	0	0	111.6	Q237 F238 K239 S243 K244	Q237-S241 WeakPolarHBondContact O-CB 3.3Å; Q237-S241 PolarHBondContact O-N 3.1Å; Q237-S241 PolarHBondContact O-OG 3.1Å; F238-S241 WeakPolarHBondContact O-CA 3.15Å; F238-S241 WeakPolarHBondContact O-CB 3.4Å; F238-S241 PolarHBondContact O-N 2.78Å; K239-S241 VanDerWaalsContact C-N 3.25Å; K239-S241 PolarHBondContact O-N 3.35Å; S241-S243 VanDerWaalsContact C-N 3.34Å; S241-S243 PolarHBondContact O-N 2.93Å; S241-K244 WeakPolarHBondContact O-CB 3.4Å; S241-K244 PolarHBondContact O-N 2.99Å
242	C	95	Very high	94	Very high	20 Å²	20	61 Å²	61	14%	0.135	35%	0.348	C	S	.	.	H	α-helix	trans	-58.9	-43.9	171.2	-63.1	0	0	0	0	111.9	F238 K239 K244 L245 A246 A247	F238-C242 PolarHBondContact O-N 2.89Å; F238-C242 PolarHBondContact O-SG 2.54Å; F238-C242 VanDerWaalsContact O-SG 3.39Å; K239-C242 WeakPolarHBondContact O-CB 3.36Å; K239-C242 PolarHBondContact O-N 3.08Å; C242-K244 PolarHBondContact O-N 3.07Å; C242-L245 CarbonylContact O-C 3.47Å; C242-L245 WeakPolarHBondContact O-CA 3.05Å; C242-L245 WeakPolarHBondContact O-CB 3.43Å; C242-L245 PolarHBondContact O-N 3.09Å; C242-A246 PolarHBondContact O-N 2.9Å; C242-A247 CarbonylContact C-O 3.6Å; C242-A247 HydrophobicContact CB-CB 4.39Å; C242-A247 PolarHBondContact O-N 2.56Å
243	S	92.2	Very high	94	Very high	68 Å²	68	65.3 Å²	65.3	48%	0.476	37%	0.368	S	S	.	.	H	α-helix	trans	-60	-33.5	179.4	-62.6	0	0	0	0	113.1	K239 L240 S241 L245 A246 A247	K239-S243 PolarHBondContact O-N 3.38Å; K239-S243 PolarHBondContact O-OG 3.22Å; L240-S243 PolarHBondContact O-N 2.85Å; S241-S243 VanDerWaalsContact C-N 3.34Å; S241-S243 PolarHBondContact O-N 2.93Å; S243-L245 PolarHBondContact O-N 3.21Å; S243-A246 PolarHBondContact O-N 3.38Å; S243-A247 PolarHBondContact N-O 3.4Å
244	K	91.6	Very high	94	Very high	135 Å²	135	67.1 Å²	67.1	59%	0.587	38%	0.38	S	S	*	.	H	α-helix	trans	-65.8	-24.6	175.2	-69.8	169.5	-179	163.1	0	112.8	L240 S241 C242 A246	L240-K244 WeakPolarHBondContact O-CG 3.42Å; L240-K244 PolarHBondContact O-N 3.27Å; S241-K244 WeakPolarHBondContact O-CB 3.4Å; S241-K244 PolarHBondContact O-N 2.99Å; C242-K244 PolarHBondContact O-N 3.07Å; K244-A246 VanDerWaalsContact C-N 3.28Å
245	L	93.4	Very high	94	Very high	144 Å²	144	67 Å²	67	75%	0.754	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	14.6	174.9	-57.6	175.7	0	0	0	112	C242 S243 A247	C242-L245 CarbonylContact O-C 3.47Å; C242-L245 WeakPolarHBondContact O-CA 3.05Å; C242-L245 WeakPolarHBondContact O-CB 3.43Å; C242-L245 PolarHBondContact O-N 3.09Å; S243-L245 PolarHBondContact O-N 3.21Å; L245-A247 PolarHBondContact O-N 2.84Å; L245-A247 VanDerWaalsContact O-N 3.11Å
246	A	93.6	Very high	94	Very high	102 Å²	102	70 Å²	70	84%	0.843	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	25.5	-172.8	0	0	0	0	0	113.8	C242 S243 K244	C242-A246 PolarHBondContact O-N 2.9Å; S243-A246 PolarHBondContact O-N 3.38Å; K244-A246 VanDerWaalsContact C-N 3.28Å
247	A	94.1	Very high	93.9	Very high	49 Å²	49	75.2 Å²	75.2	41%	0.405	43%	0.426	S	S	.	.			trans	-104.8	150.1	177.1	0	0	0	0	0	110.9	C242 S243 L245	C242-A247 CarbonylContact C-O 3.6Å; C242-A247 HydrophobicContact CB-CB 4.39Å; C242-A247 PolarHBondContact O-N 2.56Å; S243-A247 PolarHBondContact N-O 3.4Å; L245-A247 PolarHBondContact O-N 2.84Å; L245-A247 VanDerWaalsContact O-N 3.11Å
248	S	91.1	Very high	93.8	Very high	88 Å²	88	77.6 Å²	77.6	62%	0.615	44%	0.441	S	S	*	.			trans	-102.1	128.9	173	61.4	0	0	0	0	110.2	Q250	S248-Q250 PolarHBondContact O-N 2.84Å
249	F	93.5	Very high	93.8	Very high	16 Å²	16	76.7 Å²	76.7	7%	0.07	44%	0.437	C	S	.	.			trans	-67.6	126.9	168.8	179.8	-117.2	0	0	0	109.2	F211 I235 F238 K239 S251 M252 I263 Y271	F211-F249 HydrophobicContact CZ-CD1 4.26Å; F211-F249 HydrophobicContact CZ-CE1 4.4Å; I235-F249 HydrophobicContact CG2-CD1 4.36Å; I235-F249 HydrophobicContact CG2-CE1 3.71Å; I235-F249 HydrophobicContact CG2-CZ 4.27Å; F238-F249 AromaticContact CD1-CD2 3.76Å; F238-F249 HydrophobicContact CD1-CD2 3.76Å; F238-F249 AromaticContact CD1-CE2 3.88Å; F238-F249 HydrophobicContact CD1-CE2 3.88Å; F238-F249 HydrophobicContact CD1-CG 4.41Å; F238-F249 AromaticContact CE1-CD2 3.59Å; F238-F249 HydrophobicContact CE1-CD2 3.59Å; F238-F249 AromaticContact CE1-CE2 3.74Å; F238-F249 HydrophobicContact CE1-CE2 3.74Å; K239-F249 HydrophobicContact CB-CB 4.11Å; K239-F249 HydrophobicContact CB-CD1 4.49Å; K239-F249 HydrophobicContact CG-CB 4.14Å; F249-S251 VanDerWaalsContact CE2-O 3.31Å; F249-S251 WeakPolarHBondContact CE2-O 3.11Å; F249-M252 HydrophobicContact CE2-CB 3.86Å; F249-M252 HydrophobicContact CE2-CE 4.09Å; F249-M252 HydrophobicContact CZ-CB 3.9Å; F249-M252 HydrophobicContact CZ-CE 4.49Å; F249-I263 HydrophobicContact CE1-CG2 4.09Å; F249-I263 HydrophobicContact CZ-CG2 4.04Å; F249-Y271 HydrophobicContact CD1-CE1 4.05Å; F249-Y271 AromaticContact CD1-CZ 3.96Å; F249-Y271 HydrophobicContact CE1-CD1 4.41Å; F249-Y271 AromaticContact CE1-CE1 3.78Å; F249-Y271 HydrophobicContact CE1-CE1 3.78Å; F249-Y271 PolarHBondContact O-OH 2.98Å
250	Q	93.3	Very high	94	Very high	121 Å²	121	75 Å²	75	57%	0.565	43%	0.43	S	S	*	.			trans	-119.2	-49.5	179.3	-65.1	-172.3	-1.9	0	0	111.9	S248 I265 Y271	S248-Q250 PolarHBondContact O-N 2.84Å; Q250-I265 HydrophobicContact CB-CD1 4.34Å; Q250-I265 WeakPolarHBondContact O-CG1 3.44Å; Q250-I265 PolarHBondContact O-N 2.76Å; Q250-Y271 WeakPolarHBondContact O-CE1 3.44Å
251	S	95.4	Very high	94.2	Very high	69 Å²	69	74.6 Å²	74.6	48%	0.483	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	165.3	178.9	60.2	0	0	0	0	111.1	F249 I263	F249-S251 VanDerWaalsContact CE2-O 3.31Å; F249-S251 WeakPolarHBondContact CE2-O 3.11Å; S251-I263 CarbonylContact C-O 3.5Å; S251-I263 WeakPolarHBondContact CA-O 3.1Å; S251-I263 WeakPolarHBondContact CB-O 3.24Å
252	M	95.9	Very high	94.4	Very high	49 Å²	49	72 Å²	72	24%	0.241	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	135.9	175.2	-175.2	-179.9	-71.7	0	0	109.2	I235 F238 F249 V254 I263	I235-M252 HydrophobicContact CD1-CE 4.36Å; I235-M252 HydrophobicContact CD1-SD 4.22Å; F238-M252 HydrophobicContact CD1-CE 3.39Å; F238-M252 HydrophobicContact CD2-CE 4.31Å; F238-M252 HydrophobicContact CE1-CE 3.31Å; F238-M252 HydrophobicContact CE2-CE 4.26Å; F238-M252 HydrophobicContact CG-CE 3.91Å; F238-M252 HydrophobicContact CZ-CE 3.78Å; F249-M252 HydrophobicContact CE2-CB 3.86Å; F249-M252 HydrophobicContact CE2-CE 4.09Å; F249-M252 HydrophobicContact CZ-CB 3.9Å; F249-M252 HydrophobicContact CZ-CE 4.49Å; M252-V254 HydrophobicContact CG-CG2 3.95Å; M252-V254 HydrophobicContact SD-CG2 3.92Å; M252-I263 HydrophobicContact CB-CB 4.3Å; M252-I263 PolarHBondContact N-O 3.34Å; M252-I263 PolarHBondContact O-N 2.85Å
253	E	96.4	Very high	94.5	Very high	91 Å²	91	71.6 Å²	71.6	43%	0.425	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	129.5	166.8	178.3	177.2	165.3	0	0	108.5	R255 A261 F262 S283	E253-R255 IonicContact OE1-NE 2.71Å; E253-A261 CarbonylContact C-O 3.53Å; E253-A261 WeakPolarHBondContact CA-O 3.43Å; E253-F262 HydrophobicContact CB-CD1 4.25Å; E253-F262 VanDerWaalsContact CD-CE1 3.41Å; E253-F262 HydrophobicContact CG-CD1 3.83Å; E253-F262 HydrophobicContact CG-CE1 3.65Å; E253-S283 WeakPolarHBondContact OE1-CB 3.4Å; E253-S283 PolarHBondContact OE1-OG 2.8Å
254	V	95.1	Very high	94.7	Very high	69 Å²	69	70 Å²	70	42%	0.418	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	115.8	173.9	-178.2	0	0	0	0	107.9	M252 A260 A261	M252-V254 HydrophobicContact CG-CG2 3.95Å; M252-V254 HydrophobicContact SD-CG2 3.92Å; V254-A260 CarbonylContact O-C 3.06Å; V254-A260 WeakPolarHBondContact O-CA 3.49Å; V254-A261 PolarHBondContact N-O 3.29Å; V254-A261 PolarHBondContact O-N 2.78Å
255	R	94.4	Very high	94.9	Very high	108 Å²	108	65.1 Å²	65.1	41%	0.408	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	136.4	-179.6	-177	177.9	-78.6	-104	2.1	110.5	E253 A260 I281 S283	E253-R255 IonicContact OE1-NE 2.71Å; R255-A260 HydrophobicContact CB-CB 4.27Å; R255-A260 HydrophobicContact CG-CB 4.12Å; R255-I281 PolarHBondContact NH2-O 3.44Å; R255-S283 PolarHBondContact NE-OG 2.83Å; R255-S283 PolarHBondContact NH2-OG 3.3Å
256	N	94.2	Very high	95	Very high	69 Å²	69	58.3 Å²	58.3	37%	0.369	34%	0.337	S	S	.	.			trans	-138.4	-171.3	170.5	61	53.6	0	0	0	109.7	N258 F259	N256-N258 PolarHBondContact O-N 2.85Å; N256-N258 WeakPolarHBondContact OD1-CA 3.34Å; N256-N258 WeakPolarHBondContact OD1-CB 3.19Å; N256-N258 PolarHBondContact OD1-N 2.86Å; N256-F259 PolarHBondContact N-O 2.96Å; N256-F259 WeakPolarHBondContact ND2-CD1 3.41Å; N256-F259 WeakPolarHBondContact ND2-CE1 3.49Å; N256-F259 WeakPolarHBondContact ND2-CZ 3.01Å; N256-F259 PolarHBondContact OD1-N 2.79Å; N256-F259 PolarHBondContact OD1-O 3.29Å
257	S	92.4	Very high	95.1	Very high	112 Å²	112	53.6 Å²	53.6	78%	0.783	30%	0.298	S	S	*	.	S	Bend	trans	-66.1	-19.1	-179.6	57.9	0	0	0	0	114.6
258	N	92.5	Very high	95	Very high	117 Å²	117	54.6 Å²	54.6	63%	0.626	30%	0.302	S	S	*	.	S	Bend	trans	-106.5	-31.3	-171.6	-56.4	-21.4	0	0	0	112.5	N256	N256-N258 PolarHBondContact O-N 2.85Å; N256-N258 WeakPolarHBondContact OD1-CA 3.34Å; N256-N258 WeakPolarHBondContact OD1-CB 3.19Å; N256-N258 PolarHBondContact OD1-N 2.86Å
259	F	95.2	Very high	95.1	Very high	72 Å²	72	51.6 Å²	51.6	32%	0.316	28%	0.279	S	S	.	.			trans	-158.6	163.7	179.8	73.4	-89.4	0	0	0	112.9	N256 A261 V275 M276	N256-F259 PolarHBondContact N-O 2.96Å; N256-F259 WeakPolarHBondContact ND2-CD1 3.41Å; N256-F259 WeakPolarHBondContact ND2-CE1 3.49Å; N256-F259 WeakPolarHBondContact ND2-CZ 3.01Å; N256-F259 PolarHBondContact OD1-N 2.79Å; N256-F259 PolarHBondContact OD1-O 3.29Å; F259-A261 HydrophobicContact CD2-CB 4.04Å; F259-A261 HydrophobicContact CE2-CB 3.76Å; F259-V275 HydrophobicContact CB-CG1 4.22Å; F259-V275 HydrophobicContact CD2-CG1 3.96Å; F259-V275 HydrophobicContact CG-CG1 4.33Å; F259-M276 CarbonylContact C-O 3.15Å; F259-M276 VanDerWaalsContact CA-O 3.23Å; F259-M276 WeakPolarHBondContact CA-O 3.31Å; F259-M276 WeakPolarHBondContact CB-O 3.36Å
260	A	97	Very high	95.2	Very high	3 Å²	3	50.9 Å²	50.9	3%	0.025	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.8	163	0	0	0	0	0	109.8	V254 R255 F262 V275 M276	V254-A260 CarbonylContact O-C 3.06Å; V254-A260 WeakPolarHBondContact O-CA 3.49Å; R255-A260 HydrophobicContact CB-CB 4.27Å; R255-A260 HydrophobicContact CG-CB 4.12Å; A260-F262 HydrophobicContact CB-CE2 3.63Å; A260-F262 HydrophobicContact CB-CZ 3.69Å; A260-V275 WeakPolarHBondContact O-CA 3.42Å; A260-M276 PolarHBondContact N-O 3.41Å; A260-M276 PolarHBondContact O-N 3.49Å
261	A	97.4	Very high	95.4	Very high	8 Å²	8	45.3 Å²	45.3	7%	0.066	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.7	175	0	0	0	0	0	109.9	E253 V254 F259 M273 V274 V275	E253-A261 CarbonylContact C-O 3.53Å; E253-A261 WeakPolarHBondContact CA-O 3.43Å; V254-A261 PolarHBondContact N-O 3.29Å; V254-A261 PolarHBondContact O-N 2.78Å; F259-A261 HydrophobicContact CD2-CB 4.04Å; F259-A261 HydrophobicContact CE2-CB 3.76Å; A261-M273 HydrophobicContact CB-CE 4.2Å; A261-V274 CarbonylContact C-O 3.45Å; A261-V274 WeakPolarHBondContact CA-O 3.43Å; A261-V275 HydrophobicContact CB-CG2 4.23Å
262	F	98	Very high	95.5	Very high	2 Å²	2	42 Å²	42	1%	0.009	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.1	-177.2	-54	-89	0	0	0	108.7	E253 A260 M273 V274 M276 T286 L287 I290	E253-F262 HydrophobicContact CB-CD1 4.25Å; E253-F262 VanDerWaalsContact CD-CE1 3.41Å; E253-F262 HydrophobicContact CG-CD1 3.83Å; E253-F262 HydrophobicContact CG-CE1 3.65Å; A260-F262 HydrophobicContact CB-CE2 3.63Å; A260-F262 HydrophobicContact CB-CZ 3.69Å; F262-M273 CarbonylContact O-C 3.48Å; F262-M273 WeakPolarHBondContact O-CA 3.44Å; F262-V274 PolarHBondContact N-O 3.29Å; F262-V274 PolarHBondContact O-N 3.03Å; F262-M276 HydrophobicContact CD2-CG 4.45Å; F262-M276 HydrophobicContact CE2-CG 3.99Å; F262-T286 HydrophobicContact CD2-CG2 3.62Å; F262-T286 HydrophobicContact CE2-CG2 3.83Å; F262-T286 HydrophobicContact CG-CG2 4.16Å; F262-L287 HydrophobicContact CD1-CD2 4.12Å; F262-L287 HydrophobicContact CD1-CG 4.33Å; F262-I290 HydrophobicContact CB-CD1 4.21Å
263	I	98	Very high	95.6	Very high	12 Å²	12	40.2 Å²	40.2	6%	0.062	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	122.9	172.1	-59.8	173.2	0	0	0	106.9	I235 F249 S251 M252 Y271 V272 M273	I235-I263 HydrophobicContact CD1-CD1 3.29Å; I235-I263 HydrophobicContact CG1-CD1 3.7Å; F249-I263 HydrophobicContact CE1-CG2 4.09Å; F249-I263 HydrophobicContact CZ-CG2 4.04Å; S251-I263 CarbonylContact C-O 3.5Å; S251-I263 WeakPolarHBondContact CA-O 3.1Å; S251-I263 WeakPolarHBondContact CB-O 3.24Å; M252-I263 HydrophobicContact CB-CB 4.3Å; M252-I263 PolarHBondContact N-O 3.34Å; M252-I263 PolarHBondContact O-N 2.85Å; I263-Y271 HydrophobicContact CG2-CD1 3.86Å; I263-Y271 HydrophobicContact CG2-CE1 4.48Å; I263-V272 WeakPolarHBondContact CA-O 3.2Å; I263-M273 HydrophobicContact CD1-CG 4.48Å; I263-M273 HydrophobicContact CD1-SD 4.06Å; I263-M273 HydrophobicContact CG1-CB 3.96Å; I263-M273 HydrophobicContact CG1-CG 3.78Å; I263-M273 HydrophobicContact CG1-SD 4.01Å
264	D	96.9	Very high	95.7	Very high	33 Å²	33	35.9 Å²	35.9	18%	0.176	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	152.9	-179.2	-158.8	-12.1	0	0	0	110.7	F266 Y271 V272 I290	D264-F266 PolarHBondContact O-N 3.5Å; D264-F266 VanDerWaalsContact O-N 3.1Å; D264-Y271 WeakPolarHBondContact O-CA 3.22Å; D264-Y271 VanDerWaalsContact O-CD1 3.25Å; D264-Y271 WeakPolarHBondContact O-CD1 3.12Å; D264-V272 PolarHBondContact N-O 3.49Å; D264-V272 PolarHBondContact O-N 2.78Å; D264-I290 HydrophobicContact CB-CG2 4.44Å
265	I	95.9	Very high	95.8	Very high	34 Å²	34	33 Å²	33	17%	0.174	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	117.3	168.9	-67.9	166	0	0	0	107.2	Q250 T267 Y271 R294	Q250-I265 HydrophobicContact CB-CD1 4.34Å; Q250-I265 WeakPolarHBondContact O-CG1 3.44Å; Q250-I265 PolarHBondContact O-N 2.76Å; I265-T267 WeakPolarHBondContact CG2-O 3.29Å; I265-Y271 HydrophobicContact CB-CE1 4.39Å; I265-Y271 HydrophobicContact CG1-CD1 4.29Å; I265-Y271 HydrophobicContact CG1-CE1 3.54Å; I265-Y271 HydrophobicContact CG1-CE2 4.19Å; I265-Y271 VanDerWaalsContact CG1-CZ 3.45Å; I265-Y271 WeakPolarHBondContact CG1-OH 3.5Å; I265-R294 PolarHBondContact O-NH2 2.9Å
266	F	95.8	Very high	95.9	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.162	C	C	.	.			trans	-92.6	-51.7	-177	-166	-141.4	0	0	0	111.2	L205 D264 T270 V272 I290 A293 R294 F297	L205-F266 HydrophobicContact CD1-CD1 3.57Å; L205-F266 HydrophobicContact CD1-CE1 4.09Å; D264-F266 PolarHBondContact O-N 3.5Å; D264-F266 VanDerWaalsContact O-N 3.1Å; F266-T270 PolarHBondContact N-O 2.66Å; F266-V272 HydrophobicContact CB-CB 3.74Å; F266-V272 HydrophobicContact CB-CG1 3.77Å; F266-V272 HydrophobicContact CD1-CB 4.07Å; F266-V272 HydrophobicContact CD2-CB 4.07Å; F266-V272 HydrophobicContact CD2-CG1 3.68Å; F266-V272 HydrophobicContact CE2-CG1 4.36Å; F266-V272 HydrophobicContact CG-CB 3.73Å; F266-V272 HydrophobicContact CG-CG1 3.79Å; F266-I290 HydrophobicContact CD2-CG2 4.05Å; F266-I290 HydrophobicContact CE2-CG2 4.36Å; F266-I290 WeakPolarHBondContact CE2-O 3.37Å; F266-A293 HydrophobicContact CE2-CB 3.96Å; F266-A293 HydrophobicContact CZ-CB 3.96Å; F266-R294 WeakPolarHBondContact O-CB 3.4Å; F266-R294 VanDerWaalsContact O-CD 3.23Å; F266-R294 WeakPolarHBondContact O-CD 3.42Å; F266-R294 WeakPolarHBondContact O-CG 3.3Å; F266-R294 PolarHBondContact O-NE 2.75Å; F266-F297 HydrophobicContact CD1-CB 4.15Å; F266-F297 HydrophobicContact CD1-CG 4.26Å; F266-F297 HydrophobicContact CE1-CB 3.5Å; F266-F297 VanDerWaalsContact CE1-CB 3.5Å; F266-F297 AromaticContact CE1-CD1 3.65Å; F266-F297 HydrophobicContact CE1-CD1 3.65Å; F266-F297 AromaticContact CE1-CD2 3.4Å; F266-F297 HydrophobicContact CE1-CD2 3.4Å; F266-F297 HydrophobicContact CE1-CE1 4.16Å; F266-F297 AromaticContact CE1-CE2 3.94Å; F266-F297 HydrophobicContact CE1-CE2 3.94Å; F266-F297 AromaticContact CE1-CG 3.22Å; F266-F297 HydrophobicContact CE1-CG 3.22Å; F266-F297 HydrophobicContact CE1-CZ 4.28Å; F266-F297 HydrophobicContact CE2-CD2 4.43Å; F266-F297 HydrophobicContact CZ-CB 3.98Å; F266-F297 HydrophobicContact CZ-CD1 4.35Å; F266-F297 AromaticContact CZ-CD2 3.23Å; F266-F297 HydrophobicContact CZ-CD2 3.23Å; F266-F297 AromaticContact CZ-CE2 3.68Å; F266-F297 HydrophobicContact CZ-CE2 3.68Å; F266-F297 AromaticContact CZ-CG 3.61Å; F266-F297 HydrophobicContact CZ-CG 3.61Å; F266-F297 HydrophobicContact CZ-CZ 4.39Å
267	T	94.5	Very high	95.9	Very high	3 Å²	3	27.8 Å²	27.8	2%	0.018	17%	0.165	C	C	.	.	S	Bend	trans	-131.5	-173.1	175	76.8	0	0	0	0	110.6	I265 N269 T270 F297 E298 E301	I265-T267 WeakPolarHBondContact CG2-O 3.29Å; T267-N269 PolarHBondContact O-N 3.43Å; T267-N269 PolarHBondContact OG1-N 3.04Å; T267-T270 WeakPolarHBondContact CG2-OG1 3.48Å; T267-T270 PolarHBondContact N-O 2.83Å; T267-T270 VanDerWaalsContact N-O 3.14Å; T267-T270 PolarHBondContact OG1-N 3.2Å; T267-T270 PolarHBondContact OG1-OG1 2.9Å; T267-F297 HydrophobicContact CG2-CB 4.15Å; T267-E298 HydrophobicContact CG2-CG 3.82Å; T267-E301 VanDerWaalsContact CB-OE1 3.29Å; T267-E301 WeakPolarHBondContact CB-OE1 3.23Å; T267-E301 WeakPolarHBondContact CG2-OE1 3.4Å; T267-E301 PolarHBondContact OG1-OE1 3.05Å; T267-E301 PolarHBondContact OG1-OE2 2.73Å; T267-E301 VanDerWaalsContact OG1-OE2 3.07Å
268	S	91.7	Very high	96	Very high	71 Å²	71	25.4 Å²	25.4	50%	0.497	14%	0.144	S	C	.	.	S	Bend	trans	-58.1	-28.5	169.8	50.4	0	0	0	0	113.4	R208	R208-S268 WeakPolarHBondContact CD-O 3.45Å; R208-S268 PolarHBondContact NH1-O 3.02Å
269	N	92.9	Very high	95.9	Very high	25 Å²	25	24.8 Å²	24.8	13%	0.134	15%	0.146	C	C	.	.	S	Bend	trans	-116.5	-6.9	-171.9	-50.9	-64.3	0	0	0	113.7	L53 G54 R208 T267 E301	L53-N269 HydrophobicContact CD1-CB 3.98Å; G54-N269 PolarHBondContact N-ND2 3.28Å; R208-N269 WeakPolarHBondContact CB-O 3.44Å; R208-N269 PolarHBondContact N-O 2.81Å; T267-N269 PolarHBondContact O-N 3.43Å; T267-N269 PolarHBondContact OG1-N 3.04Å; N269-E301 PolarHBondContact ND2-OE2 2.65Å
270	T	95.8	Very high	95.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	151.7	-176.3	59.2	0	0	0	0	114.6	L53 L205 F206 I214 F266 T267 E301	L53-T270 HydrophobicContact CD1-CG2 3.44Å; L53-T270 VanDerWaalsContact CD1-CG2 3.44Å; L205-T270 HydrophobicContact CD1-CG2 4.1Å; L205-T270 HydrophobicContact CG-CG2 4.22Å; F206-T270 CarbonylContact O-C 3.47Å; F206-T270 WeakPolarHBondContact O-CA 3.23Å; F206-T270 VanDerWaalsContact O-CB 3.23Å; F206-T270 WeakPolarHBondContact O-CB 3.25Å; I214-T270 HydrophobicContact CD1-CG2 3.59Å; F266-T270 PolarHBondContact N-O 2.66Å; T267-T270 WeakPolarHBondContact CG2-OG1 3.48Å; T267-T270 PolarHBondContact N-O 2.83Å; T267-T270 VanDerWaalsContact N-O 3.14Å; T267-T270 PolarHBondContact OG1-N 3.2Å; T267-T270 PolarHBondContact OG1-OG1 2.9Å; T270-E301 WeakPolarHBondContact CG2-OE1 3.44Å; T270-E301 PolarHBondContact OG1-OE1 3.45Å; T270-E301 VanDerWaalsContact OG1-OE1 3.08Å
271	Y	97.5	Very high	95.4	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.016	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	150.2	159	-86.5	-93.2	0	0	0	109.2	F206 R208 F211 F249 Q250 I263 D264 I265	F206-Y271 PolarHBondContact N-O 3.03Å; F206-Y271 PolarHBondContact O-N 3.43Å; R208-Y271 HydrophobicContact CB-CD2 4.19Å; R208-Y271 HydrophobicContact CB-CE2 4.41Å; R208-Y271 HydrophobicContact CG-CD2 3.85Å; R208-Y271 HydrophobicContact CG-CE2 3.6Å; F211-Y271 HydrophobicContact CE1-CD1 4.38Å; F211-Y271 AromaticContact CE1-CD2 3.6Å; F211-Y271 HydrophobicContact CE1-CD2 3.6Å; F211-Y271 AromaticContact CE1-CE2 4Å; F211-Y271 HydrophobicContact CE1-CE2 4Å; F211-Y271 AromaticContact CE1-CG 3.84Å; F211-Y271 HydrophobicContact CE1-CG 3.84Å; F211-Y271 HydrophobicContact CE2-CD2 4.47Å; F211-Y271 HydrophobicContact CE2-CE2 4.33Å; F211-Y271 AromaticContact CZ-CD2 3.56Å; F211-Y271 HydrophobicContact CZ-CD2 3.56Å; F211-Y271 AromaticContact CZ-CE2 3.48Å; F211-Y271 HydrophobicContact CZ-CE2 3.48Å; F211-Y271 VanDerWaalsContact CZ-CE2 3.48Å; F211-Y271 HydrophobicContact CZ-CG 4.19Å; F249-Y271 HydrophobicContact CD1-CE1 4.05Å; F249-Y271 AromaticContact CD1-CZ 3.96Å; F249-Y271 HydrophobicContact CE1-CD1 4.41Å; F249-Y271 AromaticContact CE1-CE1 3.78Å; F249-Y271 HydrophobicContact CE1-CE1 3.78Å; F249-Y271 PolarHBondContact O-OH 2.98Å; Q250-Y271 WeakPolarHBondContact O-CE1 3.44Å; I263-Y271 HydrophobicContact CG2-CD1 3.86Å; I263-Y271 HydrophobicContact CG2-CE1 4.48Å; D264-Y271 WeakPolarHBondContact O-CA 3.22Å; D264-Y271 VanDerWaalsContact O-CD1 3.25Å; D264-Y271 WeakPolarHBondContact O-CD1 3.12Å; I265-Y271 HydrophobicContact CB-CE1 4.39Å; I265-Y271 HydrophobicContact CG1-CD1 4.29Å; I265-Y271 HydrophobicContact CG1-CE1 3.54Å; I265-Y271 HydrophobicContact CG1-CE2 4.19Å; I265-Y271 VanDerWaalsContact CG1-CZ 3.45Å; I265-Y271 WeakPolarHBondContact CG1-OH 3.5Å
272	V	98	Very high	95.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	140.1	167.1	67.5	0	0	0	0	108.9	V203 L204 I263 D264 F266 V274 I290	V203-V272 HydrophobicContact CG1-CG2 3.7Å; L204-V272 CarbonylContact O-C 3.5Å; L204-V272 VanDerWaalsContact O-CA 3.3Å; L204-V272 WeakPolarHBondContact O-CA 3.4Å; I263-V272 WeakPolarHBondContact CA-O 3.2Å; D264-V272 PolarHBondContact N-O 3.49Å; D264-V272 PolarHBondContact O-N 2.78Å; F266-V272 HydrophobicContact CB-CB 3.74Å; F266-V272 HydrophobicContact CB-CG1 3.77Å; F266-V272 HydrophobicContact CD1-CB 4.07Å; F266-V272 HydrophobicContact CD2-CB 4.07Å; F266-V272 HydrophobicContact CD2-CG1 3.68Å; F266-V272 HydrophobicContact CE2-CG1 4.36Å; F266-V272 HydrophobicContact CG-CB 3.73Å; F266-V272 HydrophobicContact CG-CG1 3.79Å; V272-V274 HydrophobicContact CG2-CG2 4.05Å; V272-I290 HydrophobicContact CG1-CD1 4.41Å; V272-I290 HydrophobicContact CG1-CG1 4.31Å; V272-I290 HydrophobicContact CG1-CG2 3.68Å
273	M	98.2	Very high	95	Very high	11 Å²	11	31.2 Å²	31.2	5%	0.054	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	133.5	163.1	179	172.1	156.3	0	0	109.3	V203 L204 F206 I231 A261 F262 I263 V275	V203-M273 CarbonylContact C-O 3.56Å; V203-M273 VanDerWaalsContact CA-O 3.23Å; V203-M273 WeakPolarHBondContact CA-O 3.47Å; L204-M273 HydrophobicContact CB-CB 4.13Å; L204-M273 HydrophobicContact CD1-SD 4.07Å; L204-M273 PolarHBondContact N-O 2.81Å; L204-M273 PolarHBondContact O-N 2.82Å; F206-M273 HydrophobicContact CE2-CB 3.75Å; I231-M273 HydrophobicContact CD1-CE 3.84Å; I231-M273 HydrophobicContact CD1-SD 4.1Å; I231-M273 HydrophobicContact CG2-SD 3.7Å; A261-M273 HydrophobicContact CB-CE 4.2Å; F262-M273 CarbonylContact O-C 3.48Å; F262-M273 WeakPolarHBondContact O-CA 3.44Å; I263-M273 HydrophobicContact CD1-CG 4.48Å; I263-M273 HydrophobicContact CD1-SD 4.06Å; I263-M273 HydrophobicContact CG1-CB 3.96Å; I263-M273 HydrophobicContact CG1-CG 3.78Å; I263-M273 HydrophobicContact CG1-SD 4.01Å; M273-V275 HydrophobicContact CE-CG2 3.48Å; M273-V275 VanDerWaalsContact CE-CG2 3.48Å
274	V	98.3	Very high	94.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	129.5	175.5	178.4	0	0	0	0	108.5	F194 I198 A200 E202 V203 A261 F262 V272 M276 T286 I290	F194-V274 HydrophobicContact CE1-CG2 4.19Å; I198-V274 HydrophobicContact CD1-CG1 3.66Å; I198-V274 HydrophobicContact CD1-CG2 4.18Å; A200-V274 HydrophobicContact CB-CG1 3.77Å; E202-V274 CarbonylContact O-C 3.6Å; E202-V274 WeakPolarHBondContact O-CA 3.23Å; V203-V274 HydrophobicContact CG1-CG2 4.31Å; V203-V274 HydrophobicContact CG2-CG2 4.35Å; A261-V274 CarbonylContact C-O 3.45Å; A261-V274 WeakPolarHBondContact CA-O 3.43Å; F262-V274 PolarHBondContact N-O 3.29Å; F262-V274 PolarHBondContact O-N 3.03Å; V272-V274 HydrophobicContact CG2-CG2 4.05Å; V274-M276 HydrophobicContact CG1-CG 4.13Å; V274-M276 HydrophobicContact CG1-SD 3.71Å; V274-T286 HydrophobicContact CB-CG2 4.3Å; V274-T286 HydrophobicContact CG1-CG2 3.87Å; V274-I290 HydrophobicContact CB-CD1 4.31Å; V274-I290 HydrophobicContact CG2-CD1 3.81Å; V274-I290 HydrophobicContact CG2-CG1 3.95Å
275	V	97.2	Very high	94.8	Very high	10 Å²	10	33.5 Å²	33.5	6%	0.061	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	130.3	173.7	-173.4	0	0	0	0	109.4	D201 E202 F259 A260 A261 M273	D201-V275 PolarHBondContact N-O 3.42Å; E202-V275 HydrophobicContact CB-CB 3.83Å; E202-V275 HydrophobicContact CB-CG2 3.94Å; E202-V275 PolarHBondContact N-O 3.19Å; E202-V275 PolarHBondContact O-N 3.24Å; F259-V275 HydrophobicContact CB-CG1 4.22Å; F259-V275 HydrophobicContact CD2-CG1 3.96Å; F259-V275 HydrophobicContact CG-CG1 4.33Å; A260-V275 WeakPolarHBondContact O-CA 3.42Å; A261-V275 HydrophobicContact CB-CG2 4.23Å; M273-V275 HydrophobicContact CE-CG2 3.48Å; M273-V275 VanDerWaalsContact CE-CG2 3.48Å
276	M	96.2	Very high	94.8	Very high	5 Å²	5	32 Å²	32	3%	0.025	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	126.7	-179.7	-53.8	-63.2	-50.5	0	0	109.1	I198 E199 A200 F259 A260 F262 V274 I281 T286	I198-M276 VanDerWaalsContact O-CE 3.31Å; I198-M276 WeakPolarHBondContact O-CE 3.44Å; E199-M276 WeakPolarHBondContact O-CE 3.4Å; A200-M276 VanDerWaalsContact CA-SD 3.5Å; A200-M276 HydrophobicContact CB-SD 3.62Å; F259-M276 CarbonylContact C-O 3.15Å; F259-M276 VanDerWaalsContact CA-O 3.23Å; F259-M276 WeakPolarHBondContact CA-O 3.31Å; F259-M276 WeakPolarHBondContact CB-O 3.36Å; A260-M276 PolarHBondContact N-O 3.41Å; A260-M276 PolarHBondContact O-N 3.49Å; F262-M276 HydrophobicContact CD2-CG 4.45Å; F262-M276 HydrophobicContact CE2-CG 3.99Å; V274-M276 HydrophobicContact CG1-CG 4.13Å; V274-M276 HydrophobicContact CG1-SD 3.71Å; M276-I281 HydrophobicContact CE-CD1 3.58Å; M276-T286 HydrophobicContact CG-CG2 4.25Å
277	S	94.4	Very high	94.9	Very high	61 Å²	61	34.8 Å²	34.8	43%	0.427	23%	0.227	S	C	.	.			trans	-99.1	-17.5	174.9	59.7	0	0	0	0	113	D201 P279	D201-S277 VanDerWaalsContact CG-OG 3.26Å; D201-S277 PolarHBondContact OD1-OG 3.18Å; D201-S277 WeakPolarHBondContact OD2-CA 3.45Å; D201-S277 WeakPolarHBondContact OD2-CB 3.39Å; D201-S277 PolarHBondContact OD2-N 3.34Å; D201-S277 PolarHBondContact OD2-OG 3.18Å; S277-P279 WeakPolarHBondContact O-CD 3.41Å
278	D	93.8	Very high	95	Very high	62 Å²	62	39 Å²	39	33%	0.332	25%	0.249	S	C	.	.			trans	-73.4	111.7	175.1	-172.9	-12	0	0	0	110.8	S280 I281	D278-S280 PolarHBondContact O-N 2.9Å; D278-S280 WeakPolarHBondContact OD1-CA 3.37Å; D278-S280 WeakPolarHBondContact OD1-CB 3.31Å; D278-S280 PolarHBondContact OD1-N 3.5Å; D278-S280 PolarHBondContact OD1-OG 3.12Å; D278-S280 PolarHBondContact OD2-OG 2.79Å; D278-I281 HydrophobicContact CB-CD1 4.13Å; D278-I281 HydrophobicContact CB-CG1 4.32Å; D278-I281 PolarHBondContact O-N 3.23Å
279	P	90.3	Very high	95.2	Very high	104 Å²	104	38.3 Å²	38.3	68%	0.675	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-15.6	179.9	32.5	-36.5	0	0	0	113	S277 I281	S277-P279 WeakPolarHBondContact O-CD 3.41Å; P279-I281 PolarHBondContact O-N 3.48Å
280	S	92.3	Very high	95.4	Very high	88 Å²	88	37.1 Å²	37.1	62%	0.615	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-22.5	179	80.9	0	0	0	0	112.4	D278 P282	D278-S280 PolarHBondContact O-N 2.9Å; D278-S280 WeakPolarHBondContact OD1-CA 3.37Å; D278-S280 WeakPolarHBondContact OD1-CB 3.31Å; D278-S280 PolarHBondContact OD1-N 3.5Å; D278-S280 PolarHBondContact OD1-OG 3.12Å; D278-S280 PolarHBondContact OD2-OG 2.79Å; S280-P282 VanDerWaalsContact O-CD 3.31Å; S280-P282 WeakPolarHBondContact O-CD 3.5Å
281	I	91.1	Very high	95.4	Very high	31 Å²	31	45.1 Å²	45.1	16%	0.159	26%	0.263	C	S	.	.	S	Bend	trans	-82.5	114.6	179.6	-61	174.6	0	0	0	109.7	R255 M276 D278 P279 A285	R255-I281 PolarHBondContact NH2-O 3.44Å; M276-I281 HydrophobicContact CE-CD1 3.58Å; D278-I281 HydrophobicContact CB-CD1 4.13Å; D278-I281 HydrophobicContact CB-CG1 4.32Å; D278-I281 PolarHBondContact O-N 3.23Å; P279-I281 PolarHBondContact O-N 3.48Å; I281-A285 HydrophobicContact CG2-CB 4.26Å
282	P	92.5	Very high	95.3	Very high	79 Å²	79	50.1 Å²	50.1	51%	0.513	29%	0.29	S	S	.	.			trans	-72.8	146.3	179.5	30	-34	0	0	0	111	S280 A284 A285	S280-P282 VanDerWaalsContact O-CD 3.31Å; S280-P282 WeakPolarHBondContact O-CD 3.5Å; P282-A284 PolarHBondContact O-N 3.34Å; P282-A284 VanDerWaalsContact O-N 3.09Å; P282-A285 HydrophobicContact CG-CB 3.96Å; P282-A285 WeakPolarHBondContact O-CB 3.49Å; P282-A285 PolarHBondContact O-N 3.42Å
283	S	94.4	Very high	95.3	Very high	22 Å²	22	50.9 Å²	50.9	15%	0.154	30%	0.296	C	S	.	.	H	α-helix	trans	-51.6	-37.9	179.2	-60.8	0	0	0	0	113.3	E253 R255 A285 T286 L287	E253-S283 WeakPolarHBondContact OE1-CB 3.4Å; E253-S283 PolarHBondContact OE1-OG 2.8Å; R255-S283 PolarHBondContact NE-OG 2.83Å; R255-S283 PolarHBondContact NH2-OG 3.3Å; S283-A285 VanDerWaalsContact C-N 3.29Å; S283-A285 PolarHBondContact O-N 2.98Å; S283-T286 PolarHBondContact O-N 3.46Å; S283-L287 VanDerWaalsContact O-CG 3.31Å; S283-L287 WeakPolarHBondContact O-CG 3.5Å; S283-L287 PolarHBondContact O-N 3.28Å
284	A	95	Very high	95.2	Very high	60 Å²	60	53.5 Å²	53.5	50%	0.496	31%	0.306	S	S	.	.	H	α-helix	trans	-60	-37.1	178.2	0	0	0	0	0	112.9	P282 I288	P282-A284 PolarHBondContact O-N 3.34Å; P282-A284 VanDerWaalsContact O-N 3.09Å; A284-I288 WeakPolarHBondContact O-CB 3.27Å; A284-I288 WeakPolarHBondContact O-CD1 3.42Å; A284-I288 WeakPolarHBondContact O-CG1 3.31Å; A284-I288 PolarHBondContact O-N 2.92Å
285	A	95.8	Very high	94.9	Very high	33 Å²	33	61 Å²	61	27%	0.273	34%	0.338	S	S	.	.	H	α-helix	trans	-65.5	-47.8	178.1	0	0	0	0	0	110.8	I281 P282 S283 L287 I288 N289	I281-A285 HydrophobicContact CG2-CB 4.26Å; P282-A285 HydrophobicContact CG-CB 3.96Å; P282-A285 WeakPolarHBondContact O-CB 3.49Å; P282-A285 PolarHBondContact O-N 3.42Å; S283-A285 VanDerWaalsContact C-N 3.29Å; S283-A285 PolarHBondContact O-N 2.98Å; A285-L287 PolarHBondContact O-N 2.62Å; A285-I288 PolarHBondContact O-N 3.44Å; A285-N289 VanDerWaalsContact O-CG 3.25Å; A285-N289 PolarHBondContact O-N 3.21Å; A285-N289 PolarHBondContact O-ND2 3.24Å
286	T	95.9	Very high	94.8	Very high	2 Å²	2	64.6 Å²	64.6	1%	0.012	35%	0.354	C	S	.	.	H	α-helix	trans	-60.2	-45.7	176.8	-51.7	0	0	0	0	111.8	F262 V274 M276 S283 I288 N289 I290	F262-T286 HydrophobicContact CD2-CG2 3.62Å; F262-T286 HydrophobicContact CE2-CG2 3.83Å; F262-T286 HydrophobicContact CG-CG2 4.16Å; V274-T286 HydrophobicContact CB-CG2 4.3Å; V274-T286 HydrophobicContact CG1-CG2 3.87Å; M276-T286 HydrophobicContact CG-CG2 4.25Å; S283-T286 PolarHBondContact O-N 3.46Å; T286-I288 PolarHBondContact O-N 3.44Å; T286-N289 PolarHBondContact O-N 3.07Å; T286-I290 HydrophobicContact CG2-CD1 4.13Å; T286-I290 WeakPolarHBondContact O-CG1 3.38Å; T286-I290 PolarHBondContact O-N 2.88Å
287	L	96.1	Very high	94.7	Very high	60 Å²	60	64.5 Å²	64.5	31%	0.314	35%	0.354	S	S	.	.	H	α-helix	trans	-65	-38.2	179	-68.5	172.3	0	0	0	112.8	F262 S283 A285 R291	F262-L287 HydrophobicContact CD1-CD2 4.12Å; F262-L287 HydrophobicContact CD1-CG 4.33Å; S283-L287 VanDerWaalsContact O-CG 3.31Å; S283-L287 WeakPolarHBondContact O-CG 3.5Å; S283-L287 PolarHBondContact O-N 3.28Å; A285-L287 PolarHBondContact O-N 2.62Å; L287-R291 WeakPolarHBondContact O-CB 3.5Å; L287-R291 PolarHBondContact O-N 3.35Å
288	I	96.6	Very high	94.6	Very high	91 Å²	91	64.3 Å²	64.3	47%	0.467	35%	0.346	S	S	.	.	H	α-helix	trans	-64.1	-42.8	173.5	-72.4	166.2	0	0	0	110.2	A284 A285 T286 R291 N292	A284-I288 WeakPolarHBondContact O-CB 3.27Å; A284-I288 WeakPolarHBondContact O-CD1 3.42Å; A284-I288 WeakPolarHBondContact O-CG1 3.31Å; A284-I288 PolarHBondContact O-N 2.92Å; A285-I288 PolarHBondContact O-N 3.44Å; T286-I288 PolarHBondContact O-N 3.44Å; I288-R291 PolarHBondContact O-N 3.13Å; I288-N292 WeakPolarHBondContact O-CB 3.21Å; I288-N292 VanDerWaalsContact O-CG 3.26Å; I288-N292 PolarHBondContact O-N 3.33Å; I288-N292 PolarHBondContact O-ND2 3.35Å
289	N	96.3	Very high	94.4	Very high	56 Å²	56	68.6 Å²	68.6	30%	0.299	36%	0.362	S	S	.	.	H	α-helix	trans	-64.5	-43.7	178.8	-70.7	-21.6	0	0	0	112.2	F194 I198 A285 T286 R291 N292 A293	F194-N289 HydrophobicContact CE2-CB 4.47Å; I198-N289 HydrophobicContact CG2-CB 3.56Å; A285-N289 VanDerWaalsContact O-CG 3.25Å; A285-N289 PolarHBondContact O-N 3.21Å; A285-N289 PolarHBondContact O-ND2 3.24Å; T286-N289 PolarHBondContact O-N 3.07Å; N289-R291 VanDerWaalsContact C-N 3.31Å; N289-R291 PolarHBondContact O-N 3.39Å; N289-N292 PolarHBondContact O-N 3.43Å; N289-A293 WeakPolarHBondContact O-CB 3.17Å; N289-A293 PolarHBondContact O-N 2.91Å
290	I	97.2	Very high	94.2	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-55.5	-48.2	172.2	-71.2	166.9	0	0	0	110.3	F194 F262 D264 F266 V272 V274 T286 N292 A293 R294	F194-I290 HydrophobicContact CZ-CG1 4.09Å; F262-I290 HydrophobicContact CB-CD1 4.21Å; D264-I290 HydrophobicContact CB-CG2 4.44Å; F266-I290 HydrophobicContact CD2-CG2 4.05Å; F266-I290 HydrophobicContact CE2-CG2 4.36Å; F266-I290 WeakPolarHBondContact CE2-O 3.37Å; V272-I290 HydrophobicContact CG1-CD1 4.41Å; V272-I290 HydrophobicContact CG1-CG1 4.31Å; V272-I290 HydrophobicContact CG1-CG2 3.68Å; V274-I290 HydrophobicContact CB-CD1 4.31Å; V274-I290 HydrophobicContact CG2-CD1 3.81Å; V274-I290 HydrophobicContact CG2-CG1 3.95Å; T286-I290 HydrophobicContact CG2-CD1 4.13Å; T286-I290 WeakPolarHBondContact O-CG1 3.38Å; T286-I290 PolarHBondContact O-N 2.88Å; I290-N292 VanDerWaalsContact C-N 3.34Å; I290-N292 PolarHBondContact O-N 3.26Å; I290-A293 PolarHBondContact O-N 3.22Å; I290-R294 PolarHBondContact O-N 3.44Å
291	R	96.4	Very high	93.8	Very high	168 Å²	168	60.8 Å²	60.8	63%	0.634	31%	0.307	S	S	*	.	H	α-helix	trans	-62.6	-38.7	179.1	-174.8	-178.9	-67.1	174.8	-1.3	112.7	L287 I288 N289 R294	L287-R291 WeakPolarHBondContact O-CB 3.5Å; L287-R291 PolarHBondContact O-N 3.35Å; I288-R291 PolarHBondContact O-N 3.13Å; N289-R291 VanDerWaalsContact C-N 3.31Å; N289-R291 PolarHBondContact O-N 3.39Å; R291-R294 WeakPolarHBondContact O-CB 3.35Å
292	N	96	Very high	93	Very high	110 Å²	110	67.3 Å²	67.3	59%	0.588	33%	0.33	S	S	*	.	H	α-helix	trans	-69.9	-37.7	179.4	-72.7	-19.6	0	0	0	111.9	I288 N289 I290 R294	I288-N292 WeakPolarHBondContact O-CB 3.21Å; I288-N292 VanDerWaalsContact O-CG 3.26Å; I288-N292 PolarHBondContact O-N 3.33Å; I288-N292 PolarHBondContact O-ND2 3.35Å; N289-N292 PolarHBondContact O-N 3.43Å; I290-N292 VanDerWaalsContact C-N 3.34Å; I290-N292 PolarHBondContact O-N 3.26Å; N292-R294 VanDerWaalsContact C-N 3.34Å; N292-R294 PolarHBondContact O-N 2.76Å
293	A	96.5	Very high	91.5	Very high	15 Å²	15	66.4 Å²	66.4	12%	0.124	32%	0.322	C	S	.	.	H	α-helix	trans	-70.9	-26.4	178.5	0	0	0	0	0	113.4	F194 F266 N289 I290 K295 H296 F297	F194-A293 HydrophobicContact CD2-CB 3.58Å; F194-A293 HydrophobicContact CE2-CB 3.41Å; F194-A293 VanDerWaalsContact CE2-CB 3.41Å; F194-A293 HydrophobicContact CG-CB 4.35Å; F194-A293 HydrophobicContact CZ-CB 4.07Å; F266-A293 HydrophobicContact CE2-CB 3.96Å; F266-A293 HydrophobicContact CZ-CB 3.96Å; N289-A293 WeakPolarHBondContact O-CB 3.17Å; N289-A293 PolarHBondContact O-N 2.91Å; I290-A293 PolarHBondContact O-N 3.22Å; A293-K295 PolarHBondContact O-N 3.02Å; A293-H296 WeakPolarHBondContact O-CA 3.5Å; A293-H296 VanDerWaalsContact O-CB 3.27Å; A293-H296 WeakPolarHBondContact O-CB 3.25Å; A293-H296 PolarHBondContact O-N 3.26Å; A293-F297 HydrophobicContact CB-CD2 4.37Å; A293-F297 HydrophobicContact CB-CE2 4.36Å; A293-F297 WeakPolarHBondContact O-CD2 3.18Å; A293-F297 PolarHBondContact O-N 3.39Å
294	R	95.9	Very high	89.6	Confident	66 Å²	66	68.7 Å²	68.7	25%	0.249	33%	0.333	C	S	.	.	H	α-helix	trans	-44.8	-53.3	-178.8	169.6	172.4	-52.2	148.9	1.9	114.2	I265 F266 I290 R291 N292 H296 F297 E298	I265-R294 PolarHBondContact O-NH2 2.9Å; F266-R294 WeakPolarHBondContact O-CB 3.4Å; F266-R294 VanDerWaalsContact O-CD 3.23Å; F266-R294 WeakPolarHBondContact O-CD 3.42Å; F266-R294 WeakPolarHBondContact O-CG 3.3Å; F266-R294 PolarHBondContact O-NE 2.75Å; I290-R294 PolarHBondContact O-N 3.44Å; R291-R294 WeakPolarHBondContact O-CB 3.35Å; N292-R294 VanDerWaalsContact C-N 3.34Å; N292-R294 PolarHBondContact O-N 2.76Å; R294-H296 PolarHBondContact O-N 2.98Å; R294-F297 PolarHBondContact O-N 3.19Å; R294-E298 HydrophobicContact CG-CG 4.26Å; R294-E298 WeakPolarHBondContact CG-OE1 3.43Å; R294-E298 WeakPolarHBondContact O-CG 3.48Å; R294-E298 PolarHBondContact O-N 2.8Å
295	K	92.7	Very high	87.3	Confident	157 Å²	157	67.1 Å²	67.1	68%	0.683	32%	0.323	S	S	*	.	H	α-helix	trans	-61.8	-28.3	-177	-70.7	-176.9	-179.1	176.1	0	112.9	A293 K299	A293-K295 PolarHBondContact O-N 3.02Å; K295-K299 WeakPolarHBondContact O-CG 3.31Å
296	H	94.8	Very high	84.8	Confident	87 Å²	87	71.4 Å²	71.4	40%	0.403	35%	0.348	S	S	.	.	H	α-helix	trans	-72	-49	176.8	-177.8	65.9	0	0	0	110.6	N190 A293 R294 E298 K299 L300	N190-H296 PolarHBondContact OD1-NE2 3.47Å; A293-H296 WeakPolarHBondContact O-CA 3.5Å; A293-H296 VanDerWaalsContact O-CB 3.27Å; A293-H296 WeakPolarHBondContact O-CB 3.25Å; A293-H296 PolarHBondContact O-N 3.26Å; R294-H296 PolarHBondContact O-N 2.98Å; H296-E298 PolarHBondContact O-N 2.97Å; H296-K299 WeakPolarHBondContact O-CB 3.4Å; H296-K299 PolarHBondContact O-N 3.02Å; H296-K299 VanDerWaalsContact O-N 3.12Å; H296-L300 PolarHBondContact O-N 2.96Å
297	F	94.2	Very high	82.1	Confident	3 Å²	3	79.2 Å²	79.2	1%	0.013	38%	0.382	C	S	.	.	H	α-helix	trans	-69.7	-32.3	179.4	-77.3	-97.1	0	0	0	113.3	L187 N190 L191 F194 F266 T267 A293 R294 K299 L300 E301	L187-F297 HydrophobicContact CD2-CD1 4.22Å; N190-F297 HydrophobicContact CB-CE1 4.2Å; N190-F297 HydrophobicContact CB-CZ 4.07Å; L191-F297 HydrophobicContact CB-CE1 4.45Å; L191-F297 HydrophobicContact CB-CZ 4.49Å; L191-F297 HydrophobicContact CD1-CE1 4.05Å; L191-F297 HydrophobicContact CD1-CZ 4.06Å; F194-F297 HydrophobicContact CB-CE2 4.21Å; F194-F297 HydrophobicContact CB-CZ 4.26Å; F194-F297 HydrophobicContact CG-CE2 4.46Å; F266-F297 HydrophobicContact CD1-CB 4.15Å; F266-F297 HydrophobicContact CD1-CG 4.26Å; F266-F297 HydrophobicContact CE1-CB 3.5Å; F266-F297 VanDerWaalsContact CE1-CB 3.5Å; F266-F297 AromaticContact CE1-CD1 3.65Å; F266-F297 HydrophobicContact CE1-CD1 3.65Å; F266-F297 AromaticContact CE1-CD2 3.4Å; F266-F297 HydrophobicContact CE1-CD2 3.4Å; F266-F297 HydrophobicContact CE1-CE1 4.16Å; F266-F297 AromaticContact CE1-CE2 3.94Å; F266-F297 HydrophobicContact CE1-CE2 3.94Å; F266-F297 AromaticContact CE1-CG 3.22Å; F266-F297 HydrophobicContact CE1-CG 3.22Å; F266-F297 HydrophobicContact CE1-CZ 4.28Å; F266-F297 HydrophobicContact CE2-CD2 4.43Å; F266-F297 HydrophobicContact CZ-CB 3.98Å; F266-F297 HydrophobicContact CZ-CD1 4.35Å; F266-F297 AromaticContact CZ-CD2 3.23Å; F266-F297 HydrophobicContact CZ-CD2 3.23Å; F266-F297 AromaticContact CZ-CE2 3.68Å; F266-F297 HydrophobicContact CZ-CE2 3.68Å; F266-F297 AromaticContact CZ-CG 3.61Å; F266-F297 HydrophobicContact CZ-CG 3.61Å; F266-F297 HydrophobicContact CZ-CZ 4.39Å; T267-F297 HydrophobicContact CG2-CB 4.15Å; A293-F297 HydrophobicContact CB-CD2 4.37Å; A293-F297 HydrophobicContact CB-CE2 4.36Å; A293-F297 WeakPolarHBondContact O-CD2 3.18Å; A293-F297 PolarHBondContact O-N 3.39Å; R294-F297 PolarHBondContact O-N 3.19Å; F297-K299 PolarHBondContact O-N 3.48Å; F297-L300 HydrophobicContact CD1-CD1 4.04Å; F297-L300 HydrophobicContact CE1-CD1 4.31Å; F297-L300 HydrophobicContact CG-CD1 4.39Å; F297-L300 WeakPolarHBondContact O-CB 3.48Å; F297-L300 PolarHBondContact O-N 3.42Å; F297-E301 PolarHBondContact O-N 3.47Å
298	E	91.9	Very high	79.2	Confident	57 Å²	57	83.9 Å²	83.9	27%	0.266	40%	0.402	S	S	.	.	H	α-helix	trans	-57.6	-31.6	170.2	-76.8	175.8	174.1	0	0	112.9	T267 R294 H296 R302	T267-E298 HydrophobicContact CG2-CG 3.82Å; R294-E298 HydrophobicContact CG-CG 4.26Å; R294-E298 WeakPolarHBondContact CG-OE1 3.43Å; R294-E298 WeakPolarHBondContact O-CG 3.48Å; R294-E298 PolarHBondContact O-N 2.8Å; H296-E298 PolarHBondContact O-N 2.97Å; E298-R302 VanDerWaalsContact O-CG 3.31Å; E298-R302 WeakPolarHBondContact O-CG 3.38Å
299	K	89.5	Confident	76.1	Confident	151 Å²	151	85.4 Å²	85.4	66%	0.657	42%	0.42	S	S	*	.	H	α-helix	trans	-75.1	-38.5	174.8	-67.6	172.7	-176.6	179.3	0	111.5	K295 H296 F297 E301 R302	K295-K299 WeakPolarHBondContact O-CG 3.31Å; H296-K299 WeakPolarHBondContact O-CB 3.4Å; H296-K299 PolarHBondContact O-N 3.02Å; H296-K299 VanDerWaalsContact O-N 3.12Å; F297-K299 PolarHBondContact O-N 3.48Å; K299-E301 VanDerWaalsContact C-N 3.33Å; K299-E301 PolarHBondContact O-N 3.02Å; K299-R302 PolarHBondContact O-N 3.33Å
300	L	87.6	Confident	73.1	Confident	18 Å²	18	89.2 Å²	89.2	9%	0.094	44%	0.44	C	S	.	.	H	α-helix	trans	-63.3	-39.5	177.1	-64.1	174.4	0	0	0	111.3	N183 L187 N190 H296 F297 R302 V303	N183-L300 PolarHBondContact ND2-O 2.89Å; L187-L300 HydrophobicContact CD2-CB 3.84Å; L187-L300 HydrophobicContact CD2-CD1 4.23Å; N190-L300 HydrophobicContact CB-CD1 3.58Å; H296-L300 PolarHBondContact O-N 2.96Å; F297-L300 HydrophobicContact CD1-CD1 4.04Å; F297-L300 HydrophobicContact CE1-CD1 4.31Å; F297-L300 HydrophobicContact CG-CD1 4.39Å; F297-L300 WeakPolarHBondContact O-CB 3.48Å; F297-L300 PolarHBondContact O-N 3.42Å; L300-R302 PolarHBondContact O-N 3.22Å; L300-V303 VanDerWaalsContact O-CG2 3.3Å; L300-V303 WeakPolarHBondContact O-CG2 3.46Å; L300-V303 PolarHBondContact O-N 3.09Å
301	E	84	Confident	69.9	Low	10 Å²	10	95.1 Å²	95.1	5%	0.047	47%	0.471	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-24.2	176.7	-70.5	-178.4	-169.9	0	0	114.1	L53 T267 N269 T270 F297 K299	L53-E301 HydrophobicContact CD1-CG 3.8Å; L53-E301 HydrophobicContact CG-CG 4.21Å; T267-E301 VanDerWaalsContact CB-OE1 3.29Å; T267-E301 WeakPolarHBondContact CB-OE1 3.23Å; T267-E301 WeakPolarHBondContact CG2-OE1 3.4Å; T267-E301 PolarHBondContact OG1-OE1 3.05Å; T267-E301 PolarHBondContact OG1-OE2 2.73Å; T267-E301 VanDerWaalsContact OG1-OE2 3.07Å; N269-E301 PolarHBondContact ND2-OE2 2.65Å; T270-E301 WeakPolarHBondContact CG2-OE1 3.44Å; T270-E301 PolarHBondContact OG1-OE1 3.45Å; T270-E301 VanDerWaalsContact OG1-OE1 3.08Å; F297-E301 PolarHBondContact O-N 3.47Å; K299-E301 VanDerWaalsContact C-N 3.33Å; K299-E301 PolarHBondContact O-N 3.02Å
302	R	74.1	Confident	66.9	Low	168 Å²	168	96.8 Å²	96.8	63%	0.634	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-7.4	-176.8	-72	176.3	-170.2	-157.9	3.7	113.7	N3 E298 K299 L300 D304	N3-R302 PolarHBondContact ND2-O 2.95Å; E298-R302 VanDerWaalsContact O-CG 3.31Å; E298-R302 WeakPolarHBondContact O-CG 3.38Å; K299-R302 PolarHBondContact O-N 3.33Å; L300-R302 PolarHBondContact O-N 3.22Å; R302-D304 PolarHBondContact O-N 3.21Å
303	V	59.7	Low	63.8	Low	60 Å²	60	105.5 Å²	105.5	36%	0.364	51%	0.513	S	S	.	.			trans	-53.9	108.7	-170.6	176	0	0	0	0	109	L300 G305	L300-V303 VanDerWaalsContact O-CG2 3.3Å; L300-V303 WeakPolarHBondContact O-CG2 3.46Å; L300-V303 PolarHBondContact O-N 3.09Å; V303-G305 PolarHBondContact O-N 2.92Å
304	D	54.7	Low	62.1	Low	70 Å²	70	110.1 Å²	110.1	37%	0.374	53%	0.532	S	S	.	.			trans	-49	130.9	173.7	-56.8	-47.8	0	0	0	107.3	N3 R302	N3-D304 PolarHBondContact ND2-OD1 2.77Å; N3-D304 PolarHBondContact OD1-OD1 2.87Å; R302-D304 PolarHBondContact O-N 3.21Å
305	G	47.7	Very low	60.4	Low	28 Å²	28	112.4 Å²	112.4	29%	0.289	55%	0.547	S	S	.	.	S	Bend	trans	-45	151.6	172.1	0	0	0	0	0	110.2	V303 K307	V303-G305 PolarHBondContact O-N 2.92Å; G305-K307 PolarHBondContact O-N 2.96Å
306	P	42.5	Very low	58.6	Low	122 Å²	122	109.9 Å²	109.9	79%	0.792	54%	0.54	S	S	*	.			trans	-36	104.9	-157.2	17.3	-32	0	0	0	109.7	H308	P306-H308 VanDerWaalsContact C-N 3.31Å; P306-H308 PolarHBondContact O-N 3.36Å
307	K	39.9	Very low	56.4	Low	167 Å²	167	111.2 Å²	111.2	73%	0.726	55%	0.548	S	S	*	.			trans	-50.6	111.5	168.4	-79.7	-175.5	176.7	178.6	0	103.5	G305 S309	G305-K307 PolarHBondContact O-N 2.96Å; K307-S309 PolarHBondContact O-N 2.97Å
308	H	35.8	Very low	54.1	Low	158 Å²	158	118 Å²	118	73%	0.731	58%	0.581	S	S	*	*			trans	-36.8	122	165	-106	-81.8	0	0	0	105.5	P306 L310	P306-H308 VanDerWaalsContact C-N 3.31Å; P306-H308 PolarHBondContact O-N 3.36Å; H308-L310 HydrophobicContact CB-CD1 4.4Å; H308-L310 HydrophobicContact CB-CG 4.16Å; H308-L310 PolarHBondContact O-N 3.39Å
309	S	30.6	Very low	51.6	Low	122 Å²	122	122.1 Å²	122.1	85%	0.853	60%	0.602	S	S	*	*			trans	-51.7	73.5	159.2	29.8	0	0	0	0	107.6	K307 L311	K307-S309 PolarHBondContact O-N 2.97Å; S309-L311 PolarHBondContact O-N 3.36Å
310	L	32.6	Very low	48.8	Very low	136 Å²	136	120 Å²	120	71%	0.712	60%	0.598	S	S	*	*			trans	-78.6	99.4	168.7	-84.9	159.7	0	0	0	104.1	H308	H308-L310 HydrophobicContact CB-CD1 4.4Å; H308-L310 HydrophobicContact CB-CG 4.16Å; H308-L310 PolarHBondContact O-N 3.39Å
311	L	30.2	Very low	45.9	Very low	125 Å²	125	127.8 Å²	127.8	65%	0.654	64%	0.637	S	S	*	*			trans	68.7	71.4	143.9	-57.8	151.5	0	0	0	114.1	S309 R313	S309-L311 PolarHBondContact O-N 3.36Å; L311-R313 HydrophobicContact CD2-CG 4.33Å; L311-R313 PolarHBondContact O-N 2.97Å
312	M	33.7	Very low	42.7	Very low	202 Å²	202	137.7 Å²	137.7	100%	0.995	69%	0.686	S	S	*	*				-75.9	95	129.2	-75.2	-167.4	178.4	0	0	105.9
313	R	31	Very low	39.8	Very low	294 Å²	294	134.9 Å²	134.9	100%	1.109	69%	0.691	S	S	*	*			trans	-65.4	0	153.7	-82.3	-176.9	173.2	-172.8	-1.9	108.9	L311	L311-R313 HydrophobicContact CD2-CG 4.33Å; L311-R313 PolarHBondContact O-N 2.97Å

Retrieved 313 of 313 residues in 64.1 ms (Link to these results)

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