A0A2K6CRQ8_MACNE Loading...

START domain-containing protein 10

AlphaFold DB , UniProt , Accession A0A2K6CRQ8, Species MACNE (Macaca nemestrina, Pig-tailed macaque), Gene STARD10, Length 291 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	41.3	Very low	38.9	Very low	248 Å²	248	149.5 Å²	149.5	100%	1.222	85%	0.845	S	S	*	*				0	90.6	0	-80	176.3	172	0	0	107.2
2	E	37.3	Very low	39	Very low	198 Å²	198	141.3 Å²	141.3	93%	0.925	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-76.8	133.2	174.7	-74.9	177.2	130.2	0	0	109.2
3	K	37.1	Very low	39.3	Very low	201 Å²	201	138.2 Å²	138.2	87%	0.874	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-69.9	133.9	171.3	-83.7	-179.9	172.6	179.3	0	108.6
4	P	40.7	Very low	40.1	Very low	125 Å²	125	139.6 Å²	139.6	81%	0.812	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-71.4	136.7	173.8	19.4	-13.6	0	0	0	110.1
5	A	42.1	Very low	41	Very low	100 Å²	100	135.7 Å²	135.7	83%	0.826	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-60.4	135.5	174.1	0	0	0	0	0	110.4	S7	A5-S7 PolarHBondContact O-N 3.06Å
6	A	41.2	Very low	41.8	Very low	97 Å²	97	128.1 Å²	128.1	80%	0.802	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-63.1	119.5	175.2	0	0	0	0	0	109.7	T8	A6-T8 PolarHBondContact O-N 2.96Å
7	S	34.9	Very low	42.2	Very low	108 Å²	108	122.8 Å²	122.8	76%	0.755	70%	0.699	S	S	*	*			trans	-64.6	111.4	169.1	49.7	0	0	0	0	109.3	A5 E9	A5-S7 PolarHBondContact O-N 3.06Å; S7-E9 PolarHBondContact O-N 3.1Å; S7-E9 VanDerWaalsContact O-N 3.12Å
8	T	40.5	Very low	42.8	Very low	137 Å²	137	119.8 Å²	119.8	84%	0.84	70%	0.7	S	S	*	*			trans	-71.7	98.9	166	43.8	0	0	0	0	108.4	A6	A6-T8 PolarHBondContact O-N 2.96Å
9	E	36.8	Very low	44	Very low	164 Å²	164	115.6 Å²	115.6	77%	0.766	67%	0.671	S	S	*	*			trans	-58.9	140.8	165.3	-71.9	-173.9	156.3	0	0	109.7	S7 Q11	S7-E9 PolarHBondContact O-N 3.1Å; S7-E9 VanDerWaalsContact O-N 3.12Å; E9-Q11 PolarHBondContact O-N 3.07Å
10	P	37.2	Very low	45.6	Very low	126 Å²	126	119.9 Å²	119.9	82%	0.818	68%	0.684	S	S	*	*			trans	-62.7	113.4	172.1	24.6	-29.8	0	0	0	108.4	G12	P10-G12 PolarHBondContact O-N 3.26Å
11	Q	38.6	Very low	47.5	Very low	141 Å²	141	117.3 Å²	117.3	66%	0.659	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-58.5	124.4	175.2	-69	179.8	4.4	0	0	108.7	E9	E9-Q11 PolarHBondContact O-N 3.07Å
12	G	40.2	Very low	50	Low	51 Å²	51	105.9 Å²	105.9	53%	0.526	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-57.6	166.3	176.5	0	0	0	0	0	112.5	P10 R14	P10-G12 PolarHBondContact O-N 3.26Å; G12-R14 PolarHBondContact O-N 2.91Å
13	P	43.6	Very low	52.7	Low	101 Å²	101	100 Å²	100	66%	0.656	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-56.3	116.6	179.3	21.3	-30.5	0	0	0	110.3
14	R	50.7	Low	55.5	Low	158 Å²	158	92.3 Å²	92.3	60%	0.596	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-78.2	124	171.9	-69.8	-174.1	-163.2	-179.8	3.2	108.2	G12 V16	G12-R14 PolarHBondContact O-N 2.91Å; R14-V16 PolarHBondContact O-N 2.99Å
15	P	53.6	Low	58.1	Low	81 Å²	81	86.8 Å²	86.8	53%	0.526	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-63.1	134.1	171.2	24.1	-29.7	0	0	0	109.4	L17	P15-L17 PolarHBondContact O-N 2.98Å
16	V	53	Low	60.7	Low	14 Å²	14	85.7 Å²	85.7	9%	0.085	51%	0.505	C	S	.	.	S	Bend	trans	-56.8	-34.7	172.1	-177.3	0	0	0	0	109.9	R14 G18 R19 D29 Y148	R14-V16 PolarHBondContact O-N 2.99Å; V16-G18 PolarHBondContact O-N 3.28Å; V16-R19 WeakPolarHBondContact O-CD 3.42Å; V16-D29 HydrophobicContact CG2-CB 4.15Å; V16-Y148 HydrophobicContact CG1-CD1 3.4Å; V16-Y148 VanDerWaalsContact CG1-CD1 3.4Å; V16-Y148 HydrophobicContact CG1-CE1 3.37Å; V16-Y148 HydrophobicContact CG1-CG 4.05Å
17	L	49.3	Very low	63.2	Low	38 Å²	38	86.4 Å²	86.4	20%	0.199	50%	0.495	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	87.1	171.1	-117.5	102.2	0	0	0	111.7	P15 Y148 I167	P15-L17 PolarHBondContact O-N 2.98Å; L17-Y148 HydrophobicContact CD1-CD2 3.39Å; L17-Y148 HydrophobicContact CD1-CE2 4.32Å; L17-Y148 HydrophobicContact CD1-CG 3.79Å; L17-I167 HydrophobicContact CB-CG2 4.04Å; L17-I167 VanDerWaalsContact CD1-O 3.28Å; L17-I167 WeakPolarHBondContact CD1-O 3.21Å; L17-I167 HydrophobicContact CD2-CG2 4.29Å
18	G	53.2	Low	66.1	Low	69 Å²	69	85.6 Å²	85.6	71%	0.711	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-172.6	11.7	168.3	0	0	0	0	0	111.3	V16	V16-G18 PolarHBondContact O-N 3.28Å
19	R	64.1	Low	68.7	Low	40 Å²	40	79.3 Å²	79.3	15%	0.151	44%	0.441	C	S	.	.			trans	-96.1	139.9	-171.2	-63.8	171.5	172.9	-169.8	9.8	108.1	V16 S21 D29	V16-R19 WeakPolarHBondContact O-CD 3.42Å; R19-S21 WeakPolarHBondContact CB-O 3.46Å; R19-S21 PolarHBondContact O-N 2.91Å; R19-D29 IonicContact CZ-OD1 2.95Å; R19-D29 IonicContact CZ-OD2 3.79Å; R19-D29 IonicContact NH1-OD2 3.57Å; R19-D29 PolarHBondContact NH1-OD2 3.48Å; R19-D29 VanDerWaalsContact NH1-OD2 3.14Å; R19-D29 IonicContact NH2-OD1 3.48Å; R19-D29 PolarHBondContact NH2-OD1 3.29Å; R19-D29 IonicContact NH2-OD2 3.84Å; R19-D29 PolarHBondContact NH2-OD2 3.05Å
20	E	76.3	Confident	71.6	Confident	200 Å²	200	71.7 Å²	71.7	94%	0.935	41%	0.405	S	S	*	.	S	Bend	trans	-65.4	-15.5	178.2	-63.3	179.6	161.1	0	0	112.6
21	S	86.4	Confident	74.5	Confident	66 Å²	66	72.4 Å²	72.4	46%	0.462	39%	0.391	S	S	.	.	S	Bend	trans	-140.1	159.2	-179.8	54.1	0	0	0	0	111.8	R19	R19-S21 WeakPolarHBondContact CB-O 3.46Å; R19-S21 PolarHBondContact O-N 2.91Å
22	V	93.1	Very high	77.3	Confident	9 Å²	9	66.6 Å²	66.6	6%	0.055	37%	0.366	C	S	.	.			trans	-67.6	134.8	174.1	-175.2	0	0	0	0	109.2	L133 Y148 V150 L249 L252 S253 V254	V22-L133 HydrophobicContact CG1-CD1 3.79Å; V22-Y148 HydrophobicContact CG1-CE2 4.47Å; V22-Y148 WeakPolarHBondContact CG1-OH 3.43Å; V22-V150 HydrophobicContact CG1-CG1 3.69Å; V22-V150 HydrophobicContact CG2-CG1 4.29Å; V22-L249 HydrophobicContact CB-CD1 4.26Å; V22-L249 HydrophobicContact CG1-CD1 3.77Å; V22-L249 WeakPolarHBondContact O-CD2 3.37Å; V22-L252 HydrophobicContact CB-CB 4.17Å; V22-L252 HydrophobicContact CG1-CB 4.08Å; V22-L252 HydrophobicContact CG1-CD1 4.06Å; V22-L252 HydrophobicContact CG2-CB 3.88Å; V22-S253 WeakPolarHBondContact CG2-O 3.44Å; V22-V254 HydrophobicContact CG2-CG2 4.19Å
23	Q	94.3	Very high	80	Confident	74 Å²	74	64.2 Å²	64.2	35%	0.346	34%	0.341	S	S	.	.			trans	-134.4	137.3	-179.9	-66.9	-168.3	-20.8	0	0	111.7	Y148	Q23-Y148 PolarHBondContact N-OH 2.9Å; Q23-Y148 PolarHBondContact O-OH 2.67Å
24	V	96.4	Very high	82.6	Confident	39 Å²	39	62.3 Å²	62.3	24%	0.236	32%	0.321	C	S	.	.			trans	-68.2	130.1	167.5	179.1	0	0	0	0	107.7	D26 L108 T109 A112 L249	V24-D26 PolarHBondContact O-N 3.01Å; V24-L108 HydrophobicContact CG2-CB 4.26Å; V24-L108 HydrophobicContact CG2-CD1 4.25Å; V24-T109 HydrophobicContact CG1-CG2 4.18Å; V24-T109 HydrophobicContact CG2-CG2 4.21Å; V24-A112 HydrophobicContact CG1-CB 3.68Å; V24-A112 HydrophobicContact CG2-CB 4.5Å; V24-L249 HydrophobicContact CG2-CD1 4.09Å; V24-L249 HydrophobicContact CG2-CD2 4.5Å
25	P	95.7	Very high	84.8	Confident	9 Å²	9	58.3 Å²	58.3	6%	0.058	32%	0.317	C	S	.	.			trans	-53.9	132.9	178.2	-29.4	36.5	0	0	0	112.6	D29 F30 L133 M146 Y148	P25-D29 WeakPolarHBondContact CA-OD2 3.39Å; P25-D29 HydrophobicContact CB-CB 3.98Å; P25-F30 HydrophobicContact CB-CE2 4.07Å; P25-F30 HydrophobicContact CB-CZ 4.4Å; P25-L133 HydrophobicContact CG-CD2 4.34Å; P25-M146 HydrophobicContact CB-CG 4.45Å; P25-M146 HydrophobicContact CB-SD 3.59Å; P25-M146 VanDerWaalsContact CB-SD 3.59Å; P25-M146 HydrophobicContact CG-CG 4.27Å; P25-M146 HydrophobicContact CG-SD 3.83Å; P25-Y148 HydrophobicContact CG-CE1 4.37Å
26	D	95	Very high	86.9	Confident	78 Å²	78	56.2 Å²	56.2	42%	0.417	30%	0.3	S	S	.	.			trans	-99.5	-179.5	176.7	69.5	23.1	0	0	0	112.5	V24 Q28 D29 F30	V24-D26 PolarHBondContact O-N 3.01Å; D26-Q28 PolarHBondContact O-N 3.04Å; D26-Q28 WeakPolarHBondContact OD1-CA 3.42Å; D26-Q28 VanDerWaalsContact OD1-CB 3.3Å; D26-Q28 WeakPolarHBondContact OD1-CB 3.43Å; D26-Q28 PolarHBondContact OD1-N 3.46Å; D26-D29 PolarHBondContact N-OD2 3.42Å; D26-D29 VanDerWaalsContact N-OD2 3.14Å; D26-D29 WeakPolarHBondContact O-CB 3.47Å; D26-D29 PolarHBondContact O-N 3.13Å; D26-D29 VanDerWaalsContact O-N 3.08Å; D26-D29 PolarHBondContact OD1-N 3.47Å; D26-F30 WeakPolarHBondContact O-CD2 3.29Å; D26-F30 PolarHBondContact O-N 2.76Å; D26-F30 VanDerWaalsContact O-N 3.08Å
27	D	94.9	Very high	89	Confident	112 Å²	112	55.9 Å²	55.9	60%	0.599	30%	0.298	S	S	*	.	H	α-helix	trans	-59.6	-28.9	179.6	-70.8	-10.1	0	0	0	113.6	R31	D27-R31 WeakPolarHBondContact O-CB 3.41Å; D27-R31 VanDerWaalsContact O-CG 3.29Å; D27-R31 WeakPolarHBondContact O-CG 3.34Å; D27-R31 PolarHBondContact O-N 3.3Å; D27-R31 VanDerWaalsContact O-N 3.12Å; D27-R31 PolarHBondContact O-NE 2.89Å
28	Q	95.3	Very high	91.3	Very high	91 Å²	91	58.3 Å²	58.3	43%	0.425	31%	0.309	S	S	.	.	H	α-helix	trans	-72.8	-41.1	176.1	-175.8	56.3	47.9	0	0	110.3	D26 F30 R31 S32	D26-Q28 PolarHBondContact O-N 3.04Å; D26-Q28 WeakPolarHBondContact OD1-CA 3.42Å; D26-Q28 VanDerWaalsContact OD1-CB 3.3Å; D26-Q28 WeakPolarHBondContact OD1-CB 3.43Å; D26-Q28 PolarHBondContact OD1-N 3.46Å; Q28-F30 PolarHBondContact O-N 2.78Å; Q28-R31 PolarHBondContact O-N 3.34Å; Q28-S32 PolarHBondContact NE2-OG 3.36Å; Q28-S32 VanDerWaalsContact NE2-OG 3.11Å; Q28-S32 WeakPolarHBondContact O-CB 3.42Å; Q28-S32 PolarHBondContact O-N 3.48Å; Q28-S32 PolarHBondContact O-OG 3.14Å
29	D	96.2	Very high	93.4	Very high	5 Å²	5	56.7 Å²	56.7	3%	0.027	29%	0.288	C	S	.	.	H	α-helix	trans	-59.2	-45.7	175.4	-67.5	-45.2	0	0	0	111.5	V16 R19 P25 D26 S32 F33 M146	V16-D29 HydrophobicContact CG2-CB 4.15Å; R19-D29 IonicContact CZ-OD1 2.95Å; R19-D29 IonicContact CZ-OD2 3.79Å; R19-D29 IonicContact NH1-OD2 3.57Å; R19-D29 PolarHBondContact NH1-OD2 3.48Å; R19-D29 VanDerWaalsContact NH1-OD2 3.14Å; R19-D29 IonicContact NH2-OD1 3.48Å; R19-D29 PolarHBondContact NH2-OD1 3.29Å; R19-D29 IonicContact NH2-OD2 3.84Å; R19-D29 PolarHBondContact NH2-OD2 3.05Å; P25-D29 WeakPolarHBondContact CA-OD2 3.39Å; P25-D29 HydrophobicContact CB-CB 3.98Å; D26-D29 PolarHBondContact N-OD2 3.42Å; D26-D29 VanDerWaalsContact N-OD2 3.14Å; D26-D29 WeakPolarHBondContact O-CB 3.47Å; D26-D29 PolarHBondContact O-N 3.13Å; D26-D29 VanDerWaalsContact O-N 3.08Å; D26-D29 PolarHBondContact OD1-N 3.47Å; D29-S32 PolarHBondContact O-N 3.18Å; D29-F33 WeakPolarHBondContact O-CB 3.3Å; D29-F33 PolarHBondContact O-N 3.41Å; D29-M146 HydrophobicContact CB-SD 4.46Å
30	F	97.6	Very high	94.8	Very high	4 Å²	4	62.8 Å²	62.8	2%	0.018	32%	0.319	C	S	.	.	H	α-helix	trans	-62.7	-44.1	176	-77.3	-72.8	0	0	0	112.8	P25 D26 Q28 F33 R34 S135 L137 I144 M146	P25-F30 HydrophobicContact CB-CE2 4.07Å; P25-F30 HydrophobicContact CB-CZ 4.4Å; D26-F30 WeakPolarHBondContact O-CD2 3.29Å; D26-F30 PolarHBondContact O-N 2.76Å; D26-F30 VanDerWaalsContact O-N 3.08Å; Q28-F30 PolarHBondContact O-N 2.78Å; F30-F33 PolarHBondContact O-N 2.89Å; F30-R34 PolarHBondContact O-N 2.89Å; F30-S135 WeakPolarHBondContact CZ-OG 3.49Å; F30-L137 HydrophobicContact CB-CD2 3.94Å; F30-L137 HydrophobicContact CD1-CB 3.73Å; F30-L137 HydrophobicContact CD1-CD2 4.23Å; F30-L137 HydrophobicContact CD2-CB 4.13Å; F30-L137 HydrophobicContact CD2-CD2 3.73Å; F30-L137 HydrophobicContact CE1-CB 3.57Å; F30-L137 HydrophobicContact CE2-CB 3.99Å; F30-L137 HydrophobicContact CE2-CD2 4.3Å; F30-L137 HydrophobicContact CG-CB 4.02Å; F30-L137 HydrophobicContact CG-CD2 3.71Å; F30-L137 HydrophobicContact CZ-CB 3.7Å; F30-I144 HydrophobicContact CD1-CB 3.85Å; F30-I144 HydrophobicContact CD1-CD1 4.37Å; F30-I144 HydrophobicContact CD1-CG2 3.61Å; F30-I144 HydrophobicContact CE1-CB 4.18Å; F30-I144 HydrophobicContact CE1-CG2 3.91Å; F30-M146 HydrophobicContact CD1-CE 3.83Å; F30-M146 HydrophobicContact CD1-CG 4.47Å; F30-M146 HydrophobicContact CD1-SD 4.2Å; F30-M146 HydrophobicContact CE1-CE 4.21Å; F30-M146 HydrophobicContact CE1-CG 3.91Å; F30-M146 HydrophobicContact CE1-SD 4.11Å; F30-M146 HydrophobicContact CG-CE 4.35Å; F30-M146 HydrophobicContact CZ-CG 4.33Å; F30-M146 HydrophobicContact CZ-SD 4.44Å
31	R	97.2	Very high	95.7	Very high	141 Å²	141	59.9 Å²	59.9	53%	0.532	31%	0.314	S	S	.	.	H	α-helix	trans	-63.9	-42.8	176.5	-76.6	-176.8	-69.7	-176.8	1.7	112.2	D27 Q28 R34 S35	D27-R31 WeakPolarHBondContact O-CB 3.41Å; D27-R31 VanDerWaalsContact O-CG 3.29Å; D27-R31 WeakPolarHBondContact O-CG 3.34Å; D27-R31 PolarHBondContact O-N 3.3Å; D27-R31 VanDerWaalsContact O-N 3.12Å; D27-R31 PolarHBondContact O-NE 2.89Å; Q28-R31 PolarHBondContact O-N 3.34Å; R31-R34 PolarHBondContact O-N 3.31Å; R31-S35 WeakPolarHBondContact O-CB 3.36Å; R31-S35 PolarHBondContact O-N 3.06Å
32	S	96.5	Very high	96	Very high	18 Å²	18	58.5 Å²	58.5	13%	0.126	31%	0.311	C	S	.	.	H	α-helix	trans	-64.5	-42.5	177.3	-73.5	0	0	0	0	111.8	Q28 D29 S35 E36	Q28-S32 PolarHBondContact NE2-OG 3.36Å; Q28-S32 VanDerWaalsContact NE2-OG 3.11Å; Q28-S32 WeakPolarHBondContact O-CB 3.42Å; Q28-S32 PolarHBondContact O-N 3.48Å; Q28-S32 PolarHBondContact O-OG 3.14Å; D29-S32 PolarHBondContact O-N 3.18Å; S32-S35 PolarHBondContact O-N 2.79Å; S32-E36 WeakPolarHBondContact O-CB 3.35Å; S32-E36 PolarHBondContact O-N 3.31Å
33	F	97.6	Very high	96.1	Very high	1 Å²	1	59.3 Å²	59.3	0%	0.004	31%	0.313	C	S	.	.	H	α-helix	trans	-62.8	-44.5	175.6	-178.7	-90.6	0	0	0	112.4	D29 F30 S35 E36 C37 I144 M146 Q168 G170 L172 L186	D29-F33 WeakPolarHBondContact O-CB 3.3Å; D29-F33 PolarHBondContact O-N 3.41Å; F30-F33 PolarHBondContact O-N 2.89Å; F33-S35 PolarHBondContact O-N 3.41Å; F33-E36 PolarHBondContact O-N 3.49Å; F33-C37 WeakPolarHBondContact CE1-SG 3.48Å; F33-C37 PolarHBondContact O-N 3.24Å; F33-C37 PolarHBondContact O-SG 2.9Å; F33-I144 HydrophobicContact CD1-CG2 3.62Å; F33-I144 HydrophobicContact CE1-CG2 3.96Å; F33-I144 HydrophobicContact CG-CG2 4.49Å; F33-M146 HydrophobicContact CB-CE 3.16Å; F33-M146 HydrophobicContact CD1-CE 4.04Å; F33-M146 HydrophobicContact CD2-CE 3.94Å; F33-M146 HydrophobicContact CG-CE 3.45Å; F33-M146 VanDerWaalsContact CG-CE 3.45Å; F33-Q168 HydrophobicContact CD2-CG 4.43Å; F33-G170 VanDerWaalsContact CZ-CA 3.45Å; F33-L172 HydrophobicContact CE1-CB 4.39Å; F33-L186 HydrophobicContact CD2-CD2 4.04Å; F33-L186 HydrophobicContact CE2-CB 3.98Å; F33-L186 HydrophobicContact CE2-CD2 3.74Å; F33-L186 HydrophobicContact CE2-CG 4.16Å; F33-L186 HydrophobicContact CZ-CB 3.93Å; F33-L186 HydrophobicContact CZ-CD2 4.3Å
34	R	98.1	Very high	96	Very high	62 Å²	62	60.4 Å²	60.4	23%	0.234	32%	0.321	C	S	.	.	H	α-helix	trans	-57.2	-50.6	174.3	-177.6	-179.9	177	137.4	10.8	111.3	F30 R31 E36 C37 E38 D142 I144 L172	F30-R34 PolarHBondContact O-N 2.89Å; R31-R34 PolarHBondContact O-N 3.31Å; R34-E36 VanDerWaalsContact C-N 3.26Å; R34-E36 PolarHBondContact O-N 2.96Å; R34-C37 WeakPolarHBondContact O-CB 3.39Å; R34-C37 PolarHBondContact O-N 2.75Å; R34-C37 VanDerWaalsContact O-N 3.14Å; R34-E38 HydrophobicContact CG-CG 4.44Å; R34-E38 IonicContact CZ-OE1 3.87Å; R34-E38 IonicContact NE-OE1 3.06Å; R34-E38 PolarHBondContact NE-OE1 3.5Å; R34-E38 IonicContact NE-OE2 2.89Å; R34-E38 IonicContact NH2-OE1 3.44Å; R34-E38 PolarHBondContact NH2-OE1 3.18Å; R34-E38 WeakPolarHBondContact O-CG 3.36Å; R34-E38 PolarHBondContact O-N 3.48Å; R34-D142 IonicContact CZ-OD2 3.04Å; R34-D142 VanDerWaalsContact CZ-OD2 3.31Å; R34-D142 IonicContact NH1-OD2 2.67Å; R34-D142 PolarHBondContact NH1-OD2 3.33Å; R34-D142 IonicContact NH2-OD2 3.93Å; R34-D142 PolarHBondContact NH2-OD2 2.55Å; R34-I144 HydrophobicContact CB-CD1 3.85Å; R34-L172 HydrophobicContact CG-CD1 4.27Å; R34-L172 HydrophobicContact CG-CD2 4.09Å
35	S	97.7	Very high	96	Very high	74 Å²	74	63 Å²	63	52%	0.517	33%	0.333	S	S	.	.	H	α-helix	trans	-57.6	-40.2	178.5	179	0	0	0	0	111.6	R31 S32 F33 E38 A39	R31-S35 WeakPolarHBondContact O-CB 3.36Å; R31-S35 PolarHBondContact O-N 3.06Å; S32-S35 PolarHBondContact O-N 2.79Å; F33-S35 PolarHBondContact O-N 3.41Å; S35-E38 PolarHBondContact O-N 3.35Å; S35-A39 VanDerWaalsContact O-CB 3.29Å; S35-A39 WeakPolarHBondContact O-CB 3.22Å; S35-A39 PolarHBondContact O-N 3.07Å
36	E	97.3	Very high	95.8	Very high	37 Å²	37	65.6 Å²	65.6	17%	0.173	35%	0.349	C	S	.	.	H	α-helix	trans	-68.6	-37.6	177.6	-169.2	170.6	-166	0	0	112.9	S32 F33 R34 W43 K67 K69 Q168 L186	S32-E36 WeakPolarHBondContact O-CB 3.35Å; S32-E36 PolarHBondContact O-N 3.31Å; F33-E36 PolarHBondContact O-N 3.49Å; R34-E36 VanDerWaalsContact C-N 3.26Å; R34-E36 PolarHBondContact O-N 2.96Å; E36-W43 HydrophobicContact CG-CZ2 4.13Å; E36-K67 VanDerWaalsContact CD-NZ 3.35Å; E36-K67 WeakPolarHBondContact OE1-CD 3.33Å; E36-K67 WeakPolarHBondContact OE1-CE 3.41Å; E36-K67 IonicContact OE1-NZ 2.81Å; E36-K67 PolarHBondContact OE1-NZ 3.43Å; E36-K67 IonicContact OE2-NZ 3.6Å; E36-K67 PolarHBondContact OE2-NZ 3.02Å; E36-K69 PolarHBondContact O-NZ 3.46Å; E36-K69 VanDerWaalsContact O-NZ 3.14Å; E36-Q168 PolarHBondContact OE2-NE2 2.87Å; E36-Q168 PolarHBondContact OE2-OE1 2.83Å; E36-L186 HydrophobicContact CB-CD2 3.99Å; E36-L186 HydrophobicContact CG-CD2 3.66Å
37	C	98	Very high	95.8	Very high	6 Å²	6	65.6 Å²	65.6	4%	0.041	34%	0.344	C	S	.	.	H	α-helix	trans	-61	-45.5	170.4	-73.9	0	0	0	0	111.6	F33 R34 K69 L172 T184	F33-C37 WeakPolarHBondContact CE1-SG 3.48Å; F33-C37 PolarHBondContact O-N 3.24Å; F33-C37 PolarHBondContact O-SG 2.9Å; R34-C37 WeakPolarHBondContact O-CB 3.39Å; R34-C37 PolarHBondContact O-N 2.75Å; R34-C37 VanDerWaalsContact O-N 3.14Å; C37-K69 WeakPolarHBondContact O-CD 3.34Å; C37-K69 PolarHBondContact O-NZ 3.3Å; C37-L172 HydrophobicContact CB-CB 4.11Å; C37-L172 HydrophobicContact CB-CD2 3.65Å; C37-T184 HydrophobicContact CB-CG2 3.79Å
38	E	97.3	Very high	95.8	Very high	90 Å²	90	64 Å²	64	42%	0.421	34%	0.342	S	S	.	.	H	α-helix	trans	-77.5	-21.4	-176.7	-68.3	171.5	163.8	0	0	113.4	R34 S35 E40 L172 Q174	R34-E38 HydrophobicContact CG-CG 4.44Å; R34-E38 IonicContact CZ-OE1 3.87Å; R34-E38 IonicContact NE-OE1 3.06Å; R34-E38 PolarHBondContact NE-OE1 3.5Å; R34-E38 IonicContact NE-OE2 2.89Å; R34-E38 IonicContact NH2-OE1 3.44Å; R34-E38 PolarHBondContact NH2-OE1 3.18Å; R34-E38 WeakPolarHBondContact O-CG 3.36Å; R34-E38 PolarHBondContact O-N 3.48Å; S35-E38 PolarHBondContact O-N 3.35Å; E38-E40 PolarHBondContact O-N 3.03Å; E38-L172 HydrophobicContact CG-CD2 4.14Å; E38-Q174 PolarHBondContact OE1-NE2 2.77Å
39	A	96.6	Very high	95.8	Very high	34 Å²	34	66.6 Å²	66.6	28%	0.281	35%	0.352	S	S	.	.			trans	-65.1	128.2	-176.3	0	0	0	0	0	113.5	S35 K69	S35-A39 VanDerWaalsContact O-CB 3.29Å; S35-A39 WeakPolarHBondContact O-CB 3.22Å; S35-A39 PolarHBondContact O-N 3.07Å; A39-K69 PolarHBondContact O-NZ 3.3Å
40	E	93.7	Very high	95.6	Very high	168 Å²	168	70.4 Å²	70.4	79%	0.785	38%	0.384	S	S	*	.			trans	-94.8	-34.9	173.1	-61	-173.6	167.4	0	0	112.3	E38 W43	E38-E40 PolarHBondContact O-N 3.03Å; E40-W43 PolarHBondContact O-N 2.92Å
41	V	94.6	Very high	95.4	Very high	139 Å²	139	71.5 Å²	71.5	84%	0.842	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	136.8	177.7	-179.2	0	0	0	0	110.1	W43	V41-W43 VanDerWaalsContact C-N 3.35Å
42	G	92.5	Very high	95.5	Very high	38 Å²	38	64.9 Å²	64.9	39%	0.392	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	13.1	-178	0	0	0	0	0	114.2	A58	G42-A58 WeakPolarHBondContact O-CB 3.46Å; G42-A58 PolarHBondContact O-N 3.36Å
43	W	95	Very high	95.5	Very high	25 Å²	25	65 Å²	65	10%	0.095	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	126.1	178.8	-69.2	94.4	0	0	0	111.5	E36 E40 V41 W55 Q57 K67 K69 L186	E36-W43 HydrophobicContact CG-CZ2 4.13Å; E40-W43 PolarHBondContact O-N 2.92Å; V41-W43 VanDerWaalsContact C-N 3.35Å; W43-W55 HydrophobicContact CB-CB 3.98Å; W43-W55 HydrophobicContact CB-CG 4.26Å; W43-W55 HydrophobicContact CD2-CB 4.45Å; W43-W55 HydrophobicContact CE3-CB 3.84Å; W43-Q57 HydrophobicContact CE3-CB 4.4Å; W43-Q57 HydrophobicContact CH2-CB 4.43Å; W43-Q57 HydrophobicContact CZ3-CB 4.18Å; W43-K67 HydrophobicContact CH2-CB 3.56Å; W43-K67 HydrophobicContact CZ2-CB 4.48Å; W43-K67 HydrophobicContact CZ3-CB 4.13Å; W43-K67 WeakPolarHBondContact CZ3-O 3.41Å; W43-K69 HydrophobicContact CE3-CB 3.95Å; W43-K69 HydrophobicContact CH2-CB 4Å; W43-K69 HydrophobicContact CZ3-CB 3.65Å; W43-L186 HydrophobicContact CH2-CD1 3.43Å; W43-L186 VanDerWaalsContact CH2-CD1 3.43Å; W43-L186 HydrophobicContact CZ2-CD1 3.85Å; W43-L186 HydrophobicContact CZ3-CD1 4.44Å
44	N	93.8	Very high	95.5	Very high	97 Å²	97	65 Å²	65	52%	0.519	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	123.1	175.7	-68.4	-29.9	0	0	0	110.2	T46 W55 V56 A58	N44-T46 PolarHBondContact O-N 3.21Å; N44-W55 CarbonylContact O-C 3.55Å; N44-W55 WeakPolarHBondContact O-CA 3.26Å; N44-V56 PolarHBondContact N-O 3.05Å; N44-V56 PolarHBondContact O-N 3.05Å; N44-A58 WeakPolarHBondContact ND2-CB 3.26Å
45	L	94.9	Very high	95.4	Very high	94 Å²	94	64.6 Å²	64.6	49%	0.492	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	118.9	174.4	-178.1	72.7	0	0	0	110	Y47 W55	L45-Y47 WeakPolarHBondContact CD1-O 3.45Å; L45-W55 HydrophobicContact CD1-CD2 3.9Å; L45-W55 VanDerWaalsContact CD1-CE2 3.46Å; L45-W55 HydrophobicContact CD1-CG 4.3Å; L45-W55 HydrophobicContact CD1-CH2 4.4Å; L45-W55 HydrophobicContact CD1-CZ2 3.74Å
46	T	93.1	Very high	95.2	Very high	64 Å²	64	61.5 Å²	61.5	39%	0.393	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	-15.8	-178.5	61.1	0	0	0	0	113.6	N44 V54 V56	N44-T46 PolarHBondContact O-N 3.21Å; T46-V54 PolarHBondContact N-O 3.38Å; T46-V54 PolarHBondContact OG1-O 3.23Å; T46-V56 HydrophobicContact CG2-CB 4.2Å; T46-V56 HydrophobicContact CG2-CG2 3.65Å
47	Y	93.8	Very high	94.9	Very high	77 Å²	77	62.5 Å²	62.5	30%	0.302	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	138.4	176	177.3	-90.7	0	0	0	110.1	L45 K49 V52 S53 V54 P209	L45-Y47 WeakPolarHBondContact CD1-O 3.45Å; Y47-K49 HydrophobicContact CE1-CB 4.05Å; Y47-K49 HydrophobicContact CE2-CB 4.32Å; Y47-V52 HydrophobicContact CE1-CB 4.2Å; Y47-V52 HydrophobicContact CE1-CG1 4.18Å; Y47-V52 WeakPolarHBondContact CE1-O 3.32Å; Y47-S53 CarbonylContact O-C 3.52Å; Y47-S53 WeakPolarHBondContact O-CA 3.42Å; Y47-V54 HydrophobicContact CD1-CG2 4.08Å; Y47-V54 HydrophobicContact CG-CG2 4.34Å; Y47-V54 PolarHBondContact N-O 3.18Å; Y47-V54 PolarHBondContact O-N 2.95Å; Y47-P209 HydrophobicContact CD1-CB 4.45Å; Y47-P209 HydrophobicContact CD1-CG 3.91Å; Y47-P209 HydrophobicContact CE1-CB 3.99Å; Y47-P209 HydrophobicContact CE1-CG 3.94Å; Y47-P209 HydrophobicContact CG-CG 4.3Å
48	S	95.8	Very high	94.2	Very high	80 Å²	80	64.4 Å²	64.4	56%	0.559	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.6	112	168.9	-179.2	0	0	0	0	109.8	V52 S53	S48-V52 WeakPolarHBondContact CA-O 3.28Å; S48-S53 PolarHBondContact OG-OG 3.17Å
49	K	94.1	Very high	93.4	Very high	145 Å²	145	62.9 Å²	62.9	63%	0.63	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-160.6	134.7	176.7	-171.4	170.7	-177.8	170.7	0	111.8	Y47 G51 V52	Y47-K49 HydrophobicContact CE1-CB 4.05Å; Y47-K49 HydrophobicContact CE2-CB 4.32Å; K49-G51 PolarHBondContact O-N 3.49Å; K49-V52 PolarHBondContact N-O 2.81Å; K49-V52 PolarHBondContact O-N 2.93Å
50	A	93.2	Very high	91.6	Very high	85 Å²	85	71.1 Å²	71.1	70%	0.702	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	52	172.8	0	0	0	0	0	113.2	V52	A50-V52 PolarHBondContact O-N 3.43Å
51	G	93.9	Very high	89.9	Confident	27 Å²	27	69.1 Å²	69.1	28%	0.278	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	9.5	177.7	0	0	0	0	0	115	K49 M72 E73	K49-G51 PolarHBondContact O-N 3.49Å; G51-M72 WeakPolarHBondContact O-CA 3.42Å; G51-E73 PolarHBondContact O-N 3.36Å
52	V	97.3	Very high	88.2	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.012	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	130.3	174.7	-177.5	0	0	0	0	109.7	Y47 S48 K49 A50 R71 M72 P209 K213	Y47-V52 HydrophobicContact CE1-CB 4.2Å; Y47-V52 HydrophobicContact CE1-CG1 4.18Å; Y47-V52 WeakPolarHBondContact CE1-O 3.32Å; S48-V52 WeakPolarHBondContact CA-O 3.28Å; K49-V52 PolarHBondContact N-O 2.81Å; K49-V52 PolarHBondContact O-N 2.93Å; A50-V52 PolarHBondContact O-N 3.43Å; V52-R71 CarbonylContact C-O 3.48Å; V52-R71 WeakPolarHBondContact CA-O 2.9Å; V52-M72 HydrophobicContact CG2-CB 4.12Å; V52-M72 HydrophobicContact CG2-CG 3.75Å; V52-M72 HydrophobicContact CG2-SD 3.97Å; V52-P209 HydrophobicContact CG1-CB 3.97Å; V52-P209 HydrophobicContact CG1-CG 4.42Å; V52-K213 HydrophobicContact CG2-CG 4.41Å
53	S	97.7	Very high	86.6	Confident	21 Å²	21	76.3 Å²	76.3	15%	0.147	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	141.4	178.9	-61.1	0	0	0	0	110.9	Y47 S48 W55 C70 R71	Y47-S53 CarbonylContact O-C 3.52Å; Y47-S53 WeakPolarHBondContact O-CA 3.42Å; S48-S53 PolarHBondContact OG-OG 3.17Å; S53-W55 WeakPolarHBondContact O-CZ3 3.23Å; S53-C70 CarbonylContact O-C 3.47Å; S53-C70 VanDerWaalsContact O-CA 3.32Å; S53-C70 WeakPolarHBondContact O-CA 3.23Å; S53-R71 PolarHBondContact N-O 2.89Å; S53-R71 PolarHBondContact O-N 2.86Å
54	V	97	Very high	85.7	Confident	0 Å²	0	78.2 Å²	78.2	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	133.6	177.6	-173.1	0	0	0	0	109.2	T46 Y47 I68 K69 C70 P209	T46-V54 PolarHBondContact N-O 3.38Å; T46-V54 PolarHBondContact OG1-O 3.23Å; Y47-V54 HydrophobicContact CD1-CG2 4.08Å; Y47-V54 HydrophobicContact CG-CG2 4.34Å; Y47-V54 PolarHBondContact N-O 3.18Å; Y47-V54 PolarHBondContact O-N 2.95Å; V54-I68 HydrophobicContact CG1-CG2 3.85Å; V54-K69 CarbonylContact C-O 3.53Å; V54-K69 VanDerWaalsContact CA-O 3.31Å; V54-K69 WeakPolarHBondContact CA-O 3.34Å; V54-C70 HydrophobicContact CG2-CB 4.43Å; V54-P209 HydrophobicContact CG2-CG 3.5Å; V54-P209 VanDerWaalsContact CG2-CG 3.5Å
55	W	95.9	Very high	85.1	Confident	53 Å²	53	74.5 Å²	74.5	20%	0.201	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	151.3	170.7	-60.1	-108.5	0	0	0	110.5	W43 N44 L45 S53 I68 K69 R71	W43-W55 HydrophobicContact CB-CB 3.98Å; W43-W55 HydrophobicContact CB-CG 4.26Å; W43-W55 HydrophobicContact CD2-CB 4.45Å; W43-W55 HydrophobicContact CE3-CB 3.84Å; N44-W55 CarbonylContact O-C 3.55Å; N44-W55 WeakPolarHBondContact O-CA 3.26Å; L45-W55 HydrophobicContact CD1-CD2 3.9Å; L45-W55 VanDerWaalsContact CD1-CE2 3.46Å; L45-W55 HydrophobicContact CD1-CG 4.3Å; L45-W55 HydrophobicContact CD1-CH2 4.4Å; L45-W55 HydrophobicContact CD1-CZ2 3.74Å; S53-W55 WeakPolarHBondContact O-CZ3 3.23Å; W55-I68 WeakPolarHBondContact O-CA 3.43Å; W55-K69 HydrophobicContact CB-CB 4.36Å; W55-K69 HydrophobicContact CE3-CG 4.27Å; W55-K69 PolarHBondContact N-O 2.82Å; W55-K69 PolarHBondContact O-N 2.97Å; W55-R71 HydrophobicContact CH2-CB 3.99Å; W55-R71 HydrophobicContact CZ3-CB 3.54Å
56	V	93.3	Very high	84.7	Confident	10 Å²	10	71.2 Å²	71.2	6%	0.061	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	141	172.5	-176	0	0	0	0	107.6	N44 T46 A58 H66 Q205	N44-V56 PolarHBondContact N-O 3.05Å; N44-V56 PolarHBondContact O-N 3.05Å; T46-V56 HydrophobicContact CG2-CB 4.2Å; T46-V56 HydrophobicContact CG2-CG2 3.65Å; V56-A58 PolarHBondContact O-N 2.57Å; V56-H66 HydrophobicContact CG1-CB 3.65Å; V56-Q205 HydrophobicContact CG2-CG 3.47Å; V56-Q205 VanDerWaalsContact CG2-CG 3.47Å
57	Q	91	Very high	84.7	Confident	58 Å²	58	69.4 Å²	69.4	27%	0.271	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	129.7	177.4	-162.5	-178.1	13.5	0	0	110.2	W43 V59 K67	W43-Q57 HydrophobicContact CE3-CB 4.4Å; W43-Q57 HydrophobicContact CH2-CB 4.43Å; W43-Q57 HydrophobicContact CZ3-CB 4.18Å; Q57-V59 HydrophobicContact CB-CG1 4.49Å; Q57-V59 HydrophobicContact CG-CG1 3.97Å; Q57-V59 PolarHBondContact O-N 3.01Å; Q57-K67 HydrophobicContact CB-CB 4.16Å; Q57-K67 PolarHBondContact N-O 3.09Å
58	A	84.3	Confident	84.8	Confident	45 Å²	45	66.2 Å²	66.2	37%	0.372	35%	0.35	S	S	.	.			trans	-76.7	87.8	177.9	0	0	0	0	0	109.2	G42 N44 V56	G42-A58 WeakPolarHBondContact O-CB 3.46Å; G42-A58 PolarHBondContact O-N 3.36Å; N44-A58 WeakPolarHBondContact ND2-CB 3.26Å; V56-A58 PolarHBondContact O-N 2.57Å
59	V	79.7	Confident	84.8	Confident	58 Å²	58	62.8 Å²	62.8	35%	0.352	33%	0.325	S	S	.	.			trans	-119.6	142.4	175	-65.2	0	0	0	0	110.2	Q57 M61 H66	Q57-V59 HydrophobicContact CB-CG1 4.49Å; Q57-V59 HydrophobicContact CG-CG1 3.97Å; Q57-V59 PolarHBondContact O-N 3.01Å; V59-M61 PolarHBondContact O-N 3.25Å; V59-H66 WeakPolarHBondContact CG2-CD2 3.22Å; V59-H66 WeakPolarHBondContact CG2-NE2 3.3Å
60	E	58.8	Low	85	Confident	207 Å²	207	55.9 Å²	55.9	97%	0.967	30%	0.295	S	S	*	.	S	Bend	trans	-72.3	-10.9	-174.3	-64.1	-176.2	165.8	0	0	113.8
61	M	59.5	Low	85.2	Confident	126 Å²	126	55.7 Å²	55.7	62%	0.621	28%	0.276	S	S	*	.			trans	-116.7	111.7	-173.2	-66.9	-163.3	177.4	0	0	113.9	V59 R63 T64 H66	V59-M61 PolarHBondContact O-N 3.25Å; M61-R63 PolarHBondContact O-N 3.26Å; M61-R63 VanDerWaalsContact O-N 3.14Å; M61-T64 HydrophobicContact CB-CG2 4.38Å; M61-T64 PolarHBondContact O-N 2.88Å; M61-T64 PolarHBondContact O-OG1 2.77Å; M61-H66 PolarHBondContact O-NE2 2.9Å
62	D	58.3	Low	85.5	Confident	103 Å²	103	54.8 Å²	54.8	55%	0.551	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-4.7	171.1	-163.1	25.1	0	0	0	113.6	T64	D62-T64 VanDerWaalsContact C-N 3.33Å
63	R	57.7	Low	85.5	Confident	226 Å²	226	58.3 Å²	58.3	85%	0.853	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-12.2	175.9	-63.9	-173.8	179.7	-172.5	0.3	113.5	M61	M61-R63 PolarHBondContact O-N 3.26Å; M61-R63 VanDerWaalsContact O-N 3.14Å
64	T	76.2	Confident	85.5	Confident	64 Å²	64	57.4 Å²	57.4	39%	0.393	28%	0.275	S	S	.	.	S	Bend	trans	-102.7	154	-177.8	64.5	0	0	0	0	111.4	M61 D62 H66 N201	M61-T64 HydrophobicContact CB-CG2 4.38Å; M61-T64 PolarHBondContact O-N 2.88Å; M61-T64 PolarHBondContact O-OG1 2.77Å; D62-T64 VanDerWaalsContact C-N 3.33Å; T64-H66 PolarHBondContact O-CD2 2.89Å; T64-H66 PolarHBondContact O-N 3.04Å; T64-H66 PolarHBondContact O-NE2 3.26Å; T64-N201 PolarHBondContact O-ND2 3.27Å; T64-N201 VanDerWaalsContact O-ND2 3.1Å
65	L	82.3	Confident	85.5	Confident	20 Å²	20	66.5 Å²	66.5	11%	0.105	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-75.3	118.2	173	-177.5	76.4	0	0	0	109.1	I167 Q188 V189 D190 V200	L65-I167 HydrophobicContact CD2-CD1 3.91Å; L65-Q188 HydrophobicContact CD2-CG 3.98Å; L65-Q188 HydrophobicContact CG-CG 4.34Å; L65-Q188 PolarHBondContact O-NE2 2.93Å; L65-V189 WeakPolarHBondContact CD1-O 3.34Å; L65-V189 VanDerWaalsContact CD2-O 3.27Å; L65-V189 WeakPolarHBondContact CD2-O 3.18Å; L65-D190 HydrophobicContact CD2-CB 3.9Å; L65-V200 HydrophobicContact CD1-CB 4.36Å; L65-V200 HydrophobicContact CD1-CG1 3.71Å
66	H	86.4	Confident	85.6	Confident	24 Å²	24	68 Å²	68	11%	0.111	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-82.7	146.8	-175.2	-59.4	168.8	0	0	0	111.3	V56 V59 M61 T64 N201	V56-H66 HydrophobicContact CG1-CB 3.65Å; V59-H66 WeakPolarHBondContact CG2-CD2 3.22Å; V59-H66 WeakPolarHBondContact CG2-NE2 3.3Å; M61-H66 PolarHBondContact O-NE2 2.9Å; T64-H66 PolarHBondContact O-CD2 2.89Å; T64-H66 PolarHBondContact O-N 3.04Å; T64-H66 PolarHBondContact O-NE2 3.26Å; H66-N201 PolarHBondContact N-OD1 2.83Å; H66-N201 PolarHBondContact ND1-ND2 2.82Å
67	K	92.6	Very high	85.9	Confident	26 Å²	26	67.7 Å²	67.7	11%	0.113	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-73	143.3	164	-55.1	-164.3	176.4	-171.9	0	109.7	E36 W43 Q57 L186 A187 Q188	E36-K67 VanDerWaalsContact CD-NZ 3.35Å; E36-K67 WeakPolarHBondContact OE1-CD 3.33Å; E36-K67 WeakPolarHBondContact OE1-CE 3.41Å; E36-K67 IonicContact OE1-NZ 2.81Å; E36-K67 PolarHBondContact OE1-NZ 3.43Å; E36-K67 IonicContact OE2-NZ 3.6Å; E36-K67 PolarHBondContact OE2-NZ 3.02Å; W43-K67 HydrophobicContact CH2-CB 3.56Å; W43-K67 HydrophobicContact CZ2-CB 4.48Å; W43-K67 HydrophobicContact CZ3-CB 4.13Å; W43-K67 WeakPolarHBondContact CZ3-O 3.41Å; Q57-K67 HydrophobicContact CB-CB 4.16Å; Q57-K67 PolarHBondContact N-O 3.09Å; K67-L186 HydrophobicContact CB-CD1 4.49Å; K67-A187 WeakPolarHBondContact CA-O 3.48Å; K67-Q188 HydrophobicContact CG-CB 3.92Å; K67-Q188 HydrophobicContact CG-CG 3.91Å
68	I	95	Very high	86.2	Confident	10 Å²	10	66.3 Å²	66.3	5%	0.051	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	136.8	175.2	-64.3	-177	0	0	0	109.1	V54 W55 L186 A187 Q205	V54-I68 HydrophobicContact CG1-CG2 3.85Å; W55-I68 WeakPolarHBondContact O-CA 3.43Å; I68-L186 WeakPolarHBondContact O-CA 3.28Å; I68-A187 PolarHBondContact N-O 3.04Å; I68-A187 PolarHBondContact O-N 2.91Å; I68-Q205 HydrophobicContact CD1-CG 3.92Å
69	K	96.7	Very high	86.9	Confident	8 Å²	8	64.2 Å²	64.2	4%	0.035	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	128.4	173	175.5	162.9	57.4	-175.3	0	109.5	E36 C37 A39 W43 V54 W55 T184 Y185 L186	E36-K69 PolarHBondContact O-NZ 3.46Å; E36-K69 VanDerWaalsContact O-NZ 3.14Å; C37-K69 WeakPolarHBondContact O-CD 3.34Å; C37-K69 PolarHBondContact O-NZ 3.3Å; A39-K69 PolarHBondContact O-NZ 3.3Å; W43-K69 HydrophobicContact CE3-CB 3.95Å; W43-K69 HydrophobicContact CH2-CB 4Å; W43-K69 HydrophobicContact CZ3-CB 3.65Å; V54-K69 CarbonylContact C-O 3.53Å; V54-K69 VanDerWaalsContact CA-O 3.31Å; V54-K69 WeakPolarHBondContact CA-O 3.34Å; W55-K69 HydrophobicContact CB-CB 4.36Å; W55-K69 HydrophobicContact CE3-CG 4.27Å; W55-K69 PolarHBondContact N-O 2.82Å; W55-K69 PolarHBondContact O-N 2.97Å; K69-T184 HydrophobicContact CD-CG2 3.69Å; K69-T184 HydrophobicContact CG-CG2 3.64Å; K69-Y185 CarbonylContact C-O 3.59Å; K69-Y185 VanDerWaalsContact CA-O 3.3Å; K69-Y185 WeakPolarHBondContact CA-O 3.21Å; K69-L186 HydrophobicContact CB-CD1 4.33Å
70	C	98.1	Very high	87.8	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	115.7	177.1	-171.1	0	0	0	0	109.4	S53 V54 Y185 A208 M212	S53-C70 CarbonylContact O-C 3.47Å; S53-C70 VanDerWaalsContact O-CA 3.32Å; S53-C70 WeakPolarHBondContact O-CA 3.23Å; V54-C70 HydrophobicContact CG2-CB 4.43Å; C70-Y185 HydrophobicContact CB-CD1 4.25Å; C70-Y185 PolarHBondContact N-O 3.47Å; C70-Y185 PolarHBondContact O-N 3.12Å; C70-A208 HydrophobicContact CB-CB 4.1Å; C70-M212 HydrophobicContact CB-CG 4.35Å
71	R	98.5	Very high	89.7	Confident	82 Å²	82	56.6 Å²	56.6	31%	0.309	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	136.9	178.6	-170	179.5	176.3	-81.1	4	109.9	V52 S53 W55 E73 V182 I183	V52-R71 CarbonylContact C-O 3.48Å; V52-R71 WeakPolarHBondContact CA-O 2.9Å; S53-R71 PolarHBondContact N-O 2.89Å; S53-R71 PolarHBondContact O-N 2.86Å; W55-R71 HydrophobicContact CH2-CB 3.99Å; W55-R71 HydrophobicContact CZ3-CB 3.54Å; R71-E73 IonicContact NH1-OE1 2.8Å; R71-V182 HydrophobicContact CG-CG1 3.74Å; R71-V182 VanDerWaalsContact CZ-CG1 3.41Å; R71-I183 CarbonylContact C-O 3.5Å; R71-I183 VanDerWaalsContact CA-O 3.28Å; R71-I183 WeakPolarHBondContact CA-O 3.42Å
72	M	98.6	Very high	91.6	Very high	7 Å²	7	50.6 Å²	50.6	3%	0.034	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	130.5	177.5	177.3	172.4	69.2	0	0	111.4	G51 V52 I183 M212	G51-M72 WeakPolarHBondContact O-CA 3.42Å; V52-M72 HydrophobicContact CG2-CB 4.12Å; V52-M72 HydrophobicContact CG2-CG 3.75Å; V52-M72 HydrophobicContact CG2-SD 3.97Å; M72-I183 HydrophobicContact CB-CG2 3.97Å; M72-I183 HydrophobicContact CE-CG2 3.84Å; M72-I183 PolarHBondContact N-O 3.44Å; M72-I183 PolarHBondContact O-N 3.1Å; M72-M212 HydrophobicContact CB-CE 4.12Å; M72-M212 HydrophobicContact CE-CB 3.92Å; M72-M212 HydrophobicContact CE-CE 4.28Å; M72-M212 VanDerWaalsContact CE-O 3.3Å; M72-M212 WeakPolarHBondContact CE-O 3.28Å; M72-M212 HydrophobicContact SD-CB 3.84Å
73	E	98.4	Very high	93.5	Very high	76 Å²	76	45.9 Å²	45.9	36%	0.355	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	128.9	168.9	-69.2	173.1	-159.8	0	0	110.7	G51 R71 R75 V182	G51-E73 PolarHBondContact O-N 3.36Å; R71-E73 IonicContact NH1-OE1 2.8Å; E73-R75 IonicContact OE2-CZ 3.9Å; E73-R75 IonicContact OE2-NE 3.02Å; E73-R75 PolarHBondContact OE2-NE 3.19Å; E73-R75 IonicContact OE2-NH2 3.72Å; E73-R75 PolarHBondContact OE2-NH2 3.06Å; E73-V182 HydrophobicContact CG-CG2 4.27Å
74	C	98.3	Very high	95.5	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.014	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	100.2	175.1	-56.7	0	0	0	0	108.3	V77 S180 C181 Y216	C74-V77 HydrophobicContact CB-CB 4.15Å; C74-S180 CarbonylContact O-C 3.55Å; C74-S180 VanDerWaalsContact O-CA 3.26Å; C74-S180 WeakPolarHBondContact O-CA 3.5Å; C74-S180 WeakPolarHBondContact O-CB 3.43Å; C74-C181 CarbonylContact C-O 3.16Å; C74-C181 WeakPolarHBondContact CA-O 3.45Å; C74-C181 WeakPolarHBondContact CB-O 3.24Å; C74-C181 PolarHBondContact N-O 2.69Å; C74-C181 PolarHBondContact O-N 3.28Å; C74-C181 VanDerWaalsContact O-O 3.08Å; C74-Y216 HydrophobicContact CB-CD2 4.21Å; C74-Y216 HydrophobicContact CB-CE2 4.38Å
75	R	96.8	Very high	96.6	Very high	191 Å²	191	32.6 Å²	32.6	72%	0.721	15%	0.148	S	C	*	.	S	Bend	trans	-84.3	-15.4	-168	-63.5	-178.1	-179.7	-173.2	-3.2	114.5	E73 K179	E73-R75 IonicContact OE2-CZ 3.9Å; E73-R75 IonicContact OE2-NE 3.02Å; E73-R75 PolarHBondContact OE2-NE 3.19Å; E73-R75 IonicContact OE2-NH2 3.72Å; E73-R75 PolarHBondContact OE2-NH2 3.06Å; R75-K179 CarbonylContact C-O 3.47Å
76	D	97.9	Very high	97.3	Very high	86 Å²	86	32.6 Å²	32.6	46%	0.46	15%	0.149	S	C	.	.	S	Bend	trans	-136.6	20.2	-170.5	58.4	-21.2	0	0	0	112	K179 Y216	D76-K179 CarbonylContact C-O 3.37Å; D76-K179 VanDerWaalsContact CA-O 3.22Å; D76-K179 WeakPolarHBondContact CA-O 3.44Å; D76-K179 PolarHBondContact N-O 2.78Å; D76-Y216 WeakPolarHBondContact OD1-CE2 3.43Å; D76-Y216 VanDerWaalsContact OD1-CZ 3.26Å; D76-Y216 PolarHBondContact OD1-OH 3.27Å; D76-Y216 PolarHBondContact OD2-OH 3.46Å
77	V	98.3	Very high	97.9	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.012	15%	0.145	C	C	.	.	S	Bend	trans	-129	122.2	174	174.8	0	0	0	0	108.2	C74 T81 L82 K179 S180 C181 Y216 C219 L220	C74-V77 HydrophobicContact CB-CB 4.15Å; V77-T81 HydrophobicContact CG1-CG2 4.12Å; V77-L82 HydrophobicContact CG1-CB 4.26Å; V77-K179 CarbonylContact C-O 3.55Å; V77-K179 PolarHBondContact N-O 3.02Å; V77-K179 CarbonylContact O-C 3.52Å; V77-S180 CarbonylContact O-C 3.4Å; V77-S180 VanDerWaalsContact O-CA 3.23Å; V77-S180 WeakPolarHBondContact O-CA 3.36Å; V77-S180 PolarHBondContact O-N 2.95Å; V77-C181 PolarHBondContact O-N 3.16Å; V77-Y216 HydrophobicContact CG2-CD2 4.03Å; V77-Y216 HydrophobicContact CG2-CE2 3.78Å; V77-C219 HydrophobicContact CB-CB 4.38Å; V77-C219 HydrophobicContact CG1-CB 3.6Å; V77-C219 HydrophobicContact CG2-CB 3.82Å; V77-L220 HydrophobicContact CG2-CD2 3.66Å; V77-L220 HydrophobicContact CG2-CG 4.36Å
78	P	98.5	Very high	98.2	Very high	30 Å²	30	30.8 Å²	30.8	20%	0.195	14%	0.14	C	C	.	.			trans	-73.2	156	174.1	33.3	-36	0	0	0	111.2	E80 T81 L82	P78-E80 WeakPolarHBondContact CB-OE2 3.36Å; P78-E80 PolarHBondContact O-N 2.97Å; P78-T81 WeakPolarHBondContact CG-OG1 3.25Å; P78-T81 PolarHBondContact O-N 3.14Å; P78-L82 PolarHBondContact O-N 3.13Å
79	A	98.8	Very high	98.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-58	-37.3	-175.3	0	0	0	0	0	112.5	T81 L82 Y83 Y143 I173 C181	A79-T81 PolarHBondContact O-N 2.8Å; A79-L82 PolarHBondContact O-N 2.82Å; A79-Y83 WeakPolarHBondContact O-CB 3.39Å; A79-Y83 PolarHBondContact O-N 3.43Å; A79-Y143 HydrophobicContact CB-CD2 4.11Å; A79-Y143 HydrophobicContact CB-CE2 3.8Å; A79-I173 HydrophobicContact CB-CG2 3.76Å; A79-C181 HydrophobicContact CB-CB 3.92Å
80	E	98.5	Very high	98.2	Very high	84 Å²	84	35.9 Å²	35.9	39%	0.393	17%	0.165	S	C	.	.	H	α-helix	trans	-62.2	-43.1	179.7	-60.1	70.9	-158.5	0	0	111.7	P78 L82 Y83 D84	P78-E80 WeakPolarHBondContact CB-OE2 3.36Å; P78-E80 PolarHBondContact O-N 2.97Å; E80-L82 VanDerWaalsContact C-N 3.35Å; E80-L82 PolarHBondContact O-N 2.89Å; E80-Y83 WeakPolarHBondContact O-CB 3.2Å; E80-Y83 PolarHBondContact O-N 3.2Å; E80-D84 PolarHBondContact O-N 2.85Å
81	T	98.8	Very high	98.2	Very high	22 Å²	22	36.2 Å²	36.2	14%	0.135	17%	0.166	C	C	.	.	H	α-helix	trans	-64.9	-41.9	178.4	-65.7	0	0	0	0	110.9	V77 P78 A79 D84 V85 C219 Y222 P223	V77-T81 HydrophobicContact CG1-CG2 4.12Å; P78-T81 WeakPolarHBondContact CG-OG1 3.25Å; P78-T81 PolarHBondContact O-N 3.14Å; A79-T81 PolarHBondContact O-N 2.8Å; T81-D84 PolarHBondContact O-N 3.36Å; T81-V85 VanDerWaalsContact O-CG2 3.28Å; T81-V85 WeakPolarHBondContact O-CG2 3.26Å; T81-V85 PolarHBondContact O-N 3.28Å; T81-C219 HydrophobicContact CG2-CB 4.16Å; T81-Y222 HydrophobicContact CG2-CD1 4.31Å; T81-P223 HydrophobicContact CG2-CG 4.43Å
82	L	98.8	Very high	98.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-66.7	-40.2	177.3	-178.2	73.7	0	0	0	111.3	V77 P78 A79 E80 V85 L86 I173 I183 M215 C219	V77-L82 HydrophobicContact CG1-CB 4.26Å; P78-L82 PolarHBondContact O-N 3.13Å; A79-L82 PolarHBondContact O-N 2.82Å; E80-L82 VanDerWaalsContact C-N 3.35Å; E80-L82 PolarHBondContact O-N 2.89Å; L82-V85 PolarHBondContact O-N 3.36Å; L82-L86 HydrophobicContact CG-CD1 4.48Å; L82-L86 WeakPolarHBondContact O-CG 3.24Å; L82-L86 PolarHBondContact O-N 2.83Å; L82-L86 VanDerWaalsContact O-N 3.13Å; L82-I173 HydrophobicContact CB-CD1 4.39Å; L82-I173 HydrophobicContact CD2-CB 4.37Å; L82-I173 HydrophobicContact CD2-CD1 3.91Å; L82-I173 HydrophobicContact CD2-CG1 3.84Å; L82-I173 HydrophobicContact CD2-CG2 3.75Å; L82-I173 HydrophobicContact CG-CD1 4.03Å; L82-I173 HydrophobicContact CG-CG1 4.48Å; L82-I183 HydrophobicContact CD1-CD1 4.3Å; L82-I183 HydrophobicContact CD2-CB 3.6Å; L82-I183 HydrophobicContact CD2-CD1 3.82Å; L82-I183 HydrophobicContact CD2-CG1 4.02Å; L82-I183 HydrophobicContact CD2-CG2 4.13Å; L82-I183 HydrophobicContact CG-CD1 4.35Å; L82-M215 HydrophobicContact CD1-CG 4.32Å; L82-M215 HydrophobicContact CD1-SD 3.84Å; L82-C219 WeakPolarHBondContact CD1-SG 3.44Å
83	Y	98.8	Very high	98	Very high	3 Å²	3	40.1 Å²	40.1	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-60	-47.1	175.3	-176.2	-115.2	0	0	0	111.4	A79 E80 V85 L86 H87 Y143 I145 I173 L237	A79-Y83 WeakPolarHBondContact O-CB 3.39Å; A79-Y83 PolarHBondContact O-N 3.43Å; E80-Y83 WeakPolarHBondContact O-CB 3.2Å; E80-Y83 PolarHBondContact O-N 3.2Å; Y83-V85 PolarHBondContact O-N 3.33Å; Y83-L86 PolarHBondContact O-N 2.84Å; Y83-H87 AromaticContact CD2-CD2 3.9Å; Y83-H87 AromaticContact CE1-CD2 3.88Å; Y83-H87 AromaticContact CE2-CD2 3.44Å; Y83-H87 VanDerWaalsContact CE2-CD2 3.44Å; Y83-H87 WeakPolarHBondContact CE2-CD2 3.29Å; Y83-H87 AromaticContact CE2-NE2 3.24Å; Y83-H87 WeakPolarHBondContact CE2-NE2 3.03Å; Y83-H87 AromaticContact CZ-CD2 3.42Å; Y83-H87 VanDerWaalsContact CZ-CD2 3.42Å; Y83-H87 AromaticContact CZ-NE2 3.24Å; Y83-H87 PolarHBondContact O-N 3.18Å; Y83-H87 PolarHBondContact OH-NE2 3.31Å; Y83-H87 VanDerWaalsContact OH-NE2 3.09Å; Y83-Y143 AromaticContact CD1-CD1 3.88Å; Y83-Y143 HydrophobicContact CD1-CD1 3.88Å; Y83-Y143 HydrophobicContact CD1-CE1 4.03Å; Y83-Y143 HydrophobicContact CD1-CG 4.47Å; Y83-Y143 AromaticContact CD2-CD1 3.77Å; Y83-Y143 HydrophobicContact CD2-CD1 3.77Å; Y83-Y143 AromaticContact CD2-CG 3.75Å; Y83-Y143 HydrophobicContact CD2-CG 3.75Å; Y83-Y143 HydrophobicContact CE1-CD1 4Å; Y83-Y143 HydrophobicContact CE1-CE1 4.26Å; Y83-Y143 AromaticContact CE2-CD1 3.92Å; Y83-Y143 HydrophobicContact CE2-CD1 3.92Å; Y83-Y143 HydrophobicContact CE2-CG 4.23Å; Y83-Y143 AromaticContact CG-CD1 3.77Å; Y83-Y143 HydrophobicContact CG-CD1 3.77Å; Y83-Y143 HydrophobicContact CG-CD2 4.47Å; Y83-Y143 HydrophobicContact CG-CE1 4.25Å; Y83-Y143 AromaticContact CG-CG 3.9Å; Y83-Y143 HydrophobicContact CG-CG 3.9Å; Y83-I145 HydrophobicContact CD2-CD1 3.8Å; Y83-I145 HydrophobicContact CD2-CG1 4.11Å; Y83-I145 HydrophobicContact CE2-CD1 3.75Å; Y83-I145 HydrophobicContact CE2-CG1 3.69Å; Y83-I173 HydrophobicContact CD2-CD1 4.18Å; Y83-L237 HydrophobicContact CD1-CD2 4.11Å; Y83-L237 HydrophobicContact CE1-CD2 3.77Å
84	D	98.8	Very high	97.8	Very high	10 Å²	10	43.7 Å²	43.7	5%	0.053	20%	0.198	C	C	.	.	H	α-helix	trans	-58.8	-46.1	174.6	-75	-22.5	0	0	0	112.1	E80 T81 L86 H87 D88 Y222 K234 W236	E80-D84 PolarHBondContact O-N 2.85Å; T81-D84 PolarHBondContact O-N 3.36Å; D84-L86 PolarHBondContact O-N 3.4Å; D84-H87 PolarHBondContact O-N 3.21Å; D84-H87 VanDerWaalsContact O-N 3.14Å; D84-D88 VanDerWaalsContact O-CB 3.32Å; D84-D88 WeakPolarHBondContact O-CB 3.46Å; D84-D88 PolarHBondContact O-N 2.98Å; D84-Y222 HydrophobicContact CB-CD1 4.11Å; D84-Y222 HydrophobicContact CB-CE1 3.34Å; D84-K234 IonicContact OD1-NZ 2.83Å; D84-K234 IonicContact OD2-NZ 3.94Å; D84-K234 PolarHBondContact OD2-NZ 3.18Å; D84-W236 HydrophobicContact CB-CZ2 4.35Å; D84-W236 PolarHBondContact OD1-NE1 2.67Å
85	V	98.8	Very high	97.7	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-61.7	-32.5	-179.6	167	0	0	0	0	112.9	T81 L82 Y83 Y91 W95 M215 A218 C219 Y222	T81-V85 VanDerWaalsContact O-CG2 3.28Å; T81-V85 WeakPolarHBondContact O-CG2 3.26Å; T81-V85 PolarHBondContact O-N 3.28Å; L82-V85 PolarHBondContact O-N 3.36Å; Y83-V85 PolarHBondContact O-N 3.33Å; V85-Y91 HydrophobicContact CG1-CD1 4.4Å; V85-Y91 HydrophobicContact CG2-CD1 4.29Å; V85-Y91 HydrophobicContact CG2-CE1 4.23Å; V85-W95 HydrophobicContact CG1-CZ2 4.32Å; V85-M215 HydrophobicContact CG1-CG 4.37Å; V85-A218 HydrophobicContact CG1-CB 4.3Å; V85-C219 HydrophobicContact CG2-CB 4.42Å; V85-Y222 VanDerWaalsContact CG2-CB 3.47Å; V85-Y222 HydrophobicContact CG2-CD1 3.93Å; V85-Y222 HydrophobicContact CG2-CD2 3.75Å; V85-Y222 HydrophobicContact CG2-CE2 4.45Å; V85-Y222 HydrophobicContact CG2-CG 3.42Å; V85-Y222 VanDerWaalsContact CG2-CG 3.42Å
86	L	98.4	Very high	97.6	Very high	21 Å²	21	37 Å²	37	11%	0.11	17%	0.174	C	C	.	.	H	α-helix	trans	-76.4	-29.5	177.4	-73.1	170.8	0	0	0	112.7	L82 Y83 D84 I145 Y171 I173 I183 M215	L82-L86 HydrophobicContact CG-CD1 4.48Å; L82-L86 WeakPolarHBondContact O-CG 3.24Å; L82-L86 PolarHBondContact O-N 2.83Å; L82-L86 VanDerWaalsContact O-N 3.13Å; Y83-L86 PolarHBondContact O-N 2.84Å; D84-L86 PolarHBondContact O-N 3.4Å; L86-I145 HydrophobicContact CB-CD1 3.71Å; L86-I145 HydrophobicContact CD1-CD1 4.18Å; L86-Y171 HydrophobicContact CD1-CD1 4.1Å; L86-Y171 HydrophobicContact CD1-CD2 4.06Å; L86-Y171 HydrophobicContact CD1-CG 3.75Å; L86-Y171 HydrophobicContact CD2-CD1 4.18Å; L86-Y171 HydrophobicContact CD2-CD2 4.12Å; L86-Y171 HydrophobicContact CD2-CE1 3.92Å; L86-Y171 HydrophobicContact CD2-CE2 3.89Å; L86-Y171 HydrophobicContact CD2-CG 4.26Å; L86-I173 HydrophobicContact CD1-CD1 3.92Å; L86-I173 HydrophobicContact CD1-CG1 4.49Å; L86-I183 HydrophobicContact CD1-CD1 4.11Å; L86-M215 HydrophobicContact CD2-CE 4.09Å; L86-M215 HydrophobicContact CD2-SD 3.72Å; L86-M215 HydrophobicContact CG-SD 4.3Å
87	H	98.7	Very high	97.3	Very high	6 Å²	6	36.2 Å²	36.2	3%	0.028	18%	0.175	C	C	.	.	H	α-helix	trans	-86	-29.9	176.8	-86.8	-71.3	0	0	0	114.1	Y83 D84 I89 W136 I145 W236	Y83-H87 AromaticContact CD2-CD2 3.9Å; Y83-H87 AromaticContact CE1-CD2 3.88Å; Y83-H87 AromaticContact CE2-CD2 3.44Å; Y83-H87 VanDerWaalsContact CE2-CD2 3.44Å; Y83-H87 WeakPolarHBondContact CE2-CD2 3.29Å; Y83-H87 AromaticContact CE2-NE2 3.24Å; Y83-H87 WeakPolarHBondContact CE2-NE2 3.03Å; Y83-H87 AromaticContact CZ-CD2 3.42Å; Y83-H87 VanDerWaalsContact CZ-CD2 3.42Å; Y83-H87 AromaticContact CZ-NE2 3.24Å; Y83-H87 PolarHBondContact O-N 3.18Å; Y83-H87 PolarHBondContact OH-NE2 3.31Å; Y83-H87 VanDerWaalsContact OH-NE2 3.09Å; D84-H87 PolarHBondContact O-N 3.21Å; D84-H87 VanDerWaalsContact O-N 3.14Å; H87-I89 PolarHBondContact O-N 3.48Å; H87-W136 AromaticContact CE1-CD2 3.37Å; H87-W136 AromaticContact CE1-CE2 3.87Å; H87-W136 AromaticContact CE1-CE3 3.56Å; H87-W136 AromaticContact CE1-CG 3.56Å; H87-W136 AromaticContact NE2-CG 3.69Å; H87-I145 WeakPolarHBondContact NE2-CD1 3.42Å; H87-W236 HydrophobicContact CB-CB 3.82Å; H87-W236 HydrophobicContact CB-CD2 3.37Å; H87-W236 HydrophobicContact CB-CE3 3.72Å; H87-W236 HydrophobicContact CB-CG 3.4Å; H87-W236 VanDerWaalsContact CB-CG 3.4Å; H87-W236 HydrophobicContact CB-CZ3 4.42Å; H87-W236 VanDerWaalsContact CG-CB 3.49Å; H87-W236 AromaticContact CG-CD1 3.97Å; H87-W236 AromaticContact CG-CG 3.58Å
88	D	98.4	Very high	97.1	Very high	5 Å²	5	39.8 Å²	39.8	3%	0.027	19%	0.194	C	C	.	.			trans	-75.8	92	-173.4	-161.5	-39.3	0	0	0	112	D84 E90 Y91 R92 Y222 K226 W236	D84-D88 VanDerWaalsContact O-CB 3.32Å; D84-D88 WeakPolarHBondContact O-CB 3.46Å; D84-D88 PolarHBondContact O-N 2.98Å; D88-E90 VanDerWaalsContact C-N 3.3Å; D88-E90 PolarHBondContact O-N 2.95Å; D88-E90 PolarHBondContact OD1-N 3.41Å; D88-Y91 PolarHBondContact O-N 3.06Å; D88-Y91 PolarHBondContact OD1-N 3.28Å; D88-R92 PolarHBondContact O-N 3.02Å; D88-Y222 HydrophobicContact CB-CE2 3.95Å; D88-Y222 WeakPolarHBondContact OD2-CE2 3.28Å; D88-Y222 PolarHBondContact OD2-OH 2.89Å; D88-K226 IonicContact OD2-NZ 3.97Å; D88-K226 PolarHBondContact OD2-NZ 3.43Å; D88-W236 HydrophobicContact CB-CH2 3.56Å; D88-W236 HydrophobicContact CB-CZ2 4.11Å; D88-W236 HydrophobicContact CB-CZ3 4.19Å; D88-W236 WeakPolarHBondContact OD2-CH2 3.39Å
89	I	96.4	Very high	96.9	Very high	26 Å²	26	39.1 Å²	39.1	13%	0.133	19%	0.19	C	C	.	.	H	α-helix	trans	-66.4	-31.4	-178.6	-65.3	176.2	0	0	0	112.3	H87 R92 T102 D104	H87-I89 PolarHBondContact O-N 3.48Å; I89-R92 WeakPolarHBondContact O-CB 3.2Å; I89-R92 PolarHBondContact O-N 3.1Å; I89-T102 HydrophobicContact CG2-CG2 3.7Å; I89-D104 HydrophobicContact CD1-CB 4.26Å; I89-D104 WeakPolarHBondContact CD1-OD1 3.25Å; I89-D104 WeakPolarHBondContact CD1-OD2 3.43Å
90	E	96.5	Very high	96.8	Very high	100 Å²	100	42.7 Å²	42.7	47%	0.467	21%	0.208	S	C	.	.	H	α-helix	trans	-64.7	-46.7	173.4	-173.4	-176.8	175.1	0	0	109.5	D88 R92 K93 W225 H229	D88-E90 VanDerWaalsContact C-N 3.3Å; D88-E90 PolarHBondContact O-N 2.95Å; D88-E90 PolarHBondContact OD1-N 3.41Å; E90-R92 VanDerWaalsContact C-N 3.28Å; E90-R92 PolarHBondContact O-N 2.92Å; E90-K93 PolarHBondContact O-N 2.85Å; E90-W225 HydrophobicContact CB-CH2 4.18Å; E90-W225 HydrophobicContact CG-CH2 3.99Å; E90-W225 HydrophobicContact CG-CZ2 4.18Å; E90-H229 IonicContact OE1-CD2 3.14Å
91	Y	98.2	Very high	96.8	Very high	6 Å²	6	42.3 Å²	42.3	2%	0.024	21%	0.206	C	C	.	.	H	α-helix	trans	-65.4	-31.5	176.5	-165.3	-126.3	0	0	0	113	V85 D88 K93 K94 W95 A218 K221 Y222 W225	V85-Y91 HydrophobicContact CG1-CD1 4.4Å; V85-Y91 HydrophobicContact CG2-CD1 4.29Å; V85-Y91 HydrophobicContact CG2-CE1 4.23Å; D88-Y91 PolarHBondContact O-N 3.06Å; D88-Y91 PolarHBondContact OD1-N 3.28Å; Y91-K93 PolarHBondContact O-N 3.05Å; Y91-K94 HydrophobicContact CD2-CB 3.92Å; Y91-K94 HydrophobicContact CD2-CG 4.35Å; Y91-K94 HydrophobicContact CE2-CB 4.09Å; Y91-K94 HydrophobicContact CE2-CG 4.06Å; Y91-K94 WeakPolarHBondContact O-CA 3.45Å; Y91-K94 VanDerWaalsContact O-CB 3.24Å; Y91-K94 WeakPolarHBondContact O-CB 3.36Å; Y91-K94 PolarHBondContact O-N 2.99Å; Y91-W95 AromaticContact CD1-CD1 3.42Å; Y91-W95 VanDerWaalsContact CD1-CD1 3.42Å; Y91-W95 AromaticContact CD1-NE1 3.81Å; Y91-W95 AromaticContact CE1-CD1 3.62Å; Y91-W95 HydrophobicContact CE1-CG 4.44Å; Y91-W95 PolarHBondContact O-N 3.3Å; Y91-A218 HydrophobicContact CE1-CB 3.84Å; Y91-A218 PolarHBondContact OH-O 3.45Å; Y91-A218 VanDerWaalsContact OH-O 3.05Å; Y91-K221 WeakPolarHBondContact OH-CB 3.45Å; Y91-Y222 AromaticContact CD1-CD2 3.36Å; Y91-Y222 HydrophobicContact CD1-CD2 3.36Å; Y91-Y222 AromaticContact CD1-CE2 3.91Å; Y91-Y222 HydrophobicContact CD1-CE2 3.91Å; Y91-Y222 HydrophobicContact CD1-CG 4.38Å; Y91-Y222 HydrophobicContact CD2-CD2 4.27Å; Y91-Y222 AromaticContact CE1-CD2 3.57Å; Y91-Y222 HydrophobicContact CE1-CD2 3.57Å; Y91-Y222 HydrophobicContact CE1-CG 4.25Å; Y91-Y222 HydrophobicContact CE2-CD2 4.43Å; Y91-Y222 AromaticContact CG-CD2 3.73Å; Y91-Y222 HydrophobicContact CG-CD2 3.73Å; Y91-Y222 AromaticContact CG-CE2 3.96Å; Y91-Y222 HydrophobicContact CG-CE2 3.96Å; Y91-W225 HydrophobicContact CD2-CB 4.39Å; Y91-W225 AromaticContact CD2-CD2 3.17Å; Y91-W225 HydrophobicContact CD2-CD2 3.17Å; Y91-W225 AromaticContact CD2-CE2 3.49Å; Y91-W225 VanDerWaalsContact CD2-CE2 3.49Å; Y91-W225 AromaticContact CD2-CE3 3.3Å; Y91-W225 HydrophobicContact CD2-CE3 3.3Å; Y91-W225 AromaticContact CD2-CG 3.67Å; Y91-W225 HydrophobicContact CD2-CG 3.67Å; Y91-W225 HydrophobicContact CD2-CH2 4.04Å; Y91-W225 AromaticContact CD2-CZ2 3.93Å; Y91-W225 HydrophobicContact CD2-CZ2 3.93Å; Y91-W225 AromaticContact CD2-CZ3 3.74Å; Y91-W225 HydrophobicContact CD2-CZ3 3.74Å; Y91-W225 HydrophobicContact CE2-CB 3.75Å; Y91-W225 AromaticContact CE2-CD1 3.86Å; Y91-W225 AromaticContact CE2-CD2 3.47Å; Y91-W225 HydrophobicContact CE2-CD2 3.47Å; Y91-W225 VanDerWaalsContact CE2-CD2 3.47Å; Y91-W225 AromaticContact CE2-CE3 3.86Å; Y91-W225 HydrophobicContact CE2-CE3 3.86Å; Y91-W225 AromaticContact CE2-CG 3.38Å; Y91-W225 HydrophobicContact CE2-CG 3.38Å; Y91-W225 HydrophobicContact CG-CD2 4.18Å; Y91-W225 AromaticContact CG-CE3 3.85Å; Y91-W225 HydrophobicContact CG-CE3 3.85Å; Y91-W225 HydrophobicContact CG-CH2 4.39Å; Y91-W225 AromaticContact CG-CZ3 3.98Å; Y91-W225 HydrophobicContact CG-CZ3 3.98Å
92	R	97.1	Very high	96.7	Very high	50 Å²	50	41.8 Å²	41.8	19%	0.189	20%	0.203	C	C	.	.	H	α-helix	trans	-52.6	-41	177	-169.5	65.3	-178.6	-139.1	4.6	112.1	D88 I89 E90 K94 W95 D96 T102	D88-R92 PolarHBondContact O-N 3.02Å; I89-R92 WeakPolarHBondContact O-CB 3.2Å; I89-R92 PolarHBondContact O-N 3.1Å; E90-R92 VanDerWaalsContact C-N 3.28Å; E90-R92 PolarHBondContact O-N 2.92Å; R92-K94 PolarHBondContact O-N 3.2Å; R92-W95 VanDerWaalsContact CD-CZ2 3.4Å; R92-W95 VanDerWaalsContact CZ-CH2 3.48Å; R92-W95 PolarHBondContact O-N 3.12Å; R92-D96 HydrophobicContact CG-CB 4.22Å; R92-D96 IonicContact CZ-OD2 3.68Å; R92-D96 VanDerWaalsContact CZ-OD2 3.26Å; R92-D96 IonicContact NE-OD2 3.48Å; R92-D96 PolarHBondContact NE-OD2 3.08Å; R92-D96 IonicContact NH2-OD2 2.92Å; R92-D96 PolarHBondContact NH2-OD2 2.89Å; R92-D96 VanDerWaalsContact O-CB 3.26Å; R92-D96 WeakPolarHBondContact O-CB 3.45Å; R92-D96 PolarHBondContact O-N 2.94Å; R92-T102 HydrophobicContact CB-CG2 4.49Å
93	K	94.2	Very high	96.7	Very high	121 Å²	121	44.6 Å²	44.6	53%	0.526	22%	0.215	S	C	.	.	H	α-helix	trans	-63.4	-22.4	176.7	-62.9	176.3	-175.3	173.6	0	113.4	E90 Y91 V99 T102	E90-K93 PolarHBondContact O-N 2.85Å; Y91-K93 PolarHBondContact O-N 3.05Å; K93-V99 HydrophobicContact CG-CG1 4.37Å; K93-T102 HydrophobicContact CD-CG2 4.42Å; K93-T102 WeakPolarHBondContact CE-O 3.38Å; K93-T102 HydrophobicContact CG-CG2 3.83Å; K93-T102 PolarHBondContact NZ-O 2.73Å
94	K	95.6	Very high	96.7	Very high	151 Å²	151	46.5 Å²	46.5	66%	0.657	23%	0.226	S	C	*	.	H	α-helix	trans	-81.6	-38	-179.5	-172.8	57.6	176.7	-178.9	0	113.1	Y91 R92	Y91-K94 HydrophobicContact CD2-CB 3.92Å; Y91-K94 HydrophobicContact CD2-CG 4.35Å; Y91-K94 HydrophobicContact CE2-CB 4.09Å; Y91-K94 HydrophobicContact CE2-CG 4.06Å; Y91-K94 WeakPolarHBondContact O-CA 3.45Å; Y91-K94 VanDerWaalsContact O-CB 3.24Å; Y91-K94 WeakPolarHBondContact O-CB 3.36Å; Y91-K94 PolarHBondContact O-N 2.99Å; R92-K94 PolarHBondContact O-N 3.2Å
95	W	95.5	Very high	96.7	Very high	36 Å²	36	46.9 Å²	46.9	14%	0.136	23%	0.228	C	C	.	.	H	α-helix	trans	-110.4	-24.9	-171.1	70.6	-99.3	0	0	0	114.2	V85 Y91 R92 S97 K214 M215 A218	V85-W95 HydrophobicContact CG1-CZ2 4.32Å; Y91-W95 AromaticContact CD1-CD1 3.42Å; Y91-W95 VanDerWaalsContact CD1-CD1 3.42Å; Y91-W95 AromaticContact CD1-NE1 3.81Å; Y91-W95 AromaticContact CE1-CD1 3.62Å; Y91-W95 HydrophobicContact CE1-CG 4.44Å; Y91-W95 PolarHBondContact O-N 3.3Å; R92-W95 VanDerWaalsContact CD-CZ2 3.4Å; R92-W95 VanDerWaalsContact CZ-CH2 3.48Å; R92-W95 PolarHBondContact O-N 3.12Å; W95-S97 PolarHBondContact O-N 3.38Å; W95-K214 HydrophobicContact CE3-CB 4.47Å; W95-K214 HydrophobicContact CZ3-CB 4.49Å; W95-M215 HydrophobicContact CH2-CB 3.76Å; W95-M215 HydrophobicContact CH2-CG 3.9Å; W95-M215 HydrophobicContact CZ2-CB 4.47Å; W95-M215 HydrophobicContact CZ2-CG 4.2Å; W95-M215 HydrophobicContact CZ3-CB 3.9Å; W95-M215 HydrophobicContact CZ3-CG 4.49Å; W95-A218 HydrophobicContact CB-CB 3.6Å; W95-A218 HydrophobicContact CD2-CB 3.72Å; W95-A218 HydrophobicContact CE3-CB 4.27Å; W95-A218 HydrophobicContact CG-CB 3.41Å; W95-A218 VanDerWaalsContact CG-CB 3.41Å
96	D	93.8	Very high	96.7	Very high	18 Å²	18	47 Å²	47	10%	0.096	23%	0.229	C	C	.	.			trans	-86.7	97	176.3	-164.9	-23.9	0	0	0	110.5	R92 N98 V99 Y117	R92-D96 HydrophobicContact CG-CB 4.22Å; R92-D96 IonicContact CZ-OD2 3.68Å; R92-D96 VanDerWaalsContact CZ-OD2 3.26Å; R92-D96 IonicContact NE-OD2 3.48Å; R92-D96 PolarHBondContact NE-OD2 3.08Å; R92-D96 IonicContact NH2-OD2 2.92Å; R92-D96 PolarHBondContact NH2-OD2 2.89Å; R92-D96 VanDerWaalsContact O-CB 3.26Å; R92-D96 WeakPolarHBondContact O-CB 3.45Å; R92-D96 PolarHBondContact O-N 2.94Å; D96-N98 PolarHBondContact O-N 3.21Å; D96-N98 VanDerWaalsContact O-N 3.09Å; D96-N98 PolarHBondContact OD1-N 2.76Å; D96-V99 HydrophobicContact CB-CB 4.32Å; D96-V99 HydrophobicContact CB-CG1 4.33Å; D96-V99 VanDerWaalsContact O-CG1 3.24Å; D96-V99 WeakPolarHBondContact O-CG1 3.24Å; D96-V99 PolarHBondContact O-N 2.97Å; D96-Y117 PolarHBondContact OD2-OH 2.9Å; D96-Y117 VanDerWaalsContact OD2-OH 3.1Å
97	S	91.9	Very high	96.6	Very high	69 Å²	69	49.5 Å²	49.5	48%	0.483	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-15.9	-179.9	60.8	0	0	0	0	114.5	W95 K214	W95-S97 PolarHBondContact O-N 3.38Å; S97-K214 PolarHBondContact OG-NZ 3.49Å
98	N	93.7	Very high	96.6	Very high	77 Å²	77	50.7 Å²	50.7	41%	0.412	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-17.8	-176.6	-66.2	-9.9	0	0	0	112.1	D96 I100 W119 R120	D96-N98 PolarHBondContact O-N 3.21Å; D96-N98 VanDerWaalsContact O-N 3.09Å; D96-N98 PolarHBondContact OD1-N 2.76Å; N98-I100 PolarHBondContact O-N 2.91Å; N98-W119 HydrophobicContact CB-CB 4.33Å; N98-W119 CarbonylContact O-C 3.6Å; N98-W119 WeakPolarHBondContact O-CA 3.2Å; N98-W119 WeakPolarHBondContact O-CB 3.34Å; N98-R120 PolarHBondContact O-N 2.85Å
99	V	96.1	Very high	96.6	Very high	16 Å²	16	52.6 Å²	52.6	10%	0.097	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	133.4	-178.5	76	0	0	0	0	110.6	K93 D96 T102 Y117 S118	K93-V99 HydrophobicContact CG-CG1 4.37Å; D96-V99 HydrophobicContact CB-CB 4.32Å; D96-V99 HydrophobicContact CB-CG1 4.33Å; D96-V99 VanDerWaalsContact O-CG1 3.24Å; D96-V99 WeakPolarHBondContact O-CG1 3.24Å; D96-V99 PolarHBondContact O-N 2.97Å; V99-T102 HydrophobicContact CG2-CG2 3.65Å; V99-Y117 HydrophobicContact CB-CE2 3.99Å; V99-Y117 HydrophobicContact CG2-CD2 3.93Å; V99-Y117 HydrophobicContact CG2-CE2 3.46Å; V99-Y117 VanDerWaalsContact CG2-CE2 3.46Å; V99-S118 WeakPolarHBondContact CA-O 3.29Å
100	I	96.7	Very high	96.7	Very high	75 Å²	75	55.5 Å²	55.5	39%	0.385	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-52.7	170.9	-60.3	173.9	0	0	0	107.8	N98 S118 R120 N127	N98-I100 PolarHBondContact O-N 2.91Å; I100-S118 PolarHBondContact N-O 3.16Å; I100-R120 HydrophobicContact CD1-CG 3.73Å; I100-R120 HydrophobicContact CG1-CG 3.47Å; I100-R120 VanDerWaalsContact CG1-CG 3.47Å; I100-N127 HydrophobicContact CD1-CB 3.74Å; I100-N127 WeakPolarHBondContact CD1-ND2 3.22Å
101	E	97	Very high	96.7	Very high	76 Å²	76	52.8 Å²	52.8	36%	0.355	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	140.2	-178	-177.2	175.3	-145.4	0	0	109.4	F103 Y116 S118 R158	E101-F103 HydrophobicContact CG-CD1 3.81Å; E101-F103 HydrophobicContact CG-CE1 3.67Å; E101-Y116 HydrophobicContact CB-CE1 4.08Å; E101-Y116 HydrophobicContact CG-CD1 4.28Å; E101-Y116 HydrophobicContact CG-CE1 4Å; E101-S118 WeakPolarHBondContact CB-OG 3.34Å; E101-S118 PolarHBondContact N-OG 3.18Å; E101-S118 VanDerWaalsContact N-OG 3.09Å; E101-S118 PolarHBondContact O-N 3.01Å; E101-S118 PolarHBondContact O-OG 3.45Å; E101-S118 VanDerWaalsContact O-OG 3.1Å; E101-R158 IonicContact OE2-NH1 3.19Å
102	T	97.9	Very high	96.7	Very high	11 Å²	11	52.5 Å²	52.5	7%	0.067	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	134.3	178.3	-177.6	0	0	0	0	109.6	I89 R92 K93 V99 Y116	I89-T102 HydrophobicContact CG2-CG2 3.7Å; R92-T102 HydrophobicContact CB-CG2 4.49Å; K93-T102 HydrophobicContact CD-CG2 4.42Å; K93-T102 WeakPolarHBondContact CE-O 3.38Å; K93-T102 HydrophobicContact CG-CG2 3.83Å; K93-T102 PolarHBondContact NZ-O 2.73Å; V99-T102 HydrophobicContact CG2-CG2 3.65Å; T102-Y116 VanDerWaalsContact CA-O 3.3Å; T102-Y116 WeakPolarHBondContact CA-O 3.43Å; T102-Y116 PolarHBondContact OG1-O 3.28Å
103	F	98.3	Very high	96.8	Very high	58 Å²	58	50.4 Å²	50.4	25%	0.254	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	152.7	177.8	54.1	-94.5	0	0	0	110.7	E101 I105 Y116 Y155	E101-F103 HydrophobicContact CG-CD1 3.81Å; E101-F103 HydrophobicContact CG-CE1 3.67Å; F103-I105 HydrophobicContact CD2-CG1 4.13Å; F103-I105 HydrophobicContact CE2-CG1 3.82Å; F103-Y116 HydrophobicContact CD1-CD1 4.09Å; F103-Y116 AromaticContact CE1-CD1 3.42Å; F103-Y116 HydrophobicContact CE1-CD1 3.42Å; F103-Y116 VanDerWaalsContact CE1-CD1 3.42Å; F103-Y116 HydrophobicContact CE1-CE1 4.1Å; F103-Y116 HydrophobicContact CE1-CG 4.13Å; F103-Y116 HydrophobicContact CE2-CD1 4.5Å; F103-Y116 HydrophobicContact CE2-CG 4.43Å; F103-Y116 AromaticContact CZ-CD1 3.66Å; F103-Y116 HydrophobicContact CZ-CD1 3.66Å; F103-Y116 HydrophobicContact CZ-CE1 4.46Å; F103-Y116 AromaticContact CZ-CG 3.9Å; F103-Y116 HydrophobicContact CZ-CG 3.9Å; F103-Y116 PolarHBondContact N-O 3.02Å; F103-Y116 VanDerWaalsContact N-O 3.14Å; F103-Y116 PolarHBondContact O-N 2.84Å; F103-Y155 AromaticContact CE2-CE1 3.79Å; F103-Y155 HydrophobicContact CE2-CE1 3.79Å; F103-Y155 AromaticContact CZ-CE1 3.78Å; F103-Y155 HydrophobicContact CZ-CE1 3.78Å
104	D	98.3	Very high	97	Very high	44 Å²	44	44.7 Å²	44.7	24%	0.235	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	139.7	168	-67.4	-32.4	0	0	0	110.1	I89 R134 L244	I89-D104 HydrophobicContact CD1-CB 4.26Å; I89-D104 WeakPolarHBondContact CD1-OD1 3.25Å; I89-D104 WeakPolarHBondContact CD1-OD2 3.43Å; D104-R134 VanDerWaalsContact CG-NH2 3.27Å; D104-R134 IonicContact OD1-CZ 3.21Å; D104-R134 IonicContact OD1-NH2 3.69Å; D104-R134 PolarHBondContact OD1-NH2 2.88Å; D104-R134 IonicContact OD2-NH2 2.77Å; D104-R134 PolarHBondContact OD2-NH2 2.83Å; D104-L244 HydrophobicContact CB-CD1 3.58Å; D104-L244 HydrophobicContact CB-CD2 3.82Å; D104-L244 HydrophobicContact CB-CG 4.33Å
105	I	98.6	Very high	97.2	Very high	18 Å²	18	37.8 Å²	37.8	9%	0.092	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	-54.2	-176.4	-65.5	164.4	0	0	0	110.2	F103 V114 I131 Y155	F103-I105 HydrophobicContact CD2-CG1 4.13Å; F103-I105 HydrophobicContact CE2-CG1 3.82Å; I105-V114 WeakPolarHBondContact CA-O 3.48Å; I105-V114 WeakPolarHBondContact CB-O 3.38Å; I105-V114 HydrophobicContact CD1-CG1 4.14Å; I105-V114 PolarHBondContact N-O 3.23Å; I105-I131 HydrophobicContact CD1-CD1 3.6Å; I105-I131 HydrophobicContact CD1-CG2 4.46Å; I105-Y155 HydrophobicContact CB-CE2 4.32Å; I105-Y155 HydrophobicContact CD1-CD1 4.44Å; I105-Y155 HydrophobicContact CD1-CD2 3.72Å; I105-Y155 HydrophobicContact CD1-CE1 4.37Å; I105-Y155 HydrophobicContact CD1-CE2 3.65Å; I105-Y155 HydrophobicContact CD1-CG 4.15Å; I105-Y155 HydrophobicContact CG1-CD2 4.38Å; I105-Y155 HydrophobicContact CG1-CE1 4.45Å; I105-Y155 HydrophobicContact CG1-CE2 3.8Å; I105-Y155 HydrophobicContact CG2-CD2 4.37Å; I105-Y155 HydrophobicContact CG2-CE2 3.54Å
106	A	98.4	Very high	97.3	Very high	4 Å²	4	36.5 Å²	36.5	3%	0.033	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	158.1	-174.7	0	0	0	0	0	111.6	D113 V114 P245 L247	A106-D113 CarbonylContact O-C 3.59Å; A106-D113 WeakPolarHBondContact O-CA 3.38Å; A106-D113 WeakPolarHBondContact O-CB 3.29Å; A106-V114 PolarHBondContact N-O 3Å; A106-V114 PolarHBondContact O-N 2.98Å; A106-P245 CarbonylContact C-O 3.36Å; A106-P245 WeakPolarHBondContact CA-O 3.49Å; A106-P245 HydrophobicContact CB-CG 4.19Å; A106-P245 WeakPolarHBondContact CB-O 3.1Å; A106-L247 HydrophobicContact CB-CB 3.65Å; A106-L247 HydrophobicContact CB-CD2 4.33Å; A106-L247 HydrophobicContact CB-CG 4.45Å
107	R	98.3	Very high	97.5	Very high	72 Å²	72	37.9 Å²	37.9	27%	0.272	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	135.4	179	-175.2	172	64.2	106.3	-1.3	111	T109 L244 P245 S246 L247	R107-T109 VanDerWaalsContact CD-O 3.23Å; R107-T109 WeakPolarHBondContact CD-O 3.47Å; R107-T109 WeakPolarHBondContact CG-O 3.43Å; R107-L244 HydrophobicContact CB-CB 4.2Å; R107-P245 PolarHBondContact N-O 2.87Å; R107-S246 CarbonylContact O-C 3.49Å; R107-S246 WeakPolarHBondContact O-CA 2.89Å; R107-L247 PolarHBondContact O-N 3.12Å
108	L	98.1	Very high	97.8	Very high	31 Å²	31	34.7 Å²	34.7	16%	0.162	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-47.1	174.7	-66.9	166.7	0	0	0	111.2	V24 A112 V114 L133 L247 L249 L252	V24-L108 HydrophobicContact CG2-CB 4.26Å; V24-L108 HydrophobicContact CG2-CD1 4.25Å; L108-A112 HydrophobicContact CB-CB 4.33Å; L108-A112 PolarHBondContact N-O 3.21Å; L108-V114 HydrophobicContact CD1-CG2 3.84Å; L108-V114 HydrophobicContact CG-CG2 4.16Å; L108-L133 HydrophobicContact CD1-CD1 3.35Å; L108-L133 HydrophobicContact CD1-CG 3.6Å; L108-L247 HydrophobicContact CD2-CB 4.22Å; L108-L247 HydrophobicContact CD2-CD2 4.4Å; L108-L247 WeakPolarHBondContact CD2-O 3.24Å; L108-L249 HydrophobicContact CD1-CD1 4.38Å; L108-L249 HydrophobicContact CD2-CD1 4.31Å; L108-L252 HydrophobicContact CD1-CD1 4.14Å; L108-L252 HydrophobicContact CD2-CD1 4.09Å
109	T	98.1	Very high	97.9	Very high	46 Å²	46	33.3 Å²	33.3	28%	0.282	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	-175.3	177.4	71.1	0	0	0	0	109.8	V24 R107 N111 A112	V24-T109 HydrophobicContact CG1-CG2 4.18Å; V24-T109 HydrophobicContact CG2-CG2 4.21Å; R107-T109 VanDerWaalsContact CD-O 3.23Å; R107-T109 WeakPolarHBondContact CD-O 3.47Å; R107-T109 WeakPolarHBondContact CG-O 3.43Å; T109-N111 PolarHBondContact O-N 2.85Å; T109-N111 PolarHBondContact OG1-N 2.86Å; T109-N111 PolarHBondContact OG1-OD1 2.8Å; T109-A112 PolarHBondContact N-O 3.2Å; T109-A112 VanDerWaalsContact N-O 3.08Å; T109-A112 VanDerWaalsContact OG1-CB 3.27Å; T109-A112 WeakPolarHBondContact OG1-CB 3.45Å; T109-A112 PolarHBondContact OG1-N 2.88Å
110	V	97.5	Very high	97.9	Very high	87 Å²	87	39.8 Å²	39.8	53%	0.527	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-21.6	174.3	-64.8	0	0	0	0	113.5	P239	V110-P239 HydrophobicContact CB-CB 4.28Å; V110-P239 HydrophobicContact CB-CG 4.33Å
111	N	98.1	Very high	97.6	Very high	43 Å²	43	37.3 Å²	37.3	23%	0.23	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.8	18.9	-174.3	70.2	-41	0	0	0	113.2	T109 S135 W136	T109-N111 PolarHBondContact O-N 2.85Å; T109-N111 PolarHBondContact OG1-N 2.86Å; T109-N111 PolarHBondContact OG1-OD1 2.8Å; N111-S135 CarbonylContact O-C 3.56Å; N111-S135 VanDerWaalsContact O-CA 3.25Å; N111-S135 WeakPolarHBondContact O-CA 3.27Å; N111-S135 PolarHBondContact O-OG 3.21Å; N111-W136 VanDerWaalsContact CA-CE2 3.49Å; N111-W136 HydrophobicContact CB-CD2 4.37Å; N111-W136 HydrophobicContact CB-CG 4.41Å; N111-W136 WeakPolarHBondContact CB-O 3.44Å; N111-W136 PolarHBondContact ND2-O 3.08Å; N111-W136 VanDerWaalsContact O-CD2 3.28Å; N111-W136 VanDerWaalsContact O-CE3 3.25Å; N111-W136 PolarHBondContact O-N 2.78Å
112	A	98.6	Very high	97.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	136.8	175.6	0	0	0	0	0	111.8	V24 L108 T109 R134	V24-A112 HydrophobicContact CG1-CB 3.68Å; V24-A112 HydrophobicContact CG2-CB 4.5Å; L108-A112 HydrophobicContact CB-CB 4.33Å; L108-A112 PolarHBondContact N-O 3.21Å; T109-A112 PolarHBondContact N-O 3.2Å; T109-A112 VanDerWaalsContact N-O 3.08Å; T109-A112 VanDerWaalsContact OG1-CB 3.27Å; T109-A112 WeakPolarHBondContact OG1-CB 3.45Å; T109-A112 PolarHBondContact OG1-N 2.88Å; A112-R134 CarbonylContact C-O 3.6Å; A112-R134 WeakPolarHBondContact CA-O 3.17Å
113	D	98.7	Very high	96.4	Very high	6 Å²	6	47.2 Å²	47.2	3%	0.032	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	172.3	-179.7	58.2	26	0	0	0	111.8	A106 L133 R134 W136	A106-D113 CarbonylContact O-C 3.59Å; A106-D113 WeakPolarHBondContact O-CA 3.38Å; A106-D113 WeakPolarHBondContact O-CB 3.29Å; D113-L133 CarbonylContact O-C 3.55Å; D113-L133 WeakPolarHBondContact O-CA 3.25Å; D113-R134 PolarHBondContact N-O 2.91Å; D113-R134 PolarHBondContact O-N 3.14Å; D113-R134 WeakPolarHBondContact OD1-CB 3.35Å; D113-R134 IonicContact OD1-CZ 3.89Å; D113-R134 IonicContact OD1-NE 3.85Å; D113-R134 PolarHBondContact OD1-NE 3.31Å; D113-R134 IonicContact OD1-NH2 2.82Å; D113-R134 PolarHBondContact OD1-NH2 3.45Å; D113-R134 IonicContact OD2-CZ 2.69Å; D113-R134 IonicContact OD2-NE 2.66Å; D113-R134 IonicContact OD2-NH2 3.24Å; D113-R134 PolarHBondContact OD2-NH2 2.84Å; D113-W136 HydrophobicContact CB-CH2 4.43Å; D113-W136 HydrophobicContact CB-CZ3 4.43Å; D113-W136 VanDerWaalsContact OD2-CH2 3.25Å; D113-W136 WeakPolarHBondContact OD2-CH2 3.41Å; D113-W136 VanDerWaalsContact OD2-CZ3 3.26Å; D113-W136 WeakPolarHBondContact OD2-CZ3 3.49Å
114	V	98.8	Very high	95.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	129.6	170.6	-176.1	0	0	0	0	107.9	I105 A106 L108 I131 T132 V150 L247 L252	I105-V114 WeakPolarHBondContact CA-O 3.48Å; I105-V114 WeakPolarHBondContact CB-O 3.38Å; I105-V114 HydrophobicContact CD1-CG1 4.14Å; I105-V114 PolarHBondContact N-O 3.23Å; A106-V114 PolarHBondContact N-O 3Å; A106-V114 PolarHBondContact O-N 2.98Å; L108-V114 HydrophobicContact CD1-CG2 3.84Å; L108-V114 HydrophobicContact CG-CG2 4.16Å; V114-I131 HydrophobicContact CG1-CG2 3.81Å; V114-T132 CarbonylContact C-O 3.52Å; V114-T132 VanDerWaalsContact CA-O 3.28Å; V114-T132 WeakPolarHBondContact CA-O 3.36Å; V114-V150 HydrophobicContact CG1-CG2 4.06Å; V114-L247 HydrophobicContact CG2-CD2 4.18Å; V114-L252 HydrophobicContact CG2-CD1 3.66Å; V114-L252 HydrophobicContact CG2-CD2 4.24Å
115	G	98.4	Very high	95.5	Very high	7 Å²	7	47.3 Å²	47.3	7%	0.072	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	160.5	-179.7	0	0	0	0	0	113.3	I131 T132	G115-I131 WeakPolarHBondContact O-CA 3.37Å; G115-T132 PolarHBondContact N-O 3.14Å; G115-T132 PolarHBondContact O-N 2.95Å
116	Y	98.6	Very high	95.1	Very high	8 Å²	8	50 Å²	50	3%	0.031	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	138.8	172	175.4	-102.3	0	0	0	110.1	E101 T102 F103 D129 I131	E101-Y116 HydrophobicContact CB-CE1 4.08Å; E101-Y116 HydrophobicContact CG-CD1 4.28Å; E101-Y116 HydrophobicContact CG-CE1 4Å; T102-Y116 VanDerWaalsContact CA-O 3.3Å; T102-Y116 WeakPolarHBondContact CA-O 3.43Å; T102-Y116 PolarHBondContact OG1-O 3.28Å; F103-Y116 HydrophobicContact CD1-CD1 4.09Å; F103-Y116 AromaticContact CE1-CD1 3.42Å; F103-Y116 HydrophobicContact CE1-CD1 3.42Å; F103-Y116 VanDerWaalsContact CE1-CD1 3.42Å; F103-Y116 HydrophobicContact CE1-CE1 4.1Å; F103-Y116 HydrophobicContact CE1-CG 4.13Å; F103-Y116 HydrophobicContact CE2-CD1 4.5Å; F103-Y116 HydrophobicContact CE2-CG 4.43Å; F103-Y116 AromaticContact CZ-CD1 3.66Å; F103-Y116 HydrophobicContact CZ-CD1 3.66Å; F103-Y116 HydrophobicContact CZ-CE1 4.46Å; F103-Y116 AromaticContact CZ-CG 3.9Å; F103-Y116 HydrophobicContact CZ-CG 3.9Å; F103-Y116 PolarHBondContact N-O 3.02Å; F103-Y116 VanDerWaalsContact N-O 3.14Å; F103-Y116 PolarHBondContact O-N 2.84Å; Y116-D129 HydrophobicContact CE2-CB 3.6Å; Y116-D129 WeakPolarHBondContact CE2-OD2 3.49Å; Y116-I131 HydrophobicContact CD2-CD1 3.53Å; Y116-I131 HydrophobicContact CD2-CG1 4.32Å; Y116-I131 HydrophobicContact CG-CD1 4.21Å
117	Y	98.3	Very high	94.9	Very high	48 Å²	48	52.2 Å²	52.2	19%	0.188	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	133	173.5	176.4	-92.2	0	0	0	110.4	D96 V99 W119 D129 V130	D96-Y117 PolarHBondContact OD2-OH 2.9Å; D96-Y117 VanDerWaalsContact OD2-OH 3.1Å; V99-Y117 HydrophobicContact CB-CE2 3.99Å; V99-Y117 HydrophobicContact CG2-CD2 3.93Å; V99-Y117 HydrophobicContact CG2-CE2 3.46Å; V99-Y117 VanDerWaalsContact CG2-CE2 3.46Å; Y117-W119 HydrophobicContact CD1-CD2 4.47Å; Y117-W119 AromaticContact CD1-CE3 3.53Å; Y117-W119 HydrophobicContact CD1-CE3 3.53Å; Y117-W119 AromaticContact CD1-CZ3 4Å; Y117-W119 HydrophobicContact CD1-CZ3 4Å; Y117-W119 HydrophobicContact CE1-CB 3.77Å; Y117-W119 AromaticContact CE1-CD2 3.93Å; Y117-W119 HydrophobicContact CE1-CD2 3.93Å; Y117-W119 AromaticContact CE1-CE3 3.42Å; Y117-W119 HydrophobicContact CE1-CE3 3.42Å; Y117-W119 VanDerWaalsContact CE1-CE3 3.42Å; Y117-W119 HydrophobicContact CE1-CG 4.13Å; Y117-W119 HydrophobicContact CE1-CZ3 4.2Å; Y117-D129 CarbonylContact O-C 3.6Å; Y117-D129 VanDerWaalsContact O-CA 3.32Å; Y117-D129 WeakPolarHBondContact O-CA 3.4Å; Y117-V130 HydrophobicContact CD1-CG2 4.21Å; Y117-V130 PolarHBondContact N-O 3.4Å; Y117-V130 PolarHBondContact O-N 3.4Å
118	S	97.8	Very high	94.8	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.007	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	146.3	174.3	60.3	0	0	0	0	111.6	V99 I100 E101 R128	V99-S118 WeakPolarHBondContact CA-O 3.29Å; I100-S118 PolarHBondContact N-O 3.16Å; E101-S118 WeakPolarHBondContact CB-OG 3.34Å; E101-S118 PolarHBondContact N-OG 3.18Å; E101-S118 VanDerWaalsContact N-OG 3.09Å; E101-S118 PolarHBondContact O-N 3.01Å; E101-S118 PolarHBondContact O-OG 3.45Å; E101-S118 VanDerWaalsContact O-OG 3.1Å; S118-R128 CarbonylContact C-O 3.49Å; S118-R128 WeakPolarHBondContact CA-O 3.43Å; S118-R128 WeakPolarHBondContact CB-O 3.28Å
119	W	95.9	Very high	94.8	Very high	48 Å²	48	47.4 Å²	47.4	18%	0.182	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	155.1	-175.8	71.9	96.4	0	0	0	114.1	N98 Y117 C121 N127 R128 V130 A164	N98-W119 HydrophobicContact CB-CB 4.33Å; N98-W119 CarbonylContact O-C 3.6Å; N98-W119 WeakPolarHBondContact O-CA 3.2Å; N98-W119 WeakPolarHBondContact O-CB 3.34Å; Y117-W119 HydrophobicContact CD1-CD2 4.47Å; Y117-W119 AromaticContact CD1-CE3 3.53Å; Y117-W119 HydrophobicContact CD1-CE3 3.53Å; Y117-W119 AromaticContact CD1-CZ3 4Å; Y117-W119 HydrophobicContact CD1-CZ3 4Å; Y117-W119 HydrophobicContact CE1-CB 3.77Å; Y117-W119 AromaticContact CE1-CD2 3.93Å; Y117-W119 HydrophobicContact CE1-CD2 3.93Å; Y117-W119 AromaticContact CE1-CE3 3.42Å; Y117-W119 HydrophobicContact CE1-CE3 3.42Å; Y117-W119 VanDerWaalsContact CE1-CE3 3.42Å; Y117-W119 HydrophobicContact CE1-CG 4.13Å; Y117-W119 HydrophobicContact CE1-CZ3 4.2Å; W119-C121 PolarHBondContact NE1-SG 2.93Å; W119-N127 WeakPolarHBondContact O-CB 3Å; W119-R128 HydrophobicContact CD2-CB 3.87Å; W119-R128 VanDerWaalsContact CE2-CB 3.45Å; W119-R128 HydrophobicContact CE3-CB 3.99Å; W119-R128 HydrophobicContact CH2-CB 3.47Å; W119-R128 VanDerWaalsContact CH2-CB 3.47Å; W119-R128 HydrophobicContact CH2-CG 4.22Å; W119-R128 HydrophobicContact CZ2-CB 3.25Å; W119-R128 HydrophobicContact CZ2-CG 3.81Å; W119-R128 HydrophobicContact CZ3-CB 3.8Å; W119-R128 PolarHBondContact N-O 3.09Å; W119-R128 PolarHBondContact O-N 3.35Å; W119-R128 VanDerWaalsContact O-N 3.11Å; W119-V130 HydrophobicContact CH2-CG1 3.98Å; W119-V130 HydrophobicContact CZ3-CG1 3.85Å; W119-V130 HydrophobicContact CZ3-CG2 4.18Å; W119-A164 HydrophobicContact CH2-CB 3.58Å; W119-A164 HydrophobicContact CZ2-CB 4.26Å; W119-A164 HydrophobicContact CZ3-CB 4.47Å
120	R	94.8	Very high	94.8	Very high	152 Å²	152	45.8 Å²	45.8	57%	0.574	23%	0.229	S	C	*	.	P	Polyproline II helix	trans	-75	132	175.5	-62.1	-178	-175.8	166.4	1.1	110.7	N98 I100 N127	N98-R120 PolarHBondContact O-N 2.85Å; I100-R120 HydrophobicContact CD1-CG 3.73Å; I100-R120 HydrophobicContact CG1-CG 3.47Å; I100-R120 VanDerWaalsContact CG1-CG 3.47Å; R120-N127 VanDerWaalsContact CA-OD1 3.29Å; R120-N127 WeakPolarHBondContact CA-OD1 3.3Å
121	C	90.8	Very high	94.8	Very high	23 Å²	23	41.7 Å²	41.7	16%	0.155	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-103.4	151.8	167.2	-75.9	0	0	0	0	110.6	W119 K123 L125 K126 N127 R128	W119-C121 PolarHBondContact NE1-SG 2.93Å; C121-K123 PolarHBondContact O-N 3.25Å; C121-L125 HydrophobicContact CB-CB 3.84Å; C121-K126 WeakPolarHBondContact CB-O 3.36Å; C121-N127 PolarHBondContact N-OD1 3.27Å; C121-R128 VanDerWaalsContact SG-CD 3.52Å
122	P	86.6	Confident	94.8	Very high	98 Å²	98	40.5 Å²	40.5	64%	0.636	20%	0.198	S	C	*	.	P	Polyproline II helix	trans	-62.7	130.8	173.6	26.6	-32.3	0	0	0	109.1	L125	P122-L125 HydrophobicContact CG-CD1 4.37Å; P122-L125 VanDerWaalsContact O-CB 3.31Å; P122-L125 WeakPolarHBondContact O-CB 3.39Å; P122-L125 PolarHBondContact O-N 3.19Å
123	K	84.6	Confident	94.8	Very high	198 Å²	198	40.5 Å²	40.5	86%	0.861	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.4	140.9	170	-69.1	-173.1	178.9	-175.8	0	108.8	C121	C121-K123 PolarHBondContact O-N 3.25Å
124	P	87.6	Confident	94.8	Very high	72 Å²	72	41.8 Å²	41.8	47%	0.468	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	cis	-87.9	4.1	11.9	33.8	-39.2	0	0	0	116.7	V268	P124-V268 HydrophobicContact CB-CB 4.01Å; P124-V268 HydrophobicContact CB-CG1 3.33Å; P124-V268 HydrophobicContact CB-CG2 4.05Å; P124-V268 HydrophobicContact CG-CB 4.33Å; P124-V268 HydrophobicContact CG-CG1 3.22Å; P124-V268 WeakPolarHBondContact O-CG2 3.38Å
125	L	88.2	Confident	94.8	Very high	32 Å²	32	41.8 Å²	41.8	17%	0.168	20%	0.203	C	C	.	.	S	Bend	trans	-67	142.7	-177.7	-61.7	173.3	0	0	0	112.7	C121 P122 L195	C121-L125 HydrophobicContact CB-CB 3.84Å; P122-L125 HydrophobicContact CG-CD1 4.37Å; P122-L125 VanDerWaalsContact O-CB 3.31Å; P122-L125 WeakPolarHBondContact O-CB 3.39Å; P122-L125 PolarHBondContact O-N 3.19Å; L125-L195 HydrophobicContact CD1-CD1 3.82Å; L125-L195 HydrophobicContact CD1-CD2 4.2Å; L125-L195 HydrophobicContact CD1-CG 4.32Å; L125-L195 HydrophobicContact CD2-CD1 4.25Å; L125-L195 HydrophobicContact CD2-CD2 3.79Å; L125-L195 HydrophobicContact CD2-CG 3.88Å
126	K	91.1	Very high	94.8	Very high	74 Å²	74	42.4 Å²	42.4	32%	0.322	20%	0.203	S	C	.	.	P	Polyproline II helix	trans	-66	154.9	170.5	-70.3	-177.3	179.1	175.4	0	110.4	C121 R128 V162 I263 E265	C121-K126 WeakPolarHBondContact CB-O 3.36Å; K126-R128 WeakPolarHBondContact O-CD 3.26Å; K126-R128 PolarHBondContact O-NH1 3.31Å; K126-V162 HydrophobicContact CB-CG2 3.95Å; K126-V162 HydrophobicContact CD-CG2 4.39Å; K126-I263 HydrophobicContact CD-CG2 4.05Å; K126-I263 VanDerWaalsContact NZ-CG2 3.28Å; K126-E265 WeakPolarHBondContact CB-OE1 3Å; K126-E265 HydrophobicContact CD-CG 4.34Å; K126-E265 HydrophobicContact CG-CG 4.37Å; K126-E265 PolarHBondContact N-OE1 3.44Å
127	N	95.1	Very high	94.8	Very high	51 Å²	51	44 Å²	44	27%	0.273	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	159.9	173.2	-64.9	-27.5	0	0	0	110	I100 W119 R120 C121 L161 V162	I100-N127 HydrophobicContact CD1-CB 3.74Å; I100-N127 WeakPolarHBondContact CD1-ND2 3.22Å; W119-N127 WeakPolarHBondContact O-CB 3Å; R120-N127 VanDerWaalsContact CA-OD1 3.29Å; R120-N127 WeakPolarHBondContact CA-OD1 3.3Å; C121-N127 PolarHBondContact N-OD1 3.27Å; N127-L161 HydrophobicContact CB-CD2 3.37Å; N127-L161 CarbonylContact O-C 3.56Å; N127-L161 WeakPolarHBondContact O-CA 3.4Å; N127-V162 PolarHBondContact O-N 3.44Å
128	R	95.8	Very high	94.7	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	152.6	-178.8	-86	71.6	171.4	155.7	5.2	111.4	S118 W119 C121 K126 V162 A164 P191 K192 E265	S118-R128 CarbonylContact C-O 3.49Å; S118-R128 WeakPolarHBondContact CA-O 3.43Å; S118-R128 WeakPolarHBondContact CB-O 3.28Å; W119-R128 HydrophobicContact CD2-CB 3.87Å; W119-R128 VanDerWaalsContact CE2-CB 3.45Å; W119-R128 HydrophobicContact CE3-CB 3.99Å; W119-R128 HydrophobicContact CH2-CB 3.47Å; W119-R128 VanDerWaalsContact CH2-CB 3.47Å; W119-R128 HydrophobicContact CH2-CG 4.22Å; W119-R128 HydrophobicContact CZ2-CB 3.25Å; W119-R128 HydrophobicContact CZ2-CG 3.81Å; W119-R128 HydrophobicContact CZ3-CB 3.8Å; W119-R128 PolarHBondContact N-O 3.09Å; W119-R128 PolarHBondContact O-N 3.35Å; W119-R128 VanDerWaalsContact O-N 3.11Å; C121-R128 VanDerWaalsContact SG-CD 3.52Å; K126-R128 WeakPolarHBondContact O-CD 3.26Å; K126-R128 PolarHBondContact O-NH1 3.31Å; R128-V162 WeakPolarHBondContact CA-O 3.46Å; R128-V162 WeakPolarHBondContact CB-O 3.22Å; R128-V162 HydrophobicContact CG-CB 3.97Å; R128-V162 HydrophobicContact CG-CG1 4.32Å; R128-V162 WeakPolarHBondContact CG-O 3.3Å; R128-A164 HydrophobicContact CB-CB 4.38Å; R128-A164 HydrophobicContact CG-CB 4.19Å; R128-P191 PolarHBondContact NE-O 3.24Å; R128-K192 PolarHBondContact NH2-O 3.14Å; R128-E265 IonicContact CZ-OE1 3.85Å; R128-E265 IonicContact CZ-OE2 3.54Å; R128-E265 IonicContact NH1-OE1 3.2Å; R128-E265 PolarHBondContact NH1-OE1 3.06Å; R128-E265 IonicContact NH1-OE2 3.02Å; R128-E265 IonicContact NH2-OE1 3.26Å; R128-E265 PolarHBondContact NH2-OE1 3.05Å; R128-E265 IonicContact NH2-OE2 3.5Å; R128-E265 PolarHBondContact NH2-OE2 2.96Å
129	D	97.5	Very high	94.5	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	159.7	167	74.4	-20.9	0	0	0	112	Y116 Y117 L161 V162 R163 A164	Y116-D129 HydrophobicContact CE2-CB 3.6Å; Y116-D129 WeakPolarHBondContact CE2-OD2 3.49Å; Y117-D129 CarbonylContact O-C 3.6Å; Y117-D129 VanDerWaalsContact O-CA 3.32Å; Y117-D129 WeakPolarHBondContact O-CA 3.4Å; D129-L161 HydrophobicContact CB-CB 4.5Å; D129-L161 HydrophobicContact CB-CD1 3.94Å; D129-V162 PolarHBondContact N-O 3.48Å; D129-R163 VanDerWaalsContact CG-NE 3.3Å; D129-R163 VanDerWaalsContact OD1-CA 3.23Å; D129-R163 WeakPolarHBondContact OD1-CA 3.35Å; D129-R163 IonicContact OD1-CZ 2.89Å; D129-R163 IonicContact OD1-NE 3.28Å; D129-R163 PolarHBondContact OD1-NE 3.44Å; D129-R163 IonicContact OD1-NH2 3.31Å; D129-R163 IonicContact OD2-CZ 3.62Å; D129-R163 IonicContact OD2-NE 2.72Å; D129-R163 PolarHBondContact OD2-NE 3.15Å; D129-R163 IonicContact OD2-NH2 3.63Å; D129-R163 PolarHBondContact OD2-NH2 3.27Å; D129-A164 PolarHBondContact O-N 2.96Å
130	V	97.6	Very high	94.4	Very high	13 Å²	13	49.3 Å²	49.3	8%	0.079	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	148.9	171.6	-68.6	0	0	0	0	110.3	Y117 W119 T132 A164	Y117-V130 HydrophobicContact CD1-CG2 4.21Å; Y117-V130 PolarHBondContact N-O 3.4Å; Y117-V130 PolarHBondContact O-N 3.4Å; W119-V130 HydrophobicContact CH2-CG1 3.98Å; W119-V130 HydrophobicContact CZ3-CG1 3.85Å; W119-V130 HydrophobicContact CZ3-CG2 4.18Å; V130-T132 HydrophobicContact CB-CG2 4.27Å; V130-T132 HydrophobicContact CG2-CG2 4.24Å; V130-A164 HydrophobicContact CG1-CB 3.7Å
131	I	98.3	Very high	94.4	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	123.1	164.2	-61.9	-76.2	0	0	0	106.2	I105 V114 G115 Y116 S149 V150 H152 Y155	I105-I131 HydrophobicContact CD1-CD1 3.6Å; I105-I131 HydrophobicContact CD1-CG2 4.46Å; V114-I131 HydrophobicContact CG1-CG2 3.81Å; G115-I131 WeakPolarHBondContact O-CA 3.37Å; Y116-I131 HydrophobicContact CD2-CD1 3.53Å; Y116-I131 HydrophobicContact CD2-CG1 4.32Å; Y116-I131 HydrophobicContact CG-CD1 4.21Å; I131-S149 VanDerWaalsContact O-CA 3.24Å; I131-S149 WeakPolarHBondContact O-CA 3.28Å; I131-V150 WeakPolarHBondContact CB-O 3.44Å; I131-V150 HydrophobicContact CG2-CG2 3.89Å; I131-V150 WeakPolarHBondContact CG2-O 3.48Å; I131-V150 PolarHBondContact O-N 2.89Å; I131-H152 HydrophobicContact CG2-CB 4.1Å; I131-Y155 HydrophobicContact CD1-CD1 4.26Å; I131-Y155 HydrophobicContact CD1-CD2 4.45Å; I131-Y155 HydrophobicContact CD1-CG 3.85Å
132	T	98.3	Very high	94.7	Very high	18 Å²	18	44.7 Å²	44.7	11%	0.11	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	140.1	-176.4	54	0	0	0	0	111.8	V114 G115 V130 Y148	V114-T132 CarbonylContact C-O 3.52Å; V114-T132 VanDerWaalsContact CA-O 3.28Å; V114-T132 WeakPolarHBondContact CA-O 3.36Å; G115-T132 PolarHBondContact N-O 3.14Å; G115-T132 PolarHBondContact O-N 2.95Å; V130-T132 HydrophobicContact CB-CG2 4.27Å; V130-T132 HydrophobicContact CG2-CG2 4.24Å; T132-Y148 CarbonylContact C-O 3.47Å; T132-Y148 WeakPolarHBondContact CA-O 3.44Å; T132-Y148 WeakPolarHBondContact CB-O 3.42Å
133	L	98.5	Very high	95.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	124	158.1	-176.9	161.9	0	0	0	106.5	V22 P25 L108 D113 N147 Y148 V150 L249 L252	V22-L133 HydrophobicContact CG1-CD1 3.79Å; P25-L133 HydrophobicContact CG-CD2 4.34Å; L108-L133 HydrophobicContact CD1-CD1 3.35Å; L108-L133 HydrophobicContact CD1-CG 3.6Å; D113-L133 CarbonylContact O-C 3.55Å; D113-L133 WeakPolarHBondContact O-CA 3.25Å; L133-N147 WeakPolarHBondContact O-CA 3.3Å; L133-N147 VanDerWaalsContact O-CB 3.29Å; L133-N147 WeakPolarHBondContact O-CB 3.33Å; L133-Y148 HydrophobicContact CB-CE1 4.29Å; L133-Y148 HydrophobicContact CD1-CE1 4.4Å; L133-Y148 HydrophobicContact CD2-CE1 3.91Å; L133-Y148 HydrophobicContact CG-CE1 4.43Å; L133-Y148 PolarHBondContact N-O 2.83Å; L133-Y148 PolarHBondContact O-N 3.14Å; L133-V150 HydrophobicContact CB-CG1 3.7Å; L133-V150 HydrophobicContact CB-CG2 4.27Å; L133-L249 HydrophobicContact CD1-CD1 4.24Å; L133-L252 HydrophobicContact CD1-CD1 4.47Å
134	R	98.7	Very high	96	Very high	33 Å²	33	32 Å²	32	13%	0.125	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	141	175.7	171.5	-176.8	64.2	-170.3	0.9	109.1	D104 A112 D113 W136 I145 M146 N147	D104-R134 VanDerWaalsContact CG-NH2 3.27Å; D104-R134 IonicContact OD1-CZ 3.21Å; D104-R134 IonicContact OD1-NH2 3.69Å; D104-R134 PolarHBondContact OD1-NH2 2.88Å; D104-R134 IonicContact OD2-NH2 2.77Å; D104-R134 PolarHBondContact OD2-NH2 2.83Å; A112-R134 CarbonylContact C-O 3.6Å; A112-R134 WeakPolarHBondContact CA-O 3.17Å; D113-R134 PolarHBondContact N-O 2.91Å; D113-R134 PolarHBondContact O-N 3.14Å; D113-R134 WeakPolarHBondContact OD1-CB 3.35Å; D113-R134 IonicContact OD1-CZ 3.89Å; D113-R134 IonicContact OD1-NE 3.85Å; D113-R134 PolarHBondContact OD1-NE 3.31Å; D113-R134 IonicContact OD1-NH2 2.82Å; D113-R134 PolarHBondContact OD1-NH2 3.45Å; D113-R134 IonicContact OD2-CZ 2.69Å; D113-R134 IonicContact OD2-NE 2.66Å; D113-R134 IonicContact OD2-NH2 3.24Å; D113-R134 PolarHBondContact OD2-NH2 2.84Å; R134-W136 HydrophobicContact CG-CE3 4.21Å; R134-W136 HydrophobicContact CG-CZ3 4.42Å; R134-I145 HydrophobicContact CG-CG2 3.87Å; R134-M146 CarbonylContact C-O 3.52Å; R134-M146 VanDerWaalsContact CA-O 3.29Å; R134-M146 WeakPolarHBondContact CA-O 3.24Å; R134-N147 HydrophobicContact CB-CB 3.93Å; R134-N147 HydrophobicContact CG-CB 4.42Å
135	S	98.6	Very high	96.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	147	174.8	-170.8	0	0	0	0	110.1	F30 N111 M146	F30-S135 WeakPolarHBondContact CZ-OG 3.49Å; N111-S135 CarbonylContact O-C 3.56Å; N111-S135 VanDerWaalsContact O-CA 3.25Å; N111-S135 WeakPolarHBondContact O-CA 3.27Å; N111-S135 PolarHBondContact O-OG 3.21Å; S135-M146 PolarHBondContact N-O 3.08Å; S135-M146 PolarHBondContact O-N 2.87Å
136	W	98.8	Very high	97	Very high	20 Å²	20	27.7 Å²	27.7	8%	0.076	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	150.9	-178	57.1	92.8	0	0	0	112.7	H87 N111 D113 R134 I144 I145	H87-W136 AromaticContact CE1-CD2 3.37Å; H87-W136 AromaticContact CE1-CE2 3.87Å; H87-W136 AromaticContact CE1-CE3 3.56Å; H87-W136 AromaticContact CE1-CG 3.56Å; H87-W136 AromaticContact NE2-CG 3.69Å; N111-W136 VanDerWaalsContact CA-CE2 3.49Å; N111-W136 HydrophobicContact CB-CD2 4.37Å; N111-W136 HydrophobicContact CB-CG 4.41Å; N111-W136 WeakPolarHBondContact CB-O 3.44Å; N111-W136 PolarHBondContact ND2-O 3.08Å; N111-W136 VanDerWaalsContact O-CD2 3.28Å; N111-W136 VanDerWaalsContact O-CE3 3.25Å; N111-W136 PolarHBondContact O-N 2.78Å; D113-W136 HydrophobicContact CB-CH2 4.43Å; D113-W136 HydrophobicContact CB-CZ3 4.43Å; D113-W136 VanDerWaalsContact OD2-CH2 3.25Å; D113-W136 WeakPolarHBondContact OD2-CH2 3.41Å; D113-W136 VanDerWaalsContact OD2-CZ3 3.26Å; D113-W136 WeakPolarHBondContact OD2-CZ3 3.49Å; R134-W136 HydrophobicContact CG-CE3 4.21Å; R134-W136 HydrophobicContact CG-CZ3 4.42Å; W136-I144 CarbonylContact C-O 3.53Å; W136-I144 WeakPolarHBondContact CA-O 3.34Å; W136-I145 HydrophobicContact CB-CG1 4.11Å
137	L	97.9	Very high	97.3	Very high	42 Å²	42	25.4 Å²	25.4	22%	0.22	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	115.1	-179.5	-172.3	64.6	0	0	0	110.7	F30 M139 I144	F30-L137 HydrophobicContact CB-CD2 3.94Å; F30-L137 HydrophobicContact CD1-CB 3.73Å; F30-L137 HydrophobicContact CD1-CD2 4.23Å; F30-L137 HydrophobicContact CD2-CB 4.13Å; F30-L137 HydrophobicContact CD2-CD2 3.73Å; F30-L137 HydrophobicContact CE1-CB 3.57Å; F30-L137 HydrophobicContact CE2-CB 3.99Å; F30-L137 HydrophobicContact CE2-CD2 4.3Å; F30-L137 HydrophobicContact CG-CB 4.02Å; F30-L137 HydrophobicContact CG-CD2 3.71Å; F30-L137 HydrophobicContact CZ-CB 3.7Å; L137-M139 HydrophobicContact CD2-CG 4.12Å; L137-M139 HydrophobicContact CD2-SD 4.46Å; L137-M139 HydrophobicContact CG-CG 4.1Å; L137-I144 PolarHBondContact N-O 3.11Å; L137-I144 PolarHBondContact O-N 3.43Å
138	P	96.4	Very high	97.4	Very high	73 Å²	73	23.6 Å²	23.6	47%	0.474	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	132.9	162.3	-17.6	32.1	0	0	0	110.5	Y143	P138-Y143 HydrophobicContact CB-CD1 4.01Å; P138-Y143 HydrophobicContact CB-CE1 4.08Å; P138-Y143 HydrophobicContact CG-CD1 4.29Å; P138-Y143 HydrophobicContact CG-CE1 4.45Å
139	M	92.7	Very high	97.4	Very high	59 Å²	59	23.6 Å²	23.6	29%	0.291	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	72.7	-178.2	-63.5	-170.8	76.5	0	0	110.1	L137 A141 D142 I144	L137-M139 HydrophobicContact CD2-CG 4.12Å; L137-M139 HydrophobicContact CD2-SD 4.46Å; L137-M139 HydrophobicContact CG-CG 4.1Å; M139-A141 PolarHBondContact O-N 2.85Å; M139-D142 HydrophobicContact CB-CB 4.43Å; M139-D142 PolarHBondContact N-O 3.23Å; M139-D142 PolarHBondContact O-N 3.31Å; M139-I144 HydrophobicContact SD-CD1 3.59Å; M139-I144 VanDerWaalsContact SD-CD1 3.59Å; M139-I144 HydrophobicContact SD-CG1 4.31Å
140	G	94.1	Very high	97.4	Very high	76 Å²	76	23.6 Å²	23.6	78%	0.784	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.5	-114.3	-171.6	0	0	0	0	0	110.4
141	A	94.9	Very high	97.3	Very high	56 Å²	56	26.6 Å²	26.6	46%	0.463	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-6.7	176.7	0	0	0	0	0	113.6	M139 S175	M139-A141 PolarHBondContact O-N 2.85Å; A141-S175 WeakPolarHBondContact O-CB 3.3Å
142	D	97.7	Very high	97.2	Very high	22 Å²	22	27.2 Å²	27.2	12%	0.118	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	157.9	179.4	-61.6	-17	0	0	0	110.4	R34 M139 I173 Q174 S175	R34-D142 IonicContact CZ-OD2 3.04Å; R34-D142 VanDerWaalsContact CZ-OD2 3.31Å; R34-D142 IonicContact NH1-OD2 2.67Å; R34-D142 PolarHBondContact NH1-OD2 3.33Å; R34-D142 IonicContact NH2-OD2 3.93Å; R34-D142 PolarHBondContact NH2-OD2 2.55Å; M139-D142 HydrophobicContact CB-CB 4.43Å; M139-D142 PolarHBondContact N-O 3.23Å; M139-D142 PolarHBondContact O-N 3.31Å; D142-I173 CarbonylContact C-O 3.52Å; D142-I173 WeakPolarHBondContact CA-O 3.37Å; D142-I173 WeakPolarHBondContact CB-O 3.41Å; D142-Q174 VanDerWaalsContact OD1-CA 3.29Å; D142-Q174 WeakPolarHBondContact OD1-CA 3.21Å; D142-S175 PolarHBondContact OD1-N 3.48Å
143	Y	98.7	Very high	97.1	Very high	29 Å²	29	30.9 Å²	30.9	11%	0.114	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	141.4	176.2	-54.5	-91.8	0	0	0	110.5	A79 Y83 P138 I173	A79-Y143 HydrophobicContact CB-CD2 4.11Å; A79-Y143 HydrophobicContact CB-CE2 3.8Å; Y83-Y143 AromaticContact CD1-CD1 3.88Å; Y83-Y143 HydrophobicContact CD1-CD1 3.88Å; Y83-Y143 HydrophobicContact CD1-CE1 4.03Å; Y83-Y143 HydrophobicContact CD1-CG 4.47Å; Y83-Y143 AromaticContact CD2-CD1 3.77Å; Y83-Y143 HydrophobicContact CD2-CD1 3.77Å; Y83-Y143 AromaticContact CD2-CG 3.75Å; Y83-Y143 HydrophobicContact CD2-CG 3.75Å; Y83-Y143 HydrophobicContact CE1-CD1 4Å; Y83-Y143 HydrophobicContact CE1-CE1 4.26Å; Y83-Y143 AromaticContact CE2-CD1 3.92Å; Y83-Y143 HydrophobicContact CE2-CD1 3.92Å; Y83-Y143 HydrophobicContact CE2-CG 4.23Å; Y83-Y143 AromaticContact CG-CD1 3.77Å; Y83-Y143 HydrophobicContact CG-CD1 3.77Å; Y83-Y143 HydrophobicContact CG-CD2 4.47Å; Y83-Y143 HydrophobicContact CG-CE1 4.25Å; Y83-Y143 AromaticContact CG-CG 3.9Å; Y83-Y143 HydrophobicContact CG-CG 3.9Å; P138-Y143 HydrophobicContact CB-CD1 4.01Å; P138-Y143 HydrophobicContact CB-CE1 4.08Å; P138-Y143 HydrophobicContact CG-CD1 4.29Å; P138-Y143 HydrophobicContact CG-CE1 4.45Å; Y143-I173 HydrophobicContact CD2-CB 4.36Å; Y143-I173 HydrophobicContact CD2-CG2 4.41Å; Y143-I173 PolarHBondContact N-O 2.92Å; Y143-I173 PolarHBondContact O-N 3.41Å
144	I	98.8	Very high	97	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	134.5	169.2	-59.8	176.3	0	0	0	109.6	F30 F33 R34 W136 L137 M139 M146 Y171 L172	F30-I144 HydrophobicContact CD1-CB 3.85Å; F30-I144 HydrophobicContact CD1-CD1 4.37Å; F30-I144 HydrophobicContact CD1-CG2 3.61Å; F30-I144 HydrophobicContact CE1-CB 4.18Å; F30-I144 HydrophobicContact CE1-CG2 3.91Å; F33-I144 HydrophobicContact CD1-CG2 3.62Å; F33-I144 HydrophobicContact CE1-CG2 3.96Å; F33-I144 HydrophobicContact CG-CG2 4.49Å; R34-I144 HydrophobicContact CB-CD1 3.85Å; W136-I144 CarbonylContact C-O 3.53Å; W136-I144 WeakPolarHBondContact CA-O 3.34Å; L137-I144 PolarHBondContact N-O 3.11Å; L137-I144 PolarHBondContact O-N 3.43Å; M139-I144 HydrophobicContact SD-CD1 3.59Å; M139-I144 VanDerWaalsContact SD-CD1 3.59Å; M139-I144 HydrophobicContact SD-CG1 4.31Å; I144-M146 HydrophobicContact CG2-CE 4.09Å; I144-Y171 WeakPolarHBondContact CA-O 3.35Å; I144-L172 HydrophobicContact CD1-CD1 4.15Å; I144-L172 HydrophobicContact CG1-CD1 3.69Å
145	I	98.8	Very high	97	Very high	6 Å²	6	40.9 Å²	40.9	3%	0.031	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	122.2	166.9	-52.4	170.6	0	0	0	106.8	Y83 L86 H87 R134 W136 G170 Y171	Y83-I145 HydrophobicContact CD2-CD1 3.8Å; Y83-I145 HydrophobicContact CD2-CG1 4.11Å; Y83-I145 HydrophobicContact CE2-CD1 3.75Å; Y83-I145 HydrophobicContact CE2-CG1 3.69Å; L86-I145 HydrophobicContact CB-CD1 3.71Å; L86-I145 HydrophobicContact CD1-CD1 4.18Å; H87-I145 WeakPolarHBondContact NE2-CD1 3.42Å; R134-I145 HydrophobicContact CG-CG2 3.87Å; W136-I145 HydrophobicContact CB-CG1 4.11Å; I145-G170 CarbonylContact O-C 3.54Å; I145-G170 WeakPolarHBondContact O-CA 3.46Å; I145-Y171 HydrophobicContact CB-CD2 4.41Å; I145-Y171 PolarHBondContact N-O 3Å; I145-Y171 PolarHBondContact O-N 3.43Å
146	M	98	Very high	96.8	Very high	8 Å²	8	44.7 Å²	44.7	4%	0.039	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	152.4	177.3	57.5	172.8	53.3	0	0	111	P25 D29 F30 F33 R134 S135 I144 T169	P25-M146 HydrophobicContact CB-CG 4.45Å; P25-M146 HydrophobicContact CB-SD 3.59Å; P25-M146 VanDerWaalsContact CB-SD 3.59Å; P25-M146 HydrophobicContact CG-CG 4.27Å; P25-M146 HydrophobicContact CG-SD 3.83Å; D29-M146 HydrophobicContact CB-SD 4.46Å; F30-M146 HydrophobicContact CD1-CE 3.83Å; F30-M146 HydrophobicContact CD1-CG 4.47Å; F30-M146 HydrophobicContact CD1-SD 4.2Å; F30-M146 HydrophobicContact CE1-CE 4.21Å; F30-M146 HydrophobicContact CE1-CG 3.91Å; F30-M146 HydrophobicContact CE1-SD 4.11Å; F30-M146 HydrophobicContact CG-CE 4.35Å; F30-M146 HydrophobicContact CZ-CG 4.33Å; F30-M146 HydrophobicContact CZ-SD 4.44Å; F33-M146 HydrophobicContact CB-CE 3.16Å; F33-M146 HydrophobicContact CD1-CE 4.04Å; F33-M146 HydrophobicContact CD2-CE 3.94Å; F33-M146 HydrophobicContact CG-CE 3.45Å; F33-M146 VanDerWaalsContact CG-CE 3.45Å; R134-M146 CarbonylContact C-O 3.52Å; R134-M146 VanDerWaalsContact CA-O 3.29Å; R134-M146 WeakPolarHBondContact CA-O 3.24Å; S135-M146 PolarHBondContact N-O 3.08Å; S135-M146 PolarHBondContact O-N 2.87Å; I144-M146 HydrophobicContact CG2-CE 4.09Å; M146-T169 CarbonylContact C-O 3.47Å; M146-T169 WeakPolarHBondContact CA-O 3.41Å
147	N	97.8	Very high	96.5	Very high	25 Å²	25	47.4 Å²	47.4	13%	0.134	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	157.9	175.5	68.9	83.9	0	0	0	111.3	L133 R134 S166 T169	L133-N147 WeakPolarHBondContact O-CA 3.3Å; L133-N147 VanDerWaalsContact O-CB 3.29Å; L133-N147 WeakPolarHBondContact O-CB 3.33Å; R134-N147 HydrophobicContact CB-CB 3.93Å; R134-N147 HydrophobicContact CG-CB 4.42Å; N147-S166 PolarHBondContact OD1-OG 3.5Å; N147-T169 PolarHBondContact N-O 2.94Å; N147-T169 PolarHBondContact ND2-O 2.96Å; N147-T169 PolarHBondContact O-N 3.36Å; N147-T169 VanDerWaalsContact O-O 3.1Å
148	Y	96.6	Very high	96.2	Very high	13 Å²	13	50.2 Å²	50.2	5%	0.051	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	158.3	172.3	69.8	-92.1	0	0	0	109.6	V16 L17 V22 Q23 P25 T132 L133 V150	V16-Y148 HydrophobicContact CG1-CD1 3.4Å; V16-Y148 VanDerWaalsContact CG1-CD1 3.4Å; V16-Y148 HydrophobicContact CG1-CE1 3.37Å; V16-Y148 HydrophobicContact CG1-CG 4.05Å; L17-Y148 HydrophobicContact CD1-CD2 3.39Å; L17-Y148 HydrophobicContact CD1-CE2 4.32Å; L17-Y148 HydrophobicContact CD1-CG 3.79Å; V22-Y148 HydrophobicContact CG1-CE2 4.47Å; V22-Y148 WeakPolarHBondContact CG1-OH 3.43Å; Q23-Y148 PolarHBondContact N-OH 2.9Å; Q23-Y148 PolarHBondContact O-OH 2.67Å; P25-Y148 HydrophobicContact CG-CE1 4.37Å; T132-Y148 CarbonylContact C-O 3.47Å; T132-Y148 WeakPolarHBondContact CA-O 3.44Å; T132-Y148 WeakPolarHBondContact CB-O 3.42Å; L133-Y148 HydrophobicContact CB-CE1 4.29Å; L133-Y148 HydrophobicContact CD1-CE1 4.4Å; L133-Y148 HydrophobicContact CD2-CE1 3.91Å; L133-Y148 HydrophobicContact CG-CE1 4.43Å; L133-Y148 PolarHBondContact N-O 2.83Å; L133-Y148 PolarHBondContact O-N 3.14Å; Y148-V150 HydrophobicContact CD2-CG1 4.06Å; Y148-V150 HydrophobicContact CE2-CG1 3.55Å
149	S	97.1	Very high	95.7	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.007	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	139.6	-174.9	-69.8	0	0	0	0	113.3	I131 S166 Q255	I131-S149 VanDerWaalsContact O-CA 3.24Å; I131-S149 WeakPolarHBondContact O-CA 3.28Å; S149-S166 WeakPolarHBondContact CB-O 3.29Å; S149-S166 PolarHBondContact N-O 3.2Å; S149-S166 PolarHBondContact OG-N 3.05Å; S149-S166 PolarHBondContact OG-O 2.9Å; S149-Q255 WeakPolarHBondContact O-CB 3.1Å
150	V	96.5	Very high	95.6	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.006	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	159.8	174.9	-61.5	0	0	0	0	109.7	V22 V114 I131 L133 Y148 L252	V22-V150 HydrophobicContact CG1-CG1 3.69Å; V22-V150 HydrophobicContact CG2-CG1 4.29Å; V114-V150 HydrophobicContact CG1-CG2 4.06Å; I131-V150 WeakPolarHBondContact CB-O 3.44Å; I131-V150 HydrophobicContact CG2-CG2 3.89Å; I131-V150 WeakPolarHBondContact CG2-O 3.48Å; I131-V150 PolarHBondContact O-N 2.89Å; L133-V150 HydrophobicContact CB-CG1 3.7Å; L133-V150 HydrophobicContact CB-CG2 4.27Å; Y148-V150 HydrophobicContact CD2-CG1 4.06Å; Y148-V150 HydrophobicContact CE2-CG1 3.55Å; V150-L252 HydrophobicContact CG2-CD1 4.33Å; V150-L252 HydrophobicContact CG2-CD2 4.24Å
151	K	96.1	Very high	95.6	Very high	75 Å²	75	54.3 Å²	54.3	33%	0.326	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	126.1	168.9	-66.7	178.1	-179.1	175.6	0	108.8	L252 S253 Q255	K151-L252 WeakPolarHBondContact O-CA 3.39Å; K151-S253 PolarHBondContact N-O 2.82Å; K151-S253 PolarHBondContact O-N 3Å; K151-S253 VanDerWaalsContact O-N 3.1Å; K151-Q255 HydrophobicContact CG-CB 4.21Å; K151-Q255 VanDerWaalsContact CG-OE1 3.25Å
152	H	97.1	Very high	95.5	Very high	14 Å²	14	51.8 Å²	51.8	7%	0.065	25%	0.254	C	S	.	.			trans	-108.8	126.2	169.1	-173	-65.5	0	0	0	108.9	I131 K154 Y155 L252	I131-H152 HydrophobicContact CG2-CB 4.1Å; H152-K154 VanDerWaalsContact C-N 3.25Å; H152-K154 PolarHBondContact ND1-N 3.47Å; H152-K154 VanDerWaalsContact ND1-N 3.2Å; H152-K154 PolarHBondContact O-N 3.25Å; H152-K154 VanDerWaalsContact O-N 3.12Å; H152-Y155 HydrophobicContact CB-CD2 4.09Å; H152-Y155 AromaticContact CG-CD2 3.76Å; H152-Y155 AromaticContact ND1-CD2 3.43Å; H152-Y155 WeakPolarHBondContact ND1-CD2 3.43Å; H152-Y155 AromaticContact ND1-CE2 3.93Å; H152-Y155 CarbonylContact O-C 3.58Å; H152-Y155 PolarHBondContact O-N 2.74Å; H152-L252 HydrophobicContact CB-CD2 4.14Å
153	P	95.5	Very high	95.4	Very high	95 Å²	95	51.4 Å²	51.4	62%	0.617	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-35.7	-172.2	-28.1	34.2	0	0	0	114.6	Y155 E251	P153-Y155 VanDerWaalsContact C-N 3.32Å; P153-Y155 PolarHBondContact O-N 2.95Å; P153-E251 WeakPolarHBondContact CD-O 3.3Å; P153-E251 VanDerWaalsContact CG-O 3.29Å; P153-E251 WeakPolarHBondContact CG-O 3.47Å
154	K	97.3	Very high	95.2	Very high	169 Å²	169	50 Å²	50	74%	0.735	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-6.7	178.1	-55.9	-179.2	-174.5	168.6	0	115.1	H152 P156	H152-K154 VanDerWaalsContact C-N 3.25Å; H152-K154 PolarHBondContact ND1-N 3.47Å; H152-K154 VanDerWaalsContact ND1-N 3.2Å; H152-K154 PolarHBondContact O-N 3.25Å; H152-K154 VanDerWaalsContact O-N 3.12Å; K154-P156 WeakPolarHBondContact O-CD 3.39Å
155	Y	96.8	Very high	95	Very high	74 Å²	74	50 Å²	50	29%	0.29	25%	0.245	S	C	.	.	S	Bend	trans	-126.2	60.7	-178.6	-61.7	-91.3	0	0	0	111.8	F103 I105 I131 H152 P153 R163	F103-Y155 AromaticContact CE2-CE1 3.79Å; F103-Y155 HydrophobicContact CE2-CE1 3.79Å; F103-Y155 AromaticContact CZ-CE1 3.78Å; F103-Y155 HydrophobicContact CZ-CE1 3.78Å; I105-Y155 HydrophobicContact CB-CE2 4.32Å; I105-Y155 HydrophobicContact CD1-CD1 4.44Å; I105-Y155 HydrophobicContact CD1-CD2 3.72Å; I105-Y155 HydrophobicContact CD1-CE1 4.37Å; I105-Y155 HydrophobicContact CD1-CE2 3.65Å; I105-Y155 HydrophobicContact CD1-CG 4.15Å; I105-Y155 HydrophobicContact CG1-CD2 4.38Å; I105-Y155 HydrophobicContact CG1-CE1 4.45Å; I105-Y155 HydrophobicContact CG1-CE2 3.8Å; I105-Y155 HydrophobicContact CG2-CD2 4.37Å; I105-Y155 HydrophobicContact CG2-CE2 3.54Å; I131-Y155 HydrophobicContact CD1-CD1 4.26Å; I131-Y155 HydrophobicContact CD1-CD2 4.45Å; I131-Y155 HydrophobicContact CD1-CG 3.85Å; H152-Y155 HydrophobicContact CB-CD2 4.09Å; H152-Y155 AromaticContact CG-CD2 3.76Å; H152-Y155 AromaticContact ND1-CD2 3.43Å; H152-Y155 WeakPolarHBondContact ND1-CD2 3.43Å; H152-Y155 AromaticContact ND1-CE2 3.93Å; H152-Y155 CarbonylContact O-C 3.58Å; H152-Y155 PolarHBondContact O-N 2.74Å; P153-Y155 VanDerWaalsContact C-N 3.32Å; P153-Y155 PolarHBondContact O-N 2.95Å; Y155-R163 PolarHBondContact O-NH1 3.31Å; Y155-R163 PolarHBondContact O-NH2 3.01Å; Y155-R163 VanDerWaalsContact O-NH2 3.17Å
156	P	95.1	Very high	94.8	Very high	81 Å²	81	50 Å²	50	53%	0.526	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-63.3	163.6	175.8	30.8	-36.5	0	0	0	111.4	K154 R158 R163	K154-P156 WeakPolarHBondContact O-CD 3.39Å; P156-R158 PolarHBondContact O-N 2.93Å; P156-R163 PolarHBondContact O-NH2 2.84Å; P156-R163 VanDerWaalsContact O-NH2 3.16Å
157	P	93.4	Very high	94.6	Very high	76 Å²	76	51.1 Å²	51.1	49%	0.494	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-53.4	139.3	172.1	-25.8	35.4	0	0	0	112	R163	P157-R163 HydrophobicContact CB-CB 4.27Å; P157-R163 HydrophobicContact CG-CB 4.4Å
158	R	90.3	Very high	94.4	Very high	101 Å²	101	51.1 Å²	51.1	38%	0.381	25%	0.25	S	S	.	.	P	Polyproline II helix	trans	-97.7	150.4	178.9	-63.9	168.5	50	160.9	-1.6	110.3	E101 P156 D160 L161	E101-R158 IonicContact OE2-NH1 3.19Å; P156-R158 PolarHBondContact O-N 2.93Å; R158-D160 VanDerWaalsContact C-N 3.32Å; R158-D160 VanDerWaalsContact CB-OD1 3.27Å; R158-D160 WeakPolarHBondContact CB-OD1 3.29Å; R158-D160 IonicContact CZ-OD1 2.73Å; R158-D160 IonicContact CZ-OD2 2.8Å; R158-D160 IonicContact NE-OD1 3.53Å; R158-D160 PolarHBondContact NE-OD1 3.32Å; R158-D160 IonicContact NE-OD2 3.61Å; R158-D160 IonicContact NH2-OD1 3.65Å; R158-D160 IonicContact NH2-OD2 2.67Å; R158-D160 PolarHBondContact NH2-OD2 2.84Å; R158-D160 PolarHBondContact O-N 3.14Å; R158-L161 HydrophobicContact CB-CB 4.48Å
159	K	87.2	Confident	94.4	Very high	199 Å²	199	51 Å²	51	87%	0.865	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-27.1	-178.5	-66.3	-175.8	178.3	-178	0	113.4
160	D	90	Very high	94.4	Very high	89 Å²	89	50.9 Å²	50.9	48%	0.476	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-11.9	-177.2	60.7	-45.8	0	0	0	113.7	R158	R158-D160 VanDerWaalsContact C-N 3.32Å; R158-D160 VanDerWaalsContact CB-OD1 3.27Å; R158-D160 WeakPolarHBondContact CB-OD1 3.29Å; R158-D160 IonicContact CZ-OD1 2.73Å; R158-D160 IonicContact CZ-OD2 2.8Å; R158-D160 IonicContact NE-OD1 3.53Å; R158-D160 PolarHBondContact NE-OD1 3.32Å; R158-D160 IonicContact NE-OD2 3.61Å; R158-D160 IonicContact NH2-OD1 3.65Å; R158-D160 IonicContact NH2-OD2 2.67Å; R158-D160 PolarHBondContact NH2-OD2 2.84Å; R158-D160 PolarHBondContact O-N 3.14Å
161	L	93.6	Very high	94.5	Very high	7 Å²	7	52.3 Å²	52.3	4%	0.037	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	146.4	-176.9	-56.5	178.7	0	0	0	111	N127 D129 R158 I263	N127-L161 HydrophobicContact CB-CD2 3.37Å; N127-L161 CarbonylContact O-C 3.56Å; N127-L161 WeakPolarHBondContact O-CA 3.4Å; D129-L161 HydrophobicContact CB-CB 4.5Å; D129-L161 HydrophobicContact CB-CD1 3.94Å; R158-L161 HydrophobicContact CB-CB 4.48Å; L161-I263 WeakPolarHBondContact O-CD1 3.46Å
162	V	93.6	Very high	94.7	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.018	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	121.9	169.7	176.7	0	0	0	0	109.2	K126 N127 R128 D129 A164 P191 K192 I263 E265	K126-V162 HydrophobicContact CB-CG2 3.95Å; K126-V162 HydrophobicContact CD-CG2 4.39Å; N127-V162 PolarHBondContact O-N 3.44Å; R128-V162 WeakPolarHBondContact CA-O 3.46Å; R128-V162 WeakPolarHBondContact CB-O 3.22Å; R128-V162 HydrophobicContact CG-CB 3.97Å; R128-V162 HydrophobicContact CG-CG1 4.32Å; R128-V162 WeakPolarHBondContact CG-O 3.3Å; D129-V162 PolarHBondContact N-O 3.48Å; V162-A164 PolarHBondContact O-N 2.99Å; V162-A164 VanDerWaalsContact O-N 3.11Å; V162-P191 WeakPolarHBondContact CG1-O 3.31Å; V162-K192 HydrophobicContact CG1-CB 3.67Å; V162-I263 HydrophobicContact CG2-CB 4.25Å; V162-I263 HydrophobicContact CG2-CD1 4.4Å; V162-I263 HydrophobicContact CG2-CG2 4.46Å; V162-E265 HydrophobicContact CG2-CG 4.45Å
163	R	95.8	Very high	94.8	Very high	14 Å²	14	48.1 Å²	48.1	5%	0.053	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	104.2	172.4	-179.6	59.4	56.3	84.8	-0.9	109.8	D129 Y155 P156 P157 K192 L260	D129-R163 VanDerWaalsContact CG-NE 3.3Å; D129-R163 VanDerWaalsContact OD1-CA 3.23Å; D129-R163 WeakPolarHBondContact OD1-CA 3.35Å; D129-R163 IonicContact OD1-CZ 2.89Å; D129-R163 IonicContact OD1-NE 3.28Å; D129-R163 PolarHBondContact OD1-NE 3.44Å; D129-R163 IonicContact OD1-NH2 3.31Å; D129-R163 IonicContact OD2-CZ 3.62Å; D129-R163 IonicContact OD2-NE 2.72Å; D129-R163 PolarHBondContact OD2-NE 3.15Å; D129-R163 IonicContact OD2-NH2 3.63Å; D129-R163 PolarHBondContact OD2-NH2 3.27Å; Y155-R163 PolarHBondContact O-NH1 3.31Å; Y155-R163 PolarHBondContact O-NH2 3.01Å; Y155-R163 VanDerWaalsContact O-NH2 3.17Å; P156-R163 PolarHBondContact O-NH2 2.84Å; P156-R163 VanDerWaalsContact O-NH2 3.16Å; P157-R163 HydrophobicContact CB-CB 4.27Å; P157-R163 HydrophobicContact CG-CB 4.4Å; R163-K192 WeakPolarHBondContact O-CG 3.32Å; R163-L260 HydrophobicContact CB-CD1 4.21Å; R163-L260 HydrophobicContact CG-CD1 3.8Å
164	A	94.9	Very high	94.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.217	C	C	.	.			trans	-78.3	165.4	171.7	0	0	0	0	0	110.7	W119 R128 D129 V130 V162 D190	W119-A164 HydrophobicContact CH2-CB 3.58Å; W119-A164 HydrophobicContact CZ2-CB 4.26Å; W119-A164 HydrophobicContact CZ3-CB 4.47Å; R128-A164 HydrophobicContact CB-CB 4.38Å; R128-A164 HydrophobicContact CG-CB 4.19Å; D129-A164 PolarHBondContact O-N 2.96Å; V130-A164 HydrophobicContact CG1-CB 3.7Å; V162-A164 PolarHBondContact O-N 2.99Å; V162-A164 VanDerWaalsContact O-N 3.11Å; A164-D190 CarbonylContact C-O 3.55Å; A164-D190 WeakPolarHBondContact CA-O 3.4Å; A164-D190 WeakPolarHBondContact CB-O 3.48Å
165	V	93.9	Very high	95	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	109.5	179	-176.6	0	0	0	0	109	I167 V189 D190 Q255 A257 L260	V165-I167 HydrophobicContact CG1-CG1 4.39Å; V165-I167 PolarHBondContact O-N 2.78Å; V165-V189 CarbonylContact O-C 3.59Å; V165-V189 WeakPolarHBondContact O-CA 3.33Å; V165-D190 HydrophobicContact CB-CB 4.43Å; V165-D190 PolarHBondContact N-O 2.93Å; V165-D190 PolarHBondContact O-N 3.06Å; V165-Q255 HydrophobicContact CG1-CG 4.08Å; V165-Q255 HydrophobicContact CG2-CG 3.9Å; V165-A257 HydrophobicContact CG1-CB 4.32Å; V165-L260 HydrophobicContact CG2-CD1 3.38Å; V165-L260 HydrophobicContact CG2-CG 4.46Å
166	S	94.4	Very high	95	Very high	4 Å²	4	39.7 Å²	39.7	3%	0.028	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	108.8	161.9	172.6	0	0	0	0	108.5	N147 S149 T169	N147-S166 PolarHBondContact OD1-OG 3.5Å; S149-S166 WeakPolarHBondContact CB-O 3.29Å; S149-S166 PolarHBondContact N-O 3.2Å; S149-S166 PolarHBondContact OG-N 3.05Å; S149-S166 PolarHBondContact OG-O 2.9Å; S166-T169 WeakPolarHBondContact OG-CB 3.5Å; S166-T169 PolarHBondContact OG-OG1 3.1Å
167	I	92.6	Very high	95.1	Very high	33 Å²	33	37 Å²	37	17%	0.169	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	-43.5	175.4	-61.6	168.1	0	0	0	108.9	L17 L65 V165 Q188	L17-I167 HydrophobicContact CB-CG2 4.04Å; L17-I167 VanDerWaalsContact CD1-O 3.28Å; L17-I167 WeakPolarHBondContact CD1-O 3.21Å; L17-I167 HydrophobicContact CD2-CG2 4.29Å; L65-I167 HydrophobicContact CD2-CD1 3.91Å; V165-I167 HydrophobicContact CG1-CG1 4.39Å; V165-I167 PolarHBondContact O-N 2.78Å; I167-Q188 HydrophobicContact CB-CB 4.24Å; I167-Q188 HydrophobicContact CB-CG 4.42Å; I167-Q188 WeakPolarHBondContact CB-O 3.43Å; I167-Q188 HydrophobicContact CD1-CG 4.1Å; I167-Q188 PolarHBondContact N-O 3.33Å
168	Q	94.1	Very high	95.3	Very high	24 Å²	24	39.2 Å²	39.2	11%	0.112	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	125.2	171.8	-176.4	-171.2	30.7	0	0	107.1	F33 E36 A187 Q188	F33-Q168 HydrophobicContact CD2-CG 4.43Å; E36-Q168 PolarHBondContact OE2-NE2 2.87Å; E36-Q168 PolarHBondContact OE2-OE1 2.83Å; Q168-A187 CarbonylContact O-C 3.56Å; Q168-A187 VanDerWaalsContact O-CA 3.31Å; Q168-A187 WeakPolarHBondContact O-CA 3.16Å; Q168-Q188 PolarHBondContact N-O 2.81Å; Q168-Q188 PolarHBondContact O-N 2.8Å
169	T	96.8	Very high	95.6	Very high	10 Å²	10	41.8 Å²	41.8	6%	0.061	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	139.5	173.1	-61.9	0	0	0	0	109.2	M146 N147 S166 Y185 L186 A187 V189	M146-T169 CarbonylContact C-O 3.47Å; M146-T169 WeakPolarHBondContact CA-O 3.41Å; N147-T169 PolarHBondContact N-O 2.94Å; N147-T169 PolarHBondContact ND2-O 2.96Å; N147-T169 PolarHBondContact O-N 3.36Å; N147-T169 VanDerWaalsContact O-O 3.1Å; S166-T169 WeakPolarHBondContact OG-CB 3.5Å; S166-T169 PolarHBondContact OG-OG1 3.1Å; T169-Y185 HydrophobicContact CG2-CE2 3.58Å; T169-L186 CarbonylContact C-O 3.58Å; T169-L186 WeakPolarHBondContact CA-O 3.42Å; T169-A187 HydrophobicContact CG2-CB 4.09Å; T169-V189 WeakPolarHBondContact OG1-CG2 3.29Å
170	G	98.1	Very high	96.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.3	-176.9	174.5	0	0	0	0	0	114.4	F33 I145 Y185 L186	F33-G170 VanDerWaalsContact CZ-CA 3.45Å; I145-G170 CarbonylContact O-C 3.54Å; I145-G170 WeakPolarHBondContact O-CA 3.46Å; G170-Y185 WeakPolarHBondContact O-CA 3.19Å; G170-Y185 WeakPolarHBondContact O-CD2 3.4Å; G170-L186 PolarHBondContact N-O 3.09Å; G170-L186 PolarHBondContact O-N 2.83Å
171	Y	98.8	Very high	96.6	Very high	30 Å²	30	29.3 Å²	29.3	12%	0.118	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	128.5	-177.2	-54.5	-83.7	0	0	0	108.7	L86 I144 I145 I183 T184 Y185 M215	L86-Y171 HydrophobicContact CD1-CD1 4.1Å; L86-Y171 HydrophobicContact CD1-CD2 4.06Å; L86-Y171 HydrophobicContact CD1-CG 3.75Å; L86-Y171 HydrophobicContact CD2-CD1 4.18Å; L86-Y171 HydrophobicContact CD2-CD2 4.12Å; L86-Y171 HydrophobicContact CD2-CE1 3.92Å; L86-Y171 HydrophobicContact CD2-CE2 3.89Å; L86-Y171 HydrophobicContact CD2-CG 4.26Å; I144-Y171 WeakPolarHBondContact CA-O 3.35Å; I145-Y171 HydrophobicContact CB-CD2 4.41Å; I145-Y171 PolarHBondContact N-O 3Å; I145-Y171 PolarHBondContact O-N 3.43Å; Y171-I183 HydrophobicContact CD1-CD1 3.64Å; Y171-I183 HydrophobicContact CD1-CG1 4.35Å; Y171-I183 HydrophobicContact CE1-CD1 4.39Å; Y171-I183 HydrophobicContact CG-CD1 4.38Å; Y171-T184 WeakPolarHBondContact CA-O 3.49Å; Y171-Y185 AromaticContact CD1-CD2 3.77Å; Y171-Y185 HydrophobicContact CD1-CD2 3.77Å; Y171-Y185 HydrophobicContact CD1-CG 4.43Å; Y171-Y185 AromaticContact CE1-CD2 3.24Å; Y171-Y185 HydrophobicContact CE1-CD2 3.24Å; Y171-Y185 AromaticContact CE1-CE2 3.93Å; Y171-Y185 HydrophobicContact CE1-CE2 3.93Å; Y171-Y185 HydrophobicContact CE1-CG 4.06Å; Y171-Y185 AromaticContact CZ-CD2 3.71Å; Y171-Y185 AromaticContact CZ-CE2 3.93Å; Y171-M215 HydrophobicContact CE1-CE 3.87Å
172	L	98.9	Very high	96.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	121.2	161.4	170.9	65.4	0	0	0	107.4	F33 R34 C37 E38 I144 Q174 I183 T184	F33-L172 HydrophobicContact CE1-CB 4.39Å; R34-L172 HydrophobicContact CG-CD1 4.27Å; R34-L172 HydrophobicContact CG-CD2 4.09Å; C37-L172 HydrophobicContact CB-CB 4.11Å; C37-L172 HydrophobicContact CB-CD2 3.65Å; E38-L172 HydrophobicContact CG-CD2 4.14Å; I144-L172 HydrophobicContact CD1-CD1 4.15Å; I144-L172 HydrophobicContact CG1-CD1 3.69Å; L172-Q174 HydrophobicContact CD1-CG 4.13Å; L172-Q174 HydrophobicContact CD2-CG 4.1Å; L172-Q174 HydrophobicContact CG-CG 3.86Å; L172-I183 CarbonylContact O-C 3.57Å; L172-I183 WeakPolarHBondContact O-CA 3.42Å; L172-T184 PolarHBondContact N-O 2.87Å; L172-T184 PolarHBondContact O-N 3.4Å
173	I	98.9	Very high	97.1	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	122.8	174.8	-50.9	174.1	0	0	0	107.5	A79 L82 Y83 L86 D142 Y143 C181 V182 I183	A79-I173 HydrophobicContact CB-CG2 3.76Å; L82-I173 HydrophobicContact CB-CD1 4.39Å; L82-I173 HydrophobicContact CD2-CB 4.37Å; L82-I173 HydrophobicContact CD2-CD1 3.91Å; L82-I173 HydrophobicContact CD2-CG1 3.84Å; L82-I173 HydrophobicContact CD2-CG2 3.75Å; L82-I173 HydrophobicContact CG-CD1 4.03Å; L82-I173 HydrophobicContact CG-CG1 4.48Å; Y83-I173 HydrophobicContact CD2-CD1 4.18Å; L86-I173 HydrophobicContact CD1-CD1 3.92Å; L86-I173 HydrophobicContact CD1-CG1 4.49Å; D142-I173 CarbonylContact C-O 3.52Å; D142-I173 WeakPolarHBondContact CA-O 3.37Å; D142-I173 WeakPolarHBondContact CB-O 3.41Å; Y143-I173 HydrophobicContact CD2-CB 4.36Å; Y143-I173 HydrophobicContact CD2-CG2 4.41Å; Y143-I173 PolarHBondContact N-O 2.92Å; Y143-I173 PolarHBondContact O-N 3.41Å; I173-C181 HydrophobicContact CG2-CB 4.18Å; I173-V182 CarbonylContact C-O 3.5Å; I173-V182 WeakPolarHBondContact CA-O 3.41Å; I173-I183 HydrophobicContact CG1-CG1 4.44Å
174	Q	98.7	Very high	97.2	Very high	40 Å²	40	28.7 Å²	28.7	19%	0.187	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	120.8	179.6	-58.5	178.7	-78	0	0	109	E38 D142 L172 C181 V182	E38-Q174 PolarHBondContact OE1-NE2 2.77Å; D142-Q174 VanDerWaalsContact OD1-CA 3.29Å; D142-Q174 WeakPolarHBondContact OD1-CA 3.21Å; L172-Q174 HydrophobicContact CD1-CG 4.13Å; L172-Q174 HydrophobicContact CD2-CG 4.1Å; L172-Q174 HydrophobicContact CG-CG 3.86Å; Q174-C181 CarbonylContact O-C 3.58Å; Q174-C181 WeakPolarHBondContact O-CA 3.29Å; Q174-C181 VanDerWaalsContact O-CB 3.28Å; Q174-C181 WeakPolarHBondContact O-CB 3.16Å; Q174-V182 PolarHBondContact N-O 3.05Å; Q174-V182 PolarHBondContact O-N 3.1Å
175	S	98.4	Very high	97.4	Very high	38 Å²	38	31.2 Å²	31.2	27%	0.266	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	135	175.5	-176.4	0	0	0	0	109.9	A141 D142 G177	A141-S175 WeakPolarHBondContact O-CB 3.3Å; D142-S175 PolarHBondContact OD1-N 3.48Å; S175-G177 PolarHBondContact OG-O 3.42Å
176	T	98.3	Very high	97.6	Very high	83 Å²	83	31.2 Å²	31.2	51%	0.509	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	10	174.2	59.7	0	0	0	0	112	S180 C181 V182	T176-S180 PolarHBondContact N-O 2.99Å; T176-S180 PolarHBondContact O-OG 3.31Å; T176-S180 VanDerWaalsContact OG1-CB 3.26Å; T176-S180 WeakPolarHBondContact OG1-CB 3.44Å; T176-S180 PolarHBondContact OG1-O 3.13Å; T176-S180 PolarHBondContact OG1-OG 2.93Å; T176-C181 PolarHBondContact OG1-N 3Å; T176-V182 HydrophobicContact CG2-CG2 3.83Å
177	G	96.6	Very high	97.6	Very high	24 Å²	24	31.4 Å²	31.4	25%	0.247	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.5	177.8	-176.8	0	0	0	0	0	111.8	S175 K179 S180	S175-G177 PolarHBondContact OG-O 3.42Å; G177-K179 PolarHBondContact O-N 2.89Å; G177-S180 PolarHBondContact N-O 3.27Å; G177-S180 PolarHBondContact O-N 3.42Å; G177-S180 VanDerWaalsContact O-O 3.12Å
178	P	97.1	Very high	97.6	Very high	123 Å²	123	31.5 Å²	31.5	80%	0.799	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-10.6	-173.7	27.4	-36.2	0	0	0	114.7
179	K	97.8	Very high	97.5	Very high	155 Å²	155	32.3 Å²	32.3	67%	0.674	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-136.5	13	-178.1	-63.7	-173.9	179.6	-179.5	0	112.8	R75 D76 V77 G177	R75-K179 CarbonylContact C-O 3.47Å; D76-K179 CarbonylContact C-O 3.37Å; D76-K179 VanDerWaalsContact CA-O 3.22Å; D76-K179 WeakPolarHBondContact CA-O 3.44Å; D76-K179 PolarHBondContact N-O 2.78Å; V77-K179 CarbonylContact C-O 3.55Å; V77-K179 PolarHBondContact N-O 3.02Å; V77-K179 CarbonylContact O-C 3.52Å; G177-K179 PolarHBondContact O-N 2.89Å
180	S	98.5	Very high	97.2	Very high	25 Å²	25	32.3 Å²	32.3	18%	0.175	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	147.9	-174.1	60.7	0	0	0	0	111.7	C74 V77 T176 G177	C74-S180 CarbonylContact O-C 3.55Å; C74-S180 VanDerWaalsContact O-CA 3.26Å; C74-S180 WeakPolarHBondContact O-CA 3.5Å; C74-S180 WeakPolarHBondContact O-CB 3.43Å; V77-S180 CarbonylContact O-C 3.4Å; V77-S180 VanDerWaalsContact O-CA 3.23Å; V77-S180 WeakPolarHBondContact O-CA 3.36Å; V77-S180 PolarHBondContact O-N 2.95Å; T176-S180 PolarHBondContact N-O 2.99Å; T176-S180 PolarHBondContact O-OG 3.31Å; T176-S180 VanDerWaalsContact OG1-CB 3.26Å; T176-S180 WeakPolarHBondContact OG1-CB 3.44Å; T176-S180 PolarHBondContact OG1-O 3.13Å; T176-S180 PolarHBondContact OG1-OG 2.93Å; G177-S180 PolarHBondContact N-O 3.27Å; G177-S180 PolarHBondContact O-N 3.42Å; G177-S180 VanDerWaalsContact O-O 3.12Å
181	C	98.8	Very high	96.7	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.007	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	170	175	69.6	0	0	0	0	111.3	C74 V77 A79 I173 Q174 T176	C74-C181 CarbonylContact C-O 3.16Å; C74-C181 WeakPolarHBondContact CA-O 3.45Å; C74-C181 WeakPolarHBondContact CB-O 3.24Å; C74-C181 PolarHBondContact N-O 2.69Å; C74-C181 PolarHBondContact O-N 3.28Å; C74-C181 VanDerWaalsContact O-O 3.08Å; V77-C181 PolarHBondContact O-N 3.16Å; A79-C181 HydrophobicContact CB-CB 3.92Å; I173-C181 HydrophobicContact CG2-CB 4.18Å; Q174-C181 CarbonylContact O-C 3.58Å; Q174-C181 WeakPolarHBondContact O-CA 3.29Å; Q174-C181 VanDerWaalsContact O-CB 3.28Å; Q174-C181 WeakPolarHBondContact O-CB 3.16Å; T176-C181 PolarHBondContact OG1-N 3Å
182	V	98.8	Very high	96.2	Very high	9 Å²	9	32.9 Å²	32.9	6%	0.055	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	135.9	167.4	169.2	0	0	0	0	107.5	R71 E73 I173 Q174 T176	R71-V182 HydrophobicContact CG-CG1 3.74Å; R71-V182 VanDerWaalsContact CZ-CG1 3.41Å; E73-V182 HydrophobicContact CG-CG2 4.27Å; I173-V182 CarbonylContact C-O 3.5Å; I173-V182 WeakPolarHBondContact CA-O 3.41Å; Q174-V182 PolarHBondContact N-O 3.05Å; Q174-V182 PolarHBondContact O-N 3.1Å; T176-V182 HydrophobicContact CG2-CG2 3.83Å
183	I	98.8	Very high	95.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	133.7	171.5	-175.3	-179.9	0	0	0	110.4	R71 M72 L82 L86 Y171 L172 I173 M212 M215	R71-I183 CarbonylContact C-O 3.5Å; R71-I183 VanDerWaalsContact CA-O 3.28Å; R71-I183 WeakPolarHBondContact CA-O 3.42Å; M72-I183 HydrophobicContact CB-CG2 3.97Å; M72-I183 HydrophobicContact CE-CG2 3.84Å; M72-I183 PolarHBondContact N-O 3.44Å; M72-I183 PolarHBondContact O-N 3.1Å; L82-I183 HydrophobicContact CD1-CD1 4.3Å; L82-I183 HydrophobicContact CD2-CB 3.6Å; L82-I183 HydrophobicContact CD2-CD1 3.82Å; L82-I183 HydrophobicContact CD2-CG1 4.02Å; L82-I183 HydrophobicContact CD2-CG2 4.13Å; L82-I183 HydrophobicContact CG-CD1 4.35Å; L86-I183 HydrophobicContact CD1-CD1 4.11Å; Y171-I183 HydrophobicContact CD1-CD1 3.64Å; Y171-I183 HydrophobicContact CD1-CG1 4.35Å; Y171-I183 HydrophobicContact CE1-CD1 4.39Å; Y171-I183 HydrophobicContact CG-CD1 4.38Å; L172-I183 CarbonylContact O-C 3.57Å; L172-I183 WeakPolarHBondContact O-CA 3.42Å; I173-I183 HydrophobicContact CG1-CG1 4.44Å; I183-M212 HydrophobicContact CB-CE 4.25Å; I183-M212 HydrophobicContact CD1-CE 3.96Å; I183-M212 HydrophobicContact CG1-CE 4.01Å; I183-M212 HydrophobicContact CG2-CE 3.44Å; I183-M212 VanDerWaalsContact CG2-CE 3.44Å; I183-M215 HydrophobicContact CD1-CE 4.3Å; I183-M215 HydrophobicContact CD1-SD 3.74Å
184	T	98.8	Very high	94.6	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.018	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	112.6	168	-56.6	0	0	0	0	108.9	C37 K69 Y171 L172	C37-T184 HydrophobicContact CB-CG2 3.79Å; K69-T184 HydrophobicContact CD-CG2 3.69Å; K69-T184 HydrophobicContact CG-CG2 3.64Å; Y171-T184 WeakPolarHBondContact CA-O 3.49Å; L172-T184 PolarHBondContact N-O 2.87Å; L172-T184 PolarHBondContact O-N 3.4Å
185	Y	98.4	Very high	93.7	Very high	52 Å²	52	36.6 Å²	36.6	20%	0.204	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	124.5	169.6	169.5	-109.9	0	0	0	109.2	K69 C70 T169 G170 Y171 A187 M212	K69-Y185 CarbonylContact C-O 3.59Å; K69-Y185 VanDerWaalsContact CA-O 3.3Å; K69-Y185 WeakPolarHBondContact CA-O 3.21Å; C70-Y185 HydrophobicContact CB-CD1 4.25Å; C70-Y185 PolarHBondContact N-O 3.47Å; C70-Y185 PolarHBondContact O-N 3.12Å; T169-Y185 HydrophobicContact CG2-CE2 3.58Å; G170-Y185 WeakPolarHBondContact O-CA 3.19Å; G170-Y185 WeakPolarHBondContact O-CD2 3.4Å; Y171-Y185 AromaticContact CD1-CD2 3.77Å; Y171-Y185 HydrophobicContact CD1-CD2 3.77Å; Y171-Y185 HydrophobicContact CD1-CG 4.43Å; Y171-Y185 AromaticContact CE1-CD2 3.24Å; Y171-Y185 HydrophobicContact CE1-CD2 3.24Å; Y171-Y185 AromaticContact CE1-CE2 3.93Å; Y171-Y185 HydrophobicContact CE1-CE2 3.93Å; Y171-Y185 HydrophobicContact CE1-CG 4.06Å; Y171-Y185 AromaticContact CZ-CD2 3.71Å; Y171-Y185 AromaticContact CZ-CE2 3.93Å; Y185-A187 HydrophobicContact CD1-CB 4.47Å; Y185-A187 HydrophobicContact CE1-CB 3.6Å; Y185-A187 HydrophobicContact CE2-CB 3.96Å; Y185-A187 WeakPolarHBondContact OH-CB 3.45Å; Y185-M212 HydrophobicContact CG-SD 4.4Å
186	L	97.8	Very high	92.9	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	128.9	176	172.9	64.3	0	0	0	108.6	F33 E36 W43 K67 I68 K69 T169 G170	F33-L186 HydrophobicContact CD2-CD2 4.04Å; F33-L186 HydrophobicContact CE2-CB 3.98Å; F33-L186 HydrophobicContact CE2-CD2 3.74Å; F33-L186 HydrophobicContact CE2-CG 4.16Å; F33-L186 HydrophobicContact CZ-CB 3.93Å; F33-L186 HydrophobicContact CZ-CD2 4.3Å; E36-L186 HydrophobicContact CB-CD2 3.99Å; E36-L186 HydrophobicContact CG-CD2 3.66Å; W43-L186 HydrophobicContact CH2-CD1 3.43Å; W43-L186 VanDerWaalsContact CH2-CD1 3.43Å; W43-L186 HydrophobicContact CZ2-CD1 3.85Å; W43-L186 HydrophobicContact CZ3-CD1 4.44Å; K67-L186 HydrophobicContact CB-CD1 4.49Å; I68-L186 WeakPolarHBondContact O-CA 3.28Å; K69-L186 HydrophobicContact CB-CD1 4.33Å; T169-L186 CarbonylContact C-O 3.58Å; T169-L186 WeakPolarHBondContact CA-O 3.42Å; G170-L186 PolarHBondContact N-O 3.09Å; G170-L186 PolarHBondContact O-N 2.83Å
187	A	95.4	Very high	92.1	Very high	8 Å²	8	36.8 Å²	36.8	7%	0.066	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	142.9	-177.7	0	0	0	0	0	114.5	K67 I68 Q168 T169 Y185 V189	K67-A187 WeakPolarHBondContact CA-O 3.48Å; I68-A187 PolarHBondContact N-O 3.04Å; I68-A187 PolarHBondContact O-N 2.91Å; Q168-A187 CarbonylContact O-C 3.56Å; Q168-A187 VanDerWaalsContact O-CA 3.31Å; Q168-A187 WeakPolarHBondContact O-CA 3.16Å; T169-A187 HydrophobicContact CG2-CB 4.09Å; Y185-A187 HydrophobicContact CD1-CB 4.47Å; Y185-A187 HydrophobicContact CE1-CB 3.6Å; Y185-A187 HydrophobicContact CE2-CB 3.96Å; Y185-A187 WeakPolarHBondContact OH-CB 3.45Å; A187-V189 HydrophobicContact CB-CG2 4.4Å
188	Q	93.1	Very high	91.2	Very high	35 Å²	35	42.1 Å²	42.1	16%	0.164	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	105.8	165.5	-159.6	-177.5	12.5	0	0	107.5	L65 K67 I167 Q168	L65-Q188 HydrophobicContact CD2-CG 3.98Å; L65-Q188 HydrophobicContact CG-CG 4.34Å; L65-Q188 PolarHBondContact O-NE2 2.93Å; K67-Q188 HydrophobicContact CG-CB 3.92Å; K67-Q188 HydrophobicContact CG-CG 3.91Å; I167-Q188 HydrophobicContact CB-CB 4.24Å; I167-Q188 HydrophobicContact CB-CG 4.42Å; I167-Q188 WeakPolarHBondContact CB-O 3.43Å; I167-Q188 HydrophobicContact CD1-CG 4.1Å; I167-Q188 PolarHBondContact N-O 3.33Å; Q168-Q188 PolarHBondContact N-O 2.81Å; Q168-Q188 PolarHBondContact O-N 2.8Å
189	V	91	Very high	90.5	Very high	42 Å²	42	37.9 Å²	37.9	26%	0.255	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	122.7	-173.9	-178.3	0	0	0	0	109.5	L65 V165 T169 A187 P191	L65-V189 WeakPolarHBondContact CD1-O 3.34Å; L65-V189 VanDerWaalsContact CD2-O 3.27Å; L65-V189 WeakPolarHBondContact CD2-O 3.18Å; V165-V189 CarbonylContact O-C 3.59Å; V165-V189 WeakPolarHBondContact O-CA 3.33Å; T169-V189 WeakPolarHBondContact OG1-CG2 3.29Å; A187-V189 HydrophobicContact CB-CG2 4.4Å; V189-P191 VanDerWaalsContact O-CD 3.25Å; V189-P191 WeakPolarHBondContact O-CD 3.33Å
190	D	90.3	Very high	89.8	Confident	9 Å²	9	30.9 Å²	30.9	5%	0.048	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	106	169.9	-167.9	-14.5	0	0	0	108.9	L65 A164 V165 K192 K197	L65-D190 HydrophobicContact CD2-CB 3.9Å; A164-D190 CarbonylContact C-O 3.55Å; A164-D190 WeakPolarHBondContact CA-O 3.4Å; A164-D190 WeakPolarHBondContact CB-O 3.48Å; V165-D190 HydrophobicContact CB-CB 4.43Å; V165-D190 PolarHBondContact N-O 2.93Å; V165-D190 PolarHBondContact O-N 3.06Å; D190-K192 HydrophobicContact CB-CD 4.47Å; D190-K192 PolarHBondContact O-N 3.29Å; D190-K192 PolarHBondContact OD1-N 2.66Å; D190-K192 VanDerWaalsContact OD2-CE 3.24Å; D190-K192 WeakPolarHBondContact OD2-CE 3.44Å; D190-K192 IonicContact OD2-NZ 3.65Å; D190-K192 PolarHBondContact OD2-NZ 2.6Å; D190-K197 IonicContact OD1-NZ 2.85Å; D190-K197 PolarHBondContact OD1-NZ 3.17Å; D190-K197 IonicContact OD2-NZ 2.81Å; D190-K197 PolarHBondContact OD2-NZ 3.4Å
191	P	88.3	Confident	89.1	Confident	19 Å²	19	29.9 Å²	29.9	12%	0.123	16%	0.158	C	C	.	.			trans	-71.7	-5.5	178.9	32.3	-37	0	0	0	113.1	R128 V162 V189 V200	R128-P191 PolarHBondContact NE-O 3.24Å; V162-P191 WeakPolarHBondContact CG1-O 3.31Å; V189-P191 VanDerWaalsContact O-CD 3.25Å; V189-P191 WeakPolarHBondContact O-CD 3.33Å; P191-V200 HydrophobicContact CG-CB 4.26Å; P191-V200 HydrophobicContact CG-CG1 3.69Å; P191-V200 HydrophobicContact CG-CG2 3.49Å; P191-V200 VanDerWaalsContact CG-CG2 3.49Å
192	K	88.6	Confident	88.4	Confident	23 Å²	23	36.6 Å²	36.6	10%	0.1	19%	0.187	C	C	.	.			trans	52.4	-167.7	-176.1	-63.7	-60.9	-176.7	-167.5	0	112.8	R128 V162 R163 D190 A257	R128-K192 PolarHBondContact NH2-O 3.14Å; V162-K192 HydrophobicContact CG1-CB 3.67Å; R163-K192 WeakPolarHBondContact O-CG 3.32Å; D190-K192 HydrophobicContact CB-CD 4.47Å; D190-K192 PolarHBondContact O-N 3.29Å; D190-K192 PolarHBondContact OD1-N 2.66Å; D190-K192 VanDerWaalsContact OD2-CE 3.24Å; D190-K192 WeakPolarHBondContact OD2-CE 3.44Å; D190-K192 IonicContact OD2-NZ 3.65Å; D190-K192 PolarHBondContact OD2-NZ 2.6Å; K192-A257 WeakPolarHBondContact CE-O 3.37Å; K192-A257 VanDerWaalsContact NZ-C 3.3Å; K192-A257 PolarHBondContact NZ-O 3.49Å
193	G	83.9	Confident	87.6	Confident	18 Å²	18	38.8 Å²	38.8	19%	0.186	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.8	-153.4	-176.4	0	0	0	0	0	112.5	E265	G193-E265 VanDerWaalsContact CA-OE2 3.3Å; G193-E265 WeakPolarHBondContact CA-OE2 3.37Å
194	S	79.6	Confident	86.8	Confident	55 Å²	55	41.1 Å²	41.1	39%	0.385	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-3.1	-168.7	63.5	0	0	0	0	115	P196 E265	S194-P196 WeakPolarHBondContact O-CD 3.32Å; S194-E265 PolarHBondContact N-OE2 2.82Å; S194-E265 VanDerWaalsContact N-OE2 3.15Å; S194-E265 WeakPolarHBondContact OG-CB 3.34Å; S194-E265 PolarHBondContact OG-O 3.06Å; S194-E265 VanDerWaalsContact OG-O 3.1Å
195	L	79.3	Confident	86.1	Confident	46 Å²	46	43.5 Å²	43.5	24%	0.241	23%	0.23	C	C	.	.			trans	-69.1	124	-176.2	-72.3	179	0	0	0	112	L125 V199 V200	L125-L195 HydrophobicContact CD1-CD1 3.82Å; L125-L195 HydrophobicContact CD1-CD2 4.2Å; L125-L195 HydrophobicContact CD1-CG 4.32Å; L125-L195 HydrophobicContact CD2-CD1 4.25Å; L125-L195 HydrophobicContact CD2-CD2 3.79Å; L125-L195 HydrophobicContact CD2-CG 3.88Å; L195-V199 HydrophobicContact CD2-CG1 4.26Å; L195-V200 HydrophobicContact CB-CG2 3.87Å; L195-V200 HydrophobicContact CD1-CG2 4.32Å
196	P	82.1	Confident	85.5	Confident	63 Å²	63	47.5 Å²	47.5	41%	0.409	25%	0.249	S	C	.	.			trans	-59.2	143.4	170.1	-22.5	33.3	0	0	0	111.4	S194 W198 V199 V200	S194-P196 WeakPolarHBondContact O-CD 3.32Å; P196-W198 VanDerWaalsContact C-N 3.3Å; P196-W198 HydrophobicContact CB-CG 4.41Å; P196-W198 PolarHBondContact O-N 3.16Å; P196-V199 HydrophobicContact CB-CG2 4.1Å; P196-V199 HydrophobicContact CG-CG2 4.15Å; P196-V199 WeakPolarHBondContact O-CB 3.4Å; P196-V199 PolarHBondContact O-N 2.82Å; P196-V200 PolarHBondContact O-N 2.85Å
197	K	82.3	Confident	85	Confident	62 Å²	62	52.2 Å²	52.2	27%	0.27	27%	0.274	S	S	.	.	H	α-helix	trans	-59	-38.3	-175.7	-60.2	-52.6	-172.3	-164.7	0	113.3	D190 V199 V200 N201	D190-K197 IonicContact OD1-NZ 2.85Å; D190-K197 PolarHBondContact OD1-NZ 3.17Å; D190-K197 IonicContact OD2-NZ 2.81Å; D190-K197 PolarHBondContact OD2-NZ 3.4Å; K197-V199 VanDerWaalsContact C-N 3.26Å; K197-V199 PolarHBondContact O-N 3.17Å; K197-V200 WeakPolarHBondContact O-CB 3.31Å; K197-V200 PolarHBondContact O-N 2.77Å; K197-V200 VanDerWaalsContact O-N 3.12Å; K197-N201 VanDerWaalsContact O-CG 3.24Å; K197-N201 PolarHBondContact O-N 2.88Å; K197-N201 PolarHBondContact O-ND2 3.21Å
198	W	77.4	Confident	84.7	Confident	137 Å²	137	52.3 Å²	52.3	52%	0.519	28%	0.275	S	S	.	.	H	α-helix	trans	-60	-35.3	175.3	72.8	-99.6	0	0	0	112.5	P196 K202	P196-W198 VanDerWaalsContact C-N 3.3Å; P196-W198 HydrophobicContact CB-CG 4.41Å; P196-W198 PolarHBondContact O-N 3.16Å; W198-K202 WeakPolarHBondContact O-CB 3.16Å; W198-K202 PolarHBondContact O-N 2.89Å
199	V	82.7	Confident	84.7	Confident	33 Å²	33	51 Å²	51	20%	0.2	27%	0.269	C	S	.	.	H	α-helix	trans	-66.4	-46.8	175.3	-179.9	0	0	0	0	109.5	L195 P196 K197 N201 K202 S203	L195-V199 HydrophobicContact CD2-CG1 4.26Å; P196-V199 HydrophobicContact CB-CG2 4.1Å; P196-V199 HydrophobicContact CG-CG2 4.15Å; P196-V199 WeakPolarHBondContact O-CB 3.4Å; P196-V199 PolarHBondContact O-N 2.82Å; K197-V199 VanDerWaalsContact C-N 3.26Å; K197-V199 PolarHBondContact O-N 3.17Å; V199-N201 VanDerWaalsContact C-N 3.34Å; V199-N201 PolarHBondContact O-N 3.35Å; V199-K202 PolarHBondContact O-N 2.81Å; V199-S203 WeakPolarHBondContact O-CB 3.5Å; V199-S203 PolarHBondContact O-N 3.06Å; V199-S203 PolarHBondContact O-OG 3.39Å; V199-S203 VanDerWaalsContact O-OG 3.12Å
200	V	82.5	Confident	84.8	Confident	8 Å²	8	54.3 Å²	54.3	5%	0.048	28%	0.28	C	S	.	.	H	α-helix	trans	-57.9	-47.9	177.4	177.8	0	0	0	0	111	L65 P191 L195 P196 K197 K202 S203 S204	L65-V200 HydrophobicContact CD1-CB 4.36Å; L65-V200 HydrophobicContact CD1-CG1 3.71Å; P191-V200 HydrophobicContact CG-CB 4.26Å; P191-V200 HydrophobicContact CG-CG1 3.69Å; P191-V200 HydrophobicContact CG-CG2 3.49Å; P191-V200 VanDerWaalsContact CG-CG2 3.49Å; L195-V200 HydrophobicContact CB-CG2 3.87Å; L195-V200 HydrophobicContact CD1-CG2 4.32Å; P196-V200 PolarHBondContact O-N 2.85Å; K197-V200 WeakPolarHBondContact O-CB 3.31Å; K197-V200 PolarHBondContact O-N 2.77Å; K197-V200 VanDerWaalsContact O-N 3.12Å; V200-K202 PolarHBondContact O-N 2.86Å; V200-S203 PolarHBondContact O-N 2.89Å; V200-S204 VanDerWaalsContact O-CB 3.3Å; V200-S204 WeakPolarHBondContact O-CB 3.16Å; V200-S204 PolarHBondContact O-N 3.36Å; V200-S204 PolarHBondContact O-OG 2.8Å
201	N	84	Confident	84.9	Confident	5 Å²	5	56.5 Å²	56.5	3%	0.027	30%	0.299	C	S	.	.	H	α-helix	trans	-59.2	-48.1	179	-67.9	-19	0	0	0	110.4	T64 H66 K197 V199 Q205	T64-N201 PolarHBondContact O-ND2 3.27Å; T64-N201 VanDerWaalsContact O-ND2 3.1Å; H66-N201 PolarHBondContact N-OD1 2.83Å; H66-N201 PolarHBondContact ND1-ND2 2.82Å; K197-N201 VanDerWaalsContact O-CG 3.24Å; K197-N201 PolarHBondContact O-N 2.88Å; K197-N201 PolarHBondContact O-ND2 3.21Å; V199-N201 VanDerWaalsContact C-N 3.34Å; V199-N201 PolarHBondContact O-N 3.35Å; N201-Q205 VanDerWaalsContact O-CG 3.3Å; N201-Q205 WeakPolarHBondContact O-CG 3.35Å; N201-Q205 PolarHBondContact O-N 3.19Å; N201-Q205 PolarHBondContact O-NE2 3.11Å
202	K	83.4	Confident	85.2	Confident	141 Å²	141	55.8 Å²	55.8	61%	0.613	29%	0.294	S	S	*	.	H	α-helix	trans	-66.9	-44.2	-179.7	-170	172	-174.6	173.7	0	112.9	W198 V199 V200 Q205 F206	W198-K202 WeakPolarHBondContact O-CB 3.16Å; W198-K202 PolarHBondContact O-N 2.89Å; V199-K202 PolarHBondContact O-N 2.81Å; V200-K202 PolarHBondContact O-N 2.86Å; K202-Q205 PolarHBondContact O-N 2.88Å; K202-F206 PolarHBondContact O-N 2.98Å
203	S	83.1	Confident	85.5	Confident	55 Å²	55	58.2 Å²	58.2	39%	0.385	31%	0.305	S	S	.	.	H	α-helix	trans	-63.5	-42.7	178.9	-66.9	0	0	0	0	111.7	V199 V200 Q205 F206 L207	V199-S203 WeakPolarHBondContact O-CB 3.5Å; V199-S203 PolarHBondContact O-N 3.06Å; V199-S203 PolarHBondContact O-OG 3.39Å; V199-S203 VanDerWaalsContact O-OG 3.12Å; V200-S203 PolarHBondContact O-N 2.89Å; S203-Q205 VanDerWaalsContact C-N 3.33Å; S203-Q205 PolarHBondContact O-N 3.46Å; S203-F206 PolarHBondContact O-N 2.77Å; S203-F206 VanDerWaalsContact O-N 3.17Å; S203-L207 WeakPolarHBondContact O-CB 3.44Å; S203-L207 VanDerWaalsContact O-CG 3.28Å; S203-L207 WeakPolarHBondContact O-CG 3.32Å; S203-L207 PolarHBondContact O-N 3.44Å
204	S	81	Confident	86.1	Confident	50 Å²	50	62 Å²	62	35%	0.35	32%	0.316	S	S	.	.	H	α-helix	trans	-66	-36.6	-177.7	-58.1	0	0	0	0	111.9	V200 F206 L207 A208	V200-S204 VanDerWaalsContact O-CB 3.3Å; V200-S204 WeakPolarHBondContact O-CB 3.16Å; V200-S204 PolarHBondContact O-N 3.36Å; V200-S204 PolarHBondContact O-OG 2.8Å; S204-F206 VanDerWaalsContact C-N 3.33Å; S204-F206 PolarHBondContact O-N 2.82Å; S204-L207 PolarHBondContact O-N 3.28Å; S204-A208 VanDerWaalsContact O-CB 3.28Å; S204-A208 WeakPolarHBondContact O-CB 3.43Å; S204-A208 PolarHBondContact O-N 3.43Å
205	Q	85	Confident	87	Confident	52 Å²	52	59.7 Å²	59.7	24%	0.243	30%	0.299	C	S	.	.	H	α-helix	trans	-60.6	-40.7	172.5	-70.3	170.8	48.4	0	0	112.6	V56 I68 N201 K202 S203 P209	V56-Q205 HydrophobicContact CG2-CG 3.47Å; V56-Q205 VanDerWaalsContact CG2-CG 3.47Å; I68-Q205 HydrophobicContact CD1-CG 3.92Å; N201-Q205 VanDerWaalsContact O-CG 3.3Å; N201-Q205 WeakPolarHBondContact O-CG 3.35Å; N201-Q205 PolarHBondContact O-N 3.19Å; N201-Q205 PolarHBondContact O-NE2 3.11Å; K202-Q205 PolarHBondContact O-N 2.88Å; S203-Q205 VanDerWaalsContact C-N 3.33Å; S203-Q205 PolarHBondContact O-N 3.46Å; Q205-P209 WeakPolarHBondContact O-CD 3.15Å
206	F	84.8	Confident	87.9	Confident	137 Å²	137	60.1 Å²	60.1	60%	0.601	30%	0.298	S	S	*	.	H	α-helix	trans	-76.7	-32.8	-179.1	-174.3	-106.1	0	0	0	113.2	K202 S203 S204	K202-F206 PolarHBondContact O-N 2.98Å; S203-F206 PolarHBondContact O-N 2.77Å; S203-F206 VanDerWaalsContact O-N 3.17Å; S204-F206 VanDerWaalsContact C-N 3.33Å; S204-F206 PolarHBondContact O-N 2.82Å
207	L	87.1	Confident	88.7	Confident	99 Å²	99	63.6 Å²	63.6	52%	0.518	31%	0.307	S	S	.	.	H	α-helix	trans	-84.8	-29.8	-176.5	-67.3	175.6	0	0	0	112.9	S203 S204 K210 A211	S203-L207 WeakPolarHBondContact O-CB 3.44Å; S203-L207 VanDerWaalsContact O-CG 3.28Å; S203-L207 WeakPolarHBondContact O-CG 3.32Å; S203-L207 PolarHBondContact O-N 3.44Å; S204-L207 PolarHBondContact O-N 3.28Å; L207-K210 PolarHBondContact O-N 2.94Å; L207-K210 VanDerWaalsContact O-N 3.13Å; L207-A211 PolarHBondContact O-N 3.24Å
208	A	90.1	Very high	89.4	Confident	10 Å²	10	60.8 Å²	60.8	8%	0.083	30%	0.295	C	S	.	.	H	α-helix	trans	-56.1	-47.6	-177.8	0	0	0	0	0	113.4	C70 S204 K210 A211 M212	C70-A208 HydrophobicContact CB-CB 4.1Å; S204-A208 VanDerWaalsContact O-CB 3.28Å; S204-A208 WeakPolarHBondContact O-CB 3.43Å; S204-A208 PolarHBondContact O-N 3.43Å; A208-K210 VanDerWaalsContact C-N 3.3Å; A208-K210 PolarHBondContact O-N 2.82Å; A208-A211 PolarHBondContact O-N 3.05Å; A208-M212 VanDerWaalsContact O-CG 3.29Å; A208-M212 WeakPolarHBondContact O-CG 3.29Å; A208-M212 PolarHBondContact O-N 3.05Å
209	P	91.9	Very high	90.5	Very high	7 Å²	7	54.3 Å²	54.3	5%	0.045	27%	0.271	C	S	.	.	H	α-helix	trans	-60.2	-37.9	176.8	-26.3	35.2	0	0	0	113.6	Y47 V52 V54 Q205 K213	Y47-P209 HydrophobicContact CD1-CB 4.45Å; Y47-P209 HydrophobicContact CD1-CG 3.91Å; Y47-P209 HydrophobicContact CE1-CB 3.99Å; Y47-P209 HydrophobicContact CE1-CG 3.94Å; Y47-P209 HydrophobicContact CG-CG 4.3Å; V52-P209 HydrophobicContact CG1-CB 3.97Å; V52-P209 HydrophobicContact CG1-CG 4.42Å; V54-P209 HydrophobicContact CG2-CG 3.5Å; V54-P209 VanDerWaalsContact CG2-CG 3.5Å; Q205-P209 WeakPolarHBondContact O-CD 3.15Å; P209-K213 WeakPolarHBondContact O-CB 3.38Å; P209-K213 WeakPolarHBondContact O-CG 3.28Å; P209-K213 PolarHBondContact O-N 3.18Å
210	K	92.8	Very high	91.2	Very high	112 Å²	112	56.5 Å²	56.5	49%	0.487	28%	0.281	S	S	.	.	H	α-helix	trans	-69.5	-41.6	179.8	-67.5	-177.9	179.8	178.1	0	111	L207 A208 K213 K214	L207-K210 PolarHBondContact O-N 2.94Å; L207-K210 VanDerWaalsContact O-N 3.13Å; A208-K210 VanDerWaalsContact C-N 3.3Å; A208-K210 PolarHBondContact O-N 2.82Å; K210-K213 PolarHBondContact O-N 2.81Å; K210-K214 PolarHBondContact O-N 3.43Å
211	A	92.6	Very high	92	Very high	54 Å²	54	62.9 Å²	62.9	45%	0.446	31%	0.308	S	S	.	.	H	α-helix	trans	-62.8	-46.9	176.5	0	0	0	0	0	111.5	L207 A208 K213 K214 M215	L207-A211 PolarHBondContact O-N 3.24Å; A208-A211 PolarHBondContact O-N 3.05Å; A211-K213 PolarHBondContact O-N 3.22Å; A211-K214 WeakPolarHBondContact O-CB 3.17Å; A211-K214 PolarHBondContact O-N 3.12Å; A211-M215 PolarHBondContact O-N 2.85Å
212	M	95.1	Very high	92.7	Very high	4 Å²	4	62.8 Å²	62.8	2%	0.02	31%	0.307	C	S	.	.	H	α-helix	trans	-60.4	-45.1	177.1	-66	-65.4	-82.3	0	0	111.6	C70 M72 I183 Y185 A208 K214 M215 Y216	C70-M212 HydrophobicContact CB-CG 4.35Å; M72-M212 HydrophobicContact CB-CE 4.12Å; M72-M212 HydrophobicContact CE-CB 3.92Å; M72-M212 HydrophobicContact CE-CE 4.28Å; M72-M212 VanDerWaalsContact CE-O 3.3Å; M72-M212 WeakPolarHBondContact CE-O 3.28Å; M72-M212 HydrophobicContact SD-CB 3.84Å; I183-M212 HydrophobicContact CB-CE 4.25Å; I183-M212 HydrophobicContact CD1-CE 3.96Å; I183-M212 HydrophobicContact CG1-CE 4.01Å; I183-M212 HydrophobicContact CG2-CE 3.44Å; I183-M212 VanDerWaalsContact CG2-CE 3.44Å; Y185-M212 HydrophobicContact CG-SD 4.4Å; A208-M212 VanDerWaalsContact O-CG 3.29Å; A208-M212 WeakPolarHBondContact O-CG 3.29Å; A208-M212 PolarHBondContact O-N 3.05Å; M212-K214 VanDerWaalsContact C-N 3.32Å; M212-K214 PolarHBondContact O-N 3.21Å; M212-M215 WeakPolarHBondContact O-CB 3.42Å; M212-M215 PolarHBondContact O-N 2.87Å; M212-M215 VanDerWaalsContact O-N 3.16Å; M212-M215 HydrophobicContact SD-CE 3.57Å; M212-M215 VanDerWaalsContact SD-CE 3.57Å; M212-Y216 PolarHBondContact O-N 3.02Å
213	K	95.7	Very high	93.4	Very high	75 Å²	75	59.4 Å²	59.4	33%	0.326	30%	0.3	S	S	.	.	H	α-helix	trans	-62.8	-34.9	176	-74.3	179.8	-179.9	-179.7	0	113.6	V52 P209 K210 A211 K217	V52-K213 HydrophobicContact CG2-CG 4.41Å; P209-K213 WeakPolarHBondContact O-CB 3.38Å; P209-K213 WeakPolarHBondContact O-CG 3.28Å; P209-K213 PolarHBondContact O-N 3.18Å; K210-K213 PolarHBondContact O-N 2.81Å; A211-K213 PolarHBondContact O-N 3.22Å; K213-K217 WeakPolarHBondContact O-CG 3.42Å; K213-K217 PolarHBondContact O-N 2.82Å; K213-K217 VanDerWaalsContact O-N 3.1Å
214	K	96.6	Very high	94.1	Very high	97 Å²	97	63.7 Å²	63.7	42%	0.422	31%	0.314	S	S	.	.	H	α-helix	trans	-65	-44.6	173.2	-78.3	-175.7	175.5	-176.1	0	111.2	W95 S97 K210 A211 M212 K217 A218	W95-K214 HydrophobicContact CE3-CB 4.47Å; W95-K214 HydrophobicContact CZ3-CB 4.49Å; S97-K214 PolarHBondContact OG-NZ 3.49Å; K210-K214 PolarHBondContact O-N 3.43Å; A211-K214 WeakPolarHBondContact O-CB 3.17Å; A211-K214 PolarHBondContact O-N 3.12Å; M212-K214 VanDerWaalsContact C-N 3.32Å; M212-K214 PolarHBondContact O-N 3.21Å; K214-K217 PolarHBondContact O-N 3.26Å; K214-A218 PolarHBondContact O-N 2.81Å
215	M	97.8	Very high	95	Very high	6 Å²	6	63 Å²	63	3%	0.03	30%	0.303	C	S	.	.	H	α-helix	trans	-60.4	-45.9	175.7	-174.5	-159.3	-46.4	0	0	111.7	L82 V85 L86 W95 Y171 I183 A211 M212 K217 A218 C219	L82-M215 HydrophobicContact CD1-CG 4.32Å; L82-M215 HydrophobicContact CD1-SD 3.84Å; V85-M215 HydrophobicContact CG1-CG 4.37Å; L86-M215 HydrophobicContact CD2-CE 4.09Å; L86-M215 HydrophobicContact CD2-SD 3.72Å; L86-M215 HydrophobicContact CG-SD 4.3Å; W95-M215 HydrophobicContact CH2-CB 3.76Å; W95-M215 HydrophobicContact CH2-CG 3.9Å; W95-M215 HydrophobicContact CZ2-CB 4.47Å; W95-M215 HydrophobicContact CZ2-CG 4.2Å; W95-M215 HydrophobicContact CZ3-CB 3.9Å; W95-M215 HydrophobicContact CZ3-CG 4.49Å; Y171-M215 HydrophobicContact CE1-CE 3.87Å; I183-M215 HydrophobicContact CD1-CE 4.3Å; I183-M215 HydrophobicContact CD1-SD 3.74Å; A211-M215 PolarHBondContact O-N 2.85Å; M212-M215 WeakPolarHBondContact O-CB 3.42Å; M212-M215 PolarHBondContact O-N 2.87Å; M212-M215 VanDerWaalsContact O-N 3.16Å; M212-M215 HydrophobicContact SD-CE 3.57Å; M212-M215 VanDerWaalsContact SD-CE 3.57Å; M215-K217 PolarHBondContact O-N 3.35Å; M215-A218 WeakPolarHBondContact O-CA 3.43Å; M215-A218 VanDerWaalsContact O-CB 3.25Å; M215-A218 WeakPolarHBondContact O-CB 3.45Å; M215-A218 PolarHBondContact O-N 2.79Å; M215-C219 PolarHBondContact O-N 3.11Å; M215-C219 PolarHBondContact O-SG 2.93Å
216	Y	98.2	Very high	95.6	Very high	55 Å²	55	60.9 Å²	60.9	22%	0.216	29%	0.294	C	S	.	.	H	α-helix	trans	-56.8	-46.9	174.9	166.2	-105.1	0	0	0	112.2	C74 D76 V77 M212 A218 C219 L220	C74-Y216 HydrophobicContact CB-CD2 4.21Å; C74-Y216 HydrophobicContact CB-CE2 4.38Å; D76-Y216 WeakPolarHBondContact OD1-CE2 3.43Å; D76-Y216 VanDerWaalsContact OD1-CZ 3.26Å; D76-Y216 PolarHBondContact OD1-OH 3.27Å; D76-Y216 PolarHBondContact OD2-OH 3.46Å; V77-Y216 HydrophobicContact CG2-CD2 4.03Å; V77-Y216 HydrophobicContact CG2-CE2 3.78Å; M212-Y216 PolarHBondContact O-N 3.02Å; Y216-A218 PolarHBondContact O-N 3.28Å; Y216-C219 VanDerWaalsContact O-CB 3.3Å; Y216-C219 WeakPolarHBondContact O-CB 3.49Å; Y216-C219 PolarHBondContact O-N 3.2Å; Y216-L220 HydrophobicContact CE1-CD1 3.91Å; Y216-L220 HydrophobicContact CE2-CD2 4.32Å; Y216-L220 HydrophobicContact CE2-CG 4.49Å; Y216-L220 PolarHBondContact O-N 3.37Å
217	K	98.1	Very high	96.3	Very high	136 Å²	136	60.8 Å²	60.8	59%	0.591	30%	0.295	S	S	*	.	H	α-helix	trans	-61.9	-30.8	174.7	-72.4	-179.9	179.5	-171.6	0	113.1	K213 K214 M215	K213-K217 WeakPolarHBondContact O-CG 3.42Å; K213-K217 PolarHBondContact O-N 2.82Å; K213-K217 VanDerWaalsContact O-N 3.1Å; K214-K217 PolarHBondContact O-N 3.26Å; M215-K217 PolarHBondContact O-N 3.35Å
218	A	98.5	Very high	96.8	Very high	4 Å²	4	64.2 Å²	64.2	3%	0.033	31%	0.306	C	S	.	.	H	α-helix	trans	-67.9	-39.8	174	0	0	0	0	0	110.8	V85 Y91 W95 K214 M215 Y216 L220 K221 Y222	V85-A218 HydrophobicContact CG1-CB 4.3Å; Y91-A218 HydrophobicContact CE1-CB 3.84Å; Y91-A218 PolarHBondContact OH-O 3.45Å; Y91-A218 VanDerWaalsContact OH-O 3.05Å; W95-A218 HydrophobicContact CB-CB 3.6Å; W95-A218 HydrophobicContact CD2-CB 3.72Å; W95-A218 HydrophobicContact CE3-CB 4.27Å; W95-A218 HydrophobicContact CG-CB 3.41Å; W95-A218 VanDerWaalsContact CG-CB 3.41Å; K214-A218 PolarHBondContact O-N 2.81Å; M215-A218 WeakPolarHBondContact O-CA 3.43Å; M215-A218 VanDerWaalsContact O-CB 3.25Å; M215-A218 WeakPolarHBondContact O-CB 3.45Å; M215-A218 PolarHBondContact O-N 2.79Å; Y216-A218 PolarHBondContact O-N 3.28Å; A218-L220 VanDerWaalsContact C-N 3.33Å; A218-L220 PolarHBondContact O-N 2.85Å; A218-K221 CarbonylContact O-C 3.33Å; A218-K221 PolarHBondContact O-N 2.92Å; A218-Y222 PolarHBondContact O-N 2.81Å
219	C	98.7	Very high	97.2	Very high	1 Å²	1	66.7 Å²	66.7	1%	0.007	32%	0.315	C	S	.	.	H	α-helix	trans	-58.8	-42.8	175.8	-58.5	0	0	0	0	112.9	V77 T81 L82 V85 M215 Y216 K221 Y222 P223	V77-C219 HydrophobicContact CB-CB 4.38Å; V77-C219 HydrophobicContact CG1-CB 3.6Å; V77-C219 HydrophobicContact CG2-CB 3.82Å; T81-C219 HydrophobicContact CG2-CB 4.16Å; L82-C219 WeakPolarHBondContact CD1-SG 3.44Å; V85-C219 HydrophobicContact CG2-CB 4.42Å; M215-C219 PolarHBondContact O-N 3.11Å; M215-C219 PolarHBondContact O-SG 2.93Å; Y216-C219 VanDerWaalsContact O-CB 3.3Å; Y216-C219 WeakPolarHBondContact O-CB 3.49Å; Y216-C219 PolarHBondContact O-N 3.2Å; C219-K221 PolarHBondContact O-N 3.18Å; C219-Y222 PolarHBondContact O-N 2.65Å; C219-Y222 VanDerWaalsContact O-N 3.17Å; C219-P223 WeakPolarHBondContact O-CD 3.27Å
220	L	98.5	Very high	97.5	Very high	79 Å²	79	72 Å²	72	41%	0.414	34%	0.343	S	S	.	.	H	α-helix	trans	-59.7	-28.6	176.9	-61.1	176.5	0	0	0	113	V77 Y216 A218	V77-L220 HydrophobicContact CG2-CD2 3.66Å; V77-L220 HydrophobicContact CG2-CG 4.36Å; Y216-L220 HydrophobicContact CE1-CD1 3.91Å; Y216-L220 HydrophobicContact CE2-CD2 4.32Å; Y216-L220 HydrophobicContact CE2-CG 4.49Å; Y216-L220 PolarHBondContact O-N 3.37Å; A218-L220 VanDerWaalsContact C-N 3.33Å; A218-L220 PolarHBondContact O-N 2.85Å
221	K	98.5	Very high	97.7	Very high	141 Å²	141	68.2 Å²	68.2	61%	0.613	33%	0.33	S	S	*	.	H	α-helix	trans	-98.9	-8.4	-178.4	-63.5	-176.6	179.9	-170.7	0	113.3	Y91 A218 C219 W225	Y91-K221 WeakPolarHBondContact OH-CB 3.45Å; A218-K221 CarbonylContact O-C 3.33Å; A218-K221 PolarHBondContact O-N 2.92Å; C219-K221 PolarHBondContact O-N 3.18Å; K221-W225 WeakPolarHBondContact O-CB 3.23Å; K221-W225 PolarHBondContact O-N 2.86Å
222	Y	98.8	Very high	97.9	Very high	3 Å²	3	73.2 Å²	73.2	1%	0.012	34%	0.344	C	S	.	.	H	α-helix	trans	-67.8	-45.8	-171	-177.9	-107.5	0	0	0	113.4	T81 D84 V85 D88 Y91 A218 C219 E224 W225 K226	T81-Y222 HydrophobicContact CG2-CD1 4.31Å; D84-Y222 HydrophobicContact CB-CD1 4.11Å; D84-Y222 HydrophobicContact CB-CE1 3.34Å; V85-Y222 VanDerWaalsContact CG2-CB 3.47Å; V85-Y222 HydrophobicContact CG2-CD1 3.93Å; V85-Y222 HydrophobicContact CG2-CD2 3.75Å; V85-Y222 HydrophobicContact CG2-CE2 4.45Å; V85-Y222 HydrophobicContact CG2-CG 3.42Å; V85-Y222 VanDerWaalsContact CG2-CG 3.42Å; D88-Y222 HydrophobicContact CB-CE2 3.95Å; D88-Y222 WeakPolarHBondContact OD2-CE2 3.28Å; D88-Y222 PolarHBondContact OD2-OH 2.89Å; Y91-Y222 AromaticContact CD1-CD2 3.36Å; Y91-Y222 HydrophobicContact CD1-CD2 3.36Å; Y91-Y222 AromaticContact CD1-CE2 3.91Å; Y91-Y222 HydrophobicContact CD1-CE2 3.91Å; Y91-Y222 HydrophobicContact CD1-CG 4.38Å; Y91-Y222 HydrophobicContact CD2-CD2 4.27Å; Y91-Y222 AromaticContact CE1-CD2 3.57Å; Y91-Y222 HydrophobicContact CE1-CD2 3.57Å; Y91-Y222 HydrophobicContact CE1-CG 4.25Å; Y91-Y222 HydrophobicContact CE2-CD2 4.43Å; Y91-Y222 AromaticContact CG-CD2 3.73Å; Y91-Y222 HydrophobicContact CG-CD2 3.73Å; Y91-Y222 AromaticContact CG-CE2 3.96Å; Y91-Y222 HydrophobicContact CG-CE2 3.96Å; A218-Y222 PolarHBondContact O-N 2.81Å; C219-Y222 PolarHBondContact O-N 2.65Å; C219-Y222 VanDerWaalsContact O-N 3.17Å; Y222-E224 PolarHBondContact O-N 3.47Å; Y222-W225 HydrophobicContact CD2-CE3 4.1Å; Y222-W225 AromaticContact CE2-CE3 3.94Å; Y222-W225 HydrophobicContact CE2-CE3 3.94Å; Y222-W225 HydrophobicContact CE2-CZ3 4.03Å; Y222-W225 PolarHBondContact O-N 2.79Å; Y222-W225 VanDerWaalsContact O-N 3.14Å; Y222-K226 HydrophobicContact CD1-CB 4.44Å; Y222-K226 HydrophobicContact CD2-CB 4.46Å; Y222-K226 HydrophobicContact CE1-CB 4.01Å; Y222-K226 HydrophobicContact CE1-CG 4.1Å; Y222-K226 HydrophobicContact CE2-CB 4.09Å; Y222-K226 HydrophobicContact CE2-CD 4.33Å; Y222-K226 HydrophobicContact CE2-CG 4.39Å; Y222-K226 WeakPolarHBondContact O-CB 3.19Å; Y222-K226 PolarHBondContact O-N 3.28Å; Y222-K226 WeakPolarHBondContact OH-CD 3.41Å
223	P	98.5	Very high	98.1	Very high	71 Å²	71	76.6 Å²	76.6	46%	0.461	36%	0.359	S	S	.	.	H	α-helix	trans	-57	-47.5	-178.3	-26.7	35.7	0	0	0	112.9	T81 C219 W225 K226 Q227	T81-P223 HydrophobicContact CG2-CG 4.43Å; C219-P223 WeakPolarHBondContact O-CD 3.27Å; P223-W225 PolarHBondContact O-N 2.99Å; P223-K226 PolarHBondContact O-N 3.47Å; P223-Q227 WeakPolarHBondContact O-CB 3.47Å; P223-Q227 PolarHBondContact O-N 3.17Å
224	E	98.4	Very high	98.2	Very high	145 Å²	145	75.1 Å²	75.1	68%	0.678	35%	0.352	S	S	*	.	H	α-helix	trans	-65	-38.7	177.8	-66.1	-177.3	177.5	0	0	112.8	Y222	Y222-E224 PolarHBondContact O-N 3.47Å
225	W	98.6	Very high	98.3	Very high	34 Å²	34	71.7 Å²	71.7	13%	0.129	34%	0.34	C	S	.	.	H	α-helix	trans	-66.8	-50.6	176.9	179.3	86.8	0	0	0	110.6	E90 Y91 K221 Y222 P223 Q227 K228 H229	E90-W225 HydrophobicContact CB-CH2 4.18Å; E90-W225 HydrophobicContact CG-CH2 3.99Å; E90-W225 HydrophobicContact CG-CZ2 4.18Å; Y91-W225 HydrophobicContact CD2-CB 4.39Å; Y91-W225 AromaticContact CD2-CD2 3.17Å; Y91-W225 HydrophobicContact CD2-CD2 3.17Å; Y91-W225 AromaticContact CD2-CE2 3.49Å; Y91-W225 VanDerWaalsContact CD2-CE2 3.49Å; Y91-W225 AromaticContact CD2-CE3 3.3Å; Y91-W225 HydrophobicContact CD2-CE3 3.3Å; Y91-W225 AromaticContact CD2-CG 3.67Å; Y91-W225 HydrophobicContact CD2-CG 3.67Å; Y91-W225 HydrophobicContact CD2-CH2 4.04Å; Y91-W225 AromaticContact CD2-CZ2 3.93Å; Y91-W225 HydrophobicContact CD2-CZ2 3.93Å; Y91-W225 AromaticContact CD2-CZ3 3.74Å; Y91-W225 HydrophobicContact CD2-CZ3 3.74Å; Y91-W225 HydrophobicContact CE2-CB 3.75Å; Y91-W225 AromaticContact CE2-CD1 3.86Å; Y91-W225 AromaticContact CE2-CD2 3.47Å; Y91-W225 HydrophobicContact CE2-CD2 3.47Å; Y91-W225 VanDerWaalsContact CE2-CD2 3.47Å; Y91-W225 AromaticContact CE2-CE3 3.86Å; Y91-W225 HydrophobicContact CE2-CE3 3.86Å; Y91-W225 AromaticContact CE2-CG 3.38Å; Y91-W225 HydrophobicContact CE2-CG 3.38Å; Y91-W225 HydrophobicContact CG-CD2 4.18Å; Y91-W225 AromaticContact CG-CE3 3.85Å; Y91-W225 HydrophobicContact CG-CE3 3.85Å; Y91-W225 HydrophobicContact CG-CH2 4.39Å; Y91-W225 AromaticContact CG-CZ3 3.98Å; Y91-W225 HydrophobicContact CG-CZ3 3.98Å; K221-W225 WeakPolarHBondContact O-CB 3.23Å; K221-W225 PolarHBondContact O-N 2.86Å; Y222-W225 HydrophobicContact CD2-CE3 4.1Å; Y222-W225 AromaticContact CE2-CE3 3.94Å; Y222-W225 HydrophobicContact CE2-CE3 3.94Å; Y222-W225 HydrophobicContact CE2-CZ3 4.03Å; Y222-W225 PolarHBondContact O-N 2.79Å; Y222-W225 VanDerWaalsContact O-N 3.14Å; P223-W225 PolarHBondContact O-N 2.99Å; W225-Q227 VanDerWaalsContact C-N 3.27Å; W225-Q227 PolarHBondContact O-N 3.48Å; W225-K228 PolarHBondContact O-N 3.34Å; W225-H229 AromaticContact CD1-CE1 3.49Å; W225-H229 VanDerWaalsContact CD1-CE1 3.49Å; W225-H229 AromaticContact CD1-ND1 3.76Å; W225-H229 HydrophobicContact CD2-CB 4.47Å; W225-H229 AromaticContact CD2-ND1 3.72Å; W225-H229 AromaticContact CE2-CD2 3.74Å; W225-H229 AromaticContact CE2-CE1 3.6Å; W225-H229 AromaticContact CE2-CG 3.57Å; W225-H229 AromaticContact CE2-ND1 3.45Å; W225-H229 AromaticContact CE2-NE2 3.75Å; W225-H229 HydrophobicContact CE3-CB 4.39Å; W225-H229 AromaticContact CG-ND1 3.92Å; W225-H229 HydrophobicContact CH2-CB 3.8Å; W225-H229 AromaticContact CH2-CG 3.98Å; W225-H229 HydrophobicContact CZ2-CB 3.89Å; W225-H229 AromaticContact CZ2-CD2 3.52Å; W225-H229 AromaticContact CZ2-CG 3.52Å; W225-H229 AromaticContact CZ2-ND1 3.93Å; W225-H229 AromaticContact CZ2-NE2 3.96Å; W225-H229 HydrophobicContact CZ3-CB 4.06Å; W225-H229 AromaticContact NE1-CD2 3.87Å; W225-H229 AromaticContact NE1-CE1 3.13Å; W225-H229 PolarHBondContact NE1-CE1 2.72Å; W225-H229 AromaticContact NE1-CG 3.93Å; W225-H229 AromaticContact NE1-ND1 3.47Å; W225-H229 PolarHBondContact NE1-ND1 2.59Å; W225-H229 AromaticContact NE1-NE2 3.36Å; W225-H229 PolarHBondContact NE1-NE2 2.8Å; W225-H229 PolarHBondContact O-N 3.05Å; W225-H229 PolarHBondContact O-ND1 3.25Å
226	K	98.6	Very high	98.3	Very high	8 Å²	8	72.7 Å²	72.7	4%	0.035	34%	0.343	C	S	.	.	H	α-helix	trans	-63.9	-33.2	-175.6	-170.9	56.6	173.2	-174.2	0	112.2	D88 Y222 P223 K228 H229 P231 F233	D88-K226 IonicContact OD2-NZ 3.97Å; D88-K226 PolarHBondContact OD2-NZ 3.43Å; Y222-K226 HydrophobicContact CD1-CB 4.44Å; Y222-K226 HydrophobicContact CD2-CB 4.46Å; Y222-K226 HydrophobicContact CE1-CB 4.01Å; Y222-K226 HydrophobicContact CE1-CG 4.1Å; Y222-K226 HydrophobicContact CE2-CB 4.09Å; Y222-K226 HydrophobicContact CE2-CD 4.33Å; Y222-K226 HydrophobicContact CE2-CG 4.39Å; Y222-K226 WeakPolarHBondContact O-CB 3.19Å; Y222-K226 PolarHBondContact O-N 3.28Å; Y222-K226 WeakPolarHBondContact OH-CD 3.41Å; P223-K226 PolarHBondContact O-N 3.47Å; K226-K228 PolarHBondContact O-N 3.35Å; K226-K228 VanDerWaalsContact O-N 3.1Å; K226-H229 CarbonylContact O-C 3.53Å; K226-H229 PolarHBondContact O-N 3.06Å; K226-P231 WeakPolarHBondContact O-CA 3.42Å; K226-F233 VanDerWaalsContact CE-O 3.3Å; K226-F233 WeakPolarHBondContact CE-O 3.38Å; K226-F233 PolarHBondContact NZ-O 3.4Å
227	Q	98.4	Very high	98.3	Very high	136 Å²	136	73.7 Å²	73.7	64%	0.636	35%	0.352	S	S	*	.	H	α-helix	trans	-55	-29	172.4	-169.4	58.1	36.8	0	0	113.4	P223 W225	P223-Q227 WeakPolarHBondContact O-CB 3.47Å; P223-Q227 PolarHBondContact O-N 3.17Å; W225-Q227 VanDerWaalsContact C-N 3.27Å; W225-Q227 PolarHBondContact O-N 3.48Å
228	K	98.4	Very high	98.3	Very high	170 Å²	170	71 Å²	71	74%	0.739	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-5.1	-179.5	-57.2	175.4	-175.2	175.2	0	113.5	W225 K226	W225-K228 PolarHBondContact O-N 3.34Å; K226-K228 PolarHBondContact O-N 3.35Å; K226-K228 VanDerWaalsContact O-N 3.1Å
229	H	98.1	Very high	98.2	Very high	62 Å²	62	72.9 Å²	72.9	29%	0.287	35%	0.353	S	S	.	.	S	Bend	trans	-132.8	69.1	-172.3	-59.6	76	0	0	0	110	E90 W225 K226	E90-H229 IonicContact OE1-CD2 3.14Å; W225-H229 AromaticContact CD1-CE1 3.49Å; W225-H229 VanDerWaalsContact CD1-CE1 3.49Å; W225-H229 AromaticContact CD1-ND1 3.76Å; W225-H229 HydrophobicContact CD2-CB 4.47Å; W225-H229 AromaticContact CD2-ND1 3.72Å; W225-H229 AromaticContact CE2-CD2 3.74Å; W225-H229 AromaticContact CE2-CE1 3.6Å; W225-H229 AromaticContact CE2-CG 3.57Å; W225-H229 AromaticContact CE2-ND1 3.45Å; W225-H229 AromaticContact CE2-NE2 3.75Å; W225-H229 HydrophobicContact CE3-CB 4.39Å; W225-H229 AromaticContact CG-ND1 3.92Å; W225-H229 HydrophobicContact CH2-CB 3.8Å; W225-H229 AromaticContact CH2-CG 3.98Å; W225-H229 HydrophobicContact CZ2-CB 3.89Å; W225-H229 AromaticContact CZ2-CD2 3.52Å; W225-H229 AromaticContact CZ2-CG 3.52Å; W225-H229 AromaticContact CZ2-ND1 3.93Å; W225-H229 AromaticContact CZ2-NE2 3.96Å; W225-H229 HydrophobicContact CZ3-CB 4.06Å; W225-H229 AromaticContact NE1-CD2 3.87Å; W225-H229 AromaticContact NE1-CE1 3.13Å; W225-H229 PolarHBondContact NE1-CE1 2.72Å; W225-H229 AromaticContact NE1-CG 3.93Å; W225-H229 AromaticContact NE1-ND1 3.47Å; W225-H229 PolarHBondContact NE1-ND1 2.59Å; W225-H229 AromaticContact NE1-NE2 3.36Å; W225-H229 PolarHBondContact NE1-NE2 2.8Å; W225-H229 PolarHBondContact O-N 3.05Å; W225-H229 PolarHBondContact O-ND1 3.25Å; K226-H229 CarbonylContact O-C 3.53Å; K226-H229 PolarHBondContact O-N 3.06Å
230	L	97.7	Very high	98.2	Very high	119 Å²	119	79.8 Å²	79.8	62%	0.623	39%	0.385	S	S	*	.			trans	52.2	69.9	179.2	-55.4	174.9	0	0	0	112.1	H232 F233	L230-H232 PolarHBondContact O-N 2.97Å; L230-F233 HydrophobicContact CB-CB 3.76Å; L230-F233 WeakPolarHBondContact O-CB 3.49Å; L230-F233 PolarHBondContact O-N 3.04Å
231	P	97.7	Very high	98.2	Very high	33 Å²	33	78.8 Å²	78.8	21%	0.214	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-28.7	-170.4	17.4	-29.9	0	0	0	115.3	K226	K226-P231 WeakPolarHBondContact O-CA 3.42Å
232	H	97.9	Very high	98.1	Very high	158 Å²	158	73.5 Å²	73.5	73%	0.731	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-8.8	179.4	-54.7	-60.3	0	0	0	113.6	L230 K234 Q241	L230-H232 PolarHBondContact O-N 2.97Å; H232-K234 PolarHBondContact O-N 3.01Å; H232-Q241 PolarHBondContact O-NE2 2.81Å; H232-Q241 PolarHBondContact O-OE1 3.15Å
233	F	98.4	Very high	98	Very high	76 Å²	76	78.5 Å²	78.5	33%	0.333	39%	0.392	S	S	.	.			trans	-86.5	95.2	177	-172.5	-111.2	0	0	0	109.9	K226 L230 P235 Q241	K226-F233 VanDerWaalsContact CE-O 3.3Å; K226-F233 WeakPolarHBondContact CE-O 3.38Å; K226-F233 PolarHBondContact NZ-O 3.4Å; L230-F233 HydrophobicContact CB-CB 3.76Å; L230-F233 WeakPolarHBondContact O-CB 3.49Å; L230-F233 PolarHBondContact O-N 3.04Å; F233-P235 HydrophobicContact CE1-CG 4.18Å; F233-P235 HydrophobicContact CE2-CG 4.47Å; F233-P235 HydrophobicContact CZ-CG 4.02Å; F233-Q241 HydrophobicContact CD2-CB 4.2Å; F233-Q241 HydrophobicContact CE2-CB 4.02Å; F233-Q241 WeakPolarHBondContact CE2-O 3.3Å
234	K	98.4	Very high	98	Very high	43 Å²	43	77 Å²	77	19%	0.187	38%	0.38	C	S	.	.			trans	-138.2	72	-179.7	-64.1	-171.3	179.8	-172.4	0	108.9	D84 H232 W236 L237 H238	D84-K234 IonicContact OD1-NZ 2.83Å; D84-K234 IonicContact OD2-NZ 3.94Å; D84-K234 PolarHBondContact OD2-NZ 3.18Å; H232-K234 PolarHBondContact O-N 3.01Å; K234-W236 HydrophobicContact CB-CD2 4.39Å; K234-W236 HydrophobicContact CB-CZ2 3.93Å; K234-W236 HydrophobicContact CD-CZ2 4.31Å; K234-W236 HydrophobicContact CG-CH2 4.38Å; K234-W236 HydrophobicContact CG-CZ2 3.77Å; K234-W236 PolarHBondContact O-N 2.94Å; K234-L237 HydrophobicContact CB-CB 4.32Å; K234-L237 HydrophobicContact CB-CD1 4.14Å; K234-L237 HydrophobicContact CB-CG 4.22Å; K234-L237 HydrophobicContact CD-CD1 3.68Å; K234-L237 PolarHBondContact O-N 3.1Å; K234-H238 PolarHBondContact O-N 3.47Å
235	P	98	Very high	98	Very high	26 Å²	26	74 Å²	74	17%	0.169	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-17.7	-174	24.1	-34.9	0	0	0	114.4	F233 L237 H238 P239 Q241	F233-P235 HydrophobicContact CE1-CG 4.18Å; F233-P235 HydrophobicContact CE2-CG 4.47Å; F233-P235 HydrophobicContact CZ-CG 4.02Å; P235-L237 VanDerWaalsContact C-N 3.34Å; P235-H238 WeakPolarHBondContact CA-O 3.25Å; P235-H238 CarbonylContact O-C 3.59Å; P235-P239 WeakPolarHBondContact O-CA 3.48Å; P235-Q241 HydrophobicContact CB-CB 4.18Å
236	W	98.1	Very high	97.9	Very high	26 Å²	26	76.7 Å²	76.7	10%	0.098	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-23.6	171.8	53.3	91.6	0	0	0	113.6	D84 H87 D88 K234	D84-W236 HydrophobicContact CB-CZ2 4.35Å; D84-W236 PolarHBondContact OD1-NE1 2.67Å; H87-W236 HydrophobicContact CB-CB 3.82Å; H87-W236 HydrophobicContact CB-CD2 3.37Å; H87-W236 HydrophobicContact CB-CE3 3.72Å; H87-W236 HydrophobicContact CB-CG 3.4Å; H87-W236 VanDerWaalsContact CB-CG 3.4Å; H87-W236 HydrophobicContact CB-CZ3 4.42Å; H87-W236 VanDerWaalsContact CG-CB 3.49Å; H87-W236 AromaticContact CG-CD1 3.97Å; H87-W236 AromaticContact CG-CG 3.58Å; D88-W236 HydrophobicContact CB-CH2 3.56Å; D88-W236 HydrophobicContact CB-CZ2 4.11Å; D88-W236 HydrophobicContact CB-CZ3 4.19Å; D88-W236 WeakPolarHBondContact OD2-CH2 3.39Å; K234-W236 HydrophobicContact CB-CD2 4.39Å; K234-W236 HydrophobicContact CB-CZ2 3.93Å; K234-W236 HydrophobicContact CD-CZ2 4.31Å; K234-W236 HydrophobicContact CG-CH2 4.38Å; K234-W236 HydrophobicContact CG-CZ2 3.77Å; K234-W236 PolarHBondContact O-N 2.94Å
237	L	97.9	Very high	97.9	Very high	77 Å²	77	77.3 Å²	77.3	40%	0.403	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-29.6	171.2	-56.6	-177.8	0	0	0	112.1	Y83 K234 P235	Y83-L237 HydrophobicContact CD1-CD2 4.11Å; Y83-L237 HydrophobicContact CE1-CD2 3.77Å; K234-L237 HydrophobicContact CB-CB 4.32Å; K234-L237 HydrophobicContact CB-CD1 4.14Å; K234-L237 HydrophobicContact CB-CG 4.22Å; K234-L237 HydrophobicContact CD-CD1 3.68Å; K234-L237 PolarHBondContact O-N 3.1Å; P235-L237 VanDerWaalsContact C-N 3.34Å
238	H	98.1	Very high	97.8	Very high	80 Å²	80	73 Å²	73	37%	0.37	39%	0.389	S	S	.	.			trans	-128.2	79.4	-173.1	-60.8	-58.7	0	0	0	109.9	K234 P235 E240 Q241	K234-H238 PolarHBondContact O-N 3.47Å; P235-H238 WeakPolarHBondContact CA-O 3.25Å; P235-H238 CarbonylContact O-C 3.59Å; H238-E240 WeakPolarHBondContact CA-OE2 3.34Å; H238-E240 WeakPolarHBondContact CB-OE1 3.1Å; H238-E240 IonicContact CG-OE1 3.42Å; H238-E240 IonicContact ND1-OE1 2.9Å; H238-E240 PolarHBondContact O-N 3.14Å; H238-E240 VanDerWaalsContact O-N 3.07Å; H238-Q241 VanDerWaalsContact CB-CD 3.49Å; H238-Q241 HydrophobicContact CB-CG 3.75Å; H238-Q241 VanDerWaalsContact O-CB 3.29Å; H238-Q241 WeakPolarHBondContact O-CB 3.38Å; H238-Q241 WeakPolarHBondContact O-CG 3.38Å; H238-Q241 PolarHBondContact O-N 3.44Å
239	P	97.3	Very high	97.7	Very high	42 Å²	42	68 Å²	68	27%	0.273	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-57.8	-25.8	-171	-25.9	35.4	0	0	0	114.8	V110 P235 Q241 S242	V110-P239 HydrophobicContact CB-CB 4.28Å; V110-P239 HydrophobicContact CB-CG 4.33Å; P235-P239 WeakPolarHBondContact O-CA 3.48Å; P239-Q241 PolarHBondContact O-N 3.43Å; P239-S242 WeakPolarHBondContact O-CB 3.32Å; P239-S242 PolarHBondContact O-N 3.2Å
240	E	97.3	Very high	97.6	Very high	147 Å²	147	70.3 Å²	70.3	69%	0.687	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-63.1	-20.1	174.4	71.9	-77.6	-176.3	0	0	113.5	H238 S242	H238-E240 WeakPolarHBondContact CA-OE2 3.34Å; H238-E240 WeakPolarHBondContact CB-OE1 3.1Å; H238-E240 IonicContact CG-OE1 3.42Å; H238-E240 IonicContact ND1-OE1 2.9Å; H238-E240 PolarHBondContact O-N 3.14Å; H238-E240 VanDerWaalsContact O-N 3.07Å; E240-S242 VanDerWaalsContact C-N 3.29Å
241	Q	98.3	Very high	97.5	Very high	57 Å²	57	69.1 Å²	69.1	27%	0.266	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-79.2	-12.2	174.4	-58.6	-179.2	-9.3	0	0	112.6	H232 F233 P235 H238 P239 P243	H232-Q241 PolarHBondContact O-NE2 2.81Å; H232-Q241 PolarHBondContact O-OE1 3.15Å; F233-Q241 HydrophobicContact CD2-CB 4.2Å; F233-Q241 HydrophobicContact CE2-CB 4.02Å; F233-Q241 WeakPolarHBondContact CE2-O 3.3Å; P235-Q241 HydrophobicContact CB-CB 4.18Å; H238-Q241 VanDerWaalsContact CB-CD 3.49Å; H238-Q241 HydrophobicContact CB-CG 3.75Å; H238-Q241 VanDerWaalsContact O-CB 3.29Å; H238-Q241 WeakPolarHBondContact O-CB 3.38Å; H238-Q241 WeakPolarHBondContact O-CG 3.38Å; H238-Q241 PolarHBondContact O-N 3.44Å; P239-Q241 PolarHBondContact O-N 3.43Å; Q241-P243 WeakPolarHBondContact O-CD 3.3Å
242	S	97.4	Very high	97.5	Very high	30 Å²	30	68 Å²	68	21%	0.21	38%	0.376	C	S	.	.			trans	-64.9	120.9	-173.9	-173.4	0	0	0	0	111.3	P239 E240 L244	P239-S242 WeakPolarHBondContact O-CB 3.32Å; P239-S242 PolarHBondContact O-N 3.2Å; E240-S242 VanDerWaalsContact C-N 3.29Å; S242-L244 PolarHBondContact O-N 3.5Å; S242-L244 PolarHBondContact OG-N 3.45Å
243	P	97.1	Very high	97.3	Very high	108 Å²	108	63.7 Å²	63.7	70%	0.701	36%	0.364	S	S	*	.			trans	-83.7	2.4	175.9	36	-36.1	0	0	0	112.4	Q241	Q241-P243 WeakPolarHBondContact O-CD 3.3Å
244	L	98	Very high	96.8	Very high	39 Å²	39	61.2 Å²	61.2	20%	0.204	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-74.8	140.9	-171.3	-65.1	174.2	0	0	0	111.4	D104 R107 S242	D104-L244 HydrophobicContact CB-CD1 3.58Å; D104-L244 HydrophobicContact CB-CD2 3.82Å; D104-L244 HydrophobicContact CB-CG 4.33Å; R107-L244 HydrophobicContact CB-CB 4.2Å; S242-L244 PolarHBondContact O-N 3.5Å; S242-L244 PolarHBondContact OG-N 3.45Å
245	P	98.1	Very high	96.3	Very high	82 Å²	82	59.3 Å²	59.3	53%	0.532	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-64.7	154.7	168.8	30.7	-35	0	0	0	110.3	A106 R107	A106-P245 CarbonylContact C-O 3.36Å; A106-P245 WeakPolarHBondContact CA-O 3.49Å; A106-P245 HydrophobicContact CB-CG 4.19Å; A106-P245 WeakPolarHBondContact CB-O 3.1Å; R107-P245 PolarHBondContact N-O 2.87Å
246	S	97.8	Very high	95.5	Very high	91 Å²	91	62.2 Å²	62.2	64%	0.636	36%	0.358	S	S	*	.	B	Isolated β-bridge	trans	-80	147.3	169.7	-67.6	0	0	0	0	111.1	R107	R107-S246 CarbonylContact O-C 3.49Å; R107-S246 WeakPolarHBondContact O-CA 2.89Å
247	L	97.6	Very high	94.2	Very high	22 Å²	22	62.1 Å²	62.1	12%	0.115	36%	0.362	C	S	.	.			trans	-127.6	138.3	176.1	-171.4	73.9	0	0	0	109.8	A106 R107 L108 V114 E251 L252	A106-L247 HydrophobicContact CB-CB 3.65Å; A106-L247 HydrophobicContact CB-CD2 4.33Å; A106-L247 HydrophobicContact CB-CG 4.45Å; R107-L247 PolarHBondContact O-N 3.12Å; L108-L247 HydrophobicContact CD2-CB 4.22Å; L108-L247 HydrophobicContact CD2-CD2 4.4Å; L108-L247 WeakPolarHBondContact CD2-O 3.24Å; V114-L247 HydrophobicContact CG2-CD2 4.18Å; L247-E251 HydrophobicContact CD1-CB 4.1Å; L247-E251 HydrophobicContact CD1-CG 4.45Å; L247-E251 WeakPolarHBondContact CD1-OE1 3.41Å; L247-E251 HydrophobicContact CG-CB 4.37Å; L247-L252 HydrophobicContact CD2-CD1 4.26Å; L247-L252 HydrophobicContact CD2-CD2 3.66Å; L247-L252 HydrophobicContact CD2-CG 3.93Å
248	A	97.2	Very high	92.7	Very high	46 Å²	46	65.2 Å²	65.2	38%	0.38	38%	0.379	S	S	.	.			trans	-78.9	138.1	172	0	0	0	0	0	110.3	S250 E251	A248-S250 PolarHBondContact O-N 3.12Å; A248-S250 VanDerWaalsContact O-N 3.15Å; A248-E251 HydrophobicContact CB-CG 4.19Å; A248-E251 WeakPolarHBondContact CB-OE1 3.27Å; A248-E251 PolarHBondContact N-OE1 3.2Å; A248-E251 WeakPolarHBondContact O-CB 3.4Å; A248-E251 PolarHBondContact O-N 3.29Å
249	L	95.4	Very high	91	Very high	64 Å²	64	64.2 Å²	64.2	34%	0.335	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-58.2	-31.8	-179.1	-170.9	64.7	0	0	0	112.8	V22 V24 L108 L133 E251 L252	V22-L249 HydrophobicContact CB-CD1 4.26Å; V22-L249 HydrophobicContact CG1-CD1 3.77Å; V22-L249 WeakPolarHBondContact O-CD2 3.37Å; V24-L249 HydrophobicContact CG2-CD1 4.09Å; V24-L249 HydrophobicContact CG2-CD2 4.5Å; L108-L249 HydrophobicContact CD1-CD1 4.38Å; L108-L249 HydrophobicContact CD2-CD1 4.31Å; L133-L249 HydrophobicContact CD1-CD1 4.24Å; L249-E251 PolarHBondContact O-N 2.97Å; L249-L252 HydrophobicContact CD1-CD1 4.41Å; L249-L252 PolarHBondContact O-N 3.31Å; L249-L252 VanDerWaalsContact O-N 3.16Å
250	S	95.5	Very high	89.3	Confident	111 Å²	111	63.3 Å²	63.3	78%	0.776	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-67.4	-14.9	176.9	55.2	0	0	0	0	114.3	A248 L252	A248-S250 PolarHBondContact O-N 3.12Å; A248-S250 VanDerWaalsContact O-N 3.15Å; S250-L252 VanDerWaalsContact C-N 3.26Å
251	E	96.4	Very high	87.3	Confident	93 Å²	93	65.2 Å²	65.2	44%	0.435	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-78.8	-13.1	174.6	-63.8	178	-105	0	0	112.3	P153 L247 A248 L249	P153-E251 WeakPolarHBondContact CD-O 3.3Å; P153-E251 VanDerWaalsContact CG-O 3.29Å; P153-E251 WeakPolarHBondContact CG-O 3.47Å; L247-E251 HydrophobicContact CD1-CB 4.1Å; L247-E251 HydrophobicContact CD1-CG 4.45Å; L247-E251 WeakPolarHBondContact CD1-OE1 3.41Å; L247-E251 HydrophobicContact CG-CB 4.37Å; A248-E251 HydrophobicContact CB-CG 4.19Å; A248-E251 WeakPolarHBondContact CB-OE1 3.27Å; A248-E251 PolarHBondContact N-OE1 3.2Å; A248-E251 WeakPolarHBondContact O-CB 3.4Å; A248-E251 PolarHBondContact O-N 3.29Å; L249-E251 PolarHBondContact O-N 2.97Å
252	L	96.3	Very high	85.5	Confident	10 Å²	10	68.2 Å²	68.2	5%	0.052	40%	0.401	C	S	.	.			trans	-95	153.4	177	-59.4	175.6	0	0	0	110.7	V22 L108 V114 L133 V150 K151 H152 L247 L249 S250	V22-L252 HydrophobicContact CB-CB 4.17Å; V22-L252 HydrophobicContact CG1-CB 4.08Å; V22-L252 HydrophobicContact CG1-CD1 4.06Å; V22-L252 HydrophobicContact CG2-CB 3.88Å; L108-L252 HydrophobicContact CD1-CD1 4.14Å; L108-L252 HydrophobicContact CD2-CD1 4.09Å; V114-L252 HydrophobicContact CG2-CD1 3.66Å; V114-L252 HydrophobicContact CG2-CD2 4.24Å; L133-L252 HydrophobicContact CD1-CD1 4.47Å; V150-L252 HydrophobicContact CG2-CD1 4.33Å; V150-L252 HydrophobicContact CG2-CD2 4.24Å; K151-L252 WeakPolarHBondContact O-CA 3.39Å; H152-L252 HydrophobicContact CB-CD2 4.14Å; L247-L252 HydrophobicContact CD2-CD1 4.26Å; L247-L252 HydrophobicContact CD2-CD2 3.66Å; L247-L252 HydrophobicContact CD2-CG 3.93Å; L249-L252 HydrophobicContact CD1-CD1 4.41Å; L249-L252 PolarHBondContact O-N 3.31Å; L249-L252 VanDerWaalsContact O-N 3.16Å; S250-L252 VanDerWaalsContact C-N 3.26Å
253	S	93.8	Very high	83.7	Confident	68 Å²	68	68.9 Å²	68.9	48%	0.476	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	156.4	172.5	-52.1	0	0	0	0	111.4	V22 K151 Q255	V22-S253 WeakPolarHBondContact CG2-O 3.44Å; K151-S253 PolarHBondContact N-O 2.82Å; K151-S253 PolarHBondContact O-N 3Å; K151-S253 VanDerWaalsContact O-N 3.1Å; S253-Q255 PolarHBondContact O-N 3.31Å
254	V	89.6	Confident	81.7	Confident	24 Å²	24	69.1 Å²	69.1	15%	0.145	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	133.4	-179.4	-178.2	0	0	0	0	110.1	V22	V22-V254 HydrophobicContact CG2-CG2 4.19Å
255	Q	87	Confident	80	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.009	39%	0.388	C	S	.	.			trans	-95.5	90.5	170.4	-176.4	57.7	80.2	0	0	109.1	S149 K151 V165 S253	S149-Q255 WeakPolarHBondContact O-CB 3.1Å; K151-Q255 HydrophobicContact CG-CB 4.21Å; K151-Q255 VanDerWaalsContact CG-OE1 3.25Å; V165-Q255 HydrophobicContact CG1-CG 4.08Å; V165-Q255 HydrophobicContact CG2-CG 3.9Å; S253-Q255 PolarHBondContact O-N 3.31Å
256	H	80.7	Confident	78.1	Confident	87 Å²	87	66.1 Å²	66.1	40%	0.403	38%	0.381	S	S	.	.			trans	-72.8	140.4	173.3	-52.8	-88.5	0	0	0	110.2	D258 S259	H256-D258 WeakPolarHBondContact CB-OD1 3.31Å; H256-S259 WeakPolarHBondContact CB-OG 3.13Å; H256-S259 PolarHBondContact O-OG 3.04Å; H256-S259 VanDerWaalsContact O-OG 3.06Å
257	A	71.6	Confident	76.1	Confident	24 Å²	24	65 Å²	65	20%	0.198	38%	0.377	C	S	.	.	S	Bend	trans	-63.5	-50.6	177.8	0	0	0	0	0	110.4	V165 K192 S259	V165-A257 HydrophobicContact CG1-CB 4.32Å; K192-A257 WeakPolarHBondContact CE-O 3.37Å; K192-A257 VanDerWaalsContact NZ-C 3.3Å; K192-A257 PolarHBondContact NZ-O 3.49Å; A257-S259 VanDerWaalsContact C-N 3.3Å; A257-S259 PolarHBondContact O-N 3.32Å
258	D	66.5	Low	73.9	Confident	142 Å²	142	65.5 Å²	65.5	76%	0.759	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-25	-179.2	55.6	-4	0	0	0	115.5	H256 L260	H256-D258 WeakPolarHBondContact CB-OD1 3.31Å; D258-L260 PolarHBondContact O-N 3.29Å
259	S	61.3	Low	71.5	Confident	59 Å²	59	66.4 Å²	66.4	41%	0.413	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-4.1	-172.3	72.2	0	0	0	0	117.3	H256 A257	H256-S259 WeakPolarHBondContact CB-OG 3.13Å; H256-S259 PolarHBondContact O-OG 3.04Å; H256-S259 VanDerWaalsContact O-OG 3.06Å; A257-S259 VanDerWaalsContact C-N 3.3Å; A257-S259 PolarHBondContact O-N 3.32Å
260	L	61.7	Low	68.9	Low	23 Å²	23	69.4 Å²	69.4	12%	0.12	40%	0.401	C	S	.	.	S	Bend	trans	-86.2	134	-179	-72.4	177.1	0	0	0	111.6	R163 V165 D258 N262	R163-L260 HydrophobicContact CB-CD1 4.21Å; R163-L260 HydrophobicContact CG-CD1 3.8Å; V165-L260 HydrophobicContact CG2-CD1 3.38Å; V165-L260 HydrophobicContact CG2-CG 4.46Å; D258-L260 PolarHBondContact O-N 3.29Å; L260-N262 PolarHBondContact O-N 3.14Å
261	E	56.3	Low	66.3	Low	188 Å²	188	66.8 Å²	66.8	88%	0.879	38%	0.382	S	S	*	.			trans	-55.5	126.7	168.4	-67.7	-178.1	177.6	0	0	109.8	I263	E261-I263 PolarHBondContact O-N 3.17Å
262	N	59.3	Low	63.9	Low	120 Å²	120	71.6 Å²	71.6	64%	0.642	40%	0.397	S	S	*	.			trans	-72	112.2	174.5	-69	-44.5	0	0	0	107.9	L260 D264	L260-N262 PolarHBondContact O-N 3.14Å; N262-D264 PolarHBondContact O-N 3.25Å
263	I	60.4	Low	61.3	Low	43 Å²	43	78.6 Å²	78.6	22%	0.221	43%	0.429	C	S	.	.			trans	-65.6	118.4	165.3	-62.1	-176.4	0	0	0	106.8	K126 L161 V162 E261 E265	K126-I263 HydrophobicContact CD-CG2 4.05Å; K126-I263 VanDerWaalsContact NZ-CG2 3.28Å; L161-I263 WeakPolarHBondContact O-CD1 3.46Å; V162-I263 HydrophobicContact CG2-CB 4.25Å; V162-I263 HydrophobicContact CG2-CD1 4.4Å; V162-I263 HydrophobicContact CG2-CG2 4.46Å; E261-I263 PolarHBondContact O-N 3.17Å; I263-E265 PolarHBondContact O-N 3.1Å
264	D	55.9	Low	58.7	Low	113 Å²	113	83.1 Å²	83.1	60%	0.604	44%	0.442	S	S	*	.			trans	-63.5	119.2	179.5	-169	9.5	0	0	0	110.5	N262 S266	N262-D264 PolarHBondContact O-N 3.25Å; D264-S266 WeakPolarHBondContact OD1-CB 3.33Å; D264-S266 PolarHBondContact OD1-N 3.18Å; D264-S266 PolarHBondContact OD1-OG 3.2Å; D264-S266 PolarHBondContact OD2-OG 3.26Å
265	E	62.6	Low	56.5	Low	4 Å²	4	92.5 Å²	92.5	2%	0.019	48%	0.475	C	S	.	.			trans	-117.7	28.9	174	-71.2	-174.5	123.5	0	0	109.3	K126 R128 V162 G193 S194 I263 V268	K126-E265 WeakPolarHBondContact CB-OE1 3Å; K126-E265 HydrophobicContact CD-CG 4.34Å; K126-E265 HydrophobicContact CG-CG 4.37Å; K126-E265 PolarHBondContact N-OE1 3.44Å; R128-E265 IonicContact CZ-OE1 3.85Å; R128-E265 IonicContact CZ-OE2 3.54Å; R128-E265 IonicContact NH1-OE1 3.2Å; R128-E265 PolarHBondContact NH1-OE1 3.06Å; R128-E265 IonicContact NH1-OE2 3.02Å; R128-E265 IonicContact NH2-OE1 3.26Å; R128-E265 PolarHBondContact NH2-OE1 3.05Å; R128-E265 IonicContact NH2-OE2 3.5Å; R128-E265 PolarHBondContact NH2-OE2 2.96Å; V162-E265 HydrophobicContact CG2-CG 4.45Å; G193-E265 VanDerWaalsContact CA-OE2 3.3Å; G193-E265 WeakPolarHBondContact CA-OE2 3.37Å; S194-E265 PolarHBondContact N-OE2 2.82Å; S194-E265 VanDerWaalsContact N-OE2 3.15Å; S194-E265 WeakPolarHBondContact OG-CB 3.34Å; S194-E265 PolarHBondContact OG-O 3.06Å; S194-E265 VanDerWaalsContact OG-O 3.1Å; I263-E265 PolarHBondContact O-N 3.1Å; E265-V268 WeakPolarHBondContact O-CB 3.17Å
266	S	58.1	Low	54.4	Low	54 Å²	54	100 Å²	100	38%	0.378	51%	0.512	S	S	.	.			trans	-73.9	-42.2	-179.3	60.6	0	0	0	0	113.4	D264 V268 A269	D264-S266 WeakPolarHBondContact OD1-CB 3.33Å; D264-S266 PolarHBondContact OD1-N 3.18Å; D264-S266 PolarHBondContact OD1-OG 3.2Å; D264-S266 PolarHBondContact OD2-OG 3.26Å; S266-V268 PolarHBondContact O-N 2.77Å; S266-A269 WeakPolarHBondContact O-CB 3.01Å; S266-A269 PolarHBondContact O-N 2.83Å
267	A	54.3	Low	52.3	Low	68 Å²	68	99.3 Å²	99.3	56%	0.562	53%	0.529	S	S	*	.	H	α-helix	trans	-59.6	-16.1	176.5	0	0	0	0	0	113.9
268	V	53.1	Low	50.9	Low	33 Å²	33	101.4 Å²	101.4	20%	0.2	55%	0.553	C	S	.	*	H	α-helix	trans	-73.2	-31.8	174	149.7	0	0	0	0	111.3	P124 E265 S266 S271	P124-V268 HydrophobicContact CB-CB 4.01Å; P124-V268 HydrophobicContact CB-CG1 3.33Å; P124-V268 HydrophobicContact CB-CG2 4.05Å; P124-V268 HydrophobicContact CG-CB 4.33Å; P124-V268 HydrophobicContact CG-CG1 3.22Å; P124-V268 WeakPolarHBondContact O-CG2 3.38Å; E265-V268 WeakPolarHBondContact O-CB 3.17Å; S266-V268 PolarHBondContact O-N 2.77Å; V268-S271 PolarHBondContact O-OG 2.86Å; V268-S271 VanDerWaalsContact O-OG 3.06Å
269	A	45.1	Very low	49.6	Very low	64 Å²	64	99.5 Å²	99.5	53%	0.529	56%	0.557	S	S	.	*	H	α-helix	trans	-76.8	-36.3	177.8	0	0	0	0	0	112.8	S266 S271 R272	S266-A269 WeakPolarHBondContact O-CB 3.01Å; S266-A269 PolarHBondContact O-N 2.83Å; A269-S271 VanDerWaalsContact C-N 3.31Å; A269-S271 PolarHBondContact O-N 2.98Å; A269-R272 VanDerWaalsContact O-CB 3.3Å; A269-R272 WeakPolarHBondContact O-CB 3.3Å; A269-R272 PolarHBondContact O-N 3.11Å; A269-R272 VanDerWaalsContact O-N 3.11Å
270	E	41.3	Very low	48.4	Very low	127 Å²	127	100.6 Å²	100.6	59%	0.593	58%	0.577	S	S	*	*	H	α-helix	trans	-62.2	-33.9	-177.1	-67.2	178	158.2	0	0	113	R272 E273 E274	E270-R272 PolarHBondContact O-N 3.32Å; E270-E273 PolarHBondContact O-N 3.43Å; E270-E273 VanDerWaalsContact O-N 3.13Å; E270-E274 PolarHBondContact O-N 3.19Å
271	S	40.9	Very low	47.1	Very low	56 Å²	56	103 Å²	103	39%	0.392	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63	-10.5	176.8	68.6	0	0	0	0	114.9	V268 A269	V268-S271 PolarHBondContact O-OG 2.86Å; V268-S271 VanDerWaalsContact O-OG 3.06Å; A269-S271 VanDerWaalsContact C-N 3.31Å; A269-S271 PolarHBondContact O-N 2.98Å
272	R	45.6	Very low	46	Very low	195 Å²	195	103.4 Å²	103.4	74%	0.736	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-23.3	-179.2	-143.8	175.7	172.7	-159	-6	112.7	A269 E270	A269-R272 VanDerWaalsContact O-CB 3.3Å; A269-R272 WeakPolarHBondContact O-CB 3.3Å; A269-R272 PolarHBondContact O-N 3.11Å; A269-R272 VanDerWaalsContact O-N 3.11Å; E270-R272 PolarHBondContact O-N 3.32Å
273	E	41.4	Very low	44.7	Very low	156 Å²	156	101.4 Å²	101.4	73%	0.729	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-36.7	174.2	-75.8	-179.1	163.9	0	0	111.4	E270 R275 M276 G277	E270-E273 PolarHBondContact O-N 3.43Å; E270-E273 VanDerWaalsContact O-N 3.13Å; E273-R275 VanDerWaalsContact C-N 3.32Å; E273-R275 PolarHBondContact O-N 3.15Å; E273-M276 PolarHBondContact O-N 3.13Å; E273-M276 VanDerWaalsContact O-N 3.15Å; E273-G277 PolarHBondContact O-N 3.34Å
274	E	40.6	Very low	43.4	Very low	163 Å²	163	105.1 Å²	105.1	76%	0.762	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-31.8	176.9	-72.4	-173.1	154.5	0	0	113.5	E270 M276	E270-E274 PolarHBondContact O-N 3.19Å; E274-M276 VanDerWaalsContact C-N 3.35Å
275	R	43.7	Very low	42.5	Very low	222 Å²	222	107 Å²	107	84%	0.838	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-17.1	176	-72.6	-172.9	-168.4	-168.9	1.7	114.1	E273	E273-R275 VanDerWaalsContact C-N 3.32Å; E273-R275 PolarHBondContact O-N 3.15Å
276	M	42.5	Very low	41.1	Very low	158 Å²	158	114.6 Å²	114.6	78%	0.778	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	-12.2	178.7	-129.5	116.9	69.6	0	0	112.5	E273 E274	E273-M276 PolarHBondContact O-N 3.13Å; E273-M276 VanDerWaalsContact O-N 3.15Å; E274-M276 VanDerWaalsContact C-N 3.35Å
277	G	37.1	Very low	40	Very low	73 Å²	73	118.2 Å²	118.2	75%	0.753	71%	0.714	S	S	*	*	S	Bend	trans	-94.1	2.9	177.7	0	0	0	0	0	115.8	E273	E273-G277 PolarHBondContact O-N 3.34Å
278	G	41	Very low	39	Very low	69 Å²	69	120.7 Å²	120.7	71%	0.711	72%	0.722	S	S	*	*	S	Bend	trans	-124.1	29.4	-168.3	0	0	0	0	0	116.5
279	A	40.1	Very low	38.2	Very low	101 Å²	101	123.5 Å²	123.5	84%	0.835	74%	0.743	S	S	*	*			trans	-144.5	75.9	172.3	0	0	0	0	0	111.1
280	G	36	Very low	37.8	Very low	82 Å²	82	127.6 Å²	127.6	85%	0.845	76%	0.755	S	S	*	*			trans	-113.9	123.2	162.1	0	0	0	0	0	109.6
281	G	33.9	Very low	37.8	Very low	74 Å²	74	131.1 Å²	131.1	76%	0.763	79%	0.786	S	S	*	*			trans	95.4	128.7	176	0	0	0	0	0	112.7
282	E	33.3	Very low	37.6	Very low	196 Å²	196	134.9 Å²	134.9	92%	0.916	81%	0.805	S	S	*	*			cis	-151.2	154.6	7.9	-72.4	174.7	124.2	0	0	107.1
283	G	32.9	Very low	37.2	Very low	79 Å²	79	131.7 Å²	131.7	81%	0.814	81%	0.809	S	S	*	*			trans	-80.8	158.1	177.2	0	0	0	0	0	113.4
284	S	31.7	Very low	36.9	Very low	120 Å²	120	130.4 Å²	130.4	84%	0.839	81%	0.813	S	S	*	*				-158.2	144.8	125.9	85.3	0	0	0	0	109.7
285	D	36.7	Very low	36.7	Very low	152 Å²	152	128.5 Å²	128.5	81%	0.813	82%	0.816	S	S	*	*			trans	-53.3	147.2	171.6	-61.7	-55.4	0	0	0	112.1
286	D	33.7	Very low	36.3	Very low	164 Å²	164	122.6 Å²	122.6	88%	0.877	82%	0.815	S	S	*	*				-157.7	144.6	122.2	-119.3	-25	0	0	0	113.2
287	D	35.2	Very low	35.9	Very low	131 Å²	131	120.3 Å²	120.3	70%	0.701	82%	0.818	S	S	*	*			trans	-66	151.6	-177.9	-173.3	19.3	0	0	0	112.7
288	T	34	Very low	35.8	Very low	120 Å²	120	123.6 Å²	123.6	74%	0.736	82%	0.822	S	S	*	*				153.9	126.3	126.6	46.5	0	0	0	0	113.6
289	S	36.4	Very low	35.4	Very low	91 Å²	91	127.8 Å²	127.8	64%	0.636	83%	0.831	S	S	*	*			trans	-34.1	149.4	157.9	51.3	0	0	0	0	116.2
290	L	34.9	Very low	35	Very low	150 Å²	150	130.1 Å²	130.1	79%	0.785	83%	0.83	S	S	*	*				174.5	132.4	111.3	-90.2	154.6	0	0	0	112.1
291	T	41.4	Very low	34.9	Very low	202 Å²	202	134.5 Å²	134.5	100%	1.239	83%	0.829	S	S	*	*			trans	53.8	0	150	55.5	0	0	0	0	120.7

Retrieved 291 of 291 residues in 398.1 ms (Link to these results)

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