A0A060WXM8_ONCMY Loading...

Activator of 90 kDa heat shock protein ATPase homolog 1

Acts as a co-chaperone of HSP90AA1. Activates the ATPase activity of HSP90AA1 leading to increase in its chaperone activity. Competes with the inhibitory co-chaperone FNIP1 for binding to HSP90AA1, thereby providing a reciprocal regulatory mechanism for chaperoning of client proteins. Competes with the inhibitory co-chaperone TSC1 for binding to HSP90AA1, thereby providing a reciprocal regulatory mechanism for chaperoning of client proteins.

AlphaFold DB , UniProt , Accession A0A060WXM8, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene ahsa1a, Length 338 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.9	Very low	46.6	Very low	242 Å²	242	147.9 Å²	147.9	100%	1.192	76%	0.758	S	S	*	*				0	132.9	0	-58.4	174	-164.1	0	0	107.1
2	A	43	Very low	46	Very low	79 Å²	79	144.7 Å²	144.7	65%	0.653	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-68.6	152.4	171.2	0	0	0	0	0	109.8
3	K	45	Very low	46.3	Very low	159 Å²	159	143.7 Å²	143.7	69%	0.691	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-78.1	138.1	176.6	-74.8	-178.6	178.7	175.4	0	110	G5 E6	K3-G5 PolarHBondContact O-N 3.42Å; K3-E6 PolarHBondContact O-N 2.64Å
4	W	34.8	Very low	46.2	Very low	267 Å²	267	141.7 Å²	141.7	100%	1.011	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	123.1	176.1	-175.4	-92	0	0	0	110.7
5	G	54.5	Low	45.8	Very low	77 Å²	77	144.9 Å²	144.9	79%	0.794	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	100.1	-13.1	178.8	0	0	0	0	0	115.9	K3	K3-G5 PolarHBondContact O-N 3.42Å
6	E	52.1	Low	45.4	Very low	143 Å²	143	146.2 Å²	146.2	67%	0.668	74%	0.735	S	S	*	*			trans	-105.7	105.9	170.2	-70.9	-178.2	142.9	0	0	109.2	K3 D8	K3-E6 PolarHBondContact O-N 2.64Å; E6-D8 PolarHBondContact O-N 2.88Å
7	G	48.8	Very low	45	Very low	72 Å²	72	144.6 Å²	144.6	74%	0.742	75%	0.75	S	S	*	*			trans	-64.3	121.6	175	0	0	0	0	0	110.9
8	D	46.2	Very low	45.1	Very low	49 Å²	49	142 Å²	142	26%	0.262	74%	0.737	S	S	.	*			trans	-64.9	125.7	174.6	-174.1	-31.5	0	0	0	108.7	E6 R10 W11	E6-D8 PolarHBondContact O-N 2.88Å; D8-R10 PolarHBondContact O-N 3.05Å; D8-R10 VanDerWaalsContact OD1-CB 3.27Å; D8-R10 WeakPolarHBondContact OD1-CB 3.19Å; D8-R10 WeakPolarHBondContact OD1-CG 3.38Å; D8-R10 PolarHBondContact OD1-N 3.1Å; D8-R10 IonicContact OD2-NH1 3.96Å; D8-W11 WeakPolarHBondContact O-CA 3.44Å; D8-W11 PolarHBondContact O-N 3.07Å
9	P	49.6	Very low	45	Very low	107 Å²	107	139.7 Å²	139.7	70%	0.695	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-10.9	178.6	23.5	-33.2	0	0	0	114.2	W11 I12	P9-W11 VanDerWaalsContact C-N 3.29Å; P9-I12 HydrophobicContact CB-CD1 4.24Å
10	R	49.5	Very low	45	Very low	214 Å²	214	136.1 Å²	136.1	81%	0.808	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-11	168.6	-61.6	172.2	177.4	135.8	-4.4	114.2	D8	D8-R10 PolarHBondContact O-N 3.05Å; D8-R10 VanDerWaalsContact OD1-CB 3.27Å; D8-R10 WeakPolarHBondContact OD1-CB 3.19Å; D8-R10 WeakPolarHBondContact OD1-CG 3.38Å; D8-R10 PolarHBondContact OD1-N 3.1Å; D8-R10 IonicContact OD2-NH1 3.96Å
11	W	43.8	Very low	45	Very low	218 Å²	218	130.7 Å²	130.7	83%	0.826	70%	0.696	S	S	*	*	S	Bend	trans	-117.6	11.7	-174.5	-76.9	69.9	0	0	0	113.1	D8 P9 V13	D8-W11 WeakPolarHBondContact O-CA 3.44Å; D8-W11 PolarHBondContact O-N 3.07Å; P9-W11 VanDerWaalsContact C-N 3.29Å; W11-V13 PolarHBondContact O-N 3.01Å
12	I	40.1	Very low	44.9	Very low	109 Å²	109	123.9 Å²	123.9	56%	0.559	67%	0.668	S	S	*	*			trans	-73.3	91.9	173.9	-62.1	173.7	0	0	0	108.9	P9 E14	P9-I12 HydrophobicContact CB-CD1 4.24Å; I12-E14 HydrophobicContact CG2-CB 4.11Å; I12-E14 HydrophobicContact CG2-CG 3.69Å; I12-E14 PolarHBondContact O-N 2.94Å
13	V	49.2	Very low	44.9	Very low	132 Å²	132	125.4 Å²	125.4	80%	0.8	67%	0.665	S	S	*	*			trans	-80.4	79.8	157.1	-175.7	0	0	0	0	106.9	W11 E15	W11-V13 PolarHBondContact O-N 3.01Å; V13-E15 PolarHBondContact O-N 2.91Å
14	E	44.8	Very low	45	Very low	116 Å²	116	118.2 Å²	118.2	54%	0.542	63%	0.634	S	S	.	*			trans	-69.1	105.8	161.8	-97.5	-178	175.9	0	0	107.5	I12 R16	I12-E14 HydrophobicContact CG2-CB 4.11Å; I12-E14 HydrophobicContact CG2-CG 3.69Å; I12-E14 PolarHBondContact O-N 2.94Å; E14-R16 VanDerWaalsContact C-N 3.27Å; E14-R16 HydrophobicContact CB-CG 4.09Å; E14-R16 PolarHBondContact O-N 3.13Å; E14-R16 IonicContact OE2-CZ 3.19Å; E14-R16 IonicContact OE2-NE 2.69Å; E14-R16 PolarHBondContact OE2-NE 2.88Å; E14-R16 IonicContact OE2-NH2 2.72Å; E14-R16 PolarHBondContact OE2-NH2 2.65Å
15	E	40.2	Very low	45.5	Very low	190 Å²	190	113.8 Å²	113.8	89%	0.888	62%	0.617	S	S	*	*			trans	-64.5	92.7	161.8	-77.3	-169.4	138	0	0	108.7	V13	V13-E15 PolarHBondContact O-N 2.91Å
16	R	39.5	Very low	45.2	Very low	165 Å²	165	116.1 Å²	116.1	62%	0.623	61%	0.607	S	S	*	*			trans	-88.4	138	171.3	-62.1	-172.8	175.9	-167.2	-2.4	109.7	E14 D18	E14-R16 VanDerWaalsContact C-N 3.27Å; E14-R16 HydrophobicContact CB-CG 4.09Å; E14-R16 PolarHBondContact O-N 3.13Å; E14-R16 IonicContact OE2-CZ 3.19Å; E14-R16 IonicContact OE2-NE 2.69Å; E14-R16 PolarHBondContact OE2-NE 2.88Å; E14-R16 IonicContact OE2-NH2 2.72Å; E14-R16 PolarHBondContact OE2-NH2 2.65Å; R16-D18 WeakPolarHBondContact CB-OD1 3.44Å; R16-D18 PolarHBondContact O-N 3.46Å
17	A	38.8	Very low	45.1	Very low	120 Å²	120	115.7 Å²	115.7	99%	0.992	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	5.6	-174.9	0	0	0	0	0	114.7
18	D	47.6	Very low	45.7	Very low	97 Å²	97	114.9 Å²	114.9	52%	0.519	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.7	-6.6	-177.5	65.6	-35.8	0	0	0	114	R16 T20	R16-D18 WeakPolarHBondContact CB-OD1 3.44Å; R16-D18 PolarHBondContact O-N 3.46Å; D18-T20 VanDerWaalsContact CG-OG1 3.3Å; D18-T20 PolarHBondContact O-N 3Å; D18-T20 WeakPolarHBondContact OD2-CB 3.27Å; D18-T20 PolarHBondContact OD2-OG1 3.42Å
19	A	41.9	Very low	47.2	Very low	99 Å²	99	117.7 Å²	117.7	82%	0.818	59%	0.592	S	S	*	*			trans	54.1	24.9	177	0	0	0	0	0	115.1
20	T	46.4	Very low	48.7	Very low	67 Å²	67	119.8 Å²	119.8	41%	0.411	59%	0.586	S	S	.	*			trans	-73.9	128.1	-178.6	-55.2	0	0	0	0	110.8	D18 V22 L165	D18-T20 VanDerWaalsContact CG-OG1 3.3Å; D18-T20 PolarHBondContact O-N 3Å; D18-T20 WeakPolarHBondContact OD2-CB 3.27Å; D18-T20 PolarHBondContact OD2-OG1 3.42Å; T20-V22 VanDerWaalsContact C-N 3.27Å; T20-V22 VanDerWaalsContact O-CG2 3.32Å; T20-V22 WeakPolarHBondContact O-CG2 3.45Å; T20-V22 PolarHBondContact O-N 3.29Å; T20-L165 HydrophobicContact CG2-CD1 4.26Å
21	N	44.8	Very low	50.3	Low	22 Å²	22	115.1 Å²	115.1	12%	0.118	58%	0.577	C	S	.	*			trans	-72	73.2	-179	-173.6	5.9	0	0	0	112.7	N23 N24 W25 H26 T28 L165	N21-N23 PolarHBondContact O-N 3.19Å; N21-N24 PolarHBondContact O-N 3.14Å; N21-N24 VanDerWaalsContact O-N 3.14Å; N21-W25 PolarHBondContact OD1-N 2.9Å; N21-H26 PolarHBondContact ND2-O 3.43Å; N21-H26 PolarHBondContact OD1-N 3.08Å; N21-T28 HydrophobicContact CB-CG2 4.35Å; N21-T28 VanDerWaalsContact ND2-CG2 3.3Å; N21-T28 WeakPolarHBondContact ND2-CG2 3.39Å; N21-L165 HydrophobicContact CB-CD1 4.27Å; N21-L165 WeakPolarHBondContact O-CD1 3.49Å
22	V	41.7	Very low	52.4	Low	100 Å²	100	104.9 Å²	104.9	61%	0.606	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-55.9	126.5	-180	-155.8	0	0	0	0	110	T20 N24	T20-V22 VanDerWaalsContact C-N 3.27Å; T20-V22 VanDerWaalsContact O-CG2 3.32Å; T20-V22 WeakPolarHBondContact O-CG2 3.45Å; T20-V22 PolarHBondContact O-N 3.29Å; V22-N24 VanDerWaalsContact C-N 3.33Å; V22-N24 PolarHBondContact O-N 3.45Å
23	N	44.2	Very low	54.6	Low	110 Å²	110	101.2 Å²	101.2	59%	0.588	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	66.1	13	-178.3	-54.3	-45	0	0	0	117.5	N21 W25	N21-N23 PolarHBondContact O-N 3.19Å; N23-W25 PolarHBondContact O-N 3.03Å; N23-W25 VanDerWaalsContact O-N 3.17Å
24	N	46.3	Very low	56.3	Low	8 Å²	8	97 Å²	97	4%	0.043	50%	0.504	C	S	.	.	G	3₁₀ helix	trans	53.2	33.6	179	-53.2	-60.9	0	0	0	113.6	N21 V22 N72 K74	N21-N24 PolarHBondContact O-N 3.14Å; N21-N24 VanDerWaalsContact O-N 3.14Å; V22-N24 VanDerWaalsContact C-N 3.33Å; V22-N24 PolarHBondContact O-N 3.45Å; N24-N72 PolarHBondContact OD1-ND2 3.38Å; N24-K74 PolarHBondContact O-N 3.46Å; N24-K74 VanDerWaalsContact O-N 3.14Å
25	W	45.3	Very low	58.3	Low	175 Å²	175	94.8 Å²	94.8	66%	0.663	49%	0.491	S	S	*	.			trans	-85.8	-30.8	-174.9	-167.1	-100.3	0	0	0	112.7	N21 N23 K74	N21-W25 PolarHBondContact OD1-N 2.9Å; N23-W25 PolarHBondContact O-N 3.03Å; N23-W25 VanDerWaalsContact O-N 3.17Å; W25-K74 HydrophobicContact CE3-CG 4.45Å; W25-K74 HydrophobicContact CZ3-CD 4.47Å
26	H	48.8	Very low	60.7	Low	126 Å²	126	85.8 Å²	85.8	58%	0.583	45%	0.449	S	S	*	.	S	Bend	trans	-84.9	144.8	175	-60.8	93.1	0	0	0	110.7	N21 T28	N21-H26 PolarHBondContact ND2-O 3.43Å; N21-H26 PolarHBondContact OD1-N 3.08Å; H26-T28 PolarHBondContact O-N 3.09Å
27	W	50.6	Low	63.1	Low	134 Å²	134	79.2 Å²	79.2	51%	0.508	43%	0.427	S	S	.	.			trans	-61	121.6	174	-176.6	-83.4	0	0	0	109.4	N71	W27-N71 HydrophobicContact CH2-CB 4.24Å; W27-N71 HydrophobicContact CZ2-CB 3.91Å; W27-N71 VanDerWaalsContact CZ2-CG 3.4Å; W27-N71 WeakPolarHBondContact CZ2-OD1 3.27Å; W27-N71 PolarHBondContact NE1-OD1 3.06Å
28	T	61.3	Low	65.3	Low	54 Å²	54	78.6 Å²	78.6	33%	0.331	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	112.6	169.7	52.9	0	0	0	0	108.9	N21 H26 N72	N21-T28 HydrophobicContact CB-CG2 4.35Å; N21-T28 VanDerWaalsContact ND2-CG2 3.3Å; N21-T28 WeakPolarHBondContact ND2-CG2 3.39Å; H26-T28 PolarHBondContact O-N 3.09Å; T28-N72 PolarHBondContact O-N 3.49Å
29	E	77	Confident	67.4	Low	108 Å²	108	74.9 Å²	74.9	51%	0.505	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	140.7	168.1	-172.5	147.5	-140.6	0	0	109.5	S69 N71	E29-S69 WeakPolarHBondContact OE1-CB 3.32Å; E29-S69 PolarHBondContact OE1-OG 2.98Å; E29-N71 VanDerWaalsContact CA-OD1 3.27Å; E29-N71 WeakPolarHBondContact CA-OD1 3.45Å; E29-N71 WeakPolarHBondContact CB-OD1 3.34Å; E29-N71 WeakPolarHBondContact CG-OD1 3.21Å; E29-N71 PolarHBondContact OE1-ND2 3.24Å
30	R	81.3	Confident	69.7	Low	151 Å²	151	70.1 Å²	70.1	57%	0.57	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.4	125.6	157.7	-76.5	-160.8	174.3	-152	-0.7	108.9	V32 S69 I70 M163	R30-V32 HydrophobicContact CB-CG1 4.2Å; R30-S69 CarbonylContact O-C 3.58Å; R30-S69 VanDerWaalsContact O-CA 3.25Å; R30-S69 WeakPolarHBondContact O-CA 3.21Å; R30-S69 WeakPolarHBondContact O-CB 3.27Å; R30-I70 PolarHBondContact N-O 2.79Å; R30-I70 PolarHBondContact O-N 2.78Å; R30-M163 HydrophobicContact CB-CE 3.96Å; R30-M163 HydrophobicContact CG-CE 3.89Å
31	D	83.3	Confident	71.8	Confident	117 Å²	117	71.1 Å²	71.1	63%	0.626	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.5	129.5	156.6	174.8	21.3	0	0	0	109	T33	D31-T33 WeakPolarHBondContact OD1-CB 3.23Å; D31-T33 PolarHBondContact OD1-N 3.14Å; D31-T33 PolarHBondContact OD1-OG1 3.45Å
32	V	88	Confident	74	Confident	3 Å²	3	76.2 Å²	76.2	2%	0.018	37%	0.369	C	S	.	.			trans	-128.1	14.5	177.6	-47.5	0	0	0	0	111.5	R30 G34 W35 S36 A68 I70 L155 F159	R30-V32 HydrophobicContact CB-CG1 4.2Å; V32-G34 PolarHBondContact O-N 2.98Å; V32-W35 PolarHBondContact O-N 3.08Å; V32-S36 VanDerWaalsContact O-CB 3.29Å; V32-S36 WeakPolarHBondContact O-CB 3.48Å; V32-S36 PolarHBondContact O-N 2.67Å; V32-S36 PolarHBondContact O-OG 2.96Å; V32-A68 CarbonylContact C-O 3.53Å; V32-A68 HydrophobicContact CG2-CB 3.61Å; V32-A68 WeakPolarHBondContact CG2-O 3.32Å; V32-A68 PolarHBondContact N-O 2.93Å; V32-I70 HydrophobicContact CG1-CB 4.4Å; V32-I70 HydrophobicContact CG1-CD1 4.02Å; V32-I70 HydrophobicContact CG1-CG1 3.96Å; V32-I70 HydrophobicContact CG2-CD1 4.27Å; V32-I70 HydrophobicContact CG2-CG1 4.02Å; V32-L155 HydrophobicContact CG2-CD1 3.76Å; V32-F159 HydrophobicContact CB-CE1 4.17Å; V32-F159 HydrophobicContact CB-CE2 4.24Å; V32-F159 HydrophobicContact CB-CZ 4Å; V32-F159 HydrophobicContact CG1-CD1 3.75Å; V32-F159 HydrophobicContact CG1-CE1 3.19Å; V32-F159 HydrophobicContact CG1-CE2 4.09Å; V32-F159 HydrophobicContact CG1-CG 4.41Å; V32-F159 HydrophobicContact CG1-CZ 3.38Å
33	T	85.6	Confident	76.3	Confident	31 Å²	31	73.5 Å²	73.5	19%	0.19	35%	0.351	C	S	.	.	H	α-helix	trans	-58.4	-46.3	-178.6	-57	0	0	0	0	111.5	D31 S36 T37 G66 A68 W83	D31-T33 WeakPolarHBondContact OD1-CB 3.23Å; D31-T33 PolarHBondContact OD1-N 3.14Å; D31-T33 PolarHBondContact OD1-OG1 3.45Å; T33-S36 PolarHBondContact O-N 3Å; T33-T37 WeakPolarHBondContact O-CB 3.33Å; T33-T37 PolarHBondContact O-N 2.87Å; T33-T37 PolarHBondContact O-OG1 3.37Å; T33-G66 WeakPolarHBondContact CG2-O 3.35Å; T33-A68 PolarHBondContact N-O 3.25Å; T33-A68 PolarHBondContact OG1-N 2.64Å; T33-A68 PolarHBondContact OG1-O 3.29Å; T33-W83 HydrophobicContact CG2-CH2 3.71Å; T33-W83 HydrophobicContact CG2-CZ2 4.35Å; T33-W83 WeakPolarHBondContact O-CH2 3.35Å
34	G	84.3	Confident	78.6	Confident	44 Å²	44	68.5 Å²	68.5	45%	0.454	32%	0.324	S	S	.	.	H	α-helix	trans	-61.9	-49.1	177.8	0	0	0	0	0	113.1	V32 S36 T37 D38	V32-G34 PolarHBondContact O-N 2.98Å; G34-S36 VanDerWaalsContact C-N 3.32Å; G34-S36 PolarHBondContact O-N 2.84Å; G34-T37 WeakPolarHBondContact O-CB 3.39Å; G34-T37 PolarHBondContact O-N 3.26Å; G34-D38 PolarHBondContact O-N 3Å; G34-D38 VanDerWaalsContact O-N 3.14Å
35	W	88.5	Confident	80.7	Confident	70 Å²	70	72.7 Å²	72.7	27%	0.265	35%	0.346	S	S	.	.	H	α-helix	trans	-61.6	-41.5	176.4	176.7	88	0	0	0	111.9	V32 D38 K39 Y151 H154 L155 E158 F159	V32-W35 PolarHBondContact O-N 3.08Å; W35-D38 PolarHBondContact O-N 3.39Å; W35-K39 HydrophobicContact CH2-CB 4.22Å; W35-K39 HydrophobicContact CH2-CD 4.25Å; W35-K39 HydrophobicContact CH2-CG 3.91Å; W35-K39 HydrophobicContact CZ2-CB 4.27Å; W35-K39 HydrophobicContact CZ2-CD 3.86Å; W35-K39 HydrophobicContact CZ2-CG 3.99Å; W35-K39 HydrophobicContact CZ3-CB 4.35Å; W35-K39 HydrophobicContact CZ3-CG 4.46Å; W35-K39 WeakPolarHBondContact O-CB 2.91Å; W35-K39 PolarHBondContact O-N 2.89Å; W35-Y151 HydrophobicContact CZ3-CD2 4.33Å; W35-Y151 AromaticContact CZ3-CE2 3.93Å; W35-Y151 HydrophobicContact CZ3-CE2 3.93Å; W35-H154 HydrophobicContact CH2-CB 3.91Å; W35-H154 HydrophobicContact CZ2-CB 4.36Å; W35-L155 HydrophobicContact CE3-CD1 4.16Å; W35-L155 HydrophobicContact CH2-CB 4.41Å; W35-L155 HydrophobicContact CZ3-CB 4.03Å; W35-L155 HydrophobicContact CZ3-CD1 3.7Å; W35-E158 HydrophobicContact CZ2-CB 4.44Å; W35-F159 HydrophobicContact CB-CD2 4.13Å; W35-F159 HydrophobicContact CB-CE2 3.85Å; W35-F159 AromaticContact CD1-CD2 3.96Å; W35-F159 AromaticContact CD2-CD2 3.59Å; W35-F159 HydrophobicContact CD2-CD2 3.59Å; W35-F159 HydrophobicContact CD2-CE2 4.26Å; W35-F159 HydrophobicContact CD2-CG 4.47Å; W35-F159 AromaticContact CE2-CD2 3.98Å; W35-F159 HydrophobicContact CE3-CD2 4.03Å; W35-F159 AromaticContact CG-CD2 3.61Å; W35-F159 HydrophobicContact CG-CD2 3.61Å; W35-F159 AromaticContact CG-CE2 3.82Å; W35-F159 HydrophobicContact CG-CE2 3.82Å
36	S	90.1	Very high	82.7	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-65.1	-40.7	178.6	-64.1	0	0	0	0	112.1	V32 T33 G34 D38 K39 L40 Y151	V32-S36 VanDerWaalsContact O-CB 3.29Å; V32-S36 WeakPolarHBondContact O-CB 3.48Å; V32-S36 PolarHBondContact O-N 2.67Å; V32-S36 PolarHBondContact O-OG 2.96Å; T33-S36 PolarHBondContact O-N 3Å; G34-S36 VanDerWaalsContact C-N 3.32Å; G34-S36 PolarHBondContact O-N 2.84Å; S36-D38 VanDerWaalsContact C-N 3.34Å; S36-D38 PolarHBondContact O-N 2.97Å; S36-K39 PolarHBondContact O-N 2.81Å; S36-L40 VanDerWaalsContact O-CB 3.28Å; S36-L40 WeakPolarHBondContact O-CB 2.95Å; S36-L40 VanDerWaalsContact O-CG 3.31Å; S36-L40 WeakPolarHBondContact O-CG 3.13Å; S36-L40 PolarHBondContact O-N 3.27Å; S36-Y151 VanDerWaalsContact CB-OH 3.23Å; S36-Y151 WeakPolarHBondContact CB-OH 3.15Å; S36-Y151 PolarHBondContact OG-OH 3.17Å
37	T	88.8	Confident	84.7	Confident	27 Å²	27	61 Å²	61	17%	0.166	31%	0.31	C	S	.	.	H	α-helix	trans	-56.6	-48.3	174.2	-60.4	0	0	0	0	110.8	T33 G34 K41 L64 W83	T33-T37 WeakPolarHBondContact O-CB 3.33Å; T33-T37 PolarHBondContact O-N 2.87Å; T33-T37 PolarHBondContact O-OG1 3.37Å; G34-T37 WeakPolarHBondContact O-CB 3.39Å; G34-T37 PolarHBondContact O-N 3.26Å; T37-K41 HydrophobicContact CG2-CD 4.28Å; T37-K41 WeakPolarHBondContact O-CD 3.26Å; T37-K41 VanDerWaalsContact O-CG 3.27Å; T37-K41 WeakPolarHBondContact O-CG 3.25Å; T37-K41 PolarHBondContact O-N 2.97Å; T37-K41 VanDerWaalsContact O-N 3.12Å; T37-L64 HydrophobicContact CG2-CD2 4.05Å; T37-L64 WeakPolarHBondContact O-CD2 3.22Å; T37-W83 WeakPolarHBondContact OG1-CH2 3.47Å
38	D	86.2	Confident	86.7	Confident	107 Å²	107	60.4 Å²	60.4	57%	0.572	31%	0.307	S	S	*	.	H	α-helix	trans	-70.4	-41.2	-178.9	-69.2	-21.4	0	0	0	111.9	G34 W35 S36 K41 E42	G34-D38 PolarHBondContact O-N 3Å; G34-D38 VanDerWaalsContact O-N 3.14Å; W35-D38 PolarHBondContact O-N 3.39Å; S36-D38 VanDerWaalsContact C-N 3.34Å; S36-D38 PolarHBondContact O-N 2.97Å; D38-K41 PolarHBondContact O-N 2.87Å; D38-E42 WeakPolarHBondContact O-CB 3.21Å; D38-E42 PolarHBondContact O-N 3.14Å
39	K	90.6	Very high	88.1	Confident	19 Å²	19	58 Å²	58	8%	0.083	29%	0.292	C	S	.	.	H	α-helix	trans	-66.1	-40.5	178	-164.4	77.7	-172.3	-170.7	0	112.4	W35 S36 K41 E42 L43 Y151 E158	W35-K39 HydrophobicContact CH2-CB 4.22Å; W35-K39 HydrophobicContact CH2-CD 4.25Å; W35-K39 HydrophobicContact CH2-CG 3.91Å; W35-K39 HydrophobicContact CZ2-CB 4.27Å; W35-K39 HydrophobicContact CZ2-CD 3.86Å; W35-K39 HydrophobicContact CZ2-CG 3.99Å; W35-K39 HydrophobicContact CZ3-CB 4.35Å; W35-K39 HydrophobicContact CZ3-CG 4.46Å; W35-K39 WeakPolarHBondContact O-CB 2.91Å; W35-K39 PolarHBondContact O-N 2.89Å; S36-K39 PolarHBondContact O-N 2.81Å; K39-K41 VanDerWaalsContact C-N 3.34Å; K39-E42 WeakPolarHBondContact CD-OE2 3.42Å; K39-E42 IonicContact NZ-OE2 3.59Å; K39-E42 PolarHBondContact O-N 2.83Å; K39-L43 HydrophobicContact CG-CD1 3.99Å; K39-L43 WeakPolarHBondContact O-CB 3.34Å; K39-L43 WeakPolarHBondContact O-CD1 3.12Å; K39-L43 VanDerWaalsContact O-CG 3.27Å; K39-L43 WeakPolarHBondContact O-CG 3.41Å; K39-L43 PolarHBondContact O-N 3.36Å; K39-Y151 HydrophobicContact CB-CD2 4.32Å; K39-Y151 HydrophobicContact CG-CD2 4.32Å; K39-E158 IonicContact NZ-OE1 2.81Å; K39-E158 IonicContact NZ-OE2 2.68Å; K39-E158 PolarHBondContact NZ-OE2 3.42Å
40	L	91.8	Very high	88.8	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.3	-37.9	174.7	-77.2	166.8	0	0	0	111.4	S36 L44 L64 W83 L108 L148 Y151	S36-L40 VanDerWaalsContact O-CB 3.28Å; S36-L40 WeakPolarHBondContact O-CB 2.95Å; S36-L40 VanDerWaalsContact O-CG 3.31Å; S36-L40 WeakPolarHBondContact O-CG 3.13Å; S36-L40 PolarHBondContact O-N 3.27Å; L40-L44 VanDerWaalsContact O-CB 3.32Å; L40-L44 WeakPolarHBondContact O-CB 3.44Å; L40-L44 VanDerWaalsContact O-CG 3.31Å; L40-L44 WeakPolarHBondContact O-CG 3.33Å; L40-L44 PolarHBondContact O-N 2.82Å; L40-L44 VanDerWaalsContact O-N 3.13Å; L40-L64 HydrophobicContact CB-CD1 4.47Å; L40-L64 HydrophobicContact CB-CD2 3.88Å; L40-L64 HydrophobicContact CD1-CD1 4.07Å; L40-W83 HydrophobicContact CD1-CD2 3.77Å; L40-W83 HydrophobicContact CD1-CE3 4.24Å; L40-W83 HydrophobicContact CD1-CG 3.91Å; L40-L108 HydrophobicContact CD2-CD2 4.3Å; L40-L148 HydrophobicContact CD2-CD2 3.57Å; L40-Y151 HydrophobicContact CD1-CD1 4.36Å; L40-Y151 HydrophobicContact CD1-CD2 4.49Å; L40-Y151 HydrophobicContact CD1-CE1 4.22Å; L40-Y151 HydrophobicContact CD1-CE2 4.37Å; L40-Y151 HydrophobicContact CD1-CG 4.48Å; L40-Y151 HydrophobicContact CD2-CD1 3.7Å; L40-Y151 HydrophobicContact CD2-CD2 4.1Å; L40-Y151 HydrophobicContact CD2-CE1 4.37Å; L40-Y151 HydrophobicContact CD2-CG 3.53Å; L40-Y151 HydrophobicContact CG-CD1 4.14Å; L40-Y151 HydrophobicContact CG-CD2 3.86Å; L40-Y151 HydrophobicContact CG-CE1 4.44Å; L40-Y151 HydrophobicContact CG-CE2 4.19Å; L40-Y151 HydrophobicContact CG-CG 3.83Å
41	K	90.1	Very high	89.1	Confident	87 Å²	87	52.9 Å²	52.9	38%	0.378	28%	0.283	S	S	.	.	H	α-helix	trans	-64.3	-45.9	171.8	-72.8	167.8	-175.4	170.4	0	112.1	T37 D38 K39 L43 L44 L45 I61 L64	T37-K41 HydrophobicContact CG2-CD 4.28Å; T37-K41 WeakPolarHBondContact O-CD 3.26Å; T37-K41 VanDerWaalsContact O-CG 3.27Å; T37-K41 WeakPolarHBondContact O-CG 3.25Å; T37-K41 PolarHBondContact O-N 2.97Å; T37-K41 VanDerWaalsContact O-N 3.12Å; D38-K41 PolarHBondContact O-N 2.87Å; K39-K41 VanDerWaalsContact C-N 3.34Å; K41-L43 VanDerWaalsContact C-N 3.31Å; K41-L43 PolarHBondContact O-N 2.87Å; K41-L44 PolarHBondContact O-N 3.14Å; K41-L45 WeakPolarHBondContact O-CB 3.32Å; K41-L45 PolarHBondContact O-N 3.37Å; K41-I61 HydrophobicContact CB-CD1 4.36Å; K41-I61 HydrophobicContact CG-CD1 4.19Å; K41-L64 HydrophobicContact CG-CD2 4.04Å
42	E	89.4	Confident	89.1	Confident	130 Å²	130	51.5 Å²	51.5	61%	0.607	28%	0.28	S	S	*	.	H	α-helix	trans	-56.4	-43.4	176.8	-171.8	-166.3	168.8	0	0	112.1	D38 K39	D38-E42 WeakPolarHBondContact O-CB 3.21Å; D38-E42 PolarHBondContact O-N 3.14Å; K39-E42 WeakPolarHBondContact CD-OE2 3.42Å; K39-E42 IonicContact NZ-OE2 3.59Å; K39-E42 PolarHBondContact O-N 2.83Å
43	L	91.8	Very high	88.8	Confident	42 Å²	42	54.9 Å²	54.9	22%	0.22	30%	0.296	C	S	.	.	H	α-helix	trans	-80	-25.7	-174.8	-70.4	166.6	0	0	0	114.3	K39 K41 A147	K39-L43 HydrophobicContact CG-CD1 3.99Å; K39-L43 WeakPolarHBondContact O-CB 3.34Å; K39-L43 WeakPolarHBondContact O-CD1 3.12Å; K39-L43 VanDerWaalsContact O-CG 3.27Å; K39-L43 WeakPolarHBondContact O-CG 3.41Å; K39-L43 PolarHBondContact O-N 3.36Å; K41-L43 VanDerWaalsContact C-N 3.31Å; K41-L43 PolarHBondContact O-N 2.87Å; L43-A147 HydrophobicContact CB-CB 4.33Å
44	L	91.6	Very high	89	Confident	5 Å²	5	54 Å²	54	3%	0.026	29%	0.293	C	S	.	.	H	α-helix	trans	-101.4	-32.6	-176.2	-66.4	173.6	0	0	0	113.5	L40 K41 L47 V58 I61 V85 V144 A147 L148	L40-L44 VanDerWaalsContact O-CB 3.32Å; L40-L44 WeakPolarHBondContact O-CB 3.44Å; L40-L44 VanDerWaalsContact O-CG 3.31Å; L40-L44 WeakPolarHBondContact O-CG 3.33Å; L40-L44 PolarHBondContact O-N 2.82Å; L40-L44 VanDerWaalsContact O-N 3.13Å; K41-L44 PolarHBondContact O-N 3.14Å; L44-L47 HydrophobicContact CD2-CD1 4.29Å; L44-L47 WeakPolarHBondContact O-CB 3.37Å; L44-L47 PolarHBondContact O-N 2.93Å; L44-V58 VanDerWaalsContact O-CB 3.26Å; L44-V58 WeakPolarHBondContact O-CB 3.49Å; L44-V58 VanDerWaalsContact O-CG1 3.26Å; L44-V58 WeakPolarHBondContact O-CG1 3.4Å; L44-I61 HydrophobicContact CB-CD1 3.68Å; L44-V85 HydrophobicContact CD1-CG1 3.79Å; L44-V144 HydrophobicContact CD2-CG1 4.09Å; L44-A147 HydrophobicContact CD2-CB 3.94Å; L44-L148 HydrophobicContact CD1-CD2 4Å; L44-L148 HydrophobicContact CD2-CD2 4.23Å; L44-L148 HydrophobicContact CG-CD2 4.44Å
45	L	90.1	Very high	89.4	Confident	97 Å²	97	53.7 Å²	53.7	51%	0.508	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	134.1	-179.7	-162.1	98.9	0	0	0	110.6	K41 L47 I61	K41-L45 WeakPolarHBondContact O-CB 3.32Å; K41-L45 PolarHBondContact O-N 3.37Å; L45-L47 PolarHBondContact O-N 2.99Å; L45-I61 HydrophobicContact CB-CD1 4.38Å; L45-I61 HydrophobicContact CD1-CG1 4.5Å
46	G	87.4	Confident	89.5	Confident	37 Å²	37	50.4 Å²	50.4	38%	0.381	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	6.8	-174.9	0	0	0	0	0	114.1	R48 V58	G46-R48 PolarHBondContact O-N 3.41Å; G46-V58 WeakPolarHBondContact CA-O 3.31Å; G46-V58 PolarHBondContact N-O 2.7Å
47	L	91.1	Very high	89.7	Confident	19 Å²	19	53.8 Å²	53.8	10%	0.099	29%	0.287	C	S	.	.			trans	-62.4	109.7	175.5	-175.2	159.3	0	0	0	109.6	L44 L45 V49 E57 V58 K143 V144 A147	L44-L47 HydrophobicContact CD2-CD1 4.29Å; L44-L47 WeakPolarHBondContact O-CB 3.37Å; L44-L47 PolarHBondContact O-N 2.93Å; L45-L47 PolarHBondContact O-N 2.99Å; L47-V49 HydrophobicContact CD2-CG2 4.08Å; L47-E57 WeakPolarHBondContact O-CA 3.4Å; L47-V58 HydrophobicContact CB-CB 4.26Å; L47-V58 HydrophobicContact CB-CG2 4.09Å; L47-V58 HydrophobicContact CD2-CG2 4.37Å; L47-V58 PolarHBondContact O-N 2.77Å; L47-K143 HydrophobicContact CD1-CB 4.29Å; L47-K143 HydrophobicContact CD2-CB 3.82Å; L47-K143 HydrophobicContact CD2-CD 4.35Å; L47-K143 HydrophobicContact CG-CB 4.35Å; L47-V144 HydrophobicContact CD1-CG2 4.1Å; L47-V144 HydrophobicContact CD2-CG2 4.38Å; L47-A147 HydrophobicContact CD1-CB 3.95Å
48	R	92.1	Very high	89.9	Confident	121 Å²	121	52.5 Å²	52.5	46%	0.457	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	136.3	-173.4	-175.8	169.9	169.1	150.9	-9.7	113.1	G46 E50 C56 E57 K143	G46-R48 PolarHBondContact O-N 3.41Å; R48-E50 HydrophobicContact CG-CG 4.29Å; R48-E50 IonicContact CZ-OE1 3.17Å; R48-E50 IonicContact NE-OE1 2.7Å; R48-E50 PolarHBondContact NE-OE1 3.21Å; R48-E50 IonicContact NH2-OE1 3.62Å; R48-E50 PolarHBondContact NH2-OE1 2.81Å; R48-C56 CarbonylContact C-O 3.51Å; R48-C56 WeakPolarHBondContact CA-O 3.27Å; R48-E57 HydrophobicContact CB-CG 4.37Å; R48-E57 IonicContact NH1-OE2 3.63Å; R48-K143 PolarHBondContact O-NZ 2.78Å
49	V	92.1	Very high	90.1	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.012	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	132.2	177.8	-173.9	0	0	0	0	107.9	L47 S55 C56 L135 M136 E139 K143	L47-V49 HydrophobicContact CD2-CG2 4.08Å; V49-S55 CarbonylContact O-C 3.58Å; V49-S55 WeakPolarHBondContact O-CA 3.34Å; V49-C56 PolarHBondContact N-O 3.21Å; V49-C56 PolarHBondContact O-N 2.85Å; V49-L135 HydrophobicContact CG1-CD1 4.16Å; V49-L135 HydrophobicContact CG1-CD2 4.42Å; V49-L135 HydrophobicContact CG1-CG 4Å; V49-M136 HydrophobicContact CB-SD 4.02Å; V49-M136 HydrophobicContact CG2-SD 3.7Å; V49-E139 HydrophobicContact CG1-CB 3.98Å; V49-K143 HydrophobicContact CG2-CD 4.25Å
50	E	91	Very high	90	Very high	124 Å²	124	53.4 Å²	53.4	58%	0.579	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.7	143.9	177.4	-59.3	-167.7	152.7	0	0	109.6	R48	R48-E50 HydrophobicContact CG-CG 4.29Å; R48-E50 IonicContact CZ-OE1 3.17Å; R48-E50 IonicContact NE-OE1 2.7Å; R48-E50 PolarHBondContact NE-OE1 3.21Å; R48-E50 IonicContact NH2-OE1 3.62Å; R48-E50 PolarHBondContact NH2-OE1 2.81Å
51	G	86.7	Confident	90	Very high	29 Å²	29	54.1 Å²	54.1	30%	0.299	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	-177.5	-179.7	0	0	0	0	0	112.9	E53 G54	G51-E53 PolarHBondContact O-N 2.81Å; G51-E53 VanDerWaalsContact O-N 3.08Å; G51-G54 PolarHBondContact N-O 3.4Å; G51-G54 PolarHBondContact O-N 2.76Å
52	P	83.5	Confident	89.7	Confident	88 Å²	88	54 Å²	54	57%	0.571	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-7.9	179.5	28.5	-35.6	0	0	0	114	K94	P52-K94 VanDerWaalsContact O-CD 3.23Å; P52-K94 WeakPolarHBondContact O-CD 3.35Å; P52-K94 WeakPolarHBondContact O-CE 3.44Å; P52-K94 PolarHBondContact O-NZ 2.85Å
53	E	83	Confident	89.7	Confident	74 Å²	74	49.9 Å²	49.9	35%	0.346	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-25	178	-56.2	-51.1	124.2	0	0	113	G51 K94 T131 L132	G51-E53 PolarHBondContact O-N 2.81Å; G51-E53 VanDerWaalsContact O-N 3.08Å; E53-K94 PolarHBondContact O-N 2.98Å; E53-K94 VanDerWaalsContact O-N 3.14Å; E53-T131 WeakPolarHBondContact OE2-CB 3.34Å; E53-T131 PolarHBondContact OE2-OG1 3.37Å; E53-L132 HydrophobicContact CB-CD2 3.99Å
54	G	89.4	Confident	89.6	Confident	13 Å²	13	48.9 Å²	48.9	13%	0.134	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	149.2	-157.2	-175	0	0	0	0	0	112.1	G51 T92	G51-G54 PolarHBondContact N-O 3.4Å; G51-G54 PolarHBondContact O-N 2.76Å; G54-T92 WeakPolarHBondContact CA-O 3.08Å
55	S	91.5	Very high	89.5	Confident	36 Å²	36	53.1 Å²	53.1	25%	0.252	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	141.2	176.9	58.4	0	0	0	0	111.4	V49 G91 T92	V49-S55 CarbonylContact O-C 3.58Å; V49-S55 WeakPolarHBondContact O-CA 3.34Å; S55-G91 CarbonylContact O-C 3.59Å; S55-G91 VanDerWaalsContact O-CA 3.31Å; S55-G91 WeakPolarHBondContact O-CA 3.36Å; S55-T92 PolarHBondContact N-O 2.88Å; S55-T92 PolarHBondContact O-N 2.87Å
56	C	92	Very high	89.5	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.007	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	146.3	176	-60.9	0	0	0	0	110.1	R48 V49 W89 T90 M136	R48-C56 CarbonylContact C-O 3.51Å; R48-C56 WeakPolarHBondContact CA-O 3.27Å; V49-C56 PolarHBondContact N-O 3.21Å; V49-C56 PolarHBondContact O-N 2.85Å; C56-W89 HydrophobicContact CB-CE3 3.97Å; C56-W89 HydrophobicContact CB-CZ3 4.32Å; C56-T90 CarbonylContact C-O 3.56Å; C56-T90 VanDerWaalsContact CA-O 3.31Å; C56-T90 WeakPolarHBondContact CA-O 3.24Å; C56-M136 HydrophobicContact CB-CG 3.69Å; C56-M136 HydrophobicContact CB-SD 3.37Å; C56-M136 WeakPolarHBondContact CB-SD 3.31Å
57	E	92.9	Very high	89.6	Confident	71 Å²	71	55.1 Å²	55.1	33%	0.332	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	133.4	-176.4	-168.9	173.2	141.5	0	0	110	L47 R48 T59 W89 T90	L47-E57 WeakPolarHBondContact O-CA 3.4Å; R48-E57 HydrophobicContact CB-CG 4.37Å; R48-E57 IonicContact NH1-OE2 3.63Å; E57-T59 PolarHBondContact O-N 2.98Å; E57-W89 CarbonylContact O-C 3.55Å; E57-W89 VanDerWaalsContact O-CA 3.24Å; E57-W89 WeakPolarHBondContact O-CA 3.38Å; E57-T90 PolarHBondContact N-O 2.93Å; E57-T90 PolarHBondContact O-N 2.97Å
58	V	93.8	Very high	89.6	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	118.5	173.3	177.5	0	0	0	0	109	L44 G46 L47 A87 T88 I103	L44-V58 VanDerWaalsContact O-CB 3.26Å; L44-V58 WeakPolarHBondContact O-CB 3.49Å; L44-V58 VanDerWaalsContact O-CG1 3.26Å; L44-V58 WeakPolarHBondContact O-CG1 3.4Å; G46-V58 WeakPolarHBondContact CA-O 3.31Å; G46-V58 PolarHBondContact N-O 2.7Å; L47-V58 HydrophobicContact CB-CB 4.26Å; L47-V58 HydrophobicContact CB-CG2 4.09Å; L47-V58 HydrophobicContact CD2-CG2 4.37Å; L47-V58 PolarHBondContact O-N 2.77Å; V58-A87 HydrophobicContact CG1-CB 3.94Å; V58-T88 CarbonylContact C-O 3.49Å; V58-T88 WeakPolarHBondContact CA-O 3.49Å; V58-I103 HydrophobicContact CG2-CD1 3.84Å
59	T	90.3	Very high	89.4	Confident	61 Å²	61	49.4 Å²	49.4	37%	0.374	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	-24.5	-168.8	45.7	0	0	0	0	115.2	E57 T88 T90	E57-T59 PolarHBondContact O-N 2.98Å; T59-T88 PolarHBondContact N-O 3.36Å; T59-T88 PolarHBondContact OG1-OG1 2.82Å; T59-T90 HydrophobicContact CG2-CG2 3.89Å; T59-T90 WeakPolarHBondContact CG2-OG1 3.44Å
60	D	89.1	Confident	89.2	Confident	83 Å²	83	49.3 Å²	49.3	44%	0.444	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	155.9	-179.1	-178.3	35.4	0	0	0	110.4	A87 T88	D60-A87 CarbonylContact O-C 3.46Å; D60-A87 WeakPolarHBondContact O-CA 3.4Å; D60-T88 WeakPolarHBondContact CB-OG1 3.34Å; D60-T88 PolarHBondContact N-OG1 2.8Å; D60-T88 PolarHBondContact O-N 3.09Å
61	I	91.8	Very high	88.8	Confident	15 Å²	15	43.5 Å²	43.5	8%	0.077	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	77.3	-179.6	-54.2	166.7	0	0	0	107.5	K41 L44 L45 N63 L64 V85 K86 A87	K41-I61 HydrophobicContact CB-CD1 4.36Å; K41-I61 HydrophobicContact CG-CD1 4.19Å; L44-I61 HydrophobicContact CB-CD1 3.68Å; L45-I61 HydrophobicContact CB-CD1 4.38Å; L45-I61 HydrophobicContact CD1-CG1 4.5Å; I61-N63 PolarHBondContact O-N 2.83Å; I61-L64 HydrophobicContact CG2-CB 4.23Å; I61-V85 HydrophobicContact CG2-CG1 4.48Å; I61-K86 CarbonylContact C-O 3.53Å; I61-A87 HydrophobicContact CG1-CB 4.13Å
62	P	83.4	Confident	88.3	Confident	84 Å²	84	42.1 Å²	42.1	55%	0.545	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	-17.3	-171.4	26.5	-38.1	0	0	0	114.5	K86 T88	P62-K86 VanDerWaalsContact CD-O 3.23Å; P62-K86 WeakPolarHBondContact CD-O 3.45Å; P62-T88 HydrophobicContact CG-CG2 4.03Å
63	N	89.3	Confident	87.6	Confident	44 Å²	44	44.6 Å²	44.6	24%	0.235	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	129.2	177.4	180	-75.6	0	0	0	109.6	I61 D65 K86	I61-N63 PolarHBondContact O-N 2.83Å; N63-D65 VanDerWaalsContact ND2-CG 3.27Å; N63-D65 PolarHBondContact ND2-OD1 2.74Å; N63-D65 PolarHBondContact ND2-OD2 3.23Å; N63-D65 PolarHBondContact OD1-OD2 2.86Å; N63-K86 HydrophobicContact CB-CB 4.03Å; N63-K86 HydrophobicContact CB-CD 4.25Å; N63-K86 HydrophobicContact CB-CG 4.02Å; N63-K86 PolarHBondContact N-O 2.85Å; N63-K86 PolarHBondContact O-N 2.94Å; N63-K86 VanDerWaalsContact O-O 3.12Å
64	L	90.4	Very high	87	Confident	21 Å²	21	47.9 Å²	47.9	11%	0.11	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	72.3	177.7	179.9	56.9	0	0	0	106.3	T37 L40 K41 I61 W83 V85	T37-L64 HydrophobicContact CG2-CD2 4.05Å; T37-L64 WeakPolarHBondContact O-CD2 3.22Å; L40-L64 HydrophobicContact CB-CD1 4.47Å; L40-L64 HydrophobicContact CB-CD2 3.88Å; L40-L64 HydrophobicContact CD1-CD1 4.07Å; K41-L64 HydrophobicContact CG-CD2 4.04Å; I61-L64 HydrophobicContact CG2-CB 4.23Å; L64-W83 HydrophobicContact CD1-CD2 4.46Å; L64-W83 HydrophobicContact CD1-CE3 3.75Å; L64-W83 HydrophobicContact CD1-CZ3 4.37Å; L64-W83 HydrophobicContact CG-CE3 3.96Å; L64-W83 HydrophobicContact CG-CZ3 4.08Å; L64-V85 HydrophobicContact CD1-CB 4.33Å; L64-V85 HydrophobicContact CD1-CG1 4.23Å; L64-V85 HydrophobicContact CD1-CG2 3.76Å
65	D	88.9	Confident	85.7	Confident	94 Å²	94	48.8 Å²	48.8	50%	0.503	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	127.6	-174.9	-64.8	-16.6	0	0	0	109	N63 N84	N63-D65 VanDerWaalsContact ND2-CG 3.27Å; N63-D65 PolarHBondContact ND2-OD1 2.74Å; N63-D65 PolarHBondContact ND2-OD2 3.23Å; N63-D65 PolarHBondContact OD1-OD2 2.86Å; D65-N84 PolarHBondContact N-O 2.81Å; D65-N84 VanDerWaalsContact N-O 3.12Å; D65-N84 PolarHBondContact O-N 3.21Å
66	G	90.6	Very high	84.8	Confident	36 Å²	36	54.3 Å²	54.3	37%	0.371	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	167.9	177.8	-176.7	0	0	0	0	0	113.1	T33 E82	T33-G66 WeakPolarHBondContact CG2-O 3.35Å; G66-E82 CarbonylContact C-O 3.55Å; G66-E82 WeakPolarHBondContact CA-O 3.21Å
67	E	89.4	Confident	84.3	Confident	141 Å²	141	55.3 Å²	55.3	66%	0.659	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.4	156.1	174.3	64.5	-178.1	-176	0	0	111.2	Y81 E82	E67-Y81 WeakPolarHBondContact O-CA 3.35Å; E67-E82 PolarHBondContact N-O 3.38Å; E67-E82 PolarHBondContact O-N 3.38Å
68	A	91.5	Very high	83.8	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.008	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	131.7	171.4	0	0	0	0	0	110.1	V32 T33 F80 W83	V32-A68 CarbonylContact C-O 3.53Å; V32-A68 HydrophobicContact CG2-CB 3.61Å; V32-A68 WeakPolarHBondContact CG2-O 3.32Å; V32-A68 PolarHBondContact N-O 2.93Å; T33-A68 PolarHBondContact N-O 3.25Å; T33-A68 PolarHBondContact OG1-N 2.64Å; T33-A68 PolarHBondContact OG1-O 3.29Å; A68-F80 CarbonylContact C-O 3.48Å; A68-F80 VanDerWaalsContact CA-O 3.29Å; A68-F80 WeakPolarHBondContact CA-O 3.33Å; A68-W83 HydrophobicContact CB-CZ2 3.97Å
69	S	86.7	Confident	83.5	Confident	18 Å²	18	57.1 Å²	57.1	13%	0.126	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	149.7	173.5	89.6	0	0	0	0	112.1	E29 R30 N71 F80	E29-S69 WeakPolarHBondContact OE1-CB 3.32Å; E29-S69 PolarHBondContact OE1-OG 2.98Å; R30-S69 CarbonylContact O-C 3.58Å; R30-S69 VanDerWaalsContact O-CA 3.25Å; R30-S69 WeakPolarHBondContact O-CA 3.21Å; R30-S69 WeakPolarHBondContact O-CB 3.27Å; S69-N71 PolarHBondContact OG-ND2 3.49Å; S69-N71 VanDerWaalsContact OG-ND2 3.16Å; S69-F80 PolarHBondContact N-O 3.45Å; S69-F80 PolarHBondContact O-N 2.85Å; S69-F80 VanDerWaalsContact O-O 3.12Å
70	I	87.3	Confident	83.4	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	121.2	176.3	-57.7	-179.7	0	0	0	108.7	R30 V32 L77 I78 Y79 L155 F159 T160 M163	R30-I70 PolarHBondContact N-O 2.79Å; R30-I70 PolarHBondContact O-N 2.78Å; V32-I70 HydrophobicContact CG1-CB 4.4Å; V32-I70 HydrophobicContact CG1-CD1 4.02Å; V32-I70 HydrophobicContact CG1-CG1 3.96Å; V32-I70 HydrophobicContact CG2-CD1 4.27Å; V32-I70 HydrophobicContact CG2-CG1 4.02Å; I70-L77 HydrophobicContact CG2-CB 4.36Å; I70-L77 HydrophobicContact CG2-CD2 4.27Å; I70-I78 WeakPolarHBondContact CA-O 3.36Å; I70-Y79 HydrophobicContact CD1-CD1 3.87Å; I70-Y79 HydrophobicContact CD1-CE1 4.01Å; I70-Y79 HydrophobicContact CG1-CD1 3.88Å; I70-Y79 HydrophobicContact CG1-CE1 4.42Å; I70-Y79 HydrophobicContact CG2-CD1 4.35Å; I70-Y79 HydrophobicContact CG2-CE1 4.4Å; I70-L155 HydrophobicContact CD1-CD1 3.94Å; I70-L155 HydrophobicContact CD1-CG 4.38Å; I70-F159 HydrophobicContact CD1-CD1 3.8Å; I70-F159 HydrophobicContact CD1-CE1 4.5Å; I70-F159 HydrophobicContact CD1-CG 4.45Å; I70-T160 HydrophobicContact CD1-CG2 4.21Å; I70-M163 HydrophobicContact CB-CE 3.92Å; I70-M163 HydrophobicContact CB-SD 4.33Å; I70-M163 HydrophobicContact CD1-SD 4.34Å; I70-M163 HydrophobicContact CG2-CE 3.69Å; I70-M163 HydrophobicContact CG2-SD 4.04Å
71	N	82.6	Confident	83.5	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	121.7	-175.9	-80.5	-70.1	0	0	0	110.5	W27 E29 S69 L77 I78 F80	W27-N71 HydrophobicContact CH2-CB 4.24Å; W27-N71 HydrophobicContact CZ2-CB 3.91Å; W27-N71 VanDerWaalsContact CZ2-CG 3.4Å; W27-N71 WeakPolarHBondContact CZ2-OD1 3.27Å; W27-N71 PolarHBondContact NE1-OD1 3.06Å; E29-N71 VanDerWaalsContact CA-OD1 3.27Å; E29-N71 WeakPolarHBondContact CA-OD1 3.45Å; E29-N71 WeakPolarHBondContact CB-OD1 3.34Å; E29-N71 WeakPolarHBondContact CG-OD1 3.21Å; E29-N71 PolarHBondContact OE1-ND2 3.24Å; S69-N71 PolarHBondContact OG-ND2 3.49Å; S69-N71 VanDerWaalsContact OG-ND2 3.16Å; N71-L77 CarbonylContact O-C 3.54Å; N71-L77 WeakPolarHBondContact O-CA 3.47Å; N71-I78 HydrophobicContact CB-CB 4.32Å; N71-I78 PolarHBondContact N-O 2.88Å; N71-I78 PolarHBondContact O-N 2.85Å; N71-F80 HydrophobicContact CB-CE2 4.45Å
72	N	76.6	Confident	83.5	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	122.9	172.8	-174.2	-11.3	0	0	0	109.9	N24 T28 G75 L77 M163	N24-N72 PolarHBondContact OD1-ND2 3.38Å; T28-N72 PolarHBondContact O-N 3.49Å; N72-G75 WeakPolarHBondContact OD1-CA 3.35Å; N72-G75 PolarHBondContact OD1-N 2.94Å; N72-L77 HydrophobicContact CB-CD2 3.65Å; N72-M163 PolarHBondContact ND2-O 2.83Å
73	R	69.8	Low	83.9	Confident	139 Å²	139	55.3 Å²	55.3	53%	0.525	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	117.2	172.4	-170.1	177.7	-173.8	-165.3	2	110	G75 K76	R73-G75 PolarHBondContact O-N 2.91Å; R73-K76 PolarHBondContact N-O 3.04Å; R73-K76 PolarHBondContact O-N 2.84Å
74	K	68.8	Low	84	Confident	143 Å²	143	55.6 Å²	55.6	62%	0.622	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	32.3	179.6	-59.2	-179.8	174.8	-179.1	0	113.4	N24 W25 K76	N24-K74 PolarHBondContact O-N 3.46Å; N24-K74 VanDerWaalsContact O-N 3.14Å; W25-K74 HydrophobicContact CE3-CG 4.45Å; W25-K74 HydrophobicContact CZ3-CD 4.47Å; K74-K76 VanDerWaalsContact C-N 3.29Å; K74-K76 PolarHBondContact O-N 2.88Å
75	G	62.1	Low	84.2	Confident	32 Å²	32	54.8 Å²	54.8	33%	0.33	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	79	3.4	-178.5	0	0	0	0	0	115.3	N72 R73	N72-G75 WeakPolarHBondContact OD1-CA 3.35Å; N72-G75 PolarHBondContact OD1-N 2.94Å; R73-G75 PolarHBondContact O-N 2.91Å
76	K	74.4	Confident	84.4	Confident	152 Å²	152	54.2 Å²	54.2	66%	0.661	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	127.9	165.4	-170.6	179.8	-179.9	-175.8	0	108.9	R73 K74	R73-K76 PolarHBondContact N-O 3.04Å; R73-K76 PolarHBondContact O-N 2.84Å; K74-K76 VanDerWaalsContact C-N 3.29Å; K74-K76 PolarHBondContact O-N 2.88Å
77	L	80.1	Confident	84.5	Confident	23 Å²	23	52.8 Å²	52.8	12%	0.12	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	135.1	169.6	-58.7	179.3	0	0	0	109.7	I70 N71 N72 Y79 T160 M163 I164	I70-L77 HydrophobicContact CG2-CB 4.36Å; I70-L77 HydrophobicContact CG2-CD2 4.27Å; N71-L77 CarbonylContact O-C 3.54Å; N71-L77 WeakPolarHBondContact O-CA 3.47Å; N72-L77 HydrophobicContact CB-CD2 3.65Å; L77-Y79 HydrophobicContact CB-CE2 4.3Å; L77-T160 VanDerWaalsContact CD1-CB 3.47Å; L77-T160 HydrophobicContact CD1-CG2 3.48Å; L77-T160 VanDerWaalsContact CD1-CG2 3.48Å; L77-M163 HydrophobicContact CD2-CB 4.44Å; L77-I164 HydrophobicContact CD1-CD1 4.27Å; L77-I164 HydrophobicContact CD1-CG1 4.33Å; L77-I164 HydrophobicContact CD2-CG1 4.19Å; L77-I164 HydrophobicContact CG-CD1 4.19Å; L77-I164 HydrophobicContact CG-CG1 4.24Å
78	I	82.8	Confident	84.7	Confident	57 Å²	57	47.7 Å²	47.7	29%	0.292	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130.8	173.7	-53.2	173	0	0	0	105.4	I70 N71 F80	I70-I78 WeakPolarHBondContact CA-O 3.36Å; N71-I78 HydrophobicContact CB-CB 4.32Å; N71-I78 PolarHBondContact N-O 2.88Å; N71-I78 PolarHBondContact O-N 2.85Å; I78-F80 HydrophobicContact CB-CE2 4.47Å; I78-F80 HydrophobicContact CG2-CD2 4.39Å; I78-F80 HydrophobicContact CG2-CE1 4.17Å; I78-F80 HydrophobicContact CG2-CE2 3.68Å; I78-F80 HydrophobicContact CG2-CZ 3.56Å
79	Y	86.9	Confident	84.8	Confident	52 Å²	52	47.7 Å²	47.7	20%	0.204	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	131.5	-179.7	-49.2	-97.5	0	0	0	106.7	I70 L77 L155 K156 T160	I70-Y79 HydrophobicContact CD1-CD1 3.87Å; I70-Y79 HydrophobicContact CD1-CE1 4.01Å; I70-Y79 HydrophobicContact CG1-CD1 3.88Å; I70-Y79 HydrophobicContact CG1-CE1 4.42Å; I70-Y79 HydrophobicContact CG2-CD1 4.35Å; I70-Y79 HydrophobicContact CG2-CE1 4.4Å; L77-Y79 HydrophobicContact CB-CE2 4.3Å; Y79-L155 HydrophobicContact CD1-CD2 4.4Å; Y79-L155 HydrophobicContact CD1-CG 4.24Å; Y79-K156 HydrophobicContact CD1-CG 4.33Å; Y79-K156 HydrophobicContact CD2-CG 4.47Å; Y79-K156 HydrophobicContact CE1-CB 4.36Å; Y79-K156 HydrophobicContact CE1-CG 3.88Å; Y79-K156 HydrophobicContact CE2-CG 4.06Å; Y79-T160 HydrophobicContact CE1-CG2 3.56Å; Y79-T160 WeakPolarHBondContact OH-CG2 3.18Å
80	F	88.8	Confident	85.1	Confident	93 Å²	93	49 Å²	49	41%	0.408	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	131.6	164.5	-60.5	-72.5	0	0	0	106.8	A68 S69 N71 I78 D110	A68-F80 CarbonylContact C-O 3.48Å; A68-F80 VanDerWaalsContact CA-O 3.29Å; A68-F80 WeakPolarHBondContact CA-O 3.33Å; S69-F80 PolarHBondContact N-O 3.45Å; S69-F80 PolarHBondContact O-N 2.85Å; S69-F80 VanDerWaalsContact O-O 3.12Å; N71-F80 HydrophobicContact CB-CE2 4.45Å; I78-F80 HydrophobicContact CB-CE2 4.47Å; I78-F80 HydrophobicContact CG2-CD2 4.39Å; I78-F80 HydrophobicContact CG2-CE1 4.17Å; I78-F80 HydrophobicContact CG2-CE2 3.68Å; I78-F80 HydrophobicContact CG2-CZ 3.56Å; F80-D110 WeakPolarHBondContact CA-OD1 3.41Å
81	Y	91	Very high	85.2	Confident	15 Å²	15	49 Å²	49	6%	0.059	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	145.2	168.6	60.1	-92.4	0	0	0	109.8	E67 L108 S109 D110 Y151 V152 L155	E67-Y81 WeakPolarHBondContact O-CA 3.35Å; Y81-L108 HydrophobicContact CE2-CD1 4.48Å; Y81-L108 HydrophobicContact CE2-CG 4.4Å; Y81-S109 VanDerWaalsContact CE2-O 3.27Å; Y81-S109 WeakPolarHBondContact CE2-O 3.4Å; Y81-S109 CarbonylContact O-C 3.54Å; Y81-S109 WeakPolarHBondContact O-CA 3.46Å; Y81-S109 WeakPolarHBondContact O-CB 3.35Å; Y81-S109 PolarHBondContact OH-O 2.89Å; Y81-D110 HydrophobicContact CD1-CB 3.85Å; Y81-D110 HydrophobicContact CE1-CB 3.55Å; Y81-D110 HydrophobicContact CG-CB 4.48Å; Y81-D110 PolarHBondContact N-OD1 2.98Å; Y81-D110 PolarHBondContact O-N 2.99Å; Y81-D110 VanDerWaalsContact O-N 3.16Å; Y81-Y151 HydrophobicContact CD2-CE1 4.41Å; Y81-V152 HydrophobicContact CE1-CG1 4.4Å; Y81-V152 HydrophobicContact CE1-CG2 4.32Å; Y81-V152 HydrophobicContact CE2-CG2 4.11Å; Y81-V152 WeakPolarHBondContact OH-CG2 3.47Å; Y81-L155 HydrophobicContact CD1-CD2 3.68Å; Y81-L155 HydrophobicContact CE1-CD2 4.14Å; Y81-L155 HydrophobicContact CG-CD2 4.38Å
82	E	91.7	Very high	85.7	Confident	96 Å²	96	51.1 Å²	51.1	45%	0.449	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	125.7	170.3	-173.6	179.1	165.1	0	0	108.8	G66 E67 L108	G66-E82 CarbonylContact C-O 3.55Å; G66-E82 WeakPolarHBondContact CA-O 3.21Å; E67-E82 PolarHBondContact N-O 3.38Å; E67-E82 PolarHBondContact O-N 3.38Å; E82-L108 CarbonylContact C-O 3.52Å; E82-L108 WeakPolarHBondContact CA-O 3.29Å
83	W	92.3	Very high	86.2	Confident	1 Å²	1	51.8 Å²	51.8	0%	0.004	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	137.7	-178	-63.4	94	0	0	0	112.1	T33 T37 L40 L64 A68 V85 N107 L108 Y151	T33-W83 HydrophobicContact CG2-CH2 3.71Å; T33-W83 HydrophobicContact CG2-CZ2 4.35Å; T33-W83 WeakPolarHBondContact O-CH2 3.35Å; T37-W83 WeakPolarHBondContact OG1-CH2 3.47Å; L40-W83 HydrophobicContact CD1-CD2 3.77Å; L40-W83 HydrophobicContact CD1-CE3 4.24Å; L40-W83 HydrophobicContact CD1-CG 3.91Å; L64-W83 HydrophobicContact CD1-CD2 4.46Å; L64-W83 HydrophobicContact CD1-CE3 3.75Å; L64-W83 HydrophobicContact CD1-CZ3 4.37Å; L64-W83 HydrophobicContact CG-CE3 3.96Å; L64-W83 HydrophobicContact CG-CZ3 4.08Å; A68-W83 HydrophobicContact CB-CZ2 3.97Å; W83-V85 HydrophobicContact CB-CG2 4.32Å; W83-N107 PolarHBondContact O-N 2.92Å; W83-L108 HydrophobicContact CB-CB 4.12Å; W83-L108 HydrophobicContact CB-CD2 4.15Å; W83-L108 HydrophobicContact CB-CG 4.42Å; W83-L108 PolarHBondContact N-O 3.22Å; W83-L108 PolarHBondContact O-N 2.8Å; W83-Y151 AromaticContact NE1-CZ 3.94Å; W83-Y151 PolarHBondContact NE1-OH 2.84Å
84	N	92.1	Very high	86.9	Confident	50 Å²	50	52.9 Å²	52.9	27%	0.267	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	113.7	165.4	-71.2	-71.8	0	0	0	108.1	D65 P106 N107	D65-N84 PolarHBondContact N-O 2.81Å; D65-N84 VanDerWaalsContact N-O 3.12Å; D65-N84 PolarHBondContact O-N 3.21Å; N84-P106 VanDerWaalsContact OD1-CA 3.27Å; N84-P106 WeakPolarHBondContact OD1-CA 3.23Å; N84-N107 PolarHBondContact OD1-N 3.24Å; N84-N107 PolarHBondContact OD1-OD1 3.34Å
85	V	93.6	Very high	87.6	Confident	5 Å²	5	51.4 Å²	51.4	3%	0.03	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	124.9	-172.8	-170.7	0	0	0	0	109.8	L44 I61 L64 W83 E104 V105 L108	L44-V85 HydrophobicContact CD1-CG1 3.79Å; I61-V85 HydrophobicContact CG2-CG1 4.48Å; L64-V85 HydrophobicContact CD1-CB 4.33Å; L64-V85 HydrophobicContact CD1-CG1 4.23Å; L64-V85 HydrophobicContact CD1-CG2 3.76Å; W83-V85 HydrophobicContact CB-CG2 4.32Å; V85-E104 WeakPolarHBondContact O-CA 3.47Å; V85-V105 HydrophobicContact CB-CB 4.27Å; V85-V105 PolarHBondContact N-O 3.12Å; V85-V105 PolarHBondContact O-N 2.68Å; V85-L108 HydrophobicContact CG2-CD2 4.46Å
86	K	93.4	Very high	88.5	Confident	81 Å²	81	52.2 Å²	52.2	35%	0.352	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	119.4	168.5	-38.5	-168.3	-170.4	-149.1	0	110.1	I61 P62 N63 I103 E104	I61-K86 CarbonylContact C-O 3.53Å; P62-K86 VanDerWaalsContact CD-O 3.23Å; P62-K86 WeakPolarHBondContact CD-O 3.45Å; N63-K86 HydrophobicContact CB-CB 4.03Å; N63-K86 HydrophobicContact CB-CD 4.25Å; N63-K86 HydrophobicContact CB-CG 4.02Å; N63-K86 PolarHBondContact N-O 2.85Å; N63-K86 PolarHBondContact O-N 2.94Å; N63-K86 VanDerWaalsContact O-O 3.12Å; K86-I103 WeakPolarHBondContact CA-O 3.47Å; K86-E104 HydrophobicContact CD-CG 4.47Å; K86-E104 WeakPolarHBondContact CE-OE1 3.5Å; K86-E104 HydrophobicContact CG-CG 4.3Å; K86-E104 IonicContact NZ-OE1 2.77Å; K86-E104 PolarHBondContact NZ-OE1 2.78Å
87	A	93.2	Very high	89.1	Confident	7 Å²	7	49.2 Å²	49.2	6%	0.058	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	155.1	-179.8	0	0	0	0	0	111.3	V58 D60 I61 N102 I103	V58-A87 HydrophobicContact CG1-CB 3.94Å; D60-A87 CarbonylContact O-C 3.46Å; D60-A87 WeakPolarHBondContact O-CA 3.4Å; I61-A87 HydrophobicContact CG1-CB 4.13Å; A87-N102 CarbonylContact O-C 3.35Å; A87-N102 WeakPolarHBondContact O-CA 3.44Å; A87-I103 HydrophobicContact CB-CB 4.39Å; A87-I103 PolarHBondContact N-O 2.82Å; A87-I103 PolarHBondContact O-N 2.86Å
88	T	92.6	Very high	89.4	Confident	34 Å²	34	55.7 Å²	55.7	21%	0.209	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	144.3	170.5	71.8	0	0	0	0	109.8	V58 T59 D60 P62 G101	V58-T88 CarbonylContact C-O 3.49Å; V58-T88 WeakPolarHBondContact CA-O 3.49Å; T59-T88 PolarHBondContact N-O 3.36Å; T59-T88 PolarHBondContact OG1-OG1 2.82Å; D60-T88 WeakPolarHBondContact CB-OG1 3.34Å; D60-T88 PolarHBondContact N-OG1 2.8Å; D60-T88 PolarHBondContact O-N 3.09Å; P62-T88 HydrophobicContact CG-CG2 4.03Å; T88-G101 CarbonylContact C-O 3.56Å; T88-G101 WeakPolarHBondContact CA-O 3.34Å
89	W	94.5	Very high	89.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	148.2	174.7	63.9	-82.4	0	0	0	110.7	C56 E57 K100 G101 N102 I103 V121 S122 L123 L132 M136	C56-W89 HydrophobicContact CB-CE3 3.97Å; C56-W89 HydrophobicContact CB-CZ3 4.32Å; E57-W89 CarbonylContact O-C 3.55Å; E57-W89 VanDerWaalsContact O-CA 3.24Å; E57-W89 WeakPolarHBondContact O-CA 3.38Å; W89-K100 WeakPolarHBondContact O-CA 3.42Å; W89-G101 VanDerWaalsContact CD1-O 3.26Å; W89-G101 PolarHBondContact N-O 3.44Å; W89-G101 PolarHBondContact O-N 2.86Å; W89-N102 PolarHBondContact NE1-O 2.81Å; W89-I103 HydrophobicContact CG-CG1 4.47Å; W89-V121 HydrophobicContact CZ2-CG1 4.33Å; W89-S122 PolarHBondContact NE1-O 3.12Å; W89-L123 HydrophobicContact CH2-CD2 3.83Å; W89-L123 HydrophobicContact CZ2-CD2 3.87Å; W89-L132 HydrophobicContact CH2-CB 4.28Å; W89-L132 HydrophobicContact CZ3-CB 4.24Å; W89-M136 HydrophobicContact CB-CE 4.1Å; W89-M136 HydrophobicContact CD2-CE 4.29Å; W89-M136 HydrophobicContact CD2-CG 4.02Å; W89-M136 HydrophobicContact CE3-CG 3.93Å; W89-M136 HydrophobicContact CG-CE 3.98Å; W89-M136 HydrophobicContact CH2-CG 4.31Å; W89-M136 HydrophobicContact CZ2-CG 4.38Å; W89-M136 HydrophobicContact CZ3-CG 4.09Å
90	T	91.9	Very high	89.8	Confident	46 Å²	46	57.8 Å²	57.8	28%	0.282	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	140.1	166.9	64.9	0	0	0	0	109.9	C56 E57 T59 Y99 K100	C56-T90 CarbonylContact C-O 3.56Å; C56-T90 VanDerWaalsContact CA-O 3.31Å; C56-T90 WeakPolarHBondContact CA-O 3.24Å; E57-T90 PolarHBondContact N-O 2.93Å; E57-T90 PolarHBondContact O-N 2.97Å; T59-T90 HydrophobicContact CG2-CG2 3.89Å; T59-T90 WeakPolarHBondContact CG2-OG1 3.44Å; T90-Y99 CarbonylContact C-O 3.46Å; T90-Y99 WeakPolarHBondContact CA-O 3.31Å; T90-K100 HydrophobicContact CG2-CG 4Å
91	G	91.3	Very high	89.9	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.01	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	134.9	177.9	0	0	0	0	0	111.2	S55 K98 Y99	S55-G91 CarbonylContact O-C 3.59Å; S55-G91 VanDerWaalsContact O-CA 3.31Å; S55-G91 WeakPolarHBondContact O-CA 3.36Å; G91-K98 CarbonylContact O-C 3.44Å; G91-K98 VanDerWaalsContact O-CA 3.26Å; G91-K98 WeakPolarHBondContact O-CA 3.27Å; G91-Y99 PolarHBondContact N-O 3.29Å; G91-Y99 PolarHBondContact O-N 3.17Å
92	T	91.3	Very high	90	Very high	46 Å²	46	55.9 Å²	55.9	28%	0.282	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	117.3	169.3	-53.8	0	0	0	0	108.8	G54 S55 K98	G54-T92 WeakPolarHBondContact CA-O 3.08Å; S55-T92 PolarHBondContact N-O 2.88Å; S55-T92 PolarHBondContact O-N 2.87Å; T92-K98 HydrophobicContact CG2-CG 4.48Å
93	S	88.3	Confident	90.1	Very high	15 Å²	15	51.6 Å²	51.6	11%	0.105	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	163.5	175.8	60	0	0	0	0	111.6	T95 G96 I97	S93-T95 PolarHBondContact O-N 3.19Å; S93-T95 VanDerWaalsContact O-N 3.08Å; S93-T95 PolarHBondContact OG-OG1 2.98Å; S93-G96 PolarHBondContact O-N 2.88Å; S93-I97 PolarHBondContact N-O 2.9Å; S93-I97 WeakPolarHBondContact OG-CB 3.49Å; S93-I97 PolarHBondContact OG-N 3.01Å; S93-I97 VanDerWaalsContact OG-N 3.14Å; S93-I97 PolarHBondContact OG-O 3.03Å
94	K	84.7	Confident	90.2	Very high	161 Å²	161	55.3 Å²	55.3	70%	0.7	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-24.9	171.2	-83.6	179.4	164	169.2	0	115	P52 E53 G96	P52-K94 VanDerWaalsContact O-CD 3.23Å; P52-K94 WeakPolarHBondContact O-CD 3.35Å; P52-K94 WeakPolarHBondContact O-CE 3.44Å; P52-K94 PolarHBondContact O-NZ 2.85Å; E53-K94 PolarHBondContact O-N 2.98Å; E53-K94 VanDerWaalsContact O-N 3.14Å; K94-G96 VanDerWaalsContact C-N 3.29Å
95	T	82.6	Confident	90.2	Very high	113 Å²	113	53 Å²	53	69%	0.693	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	2.6	176.9	53.2	0	0	0	0	113.3	S93 I97	S93-T95 PolarHBondContact O-N 3.19Å; S93-T95 VanDerWaalsContact O-N 3.08Å; S93-T95 PolarHBondContact OG-OG1 2.98Å; T95-I97 VanDerWaalsContact C-N 3.27Å; T95-I97 PolarHBondContact O-N 3.32Å
96	G	81.9	Confident	90.1	Very high	49 Å²	49	54.9 Å²	54.9	51%	0.505	29%	0.289	S	S	.	.	S	Bend	trans	81.3	-0.5	-178.5	0	0	0	0	0	114.6	S93 K94	S93-G96 PolarHBondContact O-N 2.88Å; K94-G96 VanDerWaalsContact C-N 3.29Å
97	I	85.7	Confident	89.7	Confident	89 Å²	89	54.9 Å²	54.9	46%	0.456	29%	0.293	S	S	.	.			trans	-71.8	130.6	176.2	-55.7	173.5	0	0	0	108.7	S93 T95 Y99	S93-I97 PolarHBondContact N-O 2.9Å; S93-I97 WeakPolarHBondContact OG-CB 3.49Å; S93-I97 PolarHBondContact OG-N 3.01Å; S93-I97 VanDerWaalsContact OG-N 3.14Å; S93-I97 PolarHBondContact OG-O 3.03Å; T95-I97 VanDerWaalsContact C-N 3.27Å; T95-I97 PolarHBondContact O-N 3.32Å; I97-Y99 HydrophobicContact CB-CE2 3.92Å; I97-Y99 HydrophobicContact CG2-CD2 4.3Å; I97-Y99 HydrophobicContact CG2-CE2 3.62Å
98	K	86.9	Confident	89.5	Confident	159 Å²	159	54.6 Å²	54.6	69%	0.691	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	139.9	176.9	-67.3	-175.4	173.5	-176.5	0	110.6	G91 T92	G91-K98 CarbonylContact O-C 3.44Å; G91-K98 VanDerWaalsContact O-CA 3.26Å; G91-K98 WeakPolarHBondContact O-CA 3.27Å; T92-K98 HydrophobicContact CG2-CG 4.48Å
99	Y	88.7	Confident	89.3	Confident	27 Å²	27	53.6 Å²	53.6	11%	0.106	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	153.2	179	-65.1	-91.4	0	0	0	109.7	T90 G91 I97 P128 T130 L132	T90-Y99 CarbonylContact C-O 3.46Å; T90-Y99 WeakPolarHBondContact CA-O 3.31Å; G91-Y99 PolarHBondContact N-O 3.29Å; G91-Y99 PolarHBondContact O-N 3.17Å; I97-Y99 HydrophobicContact CB-CE2 3.92Å; I97-Y99 HydrophobicContact CG2-CD2 4.3Å; I97-Y99 HydrophobicContact CG2-CE2 3.62Å; Y99-P128 HydrophobicContact CE1-CG 4.09Å; Y99-T130 HydrophobicContact CD1-CG2 3.59Å; Y99-T130 HydrophobicContact CD2-CG2 4.3Å; Y99-T130 HydrophobicContact CE1-CG2 3.86Å; Y99-T130 HydrophobicContact CG-CG2 3.82Å; Y99-L132 HydrophobicContact CD2-CD1 3.63Å; Y99-L132 HydrophobicContact CE2-CD1 4.24Å; Y99-L132 HydrophobicContact CG-CD1 4.38Å
100	K	89.1	Confident	88.7	Confident	126 Å²	126	56.9 Å²	56.9	55%	0.548	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	146.9	170.4	-67.2	-173.5	175.9	-175.6	0	112.4	W89 T90 C124 E127	W89-K100 WeakPolarHBondContact O-CA 3.42Å; T90-K100 HydrophobicContact CG2-CG 4Å; K100-C124 PolarHBondContact O-N 2.79Å; K100-E127 PolarHBondContact N-OE1 2.87Å
101	G	91.1	Very high	87.8	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.01	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	179.3	175	0	0	0	0	0	113.1	T88 W89 S122	T88-G101 CarbonylContact C-O 3.56Å; T88-G101 WeakPolarHBondContact CA-O 3.34Å; W89-G101 VanDerWaalsContact CD1-O 3.26Å; W89-G101 PolarHBondContact N-O 3.44Å; W89-G101 PolarHBondContact O-N 2.86Å; G101-S122 CarbonylContact C-O 3.58Å; G101-S122 WeakPolarHBondContact CA-O 3.39Å
102	N	93.2	Very high	87.2	Confident	67 Å²	67	65.3 Å²	65.3	36%	0.358	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	153	-177.8	-59.1	-24	0	0	0	110.6	A87 W89 V121 S122	A87-N102 CarbonylContact O-C 3.35Å; A87-N102 WeakPolarHBondContact O-CA 3.44Å; W89-N102 PolarHBondContact NE1-O 2.81Å; N102-V121 WeakPolarHBondContact O-CA 3.4Å; N102-S122 PolarHBondContact N-O 2.84Å; N102-S122 PolarHBondContact O-N 2.93Å
103	I	94.3	Very high	86.5	Confident	6 Å²	6	68.9 Å²	68.9	3%	0.031	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	132.1	166.7	-48.2	179.7	0	0	0	106.3	V58 K86 A87 W89 V105 I119 S120 V121 M136 V144	V58-I103 HydrophobicContact CG2-CD1 3.84Å; K86-I103 WeakPolarHBondContact CA-O 3.47Å; A87-I103 HydrophobicContact CB-CB 4.39Å; A87-I103 PolarHBondContact N-O 2.82Å; A87-I103 PolarHBondContact O-N 2.86Å; W89-I103 HydrophobicContact CG-CG1 4.47Å; I103-V105 HydrophobicContact CG2-CG2 4.27Å; I103-I119 HydrophobicContact CG2-CG2 3.82Å; I103-S120 WeakPolarHBondContact CA-O 3.44Å; I103-V121 HydrophobicContact CG1-CG2 4.45Å; I103-V121 HydrophobicContact CG2-CG2 4.36Å; I103-M136 HydrophobicContact CD1-CE 3.6Å; I103-M136 HydrophobicContact CG1-CE 4.39Å; I103-V144 HydrophobicContact CD1-CG2 4.09Å
104	E	93.3	Very high	86	Confident	78 Å²	78	70 Å²	70	36%	0.364	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	123.8	175.7	170.7	167.1	-149.2	0	0	109	V85 K86 S120	V85-E104 WeakPolarHBondContact O-CA 3.47Å; K86-E104 HydrophobicContact CD-CG 4.47Å; K86-E104 WeakPolarHBondContact CE-OE1 3.5Å; K86-E104 HydrophobicContact CG-CG 4.3Å; K86-E104 IonicContact NZ-OE1 2.77Å; K86-E104 PolarHBondContact NZ-OE1 2.78Å; E104-S120 WeakPolarHBondContact CB-OG 3.08Å; E104-S120 PolarHBondContact N-O 3.46Å; E104-S120 PolarHBondContact O-N 3.33Å; E104-S120 PolarHBondContact O-OG 3.03Å
105	V	93.9	Very high	85.7	Confident	2 Å²	2	68.1 Å²	68.1	1%	0.012	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	96.9	179	-169.3	0	0	0	0	107.2	V85 I103 L117 I119 V144 L148	V85-V105 HydrophobicContact CB-CB 4.27Å; V85-V105 PolarHBondContact N-O 3.12Å; V85-V105 PolarHBondContact O-N 2.68Å; I103-V105 HydrophobicContact CG2-CG2 4.27Å; V105-L117 HydrophobicContact CG1-CB 4.36Å; V105-I119 HydrophobicContact CG1-CG1 4.24Å; V105-I119 HydrophobicContact CG2-CB 4.34Å; V105-I119 HydrophobicContact CG2-CG1 3.95Å; V105-I119 HydrophobicContact CG2-CG2 4.05Å; V105-V144 HydrophobicContact CG2-CG1 4.24Å; V105-L148 HydrophobicContact CG1-CD1 3.98Å; V105-L148 HydrophobicContact CG2-CD1 4.41Å
106	P	90.2	Very high	85.5	Confident	44 Å²	44	69 Å²	69	29%	0.286	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	155.3	175.1	32.9	-32.5	0	0	0	110.8	N84 L108 D118	N84-P106 VanDerWaalsContact OD1-CA 3.27Å; N84-P106 WeakPolarHBondContact OD1-CA 3.23Å; P106-L108 PolarHBondContact O-N 3.44Å; P106-D118 WeakPolarHBondContact CD-O 3.16Å
107	N	86.2	Confident	85.6	Confident	82 Å²	82	67 Å²	67	44%	0.439	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53	43.4	166.7	-49.9	-13.4	0	0	0	115.1	W83 N84 S109 N112	W83-N107 PolarHBondContact O-N 2.92Å; N84-N107 PolarHBondContact OD1-N 3.24Å; N84-N107 PolarHBondContact OD1-OD1 3.34Å; N107-S109 PolarHBondContact O-N 2.83Å; N107-N112 PolarHBondContact O-ND2 3.24Å
108	L	88.4	Confident	85.7	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	97.4	166.1	169.3	69.8	0	0	0	108.6	L40 Y81 E82 W83 V85 P106 M114 L117 L148	L40-L108 HydrophobicContact CD2-CD2 4.3Å; Y81-L108 HydrophobicContact CE2-CD1 4.48Å; Y81-L108 HydrophobicContact CE2-CG 4.4Å; E82-L108 CarbonylContact C-O 3.52Å; E82-L108 WeakPolarHBondContact CA-O 3.29Å; W83-L108 HydrophobicContact CB-CB 4.12Å; W83-L108 HydrophobicContact CB-CD2 4.15Å; W83-L108 HydrophobicContact CB-CG 4.42Å; W83-L108 PolarHBondContact N-O 3.22Å; W83-L108 PolarHBondContact O-N 2.8Å; V85-L108 HydrophobicContact CG2-CD2 4.46Å; P106-L108 PolarHBondContact O-N 3.44Å; L108-M114 HydrophobicContact CD1-CE 3.67Å; L108-M114 HydrophobicContact CD1-SD 4.07Å; L108-L117 HydrophobicContact CB-CD2 4.36Å; L108-L117 HydrophobicContact CD1-CD1 3.74Å; L108-L117 HydrophobicContact CD1-CD2 4Å; L108-L148 HydrophobicContact CD1-CB 4.31Å; L108-L148 HydrophobicContact CD1-CD1 4.37Å; L108-L148 HydrophobicContact CD2-CB 4.38Å; L108-L148 HydrophobicContact CD2-CD1 4.17Å; L108-L148 HydrophobicContact CD2-CD2 3.72Å; L108-L148 HydrophobicContact CD2-CG 4.29Å
109	S	87.5	Confident	85.9	Confident	13 Å²	13	61.5 Å²	61.5	9%	0.091	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	169.5	-176.3	67.7	0	0	0	0	114.5	Y81 N107 E111 N112	Y81-S109 VanDerWaalsContact CE2-O 3.27Å; Y81-S109 WeakPolarHBondContact CE2-O 3.4Å; Y81-S109 CarbonylContact O-C 3.54Å; Y81-S109 WeakPolarHBondContact O-CA 3.46Å; Y81-S109 WeakPolarHBondContact O-CB 3.35Å; Y81-S109 PolarHBondContact OH-O 2.89Å; N107-S109 PolarHBondContact O-N 2.83Å; S109-E111 PolarHBondContact O-N 3.41Å; S109-E111 PolarHBondContact OG-N 3.21Å; S109-N112 PolarHBondContact O-N 2.72Å; S109-N112 PolarHBondContact OG-ND2 2.81Å
110	D	81.9	Confident	86	Confident	69 Å²	69	62.3 Å²	62.3	37%	0.369	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-15.5	173.5	65.4	-80.2	0	0	0	113.5	F80 Y81	F80-D110 WeakPolarHBondContact CA-OD1 3.41Å; Y81-D110 HydrophobicContact CD1-CB 3.85Å; Y81-D110 HydrophobicContact CE1-CB 3.55Å; Y81-D110 HydrophobicContact CG-CB 4.48Å; Y81-D110 PolarHBondContact N-OD1 2.98Å; Y81-D110 PolarHBondContact O-N 2.99Å; Y81-D110 VanDerWaalsContact O-N 3.16Å
111	E	73.8	Confident	86.1	Confident	158 Å²	158	56.9 Å²	56.9	74%	0.738	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-17.1	173.6	-57.5	-156	138.2	0	0	114.1	S109	S109-E111 PolarHBondContact O-N 3.41Å; S109-E111 PolarHBondContact OG-N 3.21Å
112	N	78.6	Confident	86.1	Confident	66 Å²	66	59.5 Å²	59.5	35%	0.353	32%	0.321	S	S	.	.	S	Bend	trans	-107	126.2	-174.8	-73.4	-32.4	0	0	0	112.1	N107 S109 L117	N107-N112 PolarHBondContact O-ND2 3.24Å; S109-N112 PolarHBondContact O-N 2.72Å; S109-N112 PolarHBondContact OG-ND2 2.81Å; N112-L117 HydrophobicContact CB-CD2 4.49Å
113	D	76.5	Confident	85.9	Confident	122 Å²	122	58 Å²	58	65%	0.652	31%	0.313	S	S	*	.			trans	-67.6	141.5	173.9	-81.9	-44.9	0	0	0	111.2	D115 D116	D113-D115 PolarHBondContact O-N 3.45Å; D113-D115 VanDerWaalsContact O-N 3.07Å; D113-D116 PolarHBondContact O-N 3.35Å
114	M	77.7	Confident	85.5	Confident	39 Å²	39	59.6 Å²	59.6	19%	0.192	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-30.4	-176.6	-63.2	-62.8	98.1	0	0	112.9	L108 L117 R145 V152	L108-M114 HydrophobicContact CD1-CE 3.67Å; L108-M114 HydrophobicContact CD1-SD 4.07Å; M114-L117 HydrophobicContact CE-CD1 4.25Å; M114-L117 WeakPolarHBondContact O-CG 3.5Å; M114-L117 HydrophobicContact SD-CD1 4.01Å; M114-R145 HydrophobicContact CB-CG 4.35Å; M114-R145 WeakPolarHBondContact O-CD 3.43Å; M114-R145 VanDerWaalsContact O-CG 3.31Å; M114-R145 WeakPolarHBondContact O-CG 3.37Å; M114-R145 PolarHBondContact O-NE 2.94Å; M114-V152 HydrophobicContact CE-CG2 4.19Å; M114-V152 HydrophobicContact SD-CG2 4.15Å
115	D	77.4	Confident	84.6	Confident	121 Å²	121	66 Å²	66	65%	0.647	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-21.9	179.6	-81	-39.5	0	0	0	114.4	D113 R145	D113-D115 PolarHBondContact O-N 3.45Å; D113-D115 VanDerWaalsContact O-N 3.07Å; D115-R145 PolarHBondContact O-NH1 2.98Å; D115-R145 PolarHBondContact O-NH2 2.96Å; D115-R145 WeakPolarHBondContact OD1-CD 3.15Å; D115-R145 IonicContact OD1-NH1 2.7Å; D115-R145 PolarHBondContact OD1-NH1 3.5Å
116	D	79.9	Confident	83.6	Confident	131 Å²	131	73.2 Å²	73.2	70%	0.701	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-5.6	179.6	-73.6	-14.7	0	0	0	113	D113 D118	D113-D116 PolarHBondContact O-N 3.35Å; D116-D118 PolarHBondContact O-N 3.17Å
117	L	83.7	Confident	83	Confident	7 Å²	7	73.9 Å²	73.9	4%	0.037	39%	0.389	C	S	.	.			trans	-58.9	120.7	175.5	-63.5	174.9	0	0	0	111.7	V105 L108 N112 M114 I119 R145 L148	V105-L117 HydrophobicContact CG1-CB 4.36Å; L108-L117 HydrophobicContact CB-CD2 4.36Å; L108-L117 HydrophobicContact CD1-CD1 3.74Å; L108-L117 HydrophobicContact CD1-CD2 4Å; N112-L117 HydrophobicContact CB-CD2 4.49Å; M114-L117 HydrophobicContact CE-CD1 4.25Å; M114-L117 WeakPolarHBondContact O-CG 3.5Å; M114-L117 HydrophobicContact SD-CD1 4.01Å; L117-I119 HydrophobicContact CB-CG1 4.32Å; L117-I119 PolarHBondContact O-N 3.04Å; L117-I119 VanDerWaalsContact O-N 3.12Å; L117-R145 PolarHBondContact O-NH2 2.85Å; L117-L148 HydrophobicContact CD1-CD1 4Å
118	D	86.8	Confident	82.6	Confident	112 Å²	112	73.9 Å²	73.9	60%	0.599	39%	0.394	S	S	*	.			trans	-76	92.5	173.4	-174	15.1	0	0	0	110.4	P106 D116 S120	P106-D118 WeakPolarHBondContact CD-O 3.16Å; D116-D118 PolarHBondContact O-N 3.17Å; D118-S120 PolarHBondContact O-N 3.2Å
119	I	91.8	Very high	82.1	Confident	20 Å²	20	80.7 Å²	80.7	10%	0.103	43%	0.43	C	S	.	.			trans	-90.3	89.2	178.9	-57.2	174	0	0	0	108.5	I103 V105 L117 V121 A141 V144 R145	I103-I119 HydrophobicContact CG2-CG2 3.82Å; V105-I119 HydrophobicContact CG1-CG1 4.24Å; V105-I119 HydrophobicContact CG2-CB 4.34Å; V105-I119 HydrophobicContact CG2-CG1 3.95Å; V105-I119 HydrophobicContact CG2-CG2 4.05Å; L117-I119 HydrophobicContact CB-CG1 4.32Å; L117-I119 PolarHBondContact O-N 3.04Å; L117-I119 VanDerWaalsContact O-N 3.12Å; I119-V121 HydrophobicContact CG2-CG2 4.45Å; I119-A141 HydrophobicContact CB-CB 4.11Å; I119-A141 HydrophobicContact CD1-CB 4.43Å; I119-A141 VanDerWaalsContact CD1-O 3.27Å; I119-A141 WeakPolarHBondContact CD1-O 3.44Å; I119-A141 HydrophobicContact CG2-CB 3.92Å; I119-V144 HydrophobicContact CD1-CB 4.35Å; I119-V144 HydrophobicContact CD1-CG1 4.14Å; I119-V144 HydrophobicContact CG2-CG1 4.33Å; I119-R145 HydrophobicContact CD1-CB 3.76Å
120	S	90.7	Very high	81.9	Confident	45 Å²	45	80.7 Å²	80.7	32%	0.315	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	136.9	176.9	75.1	0	0	0	0	110.8	I103 E104 D118	I103-S120 WeakPolarHBondContact CA-O 3.44Å; E104-S120 WeakPolarHBondContact CB-OG 3.08Å; E104-S120 PolarHBondContact N-O 3.46Å; E104-S120 PolarHBondContact O-N 3.33Å; E104-S120 PolarHBondContact O-OG 3.03Å; D118-S120 PolarHBondContact O-N 3.2Å
121	V	91.9	Very high	82.1	Confident	11 Å²	11	80.3 Å²	80.3	7%	0.067	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	127.9	177.6	-178.3	0	0	0	0	109.3	W89 N102 I103 I119 M136 K137	W89-V121 HydrophobicContact CZ2-CG1 4.33Å; N102-V121 WeakPolarHBondContact O-CA 3.4Å; I103-V121 HydrophobicContact CG1-CG2 4.45Å; I103-V121 HydrophobicContact CG2-CG2 4.36Å; I119-V121 HydrophobicContact CG2-CG2 4.45Å; V121-M136 HydrophobicContact CG1-CB 3.81Å; V121-K137 HydrophobicContact CB-CG 3.78Å; V121-K137 HydrophobicContact CG1-CG 4.41Å; V121-K137 HydrophobicContact CG2-CG 4.35Å; V121-K137 WeakPolarHBondContact O-CE 3.33Å
122	S	90.1	Very high	82.7	Confident	57 Å²	57	72.8 Å²	72.8	40%	0.399	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	165.6	-179.1	60.5	0	0	0	0	111.8	W89 G101 N102	W89-S122 PolarHBondContact NE1-O 3.12Å; G101-S122 CarbonylContact C-O 3.58Å; G101-S122 WeakPolarHBondContact CA-O 3.39Å; N102-S122 PolarHBondContact N-O 2.84Å; N102-S122 PolarHBondContact O-N 2.93Å
123	L	89.6	Confident	83.1	Confident	34 Å²	34	70 Å²	70	18%	0.178	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	159.5	166.8	-70.5	168.5	0	0	0	110.1	W89 E127 T130 T133	W89-L123 HydrophobicContact CH2-CD2 3.83Å; W89-L123 HydrophobicContact CZ2-CD2 3.87Å; L123-E127 HydrophobicContact CB-CB 4.28Å; L123-T130 HydrophobicContact CD1-CG2 3.96Å; L123-T130 HydrophobicContact CD2-CG2 3.79Å; L123-T130 HydrophobicContact CG-CG2 4.47Å; L123-T133 WeakPolarHBondContact CD1-OG1 3.39Å; L123-T133 HydrophobicContact CG-CG2 4.37Å; L123-T133 WeakPolarHBondContact CG-OG1 3.23Å
124	C	85.6	Confident	83.7	Confident	40 Å²	40	70.6 Å²	70.6	27%	0.27	38%	0.379	S	S	.	.			trans	-63	150.6	164.5	-69.1	0	0	0	0	110.4	K100 D126 E127	K100-C124 PolarHBondContact O-N 2.79Å; C124-D126 PolarHBondContact O-N 2.86Å; C124-E127 HydrophobicContact CB-CG 4.02Å; C124-E127 PolarHBondContact O-N 3.46Å; C124-E127 VanDerWaalsContact O-N 3.1Å
125	K	73.8	Confident	84.3	Confident	213 Å²	213	69.5 Å²	69.5	93%	0.926	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-21.9	-171.8	-66.6	-177.9	-179.6	177.3	0	114.4
126	D	74	Confident	84.9	Confident	154 Å²	154	63.8 Å²	63.8	82%	0.824	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-2.2	-175.8	-45.4	-67.2	0	0	0	113.1	C124	C124-D126 PolarHBondContact O-N 2.86Å
127	E	77.2	Confident	85.5	Confident	57 Å²	57	63.4 Å²	63.4	27%	0.266	34%	0.335	S	S	.	.	S	Bend	trans	-97.8	133.3	-174.6	-68	-79.4	-167.1	0	0	111.9	K100 L123 C124	K100-E127 PolarHBondContact N-OE1 2.87Å; L123-E127 HydrophobicContact CB-CB 4.28Å; C124-E127 HydrophobicContact CB-CG 4.02Å; C124-E127 PolarHBondContact O-N 3.46Å; C124-E127 VanDerWaalsContact O-N 3.1Å
128	P	77.8	Confident	85.8	Confident	83 Å²	83	69.8 Å²	69.8	54%	0.539	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-72.1	150	176.9	27.4	-29.1	0	0	0	111.4	Y99 T130	Y99-P128 HydrophobicContact CE1-CG 4.09Å; P128-T130 PolarHBondContact O-N 3.23Å
129	N	77.5	Confident	86	Confident	143 Å²	143	67.8 Å²	67.8	77%	0.765	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-57.3	135.5	-177	-168.2	22.2	0	0	0	111.9
130	T	83.4	Confident	85.9	Confident	13 Å²	13	66.9 Å²	66.9	8%	0.08	35%	0.345	C	S	.	.			trans	-142.5	144.2	-171.7	177.6	0	0	0	0	111.9	Y99 L123 P128 L132 T133	Y99-T130 HydrophobicContact CD1-CG2 3.59Å; Y99-T130 HydrophobicContact CD2-CG2 4.3Å; Y99-T130 HydrophobicContact CE1-CG2 3.86Å; Y99-T130 HydrophobicContact CG-CG2 3.82Å; L123-T130 HydrophobicContact CD1-CG2 3.96Å; L123-T130 HydrophobicContact CD2-CG2 3.79Å; L123-T130 HydrophobicContact CG-CG2 4.47Å; P128-T130 PolarHBondContact O-N 3.23Å; T130-L132 HydrophobicContact CG2-CB 4.06Å; T130-L132 PolarHBondContact O-N 2.98Å; T130-L132 PolarHBondContact OG1-N 3.4Å; T130-T133 WeakPolarHBondContact O-CB 3.27Å; T130-T133 PolarHBondContact O-N 3.17Å; T130-T133 PolarHBondContact O-OG1 3.11Å
131	T	85.9	Confident	86	Confident	61 Å²	61	65.5 Å²	65.5	37%	0.374	34%	0.337	S	S	.	.	H	α-helix	trans	-63.3	-18.5	177.3	54.6	0	0	0	0	112.8	E53 T133 E134 L135	E53-T131 WeakPolarHBondContact OE2-CB 3.34Å; E53-T131 PolarHBondContact OE2-OG1 3.37Å; T131-T133 PolarHBondContact O-N 3.23Å; T131-E134 PolarHBondContact O-N 3.34Å; T131-E134 VanDerWaalsContact O-N 3.13Å; T131-L135 PolarHBondContact O-N 3.27Å; T131-L135 VanDerWaalsContact O-N 3.09Å
132	L	86.3	Confident	86	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-59.5	-29.8	169.5	-62.7	179.2	0	0	0	112.9	E53 W89 Y99 T130 E134 L135 M136	E53-L132 HydrophobicContact CB-CD2 3.99Å; W89-L132 HydrophobicContact CH2-CB 4.28Å; W89-L132 HydrophobicContact CZ3-CB 4.24Å; Y99-L132 HydrophobicContact CD2-CD1 3.63Å; Y99-L132 HydrophobicContact CE2-CD1 4.24Å; Y99-L132 HydrophobicContact CG-CD1 4.38Å; T130-L132 HydrophobicContact CG2-CB 4.06Å; T130-L132 PolarHBondContact O-N 2.98Å; T130-L132 PolarHBondContact OG1-N 3.4Å; L132-E134 VanDerWaalsContact C-N 3.35Å; L132-L135 HydrophobicContact CD2-CD2 4.4Å; L132-L135 WeakPolarHBondContact O-CB 3.31Å; L132-L135 PolarHBondContact O-N 2.91Å; L132-M136 PolarHBondContact O-N 3.14Å
133	T	88.1	Confident	86.1	Confident	8 Å²	8	72.6 Å²	72.6	5%	0.049	36%	0.359	C	S	.	.	H	α-helix	trans	-68.1	-37.1	176.4	-42.5	0	0	0	0	111.1	L123 T130 T131 M136 K137	L123-T133 WeakPolarHBondContact CD1-OG1 3.39Å; L123-T133 HydrophobicContact CG-CG2 4.37Å; L123-T133 WeakPolarHBondContact CG-OG1 3.23Å; T130-T133 WeakPolarHBondContact O-CB 3.27Å; T130-T133 PolarHBondContact O-N 3.17Å; T130-T133 PolarHBondContact O-OG1 3.11Å; T131-T133 PolarHBondContact O-N 3.23Å; T133-M136 PolarHBondContact O-N 3.07Å; T133-K137 HydrophobicContact CG2-CD 4.48Å; T133-K137 WeakPolarHBondContact O-CB 3.08Å; T133-K137 VanDerWaalsContact O-CG 3.27Å; T133-K137 WeakPolarHBondContact O-CG 3.16Å; T133-K137 PolarHBondContact O-N 3.08Å
134	E	88.2	Confident	86.3	Confident	133 Å²	133	71.1 Å²	71.1	62%	0.621	35%	0.352	S	S	*	.	H	α-helix	trans	-70.7	-39.3	175.9	-59.9	-175.6	172.8	0	0	111.2	T131 L132 M136 K137 K138	T131-E134 PolarHBondContact O-N 3.34Å; T131-E134 VanDerWaalsContact O-N 3.13Å; L132-E134 VanDerWaalsContact C-N 3.35Å; E134-M136 PolarHBondContact O-N 2.84Å; E134-K137 PolarHBondContact O-N 2.85Å; E134-K138 WeakPolarHBondContact O-CB 3.4Å; E134-K138 PolarHBondContact O-N 2.93Å
135	L	90.1	Very high	86.6	Confident	17 Å²	17	72.4 Å²	72.4	9%	0.089	35%	0.351	C	S	.	.	H	α-helix	trans	-57.6	-46.8	171.2	178.8	64.7	0	0	0	111.3	V49 T131 L132 K138 E139 G140	V49-L135 HydrophobicContact CG1-CD1 4.16Å; V49-L135 HydrophobicContact CG1-CD2 4.42Å; V49-L135 HydrophobicContact CG1-CG 4Å; T131-L135 PolarHBondContact O-N 3.27Å; T131-L135 VanDerWaalsContact O-N 3.09Å; L132-L135 HydrophobicContact CD2-CD2 4.4Å; L132-L135 WeakPolarHBondContact O-CB 3.31Å; L132-L135 PolarHBondContact O-N 2.91Å; L135-K138 PolarHBondContact O-N 3.38Å; L135-E139 HydrophobicContact CD1-CB 4.3Å; L135-E139 HydrophobicContact CD1-CG 4.26Å; L135-E139 PolarHBondContact O-N 2.97Å; L135-G140 PolarHBondContact O-N 2.85Å
136	M	91.8	Very high	87.5	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.33	C	S	.	.	I	π-helix	trans	-68.7	-39.7	177.6	-76.1	-62.8	-69.8	0	0	112.8	V49 C56 W89 I103 V121 L132 T133 E134 K138 G140 A141	V49-M136 HydrophobicContact CB-SD 4.02Å; V49-M136 HydrophobicContact CG2-SD 3.7Å; C56-M136 HydrophobicContact CB-CG 3.69Å; C56-M136 HydrophobicContact CB-SD 3.37Å; C56-M136 WeakPolarHBondContact CB-SD 3.31Å; W89-M136 HydrophobicContact CB-CE 4.1Å; W89-M136 HydrophobicContact CD2-CE 4.29Å; W89-M136 HydrophobicContact CD2-CG 4.02Å; W89-M136 HydrophobicContact CE3-CG 3.93Å; W89-M136 HydrophobicContact CG-CE 3.98Å; W89-M136 HydrophobicContact CH2-CG 4.31Å; W89-M136 HydrophobicContact CZ2-CG 4.38Å; W89-M136 HydrophobicContact CZ3-CG 4.09Å; I103-M136 HydrophobicContact CD1-CE 3.6Å; I103-M136 HydrophobicContact CG1-CE 4.39Å; V121-M136 HydrophobicContact CG1-CB 3.81Å; L132-M136 PolarHBondContact O-N 3.14Å; T133-M136 PolarHBondContact O-N 3.07Å; E134-M136 PolarHBondContact O-N 2.84Å; M136-K138 VanDerWaalsContact C-N 3.27Å; M136-K138 PolarHBondContact O-N 3.03Å; M136-G140 CarbonylContact O-C 3.58Å; M136-G140 WeakPolarHBondContact O-CA 3.22Å; M136-G140 PolarHBondContact O-N 2.79Å; M136-G140 VanDerWaalsContact O-N 3.14Å; M136-A141 PolarHBondContact O-N 3.37Å
137	K	90.8	Very high	88.4	Confident	124 Å²	124	58.2 Å²	58.2	54%	0.539	30%	0.295	S	S	.	.	I	π-helix	trans	-62.1	-32.6	173.9	-78.2	176.4	177.4	-178.1	0	113.3	V121 T133 E134 A141	V121-K137 HydrophobicContact CB-CG 3.78Å; V121-K137 HydrophobicContact CG1-CG 4.41Å; V121-K137 HydrophobicContact CG2-CG 4.35Å; V121-K137 WeakPolarHBondContact O-CE 3.33Å; T133-K137 HydrophobicContact CG2-CD 4.48Å; T133-K137 WeakPolarHBondContact O-CB 3.08Å; T133-K137 VanDerWaalsContact O-CG 3.27Å; T133-K137 WeakPolarHBondContact O-CG 3.16Å; T133-K137 PolarHBondContact O-N 3.08Å; E134-K137 PolarHBondContact O-N 2.85Å; K137-A141 VanDerWaalsContact O-CB 3.27Å; K137-A141 WeakPolarHBondContact O-CB 3.47Å
138	K	89.9	Confident	89.1	Confident	141 Å²	141	55.5 Å²	55.5	61%	0.613	28%	0.282	S	S	*	.	I	π-helix	trans	-97.8	-51.7	-173.3	-169	-177.5	175.4	177.5	0	114	E134 L135 M136 K142	E134-K138 WeakPolarHBondContact O-CB 3.4Å; E134-K138 PolarHBondContact O-N 2.93Å; L135-K138 PolarHBondContact O-N 3.38Å; M136-K138 VanDerWaalsContact C-N 3.27Å; M136-K138 PolarHBondContact O-N 3.03Å; K138-K142 WeakPolarHBondContact O-CD 3.47Å; K138-K142 WeakPolarHBondContact O-CE 3.27Å; K138-K142 VanDerWaalsContact O-CG 3.32Å; K138-K142 WeakPolarHBondContact O-CG 3.26Å
139	E	90.9	Very high	89.7	Confident	70 Å²	70	52.3 Å²	52.3	33%	0.327	26%	0.264	S	S	.	.	I	π-helix	trans	-101.2	-31	-177.5	-57.1	-52.7	139.7	0	0	111.8	V49 L135 K142 K143	V49-E139 HydrophobicContact CG1-CB 3.98Å; L135-E139 HydrophobicContact CD1-CB 4.3Å; L135-E139 HydrophobicContact CD1-CG 4.26Å; L135-E139 PolarHBondContact O-N 2.97Å; E139-K142 IonicContact OE1-NZ 2.65Å; E139-K142 PolarHBondContact OE1-NZ 3.01Å; E139-K142 WeakPolarHBondContact OE2-CD 3.27Å; E139-K142 IonicContact OE2-NZ 3.86Å; E139-K142 PolarHBondContact OE2-NZ 2.84Å; E139-K143 PolarHBondContact O-N 2.85Å; E139-K143 VanDerWaalsContact O-N 3.17Å
140	G	90.9	Very high	90.3	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.01	24%	0.243	C	C	.	.	I	π-helix	trans	-64.5	-49.1	171.9	0	0	0	0	0	112.8	L135 M136 K142 K143 V144	L135-G140 PolarHBondContact O-N 2.85Å; M136-G140 CarbonylContact O-C 3.58Å; M136-G140 WeakPolarHBondContact O-CA 3.22Å; M136-G140 PolarHBondContact O-N 2.79Å; M136-G140 VanDerWaalsContact O-N 3.14Å; G140-K142 VanDerWaalsContact C-N 3.29Å; G140-K142 PolarHBondContact O-N 3.34Å; G140-K143 PolarHBondContact O-N 3.05Å; G140-V144 WeakPolarHBondContact O-CG2 3.45Å; G140-V144 PolarHBondContact O-N 3.3Å
141	A	91.9	Very high	90.8	Very high	16 Å²	16	47 Å²	47	13%	0.132	24%	0.239	C	C	.	.	H	α-helix	trans	-56.7	-40.8	177.3	0	0	0	0	0	112.6	I119 M136 K137 V144 R145	I119-A141 HydrophobicContact CB-CB 4.11Å; I119-A141 HydrophobicContact CD1-CB 4.43Å; I119-A141 VanDerWaalsContact CD1-O 3.27Å; I119-A141 WeakPolarHBondContact CD1-O 3.44Å; I119-A141 HydrophobicContact CG2-CB 3.92Å; M136-A141 PolarHBondContact O-N 3.37Å; K137-A141 VanDerWaalsContact O-CB 3.27Å; K137-A141 WeakPolarHBondContact O-CB 3.47Å; A141-V144 PolarHBondContact O-N 3.29Å; A141-R145 VanDerWaalsContact O-CB 3.29Å; A141-R145 WeakPolarHBondContact O-CB 3.14Å; A141-R145 PolarHBondContact O-N 3.01Å
142	K	92.1	Very high	90.9	Very high	111 Å²	111	44.5 Å²	44.5	48%	0.483	22%	0.223	S	C	.	.	H	α-helix	trans	-61.7	-43.8	173.4	-67.4	172.2	-167.8	168.3	0	112.6	K138 E139 G140 R145 A146	K138-K142 WeakPolarHBondContact O-CD 3.47Å; K138-K142 WeakPolarHBondContact O-CE 3.27Å; K138-K142 VanDerWaalsContact O-CG 3.32Å; K138-K142 WeakPolarHBondContact O-CG 3.26Å; E139-K142 IonicContact OE1-NZ 2.65Å; E139-K142 PolarHBondContact OE1-NZ 3.01Å; E139-K142 WeakPolarHBondContact OE2-CD 3.27Å; E139-K142 IonicContact OE2-NZ 3.86Å; E139-K142 PolarHBondContact OE2-NZ 2.84Å; G140-K142 VanDerWaalsContact C-N 3.29Å; G140-K142 PolarHBondContact O-N 3.34Å; K142-R145 PolarHBondContact O-N 3.35Å; K142-A146 WeakPolarHBondContact O-CB 3.16Å; K142-A146 PolarHBondContact O-N 2.89Å
143	K	92.9	Very high	91	Very high	105 Å²	105	49.5 Å²	49.5	46%	0.457	25%	0.25	S	S	.	.	H	α-helix	trans	-67.3	-42.2	178	-74.9	-157.2	-177.4	-169.2	0	111.9	L47 R48 V49 E139 G140 A146 A147	L47-K143 HydrophobicContact CD1-CB 4.29Å; L47-K143 HydrophobicContact CD2-CB 3.82Å; L47-K143 HydrophobicContact CD2-CD 4.35Å; L47-K143 HydrophobicContact CG-CB 4.35Å; R48-K143 PolarHBondContact O-NZ 2.78Å; V49-K143 HydrophobicContact CG2-CD 4.25Å; E139-K143 PolarHBondContact O-N 2.85Å; E139-K143 VanDerWaalsContact O-N 3.17Å; G140-K143 PolarHBondContact O-N 3.05Å; K143-A146 PolarHBondContact O-N 3.1Å; K143-A147 WeakPolarHBondContact O-CB 3.4Å; K143-A147 PolarHBondContact O-N 3.09Å
144	V	92.9	Very high	90.8	Very high	4 Å²	4	51.5 Å²	51.5	2%	0.024	26%	0.259	C	S	.	.	H	α-helix	trans	-60	-48.6	174.4	171	0	0	0	0	109.9	L44 L47 I103 V105 I119 G140 A141 A146 A147 L148	L44-V144 HydrophobicContact CD2-CG1 4.09Å; L47-V144 HydrophobicContact CD1-CG2 4.1Å; L47-V144 HydrophobicContact CD2-CG2 4.38Å; I103-V144 HydrophobicContact CD1-CG2 4.09Å; V105-V144 HydrophobicContact CG2-CG1 4.24Å; I119-V144 HydrophobicContact CD1-CB 4.35Å; I119-V144 HydrophobicContact CD1-CG1 4.14Å; I119-V144 HydrophobicContact CG2-CG1 4.33Å; G140-V144 WeakPolarHBondContact O-CG2 3.45Å; G140-V144 PolarHBondContact O-N 3.3Å; A141-V144 PolarHBondContact O-N 3.29Å; V144-A146 VanDerWaalsContact C-N 3.33Å; V144-A146 PolarHBondContact O-N 2.9Å; V144-A147 WeakPolarHBondContact O-CB 3.27Å; V144-A147 PolarHBondContact O-N 3.07Å; V144-A147 VanDerWaalsContact O-N 3.1Å; V144-L148 HydrophobicContact CG1-CD1 4.16Å; V144-L148 HydrophobicContact CG1-CG 4.39Å; V144-L148 WeakPolarHBondContact O-CG 3.26Å; V144-L148 PolarHBondContact O-N 2.88Å
145	R	92.5	Very high	90.6	Very high	67 Å²	67	45.2 Å²	45.2	25%	0.253	23%	0.23	S	C	.	.	H	α-helix	trans	-55.6	-45	174.4	-175.6	172.5	-67.6	179	-6.1	112.9	M114 D115 L117 I119 A141 K142 A147 L148 G149	M114-R145 HydrophobicContact CB-CG 4.35Å; M114-R145 WeakPolarHBondContact O-CD 3.43Å; M114-R145 VanDerWaalsContact O-CG 3.31Å; M114-R145 WeakPolarHBondContact O-CG 3.37Å; M114-R145 PolarHBondContact O-NE 2.94Å; D115-R145 PolarHBondContact O-NH1 2.98Å; D115-R145 PolarHBondContact O-NH2 2.96Å; D115-R145 WeakPolarHBondContact OD1-CD 3.15Å; D115-R145 IonicContact OD1-NH1 2.7Å; D115-R145 PolarHBondContact OD1-NH1 3.5Å; L117-R145 PolarHBondContact O-NH2 2.85Å; I119-R145 HydrophobicContact CD1-CB 3.76Å; A141-R145 VanDerWaalsContact O-CB 3.29Å; A141-R145 WeakPolarHBondContact O-CB 3.14Å; A141-R145 PolarHBondContact O-N 3.01Å; K142-R145 PolarHBondContact O-N 3.35Å; R145-A147 VanDerWaalsContact C-N 3.35Å; R145-A147 PolarHBondContact O-N 3.5Å; R145-L148 PolarHBondContact O-N 3.36Å; R145-G149 PolarHBondContact O-N 3.29Å
146	A	92	Very high	90.2	Very high	59 Å²	59	49 Å²	49	49%	0.488	25%	0.245	S	C	.	.	H	α-helix	trans	-65.1	-36.4	176.9	0	0	0	0	0	112.6	K142 K143 V144 S150	K142-A146 WeakPolarHBondContact O-CB 3.16Å; K142-A146 PolarHBondContact O-N 2.89Å; K143-A146 PolarHBondContact O-N 3.1Å; V144-A146 VanDerWaalsContact C-N 3.33Å; V144-A146 PolarHBondContact O-N 2.9Å; A146-S150 WeakPolarHBondContact O-CB 3.32Å; A146-S150 PolarHBondContact O-N 3.27Å; A146-S150 PolarHBondContact O-OG 2.92Å
147	A	92.8	Very high	89.6	Confident	10 Å²	10	52 Å²	52	8%	0.083	27%	0.266	C	S	.	.	H	α-helix	trans	-66.5	-42.8	173.7	0	0	0	0	0	111.9	L43 L44 L47 K143 V144 R145 S150 Y151	L43-A147 HydrophobicContact CB-CB 4.33Å; L44-A147 HydrophobicContact CD2-CB 3.94Å; L47-A147 HydrophobicContact CD1-CB 3.95Å; K143-A147 WeakPolarHBondContact O-CB 3.4Å; K143-A147 PolarHBondContact O-N 3.09Å; V144-A147 WeakPolarHBondContact O-CB 3.27Å; V144-A147 PolarHBondContact O-N 3.07Å; V144-A147 VanDerWaalsContact O-N 3.1Å; R145-A147 VanDerWaalsContact C-N 3.35Å; R145-A147 PolarHBondContact O-N 3.5Å; A147-S150 WeakPolarHBondContact O-CB 3.27Å; A147-S150 PolarHBondContact O-N 3.42Å; A147-Y151 PolarHBondContact O-N 2.74Å
148	L	92.6	Very high	88.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-65.7	-42	175.4	-63.5	-179	0	0	0	112.2	L40 L44 V105 L108 L117 V144 R145 S150 Y151 V152	L40-L148 HydrophobicContact CD2-CD2 3.57Å; L44-L148 HydrophobicContact CD1-CD2 4Å; L44-L148 HydrophobicContact CD2-CD2 4.23Å; L44-L148 HydrophobicContact CG-CD2 4.44Å; V105-L148 HydrophobicContact CG1-CD1 3.98Å; V105-L148 HydrophobicContact CG2-CD1 4.41Å; L108-L148 HydrophobicContact CD1-CB 4.31Å; L108-L148 HydrophobicContact CD1-CD1 4.37Å; L108-L148 HydrophobicContact CD2-CB 4.38Å; L108-L148 HydrophobicContact CD2-CD1 4.17Å; L108-L148 HydrophobicContact CD2-CD2 3.72Å; L108-L148 HydrophobicContact CD2-CG 4.29Å; L117-L148 HydrophobicContact CD1-CD1 4Å; V144-L148 HydrophobicContact CG1-CD1 4.16Å; V144-L148 HydrophobicContact CG1-CG 4.39Å; V144-L148 WeakPolarHBondContact O-CG 3.26Å; V144-L148 PolarHBondContact O-N 2.88Å; R145-L148 PolarHBondContact O-N 3.36Å; L148-S150 VanDerWaalsContact C-N 3.31Å; L148-S150 PolarHBondContact O-N 3.44Å; L148-Y151 WeakPolarHBondContact O-CB 3.43Å; L148-Y151 PolarHBondContact O-N 2.87Å; L148-Y151 VanDerWaalsContact O-N 3.14Å; L148-V152 PolarHBondContact O-N 2.89Å
149	G	90.2	Very high	87.1	Confident	16 Å²	16	46 Å²	46	17%	0.165	24%	0.242	C	C	.	.	H	α-helix	trans	-60.8	-40.2	171.3	0	0	0	0	0	112.4	R145 Y151 V152 D153	R145-G149 PolarHBondContact O-N 3.29Å; G149-Y151 VanDerWaalsContact C-N 3.32Å; G149-Y151 PolarHBondContact O-N 2.84Å; G149-V152 PolarHBondContact O-N 2.7Å; G149-V152 VanDerWaalsContact O-N 3.15Å; G149-D153 PolarHBondContact O-N 3.46Å
150	S	90.7	Very high	85.8	Confident	44 Å²	44	43.6 Å²	43.6	31%	0.308	23%	0.232	S	C	.	.	H	α-helix	trans	-61.6	-38.6	173.7	-55.4	0	0	0	0	111.6	A146 A147 L148 V152 D153 H154	A146-S150 WeakPolarHBondContact O-CB 3.32Å; A146-S150 PolarHBondContact O-N 3.27Å; A146-S150 PolarHBondContact O-OG 2.92Å; A147-S150 WeakPolarHBondContact O-CB 3.27Å; A147-S150 PolarHBondContact O-N 3.42Å; L148-S150 VanDerWaalsContact C-N 3.31Å; L148-S150 PolarHBondContact O-N 3.44Å; S150-V152 VanDerWaalsContact C-N 3.34Å; S150-V152 PolarHBondContact O-N 3.05Å; S150-D153 PolarHBondContact O-N 2.66Å; S150-H154 PolarHBondContact O-N 3.2Å; S150-H154 PolarHBondContact O-ND1 3.48Å
151	Y	92.9	Very high	84.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-57.5	-47.5	172.9	155.2	-105.8	0	0	0	111.2	W35 S36 K39 L40 Y81 W83 A147 L148 G149 D153 H154 L155	W35-Y151 HydrophobicContact CZ3-CD2 4.33Å; W35-Y151 AromaticContact CZ3-CE2 3.93Å; W35-Y151 HydrophobicContact CZ3-CE2 3.93Å; S36-Y151 VanDerWaalsContact CB-OH 3.23Å; S36-Y151 WeakPolarHBondContact CB-OH 3.15Å; S36-Y151 PolarHBondContact OG-OH 3.17Å; K39-Y151 HydrophobicContact CB-CD2 4.32Å; K39-Y151 HydrophobicContact CG-CD2 4.32Å; L40-Y151 HydrophobicContact CD1-CD1 4.36Å; L40-Y151 HydrophobicContact CD1-CD2 4.49Å; L40-Y151 HydrophobicContact CD1-CE1 4.22Å; L40-Y151 HydrophobicContact CD1-CE2 4.37Å; L40-Y151 HydrophobicContact CD1-CG 4.48Å; L40-Y151 HydrophobicContact CD2-CD1 3.7Å; L40-Y151 HydrophobicContact CD2-CD2 4.1Å; L40-Y151 HydrophobicContact CD2-CE1 4.37Å; L40-Y151 HydrophobicContact CD2-CG 3.53Å; L40-Y151 HydrophobicContact CG-CD1 4.14Å; L40-Y151 HydrophobicContact CG-CD2 3.86Å; L40-Y151 HydrophobicContact CG-CE1 4.44Å; L40-Y151 HydrophobicContact CG-CE2 4.19Å; L40-Y151 HydrophobicContact CG-CG 3.83Å; Y81-Y151 HydrophobicContact CD2-CE1 4.41Å; W83-Y151 AromaticContact NE1-CZ 3.94Å; W83-Y151 PolarHBondContact NE1-OH 2.84Å; A147-Y151 PolarHBondContact O-N 2.74Å; L148-Y151 WeakPolarHBondContact O-CB 3.43Å; L148-Y151 PolarHBondContact O-N 2.87Å; L148-Y151 VanDerWaalsContact O-N 3.14Å; G149-Y151 VanDerWaalsContact C-N 3.32Å; G149-Y151 PolarHBondContact O-N 2.84Å; Y151-D153 VanDerWaalsContact C-N 3.31Å; Y151-D153 PolarHBondContact O-N 3.14Å; Y151-H154 PolarHBondContact O-N 2.92Å; Y151-L155 HydrophobicContact CE1-CD2 4.49Å; Y151-L155 HydrophobicContact CE2-CB 4.39Å; Y151-L155 WeakPolarHBondContact O-CB 3.48Å; Y151-L155 PolarHBondContact O-N 2.64Å
152	V	89.1	Confident	82.5	Confident	8 Å²	8	54.1 Å²	54.1	5%	0.048	30%	0.297	C	S	.	.	H	α-helix	trans	-62.3	-37.2	178.9	177.4	0	0	0	0	111.8	Y81 M114 L148 G149 S150 K156	Y81-V152 HydrophobicContact CE1-CG1 4.4Å; Y81-V152 HydrophobicContact CE1-CG2 4.32Å; Y81-V152 HydrophobicContact CE2-CG2 4.11Å; Y81-V152 WeakPolarHBondContact OH-CG2 3.47Å; M114-V152 HydrophobicContact CE-CG2 4.19Å; M114-V152 HydrophobicContact SD-CG2 4.15Å; L148-V152 PolarHBondContact O-N 2.89Å; G149-V152 PolarHBondContact O-N 2.7Å; G149-V152 VanDerWaalsContact O-N 3.15Å; S150-V152 VanDerWaalsContact C-N 3.34Å; S150-V152 PolarHBondContact O-N 3.05Å; V152-K156 HydrophobicContact CG1-CD 4Å; V152-K156 VanDerWaalsContact CG1-CE 3.5Å; V152-K156 WeakPolarHBondContact O-CB 3.43Å; V152-K156 WeakPolarHBondContact O-CD 3.44Å; V152-K156 VanDerWaalsContact O-CG 3.28Å; V152-K156 WeakPolarHBondContact O-CG 3.31Å; V152-K156 PolarHBondContact O-N 3.17Å; V152-K156 VanDerWaalsContact O-N 3.08Å
153	D	87.6	Confident	80.9	Confident	106 Å²	106	50.2 Å²	50.2	57%	0.567	28%	0.28	S	S	*	.	H	α-helix	trans	-68.5	-42.2	175.2	-75.2	-24.3	0	0	0	112.4	G149 S150 Y151 K156 S157	G149-D153 PolarHBondContact O-N 3.46Å; S150-D153 PolarHBondContact O-N 2.66Å; Y151-D153 VanDerWaalsContact C-N 3.31Å; Y151-D153 PolarHBondContact O-N 3.14Å; D153-K156 PolarHBondContact O-N 2.92Å; D153-S157 WeakPolarHBondContact O-CB 3.43Å; D153-S157 PolarHBondContact O-N 3.33Å; D153-S157 VanDerWaalsContact O-N 3.09Å; D153-S157 PolarHBondContact O-OG 3.49Å
154	H	84.6	Confident	79	Confident	50 Å²	50	48.8 Å²	48.8	23%	0.231	28%	0.277	C	S	.	.	H	α-helix	trans	-64.8	-40.8	173.6	-64.7	112.9	0	0	0	111.5	W35 S150 Y151 K156 S157 E158 F159	W35-H154 HydrophobicContact CH2-CB 3.91Å; W35-H154 HydrophobicContact CZ2-CB 4.36Å; S150-H154 PolarHBondContact O-N 3.2Å; S150-H154 PolarHBondContact O-ND1 3.48Å; Y151-H154 PolarHBondContact O-N 2.92Å; H154-K156 VanDerWaalsContact C-N 3.25Å; H154-K156 PolarHBondContact O-N 2.68Å; H154-S157 PolarHBondContact O-N 2.95Å; H154-S157 VanDerWaalsContact O-N 3.12Å; H154-E158 HydrophobicContact CB-CG 4.24Å; H154-E158 IonicContact CD2-OE1 3.59Å; H154-E158 PolarHBondContact CD2-OE1 3.25Å; H154-E158 IonicContact CD2-OE2 3.54Å; H154-E158 IonicContact CG-OE2 3.98Å; H154-E158 IonicContact NE2-OE1 3.45Å; H154-E158 PolarHBondContact O-N 3.49Å; H154-F159 PolarHBondContact O-N 3.47Å
155	L	84.4	Confident	76.8	Confident	1 Å²	1	52 Å²	52	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-57.7	-39.8	175.6	-178.6	71.2	0	0	0	111.3	V32 W35 I70 Y79 Y81 Y151 T160	V32-L155 HydrophobicContact CG2-CD1 3.76Å; W35-L155 HydrophobicContact CE3-CD1 4.16Å; W35-L155 HydrophobicContact CH2-CB 4.41Å; W35-L155 HydrophobicContact CZ3-CB 4.03Å; W35-L155 HydrophobicContact CZ3-CD1 3.7Å; I70-L155 HydrophobicContact CD1-CD1 3.94Å; I70-L155 HydrophobicContact CD1-CG 4.38Å; Y79-L155 HydrophobicContact CD1-CD2 4.4Å; Y79-L155 HydrophobicContact CD1-CG 4.24Å; Y81-L155 HydrophobicContact CD1-CD2 3.68Å; Y81-L155 HydrophobicContact CE1-CD2 4.14Å; Y81-L155 HydrophobicContact CG-CD2 4.38Å; Y151-L155 HydrophobicContact CE1-CD2 4.49Å; Y151-L155 HydrophobicContact CE2-CB 4.39Å; Y151-L155 WeakPolarHBondContact O-CB 3.48Å; Y151-L155 PolarHBondContact O-N 2.64Å; L155-T160 WeakPolarHBondContact O-CG2 3.42Å
156	K	81.6	Confident	74.4	Confident	95 Å²	95	54.8 Å²	54.8	41%	0.413	32%	0.32	S	S	.	.	H	α-helix	trans	-78.5	-16.9	178.5	-72.2	167.8	-177.9	168.2	0	114.4	Y79 V152 D153 H154 T160	Y79-K156 HydrophobicContact CD1-CG 4.33Å; Y79-K156 HydrophobicContact CD2-CG 4.47Å; Y79-K156 HydrophobicContact CE1-CB 4.36Å; Y79-K156 HydrophobicContact CE1-CG 3.88Å; Y79-K156 HydrophobicContact CE2-CG 4.06Å; V152-K156 HydrophobicContact CG1-CD 4Å; V152-K156 VanDerWaalsContact CG1-CE 3.5Å; V152-K156 WeakPolarHBondContact O-CB 3.43Å; V152-K156 WeakPolarHBondContact O-CD 3.44Å; V152-K156 VanDerWaalsContact O-CG 3.28Å; V152-K156 WeakPolarHBondContact O-CG 3.31Å; V152-K156 PolarHBondContact O-N 3.17Å; V152-K156 VanDerWaalsContact O-N 3.08Å; D153-K156 PolarHBondContact O-N 2.92Å; H154-K156 VanDerWaalsContact C-N 3.25Å; H154-K156 PolarHBondContact O-N 2.68Å; K156-T160 PolarHBondContact O-OG1 3Å
157	S	78.4	Confident	71.7	Confident	63 Å²	63	56 Å²	56	44%	0.441	32%	0.322	S	S	.	.	H	α-helix	trans	-122.5	-55.8	-171	59.3	0	0	0	0	115	D153 H154	D153-S157 WeakPolarHBondContact O-CB 3.43Å; D153-S157 PolarHBondContact O-N 3.33Å; D153-S157 VanDerWaalsContact O-N 3.09Å; D153-S157 PolarHBondContact O-OG 3.49Å; H154-S157 PolarHBondContact O-N 2.95Å; H154-S157 VanDerWaalsContact O-N 3.12Å
158	E	66.2	Low	68.9	Low	96 Å²	96	60.3 Å²	60.3	45%	0.449	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-45.9	-178.3	-63.8	-171.8	151.8	0	0	111.2	W35 K39 H154	W35-E158 HydrophobicContact CZ2-CB 4.44Å; K39-E158 IonicContact NZ-OE1 2.81Å; K39-E158 IonicContact NZ-OE2 2.68Å; K39-E158 PolarHBondContact NZ-OE2 3.42Å; H154-E158 HydrophobicContact CB-CG 4.24Å; H154-E158 IonicContact CD2-OE1 3.59Å; H154-E158 PolarHBondContact CD2-OE1 3.25Å; H154-E158 IonicContact CD2-OE2 3.54Å; H154-E158 IonicContact CG-OE2 3.98Å; H154-E158 IonicContact NE2-OE1 3.45Å; H154-E158 PolarHBondContact O-N 3.49Å
159	F	63	Low	66.2	Low	43 Å²	43	67.4 Å²	67.4	19%	0.189	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-32.8	-173.9	-161.2	-80.3	0	0	0	113	V32 W35 I70 H154 Q161 M163	V32-F159 HydrophobicContact CB-CE1 4.17Å; V32-F159 HydrophobicContact CB-CE2 4.24Å; V32-F159 HydrophobicContact CB-CZ 4Å; V32-F159 HydrophobicContact CG1-CD1 3.75Å; V32-F159 HydrophobicContact CG1-CE1 3.19Å; V32-F159 HydrophobicContact CG1-CE2 4.09Å; V32-F159 HydrophobicContact CG1-CG 4.41Å; V32-F159 HydrophobicContact CG1-CZ 3.38Å; W35-F159 HydrophobicContact CB-CD2 4.13Å; W35-F159 HydrophobicContact CB-CE2 3.85Å; W35-F159 AromaticContact CD1-CD2 3.96Å; W35-F159 AromaticContact CD2-CD2 3.59Å; W35-F159 HydrophobicContact CD2-CD2 3.59Å; W35-F159 HydrophobicContact CD2-CE2 4.26Å; W35-F159 HydrophobicContact CD2-CG 4.47Å; W35-F159 AromaticContact CE2-CD2 3.98Å; W35-F159 HydrophobicContact CE3-CD2 4.03Å; W35-F159 AromaticContact CG-CD2 3.61Å; W35-F159 HydrophobicContact CG-CD2 3.61Å; W35-F159 AromaticContact CG-CE2 3.82Å; W35-F159 HydrophobicContact CG-CE2 3.82Å; I70-F159 HydrophobicContact CD1-CD1 3.8Å; I70-F159 HydrophobicContact CD1-CE1 4.5Å; I70-F159 HydrophobicContact CD1-CG 4.45Å; H154-F159 PolarHBondContact O-N 3.47Å; F159-Q161 VanDerWaalsContact C-N 3.28Å; F159-Q161 PolarHBondContact O-N 3.14Å; F159-M163 HydrophobicContact CD1-SD 3.61Å; F159-M163 HydrophobicContact CE1-SD 3.7Å
160	T	62.4	Low	63.8	Low	20 Å²	20	70.5 Å²	70.5	12%	0.123	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-13.5	-177.1	60.4	0	0	0	0	113.9	I70 L77 Y79 L155 K156 G162 M163	I70-T160 HydrophobicContact CD1-CG2 4.21Å; L77-T160 VanDerWaalsContact CD1-CB 3.47Å; L77-T160 HydrophobicContact CD1-CG2 3.48Å; L77-T160 VanDerWaalsContact CD1-CG2 3.48Å; Y79-T160 HydrophobicContact CE1-CG2 3.56Å; Y79-T160 WeakPolarHBondContact OH-CG2 3.18Å; L155-T160 WeakPolarHBondContact O-CG2 3.42Å; K156-T160 PolarHBondContact O-OG1 3Å; T160-G162 PolarHBondContact O-N 3.35Å; T160-M163 PolarHBondContact O-N 2.98Å
161	Q	59.5	Low	60.9	Low	170 Å²	170	74.7 Å²	74.7	79%	0.794	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	101.1	-179	-170.9	170.2	-9.5	0	0	110.7	F159	F159-Q161 VanDerWaalsContact C-N 3.28Å; F159-Q161 PolarHBondContact O-N 3.14Å
162	G	54.3	Low	58	Low	69 Å²	69	79.3 Å²	79.3	71%	0.711	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.6	-1.8	-176.3	0	0	0	0	0	115.3	T160 I164	T160-G162 PolarHBondContact O-N 3.35Å; G162-I164 PolarHBondContact O-N 3.5Å
163	M	58.9	Low	55.2	Low	28 Å²	28	84.1 Å²	84.1	14%	0.138	52%	0.523	C	S	.	.	S	Bend	trans	-74.3	-9.9	172.4	-72.3	-167.9	64.9	0	0	114.1	R30 I70 N72 L77 F159 T160	R30-M163 HydrophobicContact CB-CE 3.96Å; R30-M163 HydrophobicContact CG-CE 3.89Å; I70-M163 HydrophobicContact CB-CE 3.92Å; I70-M163 HydrophobicContact CB-SD 4.33Å; I70-M163 HydrophobicContact CD1-SD 4.34Å; I70-M163 HydrophobicContact CG2-CE 3.69Å; I70-M163 HydrophobicContact CG2-SD 4.04Å; N72-M163 PolarHBondContact ND2-O 2.83Å; L77-M163 HydrophobicContact CD2-CB 4.44Å; F159-M163 HydrophobicContact CD1-SD 3.61Å; F159-M163 HydrophobicContact CE1-SD 3.7Å; T160-M163 PolarHBondContact O-N 2.98Å
164	I	53.5	Low	52.4	Low	76 Å²	76	88 Å²	88	39%	0.39	54%	0.535	S	S	.	.	S	Bend	trans	-107.8	113	172.6	-57.7	173.6	0	0	0	107.2	L77 G162	L77-I164 HydrophobicContact CD1-CD1 4.27Å; L77-I164 HydrophobicContact CD1-CG1 4.33Å; L77-I164 HydrophobicContact CD2-CG1 4.19Å; L77-I164 HydrophobicContact CG-CD1 4.19Å; L77-I164 HydrophobicContact CG-CG1 4.24Å; G162-I164 PolarHBondContact O-N 3.5Å
165	L	46.3	Very low	49.8	Very low	72 Å²	72	92 Å²	92	38%	0.377	57%	0.565	S	S	.	*			trans	-59.1	134.9	174.3	-80.5	159.7	0	0	0	110.2	T20 N21 T167	T20-L165 HydrophobicContact CG2-CD1 4.26Å; N21-L165 HydrophobicContact CB-CD1 4.27Å; N21-L165 WeakPolarHBondContact O-CD1 3.49Å; L165-T167 PolarHBondContact O-N 3.28Å
166	P	41.1	Very low	47.1	Very low	124 Å²	124	100.5 Å²	100.5	81%	0.805	61%	0.605	S	S	*	*			trans	-61.9	109.4	175.3	-21.7	32.8	0	0	0	111	A168	P166-A168 PolarHBondContact O-N 2.83Å
167	T	36.8	Very low	44.9	Very low	85 Å²	85	101.7 Å²	101.7	52%	0.521	62%	0.622	S	S	.	*			trans	-62.9	133.6	171.6	-41	0	0	0	0	109.1	L165 N169	L165-T167 PolarHBondContact O-N 3.28Å; T167-N169 CarbonylContact O-C 3.57Å; T167-N169 PolarHBondContact O-N 2.93Å
168	A	32.6	Very low	42.4	Very low	101 Å²	101	105.2 Å²	105.2	84%	0.835	64%	0.641	S	S	*	*	S	Bend	trans	-67.8	14.2	-171.4	0	0	0	0	0	116.2	P166	P166-A168 PolarHBondContact O-N 2.83Å
169	N	35.6	Very low	40.7	Very low	148 Å²	148	109.7 Å²	109.7	79%	0.791	66%	0.662	S	S	*	*	S	Bend	trans	-127	101.9	165.4	-85	-41.9	0	0	0	108.1	T167 V171	T167-N169 CarbonylContact O-C 3.57Å; T167-N169 PolarHBondContact O-N 2.93Å; N169-V171 PolarHBondContact O-N 3.16Å; N169-V171 VanDerWaalsContact O-N 3.17Å
170	G	40.1	Very low	38.9	Very low	81 Å²	81	114.3 Å²	114.3	84%	0.835	69%	0.694	S	S	*	*			trans	-69.4	109.3	-169.2	0	0	0	0	0	113.8
171	V	29.9	Very low	37.2	Very low	132 Å²	132	122.9 Å²	122.9	80%	0.8	73%	0.729	S	S	*	*			trans	-131.2	90.7	154.8	-174.1	0	0	0	0	108.2	N169 S173	N169-V171 PolarHBondContact O-N 3.16Å; N169-V171 VanDerWaalsContact O-N 3.17Å; V171-S173 PolarHBondContact O-N 2.95Å; V171-S173 VanDerWaalsContact O-N 3.08Å
172	A	32.7	Very low	35.8	Very low	98 Å²	98	121.1 Å²	121.1	81%	0.81	73%	0.73	S	S	*	*			trans	-74.3	94.3	170.1	0	0	0	0	0	109.3	K174	A172-K174 VanDerWaalsContact C-N 3.34Å; A172-K174 PolarHBondContact O-N 3.45Å
173	S	30.4	Very low	34.5	Very low	109 Å²	109	127.2 Å²	127.2	76%	0.762	74%	0.737	S	S	*	*			trans	-71.6	86.8	174.6	54.3	0	0	0	0	110.7	V171	V171-S173 PolarHBondContact O-N 2.95Å; V171-S173 VanDerWaalsContact O-N 3.08Å
174	K	29.1	Very low	32.9	Very low	188 Å²	188	132.4 Å²	132.4	82%	0.817	77%	0.77	S	S	*	*			trans	-62.6	139.8	164.8	-74.8	-179.4	174.3	179.2	0	109.9	A172	A172-K174 VanDerWaalsContact C-N 3.34Å; A172-K174 PolarHBondContact O-N 3.45Å
175	P	29.3	Very low	31.5	Very low	132 Å²	132	135.8 Å²	135.8	86%	0.857	79%	0.789	S	S	*	*			trans	-68.7	131.6	162.3	-5.9	21.6	0	0	0	109.2
176	Q	27.9	Very low	30.6	Very low	181 Å²	181	139.8 Å²	139.8	85%	0.846	80%	0.803	S	S	*	*			trans	-126.6	135.6	167.7	-134.7	-169.7	-44.6	0	0	108.7
177	P	35.7	Very low	29.9	Very low	119 Å²	119	140 Å²	140	77%	0.773	80%	0.803	S	S	*	*			trans	-85.4	139.5	-173.6	33	-33.8	0	0	0	111.7
178	T	26	Very low	29.4	Very low	137 Å²	137	142.2 Å²	142.2	84%	0.84	81%	0.807	S	S	*	*			trans	-115.4	95.1	175	35.5	0	0	0	0	111.8
179	Q	29.6	Very low	29.2	Very low	191 Å²	191	144.6 Å²	144.6	89%	0.893	80%	0.804	S	S	*	*			trans	-72.5	128.8	150.9	-64.6	178.7	2	0	0	108.8
180	T	24.7	Very low	28.8	Very low	139 Å²	139	140.5 Å²	140.5	85%	0.853	80%	0.797	S	S	*	*			trans	-155.8	142.7	139.1	3.2	0	0	0	0	113.8
181	K	28	Very low	28.2	Very low	200 Å²	200	142.5 Å²	142.5	87%	0.87	80%	0.798	S	S	*	*			trans	-69.1	147.3	178.6	-61.7	154.5	176.5	167.7	0	111.3
182	V	28.6	Very low	28.1	Very low	134 Å²	134	141.6 Å²	141.6	81%	0.812	80%	0.798	S	S	*	*			trans	-127.7	118.4	150.3	-178.2	0	0	0	0	109.1	V184	V182-V184 HydrophobicContact CG1-CG2 4.19Å
183	K	27.6	Very low	27.9	Very low	197 Å²	197	143.8 Å²	143.8	86%	0.857	80%	0.8	S	S	*	*			trans	-76.8	137.8	161.5	-86.3	-179.9	165.8	-172.3	0	108.2
184	V	25.9	Very low	27.9	Very low	137 Å²	137	144.6 Å²	144.6	83%	0.83	81%	0.806	S	S	*	*			trans	-134.3	137.7	147.9	-173.1	0	0	0	0	108	V182	V182-V184 HydrophobicContact CG1-CG2 4.19Å
185	D	24.3	Very low	28	Very low	147 Å²	147	140 Å²	140	79%	0.786	80%	0.804	S	S	*	*			trans	-89.4	-175.2	-173.9	-142.8	-74.6	0	0	0	112.5
186	K	27.5	Very low	28.4	Very low	155 Å²	155	139.3 Å²	139.3	67%	0.674	80%	0.799	S	S	*	*			trans	-88.7	155.3	-158.7	-175.2	-177.8	-176.7	-177	0	114
187	T	24.6	Very low	28.3	Very low	129 Å²	129	135.8 Å²	135.8	79%	0.791	80%	0.795	S	S	*	*			trans	163.5	109	143	-69.4	0	0	0	0	108.1
188	Q	28	Very low	28.5	Very low	132 Å²	132	136.3 Å²	136.3	62%	0.617	80%	0.798	S	S	*	*				61.8	133.1	71	-73.9	-173.1	-110.9	0	0	113.7
189	I	27.4	Very low	28.8	Very low	150 Å²	150	135.2 Å²	135.2	77%	0.769	80%	0.796	S	S	*	*			cis	-152.4	161.3	7.6	-90.6	145.2	0	0	0	106.1
190	G	26.8	Very low	29.3	Very low	62 Å²	62	133.8 Å²	133.8	64%	0.639	80%	0.8	S	S	*	*			cis	149.1	175.1	0.2	0	0	0	0	0	111.4
191	S	27.9	Very low	30.1	Very low	124 Å²	124	129.5 Å²	129.5	87%	0.867	78%	0.784	S	S	*	*			trans	73.2	143.5	175.4	-53.2	0	0	0	0	117.3
192	S	28	Very low	30.7	Very low	113 Å²	113	126.4 Å²	126.4	79%	0.79	78%	0.781	S	S	*	*			cis	-155.2	152.3	7.9	35.5	0	0	0	0	114.8
193	V	29.7	Very low	31.9	Very low	143 Å²	143	129.6 Å²	129.6	87%	0.867	78%	0.784	S	S	*	*			trans	3.1	130.7	166	-81.1	0	0	0	0	123.9
194	S	29.1	Very low	33.8	Very low	126 Å²	126	122.8 Å²	122.8	88%	0.881	76%	0.757	S	S	*	*				-161.1	150.8	110.9	49.4	0	0	0	0	111.2
195	A	32.4	Very low	36.3	Very low	93 Å²	93	120.8 Å²	120.8	77%	0.769	75%	0.746	S	S	*	*			trans	-117.2	154.1	178.7	0	0	0	0	0	109.6
196	P	36.1	Very low	39.1	Very low	117 Å²	117	117.2 Å²	117.2	76%	0.76	73%	0.73	S	S	*	*				-152.4	179.1	81.8	39.5	-20.2	0	0	0	117.5
197	S	27.4	Very low	41.6	Very low	107 Å²	107	110.7 Å²	110.7	75%	0.748	70%	0.704	S	S	*	*			trans	83.3	139.9	162.4	-12.9	0	0	0	0	118.6
198	P	38.7	Very low	44.8	Very low	130 Å²	130	113 Å²	113	84%	0.844	70%	0.703	S	S	*	*			trans	-89.9	116.9	-176.1	34.1	-31.4	0	0	0	112.1
199	S	32.5	Very low	47.7	Very low	114 Å²	114	108 Å²	108	80%	0.797	68%	0.679	S	S	*	*			trans	-100.3	115.1	160.9	60.5	0	0	0	0	110.4	G201	S199-G201 PolarHBondContact O-N 3.39Å
200	T	41.2	Very low	50.7	Low	160 Å²	160	104 Å²	104	98%	0.982	67%	0.665	S	S	*	*			trans	-71.1	67.5	160.5	18.1	0	0	0	0	108.9
201	G	39.8	Very low	53.6	Low	49 Å²	49	102.2 Å²	102.2	51%	0.505	64%	0.64	S	S	.	*			trans	-112	120.3	-179.3	0	0	0	0	0	111.6	S199 K203	S199-G201 PolarHBondContact O-N 3.39Å; G201-K203 PolarHBondContact O-N 3.13Å
202	V	42.3	Very low	56.6	Low	135 Å²	135	102 Å²	102	82%	0.818	63%	0.625	S	S	*	*			trans	-59.4	123.1	162.5	177.6	0	0	0	0	107.2	I204	V202-I204 VanDerWaalsContact C-N 3.28Å; V202-I204 PolarHBondContact O-N 2.58Å
203	K	51.8	Low	59.6	Low	201 Å²	201	99.5 Å²	99.5	87%	0.874	60%	0.601	S	S	*	*			trans	-73.4	84.4	178.4	-69.1	-176.7	180	179	0	109.6	G201 P205	G201-K203 PolarHBondContact O-N 3.13Å; K203-P205 WeakPolarHBondContact O-CD 3.34Å
204	I	69.1	Low	62.5	Low	55 Å²	55	95.1 Å²	95.1	28%	0.282	58%	0.575	S	S	.	*			trans	-56.4	121.7	173.4	-61.7	158.5	0	0	0	108	V202 T206 P280 H283 P308	V202-I204 VanDerWaalsContact C-N 3.28Å; V202-I204 PolarHBondContact O-N 2.58Å; I204-T206 PolarHBondContact O-N 2.85Å; I204-P280 HydrophobicContact CD1-CB 3.79Å; I204-P280 HydrophobicContact CD1-CG 3.72Å; I204-H283 HydrophobicContact CD1-CB 4.41Å; I204-P308 HydrophobicContact CG2-CB 4.03Å; I204-P308 HydrophobicContact CG2-CG 4.34Å
205	P	77.3	Confident	65.4	Low	94 Å²	94	89.1 Å²	89.1	61%	0.61	53%	0.533	S	S	*	.			trans	-63.3	120.8	172.2	-20.4	33.2	0	0	0	109.3	K203 P308 T309	K203-P205 WeakPolarHBondContact O-CD 3.34Å; P205-P308 WeakPolarHBondContact O-CA 3.27Å; P205-T309 PolarHBondContact O-N 3.13Å; P205-T309 PolarHBondContact O-OG1 3.36Å
206	T	84.6	Confident	68.1	Low	72 Å²	72	87.2 Å²	87.2	44%	0.442	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	138.8	178	57.1	0	0	0	0	111.8	I204 V307	I204-T206 PolarHBondContact O-N 2.85Å; T206-V307 CarbonylContact C-O 3.58Å; T206-V307 WeakPolarHBondContact CA-O 3.05Å; T206-V307 WeakPolarHBondContact CB-O 3.27Å
207	C	79.8	Confident	70.6	Confident	18 Å²	18	82.6 Å²	82.6	12%	0.122	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	177.2	171.8	64.3	0	0	0	0	112.4	G306 V307 E312	C207-G306 PolarHBondContact O-N 2.81Å; C207-V307 PolarHBondContact N-O 3.09Å; C207-V307 PolarHBondContact SG-O 3.33Å; C207-V307 VanDerWaalsContact SG-O 3.34Å; C207-E312 WeakPolarHBondContact CB-OE2 3.22Å; C207-E312 VanDerWaalsContact SG-CD 3.6Å; C207-E312 PolarHBondContact SG-OE2 3.27Å
208	K	90.5	Very high	73.7	Confident	177 Å²	177	80 Å²	80	77%	0.77	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.8	129.8	173.7	51.2	175.5	-179.9	173.4	0	108.3	F304	K208-F304 WeakPolarHBondContact CA-O 3.33Å
209	F	89.4	Confident	76.1	Confident	28 Å²	28	74.7 Å²	74.7	12%	0.123	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	169.5	180	60.9	-91.4	0	0	0	109.6	L211 F304 V307 E312 T315 K316	F209-L211 HydrophobicContact CD2-CG 4.41Å; F209-L211 HydrophobicContact CE2-CG 4.32Å; F209-F304 HydrophobicContact CD1-CB 4.17Å; F209-F304 HydrophobicContact CD2-CB 4.13Å; F209-F304 AromaticContact CD2-CD2 3.56Å; F209-F304 HydrophobicContact CD2-CD2 3.56Å; F209-F304 HydrophobicContact CD2-CE2 4.15Å; F209-F304 AromaticContact CD2-CG 3.95Å; F209-F304 HydrophobicContact CD2-CG 3.95Å; F209-F304 HydrophobicContact CE1-CB 3.92Å; F209-F304 HydrophobicContact CE1-CG 4.21Å; F209-F304 HydrophobicContact CE2-CB 3.89Å; F209-F304 AromaticContact CE2-CD1 3.87Å; F209-F304 HydrophobicContact CE2-CD1 3.87Å; F209-F304 AromaticContact CE2-CD2 3.23Å; F209-F304 HydrophobicContact CE2-CD2 3.23Å; F209-F304 HydrophobicContact CE2-CE1 4.17Å; F209-F304 AromaticContact CE2-CE2 3.61Å; F209-F304 HydrophobicContact CE2-CE2 3.61Å; F209-F304 AromaticContact CE2-CG 3.39Å; F209-F304 HydrophobicContact CE2-CG 3.39Å; F209-F304 HydrophobicContact CE2-CZ 4.06Å; F209-F304 HydrophobicContact CG-CB 4.26Å; F209-F304 HydrophobicContact CG-CD2 4.45Å; F209-F304 HydrophobicContact CZ-CB 3.78Å; F209-F304 AromaticContact CZ-CD1 3.73Å; F209-F304 HydrophobicContact CZ-CD1 3.73Å; F209-F304 AromaticContact CZ-CD2 3.92Å; F209-F304 HydrophobicContact CZ-CD2 3.92Å; F209-F304 HydrophobicContact CZ-CE1 4.25Å; F209-F304 HydrophobicContact CZ-CE2 4.43Å; F209-F304 AromaticContact CZ-CG 3.54Å; F209-F304 HydrophobicContact CZ-CG 3.54Å; F209-F304 PolarHBondContact N-O 2.76Å; F209-F304 PolarHBondContact O-N 2.68Å; F209-V307 HydrophobicContact CE1-CB 4.08Å; F209-V307 HydrophobicContact CE1-CG1 4.12Å; F209-V307 HydrophobicContact CE1-CG2 3.87Å; F209-V307 HydrophobicContact CZ-CG2 4.29Å; F209-E312 HydrophobicContact CD1-CG 3.76Å; F209-E312 HydrophobicContact CE1-CG 3.78Å; F209-T315 HydrophobicContact CZ-CG2 4.01Å; F209-K316 HydrophobicContact CD2-CD 4.48Å; F209-K316 HydrophobicContact CD2-CG 3.85Å; F209-K316 HydrophobicContact CE1-CG 4.47Å; F209-K316 HydrophobicContact CE2-CD 4.47Å; F209-K316 HydrophobicContact CE2-CG 3.42Å; F209-K316 VanDerWaalsContact CE2-CG 3.42Å; F209-K316 HydrophobicContact CZ-CG 3.78Å
210	S	90.4	Very high	78.9	Confident	67 Å²	67	71.5 Å²	71.5	47%	0.469	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	140.4	173.7	58.7	0	0	0	0	110.5	V302	S210-V302 CarbonylContact C-O 3.57Å; S210-V302 WeakPolarHBondContact CA-O 3.46Å
211	L	87.8	Confident	81.2	Confident	24 Å²	24	66.6 Å²	66.6	13%	0.126	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	151.2	166	-59.8	178.1	0	0	0	108.9	F209 V302 F304 K316 W319 F324	F209-L211 HydrophobicContact CD2-CG 4.41Å; F209-L211 HydrophobicContact CE2-CG 4.32Å; L211-V302 PolarHBondContact N-O 2.83Å; L211-V302 PolarHBondContact O-N 2.82Å; L211-F304 HydrophobicContact CB-CE2 4.13Å; L211-F304 HydrophobicContact CD1-CE2 3.85Å; L211-F304 HydrophobicContact CD1-CZ 3.95Å; L211-F304 HydrophobicContact CG-CE2 3.78Å; L211-F304 HydrophobicContact CG-CZ 4.4Å; L211-K316 HydrophobicContact CD2-CG 4.32Å; L211-W319 HydrophobicContact CD1-CB 3.99Å; L211-F324 HydrophobicContact CB-CE2 3.93Å; L211-F324 HydrophobicContact CB-CZ 4.13Å; L211-F324 HydrophobicContact CD1-CE2 3.95Å; L211-F324 HydrophobicContact CD1-CZ 4.28Å
212	Q	91.3	Very high	83.7	Confident	118 Å²	118	64.3 Å²	64.3	55%	0.551	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.7	134.4	175.8	178.4	175.3	-14.9	0	0	108	E299 L300	Q212-E299 HydrophobicContact CG-CG 4.26Å; Q212-E299 VanDerWaalsContact NE2-CD 3.26Å; Q212-E299 PolarHBondContact NE2-OE1 2.83Å; Q212-E299 VanDerWaalsContact NE2-OE1 3.14Å; Q212-L300 WeakPolarHBondContact CA-O 3.28Å
213	E	91	Very high	86	Confident	62 Å²	62	59.1 Å²	59.1	29%	0.29	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	149.6	-176.2	-172.4	55.4	-91.4	0	0	110.2	F215 L300 F324 K328	E213-F215 HydrophobicContact CB-CE2 3.97Å; E213-F215 HydrophobicContact CG-CE2 3.8Å; E213-F215 HydrophobicContact CG-CZ 4.04Å; E213-L300 PolarHBondContact N-O 2.96Å; E213-L300 PolarHBondContact O-N 3.38Å; E213-F324 HydrophobicContact CB-CD2 3.83Å; E213-F324 HydrophobicContact CB-CE2 4.01Å; E213-F324 HydrophobicContact CB-CG 4.21Å; E213-F324 HydrophobicContact CG-CB 4.08Å; E213-F324 HydrophobicContact CG-CD2 3.93Å; E213-F324 HydrophobicContact CG-CG 4.04Å; E213-K328 IonicContact OE1-NZ 3.6Å; E213-K328 PolarHBondContact OE1-NZ 3.04Å; E213-K328 IonicContact OE2-NZ 3.86Å; E213-K328 PolarHBondContact OE2-NZ 3.2Å
214	T	90.3	Very high	87.8	Confident	51 Å²	51	55.6 Å²	55.6	31%	0.313	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	137.1	-178.3	-54.5	0	0	0	0	111.1	E297 K328	T214-E297 HydrophobicContact CG2-CB 3.7Å; T214-E297 HydrophobicContact CG2-CG 4.47Å; T214-E297 WeakPolarHBondContact CG2-OE2 3.47Å; T214-K328 WeakPolarHBondContact O-CE 3.08Å; T214-K328 PolarHBondContact O-NZ 2.68Å; T214-K328 VanDerWaalsContact O-NZ 3.1Å
215	F	89.9	Confident	88.9	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	135.2	-178.5	-64.8	-98.1	0	0	0	110.5	E213 T217 L222 E297 T298 L300 F324 I327 K328 F333	E213-F215 HydrophobicContact CB-CE2 3.97Å; E213-F215 HydrophobicContact CG-CE2 3.8Å; E213-F215 HydrophobicContact CG-CZ 4.04Å; F215-T217 HydrophobicContact CB-CG2 3.98Å; F215-T217 PolarHBondContact O-N 3.3Å; F215-L222 HydrophobicContact CB-CD1 4.45Å; F215-L222 HydrophobicContact CB-CD2 4.21Å; F215-L222 HydrophobicContact CD1-CD1 3.99Å; F215-L222 HydrophobicContact CD2-CD1 4.29Å; F215-L222 HydrophobicContact CD2-CD2 3.81Å; F215-L222 HydrophobicContact CE1-CD1 4.3Å; F215-L222 HydrophobicContact CE2-CD2 4.43Å; F215-L222 HydrophobicContact CG-CD1 3.99Å; F215-L222 HydrophobicContact CG-CD2 4.04Å; F215-E297 CarbonylContact O-C 3.54Å; F215-E297 VanDerWaalsContact O-CA 3.29Å; F215-E297 WeakPolarHBondContact O-CA 3.38Å; F215-T298 PolarHBondContact N-O 3.16Å; F215-T298 PolarHBondContact O-N 3.29Å; F215-L300 HydrophobicContact CD2-CB 4Å; F215-L300 HydrophobicContact CE2-CB 3.79Å; F215-L300 HydrophobicContact CE2-CD2 3.7Å; F215-L300 HydrophobicContact CE2-CG 4.39Å; F215-L300 HydrophobicContact CZ-CD2 4.21Å; F215-F324 HydrophobicContact CE2-CD1 4.47Å; F215-F324 HydrophobicContact CZ-CB 4.05Å; F215-F324 AromaticContact CZ-CD1 3.88Å; F215-F324 HydrophobicContact CZ-CD1 3.88Å; F215-F324 HydrophobicContact CZ-CG 4.17Å; F215-I327 HydrophobicContact CD1-CG2 3.99Å; F215-I327 HydrophobicContact CE1-CB 4.1Å; F215-I327 HydrophobicContact CE1-CG2 3.73Å; F215-K328 HydrophobicContact CD1-CG 3.77Å; F215-K328 HydrophobicContact CE1-CD 4.43Å; F215-K328 HydrophobicContact CE1-CG 3.73Å; F215-F333 HydrophobicContact CB-CB 4.21Å; F215-F333 HydrophobicContact CD1-CB 4.01Å; F215-F333 HydrophobicContact CD1-CD2 4.32Å
216	L	89.1	Confident	89.4	Confident	53 Å²	53	49 Å²	49	28%	0.277	25%	0.25	S	C	.	.	S	Bend	trans	-80.8	60.9	178.2	-54.3	178.8	0	0	0	110.8	E297 F333 A335 R336	L216-E297 HydrophobicContact CD2-CG 3.65Å; L216-E297 WeakPolarHBondContact CD2-OE1 3.46Å; L216-F333 WeakPolarHBondContact CB-O 3.41Å; L216-F333 PolarHBondContact N-O 3.38Å; L216-A335 WeakPolarHBondContact CD1-O 3.38Å; L216-R336 HydrophobicContact CD1-CB 4.45Å; L216-R336 HydrophobicContact CD1-CG 3.61Å; L216-R336 HydrophobicContact CD2-CG 4.47Å
217	T	89.2	Confident	89.7	Confident	20 Å²	20	46.9 Å²	46.9	12%	0.123	24%	0.235	C	C	.	.	S	Bend	trans	-155.2	166.3	-177.6	-164.9	0	0	0	0	110.4	F215 L222 T298 F333	F215-T217 HydrophobicContact CB-CG2 3.98Å; F215-T217 PolarHBondContact O-N 3.3Å; T217-L222 HydrophobicContact CG2-CB 3.83Å; T217-T298 WeakPolarHBondContact O-CB 3.34Å; T217-T298 PolarHBondContact O-N 3.02Å; T217-T298 PolarHBondContact O-OG1 2.96Å; T217-F333 HydrophobicContact CG2-CB 4.47Å; T217-F333 HydrophobicContact CG2-CD1 4.17Å; T217-F333 HydrophobicContact CG2-CD2 3.61Å; T217-F333 HydrophobicContact CG2-CE1 4.29Å; T217-F333 HydrophobicContact CG2-CE2 3.75Å; T217-F333 HydrophobicContact CG2-CG 3.85Å; T217-F333 HydrophobicContact CG2-CZ 4.1Å; T217-F333 WeakPolarHBondContact OG1-CE1 3.49Å; T217-F333 WeakPolarHBondContact OG1-CZ 3.33Å
218	S	90.9	Very high	90.1	Very high	51 Å²	51	49.3 Å²	49.3	36%	0.357	25%	0.247	S	C	.	.			trans	-77	156.4	173.8	54.5	0	0	0	0	111.8	D220 E221 L222 T298	S218-D220 VanDerWaalsContact C-N 3.26Å; S218-D220 WeakPolarHBondContact CB-OD1 3.41Å; S218-D220 PolarHBondContact O-N 3.44Å; S218-D220 PolarHBondContact OG-OD1 2.88Å; S218-E221 PolarHBondContact O-N 3Å; S218-L222 PolarHBondContact O-N 3.17Å; S218-L222 VanDerWaalsContact O-N 3.13Å; S218-T298 VanDerWaalsContact C-OG1 3.28Å
219	P	90.2	Very high	89.9	Confident	19 Å²	19	44.1 Å²	44.1	12%	0.123	23%	0.225	C	C	.	.	H	α-helix	trans	-61.8	-31.6	-176.7	-24.1	33.5	0	0	0	113.9	Y223 D267 M291 D293 T298	P219-Y223 WeakPolarHBondContact O-CB 3Å; P219-Y223 PolarHBondContact O-N 3.14Å; P219-D267 HydrophobicContact CB-CB 4.37Å; P219-D267 VanDerWaalsContact CB-O 3.27Å; P219-D267 WeakPolarHBondContact CB-O 3.33Å; P219-M291 HydrophobicContact CB-CB 4.42Å; P219-D293 HydrophobicContact CG-CB 3.88Å; P219-T298 HydrophobicContact CB-CG2 4.27Å; P219-T298 WeakPolarHBondContact CD-OG1 3.42Å; P219-T298 HydrophobicContact CG-CG2 4.22Å; P219-T298 VanDerWaalsContact N-OG1 3.16Å
220	D	91.1	Very high	89.8	Confident	47 Å²	47	47.9 Å²	47.9	25%	0.251	25%	0.247	S	C	.	.	H	α-helix	trans	-70	-41.3	-179.9	69.8	-56.1	0	0	0	112.8	S218 Y223 R224 D267	S218-D220 VanDerWaalsContact C-N 3.26Å; S218-D220 WeakPolarHBondContact CB-OD1 3.41Å; S218-D220 PolarHBondContact O-N 3.44Å; S218-D220 PolarHBondContact OG-OD1 2.88Å; D220-Y223 WeakPolarHBondContact O-CB 3.32Å; D220-Y223 PolarHBondContact O-N 3.43Å; D220-R224 WeakPolarHBondContact O-CD 3.49Å; D220-R224 WeakPolarHBondContact O-CG 3.46Å; D220-R224 PolarHBondContact O-N 3.44Å; D220-R224 IonicContact OD2-NH2 2.74Å; D220-D267 VanDerWaalsContact CA-OD1 3.27Å; D220-D267 WeakPolarHBondContact CA-OD1 3.29Å; D220-D267 HydrophobicContact CB-CB 4.46Å; D220-D267 VanDerWaalsContact CB-OD1 3.27Å; D220-D267 WeakPolarHBondContact CB-OD1 3.23Å
221	E	89.9	Confident	89.7	Confident	58 Å²	58	47.3 Å²	47.3	27%	0.271	24%	0.237	S	C	.	.	H	α-helix	trans	-68.9	-40.8	174.8	-76.6	-62.7	124.8	0	0	111.1	S218 Y223 R224 T225 F333	S218-E221 PolarHBondContact O-N 3Å; E221-Y223 PolarHBondContact O-N 3.15Å; E221-R224 PolarHBondContact O-N 2.7Å; E221-R224 WeakPolarHBondContact OE1-CD 3.49Å; E221-R224 IonicContact OE1-CZ 2.83Å; E221-R224 IonicContact OE1-NE 2.64Å; E221-R224 IonicContact OE1-NH1 3.17Å; E221-R224 PolarHBondContact OE1-NH1 2.92Å; E221-T225 WeakPolarHBondContact O-CG2 3.43Å; E221-T225 PolarHBondContact O-N 3.41Å; E221-F333 HydrophobicContact CB-CZ 4.39Å
222	L	90.9	Very high	89.6	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.1	-44.7	172.8	-171.2	59.2	0	0	0	111.4	F215 T217 S218 R224 T225 F226 M291 T298 L300 I327 F333	F215-L222 HydrophobicContact CB-CD1 4.45Å; F215-L222 HydrophobicContact CB-CD2 4.21Å; F215-L222 HydrophobicContact CD1-CD1 3.99Å; F215-L222 HydrophobicContact CD2-CD1 4.29Å; F215-L222 HydrophobicContact CD2-CD2 3.81Å; F215-L222 HydrophobicContact CE1-CD1 4.3Å; F215-L222 HydrophobicContact CE2-CD2 4.43Å; F215-L222 HydrophobicContact CG-CD1 3.99Å; F215-L222 HydrophobicContact CG-CD2 4.04Å; T217-L222 HydrophobicContact CG2-CB 3.83Å; S218-L222 PolarHBondContact O-N 3.17Å; S218-L222 VanDerWaalsContact O-N 3.13Å; L222-R224 VanDerWaalsContact C-N 3.33Å; L222-R224 PolarHBondContact O-N 3.25Å; L222-T225 PolarHBondContact O-N 2.96Å; L222-T225 VanDerWaalsContact O-N 3.14Å; L222-T225 PolarHBondContact O-OG1 2.88Å; L222-F226 HydrophobicContact CD1-CE2 4.01Å; L222-F226 HydrophobicContact CG-CE2 4.21Å; L222-F226 WeakPolarHBondContact O-CD2 3.35Å; L222-M291 HydrophobicContact CD2-CG 4.17Å; L222-M291 HydrophobicContact CG-SD 4.48Å; L222-T298 HydrophobicContact CD2-CG2 3.73Å; L222-L300 HydrophobicContact CD2-CB 4.14Å; L222-L300 HydrophobicContact CD2-CD2 4.48Å; L222-I327 HydrophobicContact CD1-CG2 4.09Å; L222-F333 HydrophobicContact CD1-CD2 4.35Å; L222-F333 HydrophobicContact CD1-CE2 4.47Å
223	Y	92.3	Very high	89.3	Confident	27 Å²	27	44 Å²	44	11%	0.106	22%	0.222	C	C	.	.	H	α-helix	trans	-55.8	-45.6	176.6	-178.5	-98	0	0	0	112	P219 D220 E221 T225 F226 I227 V265 I270 M291	P219-Y223 WeakPolarHBondContact O-CB 3Å; P219-Y223 PolarHBondContact O-N 3.14Å; D220-Y223 WeakPolarHBondContact O-CB 3.32Å; D220-Y223 PolarHBondContact O-N 3.43Å; E221-Y223 PolarHBondContact O-N 3.15Å; Y223-T225 VanDerWaalsContact C-N 3.31Å; Y223-T225 PolarHBondContact O-N 2.9Å; Y223-F226 PolarHBondContact O-N 2.98Å; Y223-I227 HydrophobicContact CD1-CD1 3.78Å; Y223-I227 HydrophobicContact CD2-CD1 4.12Å; Y223-I227 HydrophobicContact CE1-CD1 3.29Å; Y223-I227 HydrophobicContact CE2-CD1 3.68Å; Y223-I227 HydrophobicContact CG-CD1 4.16Å; Y223-V265 WeakPolarHBondContact CE2-O 3.37Å; Y223-I270 HydrophobicContact CD2-CD1 3.74Å; Y223-I270 HydrophobicContact CD2-CG1 3.79Å; Y223-I270 HydrophobicContact CE2-CD1 3.88Å; Y223-I270 HydrophobicContact CE2-CG1 3.5Å; Y223-I270 HydrophobicContact CG-CD1 4.5Å; Y223-M291 HydrophobicContact CD2-CE 3.78Å; Y223-M291 HydrophobicContact CD2-SD 4.32Å
224	R	89.6	Confident	88.9	Confident	127 Å²	127	43 Å²	43	48%	0.479	22%	0.223	S	C	.	.	H	α-helix	trans	-58.3	-38.3	176.2	-73.5	164.5	-175.1	-169.2	2.3	112.9	D220 E221 L222 F226 I227 N228	D220-R224 WeakPolarHBondContact O-CD 3.49Å; D220-R224 WeakPolarHBondContact O-CG 3.46Å; D220-R224 PolarHBondContact O-N 3.44Å; D220-R224 IonicContact OD2-NH2 2.74Å; E221-R224 PolarHBondContact O-N 2.7Å; E221-R224 WeakPolarHBondContact OE1-CD 3.49Å; E221-R224 IonicContact OE1-CZ 2.83Å; E221-R224 IonicContact OE1-NE 2.64Å; E221-R224 IonicContact OE1-NH1 3.17Å; E221-R224 PolarHBondContact OE1-NH1 2.92Å; L222-R224 VanDerWaalsContact C-N 3.33Å; L222-R224 PolarHBondContact O-N 3.25Å; R224-F226 PolarHBondContact O-N 2.84Å; R224-F226 VanDerWaalsContact O-N 3.17Å; R224-I227 PolarHBondContact O-N 2.85Å; R224-I227 VanDerWaalsContact O-N 3.14Å; R224-N228 WeakPolarHBondContact O-CB 3.15Å; R224-N228 PolarHBondContact O-N 2.96Å
225	T	90.8	Very high	88.5	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-61.5	-23.7	-179.6	65.1	0	0	0	0	114.3	E221 L222 Y223 V232 F235 F331 F333	E221-T225 WeakPolarHBondContact O-CG2 3.43Å; E221-T225 PolarHBondContact O-N 3.41Å; L222-T225 PolarHBondContact O-N 2.96Å; L222-T225 VanDerWaalsContact O-N 3.14Å; L222-T225 PolarHBondContact O-OG1 2.88Å; Y223-T225 VanDerWaalsContact C-N 3.31Å; Y223-T225 PolarHBondContact O-N 2.9Å; T225-V232 WeakPolarHBondContact O-CG2 3.16Å; T225-F235 WeakPolarHBondContact O-CE1 3.39Å; T225-F331 HydrophobicContact CG2-CD2 3.78Å; T225-F331 HydrophobicContact CG2-CE2 3.65Å; T225-F331 HydrophobicContact CG2-CG 4.42Å; T225-F331 HydrophobicContact CG2-CZ 4.22Å; T225-F333 HydrophobicContact CG2-CE2 3.82Å; T225-F333 HydrophobicContact CG2-CZ 4.36Å
226	F	88.8	Confident	87.8	Confident	10 Å²	10	41.4 Å²	41.4	4%	0.044	21%	0.213	C	C	.	.	H	α-helix	trans	-90.7	-13.2	178.4	-71.3	-85.8	0	0	0	114.2	L222 Y223 R224 F261 I270 L289 L300 W319 Y323 I327	L222-F226 HydrophobicContact CD1-CE2 4.01Å; L222-F226 HydrophobicContact CG-CE2 4.21Å; L222-F226 WeakPolarHBondContact O-CD2 3.35Å; Y223-F226 PolarHBondContact O-N 2.98Å; R224-F226 PolarHBondContact O-N 2.84Å; R224-F226 VanDerWaalsContact O-N 3.17Å; F226-F261 WeakPolarHBondContact O-CZ 3.42Å; F226-I270 HydrophobicContact CB-CD1 3.74Å; F226-I270 HydrophobicContact CG-CD1 4.36Å; F226-L289 HydrophobicContact CD1-CD2 3.7Å; F226-L289 HydrophobicContact CD2-CD2 4.11Å; F226-L289 HydrophobicContact CE1-CD2 3.53Å; F226-L289 HydrophobicContact CE2-CD2 3.98Å; F226-L289 HydrophobicContact CG-CD2 3.99Å; F226-L289 HydrophobicContact CZ-CD2 3.7Å; F226-L300 HydrophobicContact CE2-CD2 4.16Å; F226-L300 HydrophobicContact CZ-CD2 3.9Å; F226-W319 HydrophobicContact CE1-CZ3 4.23Å; F226-Y323 HydrophobicContact CD1-CD1 4.33Å; F226-Y323 AromaticContact CE1-CD1 3.78Å; F226-Y323 HydrophobicContact CE1-CD1 3.78Å; F226-I327 HydrophobicContact CE1-CD1 4.15Å; F226-I327 HydrophobicContact CE2-CD1 4.04Å; F226-I327 HydrophobicContact CZ-CD1 3.7Å
227	I	89.8	Confident	87.2	Confident	27 Å²	27	45.5 Å²	45.5	14%	0.138	23%	0.231	C	C	.	.	H	α-helix	trans	-119.3	-34.8	-167.1	-66.8	171.5	0	0	0	111.8	Y223 R224 V242 G244 L264 I270	Y223-I227 HydrophobicContact CD1-CD1 3.78Å; Y223-I227 HydrophobicContact CD2-CD1 4.12Å; Y223-I227 HydrophobicContact CE1-CD1 3.29Å; Y223-I227 HydrophobicContact CE2-CD1 3.68Å; Y223-I227 HydrophobicContact CG-CD1 4.16Å; R224-I227 PolarHBondContact O-N 2.85Å; R224-I227 VanDerWaalsContact O-N 3.14Å; I227-V242 WeakPolarHBondContact O-CG1 3.38Å; I227-G244 WeakPolarHBondContact CG2-O 3.41Å; I227-L264 HydrophobicContact CD1-CD2 3.92Å; I227-L264 HydrophobicContact CG1-CD2 4.4Å; I227-I270 HydrophobicContact CD1-CD1 3.81Å; I227-I270 HydrophobicContact CD1-CG1 4.22Å; I227-I270 HydrophobicContact CG1-CD1 4.05Å
228	N	88.4	Confident	86.4	Confident	68 Å²	68	46.4 Å²	46.4	36%	0.364	24%	0.237	S	C	.	.			trans	-80.5	123	177.7	178.5	-76	0	0	0	110.6	R224 D230 M231 V232	R224-N228 WeakPolarHBondContact O-CB 3.15Å; R224-N228 PolarHBondContact O-N 2.96Å; N228-D230 VanDerWaalsContact C-N 3.35Å; N228-D230 PolarHBondContact O-N 3.24Å; N228-D230 WeakPolarHBondContact OD1-CB 3.04Å; N228-D230 PolarHBondContact OD1-N 2.88Å; N228-M231 HydrophobicContact CB-CB 4.16Å; N228-M231 HydrophobicContact CB-CG 3.89Å; N228-M231 PolarHBondContact O-N 3.39Å; N228-M231 PolarHBondContact OD1-N 3.49Å; N228-V232 WeakPolarHBondContact O-CG2 3.31Å; N228-V232 PolarHBondContact O-N 3.31Å
229	Q	87.9	Confident	85.7	Confident	68 Å²	68	47.5 Å²	47.5	32%	0.318	25%	0.248	S	C	.	.	H	α-helix	trans	-56.5	-43.9	-178.3	-173.1	-175.1	-96.3	0	0	113.4	V232 Q233 A240 V242	Q229-V232 PolarHBondContact O-N 2.69Å; Q229-Q233 HydrophobicContact CG-CG 4.46Å; Q229-Q233 WeakPolarHBondContact O-CG 3.2Å; Q229-Q233 PolarHBondContact O-N 2.87Å; Q229-A240 WeakPolarHBondContact CG-O 3.37Å; Q229-V242 HydrophobicContact CB-CB 4.05Å; Q229-V242 HydrophobicContact CG-CB 4.33Å; Q229-V242 HydrophobicContact CG-CG2 4.46Å
230	D	86.9	Confident	85.2	Confident	107 Å²	107	46.7 Å²	46.7	57%	0.572	24%	0.243	S	C	*	.	H	α-helix	trans	-68.1	-39.1	-175.3	-52.2	-33.1	0	0	0	110.8	N228 V232 Q233 A234	N228-D230 VanDerWaalsContact C-N 3.35Å; N228-D230 PolarHBondContact O-N 3.24Å; N228-D230 WeakPolarHBondContact OD1-CB 3.04Å; N228-D230 PolarHBondContact OD1-N 2.88Å; D230-V232 VanDerWaalsContact C-N 3.35Å; D230-Q233 PolarHBondContact O-N 3.2Å; D230-A234 WeakPolarHBondContact O-CB 3.31Å; D230-A234 PolarHBondContact O-N 2.74Å
231	M	87.1	Confident	84.9	Confident	56 Å²	56	48.4 Å²	48.4	28%	0.276	26%	0.255	S	S	.	.	H	α-helix	trans	-61.4	-43.6	171.2	-64.6	-68.1	-168	0	0	111.3	N228 A234 F235 F331	N228-M231 HydrophobicContact CB-CB 4.16Å; N228-M231 HydrophobicContact CB-CG 3.89Å; N228-M231 PolarHBondContact O-N 3.39Å; N228-M231 PolarHBondContact OD1-N 3.49Å; M231-A234 WeakPolarHBondContact O-CB 3.14Å; M231-A234 PolarHBondContact O-N 3.12Å; M231-F235 VanDerWaalsContact O-CD1 3.32Å; M231-F235 WeakPolarHBondContact O-CD1 3.49Å; M231-F235 PolarHBondContact O-N 3.45Å; M231-F235 VanDerWaalsContact O-N 3.14Å; M231-F331 HydrophobicContact CB-CZ 3.97Å; M231-F331 HydrophobicContact CG-CZ 4.46Å; M231-F331 WeakPolarHBondContact O-CZ 3.31Å; M231-F331 HydrophobicContact SD-CD1 4.25Å; M231-F331 HydrophobicContact SD-CE1 3.38Å; M231-F331 WeakPolarHBondContact SD-CE1 3.28Å; M231-F331 HydrophobicContact SD-CZ 3.69Å
232	V	87.2	Confident	84.8	Confident	4 Å²	4	46.2 Å²	46.2	2%	0.024	25%	0.246	C	C	.	.	H	α-helix	trans	-66.8	-41.6	179.8	176.5	0	0	0	0	111.9	T225 N228 Q229 D230 A234 F235 T236 A240 V242 L252	T225-V232 WeakPolarHBondContact O-CG2 3.16Å; N228-V232 WeakPolarHBondContact O-CG2 3.31Å; N228-V232 PolarHBondContact O-N 3.31Å; Q229-V232 PolarHBondContact O-N 2.69Å; D230-V232 VanDerWaalsContact C-N 3.35Å; V232-A234 VanDerWaalsContact C-N 3.31Å; V232-A234 PolarHBondContact O-N 3.26Å; V232-F235 HydrophobicContact CB-CE1 4.09Å; V232-F235 HydrophobicContact CG1-CE1 4.15Å; V232-F235 HydrophobicContact CG1-CZ 4.12Å; V232-F235 HydrophobicContact CG2-CE1 3.92Å; V232-F235 HydrophobicContact CG2-CZ 4.46Å; V232-T236 HydrophobicContact CG1-CG2 4.23Å; V232-T236 WeakPolarHBondContact O-CB 3.36Å; V232-T236 WeakPolarHBondContact O-CG2 3.27Å; V232-T236 PolarHBondContact O-N 3.2Å; V232-T236 PolarHBondContact O-OG1 3.41Å; V232-A240 HydrophobicContact CG1-CB 4.02Å; V232-V242 HydrophobicContact CB-CG2 3.98Å; V232-V242 HydrophobicContact CG1-CG2 3.95Å; V232-V242 HydrophobicContact CG2-CG2 4.1Å; V232-L252 HydrophobicContact CG1-CD1 4.4Å; V232-L252 HydrophobicContact CG1-CD2 3.44Å; V232-L252 VanDerWaalsContact CG1-CD2 3.44Å
233	Q	84.4	Confident	84.7	Confident	69 Å²	69	50 Å²	50	32%	0.322	27%	0.266	S	S	.	.	H	α-helix	trans	-61.1	-39.4	171.1	-71.3	-175.7	8.2	0	0	111.7	Q229 D230 F235 H237 A240	Q229-Q233 HydrophobicContact CG-CG 4.46Å; Q229-Q233 WeakPolarHBondContact O-CG 3.2Å; Q229-Q233 PolarHBondContact O-N 2.87Å; D230-Q233 PolarHBondContact O-N 3.2Å; Q233-F235 PolarHBondContact O-N 2.84Å; Q233-H237 WeakPolarHBondContact O-CA 3.32Å; Q233-H237 PolarHBondContact O-N 3.05Å; Q233-A240 HydrophobicContact CG-CB 3.82Å; Q233-A240 PolarHBondContact NE2-O 3Å
234	A	82.8	Confident	84.4	Confident	39 Å²	39	50 Å²	50	32%	0.322	27%	0.274	S	S	.	.	H	α-helix	trans	-63.9	-40.4	-179.4	0	0	0	0	0	113.4	D230 M231 V232 H237 T330 F331	D230-A234 WeakPolarHBondContact O-CB 3.31Å; D230-A234 PolarHBondContact O-N 2.74Å; M231-A234 WeakPolarHBondContact O-CB 3.14Å; M231-A234 PolarHBondContact O-N 3.12Å; V232-A234 VanDerWaalsContact C-N 3.31Å; V232-A234 PolarHBondContact O-N 3.26Å; A234-H237 PolarHBondContact O-CE1 3.25Å; A234-H237 VanDerWaalsContact O-CE1 3.24Å; A234-H237 PolarHBondContact O-ND1 2.86Å; A234-T330 HydrophobicContact CB-CG2 4.03Å; A234-T330 WeakPolarHBondContact O-CG2 3.15Å; A234-F331 HydrophobicContact CB-CE1 4.39Å; A234-F331 HydrophobicContact CB-CZ 4.15Å
235	F	82.3	Confident	84.2	Confident	3 Å²	3	49.5 Å²	49.5	1%	0.013	28%	0.281	C	S	.	.	H	α-helix	trans	-85.9	-31.1	177.5	80.9	-107.9	0	0	0	113.9	T225 M231 V232 Q233 H237 H322 Y323 A326 I327 T330 F331	T225-F235 WeakPolarHBondContact O-CE1 3.39Å; M231-F235 VanDerWaalsContact O-CD1 3.32Å; M231-F235 WeakPolarHBondContact O-CD1 3.49Å; M231-F235 PolarHBondContact O-N 3.45Å; M231-F235 VanDerWaalsContact O-N 3.14Å; V232-F235 HydrophobicContact CB-CE1 4.09Å; V232-F235 HydrophobicContact CG1-CE1 4.15Å; V232-F235 HydrophobicContact CG1-CZ 4.12Å; V232-F235 HydrophobicContact CG2-CE1 3.92Å; V232-F235 HydrophobicContact CG2-CZ 4.46Å; Q233-F235 PolarHBondContact O-N 2.84Å; F235-H237 VanDerWaalsContact C-N 3.28Å; F235-H322 VanDerWaalsContact CD2-O 3.31Å; F235-H322 WeakPolarHBondContact CD2-O 3.36Å; F235-H322 WeakPolarHBondContact CE2-O 3.38Å; F235-Y323 HydrophobicContact CE2-CD1 4.19Å; F235-Y323 HydrophobicContact CE2-CG 4.47Å; F235-Y323 HydrophobicContact CZ-CD1 4.06Å; F235-A326 HydrophobicContact CB-CB 4.2Å; F235-A326 HydrophobicContact CD2-CB 3.83Å; F235-A326 HydrophobicContact CG-CB 4.46Å; F235-A326 WeakPolarHBondContact O-CB 3.15Å; F235-I327 HydrophobicContact CB-CG1 4.17Å; F235-I327 HydrophobicContact CD1-CD1 4.24Å; F235-I327 HydrophobicContact CD1-CG1 3.62Å; F235-I327 HydrophobicContact CD2-CG1 4Å; F235-I327 HydrophobicContact CE1-CD1 3.98Å; F235-I327 HydrophobicContact CE1-CG1 3.88Å; F235-I327 HydrophobicContact CE2-CD1 4.46Å; F235-I327 HydrophobicContact CE2-CG1 4.28Å; F235-I327 HydrophobicContact CG-CG1 3.68Å; F235-I327 HydrophobicContact CZ-CD1 4.12Å; F235-I327 HydrophobicContact CZ-CG1 4.23Å; F235-T330 HydrophobicContact CB-CG2 4.34Å; F235-F331 HydrophobicContact CB-CE2 3.95Å; F235-F331 HydrophobicContact CD1-CE2 4.05Å; F235-F331 HydrophobicContact CG-CE2 4.48Å
236	T	74.3	Confident	84	Confident	15 Å²	15	57 Å²	57	9%	0.092	31%	0.313	C	S	.	.	H	α-helix	trans	-74.3	-21.7	174.9	54.8	0	0	0	0	112.5	V232 T238 L253	V232-T236 HydrophobicContact CG1-CG2 4.23Å; V232-T236 WeakPolarHBondContact O-CB 3.36Å; V232-T236 WeakPolarHBondContact O-CG2 3.27Å; V232-T236 PolarHBondContact O-N 3.2Å; V232-T236 PolarHBondContact O-OG1 3.41Å; T236-T238 PolarHBondContact O-N 2.87Å; T236-T238 PolarHBondContact O-OG1 2.85Å; T236-L253 HydrophobicContact CG2-CD2 4.11Å
237	H	75.9	Confident	83.8	Confident	139 Å²	139	58.3 Å²	58.3	64%	0.644	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	27.6	-171.7	-55.5	-61.4	0	0	0	113.1	Q233 A234 F235	Q233-H237 WeakPolarHBondContact O-CA 3.32Å; Q233-H237 PolarHBondContact O-N 3.05Å; A234-H237 PolarHBondContact O-CE1 3.25Å; A234-H237 VanDerWaalsContact O-CE1 3.24Å; A234-H237 PolarHBondContact O-ND1 2.86Å; F235-H237 VanDerWaalsContact C-N 3.28Å
238	T	72.4	Confident	83.6	Confident	40 Å²	40	57.1 Å²	57.1	25%	0.245	32%	0.324	C	S	.	.	S	Bend	trans	-146.1	163.5	-175.9	-24.1	0	0	0	0	111.4	T236 A240 E254	T236-T238 PolarHBondContact O-N 2.87Å; T236-T238 PolarHBondContact O-OG1 2.85Å; T238-A240 PolarHBondContact O-N 2.87Å; T238-E254 HydrophobicContact CG2-CG 3.36Å; T238-E254 WeakPolarHBondContact CG2-OE1 3.42Å
239	A	76.1	Confident	83.6	Confident	73 Å²	73	60.8 Å²	60.8	60%	0.603	34%	0.337	S	S	*	.			trans	-59.4	122.1	171.9	0	0	0	0	0	110.3
240	A	80.3	Confident	83.5	Confident	2 Å²	2	58 Å²	58	2%	0.017	32%	0.324	C	S	.	.			trans	-133.8	136.6	177.8	0	0	0	0	0	109.3	Q229 V232 Q233 T238 Q251 L252	Q229-A240 WeakPolarHBondContact CG-O 3.37Å; V232-A240 HydrophobicContact CG1-CB 4.02Å; Q233-A240 HydrophobicContact CG-CB 3.82Å; Q233-A240 PolarHBondContact NE2-O 3Å; T238-A240 PolarHBondContact O-N 2.87Å; A240-Q251 CarbonylContact C-O 3.27Å; A240-Q251 VanDerWaalsContact CA-O 3.31Å; A240-Q251 WeakPolarHBondContact CA-O 3.44Å; A240-L252 HydrophobicContact CB-CD2 3.78Å
241	V	84	Confident	83.4	Confident	83 Å²	83	57.1 Å²	57.1	50%	0.503	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	125	172.9	-178.8	0	0	0	0	106.9	F250 Q251	V241-F250 CarbonylContact O-C 3.51Å; V241-F250 VanDerWaalsContact O-CA 3.23Å; V241-F250 WeakPolarHBondContact O-CA 3.38Å; V241-Q251 HydrophobicContact CB-CB 4.38Å; V241-Q251 PolarHBondContact N-O 3.4Å; V241-Q251 PolarHBondContact O-N 3.32Å
242	V	89.2	Confident	83.1	Confident	13 Å²	13	54.9 Å²	54.9	8%	0.079	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	110.3	-178.9	-172.5	0	0	0	0	109	I227 Q229 V232 F250 L252 F261	I227-V242 WeakPolarHBondContact O-CG1 3.38Å; Q229-V242 HydrophobicContact CB-CB 4.05Å; Q229-V242 HydrophobicContact CG-CB 4.33Å; Q229-V242 HydrophobicContact CG-CG2 4.46Å; V232-V242 HydrophobicContact CB-CG2 3.98Å; V232-V242 HydrophobicContact CG1-CG2 3.95Å; V232-V242 HydrophobicContact CG2-CG2 4.1Å; V242-F250 HydrophobicContact CB-CB 4.46Å; V242-F250 HydrophobicContact CG1-CB 4.22Å; V242-F250 HydrophobicContact CG2-CB 4.27Å; V242-L252 HydrophobicContact CG2-CD2 3.78Å; V242-F261 HydrophobicContact CG1-CE2 3.93Å; V242-F261 HydrophobicContact CG1-CZ 4.11Å
243	D	88.6	Confident	82.4	Confident	80 Å²	80	56.2 Å²	56.2	43%	0.428	31%	0.312	S	S	.	.			trans	-90.3	107.3	168	178.2	1.4	0	0	0	108.1	D245 G248 K249 F261	D243-D245 PolarHBondContact O-N 2.9Å; D243-D245 PolarHBondContact OD1-N 3.46Å; D243-G248 VanDerWaalsContact CG-CA 3.47Å; D243-G248 WeakPolarHBondContact OD2-CA 3.3Å; D243-K249 WeakPolarHBondContact CB-O 3.37Å; D243-K249 PolarHBondContact N-O 3.35Å; D243-F261 WeakPolarHBondContact O-CD2 3.41Å; D243-F261 VanDerWaalsContact O-CE2 3.25Å; D243-F261 WeakPolarHBondContact O-CE2 3.38Å
244	G	86.7	Confident	81.8	Confident	25 Å²	25	60.5 Å²	60.5	26%	0.258	33%	0.332	S	S	.	.			trans	-78.8	3.8	-169.5	0	0	0	0	0	115.6	I227 L264	I227-G244 WeakPolarHBondContact CG2-O 3.41Å; G244-L264 WeakPolarHBondContact O-CD1 3.4Å
245	D	83.9	Confident	81.2	Confident	118 Å²	118	58.8 Å²	58.8	63%	0.631	32%	0.319	S	S	*	.	S	Bend	trans	-87.5	165.5	-179.8	-83.8	-49	0	0	0	113.4	D243 G247 G248	D243-D245 PolarHBondContact O-N 2.9Å; D243-D245 PolarHBondContact OD1-N 3.46Å; D245-G247 PolarHBondContact O-N 3.12Å; D245-G248 WeakPolarHBondContact O-CA 3.19Å; D245-G248 PolarHBondContact O-N 3.33Å
246	K	86.4	Confident	80.5	Confident	157 Å²	157	61.6 Å²	61.6	68%	0.683	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	118	175.1	-176.5	-177.6	178.4	178.2	0	110.3	G248 L262	K246-G248 VanDerWaalsContact C-N 3.33Å; K246-L262 WeakPolarHBondContact CE-O 3.21Å
247	G	84.9	Confident	80.9	Confident	39 Å²	39	61 Å²	61	40%	0.402	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.7	-4.2	-168.5	0	0	0	0	0	113.4	D245 F261	D245-G247 PolarHBondContact O-N 3.12Å; G247-F261 VanDerWaalsContact CA-O 3.27Å; G247-F261 WeakPolarHBondContact CA-O 3.38Å; G247-F261 PolarHBondContact N-O 2.88Å
248	G	85.2	Confident	81.3	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.01	31%	0.314	C	S	.	.			trans	-63.8	147.7	173.6	0	0	0	0	0	111.7	D243 D245 K246 E260 F261	D243-G248 VanDerWaalsContact CG-CA 3.47Å; D243-G248 WeakPolarHBondContact OD2-CA 3.3Å; D245-G248 WeakPolarHBondContact O-CA 3.19Å; D245-G248 PolarHBondContact O-N 3.33Å; K246-G248 VanDerWaalsContact C-N 3.33Å; G248-E260 CarbonylContact O-C 3.59Å; G248-E260 WeakPolarHBondContact O-CA 3.4Å; G248-F261 PolarHBondContact O-N 2.87Å
249	K	88.4	Confident	82.1	Confident	146 Å²	146	54.7 Å²	54.7	64%	0.635	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	149.7	-179.4	-65	-179.8	-175.8	176.1	0	111	D243 G259	D243-K249 WeakPolarHBondContact CB-O 3.37Å; D243-K249 PolarHBondContact N-O 3.35Å; K249-G259 WeakPolarHBondContact CA-O 3.49Å
250	F	87.3	Confident	82.8	Confident	10 Å²	10	53.8 Å²	53.8	4%	0.044	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	148.4	173.2	61.5	-96.1	0	0	0	112.3	V241 V242 L252 V257 N258 G259 F261 M272 K273 W274	V241-F250 CarbonylContact O-C 3.51Å; V241-F250 VanDerWaalsContact O-CA 3.23Å; V241-F250 WeakPolarHBondContact O-CA 3.38Å; V242-F250 HydrophobicContact CB-CB 4.46Å; V242-F250 HydrophobicContact CG1-CB 4.22Å; V242-F250 HydrophobicContact CG2-CB 4.27Å; F250-L252 HydrophobicContact CB-CD2 4.49Å; F250-L252 HydrophobicContact CD2-CD1 4.11Å; F250-L252 HydrophobicContact CD2-CG 4.02Å; F250-L252 HydrophobicContact CE2-CD1 4.49Å; F250-V257 HydrophobicContact CE2-CG1 4.44Å; F250-N258 WeakPolarHBondContact O-CA 3.45Å; F250-G259 VanDerWaalsContact CZ-CA 3.48Å; F250-G259 PolarHBondContact N-O 3.29Å; F250-G259 PolarHBondContact O-N 2.7Å; F250-F261 HydrophobicContact CB-CE2 4.4Å; F250-F261 HydrophobicContact CD1-CD1 4.36Å; F250-F261 HydrophobicContact CD1-CD2 4.04Å; F250-F261 HydrophobicContact CD1-CE1 4Å; F250-F261 AromaticContact CD1-CE2 3.65Å; F250-F261 HydrophobicContact CD1-CE2 3.65Å; F250-F261 HydrophobicContact CD1-CG 4.38Å; F250-F261 AromaticContact CD1-CZ 3.63Å; F250-F261 HydrophobicContact CD1-CZ 3.63Å; F250-F261 HydrophobicContact CE1-CD1 4.22Å; F250-F261 HydrophobicContact CE1-CE1 4.03Å; F250-F261 HydrophobicContact CE1-CE2 4.43Å; F250-F261 HydrophobicContact CE1-CZ 4.14Å; F250-F261 HydrophobicContact CG-CE2 4.44Å; F250-F261 HydrophobicContact CG-CZ 4.37Å; F250-M272 HydrophobicContact CE1-CB 3.84Å; F250-M272 HydrophobicContact CE1-CG 4.45Å; F250-M272 HydrophobicContact CE1-SD 3.92Å; F250-M272 HydrophobicContact CE2-SD 4.32Å; F250-M272 HydrophobicContact CZ-CB 4.07Å; F250-M272 HydrophobicContact CZ-CG 4.24Å; F250-M272 HydrophobicContact CZ-SD 3.44Å; F250-M272 WeakPolarHBondContact CZ-SD 3.4Å; F250-K273 WeakPolarHBondContact CZ-O 3.38Å; F250-W274 AromaticContact CE2-CD1 3.98Å
251	Q	84	Confident	83.4	Confident	88 Å²	88	53.8 Å²	53.8	41%	0.411	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	114.3	-178.7	-174.9	174.7	21.7	0	0	108.4	A240 V241 G255 V257 N258	A240-Q251 CarbonylContact C-O 3.27Å; A240-Q251 VanDerWaalsContact CA-O 3.31Å; A240-Q251 WeakPolarHBondContact CA-O 3.44Å; V241-Q251 HydrophobicContact CB-CB 4.38Å; V241-Q251 PolarHBondContact N-O 3.4Å; V241-Q251 PolarHBondContact O-N 3.32Å; Q251-G255 VanDerWaalsContact CG-CA 3.41Å; Q251-V257 WeakPolarHBondContact CA-O 3.25Å; Q251-N258 WeakPolarHBondContact CG-OD1 3.49Å
252	L	81.6	Confident	83.6	Confident	8 Å²	8	52.7 Å²	52.7	4%	0.042	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	159.1	-170.7	-44.5	179.9	0	0	0	110.5	V232 A240 V242 F250 G255 S256 V257 Y323	V232-L252 HydrophobicContact CG1-CD1 4.4Å; V232-L252 HydrophobicContact CG1-CD2 3.44Å; V232-L252 VanDerWaalsContact CG1-CD2 3.44Å; A240-L252 HydrophobicContact CB-CD2 3.78Å; V242-L252 HydrophobicContact CG2-CD2 3.78Å; F250-L252 HydrophobicContact CB-CD2 4.49Å; F250-L252 HydrophobicContact CD2-CD1 4.11Å; F250-L252 HydrophobicContact CD2-CG 4.02Å; F250-L252 HydrophobicContact CE2-CD1 4.49Å; L252-G255 WeakPolarHBondContact O-CA 3.49Å; L252-G255 PolarHBondContact O-N 2.86Å; L252-G255 VanDerWaalsContact O-N 3.07Å; L252-S256 PolarHBondContact O-N 3.03Å; L252-V257 HydrophobicContact CB-CB 4.2Å; L252-V257 HydrophobicContact CB-CG1 4.42Å; L252-V257 HydrophobicContact CD1-CG1 4.42Å; L252-V257 PolarHBondContact N-O 2.9Å; L252-V257 PolarHBondContact O-N 3.33Å; L252-V257 VanDerWaalsContact O-N 3.11Å; L252-Y323 HydrophobicContact CD1-CE1 4.12Å; L252-Y323 WeakPolarHBondContact CD1-OH 3.47Å
253	L	72.4	Confident	83.7	Confident	32 Å²	32	55.5 Å²	55.5	17%	0.168	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	53	56.9	176.8	-54.8	172.7	0	0	0	111.4	T236 G255 S256 V257 H322	T236-L253 HydrophobicContact CG2-CD2 4.11Å; L253-G255 PolarHBondContact O-N 3.34Å; L253-G255 VanDerWaalsContact O-N 3.08Å; L253-S256 WeakPolarHBondContact O-CB 3.5Å; L253-S256 PolarHBondContact O-N 3.11Å; L253-S256 PolarHBondContact O-OG 3.23Å; L253-V257 HydrophobicContact CD1-CG2 4.19Å; L253-H322 HydrophobicContact CD1-CB 4.28Å
254	E	71.7	Confident	83.8	Confident	159 Å²	159	53.4 Å²	53.4	74%	0.743	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	57.2	23	-176.7	-48.1	-162.2	145	0	0	114.6	T238	T238-E254 HydrophobicContact CG2-CG 3.36Å; T238-E254 WeakPolarHBondContact CG2-OE1 3.42Å
255	G	69.6	Low	84.1	Confident	4 Å²	4	54.3 Å²	54.3	4%	0.041	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	84	12.4	-176.9	0	0	0	0	0	114.9	Q251 L252 L253 V257 N258	Q251-G255 VanDerWaalsContact CG-CA 3.41Å; L252-G255 WeakPolarHBondContact O-CA 3.49Å; L252-G255 PolarHBondContact O-N 2.86Å; L252-G255 VanDerWaalsContact O-N 3.07Å; L253-G255 PolarHBondContact O-N 3.34Å; L253-G255 VanDerWaalsContact O-N 3.08Å; G255-V257 PolarHBondContact O-N 2.81Å; G255-N258 PolarHBondContact O-ND2 3.17Å
256	S	68.4	Low	84.3	Confident	62 Å²	62	52.8 Å²	52.8	43%	0.434	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-31.7	165.6	-57.7	0	0	0	0	111.7	L252 L253 F276 K277	L252-S256 PolarHBondContact O-N 3.03Å; L253-S256 WeakPolarHBondContact O-CB 3.5Å; L253-S256 PolarHBondContact O-N 3.11Å; L253-S256 PolarHBondContact O-OG 3.23Å; S256-F276 CarbonylContact O-C 3.5Å; S256-F276 VanDerWaalsContact O-CA 3.27Å; S256-F276 WeakPolarHBondContact O-CA 3.38Å; S256-K277 PolarHBondContact O-N 2.95Å
257	V	81.7	Confident	84.4	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	132.8	175.6	170.5	0	0	0	0	109.9	F250 Q251 L252 L253 G255 W274 R275 F276	F250-V257 HydrophobicContact CE2-CG1 4.44Å; Q251-V257 WeakPolarHBondContact CA-O 3.25Å; L252-V257 HydrophobicContact CB-CB 4.2Å; L252-V257 HydrophobicContact CB-CG1 4.42Å; L252-V257 HydrophobicContact CD1-CG1 4.42Å; L252-V257 PolarHBondContact N-O 2.9Å; L252-V257 PolarHBondContact O-N 3.33Å; L252-V257 VanDerWaalsContact O-N 3.11Å; L253-V257 HydrophobicContact CD1-CG2 4.19Å; G255-V257 PolarHBondContact O-N 2.81Å; V257-W274 HydrophobicContact CG1-CD2 4.38Å; V257-W274 HydrophobicContact CG1-CZ2 3.94Å; V257-W274 VanDerWaalsContact CG1-NE1 3.3Å; V257-W274 HydrophobicContact CG2-CH2 4.4Å; V257-W274 HydrophobicContact CG2-CZ2 3.76Å; V257-R275 WeakPolarHBondContact CA-O 3.47Å; V257-F276 HydrophobicContact CG2-CD1 3.7Å; V257-F276 HydrophobicContact CG2-CE1 3.74Å
258	N	84	Confident	84.7	Confident	39 Å²	39	53.2 Å²	53.2	21%	0.209	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	146.9	179.8	-59.2	-89.8	0	0	0	110.7	F250 Q251 G255 R275	F250-N258 WeakPolarHBondContact O-CA 3.45Å; Q251-N258 WeakPolarHBondContact CG-OD1 3.49Å; G255-N258 PolarHBondContact O-ND2 3.17Å; N258-R275 HydrophobicContact CB-CG 4.48Å; N258-R275 PolarHBondContact N-O 3.14Å; N258-R275 PolarHBondContact O-N 3.48Å
259	G	90.7	Very high	85	Confident	9 Å²	9	55.6 Å²	55.6	9%	0.093	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.9	-173.5	-180	0	0	0	0	0	115.6	K249 F250 K273	K249-G259 WeakPolarHBondContact CA-O 3.49Å; F250-G259 VanDerWaalsContact CZ-CA 3.48Å; F250-G259 PolarHBondContact N-O 3.29Å; F250-G259 PolarHBondContact O-N 2.7Å; G259-K273 WeakPolarHBondContact CA-O 3.37Å
260	E	90.4	Very high	85.3	Confident	53 Å²	53	48.7 Å²	48.7	25%	0.248	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	131.3	-173.8	-178.3	-168.6	171	0	0	109.2	G248 L262 M272 K273	G248-E260 CarbonylContact O-C 3.59Å; G248-E260 WeakPolarHBondContact O-CA 3.4Å; E260-L262 HydrophobicContact CG-CD2 4.48Å; E260-M272 CarbonylContact O-C 3.49Å; E260-M272 VanDerWaalsContact O-CA 3.27Å; E260-M272 WeakPolarHBondContact O-CA 3.49Å; E260-K273 HydrophobicContact CB-CB 4.31Å; E260-K273 HydrophobicContact CB-CD 4.43Å; E260-K273 PolarHBondContact N-O 2.76Å; E260-K273 VanDerWaalsContact N-O 3.14Å; E260-K273 PolarHBondContact O-N 2.91Å; E260-K273 IonicContact OE1-NZ 2.87Å; E260-K273 WeakPolarHBondContact OE2-CD 3.42Å; E260-K273 IonicContact OE2-NZ 3.98Å; E260-K273 PolarHBondContact OE2-NZ 2.79Å
261	F	92	Very high	85.6	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.009	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	121.7	174.7	-62.8	-69	0	0	0	110.6	F226 V242 D243 G247 G248 F250 L264 I270 M272	F226-F261 WeakPolarHBondContact O-CZ 3.42Å; V242-F261 HydrophobicContact CG1-CE2 3.93Å; V242-F261 HydrophobicContact CG1-CZ 4.11Å; D243-F261 WeakPolarHBondContact O-CD2 3.41Å; D243-F261 VanDerWaalsContact O-CE2 3.25Å; D243-F261 WeakPolarHBondContact O-CE2 3.38Å; G247-F261 VanDerWaalsContact CA-O 3.27Å; G247-F261 WeakPolarHBondContact CA-O 3.38Å; G247-F261 PolarHBondContact N-O 2.88Å; G248-F261 PolarHBondContact O-N 2.87Å; F250-F261 HydrophobicContact CB-CE2 4.4Å; F250-F261 HydrophobicContact CD1-CD1 4.36Å; F250-F261 HydrophobicContact CD1-CD2 4.04Å; F250-F261 HydrophobicContact CD1-CE1 4Å; F250-F261 AromaticContact CD1-CE2 3.65Å; F250-F261 HydrophobicContact CD1-CE2 3.65Å; F250-F261 HydrophobicContact CD1-CG 4.38Å; F250-F261 AromaticContact CD1-CZ 3.63Å; F250-F261 HydrophobicContact CD1-CZ 3.63Å; F250-F261 HydrophobicContact CE1-CD1 4.22Å; F250-F261 HydrophobicContact CE1-CE1 4.03Å; F250-F261 HydrophobicContact CE1-CE2 4.43Å; F250-F261 HydrophobicContact CE1-CZ 4.14Å; F250-F261 HydrophobicContact CG-CE2 4.44Å; F250-F261 HydrophobicContact CG-CZ 4.37Å; F261-L264 HydrophobicContact CB-CD1 4.15Å; F261-L264 HydrophobicContact CB-CD2 4.21Å; F261-L264 HydrophobicContact CB-CG 4.17Å; F261-L264 HydrophobicContact CD1-CD2 3.87Å; F261-L264 HydrophobicContact CG-CD1 4.37Å; F261-L264 HydrophobicContact CG-CD2 4.18Å; F261-I270 HydrophobicContact CD1-CG2 4Å; F261-I270 HydrophobicContact CE1-CG2 4.11Å; F261-M272 HydrophobicContact CD1-CB 4.16Å; F261-M272 HydrophobicContact CE1-CE 4.02Å
262	L	89.3	Confident	86.1	Confident	61 Å²	61	44.8 Å²	44.8	32%	0.319	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-39.5	-179.5	-58.9	-177.2	0	0	0	112.4	K246 E260 V271 K273	K246-L262 WeakPolarHBondContact CE-O 3.21Å; E260-L262 HydrophobicContact CG-CD2 4.48Å; L262-V271 HydrophobicContact CB-CB 4.47Å; L262-V271 HydrophobicContact CB-CG1 4.37Å; L262-V271 HydrophobicContact CD1-CG1 4.36Å; L262-V271 PolarHBondContact N-O 2.93Å; L262-K273 HydrophobicContact CD1-CG 3.98Å; L262-K273 HydrophobicContact CD2-CD 4.29Å; L262-K273 HydrophobicContact CD2-CG 4.06Å; L262-K273 HydrophobicContact CG-CG 4.19Å
263	E	91.4	Very high	86.7	Confident	72 Å²	72	47.5 Å²	47.5	34%	0.336	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	128.8	-175.8	-167.5	-169.3	160.9	0	0	108.5	V265 K269 V271	E263-V265 HydrophobicContact CG-CG2 4.44Å; E263-K269 IonicContact OE1-NZ 3.8Å; E263-K269 PolarHBondContact OE1-NZ 3.31Å; E263-K269 IonicContact OE2-NZ 2.81Å; E263-K269 PolarHBondContact OE2-NZ 3.24Å; E263-V271 HydrophobicContact CB-CB 3.85Å; E263-V271 HydrophobicContact CB-CG2 3.86Å; E263-V271 PolarHBondContact N-O 3.06Å; E263-V271 PolarHBondContact O-N 2.88Å; E263-V271 WeakPolarHBondContact OE2-CG2 3.37Å
264	L	90.9	Very high	87.6	Confident	35 Å²	35	46 Å²	46	18%	0.183	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	114.2	179.2	-67.1	178.1	0	0	0	106.9	I227 G244 F261 I270	I227-L264 HydrophobicContact CD1-CD2 3.92Å; I227-L264 HydrophobicContact CG1-CD2 4.4Å; G244-L264 WeakPolarHBondContact O-CD1 3.4Å; F261-L264 HydrophobicContact CB-CD1 4.15Å; F261-L264 HydrophobicContact CB-CD2 4.21Å; F261-L264 HydrophobicContact CB-CG 4.17Å; F261-L264 HydrophobicContact CD1-CD2 3.87Å; F261-L264 HydrophobicContact CG-CD1 4.37Å; F261-L264 HydrophobicContact CG-CD2 4.18Å; L264-I270 HydrophobicContact CD2-CB 4.31Å; L264-I270 HydrophobicContact CD2-CG1 4Å; L264-I270 HydrophobicContact CD2-CG2 3.86Å
265	V	91.1	Very high	88.1	Confident	44 Å²	44	39.9 Å²	39.9	27%	0.267	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	112.5	171.6	-174.3	0	0	0	0	106.4	Y223 E263 D267 E268 K269	Y223-V265 WeakPolarHBondContact CE2-O 3.37Å; E263-V265 HydrophobicContact CG-CG2 4.44Å; V265-D267 PolarHBondContact O-N 3.08Å; V265-E268 HydrophobicContact CG1-CB 4.12Å; V265-E268 PolarHBondContact O-N 2.95Å; V265-K269 HydrophobicContact CB-CB 4.07Å; V265-K269 HydrophobicContact CG2-CB 4.27Å; V265-K269 PolarHBondContact N-O 2.83Å; V265-K269 PolarHBondContact O-N 3.39Å; V265-K269 VanDerWaalsContact O-N 3.09Å; V265-K269 VanDerWaalsContact O-O 3.09Å
266	P	88.9	Confident	88.4	Confident	87 Å²	87	40.9 Å²	40.9	57%	0.565	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.7	133.8	-179.4	-31.1	36.9	0	0	0	112.3	E268	P266-E268 PolarHBondContact O-N 3.31Å
267	D	88.4	Confident	88.5	Confident	79 Å²	79	45 Å²	45	42%	0.422	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	-3.7	171.4	-39.7	-32	0	0	0	116.1	P219 D220 V265	P219-D267 HydrophobicContact CB-CB 4.37Å; P219-D267 VanDerWaalsContact CB-O 3.27Å; P219-D267 WeakPolarHBondContact CB-O 3.33Å; D220-D267 VanDerWaalsContact CA-OD1 3.27Å; D220-D267 WeakPolarHBondContact CA-OD1 3.29Å; D220-D267 HydrophobicContact CB-CB 4.46Å; D220-D267 VanDerWaalsContact CB-OD1 3.27Å; D220-D267 WeakPolarHBondContact CB-OD1 3.23Å; V265-D267 PolarHBondContact O-N 3.08Å
268	E	90.6	Very high	87.5	Confident	125 Å²	125	49.4 Å²	49.4	58%	0.584	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.7	-48.4	-175.1	-170.8	-179.2	-177.7	0	0	113.1	V265 P266 M291	V265-E268 HydrophobicContact CG1-CB 4.12Å; V265-E268 PolarHBondContact O-N 2.95Å; P266-E268 PolarHBondContact O-N 3.31Å; E268-M291 PolarHBondContact O-N 3.48Å
269	K	92.8	Very high	87.1	Confident	52 Å²	52	47.9 Å²	47.9	23%	0.226	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	135	-165.6	-173	-170.5	170.7	-151.7	0	114.3	E263 V265 V271 L289	E263-K269 IonicContact OE1-NZ 3.8Å; E263-K269 PolarHBondContact OE1-NZ 3.31Å; E263-K269 IonicContact OE2-NZ 2.81Å; E263-K269 PolarHBondContact OE2-NZ 3.24Å; V265-K269 HydrophobicContact CB-CB 4.07Å; V265-K269 HydrophobicContact CG2-CB 4.27Å; V265-K269 PolarHBondContact N-O 2.83Å; V265-K269 PolarHBondContact O-N 3.39Å; V265-K269 VanDerWaalsContact O-N 3.09Å; V265-K269 VanDerWaalsContact O-O 3.09Å; K269-V271 HydrophobicContact CD-CG2 4.39Å; K269-V271 VanDerWaalsContact CE-CG2 3.43Å; K269-V271 HydrophobicContact CG-CG2 4.34Å; K269-L289 WeakPolarHBondContact CA-O 3.29Å
270	I	93.9	Very high	85.8	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	126.2	170.6	-62.5	168.9	0	0	0	108.4	Y223 F226 I227 F261 L264 M272 L289 M291	Y223-I270 HydrophobicContact CD2-CD1 3.74Å; Y223-I270 HydrophobicContact CD2-CG1 3.79Å; Y223-I270 HydrophobicContact CE2-CD1 3.88Å; Y223-I270 HydrophobicContact CE2-CG1 3.5Å; Y223-I270 HydrophobicContact CG-CD1 4.5Å; F226-I270 HydrophobicContact CB-CD1 3.74Å; F226-I270 HydrophobicContact CG-CD1 4.36Å; I227-I270 HydrophobicContact CD1-CD1 3.81Å; I227-I270 HydrophobicContact CD1-CG1 4.22Å; I227-I270 HydrophobicContact CG1-CD1 4.05Å; F261-I270 HydrophobicContact CD1-CG2 4Å; F261-I270 HydrophobicContact CE1-CG2 4.11Å; L264-I270 HydrophobicContact CD2-CB 4.31Å; L264-I270 HydrophobicContact CD2-CG1 4Å; L264-I270 HydrophobicContact CD2-CG2 3.86Å; I270-M272 HydrophobicContact CG2-CE 3.81Å; I270-L289 HydrophobicContact CB-CB 4.2Å; I270-L289 PolarHBondContact N-O 2.72Å; I270-L289 PolarHBondContact O-N 3.49Å; I270-M291 HydrophobicContact CD1-CE 4.32Å; I270-M291 HydrophobicContact CG1-CE 4.22Å
271	V	94.8	Very high	84.2	Confident	11 Å²	11	53.6 Å²	53.6	7%	0.067	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125.1	169.9	-169.4	0	0	0	0	108.7	L262 E263 K269 T286 I287 T288	L262-V271 HydrophobicContact CB-CB 4.47Å; L262-V271 HydrophobicContact CB-CG1 4.37Å; L262-V271 HydrophobicContact CD1-CG1 4.36Å; L262-V271 PolarHBondContact N-O 2.93Å; E263-V271 HydrophobicContact CB-CB 3.85Å; E263-V271 HydrophobicContact CB-CG2 3.86Å; E263-V271 PolarHBondContact N-O 3.06Å; E263-V271 PolarHBondContact O-N 2.88Å; E263-V271 WeakPolarHBondContact OE2-CG2 3.37Å; K269-V271 HydrophobicContact CD-CG2 4.39Å; K269-V271 VanDerWaalsContact CE-CG2 3.43Å; K269-V271 HydrophobicContact CG-CG2 4.34Å; V271-T286 HydrophobicContact CG1-CG2 3.82Å; V271-I287 WeakPolarHBondContact CA-O 3.27Å; V271-T288 HydrophobicContact CG2-CG2 4.21Å
272	M	93.5	Very high	83.4	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.025	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	148.1	-179.9	57.9	173.3	87.4	0	0	111.9	F250 E260 F261 I270 I287 L289 W319	F250-M272 HydrophobicContact CE1-CB 3.84Å; F250-M272 HydrophobicContact CE1-CG 4.45Å; F250-M272 HydrophobicContact CE1-SD 3.92Å; F250-M272 HydrophobicContact CE2-SD 4.32Å; F250-M272 HydrophobicContact CZ-CB 4.07Å; F250-M272 HydrophobicContact CZ-CG 4.24Å; F250-M272 HydrophobicContact CZ-SD 3.44Å; F250-M272 WeakPolarHBondContact CZ-SD 3.4Å; E260-M272 CarbonylContact O-C 3.49Å; E260-M272 VanDerWaalsContact O-CA 3.27Å; E260-M272 WeakPolarHBondContact O-CA 3.49Å; F261-M272 HydrophobicContact CD1-CB 4.16Å; F261-M272 HydrophobicContact CE1-CE 4.02Å; I270-M272 HydrophobicContact CG2-CE 3.81Å; M272-I287 HydrophobicContact CG-CB 4.07Å; M272-I287 PolarHBondContact N-O 2.81Å; M272-I287 PolarHBondContact O-N 2.82Å; M272-L289 HydrophobicContact CE-CD1 3.78Å; M272-L289 HydrophobicContact CE-CD2 4.47Å; M272-W319 HydrophobicContact SD-CH2 4.46Å
273	K	93.5	Very high	82.9	Confident	65 Å²	65	60.1 Å²	60.1	28%	0.283	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	141.2	154.1	-70.2	178.5	-168.2	147.9	0	108.2	F250 G259 E260 L262 Y284 A285	F250-K273 WeakPolarHBondContact CZ-O 3.38Å; G259-K273 WeakPolarHBondContact CA-O 3.37Å; E260-K273 HydrophobicContact CB-CB 4.31Å; E260-K273 HydrophobicContact CB-CD 4.43Å; E260-K273 PolarHBondContact N-O 2.76Å; E260-K273 VanDerWaalsContact N-O 3.14Å; E260-K273 PolarHBondContact O-N 2.91Å; E260-K273 IonicContact OE1-NZ 2.87Å; E260-K273 WeakPolarHBondContact OE2-CD 3.42Å; E260-K273 IonicContact OE2-NZ 3.98Å; E260-K273 PolarHBondContact OE2-NZ 2.79Å; L262-K273 HydrophobicContact CD1-CG 3.98Å; L262-K273 HydrophobicContact CD2-CD 4.29Å; L262-K273 HydrophobicContact CD2-CG 4.06Å; L262-K273 HydrophobicContact CG-CG 4.19Å; K273-Y284 HydrophobicContact CB-CD1 3.89Å; K273-Y284 HydrophobicContact CB-CG 4.18Å; K273-Y284 HydrophobicContact CD-CD1 4.41Å; K273-Y284 HydrophobicContact CD-CD2 4.49Å; K273-Y284 HydrophobicContact CD-CG 4.2Å; K273-Y284 HydrophobicContact CG-CG 4.49Å; K273-A285 CarbonylContact C-O 3.53Å; K273-A285 WeakPolarHBondContact CA-O 3.49Å
274	W	91.4	Very high	82.6	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.008	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	139.1	-178.9	-170.8	102.3	0	0	0	110	F250 V257 F276 W279 A285 I287 T315 W319 Y323	F250-W274 AromaticContact CE2-CD1 3.98Å; V257-W274 HydrophobicContact CG1-CD2 4.38Å; V257-W274 HydrophobicContact CG1-CZ2 3.94Å; V257-W274 VanDerWaalsContact CG1-NE1 3.3Å; V257-W274 HydrophobicContact CG2-CH2 4.4Å; V257-W274 HydrophobicContact CG2-CZ2 3.76Å; W274-F276 HydrophobicContact CH2-CD1 4.04Å; W274-F276 AromaticContact CH2-CD2 3.97Å; W274-F276 HydrophobicContact CH2-CD2 3.97Å; W274-F276 AromaticContact CH2-CE1 3.74Å; W274-F276 HydrophobicContact CH2-CE1 3.74Å; W274-F276 AromaticContact CH2-CE2 3.66Å; W274-F276 HydrophobicContact CH2-CE2 3.66Å; W274-F276 HydrophobicContact CH2-CG 4.16Å; W274-F276 AromaticContact CH2-CZ 3.56Å; W274-F276 HydrophobicContact CH2-CZ 3.56Å; W274-F276 HydrophobicContact CZ2-CE1 4.26Å; W274-F276 HydrophobicContact CZ2-CZ 4.37Å; W274-F276 HydrophobicContact CZ3-CD2 4.08Å; W274-F276 HydrophobicContact CZ3-CE2 4.1Å; W274-F276 HydrophobicContact CZ3-CG 4.39Å; W274-F276 HydrophobicContact CZ3-CZ 4.43Å; W274-W279 HydrophobicContact CE3-CH2 4.06Å; W274-W279 HydrophobicContact CE3-CZ2 4.48Å; W274-W279 AromaticContact CZ3-CH2 3.95Å; W274-W279 HydrophobicContact CZ3-CH2 3.95Å; W274-W279 AromaticContact CZ3-CZ2 3.92Å; W274-W279 HydrophobicContact CZ3-CZ2 3.92Å; W274-A285 PolarHBondContact N-O 2.97Å; W274-A285 PolarHBondContact O-N 2.7Å; W274-I287 HydrophobicContact CB-CD1 3.37Å; W274-I287 HydrophobicContact CB-CG1 3.8Å; W274-I287 HydrophobicContact CD2-CD1 3.65Å; W274-I287 HydrophobicContact CE3-CD1 4.06Å; W274-I287 HydrophobicContact CG-CD1 3.36Å; W274-I287 HydrophobicContact CG-CG1 4.33Å; W274-T315 HydrophobicContact CH2-CG2 4.13Å; W274-T315 HydrophobicContact CZ3-CG2 3.91Å; W274-W319 AromaticContact CD1-CZ2 3.83Å; W274-W319 AromaticContact CD2-NE1 3.96Å; W274-W319 AromaticContact CE2-NE1 3.34Å; W274-W319 VanDerWaalsContact CE2-NE1 3.34Å; W274-W319 HydrophobicContact CG-CZ2 4.45Å; W274-W319 AromaticContact CH2-NE1 3.9Å; W274-W319 AromaticContact CZ2-CD1 3.93Å; W274-W319 AromaticContact CZ2-NE1 3.32Å; W274-W319 VanDerWaalsContact CZ2-NE1 3.32Å; W274-W319 AromaticContact NE1-CE2 3.9Å; W274-W319 AromaticContact NE1-CZ2 3.65Å; W274-W319 AromaticContact NE1-NE1 3.62Å; W274-Y323 AromaticContact NE1-CZ 3.89Å; W274-Y323 PolarHBondContact NE1-OH 3.29Å
275	R	83.2	Confident	82.6	Confident	30 Å²	30	59.6 Å²	59.6	11%	0.113	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	156.4	172.2	60.7	177.5	-75.5	-160.7	-3.4	110.9	V257 N258 K277 W279 H283 Y284	V257-R275 WeakPolarHBondContact CA-O 3.47Å; N258-R275 HydrophobicContact CB-CG 4.48Å; N258-R275 PolarHBondContact N-O 3.14Å; N258-R275 PolarHBondContact O-N 3.48Å; R275-K277 PolarHBondContact NH2-O 2.69Å; R275-W279 HydrophobicContact CB-CB 4.41Å; R275-W279 HydrophobicContact CB-CD2 4.17Å; R275-W279 HydrophobicContact CB-CE3 3.63Å; R275-W279 HydrophobicContact CB-CZ3 4.21Å; R275-W279 PolarHBondContact NH2-O 3.47Å; R275-H283 WeakPolarHBondContact CB-O 3.28Å; R275-H283 WeakPolarHBondContact CD-O 3.43Å; R275-Y284 HydrophobicContact CB-CD1 4.11Å; R275-Y284 HydrophobicContact CG-CD1 3.65Å; R275-Y284 HydrophobicContact CG-CE1 3.63Å
276	F	75.3	Confident	82.7	Confident	24 Å²	24	60 Å²	60	11%	0.105	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	152.9	154.9	-68.2	-62.4	0	0	0	110.4	S256 V257 W274 T278 W279 E311 R314	S256-F276 CarbonylContact O-C 3.5Å; S256-F276 VanDerWaalsContact O-CA 3.27Å; S256-F276 WeakPolarHBondContact O-CA 3.38Å; V257-F276 HydrophobicContact CG2-CD1 3.7Å; V257-F276 HydrophobicContact CG2-CE1 3.74Å; W274-F276 HydrophobicContact CH2-CD1 4.04Å; W274-F276 AromaticContact CH2-CD2 3.97Å; W274-F276 HydrophobicContact CH2-CD2 3.97Å; W274-F276 AromaticContact CH2-CE1 3.74Å; W274-F276 HydrophobicContact CH2-CE1 3.74Å; W274-F276 AromaticContact CH2-CE2 3.66Å; W274-F276 HydrophobicContact CH2-CE2 3.66Å; W274-F276 HydrophobicContact CH2-CG 4.16Å; W274-F276 AromaticContact CH2-CZ 3.56Å; W274-F276 HydrophobicContact CH2-CZ 3.56Å; W274-F276 HydrophobicContact CZ2-CE1 4.26Å; W274-F276 HydrophobicContact CZ2-CZ 4.37Å; W274-F276 HydrophobicContact CZ3-CD2 4.08Å; W274-F276 HydrophobicContact CZ3-CE2 4.1Å; W274-F276 HydrophobicContact CZ3-CG 4.39Å; W274-F276 HydrophobicContact CZ3-CZ 4.43Å; F276-T278 WeakPolarHBondContact CB-OG1 3.13Å; F276-T278 PolarHBondContact O-N 3.29Å; F276-W279 HydrophobicContact CB-CG 4.28Å; F276-W279 AromaticContact CD2-CE2 3.98Å; F276-W279 HydrophobicContact CD2-CZ2 4.24Å; F276-W279 AromaticContact CD2-NE1 3.5Å; F276-W279 WeakPolarHBondContact O-CB 3.15Å; F276-W279 PolarHBondContact O-N 2.85Å; F276-E311 WeakPolarHBondContact CD2-OE2 3.25Å; F276-R314 HydrophobicContact CE2-CG 4.15Å; F276-R314 HydrophobicContact CZ-CG 4.42Å
277	K	70.1	Confident	82.9	Confident	149 Å²	149	55.8 Å²	55.8	65%	0.648	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-37.6	171.9	-175.5	-178.6	174.5	-171.7	0	111.4	S256 R275 W279	S256-K277 PolarHBondContact O-N 2.95Å; R275-K277 PolarHBondContact NH2-O 2.69Å; K277-W279 VanDerWaalsContact C-N 3.28Å; K277-W279 PolarHBondContact O-N 2.64Å
278	T	61.2	Low	83.2	Confident	93 Å²	93	53.4 Å²	53.4	57%	0.571	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-16	177.9	55.1	0	0	0	0	114.6	F276	F276-T278 WeakPolarHBondContact CB-OG1 3.13Å; F276-T278 PolarHBondContact O-N 3.29Å
279	W	75	Confident	83.4	Confident	8 Å²	8	47.5 Å²	47.5	3%	0.03	24%	0.242	C	C	.	.	S	Bend	trans	-66.4	153.7	176.6	-74.4	9.9	0	0	0	111.2	W274 R275 F276 K277 H283 A285 V307 P308 E311	W274-W279 HydrophobicContact CE3-CH2 4.06Å; W274-W279 HydrophobicContact CE3-CZ2 4.48Å; W274-W279 AromaticContact CZ3-CH2 3.95Å; W274-W279 HydrophobicContact CZ3-CH2 3.95Å; W274-W279 AromaticContact CZ3-CZ2 3.92Å; W274-W279 HydrophobicContact CZ3-CZ2 3.92Å; R275-W279 HydrophobicContact CB-CB 4.41Å; R275-W279 HydrophobicContact CB-CD2 4.17Å; R275-W279 HydrophobicContact CB-CE3 3.63Å; R275-W279 HydrophobicContact CB-CZ3 4.21Å; R275-W279 PolarHBondContact NH2-O 3.47Å; F276-W279 HydrophobicContact CB-CG 4.28Å; F276-W279 AromaticContact CD2-CE2 3.98Å; F276-W279 HydrophobicContact CD2-CZ2 4.24Å; F276-W279 AromaticContact CD2-NE1 3.5Å; F276-W279 WeakPolarHBondContact O-CB 3.15Å; F276-W279 PolarHBondContact O-N 2.85Å; K277-W279 VanDerWaalsContact C-N 3.28Å; K277-W279 PolarHBondContact O-N 2.64Å; W279-H283 AromaticContact CE3-CD2 3.83Å; W279-A285 HydrophobicContact CH2-CB 3.84Å; W279-A285 HydrophobicContact CZ3-CB 3.67Å; W279-V307 HydrophobicContact CH2-CB 4.15Å; W279-V307 HydrophobicContact CH2-CG1 3.84Å; W279-V307 HydrophobicContact CH2-CG2 4.12Å; W279-V307 HydrophobicContact CZ2-CG1 3.87Å; W279-P308 HydrophobicContact CD2-CG 3.92Å; W279-P308 HydrophobicContact CE3-CG 4.16Å; W279-P308 HydrophobicContact CG-CG 4.34Å; W279-P308 VanDerWaalsContact CH2-CD 3.5Å; W279-P308 HydrophobicContact CZ2-CG 4.36Å; W279-P308 HydrophobicContact CZ3-CG 4.48Å; W279-E311 HydrophobicContact CZ2-CB 4.23Å; W279-E311 PolarHBondContact NE1-OE2 3.32Å
280	P	64.8	Low	83.5	Confident	64 Å²	64	47.1 Å²	47.1	42%	0.416	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-51.4	149.2	177.8	-30.1	38	0	0	0	113.1	I204 E282 H283	I204-P280 HydrophobicContact CD1-CB 3.79Å; I204-P280 HydrophobicContact CD1-CG 3.72Å; P280-E282 PolarHBondContact O-N 2.86Å; P280-H283 HydrophobicContact CB-CB 4.21Å; P280-H283 VanDerWaalsContact O-CB 3.22Å; P280-H283 WeakPolarHBondContact O-CB 3.2Å; P280-H283 PolarHBondContact O-N 3.22Å
281	C	56.1	Low	83.4	Confident	117 Å²	117	47.5 Å²	47.5	79%	0.791	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	139.2	-176.5	-158.4	0	0	0	0	111.5	H283	C281-H283 PolarHBondContact O-N 3.36Å
282	E	74.7	Confident	83.3	Confident	167 Å²	167	52.3 Å²	52.3	78%	0.78	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	9.3	-172.5	-51.7	-156.2	115.5	0	0	116.8	P280 Y284	P280-E282 PolarHBondContact O-N 2.86Å; E282-Y284 VanDerWaalsContact O-CD2 3.31Å; E282-Y284 WeakPolarHBondContact O-CD2 3.34Å
283	H	79.7	Confident	83.1	Confident	34 Å²	34	57 Å²	57	16%	0.157	29%	0.29	C	S	.	.			trans	-84.8	116.2	173.7	-161.4	72.8	0	0	0	111.4	I204 R275 W279 P280 C281 G306	I204-H283 HydrophobicContact CD1-CB 4.41Å; R275-H283 WeakPolarHBondContact CB-O 3.28Å; R275-H283 WeakPolarHBondContact CD-O 3.43Å; W279-H283 AromaticContact CE3-CD2 3.83Å; P280-H283 HydrophobicContact CB-CB 4.21Å; P280-H283 VanDerWaalsContact O-CB 3.22Å; P280-H283 WeakPolarHBondContact O-CB 3.2Å; P280-H283 PolarHBondContact O-N 3.22Å; C281-H283 PolarHBondContact O-N 3.36Å; H283-G306 PolarHBondContact NE2-O 3.12Å
284	Y	85.8	Confident	82.9	Confident	95 Å²	95	61.2 Å²	61.2	37%	0.373	30%	0.304	S	S	.	.			trans	-127.7	135.6	177.7	-63.4	-92.8	0	0	0	110.7	K273 R275 E282	K273-Y284 HydrophobicContact CB-CD1 3.89Å; K273-Y284 HydrophobicContact CB-CG 4.18Å; K273-Y284 HydrophobicContact CD-CD1 4.41Å; K273-Y284 HydrophobicContact CD-CD2 4.49Å; K273-Y284 HydrophobicContact CD-CG 4.2Å; K273-Y284 HydrophobicContact CG-CG 4.49Å; R275-Y284 HydrophobicContact CB-CD1 4.11Å; R275-Y284 HydrophobicContact CG-CD1 3.65Å; R275-Y284 HydrophobicContact CG-CE1 3.63Å; E282-Y284 VanDerWaalsContact O-CD2 3.31Å; E282-Y284 WeakPolarHBondContact O-CD2 3.34Å
285	A	89.6	Confident	82.5	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	144.2	162.4	0	0	0	0	0	108.9	K273 W274 W279 I287 K305 V307	K273-A285 CarbonylContact C-O 3.53Å; K273-A285 WeakPolarHBondContact CA-O 3.49Å; W274-A285 PolarHBondContact N-O 2.97Å; W274-A285 PolarHBondContact O-N 2.7Å; W279-A285 HydrophobicContact CH2-CB 3.84Å; W279-A285 HydrophobicContact CZ3-CB 3.67Å; A285-I287 HydrophobicContact CB-CG1 4.46Å; A285-K305 CarbonylContact C-O 3.49Å; A285-K305 WeakPolarHBondContact CA-O 3.46Å; A285-V307 HydrophobicContact CB-CG2 3.71Å
286	T	92.9	Very high	82.3	Confident	52 Å²	52	69.5 Å²	69.5	32%	0.319	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	123.2	163	-49	0	0	0	0	107.8	V271 K305	V271-T286 HydrophobicContact CG1-CG2 3.82Å; T286-K305 PolarHBondContact N-O 3.42Å; T286-K305 PolarHBondContact O-N 3.14Å
287	I	94.1	Very high	83	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	127.1	175.4	-52.7	-175	0	0	0	108.4	V271 M272 W274 A285 L289 V302 E303 F304 W319	V271-I287 WeakPolarHBondContact CA-O 3.27Å; M272-I287 HydrophobicContact CG-CB 4.07Å; M272-I287 PolarHBondContact N-O 2.81Å; M272-I287 PolarHBondContact O-N 2.82Å; W274-I287 HydrophobicContact CB-CD1 3.37Å; W274-I287 HydrophobicContact CB-CG1 3.8Å; W274-I287 HydrophobicContact CD2-CD1 3.65Å; W274-I287 HydrophobicContact CE3-CD1 4.06Å; W274-I287 HydrophobicContact CG-CD1 3.36Å; W274-I287 HydrophobicContact CG-CG1 4.33Å; A285-I287 HydrophobicContact CB-CG1 4.46Å; I287-L289 HydrophobicContact CG2-CD1 3.8Å; I287-V302 HydrophobicContact CG2-CG1 3.34Å; I287-E303 WeakPolarHBondContact CA-O 3.27Å; I287-F304 HydrophobicContact CD1-CD1 3.69Å; I287-F304 HydrophobicContact CD1-CE1 3.65Å; I287-F304 HydrophobicContact CG1-CD1 3.88Å; I287-F304 HydrophobicContact CG1-CE1 4.27Å; I287-F304 HydrophobicContact CG2-CD1 4.28Å; I287-F304 HydrophobicContact CG2-CE1 4.2Å; I287-W319 HydrophobicContact CD1-CH2 4.39Å; I287-W319 HydrophobicContact CD1-CZ2 3.45Å; I287-W319 VanDerWaalsContact CD1-CZ2 3.45Å; I287-W319 HydrophobicContact CG2-CH2 4.09Å; I287-W319 HydrophobicContact CG2-CZ2 4.12Å
288	T	94.9	Very high	84	Confident	29 Å²	29	63.5 Å²	63.5	18%	0.178	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	111.4	179	-57.2	0	0	0	0	108.9	V271 V302 E303	V271-T288 HydrophobicContact CG2-CG2 4.21Å; T288-V302 WeakPolarHBondContact O-CA 3.42Å; T288-E303 PolarHBondContact N-O 3.1Å; T288-E303 PolarHBondContact O-N 3.24Å
289	L	93.6	Very high	85.5	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	125.6	173	-68.6	74.3	0	0	0	107.4	F226 K269 I270 M272 I287 L300 V302 W319	F226-L289 HydrophobicContact CD1-CD2 3.7Å; F226-L289 HydrophobicContact CD2-CD2 4.11Å; F226-L289 HydrophobicContact CE1-CD2 3.53Å; F226-L289 HydrophobicContact CE2-CD2 3.98Å; F226-L289 HydrophobicContact CG-CD2 3.99Å; F226-L289 HydrophobicContact CZ-CD2 3.7Å; K269-L289 WeakPolarHBondContact CA-O 3.29Å; I270-L289 HydrophobicContact CB-CB 4.2Å; I270-L289 PolarHBondContact N-O 2.72Å; I270-L289 PolarHBondContact O-N 3.49Å; M272-L289 HydrophobicContact CE-CD1 3.78Å; M272-L289 HydrophobicContact CE-CD2 4.47Å; I287-L289 HydrophobicContact CG2-CD1 3.8Å; L289-L300 HydrophobicContact CB-CD1 4.01Å; L289-L300 HydrophobicContact CD2-CD1 4.27Å; L289-L300 HydrophobicContact CG-CD1 4.37Å; L289-V302 HydrophobicContact CD1-CG1 4.3Å; L289-V302 HydrophobicContact CG-CG1 4.23Å; L289-V302 HydrophobicContact CG-CG2 4.17Å; L289-W319 HydrophobicContact CD1-CH2 4.17Å; L289-W319 HydrophobicContact CD2-CZ3 4.41Å
290	N	94.4	Very high	86.4	Confident	44 Å²	44	60 Å²	60	24%	0.235	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	122.4	172.7	-52.1	-96.3	0	0	0	107.5	K301	N290-K301 PolarHBondContact N-O 3.31Å; N290-K301 PolarHBondContact ND2-O 3.25Å; N290-K301 PolarHBondContact O-N 2.8Å
291	M	92.9	Very high	87.8	Confident	9 Å²	9	60.2 Å²	60.2	4%	0.044	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	133.9	176.5	-73.9	147.9	-67.1	0	0	108.7	P219 L222 Y223 E268 I270 T298 L300	P219-M291 HydrophobicContact CB-CB 4.42Å; L222-M291 HydrophobicContact CD2-CG 4.17Å; L222-M291 HydrophobicContact CG-SD 4.48Å; Y223-M291 HydrophobicContact CD2-CE 3.78Å; Y223-M291 HydrophobicContact CD2-SD 4.32Å; E268-M291 PolarHBondContact O-N 3.48Å; I270-M291 HydrophobicContact CD1-CE 4.32Å; I270-M291 HydrophobicContact CG1-CE 4.22Å; M291-T298 HydrophobicContact CB-CG2 3.95Å; M291-T298 HydrophobicContact CG-CG2 4.13Å; M291-L300 HydrophobicContact CG-CD1 3.67Å; M291-L300 HydrophobicContact SD-CD1 4.47Å
292	K	91.8	Very high	89.6	Confident	112 Å²	112	54.6 Å²	54.6	49%	0.487	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	121.3	175.4	-70.8	-174.1	178.2	-177.6	0	110	R294 E299	K292-R294 PolarHBondContact O-N 3.21Å; K292-E299 HydrophobicContact CB-CB 4.32Å; K292-E299 PolarHBondContact N-O 2.9Å; K292-E299 PolarHBondContact O-N 2.86Å
293	D	91	Very high	90.6	Very high	103 Å²	103	50.5 Å²	50.5	55%	0.551	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.7	130.5	172.3	-171	7.3	0	0	0	111.1	P219 G295	P219-D293 HydrophobicContact CG-CB 3.88Å; D293-G295 WeakPolarHBondContact OD1-CA 3.26Å; D293-G295 PolarHBondContact OD1-N 2.88Å
294	R	88.4	Confident	91.2	Very high	153 Å²	153	49 Å²	49	58%	0.577	25%	0.247	S	C	*	.			trans	-119.7	21.1	170.8	-57.2	-62.7	-166.5	-174.2	4.1	111.7	K292 N296 E297 E299	K292-R294 PolarHBondContact O-N 3.21Å; R294-N296 PolarHBondContact O-N 3.27Å; R294-E297 WeakPolarHBondContact CA-O 3.41Å; R294-E297 VanDerWaalsContact CB-O 3.26Å; R294-E297 WeakPolarHBondContact CB-O 3.42Å; R294-E297 PolarHBondContact N-O 2.85Å; R294-E299 HydrophobicContact CG-CB 4.14Å; R294-E299 IonicContact CZ-OE2 3.53Å; R294-E299 IonicContact NE-OE2 3.73Å; R294-E299 PolarHBondContact NE-OE2 2.98Å; R294-E299 IonicContact NH2-OE1 3.32Å; R294-E299 IonicContact NH2-OE2 2.78Å; R294-E299 PolarHBondContact NH2-OE2 2.88Å
295	G	82.1	Confident	91.4	Very high	56 Å²	56	51.6 Å²	51.6	58%	0.577	26%	0.26	S	S	*	.	S	Bend	trans	89.8	-62	175.8	0	0	0	0	0	113.2	D293	D293-G295 WeakPolarHBondContact OD1-CA 3.26Å; D293-G295 PolarHBondContact OD1-N 2.88Å
296	N	80.6	Confident	91.1	Very high	150 Å²	150	52.4 Å²	52.4	80%	0.802	27%	0.268	S	S	*	.	S	Bend	trans	-110.2	-4.3	178	-74	24	0	0	0	113.1	R294	R294-N296 PolarHBondContact O-N 3.27Å
297	E	89.6	Confident	90.8	Very high	48 Å²	48	49.9 Å²	49.9	22%	0.224	25%	0.253	C	S	.	.	S	Bend	trans	-143.8	147.5	-174.8	-48.2	-172.5	161.4	0	0	108.6	T214 F215 L216 R294 R336	T214-E297 HydrophobicContact CG2-CB 3.7Å; T214-E297 HydrophobicContact CG2-CG 4.47Å; T214-E297 WeakPolarHBondContact CG2-OE2 3.47Å; F215-E297 CarbonylContact O-C 3.54Å; F215-E297 VanDerWaalsContact O-CA 3.29Å; F215-E297 WeakPolarHBondContact O-CA 3.38Å; L216-E297 HydrophobicContact CD2-CG 3.65Å; L216-E297 WeakPolarHBondContact CD2-OE1 3.46Å; R294-E297 WeakPolarHBondContact CA-O 3.41Å; R294-E297 VanDerWaalsContact CB-O 3.26Å; R294-E297 WeakPolarHBondContact CB-O 3.42Å; R294-E297 PolarHBondContact N-O 2.85Å; E297-R336 IonicContact OE1-CZ 3.09Å; E297-R336 IonicContact OE1-NE 2.66Å; E297-R336 IonicContact OE1-NH2 2.64Å; E297-R336 PolarHBondContact OE1-NH2 3.34Å
298	T	90.8	Very high	90.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	123.6	172.6	-62.6	0	0	0	0	109.7	F215 T217 S218 P219 L222 M291	F215-T298 PolarHBondContact N-O 3.16Å; F215-T298 PolarHBondContact O-N 3.29Å; T217-T298 WeakPolarHBondContact O-CB 3.34Å; T217-T298 PolarHBondContact O-N 3.02Å; T217-T298 PolarHBondContact O-OG1 2.96Å; S218-T298 VanDerWaalsContact C-OG1 3.28Å; P219-T298 HydrophobicContact CB-CG2 4.27Å; P219-T298 WeakPolarHBondContact CD-OG1 3.42Å; P219-T298 HydrophobicContact CG-CG2 4.22Å; P219-T298 VanDerWaalsContact N-OG1 3.16Å; L222-T298 HydrophobicContact CD2-CG2 3.73Å; M291-T298 HydrophobicContact CB-CG2 3.95Å; M291-T298 HydrophobicContact CG-CG2 4.13Å
299	E	93.1	Very high	89.1	Confident	28 Å²	28	52.3 Å²	52.3	13%	0.131	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	111.6	172.3	-179.3	-172.1	134.2	0	0	108.9	Q212 K292 R294	Q212-E299 HydrophobicContact CG-CG 4.26Å; Q212-E299 VanDerWaalsContact NE2-CD 3.26Å; Q212-E299 PolarHBondContact NE2-OE1 2.83Å; Q212-E299 VanDerWaalsContact NE2-OE1 3.14Å; K292-E299 HydrophobicContact CB-CB 4.32Å; K292-E299 PolarHBondContact N-O 2.9Å; K292-E299 PolarHBondContact O-N 2.86Å; R294-E299 HydrophobicContact CG-CB 4.14Å; R294-E299 IonicContact CZ-OE2 3.53Å; R294-E299 IonicContact NE-OE2 3.73Å; R294-E299 PolarHBondContact NE-OE2 2.98Å; R294-E299 IonicContact NH2-OE1 3.32Å; R294-E299 IonicContact NH2-OE2 2.78Å; R294-E299 PolarHBondContact NH2-OE2 2.88Å
300	L	93.6	Very high	88.1	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	114.6	176.1	-178.7	65.8	0	0	0	109.6	Q212 E213 F215 L222 F226 L289 M291 V302 F324	Q212-L300 WeakPolarHBondContact CA-O 3.28Å; E213-L300 PolarHBondContact N-O 2.96Å; E213-L300 PolarHBondContact O-N 3.38Å; F215-L300 HydrophobicContact CD2-CB 4Å; F215-L300 HydrophobicContact CE2-CB 3.79Å; F215-L300 HydrophobicContact CE2-CD2 3.7Å; F215-L300 HydrophobicContact CE2-CG 4.39Å; F215-L300 HydrophobicContact CZ-CD2 4.21Å; L222-L300 HydrophobicContact CD2-CB 4.14Å; L222-L300 HydrophobicContact CD2-CD2 4.48Å; F226-L300 HydrophobicContact CE2-CD2 4.16Å; F226-L300 HydrophobicContact CZ-CD2 3.9Å; L289-L300 HydrophobicContact CB-CD1 4.01Å; L289-L300 HydrophobicContact CD2-CD1 4.27Å; L289-L300 HydrophobicContact CG-CD1 4.37Å; M291-L300 HydrophobicContact CG-CD1 3.67Å; M291-L300 HydrophobicContact SD-CD1 4.47Å; L300-V302 HydrophobicContact CD1-CG2 4.38Å; L300-V302 HydrophobicContact CD2-CG2 3.95Å; L300-V302 HydrophobicContact CG-CG2 3.81Å; L300-F324 HydrophobicContact CD2-CD1 4.38Å; L300-F324 HydrophobicContact CD2-CE1 3.9Å
301	K	94.5	Very high	87	Confident	67 Å²	67	58.6 Å²	58.6	29%	0.291	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	115.2	170.8	-167.3	-168.4	-175.2	-159	0	110.1	N290 E303	N290-K301 PolarHBondContact N-O 3.31Å; N290-K301 PolarHBondContact ND2-O 3.25Å; N290-K301 PolarHBondContact O-N 2.8Å; K301-E303 HydrophobicContact CD-CG 4.49Å; K301-E303 WeakPolarHBondContact CE-OE1 3.42Å; K301-E303 IonicContact NZ-OE1 2.68Å; K301-E303 PolarHBondContact NZ-OE1 3.41Å
302	V	94.5	Very high	86.3	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	116.4	179.9	-168.2	0	0	0	0	109.4	S210 L211 I287 T288 L289 L300 F304 W319 F324	S210-V302 CarbonylContact C-O 3.57Å; S210-V302 WeakPolarHBondContact CA-O 3.46Å; L211-V302 PolarHBondContact N-O 2.83Å; L211-V302 PolarHBondContact O-N 2.82Å; I287-V302 HydrophobicContact CG2-CG1 3.34Å; T288-V302 WeakPolarHBondContact O-CA 3.42Å; L289-V302 HydrophobicContact CD1-CG1 4.3Å; L289-V302 HydrophobicContact CG-CG1 4.23Å; L289-V302 HydrophobicContact CG-CG2 4.17Å; L300-V302 HydrophobicContact CD1-CG2 4.38Å; L300-V302 HydrophobicContact CD2-CG2 3.95Å; L300-V302 HydrophobicContact CG-CG2 3.81Å; V302-F304 HydrophobicContact CB-CE2 3.81Å; V302-F304 HydrophobicContact CB-CZ 4.24Å; V302-F304 HydrophobicContact CG1-CD2 4.17Å; V302-F304 HydrophobicContact CG1-CE1 4.32Å; V302-F304 HydrophobicContact CG1-CE2 3.44Å; V302-F304 VanDerWaalsContact CG1-CE2 3.44Å; V302-F304 HydrophobicContact CG1-CZ 3.53Å; V302-W319 HydrophobicContact CG1-CE3 4.14Å; V302-W319 HydrophobicContact CG1-CH2 4.42Å; V302-W319 HydrophobicContact CG1-CZ3 3.93Å; V302-W319 HydrophobicContact CG2-CZ3 4.37Å; V302-F324 HydrophobicContact CB-CZ 4.42Å; V302-F324 HydrophobicContact CG2-CE1 3.89Å; V302-F324 HydrophobicContact CG2-CZ 3.7Å
303	E	94.3	Very high	85.6	Confident	80 Å²	80	60.3 Å²	60.3	37%	0.374	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	128.8	177.2	-60	-169.9	165.9	0	0	110.7	I287 T288 K301	I287-E303 WeakPolarHBondContact CA-O 3.27Å; T288-E303 PolarHBondContact N-O 3.1Å; T288-E303 PolarHBondContact O-N 3.24Å; K301-E303 HydrophobicContact CD-CG 4.49Å; K301-E303 WeakPolarHBondContact CE-OE1 3.42Å; K301-E303 IonicContact NZ-OE1 2.68Å; K301-E303 PolarHBondContact NZ-OE1 3.41Å
304	F	92.3	Very high	84.9	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.018	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	129.1	-176.3	-60.4	-104.5	0	0	0	109.5	K208 F209 L211 I287 V302 V307 T315 W319	K208-F304 WeakPolarHBondContact CA-O 3.33Å; F209-F304 HydrophobicContact CD1-CB 4.17Å; F209-F304 HydrophobicContact CD2-CB 4.13Å; F209-F304 AromaticContact CD2-CD2 3.56Å; F209-F304 HydrophobicContact CD2-CD2 3.56Å; F209-F304 HydrophobicContact CD2-CE2 4.15Å; F209-F304 AromaticContact CD2-CG 3.95Å; F209-F304 HydrophobicContact CD2-CG 3.95Å; F209-F304 HydrophobicContact CE1-CB 3.92Å; F209-F304 HydrophobicContact CE1-CG 4.21Å; F209-F304 HydrophobicContact CE2-CB 3.89Å; F209-F304 AromaticContact CE2-CD1 3.87Å; F209-F304 HydrophobicContact CE2-CD1 3.87Å; F209-F304 AromaticContact CE2-CD2 3.23Å; F209-F304 HydrophobicContact CE2-CD2 3.23Å; F209-F304 HydrophobicContact CE2-CE1 4.17Å; F209-F304 AromaticContact CE2-CE2 3.61Å; F209-F304 HydrophobicContact CE2-CE2 3.61Å; F209-F304 AromaticContact CE2-CG 3.39Å; F209-F304 HydrophobicContact CE2-CG 3.39Å; F209-F304 HydrophobicContact CE2-CZ 4.06Å; F209-F304 HydrophobicContact CG-CB 4.26Å; F209-F304 HydrophobicContact CG-CD2 4.45Å; F209-F304 HydrophobicContact CZ-CB 3.78Å; F209-F304 AromaticContact CZ-CD1 3.73Å; F209-F304 HydrophobicContact CZ-CD1 3.73Å; F209-F304 AromaticContact CZ-CD2 3.92Å; F209-F304 HydrophobicContact CZ-CD2 3.92Å; F209-F304 HydrophobicContact CZ-CE1 4.25Å; F209-F304 HydrophobicContact CZ-CE2 4.43Å; F209-F304 AromaticContact CZ-CG 3.54Å; F209-F304 HydrophobicContact CZ-CG 3.54Å; F209-F304 PolarHBondContact N-O 2.76Å; F209-F304 PolarHBondContact O-N 2.68Å; L211-F304 HydrophobicContact CB-CE2 4.13Å; L211-F304 HydrophobicContact CD1-CE2 3.85Å; L211-F304 HydrophobicContact CD1-CZ 3.95Å; L211-F304 HydrophobicContact CG-CE2 3.78Å; L211-F304 HydrophobicContact CG-CZ 4.4Å; I287-F304 HydrophobicContact CD1-CD1 3.69Å; I287-F304 HydrophobicContact CD1-CE1 3.65Å; I287-F304 HydrophobicContact CG1-CD1 3.88Å; I287-F304 HydrophobicContact CG1-CE1 4.27Å; I287-F304 HydrophobicContact CG2-CD1 4.28Å; I287-F304 HydrophobicContact CG2-CE1 4.2Å; V302-F304 HydrophobicContact CB-CE2 3.81Å; V302-F304 HydrophobicContact CB-CZ 4.24Å; V302-F304 HydrophobicContact CG1-CD2 4.17Å; V302-F304 HydrophobicContact CG1-CE1 4.32Å; V302-F304 HydrophobicContact CG1-CE2 3.44Å; V302-F304 VanDerWaalsContact CG1-CE2 3.44Å; V302-F304 HydrophobicContact CG1-CZ 3.53Å; F304-V307 HydrophobicContact CB-CG2 3.92Å; F304-V307 HydrophobicContact CD1-CG2 4.32Å; F304-T315 HydrophobicContact CD1-CG2 4.09Å; F304-T315 HydrophobicContact CE1-CG2 4Å; F304-W319 AromaticContact CE1-CD1 3.63Å; F304-W319 AromaticContact CE1-CD2 3.8Å; F304-W319 HydrophobicContact CE1-CD2 3.8Å; F304-W319 AromaticContact CE1-CE2 3.79Å; F304-W319 AromaticContact CE1-CG 3.72Å; F304-W319 HydrophobicContact CE1-CG 3.72Å; F304-W319 AromaticContact CE1-NE1 3.65Å; F304-W319 HydrophobicContact CZ-CB 4.1Å; F304-W319 AromaticContact CZ-CD2 3.65Å; F304-W319 HydrophobicContact CZ-CD2 3.65Å; F304-W319 HydrophobicContact CZ-CE3 4.06Å; F304-W319 AromaticContact CZ-CG 3.62Å; F304-W319 HydrophobicContact CZ-CG 3.62Å
305	K	90.2	Very high	84.4	Confident	148 Å²	148	54 Å²	54	64%	0.643	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.6	125.3	179.4	-178.6	-176.8	175.5	-173	0	110.5	A285 T286	A285-K305 CarbonylContact C-O 3.49Å; A285-K305 WeakPolarHBondContact CA-O 3.46Å; T286-K305 PolarHBondContact N-O 3.42Å; T286-K305 PolarHBondContact O-N 3.14Å
306	G	84.5	Confident	84.4	Confident	17 Å²	17	53.5 Å²	53.5	18%	0.175	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	87	26.5	-179.5	0	0	0	0	0	113.6	C207 H283	C207-G306 PolarHBondContact O-N 2.81Å; H283-G306 PolarHBondContact NE2-O 3.12Å
307	V	85	Confident	84.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	134.1	170.3	179	0	0	0	0	108	T206 C207 F209 W279 A285 F304 T309 T315	T206-V307 CarbonylContact C-O 3.58Å; T206-V307 WeakPolarHBondContact CA-O 3.05Å; T206-V307 WeakPolarHBondContact CB-O 3.27Å; C207-V307 PolarHBondContact N-O 3.09Å; C207-V307 PolarHBondContact SG-O 3.33Å; C207-V307 VanDerWaalsContact SG-O 3.34Å; F209-V307 HydrophobicContact CE1-CB 4.08Å; F209-V307 HydrophobicContact CE1-CG1 4.12Å; F209-V307 HydrophobicContact CE1-CG2 3.87Å; F209-V307 HydrophobicContact CZ-CG2 4.29Å; W279-V307 HydrophobicContact CH2-CB 4.15Å; W279-V307 HydrophobicContact CH2-CG1 3.84Å; W279-V307 HydrophobicContact CH2-CG2 4.12Å; W279-V307 HydrophobicContact CZ2-CG1 3.87Å; A285-V307 HydrophobicContact CB-CG2 3.71Å; F304-V307 HydrophobicContact CB-CG2 3.92Å; F304-V307 HydrophobicContact CD1-CG2 4.32Å; V307-T309 PolarHBondContact O-N 3.32Å; V307-T315 HydrophobicContact CG1-CG2 4.35Å; V307-T315 HydrophobicContact CG2-CG2 4.44Å
308	P	79.5	Confident	83.8	Confident	9 Å²	9	50 Å²	50	6%	0.058	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	134.1	172.2	-21.2	30.9	0	0	0	110.9	I204 P205 W279 V310 E311 E312	I204-P308 HydrophobicContact CG2-CB 4.03Å; I204-P308 HydrophobicContact CG2-CG 4.34Å; P205-P308 WeakPolarHBondContact O-CA 3.27Å; W279-P308 HydrophobicContact CD2-CG 3.92Å; W279-P308 HydrophobicContact CE3-CG 4.16Å; W279-P308 HydrophobicContact CG-CG 4.34Å; W279-P308 VanDerWaalsContact CH2-CD 3.5Å; W279-P308 HydrophobicContact CZ2-CG 4.36Å; W279-P308 HydrophobicContact CZ3-CG 4.48Å; P308-V310 PolarHBondContact O-N 3.47Å; P308-V310 VanDerWaalsContact O-N 3.17Å; P308-E311 HydrophobicContact CB-CB 4.15Å; P308-E311 HydrophobicContact CB-CG 4.32Å; P308-E311 HydrophobicContact CG-CB 4.44Å; P308-E311 CarbonylContact O-C 3.54Å; P308-E311 WeakPolarHBondContact O-CA 3.5Å; P308-E311 PolarHBondContact O-N 2.64Å; P308-E312 PolarHBondContact O-N 2.96Å
309	T	73.6	Confident	83.7	Confident	70 Å²	70	50 Å²	50	43%	0.429	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-60.8	-31	-174.8	-54.4	0	0	0	0	113.2	P205 V307 E311 E312	P205-T309 PolarHBondContact O-N 3.13Å; P205-T309 PolarHBondContact O-OG1 3.36Å; V307-T309 PolarHBondContact O-N 3.32Å; T309-E311 PolarHBondContact O-N 2.78Å; T309-E312 WeakPolarHBondContact O-CB 3.45Å; T309-E312 PolarHBondContact O-N 2.88Å
310	V	72.6	Confident	83.2	Confident	141 Å²	141	53 Å²	53	86%	0.855	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-65.7	-29.9	175.3	-176.1	0	0	0	0	111.9	P308	P308-V310 PolarHBondContact O-N 3.47Å; P308-V310 VanDerWaalsContact O-N 3.17Å
311	E	73	Confident	82.4	Confident	35 Å²	35	60 Å²	60	16%	0.164	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-98	3.5	-174.6	-73.2	-81.8	138.1	0	0	112.5	F276 W279 P308 T309 R314 T315	F276-E311 WeakPolarHBondContact CD2-OE2 3.25Å; W279-E311 HydrophobicContact CZ2-CB 4.23Å; W279-E311 PolarHBondContact NE1-OE2 3.32Å; P308-E311 HydrophobicContact CB-CB 4.15Å; P308-E311 HydrophobicContact CB-CG 4.32Å; P308-E311 HydrophobicContact CG-CB 4.44Å; P308-E311 CarbonylContact O-C 3.54Å; P308-E311 WeakPolarHBondContact O-CA 3.5Å; P308-E311 PolarHBondContact O-N 2.64Å; T309-E311 PolarHBondContact O-N 2.78Å; E311-R314 PolarHBondContact O-N 3Å; E311-R314 IonicContact OE1-NH1 3.32Å; E311-R314 PolarHBondContact OE1-NH1 2.99Å; E311-R314 VanDerWaalsContact OE1-NH1 3.09Å; E311-R314 WeakPolarHBondContact OE2-CD 3.35Å; E311-R314 IonicContact OE2-NH1 3.41Å; E311-T315 VanDerWaalsContact O-CB 3.3Å; E311-T315 WeakPolarHBondContact O-CB 3.37Å; E311-T315 PolarHBondContact O-N 3.42Å; E311-T315 PolarHBondContact O-OG1 3.05Å
312	E	77.8	Confident	81.7	Confident	43 Å²	43	60.3 Å²	60.3	20%	0.201	29%	0.293	C	S	.	.	H	α-helix	trans	-58.5	-53.4	-174.1	-178.6	172	155.9	0	0	112.1	C207 F209 P308 T309 T315 K316	C207-E312 WeakPolarHBondContact CB-OE2 3.22Å; C207-E312 VanDerWaalsContact SG-CD 3.6Å; C207-E312 PolarHBondContact SG-OE2 3.27Å; F209-E312 HydrophobicContact CD1-CG 3.76Å; F209-E312 HydrophobicContact CE1-CG 3.78Å; P308-E312 PolarHBondContact O-N 2.96Å; T309-E312 WeakPolarHBondContact O-CB 3.45Å; T309-E312 PolarHBondContact O-N 2.88Å; E312-T315 PolarHBondContact O-N 2.68Å; E312-K316 HydrophobicContact CG-CD 4.46Å; E312-K316 VanDerWaalsContact CG-CE 3.5Å; E312-K316 WeakPolarHBondContact O-CG 3.48Å; E312-K316 PolarHBondContact O-N 3.44Å; E312-K316 WeakPolarHBondContact OE1-CE 3.34Å; E312-K316 IonicContact OE1-NZ 2.81Å; E312-K316 PolarHBondContact OE1-NZ 2.96Å
313	D	76.9	Confident	81.4	Confident	115 Å²	115	60.8 Å²	60.8	62%	0.615	30%	0.295	S	S	*	.	H	α-helix	trans	-74.2	-33	-175.9	-67	-30.5	0	0	0	112.3	T315 K316 E317	D313-T315 VanDerWaalsContact C-N 3.34Å; D313-K316 PolarHBondContact O-N 3.21Å; D313-K316 IonicContact OD1-NZ 2.68Å; D313-K316 PolarHBondContact OD1-NZ 2.95Å; D313-E317 WeakPolarHBondContact O-CB 3.45Å; D313-E317 PolarHBondContact O-N 3.29Å
314	R	76.1	Confident	81.1	Confident	123 Å²	123	57.1 Å²	57.1	46%	0.464	28%	0.278	S	S	.	.	H	α-helix	trans	-60	-44.4	169.6	-168.7	-164.4	-169.6	158.5	4.2	111	F276 E311 G318	F276-R314 HydrophobicContact CE2-CG 4.15Å; F276-R314 HydrophobicContact CZ-CG 4.42Å; E311-R314 PolarHBondContact O-N 3Å; E311-R314 IonicContact OE1-NH1 3.32Å; E311-R314 PolarHBondContact OE1-NH1 2.99Å; E311-R314 VanDerWaalsContact OE1-NH1 3.09Å; E311-R314 WeakPolarHBondContact OE2-CD 3.35Å; E311-R314 IonicContact OE2-NH1 3.41Å; R314-G318 PolarHBondContact O-N 3.26Å
315	T	78.7	Confident	80.7	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-65.7	-43.9	178.6	-55.3	0	0	0	0	111.1	F209 W274 F304 V307 E311 E312 D313 W319	F209-T315 HydrophobicContact CZ-CG2 4.01Å; W274-T315 HydrophobicContact CH2-CG2 4.13Å; W274-T315 HydrophobicContact CZ3-CG2 3.91Å; F304-T315 HydrophobicContact CD1-CG2 4.09Å; F304-T315 HydrophobicContact CE1-CG2 4Å; V307-T315 HydrophobicContact CG1-CG2 4.35Å; V307-T315 HydrophobicContact CG2-CG2 4.44Å; E311-T315 VanDerWaalsContact O-CB 3.3Å; E311-T315 WeakPolarHBondContact O-CB 3.37Å; E311-T315 PolarHBondContact O-N 3.42Å; E311-T315 PolarHBondContact O-OG1 3.05Å; E312-T315 PolarHBondContact O-N 2.68Å; D313-T315 VanDerWaalsContact C-N 3.34Å; T315-W319 WeakPolarHBondContact O-CB 3.37Å; T315-W319 PolarHBondContact O-N 2.93Å
316	K	82.1	Confident	80.3	Confident	46 Å²	46	56 Å²	56	20%	0.2	28%	0.277	C	S	.	.	H	α-helix	trans	-60.3	-49.6	176.5	-71.8	171.6	-166.1	152.9	0	112.4	F209 L211 E312 D313 W319 K320	F209-K316 HydrophobicContact CD2-CD 4.48Å; F209-K316 HydrophobicContact CD2-CG 3.85Å; F209-K316 HydrophobicContact CE1-CG 4.47Å; F209-K316 HydrophobicContact CE2-CD 4.47Å; F209-K316 HydrophobicContact CE2-CG 3.42Å; F209-K316 VanDerWaalsContact CE2-CG 3.42Å; F209-K316 HydrophobicContact CZ-CG 3.78Å; L211-K316 HydrophobicContact CD2-CG 4.32Å; E312-K316 HydrophobicContact CG-CD 4.46Å; E312-K316 VanDerWaalsContact CG-CE 3.5Å; E312-K316 WeakPolarHBondContact O-CG 3.48Å; E312-K316 PolarHBondContact O-N 3.44Å; E312-K316 WeakPolarHBondContact OE1-CE 3.34Å; E312-K316 IonicContact OE1-NZ 2.81Å; E312-K316 PolarHBondContact OE1-NZ 2.96Å; D313-K316 PolarHBondContact O-N 3.21Å; D313-K316 IonicContact OD1-NZ 2.68Å; D313-K316 PolarHBondContact OD1-NZ 2.95Å; K316-W319 PolarHBondContact O-N 3.28Å; K316-K320 WeakPolarHBondContact O-CG 3.29Å; K316-K320 PolarHBondContact O-N 3.19Å
317	E	76.9	Confident	80.5	Confident	109 Å²	109	55.1 Å²	55.1	51%	0.509	27%	0.269	S	S	.	.	H	α-helix	trans	-69.1	-40.5	-177.6	-169	64.6	-173.4	0	0	111.1	D313 W319 K320 R321	D313-E317 WeakPolarHBondContact O-CB 3.45Å; D313-E317 PolarHBondContact O-N 3.29Å; E317-W319 VanDerWaalsContact C-N 3.34Å; E317-W319 PolarHBondContact O-N 3.14Å; E317-K320 PolarHBondContact O-N 3.49Å; E317-R321 WeakPolarHBondContact O-CB 3.11Å; E317-R321 PolarHBondContact O-N 3.02Å
318	G	80.1	Confident	80.6	Confident	16 Å²	16	57.2 Å²	57.2	17%	0.165	28%	0.278	C	S	.	.	H	α-helix	trans	-58.7	-43.5	173.8	0	0	0	0	0	112.7	R314 H322	R314-G318 PolarHBondContact O-N 3.26Å; G318-H322 WeakPolarHBondContact O-CB 3.02Å; G318-H322 PolarHBondContact O-CD2 3.08Å; G318-H322 PolarHBondContact O-N 3.39Å
319	W	88.1	Confident	80.8	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-66.8	-41.2	176.4	-92.4	75.2	0	0	0	113.3	L211 F226 M272 W274 I287 L289 V302 F304 T315 K316 E317 Y323 F324	L211-W319 HydrophobicContact CD1-CB 3.99Å; F226-W319 HydrophobicContact CE1-CZ3 4.23Å; M272-W319 HydrophobicContact SD-CH2 4.46Å; W274-W319 AromaticContact CD1-CZ2 3.83Å; W274-W319 AromaticContact CD2-NE1 3.96Å; W274-W319 AromaticContact CE2-NE1 3.34Å; W274-W319 VanDerWaalsContact CE2-NE1 3.34Å; W274-W319 HydrophobicContact CG-CZ2 4.45Å; W274-W319 AromaticContact CH2-NE1 3.9Å; W274-W319 AromaticContact CZ2-CD1 3.93Å; W274-W319 AromaticContact CZ2-NE1 3.32Å; W274-W319 VanDerWaalsContact CZ2-NE1 3.32Å; W274-W319 AromaticContact NE1-CE2 3.9Å; W274-W319 AromaticContact NE1-CZ2 3.65Å; W274-W319 AromaticContact NE1-NE1 3.62Å; I287-W319 HydrophobicContact CD1-CH2 4.39Å; I287-W319 HydrophobicContact CD1-CZ2 3.45Å; I287-W319 VanDerWaalsContact CD1-CZ2 3.45Å; I287-W319 HydrophobicContact CG2-CH2 4.09Å; I287-W319 HydrophobicContact CG2-CZ2 4.12Å; L289-W319 HydrophobicContact CD1-CH2 4.17Å; L289-W319 HydrophobicContact CD2-CZ3 4.41Å; V302-W319 HydrophobicContact CG1-CE3 4.14Å; V302-W319 HydrophobicContact CG1-CH2 4.42Å; V302-W319 HydrophobicContact CG1-CZ3 3.93Å; V302-W319 HydrophobicContact CG2-CZ3 4.37Å; F304-W319 AromaticContact CE1-CD1 3.63Å; F304-W319 AromaticContact CE1-CD2 3.8Å; F304-W319 HydrophobicContact CE1-CD2 3.8Å; F304-W319 AromaticContact CE1-CE2 3.79Å; F304-W319 AromaticContact CE1-CG 3.72Å; F304-W319 HydrophobicContact CE1-CG 3.72Å; F304-W319 AromaticContact CE1-NE1 3.65Å; F304-W319 HydrophobicContact CZ-CB 4.1Å; F304-W319 AromaticContact CZ-CD2 3.65Å; F304-W319 HydrophobicContact CZ-CD2 3.65Å; F304-W319 HydrophobicContact CZ-CE3 4.06Å; F304-W319 AromaticContact CZ-CG 3.62Å; F304-W319 HydrophobicContact CZ-CG 3.62Å; T315-W319 WeakPolarHBondContact O-CB 3.37Å; T315-W319 PolarHBondContact O-N 2.93Å; K316-W319 PolarHBondContact O-N 3.28Å; E317-W319 VanDerWaalsContact C-N 3.34Å; E317-W319 PolarHBondContact O-N 3.14Å; W319-Y323 HydrophobicContact CD2-CD2 4.01Å; W319-Y323 HydrophobicContact CD2-CE2 4.19Å; W319-Y323 HydrophobicContact CD2-CG 4.34Å; W319-Y323 HydrophobicContact CE3-CD1 4.44Å; W319-Y323 HydrophobicContact CE3-CD2 4.2Å; W319-Y323 HydrophobicContact CE3-CG 4.06Å; W319-Y323 HydrophobicContact CG-CD2 4.24Å; W319-Y323 HydrophobicContact CG-CE2 4.44Å; W319-Y323 HydrophobicContact CH2-CD1 4.25Å; W319-Y323 HydrophobicContact CH2-CE1 4.11Å; W319-Y323 HydrophobicContact CZ2-CE1 4.2Å; W319-Y323 HydrophobicContact CZ2-CE2 4.36Å; W319-Y323 HydrophobicContact CZ3-CD1 4.15Å; W319-Y323 HydrophobicContact CZ3-CE1 4.47Å; W319-Y323 HydrophobicContact CZ3-CG 4.23Å; W319-Y323 WeakPolarHBondContact O-CB 3.47Å; W319-Y323 PolarHBondContact O-N 2.94Å; W319-F324 AromaticContact CE3-CE1 3.95Å; W319-F324 HydrophobicContact CE3-CE1 3.95Å; W319-F324 HydrophobicContact CE3-CZ 4.24Å; W319-F324 HydrophobicContact CZ3-CE1 4.44Å; W319-F324 PolarHBondContact O-N 3.35Å; W319-F324 VanDerWaalsContact O-N 3.11Å
320	K	83.1	Confident	81.3	Confident	90 Å²	90	63.3 Å²	63.3	39%	0.391	30%	0.304	S	S	.	.	I	π-helix	trans	-60.6	-53.4	173.9	-72.8	174.4	-179.6	178.5	0	111.7	K316 E317 F324 E325	K316-K320 WeakPolarHBondContact O-CG 3.29Å; K316-K320 PolarHBondContact O-N 3.19Å; E317-K320 PolarHBondContact O-N 3.49Å; K320-F324 HydrophobicContact CG-CD2 4.28Å; K320-F324 WeakPolarHBondContact O-CB 3.36Å; K320-F324 PolarHBondContact O-N 3.17Å; K320-E325 PolarHBondContact O-N 3.37Å
321	R	77.8	Confident	81.8	Confident	148 Å²	148	59.1 Å²	59.1	56%	0.558	27%	0.274	S	S	*	.	I	π-helix	trans	-74.4	-49	-171.6	-172.5	175.4	174.1	-162.6	-8.2	113	E317 A326	E317-R321 WeakPolarHBondContact O-CB 3.11Å; E317-R321 PolarHBondContact O-N 3.02Å; R321-A326 PolarHBondContact O-N 3.14Å
322	H	79.4	Confident	82.3	Confident	72 Å²	72	59.2 Å²	59.2	33%	0.333	28%	0.284	S	S	.	.	I	π-helix	trans	-90.5	-13.6	-171.3	-62	-84	0	0	0	114.4	F235 L253 G318 A326	F235-H322 VanDerWaalsContact CD2-O 3.31Å; F235-H322 WeakPolarHBondContact CD2-O 3.36Å; F235-H322 WeakPolarHBondContact CE2-O 3.38Å; L253-H322 HydrophobicContact CD1-CB 4.28Å; G318-H322 WeakPolarHBondContact O-CB 3.02Å; G318-H322 PolarHBondContact O-CD2 3.08Å; G318-H322 PolarHBondContact O-N 3.39Å; H322-A326 WeakPolarHBondContact O-CB 3.27Å
323	Y	87.1	Confident	82.6	Confident	10 Å²	10	58.1 Å²	58.1	4%	0.039	28%	0.279	C	S	.	.	I	π-helix	trans	-113	-62.8	171.5	-60.6	-107.4	0	0	0	110.1	F226 F235 L252 W274 W319 I327	F226-Y323 HydrophobicContact CD1-CD1 4.33Å; F226-Y323 AromaticContact CE1-CD1 3.78Å; F226-Y323 HydrophobicContact CE1-CD1 3.78Å; F235-Y323 HydrophobicContact CE2-CD1 4.19Å; F235-Y323 HydrophobicContact CE2-CG 4.47Å; F235-Y323 HydrophobicContact CZ-CD1 4.06Å; L252-Y323 HydrophobicContact CD1-CE1 4.12Å; L252-Y323 WeakPolarHBondContact CD1-OH 3.47Å; W274-Y323 AromaticContact NE1-CZ 3.89Å; W274-Y323 PolarHBondContact NE1-OH 3.29Å; W319-Y323 HydrophobicContact CD2-CD2 4.01Å; W319-Y323 HydrophobicContact CD2-CE2 4.19Å; W319-Y323 HydrophobicContact CD2-CG 4.34Å; W319-Y323 HydrophobicContact CE3-CD1 4.44Å; W319-Y323 HydrophobicContact CE3-CD2 4.2Å; W319-Y323 HydrophobicContact CE3-CG 4.06Å; W319-Y323 HydrophobicContact CG-CD2 4.24Å; W319-Y323 HydrophobicContact CG-CE2 4.44Å; W319-Y323 HydrophobicContact CH2-CD1 4.25Å; W319-Y323 HydrophobicContact CH2-CE1 4.11Å; W319-Y323 HydrophobicContact CZ2-CE1 4.2Å; W319-Y323 HydrophobicContact CZ2-CE2 4.36Å; W319-Y323 HydrophobicContact CZ3-CD1 4.15Å; W319-Y323 HydrophobicContact CZ3-CE1 4.47Å; W319-Y323 HydrophobicContact CZ3-CG 4.23Å; W319-Y323 WeakPolarHBondContact O-CB 3.47Å; W319-Y323 PolarHBondContact O-N 2.94Å; Y323-I327 WeakPolarHBondContact O-CB 3.46Å; Y323-I327 WeakPolarHBondContact O-CD1 3.3Å; Y323-I327 WeakPolarHBondContact O-CG1 3.45Å; Y323-I327 PolarHBondContact O-N 2.79Å
324	F	88.3	Confident	82.2	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.018	27%	0.27	C	S	.	.	I	π-helix	trans	-69.1	-53.5	-168.7	-55.2	-18.6	0	0	0	113.7	L211 E213 F215 L300 V302 W319 K320 K328	L211-F324 HydrophobicContact CB-CE2 3.93Å; L211-F324 HydrophobicContact CB-CZ 4.13Å; L211-F324 HydrophobicContact CD1-CE2 3.95Å; L211-F324 HydrophobicContact CD1-CZ 4.28Å; E213-F324 HydrophobicContact CB-CD2 3.83Å; E213-F324 HydrophobicContact CB-CE2 4.01Å; E213-F324 HydrophobicContact CB-CG 4.21Å; E213-F324 HydrophobicContact CG-CB 4.08Å; E213-F324 HydrophobicContact CG-CD2 3.93Å; E213-F324 HydrophobicContact CG-CG 4.04Å; F215-F324 HydrophobicContact CE2-CD1 4.47Å; F215-F324 HydrophobicContact CZ-CB 4.05Å; F215-F324 AromaticContact CZ-CD1 3.88Å; F215-F324 HydrophobicContact CZ-CD1 3.88Å; F215-F324 HydrophobicContact CZ-CG 4.17Å; L300-F324 HydrophobicContact CD2-CD1 4.38Å; L300-F324 HydrophobicContact CD2-CE1 3.9Å; V302-F324 HydrophobicContact CB-CZ 4.42Å; V302-F324 HydrophobicContact CG2-CE1 3.89Å; V302-F324 HydrophobicContact CG2-CZ 3.7Å; W319-F324 AromaticContact CE3-CE1 3.95Å; W319-F324 HydrophobicContact CE3-CE1 3.95Å; W319-F324 HydrophobicContact CE3-CZ 4.24Å; W319-F324 HydrophobicContact CZ3-CE1 4.44Å; W319-F324 PolarHBondContact O-N 3.35Å; W319-F324 VanDerWaalsContact O-N 3.11Å; K320-F324 HydrophobicContact CG-CD2 4.28Å; K320-F324 WeakPolarHBondContact O-CB 3.36Å; K320-F324 PolarHBondContact O-N 3.17Å; F324-K328 VanDerWaalsContact O-CB 3.28Å; F324-K328 WeakPolarHBondContact O-CB 3.38Å; F324-K328 WeakPolarHBondContact O-CG 3.14Å; F324-K328 PolarHBondContact O-N 2.65Å
325	E	83.4	Confident	81.4	Confident	114 Å²	114	51.7 Å²	51.7	53%	0.533	27%	0.272	S	S	.	.	I	π-helix	trans	-64.8	-43.6	178.1	-68.3	-178.8	165.2	0	0	110.9	K320 K328 Q329	K320-E325 PolarHBondContact O-N 3.37Å; E325-K328 PolarHBondContact O-N 3.45Å; E325-Q329 VanDerWaalsContact O-CB 3.27Å; E325-Q329 WeakPolarHBondContact O-CB 3.43Å; E325-Q329 PolarHBondContact O-N 3.21Å
326	A	82.9	Confident	80.3	Confident	13 Å²	13	58.8 Å²	58.8	11%	0.107	30%	0.299	C	S	.	.	H	α-helix	trans	-58.5	-52.6	176.4	0	0	0	0	0	113.1	F235 R321 H322 K328 Q329 T330	F235-A326 HydrophobicContact CB-CB 4.2Å; F235-A326 HydrophobicContact CD2-CB 3.83Å; F235-A326 HydrophobicContact CG-CB 4.46Å; F235-A326 WeakPolarHBondContact O-CB 3.15Å; R321-A326 PolarHBondContact O-N 3.14Å; H322-A326 WeakPolarHBondContact O-CB 3.27Å; A326-K328 VanDerWaalsContact C-N 3.32Å; A326-K328 PolarHBondContact O-N 3.25Å; A326-Q329 PolarHBondContact O-N 3.04Å; A326-T330 WeakPolarHBondContact O-CB 3.43Å; A326-T330 PolarHBondContact O-N 3.17Å; A326-T330 PolarHBondContact O-OG1 2.94Å
327	I	88.4	Confident	78.5	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-60.7	-42.3	177.1	-71.4	167.4	0	0	0	110.5	F215 L222 F226 F235 Y323 Q329 F331 F333	F215-I327 HydrophobicContact CD1-CG2 3.99Å; F215-I327 HydrophobicContact CE1-CB 4.1Å; F215-I327 HydrophobicContact CE1-CG2 3.73Å; L222-I327 HydrophobicContact CD1-CG2 4.09Å; F226-I327 HydrophobicContact CE1-CD1 4.15Å; F226-I327 HydrophobicContact CE2-CD1 4.04Å; F226-I327 HydrophobicContact CZ-CD1 3.7Å; F235-I327 HydrophobicContact CB-CG1 4.17Å; F235-I327 HydrophobicContact CD1-CD1 4.24Å; F235-I327 HydrophobicContact CD1-CG1 3.62Å; F235-I327 HydrophobicContact CD2-CG1 4Å; F235-I327 HydrophobicContact CE1-CD1 3.98Å; F235-I327 HydrophobicContact CE1-CG1 3.88Å; F235-I327 HydrophobicContact CE2-CD1 4.46Å; F235-I327 HydrophobicContact CE2-CG1 4.28Å; F235-I327 HydrophobicContact CG-CG1 3.68Å; F235-I327 HydrophobicContact CZ-CD1 4.12Å; F235-I327 HydrophobicContact CZ-CG1 4.23Å; Y323-I327 WeakPolarHBondContact O-CB 3.46Å; Y323-I327 WeakPolarHBondContact O-CD1 3.3Å; Y323-I327 WeakPolarHBondContact O-CG1 3.45Å; Y323-I327 PolarHBondContact O-N 2.79Å; I327-Q329 VanDerWaalsContact C-N 3.34Å; I327-Q329 PolarHBondContact O-N 3.06Å; I327-F331 HydrophobicContact CB-CD2 4.45Å; I327-F331 HydrophobicContact CG2-CD2 4.09Å; I327-F331 WeakPolarHBondContact O-CD2 3.32Å; I327-F331 PolarHBondContact O-N 2.9Å; I327-F331 VanDerWaalsContact O-N 3.12Å; I327-F333 HydrophobicContact CG2-CD2 3.59Å; I327-F333 HydrophobicContact CG2-CE2 4.06Å
328	K	87.4	Confident	76.9	Confident	44 Å²	44	72 Å²	72	19%	0.191	36%	0.357	C	S	.	.	H	α-helix	trans	-62.9	-36.7	176.3	-78.3	179	179	-169.7	0	113.4	E213 T214 F215 F324 E325 A326 G332 F333 G334	E213-K328 IonicContact OE1-NZ 3.6Å; E213-K328 PolarHBondContact OE1-NZ 3.04Å; E213-K328 IonicContact OE2-NZ 3.86Å; E213-K328 PolarHBondContact OE2-NZ 3.2Å; T214-K328 WeakPolarHBondContact O-CE 3.08Å; T214-K328 PolarHBondContact O-NZ 2.68Å; T214-K328 VanDerWaalsContact O-NZ 3.1Å; F215-K328 HydrophobicContact CD1-CG 3.77Å; F215-K328 HydrophobicContact CE1-CD 4.43Å; F215-K328 HydrophobicContact CE1-CG 3.73Å; F324-K328 VanDerWaalsContact O-CB 3.28Å; F324-K328 WeakPolarHBondContact O-CB 3.38Å; F324-K328 WeakPolarHBondContact O-CG 3.14Å; F324-K328 PolarHBondContact O-N 2.65Å; E325-K328 PolarHBondContact O-N 3.45Å; A326-K328 VanDerWaalsContact C-N 3.32Å; A326-K328 PolarHBondContact O-N 3.25Å; K328-G332 CarbonylContact O-C 3.6Å; K328-G332 VanDerWaalsContact O-C 3.27Å; K328-G332 VanDerWaalsContact O-CA 3.27Å; K328-G332 WeakPolarHBondContact O-CA 3.41Å; K328-G332 PolarHBondContact O-N 2.83Å; K328-F333 PolarHBondContact O-N 3.31Å; K328-G334 PolarHBondContact O-N 2.8Å
329	Q	83.2	Confident	76.7	Confident	160 Å²	160	74.8 Å²	74.8	75%	0.748	37%	0.366	S	S	*	.	H	α-helix	trans	-79.8	-47.2	-178.9	-177.5	173.8	-14.3	0	0	111.8	E325 A326 I327	E325-Q329 VanDerWaalsContact O-CB 3.27Å; E325-Q329 WeakPolarHBondContact O-CB 3.43Å; E325-Q329 PolarHBondContact O-N 3.21Å; A326-Q329 PolarHBondContact O-N 3.04Å; I327-Q329 VanDerWaalsContact C-N 3.34Å; I327-Q329 PolarHBondContact O-N 3.06Å
330	T	84.3	Confident	76.1	Confident	47 Å²	47	78.7 Å²	78.7	29%	0.288	39%	0.385	S	S	.	.	H	α-helix	trans	-70.8	-42.2	-175.7	-65.5	0	0	0	0	112.6	A234 F235 A326	A234-T330 HydrophobicContact CB-CG2 4.03Å; A234-T330 WeakPolarHBondContact O-CG2 3.15Å; F235-T330 HydrophobicContact CB-CG2 4.34Å; A326-T330 WeakPolarHBondContact O-CB 3.43Å; A326-T330 PolarHBondContact O-N 3.17Å; A326-T330 PolarHBondContact O-OG1 2.94Å
331	F	84.1	Confident	75.7	Confident	53 Å²	53	78.1 Å²	78.1	23%	0.232	39%	0.385	C	S	.	.	S	Bend	trans	-101.3	3.5	-178.3	-53.7	-67.8	0	0	0	113.6	T225 M231 A234 F235 I327 F333	T225-F331 HydrophobicContact CG2-CD2 3.78Å; T225-F331 HydrophobicContact CG2-CE2 3.65Å; T225-F331 HydrophobicContact CG2-CG 4.42Å; T225-F331 HydrophobicContact CG2-CZ 4.22Å; M231-F331 HydrophobicContact CB-CZ 3.97Å; M231-F331 HydrophobicContact CG-CZ 4.46Å; M231-F331 WeakPolarHBondContact O-CZ 3.31Å; M231-F331 HydrophobicContact SD-CD1 4.25Å; M231-F331 HydrophobicContact SD-CE1 3.38Å; M231-F331 WeakPolarHBondContact SD-CE1 3.28Å; M231-F331 HydrophobicContact SD-CZ 3.69Å; A234-F331 HydrophobicContact CB-CE1 4.39Å; A234-F331 HydrophobicContact CB-CZ 4.15Å; F235-F331 HydrophobicContact CB-CE2 3.95Å; F235-F331 HydrophobicContact CD1-CE2 4.05Å; F235-F331 HydrophobicContact CG-CE2 4.48Å; I327-F331 HydrophobicContact CB-CD2 4.45Å; I327-F331 HydrophobicContact CG2-CD2 4.09Å; I327-F331 WeakPolarHBondContact O-CD2 3.32Å; I327-F331 PolarHBondContact O-N 2.9Å; I327-F331 VanDerWaalsContact O-N 3.12Å; F331-F333 HydrophobicContact CB-CD1 3.75Å; F331-F333 HydrophobicContact CB-CD2 4.03Å; F331-F333 HydrophobicContact CB-CE1 3.51Å; F331-F333 HydrophobicContact CB-CE2 3.82Å; F331-F333 HydrophobicContact CB-CG 4Å; F331-F333 HydrophobicContact CB-CZ 3.55Å; F331-F333 HydrophobicContact CD2-CE2 4.29Å; F331-F333 HydrophobicContact CG-CE2 4.28Å; F331-F333 HydrophobicContact CG-CZ 4.16Å; F331-F333 VanDerWaalsContact O-CD1 3.25Å; F331-F333 WeakPolarHBondContact O-CD1 2.97Å; F331-F333 PolarHBondContact O-N 3Å
332	G	82.2	Confident	75.6	Confident	36 Å²	36	73.9 Å²	73.9	37%	0.371	38%	0.375	S	S	.	.			trans	73.2	3.4	-179.2	0	0	0	0	0	115	K328 G334 A335	K328-G332 CarbonylContact O-C 3.6Å; K328-G332 VanDerWaalsContact O-C 3.27Å; K328-G332 VanDerWaalsContact O-CA 3.27Å; K328-G332 WeakPolarHBondContact O-CA 3.41Å; K328-G332 PolarHBondContact O-N 2.83Å; G332-G334 PolarHBondContact O-N 2.81Å; G332-A335 PolarHBondContact O-N 2.86Å
333	F	83.9	Confident	75.4	Confident	20 Å²	20	74.1 Å²	74.1	9%	0.088	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	0.4	-176.4	-56.6	-15	0	0	0	114.6	F215 L216 T217 E221 L222 T225 I327 K328 F331	F215-F333 HydrophobicContact CB-CB 4.21Å; F215-F333 HydrophobicContact CD1-CB 4.01Å; F215-F333 HydrophobicContact CD1-CD2 4.32Å; L216-F333 WeakPolarHBondContact CB-O 3.41Å; L216-F333 PolarHBondContact N-O 3.38Å; T217-F333 HydrophobicContact CG2-CB 4.47Å; T217-F333 HydrophobicContact CG2-CD1 4.17Å; T217-F333 HydrophobicContact CG2-CD2 3.61Å; T217-F333 HydrophobicContact CG2-CE1 4.29Å; T217-F333 HydrophobicContact CG2-CE2 3.75Å; T217-F333 HydrophobicContact CG2-CG 3.85Å; T217-F333 HydrophobicContact CG2-CZ 4.1Å; T217-F333 WeakPolarHBondContact OG1-CE1 3.49Å; T217-F333 WeakPolarHBondContact OG1-CZ 3.33Å; E221-F333 HydrophobicContact CB-CZ 4.39Å; L222-F333 HydrophobicContact CD1-CD2 4.35Å; L222-F333 HydrophobicContact CD1-CE2 4.47Å; T225-F333 HydrophobicContact CG2-CE2 3.82Å; T225-F333 HydrophobicContact CG2-CZ 4.36Å; I327-F333 HydrophobicContact CG2-CD2 3.59Å; I327-F333 HydrophobicContact CG2-CE2 4.06Å; K328-F333 PolarHBondContact O-N 3.31Å; F331-F333 HydrophobicContact CB-CD1 3.75Å; F331-F333 HydrophobicContact CB-CD2 4.03Å; F331-F333 HydrophobicContact CB-CE1 3.51Å; F331-F333 HydrophobicContact CB-CE2 3.82Å; F331-F333 HydrophobicContact CB-CG 4Å; F331-F333 HydrophobicContact CB-CZ 3.55Å; F331-F333 HydrophobicContact CD2-CE2 4.29Å; F331-F333 HydrophobicContact CG-CE2 4.28Å; F331-F333 HydrophobicContact CG-CZ 4.16Å; F331-F333 VanDerWaalsContact O-CD1 3.25Å; F331-F333 WeakPolarHBondContact O-CD1 2.97Å; F331-F333 PolarHBondContact O-N 3Å
334	G	69.9	Low	74.6	Confident	42 Å²	42	78.3 Å²	78.3	43%	0.433	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-9.7	171.4	0	0	0	0	0	115.4	K328 G332	K328-G334 PolarHBondContact O-N 2.8Å; G332-G334 PolarHBondContact O-N 2.81Å
335	A	59.2	Low	73.6	Confident	62 Å²	62	83.6 Å²	83.6	51%	0.512	43%	0.427	S	S	.	.			trans	-101.6	110.9	-168.7	0	0	0	0	0	112.7	L216 G332 L337	L216-A335 WeakPolarHBondContact CD1-O 3.38Å; G332-A335 PolarHBondContact O-N 2.86Å; A335-L337 PolarHBondContact O-N 2.72Å
336	R	54.2	Low	72.8	Confident	148 Å²	148	81.3 Å²	81.3	56%	0.558	42%	0.419	S	S	*	.			trans	-77.7	101.8	157.8	-68.7	-171.3	-179.5	170.3	1.6	107.9	L216 E297 Y338	L216-R336 HydrophobicContact CD1-CB 4.45Å; L216-R336 HydrophobicContact CD1-CG 3.61Å; L216-R336 HydrophobicContact CD2-CG 4.47Å; E297-R336 IonicContact OE1-CZ 3.09Å; E297-R336 IonicContact OE1-NE 2.66Å; E297-R336 IonicContact OE1-NH2 2.64Å; E297-R336 PolarHBondContact OE1-NH2 3.34Å; R336-Y338 HydrophobicContact CB-CD2 3.94Å; R336-Y338 HydrophobicContact CB-CE2 3.6Å; R336-Y338 HydrophobicContact CG-CE2 4.48Å; R336-Y338 WeakPolarHBondContact O-CD2 3.27Å; R336-Y338 PolarHBondContact O-N 3.29Å
337	L	45.5	Very low	72	Confident	172 Å²	172	87 Å²	87	90%	0.901	45%	0.445	S	S	*	.			trans	-64.8	116.4	165.8	-69.7	167.3	0	0	0	107.9	A335	A335-L337 PolarHBondContact O-N 2.72Å
338	Y	42	Very low	70.5	Confident	260 Å²	260	94.9 Å²	94.9	100%	1.02	49%	0.486	S	S	*	.			trans	-111.3	0	176.3	-83.4	-76.3	0	0	0	110	R336	R336-Y338 HydrophobicContact CB-CD2 3.94Å; R336-Y338 HydrophobicContact CB-CE2 3.6Å; R336-Y338 HydrophobicContact CG-CE2 4.48Å; R336-Y338 WeakPolarHBondContact O-CD2 3.27Å; R336-Y338 PolarHBondContact O-N 3.29Å

Retrieved 338 of 338 residues in 71.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).