A0A077ZNE2_TRITR Loading...

Major sperm protein

Central component in molecular interactions underlying sperm crawling. Forms an extensive filament system that extends from sperm villipoda, along the leading edge of the pseudopod.

AlphaFold DB , UniProt , Accession A0A077ZNE2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 238 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.3	Very low	49.7	Very low	216 Å²	216	125.6 Å²	125.6	100%	1.064	68%	0.68	S	S	*	*				0	117.5	0	-74.4	177.4	173.9	0	0	107.6
2	E	39	Very low	52.6	Low	192 Å²	192	115.8 Å²	115.8	90%	0.897	63%	0.63	S	S	*	*			trans	-85.1	128.9	166.6	-63.7	-168.7	118.1	0	0	108.6	V4	E2-V4 PolarHBondContact O-N 3.14Å
3	F	45.9	Very low	55.7	Low	138 Å²	138	111.9 Å²	111.9	61%	0.605	61%	0.605	S	S	*	*			trans	-85.4	96.5	175	-68.5	-82.4	0	0	0	108.2	S5	F3-S5 PolarHBondContact O-N 3.27Å; F3-S5 VanDerWaalsContact O-N 3.14Å
4	V	41.3	Very low	58.6	Low	138 Å²	138	104.8 Å²	104.8	84%	0.836	57%	0.567	S	S	*	*			trans	-55.9	118.6	172.4	178.7	0	0	0	0	108.3	E2 G6	E2-V4 PolarHBondContact O-N 3.14Å; V4-G6 PolarHBondContact O-N 2.83Å
5	S	46.3	Very low	61	Low	123 Å²	123	104.3 Å²	104.3	86%	0.86	56%	0.555	S	S	*	*			trans	-77.6	57.3	-175.3	-176.9	0	0	0	0	112.1	F3	F3-S5 PolarHBondContact O-N 3.27Å; F3-S5 VanDerWaalsContact O-N 3.14Å
6	G	45.2	Very low	63.1	Low	48 Å²	48	101.6 Å²	101.6	50%	0.495	54%	0.544	S	S	.	.			trans	-58.1	138.2	168.1	0	0	0	0	0	110.3	V4 R8	V4-G6 PolarHBondContact O-N 2.83Å; G6-R8 PolarHBondContact O-N 3.09Å
7	S	47.7	Very low	64.7	Low	121 Å²	121	101.1 Å²	101.1	85%	0.846	55%	0.546	S	S	*	.			trans	-64.9	88.2	-173.4	42	0	0	0	0	112.3	K9	S7-K9 PolarHBondContact O-N 2.81Å; S7-K9 VanDerWaalsContact O-N 3.09Å
8	R	54.1	Low	66.2	Low	111 Å²	111	101.2 Å²	101.2	42%	0.419	55%	0.546	S	S	.	.			trans	-60.8	112.4	179.1	-79.2	166	156.4	-164.1	-6.5	110.1	G6 L97 D121	G6-R8 PolarHBondContact O-N 3.09Å; R8-L97 HydrophobicContact CB-CD1 4.35Å; R8-L97 HydrophobicContact CG-CD1 4.12Å; R8-D121 VanDerWaalsContact CD-OD1 3.27Å; R8-D121 WeakPolarHBondContact CD-OD1 3.27Å; R8-D121 IonicContact CZ-OD1 3.98Å; R8-D121 IonicContact NH1-OD1 3.18Å; R8-D121 PolarHBondContact NH1-OD1 3.3Å; R8-D121 IonicContact NH1-OD2 3.07Å; R8-D121 PolarHBondContact NH1-OD2 2.86Å
9	K	56.7	Low	67.6	Low	195 Å²	195	96.9 Å²	96.9	85%	0.848	52%	0.524	S	S	*	.			trans	-55	148.7	176.8	-72.2	-174.7	175.4	-178.2	0	110.5	S7 T11	S7-K9 PolarHBondContact O-N 2.81Å; S7-K9 VanDerWaalsContact O-N 3.09Å; K9-T11 PolarHBondContact O-N 3.17Å; K9-T11 PolarHBondContact O-OG1 3.39Å
10	T	57.9	Low	68.9	Low	90 Å²	90	92.3 Å²	92.3	55%	0.552	50%	0.498	S	S	*	.			trans	-50.8	102.4	-166.2	48.3	0	0	0	0	113.6	G12 N39	T10-G12 VanDerWaalsContact C-N 3.31Å; T10-G12 PolarHBondContact O-N 3.07Å; T10-N39 VanDerWaalsContact O-CG 3.31Å; T10-N39 PolarHBondContact O-ND2 3.33Å; T10-N39 PolarHBondContact O-OD1 2.72Å
11	T	73.9	Confident	70	Confident	10 Å²	10	92.2 Å²	92.2	6%	0.061	50%	0.495	C	S	.	.			trans	-84.6	12.5	-162.7	-23.4	0	0	0	0	116.7	K9 N38 N39 S40 V44 L97	K9-T11 PolarHBondContact O-N 3.17Å; K9-T11 PolarHBondContact O-OG1 3.39Å; T11-N38 PolarHBondContact O-OD1 2.84Å; T11-N39 WeakPolarHBondContact CA-OD1 3.27Å; T11-S40 WeakPolarHBondContact CG2-OG 3.34Å; T11-V44 HydrophobicContact CG2-CG2 3.61Å; T11-L97 HydrophobicContact CG2-CD1 3.76Å; T11-L97 HydrophobicContact CG2-CD2 3.48Å; T11-L97 VanDerWaalsContact CG2-CD2 3.48Å; T11-L97 HydrophobicContact CG2-CG 3.56Å
12	G	85.2	Confident	72.4	Confident	7 Å²	7	82.1 Å²	82.1	7%	0.072	45%	0.445	C	S	.	.			trans	168.3	173.6	177.2	0	0	0	0	0	114	T10 Y37 N39 Y124	T10-G12 VanDerWaalsContact C-N 3.31Å; T10-G12 PolarHBondContact O-N 3.07Å; G12-Y37 CarbonylContact C-O 3.58Å; G12-Y37 WeakPolarHBondContact CA-O 3.36Å; G12-N39 PolarHBondContact N-OD1 3.08Å; G12-N39 VanDerWaalsContact N-OD1 3.08Å; G12-Y124 VanDerWaalsContact C-OH 3.31Å; G12-Y124 PolarHBondContact N-OH 2.82Å; G12-Y124 PolarHBondContact O-OH 2.77Å
13	E	93.1	Very high	74.5	Confident	66 Å²	66	73.8 Å²	73.8	31%	0.308	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	154	-175	-72.3	140.1	-138.5	0	0	109.7	Y15 Y37 N39	E13-Y15 HydrophobicContact CB-CD2 4.44Å; E13-Y15 HydrophobicContact CB-CE2 3.66Å; E13-Y15 PolarHBondContact OE2-OH 3.18Å; E13-Y37 PolarHBondContact N-O 2.73Å; E13-Y37 PolarHBondContact O-N 3.2Å; E13-Y37 WeakPolarHBondContact OE2-CD1 3.1Å; E13-N39 PolarHBondContact OE1-ND2 3.31Å
14	V	95.5	Very high	76	Confident	12 Å²	12	72.6 Å²	72.6	7%	0.073	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	130.6	-178.8	-177.3	0	0	0	0	108.4	P16 I34 K35 L36 V93 Y124 L126	V14-P16 CarbonylContact C-O 3.54Å; V14-I34 HydrophobicContact CG1-CB 4.49Å; V14-I34 HydrophobicContact CG1-CD1 4.18Å; V14-K35 WeakPolarHBondContact CA-O 2.96Å; V14-L36 HydrophobicContact CB-CD2 4.43Å; V14-L36 HydrophobicContact CG1-CD2 4.02Å; V14-L36 HydrophobicContact CG2-CD2 3.83Å; V14-V93 HydrophobicContact CG1-CG2 4.39Å; V14-V93 HydrophobicContact CG2-CG2 4.41Å; V14-Y124 HydrophobicContact CG2-CD1 3.9Å; V14-Y124 HydrophobicContact CG2-CD2 3.8Å; V14-Y124 HydrophobicContact CG2-CE1 4.41Å; V14-Y124 HydrophobicContact CG2-CE2 4.33Å; V14-Y124 HydrophobicContact CG2-CG 3.56Å; V14-L126 HydrophobicContact CG1-CD1 4.04Å; V14-L126 HydrophobicContact CG1-CD2 4.24Å
15	Y	95.4	Very high	77.7	Confident	98 Å²	98	69.9 Å²	69.9	38%	0.384	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	133.5	-178.1	-62.9	-82.4	0	0	0	110.9	E13 V17 I34 K35	E13-Y15 HydrophobicContact CB-CD2 4.44Å; E13-Y15 HydrophobicContact CB-CE2 3.66Å; E13-Y15 PolarHBondContact OE2-OH 3.18Å; Y15-V17 HydrophobicContact CD1-CG2 4.21Å; Y15-V17 HydrophobicContact CE1-CG2 4.39Å; Y15-I34 CarbonylContact O-C 3.54Å; Y15-I34 WeakPolarHBondContact O-CA 3.32Å; Y15-I34 WeakPolarHBondContact O-CB 3.33Å; Y15-K35 PolarHBondContact N-O 2.99Å; Y15-K35 PolarHBondContact O-N 3.03Å
16	P	94.3	Very high	79.2	Confident	60 Å²	60	66.4 Å²	66.4	39%	0.39	35%	0.349	S	S	.	.	S	Bend	cis	-53.4	155.4	-10.7	24.1	-37	0	0	0	113.4	V14 T19	V14-P16 CarbonylContact C-O 3.54Å; P16-T19 WeakPolarHBondContact CB-O 3.07Å; P16-T19 WeakPolarHBondContact CG-O 3.45Å
17	V	90.9	Very high	80.6	Confident	93 Å²	93	69.4 Å²	69.4	56%	0.564	35%	0.353	S	S	*	.	S	Bend	trans	-82.5	136.6	176.4	-179.5	0	0	0	0	108.2	Y15 T19	Y15-V17 HydrophobicContact CD1-CG2 4.21Å; Y15-V17 HydrophobicContact CE1-CG2 4.39Å; V17-T19 PolarHBondContact O-N 3.05Å
18	D	91.2	Very high	82.3	Confident	103 Å²	103	68.3 Å²	68.3	55%	0.551	34%	0.337	S	S	*	.	S	Bend	trans	56.1	-22.9	174	-58	-26.2	0	0	0	119.6	L126 E127	D18-L126 CarbonylContact O-C 3.42Å; D18-L126 WeakPolarHBondContact O-CA 3.33Å; D18-E127 PolarHBondContact O-N 3.19Å
19	T	93.4	Very high	84	Confident	20 Å²	20	67.3 Å²	67.3	12%	0.123	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	141.1	-178.9	-54.2	0	0	0	0	113.2	P16 V17 H21 E127 K129	P16-T19 WeakPolarHBondContact CB-O 3.07Å; P16-T19 WeakPolarHBondContact CG-O 3.45Å; V17-T19 PolarHBondContact O-N 3.05Å; T19-H21 VanDerWaalsContact CG2-NE2 3.28Å; T19-H21 WeakPolarHBondContact CG2-NE2 3.39Å; T19-E127 CarbonylContact C-O 3.59Å; T19-E127 WeakPolarHBondContact CA-O 3.29Å; T19-K129 HydrophobicContact CG2-CB 4.16Å; T19-K129 HydrophobicContact CG2-CD 3.86Å; T19-K129 HydrophobicContact CG2-CG 3.75Å; T19-K129 PolarHBondContact OG1-NZ 3.32Å
20	I	93.2	Very high	85.6	Confident	4 Å²	4	59 Å²	59	2%	0.021	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	132.5	163.7	-60	154.2	0	0	0	107.7	F22 A32 I34 I75 C91 L126 E127 V128 K129	I20-F22 HydrophobicContact CG2-CD2 4.22Å; I20-F22 HydrophobicContact CG2-CE2 3.69Å; I20-F22 HydrophobicContact CG2-CZ 4.09Å; I20-A32 HydrophobicContact CG2-CB 3.77Å; I20-I34 HydrophobicContact CD1-CG2 4.2Å; I20-I34 HydrophobicContact CG1-CG2 3.94Å; I20-I75 HydrophobicContact CD1-CD1 3.5Å; I20-I75 VanDerWaalsContact CD1-CD1 3.5Å; I20-I75 HydrophobicContact CG1-CD1 4.19Å; I20-C91 HydrophobicContact CD1-CB 4.03Å; I20-L126 HydrophobicContact CD1-CB 3.95Å; I20-L126 HydrophobicContact CD1-CD1 3.7Å; I20-L126 HydrophobicContact CD1-CG 4.47Å; I20-L126 HydrophobicContact CG1-CB 4.29Å; I20-L126 HydrophobicContact CG1-CD1 4.05Å; I20-E127 PolarHBondContact N-O 3.15Å; I20-V128 HydrophobicContact CD1-CG2 4.46Å; I20-V128 WeakPolarHBondContact O-CA 3.28Å; I20-K129 PolarHBondContact O-N 3.4Å
21	H	90.7	Very high	87.2	Confident	91 Å²	91	61.1 Å²	61.1	42%	0.421	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	144	178.6	-62.2	-104.1	0	0	0	110.8	T19 D131	T19-H21 VanDerWaalsContact CG2-NE2 3.28Å; T19-H21 WeakPolarHBondContact CG2-NE2 3.39Å; H21-D131 IonicContact CE1-OD2 3.59Å; H21-D131 IonicContact CG-OD2 3.67Å; H21-D131 IonicContact ND1-OD2 2.69Å; H21-D131 PolarHBondContact ND1-OD2 2.79Å
22	F	89.1	Confident	88.2	Confident	5 Å²	5	61.5 Å²	61.5	2%	0.022	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	154.1	174.3	-76	-68.3	0	0	0	108.1	I20 Q30 A32 I75 C77 V128 K129 F130 D131 S134	I20-F22 HydrophobicContact CG2-CD2 4.22Å; I20-F22 HydrophobicContact CG2-CE2 3.69Å; I20-F22 HydrophobicContact CG2-CZ 4.09Å; F22-Q30 VanDerWaalsContact CB-OE1 3.29Å; F22-Q30 HydrophobicContact CD1-CB 3.77Å; F22-Q30 HydrophobicContact CE1-CB 4.26Å; F22-A32 HydrophobicContact CD1-CB 4.22Å; F22-A32 HydrophobicContact CE1-CB 3.52Å; F22-A32 HydrophobicContact CE2-CB 4.5Å; F22-A32 HydrophobicContact CZ-CB 3.68Å; F22-I75 HydrophobicContact CZ-CB 4.32Å; F22-I75 HydrophobicContact CZ-CG2 3.91Å; F22-C77 HydrophobicContact CD1-CB 3.81Å; F22-C77 HydrophobicContact CD2-CB 4.11Å; F22-C77 HydrophobicContact CE1-CB 3.58Å; F22-C77 HydrophobicContact CE2-CB 3.9Å; F22-C77 HydrophobicContact CG-CB 4.07Å; F22-C77 HydrophobicContact CZ-CB 3.63Å; F22-V128 HydrophobicContact CD2-CG1 3.51Å; F22-V128 HydrophobicContact CE2-CG1 3.69Å; F22-K129 PolarHBondContact N-O 3.41Å; F22-F130 HydrophobicContact CB-CD1 3.97Å; F22-F130 HydrophobicContact CB-CE1 3.99Å; F22-F130 HydrophobicContact CD2-CE1 4.43Å; F22-F130 HydrophobicContact CD2-CZ 4.44Å; F22-F130 HydrophobicContact CG-CE1 4.47Å; F22-F130 CarbonylContact O-C 3.31Å; F22-F130 VanDerWaalsContact O-CA 3.25Å; F22-F130 WeakPolarHBondContact O-CA 3Å; F22-D131 PolarHBondContact O-N 3.21Å; F22-S134 PolarHBondContact O-OG 3.45Å
23	C	83	Confident	88.7	Confident	16 Å²	16	63 Å²	63	11%	0.108	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	155.9	168.8	-66.5	0	0	0	0	111	I25 Q30 D131 S134 C135	C23-I25 HydrophobicContact CB-CB 4.17Å; C23-I25 HydrophobicContact CB-CD1 4.43Å; C23-I25 HydrophobicContact CB-CG1 4.09Å; C23-I25 PolarHBondContact O-N 3.03Å; C23-Q30 PolarHBondContact O-NE2 3.24Å; C23-Q30 PolarHBondContact O-OE1 2.75Å; C23-D131 CarbonylContact C-O 3.54Å; C23-D131 VanDerWaalsContact C-O 3.31Å; C23-D131 VanDerWaalsContact CA-O 3.29Å; C23-D131 WeakPolarHBondContact CA-O 3.06Å; C23-S134 PolarHBondContact N-OG 2.9Å; C23-S134 PolarHBondContact SG-O 3.09Å; C23-C135 WeakPolarHBondContact CB-SG 3.3Å; C23-C135 WeakPolarHBondContact SG-CA 3.3Å; C23-C135 WeakPolarHBondContact SG-CB 3.34Å; C23-C135 CovalentContact SG-SG 2.04Å; C23-C135 PolarHBondContact SG-SG 2.81Å
24	R	77.7	Confident	88.9	Confident	113 Å²	113	60 Å²	60	43%	0.426	31%	0.31	S	S	.	.	S	Bend	trans	-81.1	8.2	163.3	-156.4	171.7	176.3	-168.2	-2.4	113.4	F26 D84 D131	R24-F26 HydrophobicContact CG-CE2 4.33Å; R24-F26 HydrophobicContact CG-CZ 4.06Å; R24-F26 PolarHBondContact O-N 2.97Å; R24-D84 IonicContact CZ-OD1 3.64Å; R24-D84 IonicContact NE-OD1 3.67Å; R24-D84 IonicContact NH2-OD1 2.77Å; R24-D84 PolarHBondContact NH2-OD1 2.93Å; R24-D84 IonicContact NH2-OD2 2.82Å; R24-D84 PolarHBondContact NH2-OD2 2.79Å; R24-D131 PolarHBondContact N-O 2.8Å
25	I	77.9	Confident	89	Confident	82 Å²	82	64.4 Å²	64.4	42%	0.421	33%	0.328	S	S	.	.			trans	-73	109.2	175.1	-56.6	175.2	0	0	0	109.7	C23 I28 Q30 C135	C23-I25 HydrophobicContact CB-CB 4.17Å; C23-I25 HydrophobicContact CB-CD1 4.43Å; C23-I25 HydrophobicContact CB-CG1 4.09Å; C23-I25 PolarHBondContact O-N 3.03Å; I25-I28 HydrophobicContact CG2-CB 4.35Å; I25-I28 HydrophobicContact CG2-CD1 3.79Å; I25-I28 HydrophobicContact CG2-CG1 4.06Å; I25-Q30 PolarHBondContact O-NE2 3.4Å; I25-C135 HydrophobicContact CD1-CB 4.44Å
26	F	76.1	Confident	89.1	Confident	50 Å²	50	59.9 Å²	59.9	22%	0.219	31%	0.311	C	S	.	.			trans	-76.4	167.1	177.7	-56.6	-67.4	0	0	0	112.7	R24 I28 R79 P81	R24-F26 HydrophobicContact CG-CE2 4.33Å; R24-F26 HydrophobicContact CG-CZ 4.06Å; R24-F26 PolarHBondContact O-N 2.97Å; F26-I28 PolarHBondContact O-N 3.18Å; F26-R79 HydrophobicContact CD1-CG 4.27Å; F26-R79 HydrophobicContact CE1-CG 4.18Å; F26-P81 HydrophobicContact CB-CB 3.92Å; F26-P81 HydrophobicContact CB-CG 4.37Å; F26-P81 HydrophobicContact CD1-CB 4.34Å; F26-P81 HydrophobicContact CD2-CB 3.72Å; F26-P81 HydrophobicContact CE2-CB 4.26Å; F26-P81 HydrophobicContact CG-CB 3.75Å
27	D	75.8	Confident	89.1	Confident	111 Å²	111	60.1 Å²	60.1	59%	0.594	30%	0.304	S	S	*	.	S	Bend	trans	59.9	-7.8	176.8	-57.1	-38.8	0	0	0	116.9	R79 L80 P81	D27-R79 PolarHBondContact N-O 3.04Å; D27-L80 VanDerWaalsContact OD1-CD2 3.24Å; D27-L80 WeakPolarHBondContact OD1-CD2 3.49Å; D27-P81 VanDerWaalsContact OD1-CD 3.28Å; D27-P81 WeakPolarHBondContact OD1-CD 3.39Å
28	I	83.1	Confident	89.3	Confident	98 Å²	98	55.7 Å²	55.7	50%	0.503	28%	0.277	S	S	.	.	S	Bend	trans	-92.3	142.6	170.2	-59.7	-169.6	0	0	0	110.6	I25 F26 Q30	I25-I28 HydrophobicContact CG2-CB 4.35Å; I25-I28 HydrophobicContact CG2-CD1 3.79Å; I25-I28 HydrophobicContact CG2-CG1 4.06Å; F26-I28 PolarHBondContact O-N 3.18Å; I28-Q30 PolarHBondContact O-N 2.81Å
29	I	89.1	Confident	89.4	Confident	90 Å²	90	53 Å²	53	46%	0.462	26%	0.263	S	S	.	.			trans	-74.3	113.7	172.9	-59.9	165.9	0	0	0	109	R76 T78	I29-R76 HydrophobicContact CG2-CG 3.73Å; I29-T78 HydrophobicContact CB-CG2 4.37Å; I29-T78 HydrophobicContact CG1-CG2 3.93Å; I29-T78 HydrophobicContact CG2-CG2 4.31Å
30	Q	90.4	Very high	89.2	Confident	19 Å²	19	53 Å²	53	9%	0.089	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	148.3	-179.7	-55.2	-170.8	30.3	0	0	112.2	F22 C23 I25 I28 R76 C77	F22-Q30 VanDerWaalsContact CB-OE1 3.29Å; F22-Q30 HydrophobicContact CD1-CB 3.77Å; F22-Q30 HydrophobicContact CE1-CB 4.26Å; C23-Q30 PolarHBondContact O-NE2 3.24Å; C23-Q30 PolarHBondContact O-OE1 2.75Å; I25-Q30 PolarHBondContact O-NE2 3.4Å; I28-Q30 PolarHBondContact O-N 2.81Å; Q30-R76 WeakPolarHBondContact O-CA 3.35Å; Q30-C77 HydrophobicContact CB-CB 4.47Å; Q30-C77 PolarHBondContact N-O 3.33Å; Q30-C77 PolarHBondContact O-N 2.79Å
31	L	93.1	Very high	89.1	Confident	136 Å²	136	58.5 Å²	58.5	71%	0.712	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.8	122.9	-176.9	-62.4	178.4	0	0	0	111.2	I75 R76	L31-I75 WeakPolarHBondContact CA-O 3.31Å; L31-R76 HydrophobicContact CD2-CB 4.02Å; L31-R76 HydrophobicContact CD2-CG 4.43Å
32	A	93.9	Very high	89	Confident	18 Å²	18	56.2 Å²	56.2	15%	0.149	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	176.4	167.9	0	0	0	0	0	109.8	I20 F22 I75	I20-A32 HydrophobicContact CG2-CB 3.77Å; F22-A32 HydrophobicContact CD1-CB 4.22Å; F22-A32 HydrophobicContact CE1-CB 3.52Å; F22-A32 HydrophobicContact CE2-CB 4.5Å; F22-A32 HydrophobicContact CZ-CB 3.68Å; A32-I75 HydrophobicContact CB-CB 4.46Å; A32-I75 PolarHBondContact N-O 3.17Å; A32-I75 PolarHBondContact O-N 3Å
33	S	96	Very high	89.1	Confident	39 Å²	39	60.2 Å²	60.2	27%	0.273	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	143.9	171.3	67.7	0	0	0	0	112.9	K72 I73	S33-K72 WeakPolarHBondContact OG-CE 3.27Å; S33-I73 WeakPolarHBondContact CA-O 3.28Å; S33-I73 VanDerWaalsContact CB-O 3.27Å; S33-I73 WeakPolarHBondContact CB-O 3.28Å
34	I	97.1	Very high	89.5	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	157.2	166.6	65.1	175	0	0	0	110.2	V14 Y15 I20 L36 L48 K72 I73 I75 V93 L126	V14-I34 HydrophobicContact CG1-CB 4.49Å; V14-I34 HydrophobicContact CG1-CD1 4.18Å; Y15-I34 CarbonylContact O-C 3.54Å; Y15-I34 WeakPolarHBondContact O-CA 3.32Å; Y15-I34 WeakPolarHBondContact O-CB 3.33Å; I20-I34 HydrophobicContact CD1-CG2 4.2Å; I20-I34 HydrophobicContact CG1-CG2 3.94Å; I34-L36 HydrophobicContact CD1-CD2 3.78Å; I34-L36 HydrophobicContact CG1-CD2 4.32Å; I34-L48 HydrophobicContact CD1-CD2 3.86Å; I34-K72 WeakPolarHBondContact O-CA 3.42Å; I34-I73 HydrophobicContact CG1-CB 3.9Å; I34-I73 HydrophobicContact CG1-CG1 4.25Å; I34-I73 PolarHBondContact N-O 2.81Å; I34-I73 PolarHBondContact O-N 3.41Å; I34-I75 HydrophobicContact CG1-CD1 4.22Å; I34-I75 HydrophobicContact CG2-CD1 3.79Å; I34-V93 HydrophobicContact CD1-CG2 3.76Å; I34-L126 HydrophobicContact CD1-CD1 4.04Å; I34-L126 HydrophobicContact CG2-CD1 3.93Å
35	K	97.6	Very high	90.2	Very high	105 Å²	105	54.2 Å²	54.2	46%	0.457	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.6	170.5	-55.6	173.7	-173.8	174.6	0	107.8	V14 Y15 M70 K71	V14-K35 WeakPolarHBondContact CA-O 2.96Å; Y15-K35 PolarHBondContact N-O 2.99Å; Y15-K35 PolarHBondContact O-N 3.03Å; K35-M70 HydrophobicContact CB-CG 4.02Å; K35-M70 HydrophobicContact CB-SD 3.79Å; K35-M70 HydrophobicContact CD-SD 3.71Å; K35-M70 HydrophobicContact CG-SD 4.2Å; K35-K71 WeakPolarHBondContact CA-O 3.28Å
36	L	96.7	Very high	91	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.021	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	125.8	171.7	-52.4	-177.4	0	0	0	108.3	V14 I34 Y46 L65 M70 K71 I73 V93	V14-L36 HydrophobicContact CB-CD2 4.43Å; V14-L36 HydrophobicContact CG1-CD2 4.02Å; V14-L36 HydrophobicContact CG2-CD2 3.83Å; I34-L36 HydrophobicContact CD1-CD2 3.78Å; I34-L36 HydrophobicContact CG1-CD2 4.32Å; L36-Y46 HydrophobicContact CD1-CD1 4.18Å; L36-Y46 HydrophobicContact CD1-CD2 3.59Å; L36-Y46 HydrophobicContact CD1-CE1 4.46Å; L36-Y46 HydrophobicContact CD1-CE2 3.93Å; L36-Y46 HydrophobicContact CD1-CG 3.72Å; L36-L65 HydrophobicContact CB-CD1 3.88Å; L36-L65 HydrophobicContact CB-CD2 4.18Å; L36-M70 CarbonylContact O-C 3.51Å; L36-M70 VanDerWaalsContact O-CA 3.26Å; L36-M70 WeakPolarHBondContact O-CA 3.42Å; L36-K71 PolarHBondContact N-O 2.81Å; L36-K71 PolarHBondContact O-N 2.69Å; L36-I73 HydrophobicContact CD1-CD1 4.18Å; L36-I73 HydrophobicContact CD1-CG1 3.88Å; L36-I73 HydrophobicContact CG-CG1 3.93Å; L36-V93 HydrophobicContact CD1-CG1 4.18Å; L36-V93 HydrophobicContact CD2-CG1 3.93Å; L36-V93 HydrophobicContact CD2-CG2 3.91Å
37	Y	95.8	Very high	91.9	Very high	64 Å²	64	50.2 Å²	50.2	25%	0.251	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	133.5	174.6	179.1	-128.7	0	0	0	110.7	G12 E13 N39 Q69 M70	G12-Y37 CarbonylContact C-O 3.58Å; G12-Y37 WeakPolarHBondContact CA-O 3.36Å; E13-Y37 PolarHBondContact N-O 2.73Å; E13-Y37 PolarHBondContact O-N 3.2Å; E13-Y37 WeakPolarHBondContact OE2-CD1 3.1Å; Y37-N39 HydrophobicContact CD1-CB 4Å; Y37-N39 HydrophobicContact CE1-CB 3.57Å; Y37-Q69 WeakPolarHBondContact CD2-O 3.3Å; Y37-M70 HydrophobicContact CD2-CB 4.13Å; Y37-M70 HydrophobicContact CG-CE 4.35Å
38	N	94.8	Very high	92.8	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.231	C	C	.	.			trans	-101.4	97.9	171.4	177.2	14.3	0	0	0	109.2	T11 S40 E42 V44 L65 Q66 L68 Q69	T11-N38 PolarHBondContact O-OD1 2.84Å; N38-S40 PolarHBondContact O-N 2.73Å; N38-S40 WeakPolarHBondContact OD1-CB 3.39Å; N38-S40 PolarHBondContact OD1-N 2.99Å; N38-S40 VanDerWaalsContact OD1-N 3.07Å; N38-S40 PolarHBondContact OD1-OG 2.84Å; N38-E42 PolarHBondContact ND2-O 3.27Å; N38-V44 WeakPolarHBondContact OD1-CG2 3.33Å; N38-L65 HydrophobicContact CB-CB 3.72Å; N38-L65 HydrophobicContact CB-CD1 3.96Å; N38-L65 HydrophobicContact CB-CG 4.49Å; N38-Q66 WeakPolarHBondContact CB-O 3.43Å; N38-Q66 PolarHBondContact ND2-O 3.2Å; N38-L68 WeakPolarHBondContact O-CA 3.44Å; N38-L68 PolarHBondContact O-N 3.05Å; N38-Q69 PolarHBondContact N-O 3.31Å
39	N	91.9	Very high	93.4	Very high	46 Å²	46	45.8 Å²	45.8	25%	0.246	23%	0.23	C	C	.	.			trans	-78.4	5.2	177.6	63.6	6.6	0	0	0	113.6	T10 T11 G12 E13 Y37	T10-N39 VanDerWaalsContact O-CG 3.31Å; T10-N39 PolarHBondContact O-ND2 3.33Å; T10-N39 PolarHBondContact O-OD1 2.72Å; T11-N39 WeakPolarHBondContact CA-OD1 3.27Å; G12-N39 PolarHBondContact N-OD1 3.08Å; G12-N39 VanDerWaalsContact N-OD1 3.08Å; E13-N39 PolarHBondContact OE1-ND2 3.31Å; Y37-N39 HydrophobicContact CD1-CB 4Å; Y37-N39 HydrophobicContact CE1-CB 3.57Å
40	S	89.6	Confident	93.8	Very high	22 Å²	22	43 Å²	43	15%	0.154	22%	0.217	C	C	.	.	S	Bend	trans	-99.6	165.9	180	84	0	0	0	0	113.4	T11 N38 E42 P67 L68	T11-S40 WeakPolarHBondContact CG2-OG 3.34Å; N38-S40 PolarHBondContact O-N 2.73Å; N38-S40 WeakPolarHBondContact OD1-CB 3.39Å; N38-S40 PolarHBondContact OD1-N 2.99Å; N38-S40 VanDerWaalsContact OD1-N 3.07Å; N38-S40 PolarHBondContact OD1-OG 2.84Å; S40-E42 VanDerWaalsContact C-N 3.3Å; S40-E42 PolarHBondContact OG-N 3.2Å; S40-E42 PolarHBondContact OG-O 3.17Å; S40-P67 WeakPolarHBondContact O-CA 3.34Å; S40-P67 WeakPolarHBondContact O-CB 3.47Å; S40-L68 PolarHBondContact O-N 2.7Å
41	T	90.6	Very high	93.9	Very high	119 Å²	119	45.8 Å²	45.8	73%	0.73	24%	0.235	S	C	*	.	S	Bend	trans	-83.8	0.4	174.2	50.6	0	0	0	0	113.8	P67	T41-P67 WeakPolarHBondContact O-CG 3.29Å
42	E	89.6	Confident	93.9	Very high	43 Å²	43	40 Å²	40	20%	0.201	21%	0.206	C	C	.	.	S	Bend	trans	-115.9	164.7	-177.9	-67.4	-169.4	157.2	0	0	111.1	N38 S40 L97 R100	N38-E42 PolarHBondContact ND2-O 3.27Å; S40-E42 VanDerWaalsContact C-N 3.3Å; S40-E42 PolarHBondContact OG-N 3.2Å; S40-E42 PolarHBondContact OG-O 3.17Å; E42-L97 HydrophobicContact CB-CD2 3.5Å; E42-R100 IonicContact OE1-CZ 3.99Å; E42-R100 IonicContact OE1-NE 3.16Å; E42-R100 PolarHBondContact OE1-NE 2.81Å; E42-R100 IonicContact OE1-NH2 3.33Å; E42-R100 PolarHBondContact OE1-NH2 2.77Å
43	R	91	Very high	93.9	Very high	88 Å²	88	43.1 Å²	43.1	33%	0.332	23%	0.225	S	C	.	.			trans	-79.5	138.1	178.6	-69.2	-169.7	-61.6	-176.9	1.4	110.4	L65 L98 V102	R43-L65 WeakPolarHBondContact CA-O 3.36Å; R43-L98 HydrophobicContact CB-CB 3.97Å; R43-L98 HydrophobicContact CB-CD2 4.28Å; R43-L98 VanDerWaalsContact O-CB 3.32Å; R43-L98 WeakPolarHBondContact O-CB 3.44Å; R43-L98 PolarHBondContact O-N 2.81Å; R43-V102 PolarHBondContact NH2-O 2.8Å
44	V	91.8	Very high	93.7	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.024	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	122.6	178.1	174	0	0	0	0	109.8	T11 N38 F64 L65 A95 L97	T11-V44 HydrophobicContact CG2-CG2 3.61Å; N38-V44 WeakPolarHBondContact OD1-CG2 3.33Å; V44-F64 CarbonylContact O-C 3.57Å; V44-F64 WeakPolarHBondContact O-CA 3.37Å; V44-L65 HydrophobicContact CB-CB 4.4Å; V44-L65 PolarHBondContact N-O 2.99Å; V44-L65 PolarHBondContact O-N 3.11Å; V44-A95 HydrophobicContact CG1-CB 3.94Å; V44-L97 HydrophobicContact CG2-CD2 3.96Å; V44-L97 HydrophobicContact CG2-CG 4.5Å
45	A	92.7	Very high	93.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	140.4	166.1	0	0	0	0	0	110	G63 F64 A95 H96 L98 Y110 W111	A45-G63 WeakPolarHBondContact CA-O 3.4Å; A45-F64 HydrophobicContact CB-CD1 3.73Å; A45-F64 HydrophobicContact CB-CE1 3.77Å; A45-A95 WeakPolarHBondContact O-CA 3.3Å; A45-H96 PolarHBondContact N-O 2.95Å; A45-H96 PolarHBondContact O-N 2.72Å; A45-L98 HydrophobicContact CB-CD1 4.12Å; A45-Y110 HydrophobicContact CB-CD1 3.91Å; A45-Y110 HydrophobicContact CB-CE1 3.23Å; A45-W111 HydrophobicContact CB-CZ2 3.96Å
46	Y	94.1	Very high	93.2	Very high	6 Å²	6	41.4 Å²	41.4	2%	0.024	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	147.7	175.6	67	-88.7	0	0	0	112.8	L36 L48 P60 Y62 G63 L65 I73 V94 W111	L36-Y46 HydrophobicContact CD1-CD1 4.18Å; L36-Y46 HydrophobicContact CD1-CD2 3.59Å; L36-Y46 HydrophobicContact CD1-CE1 4.46Å; L36-Y46 HydrophobicContact CD1-CE2 3.93Å; L36-Y46 HydrophobicContact CD1-CG 3.72Å; Y46-L48 HydrophobicContact CD2-CD1 3.65Å; Y46-L48 HydrophobicContact CE2-CD1 3.81Å; Y46-P60 WeakPolarHBondContact OH-CG 3.45Å; Y46-Y62 WeakPolarHBondContact O-CA 3.48Å; Y46-G63 VanDerWaalsContact CD1-C 3.48Å; Y46-G63 VanDerWaalsContact CD1-O 3.31Å; Y46-G63 WeakPolarHBondContact CD1-O 3.13Å; Y46-G63 PolarHBondContact N-O 2.77Å; Y46-G63 PolarHBondContact O-N 2.86Å; Y46-L65 HydrophobicContact CD1-CD1 4.46Å; Y46-L65 HydrophobicContact CD1-CD2 4Å; Y46-L65 HydrophobicContact CD1-CG 3.79Å; Y46-L65 HydrophobicContact CE1-CD2 3.72Å; Y46-L65 HydrophobicContact CE1-CG 3.99Å; Y46-I73 HydrophobicContact CE2-CD1 3.72Å; Y46-V94 CarbonylContact C-O 3.58Å; Y46-V94 VanDerWaalsContact CA-O 3.28Å; Y46-V94 WeakPolarHBondContact CA-O 3.3Å; Y46-W111 VanDerWaalsContact C-NE1 3.29Å; Y46-W111 PolarHBondContact O-NE1 2.91Å
47	K	94.5	Very high	93.2	Very high	41 Å²	41	46 Å²	46	18%	0.178	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	125.5	173.8	173.1	171.5	-168.2	154.6	0	109.2	Y62 V94 W111	K47-Y62 HydrophobicContact CB-CD1 4.08Å; K47-Y62 HydrophobicContact CB-CE1 4.28Å; K47-Y62 HydrophobicContact CD-CD1 4.09Å; K47-Y62 HydrophobicContact CD-CE1 3.46Å; K47-Y62 VanDerWaalsContact CD-CE1 3.46Å; K47-Y62 VanDerWaalsContact CE-OH 3.28Å; K47-Y62 WeakPolarHBondContact CE-OH 3.06Å; K47-Y62 HydrophobicContact CG-CD1 3.86Å; K47-Y62 HydrophobicContact CG-CE1 3.57Å; K47-Y62 PolarHBondContact NZ-OH 3.07Å; K47-V94 PolarHBondContact N-O 2.88Å; K47-V94 PolarHBondContact O-N 2.9Å; K47-W111 HydrophobicContact CB-CD2 3.68Å; K47-W111 HydrophobicContact CB-CE3 3.98Å; K47-W111 HydrophobicContact CB-CG 4.15Å; K47-W111 HydrophobicContact CB-CH2 4.19Å; K47-W111 HydrophobicContact CB-CZ2 3.88Å; K47-W111 HydrophobicContact CB-CZ3 4.23Å; K47-W111 HydrophobicContact CD-CB 4.39Å; K47-W111 HydrophobicContact CD-CD2 4.05Å; K47-W111 HydrophobicContact CD-CE3 3.83Å; K47-W111 HydrophobicContact CD-CG 4.31Å; K47-W111 HydrophobicContact CD-CZ3 4.45Å; K47-W111 HydrophobicContact CG-CD2 4.48Å
48	L	96	Very high	93.3	Very high	10 Å²	10	43.9 Å²	43.9	5%	0.052	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	142.9	173.8	-64.4	93.1	0	0	0	110.4	I34 Y46 F58 S61 I73 V93	I34-L48 HydrophobicContact CD1-CD2 3.86Å; Y46-L48 HydrophobicContact CD2-CD1 3.65Å; Y46-L48 HydrophobicContact CE2-CD1 3.81Å; L48-F58 HydrophobicContact CB-CB 4.25Å; L48-F58 HydrophobicContact CB-CD1 4.11Å; L48-F58 HydrophobicContact CB-CD2 3.51Å; L48-F58 HydrophobicContact CB-CE1 4.31Å; L48-F58 HydrophobicContact CB-CE2 3.76Å; L48-F58 HydrophobicContact CB-CG 3.69Å; L48-F58 HydrophobicContact CB-CZ 4.14Å; L48-F58 HydrophobicContact CD2-CB 4.15Å; L48-F58 HydrophobicContact CD2-CD1 3.45Å; L48-F58 VanDerWaalsContact CD2-CD1 3.45Å; L48-F58 HydrophobicContact CD2-CD2 4.42Å; L48-F58 HydrophobicContact CD2-CE1 3.85Å; L48-F58 HydrophobicContact CD2-CG 3.76Å; L48-F58 HydrophobicContact CD2-CZ 4.48Å; L48-F58 HydrophobicContact CG-CD1 4.39Å; L48-F58 HydrophobicContact CG-CG 4.27Å; L48-S61 WeakPolarHBondContact CD1-O 3.47Å; L48-S61 PolarHBondContact N-O 3.45Å; L48-I73 HydrophobicContact CD1-CG2 4.29Å; L48-I73 HydrophobicContact CD2-CG2 3.94Å; L48-V93 HydrophobicContact CD2-CG2 4.38Å; L48-V93 HydrophobicContact CG-CG2 4.44Å
49	K	95.6	Very high	93.4	Very high	107 Å²	107	53.6 Å²	53.6	47%	0.465	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	157.2	174.8	-62.4	-174.8	177.7	-173.2	0	109.6	F58 C91 T92 V94	K49-F58 WeakPolarHBondContact O-CZ 3.35Å; K49-C91 CarbonylContact O-C 3.57Å; K49-C91 VanDerWaalsContact O-CA 3.3Å; K49-C91 WeakPolarHBondContact O-CA 3.45Å; K49-T92 PolarHBondContact N-O 2.55Å; K49-T92 PolarHBondContact O-N 3.03Å; K49-V94 HydrophobicContact CD-CG2 4.14Å; K49-V94 HydrophobicContact CG-CG2 4.48Å
50	T	95.9	Very high	93.6	Very high	31 Å²	31	54 Å²	54	19%	0.19	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	154	173.7	177	0	0	0	0	109.8	S52 P53 I56 F58 R90	T50-S52 PolarHBondContact OG1-N 3.29Å; T50-P53 HydrophobicContact CG2-CB 3.98Å; T50-I56 HydrophobicContact CG2-CB 4.19Å; T50-I56 HydrophobicContact CG2-CG2 4.38Å; T50-F58 HydrophobicContact CG2-CE2 3.99Å; T50-F58 HydrophobicContact CG2-CZ 4.38Å; T50-R90 CarbonylContact C-O 3.57Å; T50-R90 VanDerWaalsContact CA-O 3.3Å; T50-R90 WeakPolarHBondContact CA-O 3.48Å
51	T	94	Very high	94	Very high	77 Å²	77	55.1 Å²	55.1	47%	0.472	29%	0.287	S	S	.	.	S	Bend	trans	-65.4	-36.6	167.6	34.3	0	0	0	0	112.8	P53 E89 R90	T51-P53 VanDerWaalsContact C-CD 3.48Å; T51-P53 WeakPolarHBondContact O-CD 3.44Å; T51-E89 WeakPolarHBondContact CB-OE2 3.26Å; T51-E89 PolarHBondContact OG1-OE2 2.97Å; T51-R90 HydrophobicContact CG2-CB 4.13Å; T51-R90 PolarHBondContact N-O 3.21Å; T51-R90 PolarHBondContact OG1-N 3.37Å; T51-R90 PolarHBondContact OG1-O 2.92Å
52	S	92.1	Very high	94.2	Very high	14 Å²	14	52.6 Å²	52.6	10%	0.098	27%	0.265	C	S	.	.			trans	-119.6	78.1	-173.9	-76.2	0	0	0	0	111.4	T50 A54 E55 I56 E89	T50-S52 PolarHBondContact OG1-N 3.29Å; S52-A54 PolarHBondContact O-N 2.96Å; S52-E55 VanDerWaalsContact CB-OE2 3.31Å; S52-E55 WeakPolarHBondContact CB-OE2 3.38Å; S52-E55 PolarHBondContact O-N 2.86Å; S52-I56 PolarHBondContact O-N 2.91Å; S52-E89 VanDerWaalsContact CB-CD 3.47Å; S52-E89 WeakPolarHBondContact CB-OE1 3.47Å; S52-E89 WeakPolarHBondContact CB-OE2 3.27Å; S52-E89 PolarHBondContact OG-OE1 2.79Å; S52-E89 PolarHBondContact OG-OE2 2.94Å
53	P	94.5	Very high	94.4	Very high	85 Å²	85	51 Å²	51	55%	0.552	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-2.1	-173.9	33.3	-38.4	0	0	0	114	T50 T51 K57	T50-P53 HydrophobicContact CG2-CB 3.98Å; T51-P53 VanDerWaalsContact C-CD 3.48Å; T51-P53 WeakPolarHBondContact O-CD 3.44Å; P53-K57 PolarHBondContact O-NZ 3.05Å
54	A	91.4	Very high	94.6	Very high	67 Å²	67	49.1 Å²	49.1	55%	0.554	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-45.8	170.2	0	0	0	0	0	110.1	S52 K57	S52-A54 PolarHBondContact O-N 2.96Å; A54-K57 WeakPolarHBondContact O-CE 3.28Å; A54-K57 PolarHBondContact O-NZ 2.96Å
55	E	90.9	Very high	94.7	Very high	36 Å²	36	49.5 Å²	49.5	17%	0.168	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-40.6	-174.3	-58.6	83.3	167.9	0	0	112.7	S52 C77 T78 Q83	S52-E55 VanDerWaalsContact CB-OE2 3.31Å; S52-E55 WeakPolarHBondContact CB-OE2 3.38Å; S52-E55 PolarHBondContact O-N 2.86Å; E55-C77 CarbonylContact O-C 3.45Å; E55-C77 WeakPolarHBondContact O-CA 3.4Å; E55-T78 PolarHBondContact O-N 3.47Å; E55-T78 PolarHBondContact O-OG1 2.8Å; E55-Q83 PolarHBondContact OE1-NE2 2.85Å
56	I	94	Very high	94.8	Very high	5 Å²	5	53.5 Å²	53.5	3%	0.026	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	121.4	-173.7	-60.5	175.8	0	0	0	110.7	T50 S52 F58 I75 R76 V128	T50-I56 HydrophobicContact CG2-CB 4.19Å; T50-I56 HydrophobicContact CG2-CG2 4.38Å; S52-I56 PolarHBondContact O-N 2.91Å; I56-F58 HydrophobicContact CG2-CE1 4.07Å; I56-F58 HydrophobicContact CG2-CE2 4.5Å; I56-F58 HydrophobicContact CG2-CZ 3.96Å; I56-I75 HydrophobicContact CG2-CG2 3.91Å; I56-R76 WeakPolarHBondContact CA-O 3.39Å; I56-V128 HydrophobicContact CD1-CG1 4.24Å; I56-V128 HydrophobicContact CD1-CG2 4.26Å
57	K	96.4	Very high	94.7	Very high	101 Å²	101	55.5 Å²	55.5	44%	0.439	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	130.8	179.1	-49.2	-64	-175.3	-171.4	0	111.2	P53 A54 R76	P53-K57 PolarHBondContact O-NZ 3.05Å; A54-K57 WeakPolarHBondContact O-CE 3.28Å; A54-K57 PolarHBondContact O-NZ 2.96Å; K57-R76 HydrophobicContact CB-CB 4.47Å; K57-R76 PolarHBondContact N-O 3Å; K57-R76 PolarHBondContact O-N 2.77Å
58	F	97.6	Very high	94.7	Very high	20 Å²	20	58.7 Å²	58.7	9%	0.088	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	141.9	175.7	-47.9	-76.4	0	0	0	111.8	L48 K49 T50 I56 I73 L74 I75 C91	L48-F58 HydrophobicContact CB-CB 4.25Å; L48-F58 HydrophobicContact CB-CD1 4.11Å; L48-F58 HydrophobicContact CB-CD2 3.51Å; L48-F58 HydrophobicContact CB-CE1 4.31Å; L48-F58 HydrophobicContact CB-CE2 3.76Å; L48-F58 HydrophobicContact CB-CG 3.69Å; L48-F58 HydrophobicContact CB-CZ 4.14Å; L48-F58 HydrophobicContact CD2-CB 4.15Å; L48-F58 HydrophobicContact CD2-CD1 3.45Å; L48-F58 VanDerWaalsContact CD2-CD1 3.45Å; L48-F58 HydrophobicContact CD2-CD2 4.42Å; L48-F58 HydrophobicContact CD2-CE1 3.85Å; L48-F58 HydrophobicContact CD2-CG 3.76Å; L48-F58 HydrophobicContact CD2-CZ 4.48Å; L48-F58 HydrophobicContact CG-CD1 4.39Å; L48-F58 HydrophobicContact CG-CG 4.27Å; K49-F58 WeakPolarHBondContact O-CZ 3.35Å; T50-F58 HydrophobicContact CG2-CE2 3.99Å; T50-F58 HydrophobicContact CG2-CZ 4.38Å; I56-F58 HydrophobicContact CG2-CE1 4.07Å; I56-F58 HydrophobicContact CG2-CE2 4.5Å; I56-F58 HydrophobicContact CG2-CZ 3.96Å; F58-I73 HydrophobicContact CB-CG2 4.37Å; F58-L74 CarbonylContact C-O 3.49Å; F58-L74 WeakPolarHBondContact CA-O 3.44Å; F58-I75 HydrophobicContact CD1-CB 4.46Å; F58-I75 HydrophobicContact CD1-CD1 4.2Å; F58-I75 HydrophobicContact CD1-CG1 4.02Å; F58-I75 HydrophobicContact CD1-CG2 3.96Å; F58-I75 HydrophobicContact CE1-CD1 4.14Å; F58-I75 HydrophobicContact CE1-CG1 4.41Å; F58-I75 HydrophobicContact CE1-CG2 3.99Å; F58-C91 HydrophobicContact CE1-CB 4.28Å; F58-C91 HydrophobicContact CZ-CB 4.06Å; F58-C91 VanDerWaalsContact CZ-SG 3.56Å
59	R	97	Very high	94.7	Very high	204 Å²	204	63.6 Å²	63.6	77%	0.77	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.5	115.3	170.3	-74.7	-169.6	173	-179.3	-2	111.8	L74	R59-L74 PolarHBondContact N-O 3.45Å; R59-L74 PolarHBondContact O-N 3.48Å
60	P	96.9	Very high	94.8	Very high	55 Å²	55	63.4 Å²	63.4	36%	0.357	33%	0.331	S	S	.	.	S	Bend	cis	-70.1	151.5	-14.1	33.2	-36.9	0	0	0	111.8	Y46 I73	Y46-P60 WeakPolarHBondContact OH-CG 3.45Å; P60-I73 HydrophobicContact CG-CD1 3.83Å; P60-I73 VanDerWaalsContact O-CG2 3.32Å; P60-I73 WeakPolarHBondContact O-CG2 3.29Å
61	S	96.4	Very high	94.8	Very high	45 Å²	45	66.8 Å²	66.8	32%	0.315	34%	0.343	S	S	.	.	S	Bend	trans	-88.6	-13.7	176	45.4	0	0	0	0	114	L48	L48-S61 WeakPolarHBondContact CD1-O 3.47Å; L48-S61 PolarHBondContact N-O 3.45Å
62	Y	95	Very high	95	Very high	65 Å²	65	69.1 Å²	69.1	26%	0.255	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	151.3	-180	-60.8	-97.4	0	0	0	108.8	Y46 K47 Y108 W111	Y46-Y62 WeakPolarHBondContact O-CA 3.48Å; K47-Y62 HydrophobicContact CB-CD1 4.08Å; K47-Y62 HydrophobicContact CB-CE1 4.28Å; K47-Y62 HydrophobicContact CD-CD1 4.09Å; K47-Y62 HydrophobicContact CD-CE1 3.46Å; K47-Y62 VanDerWaalsContact CD-CE1 3.46Å; K47-Y62 VanDerWaalsContact CE-OH 3.28Å; K47-Y62 WeakPolarHBondContact CE-OH 3.06Å; K47-Y62 HydrophobicContact CG-CD1 3.86Å; K47-Y62 HydrophobicContact CG-CE1 3.57Å; K47-Y62 PolarHBondContact NZ-OH 3.07Å; Y62-Y108 HydrophobicContact CE2-CD2 4.3Å; Y62-W111 HydrophobicContact CD1-CB 3.58Å; Y62-W111 AromaticContact CD1-CD1 3.66Å; Y62-W111 AromaticContact CD1-CG 3.72Å; Y62-W111 HydrophobicContact CD1-CG 3.72Å; Y62-W111 HydrophobicContact CE1-CB 3.71Å; Y62-W111 HydrophobicContact CE1-CG 4.2Å
63	G	95.3	Very high	95.3	Very high	9 Å²	9	68.5 Å²	68.5	9%	0.093	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.4	-169.5	170.5	0	0	0	0	0	114.5	A45 Y46 A107	A45-G63 WeakPolarHBondContact CA-O 3.4Å; Y46-G63 VanDerWaalsContact CD1-C 3.48Å; Y46-G63 VanDerWaalsContact CD1-O 3.31Å; Y46-G63 WeakPolarHBondContact CD1-O 3.13Å; Y46-G63 PolarHBondContact N-O 2.77Å; Y46-G63 PolarHBondContact O-N 2.86Å; G63-A107 VanDerWaalsContact CA-CB 3.47Å
64	F	94.1	Very high	95.4	Very high	50 Å²	50	68.7 Å²	68.7	22%	0.219	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	143	171	-52.5	-66.7	0	0	0	110.1	V44 A45 L98 A104 A107 Y110	V44-F64 CarbonylContact O-C 3.57Å; V44-F64 WeakPolarHBondContact O-CA 3.37Å; A45-F64 HydrophobicContact CB-CD1 3.73Å; A45-F64 HydrophobicContact CB-CE1 3.77Å; F64-L98 HydrophobicContact CD1-CD1 3.81Å; F64-L98 HydrophobicContact CE1-CD1 3.51Å; F64-L98 HydrophobicContact CZ-CD1 4.45Å; F64-A104 HydrophobicContact CE1-CB 4.11Å; F64-A104 HydrophobicContact CE2-CB 4.02Å; F64-A104 HydrophobicContact CZ-CB 3.45Å; F64-A104 VanDerWaalsContact CZ-CB 3.45Å; F64-A107 HydrophobicContact CD2-CB 4.25Å; F64-A107 HydrophobicContact CE1-CB 4.49Å; F64-A107 HydrophobicContact CE2-CB 3.75Å; F64-A107 HydrophobicContact CZ-CB 3.87Å; F64-Y110 AromaticContact CE1-CD1 3.97Å; F64-Y110 HydrophobicContact CE1-CD1 3.97Å; F64-Y110 HydrophobicContact CE1-CD2 4.47Å; F64-Y110 HydrophobicContact CE1-CE1 4.39Å; F64-Y110 HydrophobicContact CE1-CG 4.01Å; F64-Y110 HydrophobicContact CZ-CD1 4.41Å; F64-Y110 HydrophobicContact CZ-CG 4.1Å
65	L	94.5	Very high	95.7	Very high	11 Å²	11	65.5 Å²	65.5	6%	0.058	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	132	165	-54	174.9	0	0	0	107.7	L36 N38 R43 V44 Y46 K71	L36-L65 HydrophobicContact CB-CD1 3.88Å; L36-L65 HydrophobicContact CB-CD2 4.18Å; N38-L65 HydrophobicContact CB-CB 3.72Å; N38-L65 HydrophobicContact CB-CD1 3.96Å; N38-L65 HydrophobicContact CB-CG 4.49Å; R43-L65 WeakPolarHBondContact CA-O 3.36Å; V44-L65 HydrophobicContact CB-CB 4.4Å; V44-L65 PolarHBondContact N-O 2.99Å; V44-L65 PolarHBondContact O-N 3.11Å; Y46-L65 HydrophobicContact CD1-CD1 4.46Å; Y46-L65 HydrophobicContact CD1-CD2 4Å; Y46-L65 HydrophobicContact CD1-CG 3.79Å; Y46-L65 HydrophobicContact CE1-CD2 3.72Å; Y46-L65 HydrophobicContact CE1-CG 3.99Å; L65-K71 HydrophobicContact CD2-CB 3.46Å; L65-K71 VanDerWaalsContact CD2-CB 3.46Å; L65-K71 HydrophobicContact CD2-CG 4.34Å
66	Q	93.9	Very high	95.8	Very high	84 Å²	84	69 Å²	69	39%	0.393	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-72.4	163	168.3	-55.9	-63.8	-2.1	0	0	109.9	N38 Q69	N38-Q66 WeakPolarHBondContact CB-O 3.43Å; N38-Q66 PolarHBondContact ND2-O 3.2Å; Q66-Q69 HydrophobicContact CB-CB 4.21Å; Q66-Q69 HydrophobicContact CB-CG 4.04Å; Q66-Q69 PolarHBondContact O-N 3.05Å
67	P	93.8	Very high	95.8	Very high	49 Å²	49	68.9 Å²	68.9	32%	0.318	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	139.5	171.7	-25.3	36.8	0	0	0	111.6	S40 T41 Q69	S40-P67 WeakPolarHBondContact O-CA 3.34Å; S40-P67 WeakPolarHBondContact O-CB 3.47Å; T41-P67 WeakPolarHBondContact O-CG 3.29Å; P67-Q69 PolarHBondContact O-N 2.98Å
68	L	94.4	Very high	95.4	Very high	108 Å²	108	66 Å²	66	57%	0.565	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	24.1	175.8	-50	-179.2	0	0	0	115	N38 S40	N38-L68 WeakPolarHBondContact O-CA 3.44Å; N38-L68 PolarHBondContact O-N 3.05Å; S40-L68 PolarHBondContact O-N 2.7Å
69	Q	96.1	Very high	94.4	Very high	113 Å²	113	66.4 Å²	66.4	53%	0.528	32%	0.315	S	S	.	.			trans	-113.4	150.3	179	-73.6	-166.8	-3.7	0	0	113.4	Y37 N38 Q66 P67	Y37-Q69 WeakPolarHBondContact CD2-O 3.3Å; N38-Q69 PolarHBondContact N-O 3.31Å; Q66-Q69 HydrophobicContact CB-CB 4.21Å; Q66-Q69 HydrophobicContact CB-CG 4.04Å; Q66-Q69 PolarHBondContact O-N 3.05Å; P67-Q69 PolarHBondContact O-N 2.98Å
70	M	95.9	Very high	92.8	Very high	102 Å²	102	61.7 Å²	61.7	50%	0.502	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	141	175.6	-170.3	-178.2	-71.2	0	0	110.9	K35 L36 Y37	K35-M70 HydrophobicContact CB-CG 4.02Å; K35-M70 HydrophobicContact CB-SD 3.79Å; K35-M70 HydrophobicContact CD-SD 3.71Å; K35-M70 HydrophobicContact CG-SD 4.2Å; L36-M70 CarbonylContact O-C 3.51Å; L36-M70 VanDerWaalsContact O-CA 3.26Å; L36-M70 WeakPolarHBondContact O-CA 3.42Å; Y37-M70 HydrophobicContact CD2-CB 4.13Å; Y37-M70 HydrophobicContact CG-CE 4.35Å
71	K	97.1	Very high	91	Very high	102 Å²	102	61.8 Å²	61.8	44%	0.443	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	122.8	177.8	-168.3	72.2	176.5	-177.3	0	110.9	K35 L36 L65 I73	K35-K71 WeakPolarHBondContact CA-O 3.28Å; L36-K71 PolarHBondContact N-O 2.81Å; L36-K71 PolarHBondContact O-N 2.69Å; L65-K71 HydrophobicContact CD2-CB 3.46Å; L65-K71 VanDerWaalsContact CD2-CB 3.46Å; L65-K71 HydrophobicContact CD2-CG 4.34Å; K71-I73 HydrophobicContact CG-CD1 4.01Å
72	K	97.8	Very high	89.3	Confident	127 Å²	127	67.3 Å²	67.3	55%	0.552	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	130.8	167	-169.2	-179.9	-173.9	-178.8	0	109.3	S33 I34 L74	S33-K72 WeakPolarHBondContact OG-CE 3.27Å; I34-K72 WeakPolarHBondContact O-CA 3.42Å; K72-L74 HydrophobicContact CD-CD2 4.38Å
73	I	97.8	Very high	87.5	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	127	171.5	-49.4	-61.8	0	0	0	107.3	S33 I34 L36 Y46 L48 F58 P60 K71	S33-I73 WeakPolarHBondContact CA-O 3.28Å; S33-I73 VanDerWaalsContact CB-O 3.27Å; S33-I73 WeakPolarHBondContact CB-O 3.28Å; I34-I73 HydrophobicContact CG1-CB 3.9Å; I34-I73 HydrophobicContact CG1-CG1 4.25Å; I34-I73 PolarHBondContact N-O 2.81Å; I34-I73 PolarHBondContact O-N 3.41Å; L36-I73 HydrophobicContact CD1-CD1 4.18Å; L36-I73 HydrophobicContact CD1-CG1 3.88Å; L36-I73 HydrophobicContact CG-CG1 3.93Å; Y46-I73 HydrophobicContact CE2-CD1 3.72Å; L48-I73 HydrophobicContact CD1-CG2 4.29Å; L48-I73 HydrophobicContact CD2-CG2 3.94Å; F58-I73 HydrophobicContact CB-CG2 4.37Å; P60-I73 HydrophobicContact CG-CD1 3.83Å; P60-I73 VanDerWaalsContact O-CG2 3.32Å; P60-I73 WeakPolarHBondContact O-CG2 3.29Å; K71-I73 HydrophobicContact CG-CD1 4.01Å
74	L	97.4	Very high	85.6	Confident	90 Å²	90	70.3 Å²	70.3	47%	0.471	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	140.2	173.5	-60.7	-179.8	0	0	0	109.8	F58 R59 K72	F58-L74 CarbonylContact C-O 3.49Å; F58-L74 WeakPolarHBondContact CA-O 3.44Å; R59-L74 PolarHBondContact N-O 3.45Å; R59-L74 PolarHBondContact O-N 3.48Å; K72-L74 HydrophobicContact CD-CD2 4.38Å
75	I	96.5	Very high	84	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	120.5	177.5	-44.5	-172	0	0	0	107.4	I20 F22 L31 A32 I34 I56 F58	I20-I75 HydrophobicContact CD1-CD1 3.5Å; I20-I75 VanDerWaalsContact CD1-CD1 3.5Å; I20-I75 HydrophobicContact CG1-CD1 4.19Å; F22-I75 HydrophobicContact CZ-CB 4.32Å; F22-I75 HydrophobicContact CZ-CG2 3.91Å; L31-I75 WeakPolarHBondContact CA-O 3.31Å; A32-I75 HydrophobicContact CB-CB 4.46Å; A32-I75 PolarHBondContact N-O 3.17Å; A32-I75 PolarHBondContact O-N 3Å; I34-I75 HydrophobicContact CG1-CD1 4.22Å; I34-I75 HydrophobicContact CG2-CD1 3.79Å; I56-I75 HydrophobicContact CG2-CG2 3.91Å; F58-I75 HydrophobicContact CD1-CB 4.46Å; F58-I75 HydrophobicContact CD1-CD1 4.2Å; F58-I75 HydrophobicContact CD1-CG1 4.02Å; F58-I75 HydrophobicContact CD1-CG2 3.96Å; F58-I75 HydrophobicContact CE1-CD1 4.14Å; F58-I75 HydrophobicContact CE1-CG1 4.41Å; F58-I75 HydrophobicContact CE1-CG2 3.99Å
76	R	94.7	Very high	82.6	Confident	110 Å²	110	81.6 Å²	81.6	42%	0.415	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	131	172.4	169.6	172.8	163.8	164.8	-1.3	108.9	I29 Q30 L31 I56 K57 T78	I29-R76 HydrophobicContact CG2-CG 3.73Å; Q30-R76 WeakPolarHBondContact O-CA 3.35Å; L31-R76 HydrophobicContact CD2-CB 4.02Å; L31-R76 HydrophobicContact CD2-CG 4.43Å; I56-R76 WeakPolarHBondContact CA-O 3.39Å; K57-R76 HydrophobicContact CB-CB 4.47Å; K57-R76 PolarHBondContact N-O 3Å; K57-R76 PolarHBondContact O-N 2.77Å; R76-T78 HydrophobicContact CG-CG2 4.4Å
77	C	92.4	Very high	81.4	Confident	1 Å²	1	84.5 Å²	84.5	1%	0.007	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	141.6	166.1	-168	0	0	0	0	110	F22 Q30 E55	F22-C77 HydrophobicContact CD1-CB 3.81Å; F22-C77 HydrophobicContact CD2-CB 4.11Å; F22-C77 HydrophobicContact CE1-CB 3.58Å; F22-C77 HydrophobicContact CE2-CB 3.9Å; F22-C77 HydrophobicContact CG-CB 4.07Å; F22-C77 HydrophobicContact CZ-CB 3.63Å; Q30-C77 HydrophobicContact CB-CB 4.47Å; Q30-C77 PolarHBondContact N-O 3.33Å; Q30-C77 PolarHBondContact O-N 2.79Å; E55-C77 CarbonylContact O-C 3.45Å; E55-C77 WeakPolarHBondContact O-CA 3.4Å
78	T	89.1	Confident	80.8	Confident	42 Å²	42	86.6 Å²	86.6	26%	0.258	43%	0.428	S	S	.	.			trans	-135.3	82.9	167.3	52.6	0	0	0	0	108.4	I29 E55 R76	I29-T78 HydrophobicContact CB-CG2 4.37Å; I29-T78 HydrophobicContact CG1-CG2 3.93Å; I29-T78 HydrophobicContact CG2-CG2 4.31Å; E55-T78 PolarHBondContact O-N 3.47Å; E55-T78 PolarHBondContact O-OG1 2.8Å; R76-T78 HydrophobicContact CG-CG2 4.4Å
79	R	76.4	Confident	80.5	Confident	27 Å²	27	82 Å²	82	10%	0.102	40%	0.404	C	S	.	.			trans	-91.3	126.7	176.1	-171.1	171.5	-174.3	147.3	1.6	109.2	F26 D27 Q83 F130	F26-R79 HydrophobicContact CD1-CG 4.27Å; F26-R79 HydrophobicContact CE1-CG 4.18Å; D27-R79 PolarHBondContact N-O 3.04Å; R79-Q83 PolarHBondContact NH2-O 2.88Å; R79-F130 HydrophobicContact CB-CE1 4.1Å; R79-F130 HydrophobicContact CG-CE1 4.47Å
80	L	63.6	Low	80.4	Confident	105 Å²	105	82.9 Å²	82.9	55%	0.55	40%	0.402	S	S	.	.			trans	-82	154.5	171.5	-61.3	177.2	0	0	0	109.5	D27 D82	D27-L80 VanDerWaalsContact OD1-CD2 3.24Å; D27-L80 WeakPolarHBondContact OD1-CD2 3.49Å; L80-D82 VanDerWaalsContact C-N 3.27Å; L80-D82 PolarHBondContact O-N 2.94Å
81	P	58.7	Low	80.4	Confident	57 Å²	57	78.1 Å²	78.1	37%	0.37	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-28.5	-174.5	24.9	-33.8	0	0	0	113.8	F26 D27 Q83	F26-P81 HydrophobicContact CB-CB 3.92Å; F26-P81 HydrophobicContact CB-CG 4.37Å; F26-P81 HydrophobicContact CD1-CB 4.34Å; F26-P81 HydrophobicContact CD2-CB 3.72Å; F26-P81 HydrophobicContact CE2-CB 4.26Å; F26-P81 HydrophobicContact CG-CB 3.75Å; D27-P81 VanDerWaalsContact OD1-CD 3.28Å; D27-P81 WeakPolarHBondContact OD1-CD 3.39Å; P81-Q83 PolarHBondContact O-N 2.89Å
82	D	60	Low	80.3	Confident	162 Å²	162	75 Å²	75	87%	0.866	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	24.9	-172.2	-153.7	28.1	0	0	0	114.5	L80	L80-D82 VanDerWaalsContact C-N 3.27Å; L80-D82 PolarHBondContact O-N 2.94Å
83	Q	58	Low	80.2	Confident	39 Å²	39	69.2 Å²	69.2	18%	0.182	34%	0.344	C	S	.	.			trans	-124.3	39.4	174.4	-71.6	-160.5	65.8	0	0	111.8	E55 R79 P81 V85	E55-Q83 PolarHBondContact OE1-NE2 2.85Å; R79-Q83 PolarHBondContact NH2-O 2.88Å; P81-Q83 PolarHBondContact O-N 2.89Å; Q83-V85 PolarHBondContact O-N 2.84Å; Q83-V85 VanDerWaalsContact O-N 3.14Å
84	D	55.9	Low	79.9	Confident	98 Å²	98	69.4 Å²	69.4	52%	0.524	35%	0.345	S	S	.	.			trans	-77.3	11.3	-179.1	-124.7	17.9	0	0	0	114.2	R24	R24-D84 IonicContact CZ-OD1 3.64Å; R24-D84 IonicContact NE-OD1 3.67Å; R24-D84 IonicContact NH2-OD1 2.77Å; R24-D84 PolarHBondContact NH2-OD1 2.93Å; R24-D84 IonicContact NH2-OD2 2.82Å; R24-D84 PolarHBondContact NH2-OD2 2.79Å
85	V	60.1	Low	79.6	Confident	108 Å²	108	65.5 Å²	65.5	66%	0.655	33%	0.326	S	S	*	.	S	Bend	trans	-70.2	146.6	162.8	179.7	0	0	0	0	109.5	Q83 R87	Q83-V85 PolarHBondContact O-N 2.84Å; Q83-V85 VanDerWaalsContact O-N 3.14Å; V85-R87 PolarHBondContact O-N 2.82Å
86	E	65.2	Low	79.2	Confident	189 Å²	189	65.6 Å²	65.6	88%	0.883	33%	0.326	S	S	*	.			trans	-65.5	39.6	-175.3	-54.3	177.9	131.7	0	0	115.6	T88	E86-T88 PolarHBondContact O-N 2.91Å
87	R	68.8	Low	78.9	Confident	146 Å²	146	60.8 Å²	60.8	55%	0.551	31%	0.309	S	S	*	.			trans	-62.3	103.5	176	-74.4	-175.3	169.5	178.1	-4.6	110.3	V85 E89	V85-R87 PolarHBondContact O-N 2.82Å; R87-E89 VanDerWaalsContact C-N 3.33Å; R87-E89 PolarHBondContact O-N 2.66Å
88	T	81.5	Confident	78.7	Confident	92 Å²	92	61.1 Å²	61.1	56%	0.564	31%	0.31	S	S	*	.			trans	-63.7	92.3	167.4	-43.5	0	0	0	0	109.2	E86 R90 E127	E86-T88 PolarHBondContact O-N 2.91Å; T88-R90 HydrophobicContact CG2-CG 4.37Å; T88-R90 WeakPolarHBondContact O-CG 3.16Å; T88-E127 HydrophobicContact CG2-CG 4.32Å
89	E	88.1	Confident	78.2	Confident	12 Å²	12	60.4 Å²	60.4	6%	0.056	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	136.4	177.8	-75.3	-58	160.3	0	0	111	T51 S52 R87 V128 F130	T51-E89 WeakPolarHBondContact CB-OE2 3.26Å; T51-E89 PolarHBondContact OG1-OE2 2.97Å; S52-E89 VanDerWaalsContact CB-CD 3.47Å; S52-E89 WeakPolarHBondContact CB-OE1 3.47Å; S52-E89 WeakPolarHBondContact CB-OE2 3.27Å; S52-E89 PolarHBondContact OG-OE1 2.79Å; S52-E89 PolarHBondContact OG-OE2 2.94Å; R87-E89 VanDerWaalsContact C-N 3.33Å; R87-E89 PolarHBondContact O-N 2.66Å; E89-V128 HydrophobicContact CB-CB 3.77Å; E89-V128 HydrophobicContact CB-CG1 4.41Å; E89-V128 HydrophobicContact CB-CG2 4.36Å; E89-V128 PolarHBondContact O-N 2.84Å; E89-F130 HydrophobicContact CB-CE2 4.43Å; E89-F130 HydrophobicContact CG-CE2 4.41Å
90	R	93.4	Very high	78.4	Confident	131 Å²	131	69.2 Å²	69.2	49%	0.494	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	124.5	-173.2	-55.7	-174.7	77.7	165.6	7.5	111.3	T50 T51 T88 L126	T50-R90 CarbonylContact C-O 3.57Å; T50-R90 VanDerWaalsContact CA-O 3.3Å; T50-R90 WeakPolarHBondContact CA-O 3.48Å; T51-R90 HydrophobicContact CG2-CB 4.13Å; T51-R90 PolarHBondContact N-O 3.21Å; T51-R90 PolarHBondContact OG1-N 3.37Å; T51-R90 PolarHBondContact OG1-O 2.92Å; T88-R90 HydrophobicContact CG2-CG 4.37Å; T88-R90 WeakPolarHBondContact O-CG 3.16Å; R90-L126 CarbonylContact C-O 3.58Å; R90-L126 WeakPolarHBondContact CA-O 3.44Å
91	C	95.5	Very high	79.1	Confident	3 Å²	3	67.9 Å²	67.9	2%	0.02	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	160.1	163.1	-66.1	0	0	0	0	109.9	I20 K49 F58 L126 V128	I20-C91 HydrophobicContact CD1-CB 4.03Å; K49-C91 CarbonylContact O-C 3.57Å; K49-C91 VanDerWaalsContact O-CA 3.3Å; K49-C91 WeakPolarHBondContact O-CA 3.45Å; F58-C91 HydrophobicContact CE1-CB 4.28Å; F58-C91 HydrophobicContact CZ-CB 4.06Å; F58-C91 VanDerWaalsContact CZ-SG 3.56Å; C91-L126 HydrophobicContact CB-CB 4.11Å; C91-L126 PolarHBondContact N-O 2.85Å; C91-L126 PolarHBondContact O-N 3.28Å; C91-V128 HydrophobicContact CB-CG2 4.39Å; C91-V128 VanDerWaalsContact SG-CG2 3.59Å
92	T	95.6	Very high	80.1	Confident	37 Å²	37	67.5 Å²	67.5	23%	0.227	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	124.2	171	-60.4	0	0	0	0	110.4	K49 V94 K123 Y124	K49-T92 PolarHBondContact N-O 2.55Å; K49-T92 PolarHBondContact O-N 3.03Å; T92-V94 HydrophobicContact CG2-CG2 4.2Å; T92-K123 HydrophobicContact CG2-CB 4.09Å; T92-Y124 WeakPolarHBondContact CA-O 3.16Å
93	V	95.2	Very high	81	Confident	4 Å²	4	68.8 Å²	68.8	2%	0.024	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	118.7	167.6	-174.2	0	0	0	0	107.9	V14 I34 L36 L48 K123 Y124 L126	V14-V93 HydrophobicContact CG1-CG2 4.39Å; V14-V93 HydrophobicContact CG2-CG2 4.41Å; I34-V93 HydrophobicContact CD1-CG2 3.76Å; L36-V93 HydrophobicContact CD1-CG1 4.18Å; L36-V93 HydrophobicContact CD2-CG1 3.93Å; L36-V93 HydrophobicContact CD2-CG2 3.91Å; L48-V93 HydrophobicContact CD2-CG2 4.38Å; L48-V93 HydrophobicContact CG-CG2 4.44Å; V93-K123 CarbonylContact O-C 3.2Å; V93-K123 WeakPolarHBondContact O-CA 3.45Å; V93-Y124 HydrophobicContact CB-CD2 4.08Å; V93-Y124 HydrophobicContact CG1-CD2 4.27Å; V93-Y124 PolarHBondContact N-O 3.2Å; V93-Y124 PolarHBondContact O-N 3Å; V93-L126 HydrophobicContact CG2-CD1 4.49Å
94	V	92.3	Very high	81.7	Confident	4 Å²	4	68.1 Å²	68.1	2%	0.024	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	131.2	171.3	-174	0	0	0	0	108.1	Y46 K47 K49 T92 W111 I120	Y46-V94 CarbonylContact C-O 3.58Å; Y46-V94 VanDerWaalsContact CA-O 3.28Å; Y46-V94 WeakPolarHBondContact CA-O 3.3Å; K47-V94 PolarHBondContact N-O 2.88Å; K47-V94 PolarHBondContact O-N 2.9Å; K49-V94 HydrophobicContact CD-CG2 4.14Å; K49-V94 HydrophobicContact CG-CG2 4.48Å; T92-V94 HydrophobicContact CG2-CG2 4.2Å; V94-W111 HydrophobicContact CG1-CH2 4.06Å; V94-W111 HydrophobicContact CG1-CZ3 4.41Å; V94-I120 HydrophobicContact CG1-CD1 4.3Å; V94-I120 HydrophobicContact CG1-CG1 4.1Å; V94-I120 HydrophobicContact CG1-CG2 3.83Å
95	A	91.5	Very high	82.9	Confident	8 Å²	8	70.4 Å²	70.4	7%	0.066	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	142.2	-179.1	0	0	0	0	0	112	V44 A45 D121 K122 Y124	V44-A95 HydrophobicContact CG1-CB 3.94Å; A45-A95 WeakPolarHBondContact O-CA 3.3Å; A95-D121 PolarHBondContact O-N 2.91Å; A95-K122 PolarHBondContact N-O 2.94Å; A95-K122 PolarHBondContact O-N 2.97Å; A95-Y124 HydrophobicContact CB-CE2 4Å
96	H	87.9	Confident	84.3	Confident	3 Å²	3	68.8 Å²	68.8	1%	0.014	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	135.7	172.9	177.1	-126.4	0	0	0	110.7	A45 L98 Y110 W111 L119 D121	A45-H96 PolarHBondContact N-O 2.95Å; A45-H96 PolarHBondContact O-N 2.72Å; H96-L98 PolarHBondContact O-N 2.9Å; H96-Y110 PolarHBondContact ND1-OH 2.9Å; H96-W111 HydrophobicContact CB-CH2 4.38Å; H96-L119 WeakPolarHBondContact CB-O 3.2Å; H96-L119 PolarHBondContact CD2-O 2.73Å; H96-D121 WeakPolarHBondContact CA-OD2 3.02Å; H96-D121 IonicContact CD2-OD2 2.72Å; H96-D121 PolarHBondContact CD2-OD2 2.87Å; H96-D121 IonicContact CG-OD2 2.73Å
97	L	88.5	Confident	85.6	Confident	9 Å²	9	60.3 Å²	60.3	5%	0.047	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	121.5	171.4	-84.9	164.1	0	0	0	111.3	R8 T11 E42 V44 P99 D121	R8-L97 HydrophobicContact CB-CD1 4.35Å; R8-L97 HydrophobicContact CG-CD1 4.12Å; T11-L97 HydrophobicContact CG2-CD1 3.76Å; T11-L97 HydrophobicContact CG2-CD2 3.48Å; T11-L97 VanDerWaalsContact CG2-CD2 3.48Å; T11-L97 HydrophobicContact CG2-CG 3.56Å; E42-L97 HydrophobicContact CB-CD2 3.5Å; V44-L97 HydrophobicContact CG2-CD2 3.96Å; V44-L97 HydrophobicContact CG2-CG 4.5Å; L97-P99 VanDerWaalsContact O-CD 3.28Å; L97-P99 WeakPolarHBondContact O-CD 3.32Å; L97-D121 WeakPolarHBondContact CB-OD2 3.05Å; L97-D121 PolarHBondContact N-OD2 2.94Å
98	L	86.5	Confident	86.6	Confident	8 Å²	8	59.1 Å²	59.1	4%	0.042	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-64.3	118.7	176.7	-149.9	85.2	0	0	0	109.2	R43 A45 F64 H96 V102 A104 Y110	R43-L98 HydrophobicContact CB-CB 3.97Å; R43-L98 HydrophobicContact CB-CD2 4.28Å; R43-L98 VanDerWaalsContact O-CB 3.32Å; R43-L98 WeakPolarHBondContact O-CB 3.44Å; R43-L98 PolarHBondContact O-N 2.81Å; A45-L98 HydrophobicContact CB-CD1 4.12Å; F64-L98 HydrophobicContact CD1-CD1 3.81Å; F64-L98 HydrophobicContact CE1-CD1 3.51Å; F64-L98 HydrophobicContact CZ-CD1 4.45Å; H96-L98 PolarHBondContact O-N 2.9Å; L98-V102 HydrophobicContact CD1-CG1 4.44Å; L98-V102 HydrophobicContact CD2-CB 4.31Å; L98-V102 HydrophobicContact CD2-CG1 4.22Å; L98-V102 WeakPolarHBondContact CD2-O 3.38Å; L98-V102 HydrophobicContact CG-CB 4.2Å; L98-V102 HydrophobicContact CG-CG1 4.09Å; L98-A104 HydrophobicContact CD1-CB 4.49Å; L98-Y110 HydrophobicContact CD1-CD2 3.99Å; L98-Y110 HydrophobicContact CD1-CE1 4.24Å; L98-Y110 HydrophobicContact CD1-CE2 3.41Å; L98-Y110 VanDerWaalsContact CD1-CE2 3.41Å; L98-Y110 HydrophobicContact CG-CE2 4.41Å
99	P	80.2	Confident	87	Confident	27 Å²	27	59 Å²	59	18%	0.175	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-58.8	143.2	-178.8	-24.4	33.9	0	0	0	112	L97 G101 V102 M114	L97-P99 VanDerWaalsContact O-CD 3.28Å; L97-P99 WeakPolarHBondContact O-CD 3.32Å; P99-G101 PolarHBondContact O-N 2.75Å; P99-V102 HydrophobicContact CB-CG2 3.89Å; P99-V102 HydrophobicContact CG-CG2 4.25Å; P99-V102 VanDerWaalsContact O-CB 3.3Å; P99-V102 WeakPolarHBondContact O-CB 3.33Å; P99-V102 WeakPolarHBondContact O-CG2 3.49Å; P99-V102 PolarHBondContact O-N 3.26Å; P99-M114 HydrophobicContact CG-CE 4.26Å
100	R	78.8	Confident	87	Confident	212 Å²	212	59.1 Å²	59.1	80%	0.8	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	135.9	179.8	-64.9	-174.5	-178.6	-164.6	-1.1	110.3	E42 V102	E42-R100 IonicContact OE1-CZ 3.99Å; E42-R100 IonicContact OE1-NE 3.16Å; E42-R100 PolarHBondContact OE1-NE 2.81Å; E42-R100 IonicContact OE1-NH2 3.33Å; E42-R100 PolarHBondContact OE1-NH2 2.77Å; R100-V102 VanDerWaalsContact C-N 3.35Å
101	G	79.7	Confident	86.7	Confident	77 Å²	77	53.5 Å²	53.5	79%	0.794	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.2	-19	-174.5	0	0	0	0	0	115.4	P99 K103	P99-G101 PolarHBondContact O-N 2.75Å; G101-K103 PolarHBondContact O-N 3.45Å
102	V	79.4	Confident	86.2	Confident	49 Å²	49	60 Å²	60	30%	0.297	31%	0.313	S	S	.	.			trans	-68.2	108	179	175.5	0	0	0	0	110.6	R43 L98 P99 R100 A104 Y110	R43-V102 PolarHBondContact NH2-O 2.8Å; L98-V102 HydrophobicContact CD1-CG1 4.44Å; L98-V102 HydrophobicContact CD2-CB 4.31Å; L98-V102 HydrophobicContact CD2-CG1 4.22Å; L98-V102 WeakPolarHBondContact CD2-O 3.38Å; L98-V102 HydrophobicContact CG-CB 4.2Å; L98-V102 HydrophobicContact CG-CG1 4.09Å; P99-V102 HydrophobicContact CB-CG2 3.89Å; P99-V102 HydrophobicContact CG-CG2 4.25Å; P99-V102 VanDerWaalsContact O-CB 3.3Å; P99-V102 WeakPolarHBondContact O-CB 3.33Å; P99-V102 WeakPolarHBondContact O-CG2 3.49Å; P99-V102 PolarHBondContact O-N 3.26Å; R100-V102 VanDerWaalsContact C-N 3.35Å; V102-A104 HydrophobicContact CG1-CB 4.07Å; V102-A104 PolarHBondContact O-N 2.98Å; V102-Y110 HydrophobicContact CG1-CE2 4.42Å
103	K	78.1	Confident	85.6	Confident	189 Å²	189	62.6 Å²	62.6	82%	0.822	33%	0.333	S	S	*	.			trans	-91.6	64.5	169.2	-66.4	-175.5	-179.1	179.8	0	110.4	G101 V105	G101-K103 PolarHBondContact O-N 3.45Å; K103-V105 PolarHBondContact O-N 3.31Å
104	A	74.3	Confident	84.4	Confident	25 Å²	25	64.1 Å²	64.1	21%	0.207	34%	0.34	C	S	.	.			trans	-64.1	122.6	169.9	0	0	0	0	0	109.4	F64 L98 V102 Y110	F64-A104 HydrophobicContact CE1-CB 4.11Å; F64-A104 HydrophobicContact CE2-CB 4.02Å; F64-A104 HydrophobicContact CZ-CB 3.45Å; F64-A104 VanDerWaalsContact CZ-CB 3.45Å; L98-A104 HydrophobicContact CD1-CB 4.49Å; V102-A104 HydrophobicContact CG1-CB 4.07Å; V102-A104 PolarHBondContact O-N 2.98Å; A104-Y110 HydrophobicContact CB-CD2 4.02Å; A104-Y110 HydrophobicContact CB-CG 4.4Å
105	V	79.6	Confident	82.9	Confident	146 Å²	146	72 Å²	72	89%	0.885	38%	0.378	S	S	*	.	S	Bend	trans	-86.7	-52.3	178.6	179.2	0	0	0	0	109.7	K103	K103-V105 PolarHBondContact O-N 3.31Å
106	D	90.5	Very high	81.3	Confident	74 Å²	74	74.3 Å²	74.3	40%	0.396	39%	0.387	S	S	.	.			trans	-103.9	149.8	173.3	175.6	54.4	0	0	0	112.1	Y108 D109	D106-Y108 PolarHBondContact OD1-N 2.7Å; D106-Y108 VanDerWaalsContact OD2-CA 3.29Å; D106-Y108 WeakPolarHBondContact OD2-CA 3.47Å; D106-Y108 VanDerWaalsContact OD2-CB 3.28Å; D106-Y108 WeakPolarHBondContact OD2-CB 3.42Å; D106-Y108 PolarHBondContact OD2-N 3.06Å; D106-D109 PolarHBondContact OD2-N 2.58Å
107	A	91.9	Very high	79.7	Confident	10 Å²	10	80.4 Å²	80.4	8%	0.083	43%	0.425	C	S	.	.	H	α-helix	trans	-88	-32.8	179.2	0	0	0	0	0	113.3	G63 F64 W111	G63-A107 VanDerWaalsContact CA-CB 3.47Å; F64-A107 HydrophobicContact CD2-CB 4.25Å; F64-A107 HydrophobicContact CE1-CB 4.49Å; F64-A107 HydrophobicContact CE2-CB 3.75Å; F64-A107 HydrophobicContact CZ-CB 3.87Å; A107-W111 VanDerWaalsContact O-CB 3.27Å; A107-W111 WeakPolarHBondContact O-CB 3.39Å; A107-W111 PolarHBondContact O-N 2.84Å
108	Y	90.5	Very high	78.4	Confident	121 Å²	121	89 Å²	89	48%	0.475	46%	0.462	S	S	.	.	H	α-helix	trans	-67.3	-44	177.8	169.4	-89.9	0	0	0	111.1	Y62 D106 W111 K112	Y62-Y108 HydrophobicContact CE2-CD2 4.3Å; D106-Y108 PolarHBondContact OD1-N 2.7Å; D106-Y108 VanDerWaalsContact OD2-CA 3.29Å; D106-Y108 WeakPolarHBondContact OD2-CA 3.47Å; D106-Y108 VanDerWaalsContact OD2-CB 3.28Å; D106-Y108 WeakPolarHBondContact OD2-CB 3.42Å; D106-Y108 PolarHBondContact OD2-N 3.06Å; Y108-W111 CarbonylContact O-C 3.49Å; Y108-W111 WeakPolarHBondContact O-CA 3.3Å; Y108-W111 PolarHBondContact O-N 2.85Å; Y108-W111 VanDerWaalsContact O-N 3.11Å; Y108-K112 HydrophobicContact CE1-CD 3.88Å; Y108-K112 VanDerWaalsContact O-CB 3.3Å; Y108-K112 WeakPolarHBondContact O-CB 3.28Å; Y108-K112 PolarHBondContact O-N 2.86Å
109	D	88.5	Confident	77.4	Confident	91 Å²	91	90.6 Å²	90.6	49%	0.487	47%	0.47	S	S	.	.	H	α-helix	trans	-67.4	-36.7	176.2	-77.6	-26.7	0	0	0	112.4	D106 W111 K112 S113	D106-D109 PolarHBondContact OD2-N 2.58Å; D109-W111 VanDerWaalsContact C-N 3.34Å; D109-K112 PolarHBondContact O-N 2.88Å; D109-S113 VanDerWaalsContact O-CB 3.29Å; D109-S113 WeakPolarHBondContact O-CB 3.39Å; D109-S113 PolarHBondContact O-N 2.93Å; D109-S113 PolarHBondContact O-OG 2.9Å
110	Y	88.1	Confident	76.7	Confident	14 Å²	14	92.7 Å²	92.7	6%	0.055	48%	0.479	C	S	.	.	H	α-helix	trans	-60.3	-44.8	167.7	173.6	-88.9	0	0	0	111.1	A45 F64 H96 L98 V102 A104 K112 M114	A45-Y110 HydrophobicContact CB-CD1 3.91Å; A45-Y110 HydrophobicContact CB-CE1 3.23Å; F64-Y110 AromaticContact CE1-CD1 3.97Å; F64-Y110 HydrophobicContact CE1-CD1 3.97Å; F64-Y110 HydrophobicContact CE1-CD2 4.47Å; F64-Y110 HydrophobicContact CE1-CE1 4.39Å; F64-Y110 HydrophobicContact CE1-CG 4.01Å; F64-Y110 HydrophobicContact CZ-CD1 4.41Å; F64-Y110 HydrophobicContact CZ-CG 4.1Å; H96-Y110 PolarHBondContact ND1-OH 2.9Å; L98-Y110 HydrophobicContact CD1-CD2 3.99Å; L98-Y110 HydrophobicContact CD1-CE1 4.24Å; L98-Y110 HydrophobicContact CD1-CE2 3.41Å; L98-Y110 VanDerWaalsContact CD1-CE2 3.41Å; L98-Y110 HydrophobicContact CG-CE2 4.41Å; V102-Y110 HydrophobicContact CG1-CE2 4.42Å; A104-Y110 HydrophobicContact CB-CD2 4.02Å; A104-Y110 HydrophobicContact CB-CG 4.4Å; Y110-K112 PolarHBondContact O-N 3.05Å; Y110-M114 HydrophobicContact CE1-SD 4.14Å; Y110-M114 HydrophobicContact CE2-CE 3.52Å; Y110-M114 HydrophobicContact CE2-SD 3.85Å; Y110-M114 VanDerWaalsContact CZ-SD 3.57Å; Y110-M114 WeakPolarHBondContact OH-CE 3.34Å
111	W	87.8	Confident	76.5	Confident	12 Å²	12	85.1 Å²	85.1	5%	0.045	45%	0.454	C	S	.	.	H	α-helix	trans	-77.7	13.3	176	-76.8	112.9	0	0	0	115.1	A45 Y46 K47 Y62 V94 H96 A107 Y108 D109 F116	A45-W111 HydrophobicContact CB-CZ2 3.96Å; Y46-W111 VanDerWaalsContact C-NE1 3.29Å; Y46-W111 PolarHBondContact O-NE1 2.91Å; K47-W111 HydrophobicContact CB-CD2 3.68Å; K47-W111 HydrophobicContact CB-CE3 3.98Å; K47-W111 HydrophobicContact CB-CG 4.15Å; K47-W111 HydrophobicContact CB-CH2 4.19Å; K47-W111 HydrophobicContact CB-CZ2 3.88Å; K47-W111 HydrophobicContact CB-CZ3 4.23Å; K47-W111 HydrophobicContact CD-CB 4.39Å; K47-W111 HydrophobicContact CD-CD2 4.05Å; K47-W111 HydrophobicContact CD-CE3 3.83Å; K47-W111 HydrophobicContact CD-CG 4.31Å; K47-W111 HydrophobicContact CD-CZ3 4.45Å; K47-W111 HydrophobicContact CG-CD2 4.48Å; Y62-W111 HydrophobicContact CD1-CB 3.58Å; Y62-W111 AromaticContact CD1-CD1 3.66Å; Y62-W111 AromaticContact CD1-CG 3.72Å; Y62-W111 HydrophobicContact CD1-CG 3.72Å; Y62-W111 HydrophobicContact CE1-CB 3.71Å; Y62-W111 HydrophobicContact CE1-CG 4.2Å; V94-W111 HydrophobicContact CG1-CH2 4.06Å; V94-W111 HydrophobicContact CG1-CZ3 4.41Å; H96-W111 HydrophobicContact CB-CH2 4.38Å; A107-W111 VanDerWaalsContact O-CB 3.27Å; A107-W111 WeakPolarHBondContact O-CB 3.39Å; A107-W111 PolarHBondContact O-N 2.84Å; Y108-W111 CarbonylContact O-C 3.49Å; Y108-W111 WeakPolarHBondContact O-CA 3.3Å; Y108-W111 PolarHBondContact O-N 2.85Å; Y108-W111 VanDerWaalsContact O-N 3.11Å; D109-W111 VanDerWaalsContact C-N 3.34Å; W111-F116 VanDerWaalsContact CA-CZ 3.48Å; W111-F116 HydrophobicContact CB-CZ 4.48Å; W111-F116 HydrophobicContact CD2-CE1 4.24Å; W111-F116 AromaticContact CE3-CD1 3.85Å; W111-F116 HydrophobicContact CE3-CD1 3.85Å; W111-F116 AromaticContact CE3-CE1 3.26Å; W111-F116 HydrophobicContact CE3-CE1 3.26Å; W111-F116 AromaticContact CE3-CZ 3.76Å; W111-F116 HydrophobicContact CE3-CZ 3.76Å; W111-F116 AromaticContact CZ3-CD1 3.73Å; W111-F116 HydrophobicContact CZ3-CD1 3.73Å; W111-F116 AromaticContact CZ3-CE1 3.58Å; W111-F116 HydrophobicContact CZ3-CE1 3.58Å; W111-F116 HydrophobicContact CZ3-CZ 4.46Å; W111-F116 WeakPolarHBondContact O-CE2 3.43Å; W111-F116 WeakPolarHBondContact O-CZ 3.45Å
112	K	85.3	Confident	76.9	Confident	139 Å²	139	84.3 Å²	84.3	60%	0.604	43%	0.429	S	S	*	.	H	α-helix	trans	-126.3	-34.6	175.2	-176.7	-178.9	175.5	-173.4	0	113.1	Y108 D109 Y110	Y108-K112 HydrophobicContact CE1-CD 3.88Å; Y108-K112 VanDerWaalsContact O-CB 3.3Å; Y108-K112 WeakPolarHBondContact O-CB 3.28Å; Y108-K112 PolarHBondContact O-N 2.86Å; D109-K112 PolarHBondContact O-N 2.88Å; Y110-K112 PolarHBondContact O-N 3.05Å
113	S	82.2	Confident	77.5	Confident	92 Å²	92	88.6 Å²	88.6	64%	0.643	44%	0.444	S	S	*	.	H	α-helix	trans	-83.3	-27.2	-177.2	54.1	0	0	0	0	114.6	D109	D109-S113 VanDerWaalsContact O-CB 3.29Å; D109-S113 WeakPolarHBondContact O-CB 3.39Å; D109-S113 PolarHBondContact O-N 2.93Å; D109-S113 PolarHBondContact O-OG 2.9Å
114	M	70.9	Confident	78.2	Confident	36 Å²	36	81.4 Å²	81.4	18%	0.177	41%	0.412	C	S	.	.	S	Bend	trans	-71.9	133.5	176.1	-96.2	-173.5	176.1	0	0	112.2	P99 Y110 F116 L119	P99-M114 HydrophobicContact CG-CE 4.26Å; Y110-M114 HydrophobicContact CE1-SD 4.14Å; Y110-M114 HydrophobicContact CE2-CE 3.52Å; Y110-M114 HydrophobicContact CE2-SD 3.85Å; Y110-M114 VanDerWaalsContact CZ-SD 3.57Å; Y110-M114 WeakPolarHBondContact OH-CE 3.34Å; M114-F116 HydrophobicContact CB-CD1 3.89Å; M114-F116 HydrophobicContact CB-CE1 3.3Å; M114-F116 HydrophobicContact CB-CE2 4.25Å; M114-F116 HydrophobicContact CB-CZ 3.46Å; M114-F116 VanDerWaalsContact CB-CZ 3.46Å; M114-F116 HydrophobicContact CG-CE1 4.36Å; M114-F116 WeakPolarHBondContact O-CD2 3.16Å; M114-F116 WeakPolarHBondContact O-CE2 3.19Å; M114-F116 WeakPolarHBondContact O-CZ 3.31Å; M114-F116 PolarHBondContact O-N 3.44Å; M114-F116 HydrophobicContact SD-CE1 4.31Å; M114-L119 HydrophobicContact CE-CD1 4.06Å; M114-L119 HydrophobicContact SD-CD1 4.08Å
115	M	60.5	Low	79.2	Confident	169 Å²	169	83 Å²	83	83%	0.833	42%	0.42	S	S	*	.			trans	-75.9	87.6	165.2	-66.2	-66.3	179.9	0	0	109.1	T117	M115-T117 PolarHBondContact O-N 2.69Å
116	F	58	Low	79.9	Confident	58 Å²	58	76.1 Å²	76.1	25%	0.254	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-61.9	1.1	-166.4	-63.6	-68	0	0	0	117.8	W111 M114 K118	W111-F116 VanDerWaalsContact CA-CZ 3.48Å; W111-F116 HydrophobicContact CB-CZ 4.48Å; W111-F116 HydrophobicContact CD2-CE1 4.24Å; W111-F116 AromaticContact CE3-CD1 3.85Å; W111-F116 HydrophobicContact CE3-CD1 3.85Å; W111-F116 AromaticContact CE3-CE1 3.26Å; W111-F116 HydrophobicContact CE3-CE1 3.26Å; W111-F116 AromaticContact CE3-CZ 3.76Å; W111-F116 HydrophobicContact CE3-CZ 3.76Å; W111-F116 AromaticContact CZ3-CD1 3.73Å; W111-F116 HydrophobicContact CZ3-CD1 3.73Å; W111-F116 AromaticContact CZ3-CE1 3.58Å; W111-F116 HydrophobicContact CZ3-CE1 3.58Å; W111-F116 HydrophobicContact CZ3-CZ 4.46Å; W111-F116 WeakPolarHBondContact O-CE2 3.43Å; W111-F116 WeakPolarHBondContact O-CZ 3.45Å; M114-F116 HydrophobicContact CB-CD1 3.89Å; M114-F116 HydrophobicContact CB-CE1 3.3Å; M114-F116 HydrophobicContact CB-CE2 4.25Å; M114-F116 HydrophobicContact CB-CZ 3.46Å; M114-F116 VanDerWaalsContact CB-CZ 3.46Å; M114-F116 HydrophobicContact CG-CE1 4.36Å; M114-F116 WeakPolarHBondContact O-CD2 3.16Å; M114-F116 WeakPolarHBondContact O-CE2 3.19Å; M114-F116 WeakPolarHBondContact O-CZ 3.31Å; M114-F116 PolarHBondContact O-N 3.44Å; M114-F116 HydrophobicContact SD-CE1 4.31Å; F116-K118 VanDerWaalsContact C-N 3.26Å; F116-K118 PolarHBondContact O-N 3.14Å
117	T	54.9	Low	80	Confident	130 Å²	130	76.2 Å²	76.2	80%	0.798	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-68	-17.9	-167.3	54.5	0	0	0	0	114.9	M115	M115-T117 PolarHBondContact O-N 2.69Å
118	K	60.3	Low	80	Confident	191 Å²	191	76 Å²	76	83%	0.83	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-129.5	7.6	-177	-62.3	-170.7	177.4	-174.9	0	115.5	F116	F116-K118 VanDerWaalsContact C-N 3.26Å; F116-K118 PolarHBondContact O-N 3.14Å
119	L	65.1	Low	80	Confident	41 Å²	41	73.5 Å²	73.5	22%	0.215	37%	0.366	C	S	.	.			trans	-128.6	34.2	-168.1	-65.3	178.5	0	0	0	114.2	H96 M114	H96-L119 WeakPolarHBondContact CB-O 3.2Å; H96-L119 PolarHBondContact CD2-O 2.73Å; M114-L119 HydrophobicContact CE-CD1 4.06Å; M114-L119 HydrophobicContact SD-CD1 4.08Å
120	I	66.3	Low	79.9	Confident	71 Å²	71	71 Å²	71	36%	0.364	35%	0.351	S	S	.	.			trans	-98.5	94.9	168.9	-61.7	173.9	0	0	0	107.8	V94 K122 K123	V94-I120 HydrophobicContact CG1-CD1 4.3Å; V94-I120 HydrophobicContact CG1-CG1 4.1Å; V94-I120 HydrophobicContact CG1-CG2 3.83Å; I120-K122 VanDerWaalsContact C-N 3.33Å; I120-K123 HydrophobicContact CG2-CG 3.78Å
121	D	75.4	Confident	79.6	Confident	52 Å²	52	73.1 Å²	73.1	28%	0.278	36%	0.363	S	S	.	.			trans	-62.6	-43.5	175.2	-66.7	-48.4	0	0	0	110.2	R8 A95 H96 L97	R8-D121 VanDerWaalsContact CD-OD1 3.27Å; R8-D121 WeakPolarHBondContact CD-OD1 3.27Å; R8-D121 IonicContact CZ-OD1 3.98Å; R8-D121 IonicContact NH1-OD1 3.18Å; R8-D121 PolarHBondContact NH1-OD1 3.3Å; R8-D121 IonicContact NH1-OD2 3.07Å; R8-D121 PolarHBondContact NH1-OD2 2.86Å; A95-D121 PolarHBondContact O-N 2.91Å; H96-D121 WeakPolarHBondContact CA-OD2 3.02Å; H96-D121 IonicContact CD2-OD2 2.72Å; H96-D121 PolarHBondContact CD2-OD2 2.87Å; H96-D121 IonicContact CG-OD2 2.73Å; L97-D121 WeakPolarHBondContact CB-OD2 3.05Å; L97-D121 PolarHBondContact N-OD2 2.94Å
122	K	87.4	Confident	78.9	Confident	61 Å²	61	77.4 Å²	77.4	27%	0.265	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	152.5	-177.5	-81.1	-165.5	163.2	-159.8	0	114.8	A95 I120 Y124	A95-K122 PolarHBondContact N-O 2.94Å; A95-K122 PolarHBondContact O-N 2.97Å; I120-K122 VanDerWaalsContact C-N 3.33Å; K122-Y124 HydrophobicContact CB-CE2 4Å; K122-Y124 HydrophobicContact CD-CE1 3.99Å; K122-Y124 HydrophobicContact CD-CE2 4.39Å; K122-Y124 WeakPolarHBondContact CD-OH 3.37Å
123	K	91.2	Very high	78	Confident	139 Å²	139	78 Å²	78	60%	0.604	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.2	133.4	165.4	-58.8	174.4	-171.4	167.6	0	108	T92 V93 I120	T92-K123 HydrophobicContact CG2-CB 4.09Å; V93-K123 CarbonylContact O-C 3.2Å; V93-K123 WeakPolarHBondContact O-CA 3.45Å; I120-K123 HydrophobicContact CG2-CG 3.78Å
124	Y	93.6	Very high	77.2	Confident	37 Å²	37	75.9 Å²	75.9	15%	0.145	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	104.1	170.9	-49	-93.6	0	0	0	107	G12 V14 T92 V93 A95 K122	G12-Y124 VanDerWaalsContact C-OH 3.31Å; G12-Y124 PolarHBondContact N-OH 2.82Å; G12-Y124 PolarHBondContact O-OH 2.77Å; V14-Y124 HydrophobicContact CG2-CD1 3.9Å; V14-Y124 HydrophobicContact CG2-CD2 3.8Å; V14-Y124 HydrophobicContact CG2-CE1 4.41Å; V14-Y124 HydrophobicContact CG2-CE2 4.33Å; V14-Y124 HydrophobicContact CG2-CG 3.56Å; T92-Y124 WeakPolarHBondContact CA-O 3.16Å; V93-Y124 HydrophobicContact CB-CD2 4.08Å; V93-Y124 HydrophobicContact CG1-CD2 4.27Å; V93-Y124 PolarHBondContact N-O 3.2Å; V93-Y124 PolarHBondContact O-N 3Å; A95-Y124 HydrophobicContact CB-CE2 4Å; K122-Y124 HydrophobicContact CB-CE2 4Å; K122-Y124 HydrophobicContact CD-CE1 3.99Å; K122-Y124 HydrophobicContact CD-CE2 4.39Å; K122-Y124 WeakPolarHBondContact CD-OH 3.37Å
125	P	94.4	Very high	76.7	Confident	58 Å²	58	75.9 Å²	75.9	38%	0.377	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	147.3	172.6	31.7	-33.4	0	0	0	109.3
126	L	95.2	Very high	76.8	Confident	2 Å²	2	75.7 Å²	75.7	1%	0.01	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	122.8	168.8	-63.3	171.6	0	0	0	107.5	V14 D18 I20 I34 R90 C91 V93	V14-L126 HydrophobicContact CG1-CD1 4.04Å; V14-L126 HydrophobicContact CG1-CD2 4.24Å; D18-L126 CarbonylContact O-C 3.42Å; D18-L126 WeakPolarHBondContact O-CA 3.33Å; I20-L126 HydrophobicContact CD1-CB 3.95Å; I20-L126 HydrophobicContact CD1-CD1 3.7Å; I20-L126 HydrophobicContact CD1-CG 4.47Å; I20-L126 HydrophobicContact CG1-CB 4.29Å; I20-L126 HydrophobicContact CG1-CD1 4.05Å; I34-L126 HydrophobicContact CD1-CD1 4.04Å; I34-L126 HydrophobicContact CG2-CD1 3.93Å; R90-L126 CarbonylContact C-O 3.58Å; R90-L126 WeakPolarHBondContact CA-O 3.44Å; C91-L126 HydrophobicContact CB-CB 4.11Å; C91-L126 PolarHBondContact N-O 2.85Å; C91-L126 PolarHBondContact O-N 3.28Å; V93-L126 HydrophobicContact CG2-CD1 4.49Å
127	E	93.5	Very high	76.7	Confident	76 Å²	76	78.4 Å²	78.4	36%	0.355	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	151.6	167.3	-163.9	178.7	179.5	0	0	109.7	D18 T19 I20 T88 K129	D18-E127 PolarHBondContact O-N 3.19Å; T19-E127 CarbonylContact C-O 3.59Å; T19-E127 WeakPolarHBondContact CA-O 3.29Å; I20-E127 PolarHBondContact N-O 3.15Å; T88-E127 HydrophobicContact CG2-CG 4.32Å; E127-K129 VanDerWaalsContact CD-NZ 3.27Å; E127-K129 HydrophobicContact CG-CG 4.43Å; E127-K129 VanDerWaalsContact OE1-CE 3.3Å; E127-K129 WeakPolarHBondContact OE1-CE 3.25Å; E127-K129 IonicContact OE1-NZ 3.67Å; E127-K129 VanDerWaalsContact OE2-CE 3.27Å; E127-K129 WeakPolarHBondContact OE2-CE 3.24Å; E127-K129 IonicContact OE2-NZ 2.66Å; E127-K129 PolarHBondContact OE2-NZ 2.76Å
128	V	91.9	Very high	76.8	Confident	7 Å²	7	77.2 Å²	77.2	4%	0.042	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	112.1	178.4	-174.6	0	0	0	0	108.8	I20 F22 I56 E89 C91 F130	I20-V128 HydrophobicContact CD1-CG2 4.46Å; I20-V128 WeakPolarHBondContact O-CA 3.28Å; F22-V128 HydrophobicContact CD2-CG1 3.51Å; F22-V128 HydrophobicContact CE2-CG1 3.69Å; I56-V128 HydrophobicContact CD1-CG1 4.24Å; I56-V128 HydrophobicContact CD1-CG2 4.26Å; E89-V128 HydrophobicContact CB-CB 3.77Å; E89-V128 HydrophobicContact CB-CG1 4.41Å; E89-V128 HydrophobicContact CB-CG2 4.36Å; E89-V128 PolarHBondContact O-N 2.84Å; C91-V128 HydrophobicContact CB-CG2 4.39Å; C91-V128 VanDerWaalsContact SG-CG2 3.59Å; V128-F130 HydrophobicContact CB-CE2 4.49Å; V128-F130 HydrophobicContact CG1-CE2 3.78Å; V128-F130 HydrophobicContact CG1-CZ 3.96Å
129	K	89.5	Confident	76.4	Confident	68 Å²	68	76.5 Å²	76.5	30%	0.296	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	152.5	-177.1	-65.8	-168.1	176.6	103.1	0	111.7	T19 I20 F22 E127	T19-K129 HydrophobicContact CG2-CB 4.16Å; T19-K129 HydrophobicContact CG2-CD 3.86Å; T19-K129 HydrophobicContact CG2-CG 3.75Å; T19-K129 PolarHBondContact OG1-NZ 3.32Å; I20-K129 PolarHBondContact O-N 3.4Å; F22-K129 PolarHBondContact N-O 3.41Å; E127-K129 VanDerWaalsContact CD-NZ 3.27Å; E127-K129 HydrophobicContact CG-CG 4.43Å; E127-K129 VanDerWaalsContact OE1-CE 3.3Å; E127-K129 WeakPolarHBondContact OE1-CE 3.25Å; E127-K129 IonicContact OE1-NZ 3.67Å; E127-K129 VanDerWaalsContact OE2-CE 3.27Å; E127-K129 WeakPolarHBondContact OE2-CE 3.24Å; E127-K129 IonicContact OE2-NZ 2.66Å; E127-K129 PolarHBondContact OE2-NZ 2.76Å
130	F	86.7	Confident	76.1	Confident	39 Å²	39	79.8 Å²	79.8	17%	0.171	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	83.9	-173.6	-68.7	-91.4	0	0	0	108.7	F22 R79 E89 V128	F22-F130 HydrophobicContact CB-CD1 3.97Å; F22-F130 HydrophobicContact CB-CE1 3.99Å; F22-F130 HydrophobicContact CD2-CE1 4.43Å; F22-F130 HydrophobicContact CD2-CZ 4.44Å; F22-F130 HydrophobicContact CG-CE1 4.47Å; F22-F130 CarbonylContact O-C 3.31Å; F22-F130 VanDerWaalsContact O-CA 3.25Å; F22-F130 WeakPolarHBondContact O-CA 3Å; R79-F130 HydrophobicContact CB-CE1 4.1Å; R79-F130 HydrophobicContact CG-CE1 4.47Å; E89-F130 HydrophobicContact CB-CE2 4.43Å; E89-F130 HydrophobicContact CG-CE2 4.41Å; V128-F130 HydrophobicContact CB-CE2 4.49Å; V128-F130 HydrophobicContact CG1-CE2 3.78Å; V128-F130 HydrophobicContact CG1-CZ 3.96Å
131	D	82.6	Confident	75.4	Confident	57 Å²	57	82.4 Å²	82.4	31%	0.305	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	150.7	-171	-55.9	-20.1	0	0	0	110.3	H21 F22 C23 R24 D133	H21-D131 IonicContact CE1-OD2 3.59Å; H21-D131 IonicContact CG-OD2 3.67Å; H21-D131 IonicContact ND1-OD2 2.69Å; H21-D131 PolarHBondContact ND1-OD2 2.79Å; F22-D131 PolarHBondContact O-N 3.21Å; C23-D131 CarbonylContact C-O 3.54Å; C23-D131 VanDerWaalsContact C-O 3.31Å; C23-D131 VanDerWaalsContact CA-O 3.29Å; C23-D131 WeakPolarHBondContact CA-O 3.06Å; R24-D131 PolarHBondContact N-O 2.8Å; D131-D133 VanDerWaalsContact C-N 3.33Å
132	V	71.6	Confident	74.2	Confident	103 Å²	103	84.8 Å²	84.8	62%	0.624	47%	0.469	S	S	*	.	S	Bend	trans	-70.1	-35	178.3	179.9	0	0	0	0	111.1
133	D	67	Low	72.5	Confident	151 Å²	151	88.3 Å²	88.3	81%	0.807	50%	0.496	S	S	*	.	S	Bend	trans	-99.9	-5.4	-163.9	-48.5	-52.9	0	0	0	114.8	D131 C135	D131-D133 VanDerWaalsContact C-N 3.33Å; D133-C135 PolarHBondContact O-N 2.04Å
134	S	64.9	Low	70.4	Confident	48 Å²	48	86.2 Å²	86.2	34%	0.336	50%	0.499	S	S	.	.			trans	-80.6	36	-169.6	76.5	0	0	0	0	114.4	F22 C23	F22-S134 PolarHBondContact O-OG 3.45Å; C23-S134 PolarHBondContact N-OG 2.9Å; C23-S134 PolarHBondContact SG-O 3.09Å
135	C	60.5	Low	68	Low	36 Å²	36	90.1 Å²	90.1	24%	0.243	53%	0.532	C	S	.	.			trans	-110.4	86.2	-166.7	-56.7	0	0	0	0	113.2	C23 I25 D133 V137	C23-C135 WeakPolarHBondContact CB-SG 3.3Å; C23-C135 WeakPolarHBondContact SG-CA 3.3Å; C23-C135 WeakPolarHBondContact SG-CB 3.34Å; C23-C135 CovalentContact SG-SG 2.04Å; C23-C135 PolarHBondContact SG-SG 2.81Å; I25-C135 HydrophobicContact CD1-CB 4.44Å; D133-C135 PolarHBondContact O-N 2.04Å; C135-V137 PolarHBondContact O-N 2.91Å
136	D	62.3	Low	66	Low	164 Å²	164	96.4 Å²	96.4	88%	0.877	55%	0.549	S	S	*	.			trans	-61.9	90.8	151.4	-71.5	-37.7	0	0	0	107.8	P138	D136-P138 VanDerWaalsContact O-CD 3.27Å; D136-P138 WeakPolarHBondContact O-CD 3.27Å; D136-P138 VanDerWaalsContact O-N 3.16Å
137	V	57.1	Low	63.7	Low	115 Å²	115	102.1 Å²	102.1	70%	0.697	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-60.8	116.5	-178.3	178	0	0	0	0	108.9	C135 E139	C135-V137 PolarHBondContact O-N 2.91Å; V137-E139 PolarHBondContact O-N 3.32Å
138	P	56.7	Low	61.4	Low	106 Å²	106	102.8 Å²	102.8	69%	0.688	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-67.9	126	172.2	28.7	-32.1	0	0	0	108.1	D136	D136-P138 VanDerWaalsContact O-CD 3.27Å; D136-P138 WeakPolarHBondContact O-CD 3.27Å; D136-P138 VanDerWaalsContact O-N 3.16Å
139	E	51.9	Low	59.5	Low	175 Å²	175	109.1 Å²	109.1	82%	0.818	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-53	138.8	174.4	-82.4	-163.9	127.2	0	0	110.3	V137 V141	V137-E139 PolarHBondContact O-N 3.32Å; E139-V141 PolarHBondContact O-N 2.93Å
140	P	59.6	Low	57.5	Low	110 Å²	110	111.7 Å²	111.7	71%	0.714	65%	0.652	S	S	*	*			trans	-62.9	108.8	172.5	27.3	-32.9	0	0	0	108.1	S142	P140-S142 PolarHBondContact O-N 2.96Å
141	V	50.8	Low	55.8	Low	127 Å²	127	117 Å²	117	77%	0.77	68%	0.68	S	S	*	*			trans	-63.1	105.8	176.7	-169.6	0	0	0	0	107.5	E139 T143	E139-V141 PolarHBondContact O-N 2.93Å; V141-T143 VanDerWaalsContact C-N 3.27Å; V141-T143 PolarHBondContact O-N 2.87Å
142	S	49.9	Very low	54.2	Low	102 Å²	102	120.9 Å²	120.9	71%	0.713	70%	0.699	S	S	*	*			trans	-66.9	78	-171.5	-64.4	0	0	0	0	113.1	P140 S144	P140-S142 PolarHBondContact O-N 2.96Å; S142-S144 PolarHBondContact O-N 2.74Å
143	T	52.1	Low	52.9	Low	134 Å²	134	119.8 Å²	119.8	82%	0.822	70%	0.701	S	S	*	*			trans	-74.8	62.7	169.2	54.4	0	0	0	0	110.2	V141	V141-T143 VanDerWaalsContact C-N 3.27Å; V141-T143 PolarHBondContact O-N 2.87Å
144	S	46.2	Very low	51.7	Low	95 Å²	95	119.1 Å²	119.1	66%	0.664	70%	0.698	S	S	*	*			trans	-123.3	37.3	-179.4	68.9	0	0	0	0	112.4	S142 Y146	S142-S144 PolarHBondContact O-N 2.74Å; S144-Y146 PolarHBondContact O-N 3.4Å
145	S	44.2	Very low	50.8	Low	120 Å²	120	123.4 Å²	123.4	84%	0.839	72%	0.722	S	S	*	*			trans	-76.6	53	161.3	33.4	0	0	0	0	111	T147	S145-T147 PolarHBondContact O-N 3Å
146	Y	51.3	Low	50.1	Low	189 Å²	189	127.1 Å²	127.1	74%	0.741	75%	0.748	S	S	*	*			trans	-83.9	101	165.7	-174.5	-97.4	0	0	0	108.3	S144 S148	S144-Y146 PolarHBondContact O-N 3.4Å; Y146-S148 WeakPolarHBondContact CD1-OG 3.48Å; Y146-S148 PolarHBondContact O-N 2.97Å
147	T	47.8	Very low	49.4	Very low	122 Å²	122	124.2 Å²	124.2	75%	0.748	74%	0.741	S	S	*	*			trans	-67.7	96.8	169.7	-0.7	0	0	0	0	108.4	S145 I149	S145-T147 PolarHBondContact O-N 3Å; T147-I149 VanDerWaalsContact C-N 3.3Å; T147-I149 PolarHBondContact O-N 2.81Å
148	S	44	Very low	48.9	Very low	91 Å²	91	123.6 Å²	123.6	64%	0.636	74%	0.742	S	S	*	*			trans	-63.2	87.6	174.8	-65.5	0	0	0	0	110.9	Y146 T150	Y146-S148 WeakPolarHBondContact CD1-OG 3.48Å; Y146-S148 PolarHBondContact O-N 2.97Å; S148-T150 PolarHBondContact O-N 3.03Å; S148-T150 VanDerWaalsContact O-N 3.13Å
149	I	52.4	Low	48.9	Very low	139 Å²	139	127 Å²	127	71%	0.713	75%	0.748	S	S	*	*			trans	-70.5	104.9	167.6	-64.2	177.1	0	0	0	107.3	T147 I151	T147-I149 VanDerWaalsContact C-N 3.3Å; T147-I149 PolarHBondContact O-N 2.81Å; I149-I151 HydrophobicContact CG2-CG1 4.13Å; I149-I151 PolarHBondContact O-N 2.96Å
150	T	47.6	Very low	48.7	Very low	123 Å²	123	127.2 Å²	127.2	76%	0.755	75%	0.749	S	S	*	*			trans	-69.8	92.1	173.5	-26.2	0	0	0	0	109	S148 I152	S148-T150 PolarHBondContact O-N 3.03Å; S148-T150 VanDerWaalsContact O-N 3.13Å; T150-I152 PolarHBondContact O-N 3.13Å
151	I	51.3	Low	48.6	Very low	150 Å²	150	126.1 Å²	126.1	77%	0.769	74%	0.744	S	S	*	*			trans	-71.3	100.6	173.9	-58.6	179.2	0	0	0	107.9	I149 A153	I149-I151 HydrophobicContact CG2-CG1 4.13Å; I149-I151 PolarHBondContact O-N 2.96Å; I151-A153 PolarHBondContact O-N 3.12Å
152	I	49.7	Very low	48.6	Very low	138 Å²	138	129.1 Å²	129.1	71%	0.708	75%	0.75	S	S	*	*			trans	-71.9	108.8	172.5	-57.1	177.1	0	0	0	107.7	T150 N154	T150-I152 PolarHBondContact O-N 3.13Å; I152-N154 WeakPolarHBondContact CG2-OD1 3.47Å; I152-N154 PolarHBondContact O-N 3.21Å; I152-N154 VanDerWaalsContact O-N 3.12Å
153	A	44.7	Very low	48.8	Very low	80 Å²	80	129 Å²	129	66%	0.661	75%	0.749	S	S	*	*			trans	-79.2	90.4	177.9	0	0	0	0	0	110.5	I151 T155	I151-A153 PolarHBondContact O-N 3.12Å; A153-T155 PolarHBondContact O-N 3.05Å
154	N	40.6	Very low	48.6	Very low	138 Å²	138	128.8 Å²	128.8	74%	0.738	75%	0.748	S	S	*	*			trans	-72.2	95.4	172.5	-79	6.7	0	0	0	110.8	I152	I152-N154 WeakPolarHBondContact CG2-OD1 3.47Å; I152-N154 PolarHBondContact O-N 3.21Å; I152-N154 VanDerWaalsContact O-N 3.12Å
155	T	45.3	Very low	48.5	Very low	137 Å²	137	130.5 Å²	130.5	84%	0.84	75%	0.754	S	S	*	*			trans	-120.3	92.4	163.5	54.6	0	0	0	0	109.4	A153	A153-T155 PolarHBondContact O-N 3.05Å
156	S	46	Very low	48.9	Very low	115 Å²	115	130.4 Å²	130.4	80%	0.804	75%	0.754	S	S	*	*			trans	-121	125.3	178.5	56.6	0	0	0	0	110.5
157	S	49	Very low	48.7	Very low	103 Å²	103	126.2 Å²	126.2	72%	0.72	75%	0.752	S	S	*	*			trans	-131.7	133.7	169.4	54.7	0	0	0	0	108.7
158	S	46.7	Very low	49	Very low	102 Å²	102	125.5 Å²	125.5	71%	0.713	75%	0.752	S	S	*	*			trans	53.4	121.6	143.7	63.8	0	0	0	0	117.7
159	E	55	Low	48.9	Very low	177 Å²	177	129.5 Å²	129.5	83%	0.827	76%	0.761	S	S	*	*			cis	-157	166.3	17.1	-55	-178	108.1	0	0	110.6
160	E	49.6	Very low	48.7	Very low	180 Å²	180	128.4 Å²	128.4	84%	0.841	77%	0.766	S	S	*	*			trans	55	147.5	158	-64.1	-147.4	67	0	0	120.9
161	S	56	Low	48.4	Very low	87 Å²	87	128 Å²	128	61%	0.608	76%	0.762	S	S	*	*			cis	-158.9	164.4	-16.5	-98.2	0	0	0	0	109
162	E	52.1	Low	47.8	Very low	189 Å²	189	128 Å²	128	88%	0.883	76%	0.762	S	S	*	*			trans	7.3	133.2	163.7	-55.4	-176.1	130.4	0	0	119.5
163	S	54.1	Low	47.2	Very low	101 Å²	101	126.8 Å²	126.8	71%	0.706	76%	0.762	S	S	*	*			cis	-163.8	-159.8	4	58.1	0	0	0	0	107.7
164	T	46.7	Very low	47.2	Very low	129 Å²	129	128.9 Å²	128.9	79%	0.791	77%	0.772	S	S	*	*			cis	-151	-159	12.9	-19.7	0	0	0	0	110.7
165	T	45.1	Very low	47	Very low	130 Å²	130	128.4 Å²	128.4	80%	0.798	77%	0.774	S	S	*	*			trans	-106.1	143.2	-167.5	51	0	0	0	0	116.2
166	S	51.8	Low	47	Very low	119 Å²	119	127.1 Å²	127.1	83%	0.832	77%	0.771	S	S	*	*				-166.9	145.2	120	-172.8	0	0	0	0	112.4
167	S	47.2	Very low	47.1	Very low	100 Å²	100	127.2 Å²	127.2	70%	0.699	77%	0.772	S	S	*	*			trans	-80.9	178.4	169.8	60	0	0	0	0	111
168	S	53.3	Low	47.1	Very low	108 Å²	108	126.8 Å²	126.8	76%	0.755	77%	0.769	S	S	*	*			cis	-158.9	-177.3	37	-42.9	0	0	0	0	114.6
169	E	42.2	Very low	46.9	Very low	174 Å²	174	127.3 Å²	127.3	81%	0.813	77%	0.771	S	S	*	*			trans	-88.8	154.9	-164.2	-57.7	156	88	0	0	117
170	S	49.3	Very low	46.5	Very low	117 Å²	117	128.3 Å²	128.3	82%	0.818	77%	0.767	S	S	*	*			trans	-178.4	137.7	137.2	29.5	0	0	0	0	109
171	V	41.4	Very low	46.3	Very low	113 Å²	113	125.5 Å²	125.5	69%	0.685	75%	0.754	S	S	*	*			cis	99.2	107.9	14.7	-175.7	0	0	0	0	114.8
172	I	37.9	Very low	45.7	Very low	150 Å²	150	128.5 Å²	128.5	77%	0.769	76%	0.763	S	S	*	*			trans	83.1	107.1	165.3	-63.7	165.8	0	0	0	119.2
173	T	37.9	Very low	45.5	Very low	113 Å²	113	122.6 Å²	122.6	69%	0.693	75%	0.753	S	S	*	*			trans	43.1	135.4	132.3	-45.6	0	0	0	0	122.3
174	S	44.1	Very low	44.6	Very low	125 Å²	125	124.3 Å²	124.3	87%	0.874	76%	0.759	S	S	*	*			trans	-149.3	142	150.7	-80.4	0	0	0	0	112.5
175	T	36.9	Very low	44.7	Very low	127 Å²	127	128 Å²	128	78%	0.779	76%	0.76	S	S	*	*			trans	-124.7	127.3	-178.1	48	0	0	0	0	112.4
176	S	45.6	Very low	44.1	Very low	111 Å²	111	127.7 Å²	127.7	78%	0.776	76%	0.759	S	S	*	*			trans	-155.2	117.6	165	-50	0	0	0	0	107.8
177	S	47	Very low	43.9	Very low	117 Å²	117	128 Å²	128	82%	0.818	76%	0.755	S	S	*	*				75.2	152.5	89	89.1	0	0	0	0	113.8
178	S	50.2	Low	43.3	Very low	94 Å²	94	129.2 Å²	129.2	66%	0.657	76%	0.759	S	S	*	*			cis	-157	164.7	13	70.9	0	0	0	0	112.7
179	C	41.5	Very low	42.8	Very low	113 Å²	113	128.7 Å²	128.7	76%	0.764	76%	0.755	S	S	*	*			trans	61.4	146.5	149.8	-64.3	0	0	0	0	119.9
180	R	45.8	Very low	43	Very low	198 Å²	198	126 Å²	126	75%	0.747	76%	0.755	S	S	*	*			cis	-170.1	164.6	-3.6	-102.1	176.1	85	-161.9	0.6	105.7
181	E	45.8	Very low	42.6	Very low	120 Å²	120	128.3 Å²	128.3	56%	0.561	76%	0.757	S	S	*	*			cis	-175	161.9	-6.8	169.8	170.5	100.3	0	0	110.3
182	N	43.5	Very low	43	Very low	150 Å²	150	130.8 Å²	130.8	80%	0.802	77%	0.766	S	S	*	*			trans	67.5	132.6	167.9	-70.9	-23.4	0	0	0	120.9
183	G	49.4	Very low	43.2	Very low	66 Å²	66	126.5 Å²	126.5	68%	0.68	76%	0.76	S	S	*	*			trans	158.4	67.7	169.1	0	0	0	0	0	115.8
184	T	33.5	Very low	43.6	Very low	136 Å²	136	128.2 Å²	128.2	83%	0.834	77%	0.77	S	S	*	*			trans	-77.3	128.4	-173.7	-47.4	0	0	0	0	114.2
185	Y	49.1	Very low	43.5	Very low	207 Å²	207	127.8 Å²	127.8	81%	0.812	76%	0.762	S	S	*	*			trans	-152.2	134.8	152.4	37.7	-93.4	0	0	0	112.3
186	T	32.5	Very low	43.5	Very low	124 Å²	124	127.7 Å²	127.7	76%	0.761	76%	0.762	S	S	*	*			trans	-96.8	130.3	-178.6	-48.7	0	0	0	0	110.5	T188	T186-T188 HydrophobicContact CG2-CG2 4.39Å
187	T	47.5	Very low	43.2	Very low	124 Å²	124	128.8 Å²	128.8	76%	0.761	76%	0.763	S	S	*	*			trans	-136.2	126.7	171	-58.3	0	0	0	0	110
188	T	35.9	Very low	42.7	Very low	126 Å²	126	129 Å²	129	77%	0.773	77%	0.765	S	S	*	*			trans	-127.8	116.9	-176.3	50	0	0	0	0	111.9	T186	T186-T188 HydrophobicContact CG2-CG2 4.39Å
189	S	42.9	Very low	42.5	Very low	97 Å²	97	130.4 Å²	130.4	68%	0.678	78%	0.775	S	S	*	*			trans	-169.6	94.7	159.6	52.6	0	0	0	0	107.5
190	S	44.9	Very low	42.4	Very low	117 Å²	117	131 Å²	131	82%	0.818	78%	0.78	S	S	*	*				70.2	102.7	86.9	69.6	0	0	0	0	112.4
191	I	41	Very low	42.2	Very low	166 Å²	166	125.4 Å²	125.4	85%	0.851	78%	0.784	S	S	*	*			trans	-100.8	121.6	177.1	-63.9	168.7	0	0	0	108.7
192	D	51.2	Low	42.2	Very low	165 Å²	165	125 Å²	125	88%	0.882	80%	0.795	S	S	*	*			trans	-152.4	145.3	155.3	-82.5	-52.7	0	0	0	106
193	G	42	Very low	42.5	Very low	61 Å²	61	123.5 Å²	123.5	63%	0.629	80%	0.795	S	S	*	*			cis	129.2	89.4	3.3	0	0	0	0	0	111.4
194	T	44.7	Very low	42.5	Very low	148 Å²	148	126.9 Å²	126.9	91%	0.908	80%	0.803	S	S	*	*			trans	-177.2	153.6	156.6	-77.7	0	0	0	0	109.9
195	T	42.2	Very low	43	Very low	116 Å²	116	125 Å²	125	71%	0.712	80%	0.801	S	S	*	*			trans	-113.7	171.7	-161.5	-33.1	0	0	0	0	113.5
196	T	37	Very low	42.6	Very low	126 Å²	126	126.3 Å²	126.3	77%	0.773	81%	0.805	S	S	*	*			trans	70.2	154.4	161.3	35.3	0	0	0	0	117.6
197	V	40.5	Very low	43.1	Very low	133 Å²	133	132.3 Å²	132.3	81%	0.806	81%	0.813	S	S	*	*			cis	-132.7	150	8.8	-135	0	0	0	0	111.7
198	S	36.3	Very low	42.9	Very low	123 Å²	123	131.7 Å²	131.7	86%	0.86	81%	0.814	S	S	*	*			trans	-92.5	140.4	167.6	-57.4	0	0	0	0	111.1
199	S	44.3	Very low	43.3	Very low	122 Å²	122	131.1 Å²	131.1	85%	0.853	82%	0.815	S	S	*	*			trans	-131.7	111.4	171.6	45.4	0	0	0	0	111.4
200	S	40.2	Very low	43.4	Very low	127 Å²	127	132.8 Å²	132.8	89%	0.888	82%	0.821	S	S	*	*			trans	-90.4	102.2	-178	33.3	0	0	0	0	111.6
201	G	42.4	Very low	43.2	Very low	79 Å²	79	133.2 Å²	133.2	81%	0.814	82%	0.824	S	S	*	*			trans	-95.3	90.8	175.9	0	0	0	0	0	112.9
202	S	45.5	Very low	43.5	Very low	113 Å²	113	130 Å²	130	79%	0.79	82%	0.822	S	S	*	*			trans	-76.5	134.9	169.2	-176.4	0	0	0	0	110.7
203	S	49.3	Very low	43.1	Very low	117 Å²	117	129.4 Å²	129.4	82%	0.818	83%	0.825	S	S	*	*			trans	-136.5	133	165.5	58.8	0	0	0	0	110.3
204	V	49.6	Very low	43.2	Very low	138 Å²	138	129.4 Å²	129.4	84%	0.836	83%	0.825	S	S	*	*			trans	-93.3	150.8	-170.1	173.8	0	0	0	0	110.8
205	A	43.4	Very low	43.3	Very low	97 Å²	97	127.4 Å²	127.4	80%	0.802	82%	0.823	S	S	*	*			trans	-53.4	142.8	-174.2	0	0	0	0	0	115.2
206	R	41	Very low	43.7	Very low	234 Å²	234	126.6 Å²	126.6	88%	0.883	82%	0.822	S	S	*	*			trans	-146.9	109.8	145.9	-162.6	165.4	-174.9	160.7	0.2	111.5
207	R	42.4	Very low	44.3	Very low	249 Å²	249	127 Å²	127	94%	0.94	82%	0.824	S	S	*	*			trans	-70.4	135	157.2	-87.1	-179.4	168.3	171.5	-4.5	108.3
208	S	45.1	Very low	44.7	Very low	111 Å²	111	129.5 Å²	129.5	78%	0.776	83%	0.827	S	S	*	*			trans	-154.2	137.8	154.3	-158	0	0	0	0	109.1
209	S	43.2	Very low	45.3	Very low	115 Å²	115	128.5 Å²	128.5	80%	0.804	82%	0.82	S	S	*	*			trans	-127.4	115.2	-173.7	52.8	0	0	0	0	109.7
210	V	45.6	Very low	45.6	Very low	132 Å²	132	128.8 Å²	128.8	80%	0.8	82%	0.821	S	S	*	*			trans	-140.9	125.5	167.9	-176.3	0	0	0	0	108.2
211	S	40.4	Very low	46.3	Very low	125 Å²	125	129.1 Å²	129.1	87%	0.874	82%	0.818	S	S	*	*			trans	-89.5	138.3	168.4	-54.8	0	0	0	0	109.2
212	A	47.6	Very low	46.5	Very low	99 Å²	99	131.5 Å²	131.5	82%	0.818	82%	0.816	S	S	*	*			trans	-140.6	141.7	172.8	0	0	0	0	0	110.4
213	T	42	Very low	46.8	Very low	153 Å²	153	129.8 Å²	129.8	94%	0.939	82%	0.816	S	S	*	*			trans	-109.2	135.3	-168.4	-47.3	0	0	0	0	111.8
214	G	44.2	Very low	46.9	Very low	61 Å²	61	128.8 Å²	128.8	63%	0.629	81%	0.809	S	S	*	*			trans	-163.1	132.1	165.1	0	0	0	0	0	107.9
215	A	47.3	Very low	47.1	Very low	105 Å²	105	130.8 Å²	130.8	87%	0.868	81%	0.809	S	S	*	*				65.5	128.5	61.5	0	0	0	0	0	111.4
216	S	51.1	Low	47.4	Very low	99 Å²	99	132.7 Å²	132.7	69%	0.692	81%	0.811	S	S	*	*			cis	-161.6	164.6	7.6	-162.6	0	0	0	0	111.4
217	V	49.5	Very low	47.9	Very low	134 Å²	134	126.3 Å²	126.3	81%	0.812	81%	0.809	S	S	*	*			trans	56.4	164.2	165.8	-67.4	0	0	0	0	116.6
218	E	49.5	Very low	48.5	Very low	187 Å²	187	119.1 Å²	119.1	87%	0.874	80%	0.802	S	S	*	*			cis	-130.3	173.4	16.9	-64.5	177.5	110.5	0	0	114.1
219	S	47.3	Very low	49.3	Very low	101 Å²	101	119.1 Å²	119.1	71%	0.706	80%	0.802	S	S	*	*			trans	-139	121.5	-177.6	59	0	0	0	0	112.8
220	C	51.5	Low	49.7	Very low	129 Å²	129	121.4 Å²	121.4	87%	0.872	81%	0.805	S	S	*	*			trans	-125.1	113.9	164.8	-64.6	0	0	0	0	107
221	T	54.8	Low	50.5	Low	134 Å²	134	119.2 Å²	119.2	82%	0.822	81%	0.81	S	S	*	*				79.4	126.9	52.8	-54.6	0	0	0	0	112.2
222	V	45.9	Very low	51.2	Low	129 Å²	129	122.7 Å²	122.7	78%	0.782	81%	0.809	S	S	*	*			trans	-76.5	144.4	-169.3	176.9	0	0	0	0	111.8
223	G	53.1	Low	52.1	Low	77 Å²	77	127.4 Å²	127.4	79%	0.794	81%	0.812	S	S	*	*			trans	-121.7	134.7	162.2	0	0	0	0	0	110.3
224	S	50	Low	53.1	Low	95 Å²	95	125.1 Å²	125.1	66%	0.664	80%	0.798	S	S	*	*			trans	-123.7	169.6	-177.5	-61.8	0	0	0	0	110.6
225	E	54	Low	53.9	Low	181 Å²	181	130.7 Å²	130.7	85%	0.846	81%	0.807	S	S	*	*			trans	69.5	163.2	169.9	-50.2	-179.7	97.8	0	0	114.3
226	T	50.7	Low	54.7	Low	136 Å²	136	134.9 Å²	134.9	83%	0.834	81%	0.809	S	S	*	*			cis	-137.9	172.9	5.2	-27.6	0	0	0	0	110.5
227	A	50.3	Low	55.4	Low	101 Å²	101	134.5 Å²	134.5	84%	0.835	81%	0.807	S	S	*	*			trans	-96.1	154.2	-175.3	0	0	0	0	0	115.4
228	A	55.2	Low	56.2	Low	97 Å²	97	142.9 Å²	142.9	80%	0.802	83%	0.826	S	S	*	*			trans	-149.1	118.8	158.3	0	0	0	0	0	107.3
229	S	62.8	Low	56.5	Low	111 Å²	111	140.7 Å²	140.7	78%	0.776	82%	0.823	S	S	*	*				96.1	93	58.9	-178.5	0	0	0	0	112.6
230	N	51.2	Low	57	Low	163 Å²	163	142.7 Å²	142.7	87%	0.872	83%	0.829	S	S	*	*			trans	17.1	120.4	152.2	-58.5	-8.3	0	0	0	119.5
231	G	62	Low	57.3	Low	87 Å²	87	143.5 Å²	143.5	90%	0.897	83%	0.827	S	S	*	*			trans	-121.5	106.3	156.7	0	0	0	0	0	110.5
232	F	56.1	Low	57.4	Low	197 Å²	197	144.1 Å²	144.1	86%	0.864	83%	0.827	S	S	*	*			trans	-110.1	126.7	176.4	-146.1	-84.9	0	0	0	107.7
233	F	65.9	Low	58.1	Low	198 Å²	198	145 Å²	145	87%	0.868	83%	0.83	S	S	*	*			trans	-145.2	154.9	167.2	-148.1	-98.2	0	0	0	111.9
234	T	62.4	Low	58.5	Low	105 Å²	105	149.5 Å²	149.5	64%	0.644	83%	0.833	S	S	*	*			trans	-93.3	148.9	-152.3	35.2	0	0	0	0	116
235	Q	62	Low	59.1	Low	178 Å²	178	153.4 Å²	153.4	83%	0.832	85%	0.845	S	S	*	*			trans	-52.2	138.6	159.2	171.9	-172.4	56.9	0	0	112.2
236	Q	63.3	Low	59.5	Low	194 Å²	194	151.3 Å²	151.3	91%	0.907	85%	0.845	S	S	*	*			trans	-147.2	154.3	146.9	-130.5	169	4.1	0	0	109.9
237	S	65.2	Low	60.2	Low	91 Å²	91	152.6 Å²	152.6	64%	0.636	85%	0.845	S	S	*	*			trans	-145.2	152.8	-176.5	-57.8	0	0	0	0	109
238	Y	66.2	Low	61.1	Low	309 Å²	309	157.3 Å²	157.3	100%	1.212	85%	0.846	S	S	*	*			trans	72	0	-162.2	-66.1	-87.3	0	0	0	114.4

Retrieved 238 of 238 residues in 121.2 ms (Link to these results)

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