A0A096NS96_PAPAN 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 A0A096NS96, Species PAPAN (Papio anubis, Olive baboon), Gene AHSA1, Length 338 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45	Very low	45.9	Very low	243 Å²	243	147.2 Å²	147.2	100%	1.197	76%	0.758	S	S	*	*				0	126	0	-71.7	-172.6	-106.8	0	0	107.1
2	A	42.4	Very low	45.8	Very low	84 Å²	84	146 Å²	146	69%	0.694	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-64.5	149.2	173.9	0	0	0	0	0	109.8
3	K	43.8	Very low	45.9	Very low	166 Å²	166	144.7 Å²	144.7	72%	0.722	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-70.8	139.6	-179.9	-73.3	-179.7	178.7	174.9	0	109.8	G5 E6	K3-G5 PolarHBondContact O-N 2.79Å; K3-E6 PolarHBondContact O-N 2.85Å
4	W	35.8	Very low	45.8	Very low	264 Å²	264	146.9 Å²	146.9	100%	1	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	120.1	176.1	-174.9	-92.8	0	0	0	110.5
5	G	54.7	Low	45.7	Very low	76 Å²	76	150.3 Å²	150.3	78%	0.784	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	101.8	-5.5	178.8	0	0	0	0	0	116.1	K3	K3-G5 PolarHBondContact O-N 2.79Å
6	E	51.2	Low	45.7	Very low	143 Å²	143	152.4 Å²	152.4	67%	0.668	77%	0.765	S	S	*	*			trans	-110.4	95.6	168.8	-73.9	-178.8	160.7	0	0	108.5	K3 D8	K3-E6 PolarHBondContact O-N 2.85Å; E6-D8 PolarHBondContact O-N 3.35Å
7	G	46.1	Very low	45.4	Very low	75 Å²	75	150.5 Å²	150.5	77%	0.773	78%	0.778	S	S	*	*			trans	-62.6	123.6	173.1	0	0	0	0	0	110.3
8	D	45.8	Very low	45.8	Very low	55 Å²	55	147.1 Å²	147.1	29%	0.294	76%	0.762	S	S	.	*			trans	-64.4	126.2	170.7	-173.6	-29.7	0	0	0	107.7	E6 R10 W11	E6-D8 PolarHBondContact O-N 3.35Å; D8-R10 PolarHBondContact O-N 3.04Å; D8-R10 VanDerWaalsContact OD1-CB 3.22Å; D8-R10 WeakPolarHBondContact OD1-CB 3.43Å; D8-R10 WeakPolarHBondContact OD1-CG 3.45Å; D8-R10 PolarHBondContact OD1-N 3.34Å; D8-R10 IonicContact OD2-NH1 3.11Å; D8-R10 PolarHBondContact OD2-NH1 3.22Å; D8-W11 HydrophobicContact CB-CB 4.43Å; D8-W11 WeakPolarHBondContact O-CA 3.29Å; D8-W11 WeakPolarHBondContact O-CB 3.47Å; D8-W11 PolarHBondContact O-N 3.46Å
9	P	49.1	Very low	45.7	Very low	99 Å²	99	144.7 Å²	144.7	64%	0.643	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-59.4	-13.1	176.7	19.8	-29.6	0	0	0	113.9	W11	P9-W11 PolarHBondContact O-N 3.08Å
10	R	46.4	Very low	45.7	Very low	202 Å²	202	141.7 Å²	141.7	76%	0.762	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-74.5	-11.1	168.9	-60.3	171.7	-173.5	134.3	-3.6	113.7	D8	D8-R10 PolarHBondContact O-N 3.04Å; D8-R10 VanDerWaalsContact OD1-CB 3.22Å; D8-R10 WeakPolarHBondContact OD1-CB 3.43Å; D8-R10 WeakPolarHBondContact OD1-CG 3.45Å; D8-R10 PolarHBondContact OD1-N 3.34Å; D8-R10 IonicContact OD2-NH1 3.11Å; D8-R10 PolarHBondContact OD2-NH1 3.22Å
11	W	44.9	Very low	45.7	Very low	212 Å²	212	137.8 Å²	137.8	80%	0.803	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-120.1	43.5	-173.2	-81.3	36.7	0	0	0	111.6	D8 P9 V13	D8-W11 HydrophobicContact CB-CB 4.43Å; D8-W11 WeakPolarHBondContact O-CA 3.29Å; D8-W11 WeakPolarHBondContact O-CB 3.47Å; D8-W11 PolarHBondContact O-N 3.46Å; P9-W11 PolarHBondContact O-N 3.08Å; W11-V13 PolarHBondContact O-N 3.12Å
12	I	43.8	Very low	45.7	Very low	133 Å²	133	129.9 Å²	129.9	68%	0.682	70%	0.698	S	S	*	*			trans	-75.8	77.8	163.5	-56.9	174.1	0	0	0	107.9
13	V	47.3	Very low	45.8	Very low	129 Å²	129	131.1 Å²	131.1	78%	0.782	69%	0.693	S	S	*	*			trans	-127.5	54.2	158.7	-168.9	0	0	0	0	106.1	W11 E15	W11-V13 PolarHBondContact O-N 3.12Å; V13-E15 PolarHBondContact O-N 3.09Å
14	E	44.3	Very low	46	Very low	176 Å²	176	125.9 Å²	125.9	82%	0.822	67%	0.673	S	S	*	*			trans	-79.5	112.2	157.3	-90.1	-174.9	156.3	0	0	106.8	R16	E14-R16 PolarHBondContact O-N 3.29Å
15	E	45	Very low	46.4	Very low	198 Å²	198	121 Å²	121	93%	0.925	65%	0.654	S	S	*	*			trans	-17.5	104.2	176.5	-65.5	177.8	148.7	0	0	114.3	V13	V13-E15 PolarHBondContact O-N 3.09Å
16	R	45	Very low	46.3	Very low	184 Å²	184	124.3 Å²	124.3	69%	0.694	65%	0.649	S	S	*	*			trans	-109.4	128.8	161.9	-63.2	-168	177.1	-167.4	0	109.4	E14 D18	E14-R16 PolarHBondContact O-N 3.29Å; R16-D18 WeakPolarHBondContact CB-OD1 3.42Å; R16-D18 PolarHBondContact O-N 3.46Å; R16-D18 VanDerWaalsContact O-N 3.15Å
17	A	41.9	Very low	46.3	Very low	119 Å²	119	124.2 Å²	124.2	98%	0.983	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	0.3	-177.4	0	0	0	0	0	114.2
18	D	51.3	Low	47.2	Very low	90 Å²	90	121.9 Å²	121.9	48%	0.481	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.3	-4.5	-169.9	68.1	-20.9	0	0	0	114.5	R16 T20	R16-D18 WeakPolarHBondContact CB-OD1 3.42Å; R16-D18 PolarHBondContact O-N 3.46Å; R16-D18 VanDerWaalsContact O-N 3.15Å; D18-T20 PolarHBondContact O-N 3.18Å; D18-T20 VanDerWaalsContact O-N 3.09Å; D18-T20 PolarHBondContact OD2-OG1 3.37Å
19	A	44.9	Very low	48.8	Very low	101 Å²	101	124.5 Å²	124.5	84%	0.835	62%	0.624	S	S	*	*			trans	51.7	30.2	179.1	0	0	0	0	0	114.5
20	T	46.2	Very low	50.5	Low	84 Å²	84	125.3 Å²	125.3	52%	0.515	61%	0.614	S	S	.	*			trans	-75.7	130.8	-178.7	-57.5	0	0	0	0	110.9	D18 V22	D18-T20 PolarHBondContact O-N 3.18Å; D18-T20 VanDerWaalsContact O-N 3.09Å; D18-T20 PolarHBondContact OD2-OG1 3.37Å; T20-V22 VanDerWaalsContact C-N 3.31Å; T20-V22 WeakPolarHBondContact O-CG2 3.35Å; T20-V22 PolarHBondContact O-N 3Å
21	N	44.6	Very low	52.3	Low	61 Å²	61	120.4 Å²	120.4	33%	0.326	60%	0.603	S	S	.	*			trans	-71.3	82.6	176	-172.7	0.8	0	0	0	111	N23 N24 W25 H26 T28	N21-N23 PolarHBondContact O-N 3.05Å; N21-N24 WeakPolarHBondContact OD1-CA 3.5Å; N21-W25 PolarHBondContact OD1-N 2.98Å; N21-H26 PolarHBondContact ND2-O 2.97Å; N21-H26 PolarHBondContact OD1-N 2.89Å; N21-T28 WeakPolarHBondContact ND2-CG2 3.47Å
22	V	44.3	Very low	54.5	Low	77 Å²	77	110.3 Å²	110.3	47%	0.467	57%	0.565	S	S	.	*	G	3₁₀ helix	trans	-68.7	128.1	178.2	-159.4	0	0	0	0	109.1	T20 N24	T20-V22 VanDerWaalsContact C-N 3.31Å; T20-V22 WeakPolarHBondContact O-CG2 3.35Å; T20-V22 PolarHBondContact O-N 3Å; V22-N24 VanDerWaalsContact C-N 3.32Å; V22-N24 PolarHBondContact O-N 3.48Å
23	N	46.1	Very low	56.6	Low	109 Å²	109	104.9 Å²	104.9	58%	0.583	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	65.4	17.3	177.1	-55.4	-32	0	0	0	116.9	N21 W25 L165	N21-N23 PolarHBondContact O-N 3.05Å; N23-W25 PolarHBondContact O-N 2.89Å; N23-W25 VanDerWaalsContact O-N 3.08Å; N23-L165 HydrophobicContact CB-CD1 4.01Å
24	N	46.6	Very low	58.4	Low	56 Å²	56	104.6 Å²	104.6	30%	0.299	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	52.5	29.9	-174.9	-69.4	-13.4	0	0	0	112.6	N21 V22 H26 T28	N21-N24 WeakPolarHBondContact OD1-CA 3.5Å; V22-N24 VanDerWaalsContact C-N 3.32Å; V22-N24 PolarHBondContact O-N 3.48Å; N24-H26 CarbonylContact C-O 3.51Å; N24-T28 HydrophobicContact CB-CG2 3.8Å
25	W	45.6	Very low	60.7	Low	161 Å²	161	99.2 Å²	99.2	61%	0.61	51%	0.505	S	S	*	.			trans	-75	-28.7	-177.1	-178.8	-104.5	0	0	0	112	N21 N23	N21-W25 PolarHBondContact OD1-N 2.98Å; N23-W25 PolarHBondContact O-N 2.89Å; N23-W25 VanDerWaalsContact O-N 3.08Å
26	H	51.7	Low	62.9	Low	146 Å²	146	89.8 Å²	89.8	68%	0.676	46%	0.461	S	S	*	.	S	Bend	trans	-89.6	153.5	166.1	-134	73.9	0	0	0	110.4	N21 N24 T28	N21-H26 PolarHBondContact ND2-O 2.97Å; N21-H26 PolarHBondContact OD1-N 2.89Å; N24-H26 CarbonylContact C-O 3.51Å; H26-T28 PolarHBondContact O-N 3.16Å
27	W	51.5	Low	65.1	Low	141 Å²	141	82.2 Å²	82.2	53%	0.534	44%	0.435	S	S	.	.			trans	-28.7	115.7	-175.8	-177.4	-80.9	0	0	0	112.8	N71	W27-N71 VanDerWaalsContact CE2-OD1 3.31Å; W27-N71 HydrophobicContact CZ2-CB 4.5Å; W27-N71 WeakPolarHBondContact CZ2-OD1 3.39Å; W27-N71 PolarHBondContact NE1-OD1 3.28Å
28	T	64.4	Low	67.2	Low	27 Å²	27	81.3 Å²	81.3	17%	0.166	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	122.3	170.4	35.8	0	0	0	0	109.9	N21 N24 H26 N71 N72	N21-T28 WeakPolarHBondContact ND2-CG2 3.47Å; N24-T28 HydrophobicContact CB-CG2 3.8Å; H26-T28 PolarHBondContact O-N 3.16Å; T28-N71 CarbonylContact O-C 3.55Å; T28-N71 WeakPolarHBondContact O-CA 3.38Å; T28-N72 PolarHBondContact N-O 2.96Å; T28-N72 PolarHBondContact O-N 3.12Å
29	E	80.2	Confident	69.2	Low	110 Å²	110	79.1 Å²	79.1	51%	0.514	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	134.8	172.6	-172.9	162.1	-158.2	0	0	108.5	S69 N71	E29-S69 VanDerWaalsContact OE1-CB 3.32Å; E29-S69 WeakPolarHBondContact OE1-CB 3.38Å; E29-S69 PolarHBondContact OE1-OG 3.5Å; E29-N71 WeakPolarHBondContact CB-OD1 3.23Å; E29-N71 WeakPolarHBondContact CG-OD1 3.26Å
30	R	83.8	Confident	71.5	Confident	115 Å²	115	74.3 Å²	74.3	43%	0.434	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	125.8	166.6	-73.6	-163.5	168.5	176.7	-5.6	109.2	A32 S69 I70 F159 M163	R30-A32 PolarHBondContact O-N 2.86Å; R30-S69 WeakPolarHBondContact O-CA 3.49Å; R30-I70 PolarHBondContact N-O 2.87Å; R30-I70 PolarHBondContact O-N 2.86Å; R30-F159 HydrophobicContact CB-CE1 4.3Å; R30-M163 HydrophobicContact CB-CE 3.71Å; R30-M163 HydrophobicContact CB-SD 4.37Å; R30-M163 HydrophobicContact CG-CE 3.74Å; R30-M163 HydrophobicContact CG-SD 4.48Å
31	D	86.1	Confident	73.7	Confident	99 Å²	99	74.3 Å²	74.3	53%	0.529	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	122.6	167.8	177.1	22.6	0	0	0	109.7	S33 F159	D31-S33 WeakPolarHBondContact OD1-CB 3.36Å; D31-S33 PolarHBondContact OD1-N 3.34Å; D31-S33 PolarHBondContact OD1-OG 3.43Å; D31-F159 WeakPolarHBondContact O-CZ 3.46Å
32	A	90.9	Very high	76	Confident	1 Å²	1	76 Å²	76	1%	0.008	37%	0.366	C	S	.	.			trans	-109.9	6.9	177.7	0	0	0	0	0	112.2	R30 N34 W35 S36 A68 I70 L155 F159	R30-A32 PolarHBondContact O-N 2.86Å; A32-N34 PolarHBondContact O-N 2.88Å; A32-W35 PolarHBondContact O-N 2.89Å; A32-S36 WeakPolarHBondContact O-CB 3.41Å; A32-S36 PolarHBondContact O-N 3.3Å; A32-S36 PolarHBondContact O-OG 3.43Å; A32-A68 CarbonylContact C-O 3.58Å; A32-A68 WeakPolarHBondContact CA-O 3.14Å; A32-A68 HydrophobicContact CB-CB 4.05Å; A32-A68 PolarHBondContact N-O 2.93Å; A32-I70 HydrophobicContact CB-CD1 4.29Å; A32-I70 HydrophobicContact CB-CG1 4.27Å; A32-L155 HydrophobicContact CB-CD1 3.97Å; A32-F159 VanDerWaalsContact CA-CZ 3.43Å; A32-F159 HydrophobicContact CB-CD1 3.97Å; A32-F159 HydrophobicContact CB-CD2 4.3Å; A32-F159 HydrophobicContact CB-CE1 3.5Å; A32-F159 VanDerWaalsContact CB-CE1 3.5Å; A32-F159 HydrophobicContact CB-CE2 3.86Å; A32-F159 HydrophobicContact CB-CG 4.32Å; A32-F159 HydrophobicContact CB-CZ 3.43Å; A32-F159 VanDerWaalsContact CB-CZ 3.43Å
33	S	86.2	Confident	78.4	Confident	19 Å²	19	73.7 Å²	73.7	13%	0.133	35%	0.351	C	S	.	.	H	α-helix	trans	-63.1	-46.5	-171.3	-54.9	0	0	0	0	112.4	D31 S36 T37 E67 A68	D31-S33 WeakPolarHBondContact OD1-CB 3.36Å; D31-S33 PolarHBondContact OD1-N 3.34Å; D31-S33 PolarHBondContact OD1-OG 3.43Å; S33-S36 PolarHBondContact O-N 3.2Å; S33-T37 WeakPolarHBondContact O-CB 3.22Å; S33-T37 PolarHBondContact O-N 3.29Å; S33-T37 PolarHBondContact O-OG1 3.16Å; S33-E67 WeakPolarHBondContact OG-CA 3.47Å; S33-A68 PolarHBondContact N-O 2.86Å; S33-A68 PolarHBondContact OG-N 3.32Å; S33-A68 PolarHBondContact OG-O 3Å
34	N	86.5	Confident	80.7	Confident	123 Å²	123	68.5 Å²	68.5	66%	0.658	32%	0.323	S	S	*	.	H	α-helix	trans	-64.4	-47.3	178.8	-70.8	-31.9	0	0	0	112	A32 S36 T37 D38	A32-N34 PolarHBondContact O-N 2.88Å; N34-S36 VanDerWaalsContact C-N 3.31Å; N34-S36 PolarHBondContact O-N 3.11Å; N34-T37 WeakPolarHBondContact O-CB 3.44Å; N34-T37 PolarHBondContact O-N 3.16Å; N34-D38 PolarHBondContact O-N 2.88Å
35	W	91.3	Very high	82.9	Confident	63 Å²	63	69.9 Å²	69.9	24%	0.239	33%	0.33	C	S	.	.	H	α-helix	trans	-61.1	-42.8	177.5	177.9	92.7	0	0	0	111.5	A32 T37 D38 K39 Y151 T154 L155 E158 F159	A32-W35 PolarHBondContact O-N 2.89Å; W35-T37 VanDerWaalsContact C-N 3.35Å; W35-D38 PolarHBondContact O-N 3.43Å; W35-K39 HydrophobicContact CE3-CB 4.5Å; W35-K39 HydrophobicContact CH2-CB 4.24Å; W35-K39 HydrophobicContact CH2-CD 4.31Å; W35-K39 HydrophobicContact CH2-CG 3.93Å; W35-K39 HydrophobicContact CZ2-CB 4.42Å; W35-K39 HydrophobicContact CZ2-CD 4.09Å; W35-K39 HydrophobicContact CZ2-CG 4.17Å; W35-K39 HydrophobicContact CZ3-CB 4.3Å; W35-K39 HydrophobicContact CZ3-CG 4.4Å; W35-K39 WeakPolarHBondContact O-CB 3.44Å; W35-K39 PolarHBondContact O-N 2.99Å; W35-Y151 HydrophobicContact CE3-CE2 4.49Å; W35-Y151 HydrophobicContact CZ3-CD2 4.18Å; W35-Y151 AromaticContact CZ3-CE2 3.87Å; W35-Y151 HydrophobicContact CZ3-CE2 3.87Å; W35-T154 VanDerWaalsContact CH2-C 3.49Å; W35-L155 HydrophobicContact CE3-CD1 3.81Å; W35-L155 HydrophobicContact CH2-CB 4.27Å; W35-L155 HydrophobicContact CZ3-CB 3.85Å; W35-L155 HydrophobicContact CZ3-CD1 3.54Å; W35-L155 HydrophobicContact CZ3-CG 4.32Å; W35-E158 HydrophobicContact CZ2-CB 4.15Å; W35-F159 HydrophobicContact CB-CD2 3.59Å; W35-F159 HydrophobicContact CB-CE2 3.62Å; W35-F159 AromaticContact CD1-CD2 3.83Å; W35-F159 HydrophobicContact CD2-CB 3.98Å; W35-F159 AromaticContact CD2-CD2 3.54Å; W35-F159 HydrophobicContact CD2-CD2 3.54Å; W35-F159 HydrophobicContact CD2-CE2 4.46Å; W35-F159 HydrophobicContact CD2-CG 4.13Å; W35-F159 HydrophobicContact CE3-CB 4.04Å; W35-F159 AromaticContact CE3-CD2 3.96Å; W35-F159 HydrophobicContact CE3-CD2 3.96Å; W35-F159 HydrophobicContact CE3-CG 4.23Å; W35-F159 AromaticContact CG-CD2 3.35Å; W35-F159 HydrophobicContact CG-CD2 3.35Å; W35-F159 AromaticContact CG-CE2 3.93Å; W35-F159 HydrophobicContact CG-CE2 3.93Å; W35-F159 HydrophobicContact CG-CG 4.38Å; W35-F159 HydrophobicContact CH2-CB 4.29Å; W35-F159 HydrophobicContact CZ2-CB 4.17Å; W35-F159 HydrophobicContact CZ3-CB 4.21Å
36	S	92.4	Very high	85.2	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-64.3	-41.9	178.3	-64.7	0	0	0	0	111.6	A32 S33 N34 D38 K39 L40 A68 Y151	A32-S36 WeakPolarHBondContact O-CB 3.41Å; A32-S36 PolarHBondContact O-N 3.3Å; A32-S36 PolarHBondContact O-OG 3.43Å; S33-S36 PolarHBondContact O-N 3.2Å; N34-S36 VanDerWaalsContact C-N 3.31Å; N34-S36 PolarHBondContact O-N 3.11Å; S36-D38 PolarHBondContact O-N 3.14Å; S36-K39 PolarHBondContact O-N 3.14Å; S36-L40 VanDerWaalsContact O-CB 3.27Å; S36-L40 WeakPolarHBondContact O-CB 3.32Å; S36-L40 VanDerWaalsContact O-CG 3.31Å; S36-L40 WeakPolarHBondContact O-CG 3.46Å; S36-L40 PolarHBondContact O-N 2.84Å; S36-A68 WeakPolarHBondContact OG-CB 3.27Å; S36-Y151 WeakPolarHBondContact CB-OH 3.48Å; S36-Y151 WeakPolarHBondContact OG-CE2 3.33Å; S36-Y151 PolarHBondContact OG-OH 2.84Å
37	T	90.3	Very high	87.2	Confident	25 Å²	25	59.2 Å²	59.2	15%	0.153	30%	0.301	C	S	.	.	H	α-helix	trans	-57.3	-49.2	175.9	-63.1	0	0	0	0	110.9	S33 N34 W35 K41 L64	S33-T37 WeakPolarHBondContact O-CB 3.22Å; S33-T37 PolarHBondContact O-N 3.29Å; S33-T37 PolarHBondContact O-OG1 3.16Å; N34-T37 WeakPolarHBondContact O-CB 3.44Å; N34-T37 PolarHBondContact O-N 3.16Å; W35-T37 VanDerWaalsContact C-N 3.35Å; T37-K41 HydrophobicContact CG2-CD 4.16Å; T37-K41 WeakPolarHBondContact O-CB 3.22Å; T37-K41 VanDerWaalsContact O-CG 3.23Å; T37-K41 WeakPolarHBondContact O-CG 3.24Å; T37-K41 PolarHBondContact O-N 2.86Å; T37-L64 HydrophobicContact CG2-CD2 3.96Å
38	D	87.5	Confident	89.2	Confident	99 Å²	99	57.9 Å²	57.9	53%	0.529	30%	0.3	S	S	.	.	H	α-helix	trans	-68.3	-40.4	-179	-68.8	-21.1	0	0	0	112.2	N34 W35 S36 T42	N34-D38 PolarHBondContact O-N 2.88Å; W35-D38 PolarHBondContact O-N 3.43Å; S36-D38 PolarHBondContact O-N 3.14Å; D38-T42 WeakPolarHBondContact O-CB 3.28Å; D38-T42 PolarHBondContact O-N 2.76Å; D38-T42 PolarHBondContact O-OG1 2.72Å
39	K	92.3	Very high	90.6	Very high	45 Å²	45	57 Å²	57	20%	0.196	30%	0.295	C	S	.	.	H	α-helix	trans	-65.6	-48.5	178.4	-167.2	74.4	174.3	-159.6	0	111.3	W35 S36 K41 T42 L43 Y151 T154 E158	W35-K39 HydrophobicContact CE3-CB 4.5Å; W35-K39 HydrophobicContact CH2-CB 4.24Å; W35-K39 HydrophobicContact CH2-CD 4.31Å; W35-K39 HydrophobicContact CH2-CG 3.93Å; W35-K39 HydrophobicContact CZ2-CB 4.42Å; W35-K39 HydrophobicContact CZ2-CD 4.09Å; W35-K39 HydrophobicContact CZ2-CG 4.17Å; W35-K39 HydrophobicContact CZ3-CB 4.3Å; W35-K39 HydrophobicContact CZ3-CG 4.4Å; W35-K39 WeakPolarHBondContact O-CB 3.44Å; W35-K39 PolarHBondContact O-N 2.99Å; S36-K39 PolarHBondContact O-N 3.14Å; K39-K41 PolarHBondContact O-N 3.18Å; K39-T42 PolarHBondContact O-N 2.81Å; K39-L43 HydrophobicContact CG-CD1 3.92Å; K39-L43 VanDerWaalsContact O-CG 3.28Å; K39-L43 WeakPolarHBondContact O-CG 3.46Å; K39-L43 PolarHBondContact O-N 2.74Å; K39-Y151 HydrophobicContact CB-CD2 4.38Å; K39-Y151 HydrophobicContact CG-CD2 4.32Å; K39-T154 VanDerWaalsContact CE-OG1 3.32Å; K39-T154 WeakPolarHBondContact CE-OG1 3.39Å; K39-E158 VanDerWaalsContact NZ-CD 3.32Å; K39-E158 IonicContact NZ-OE1 3.09Å; K39-E158 PolarHBondContact NZ-OE1 3.01Å; K39-E158 VanDerWaalsContact NZ-OE1 3.11Å; K39-E158 IonicContact NZ-OE2 2.61Å; K39-E158 PolarHBondContact NZ-OE2 3.31Å
40	L	93.9	Very high	91.3	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61	-43.6	177.4	-76.4	168.3	0	0	0	111.4	S36 T42 L43 F44 L64 W83 L108 Y151	S36-L40 VanDerWaalsContact O-CB 3.27Å; S36-L40 WeakPolarHBondContact O-CB 3.32Å; S36-L40 VanDerWaalsContact O-CG 3.31Å; S36-L40 WeakPolarHBondContact O-CG 3.46Å; S36-L40 PolarHBondContact O-N 2.84Å; L40-T42 VanDerWaalsContact C-N 3.34Å; L40-T42 PolarHBondContact O-N 2.75Å; L40-L43 PolarHBondContact O-N 3.19Å; L40-F44 HydrophobicContact CB-CD2 4.24Å; L40-F44 HydrophobicContact CB-CE2 3.98Å; L40-F44 HydrophobicContact CD2-CE2 3.75Å; L40-F44 HydrophobicContact CD2-CZ 3.82Å; L40-F44 HydrophobicContact CG-CE2 4.4Å; L40-F44 WeakPolarHBondContact O-CB 3.47Å; L40-F44 WeakPolarHBondContact O-CD2 3.3Å; L40-F44 WeakPolarHBondContact O-CG 3.26Å; L40-F44 PolarHBondContact O-N 3.1Å; L40-L64 HydrophobicContact CB-CD2 3.9Å; L40-L64 HydrophobicContact CD1-CD1 4.05Å; L40-L64 HydrophobicContact CD1-CD2 4.43Å; L40-W83 HydrophobicContact CD1-CD2 3.97Å; L40-W83 HydrophobicContact CD1-CG 3.97Å; L40-L108 HydrophobicContact CD2-CD2 4.36Å; L40-Y151 HydrophobicContact CD1-CD1 4.37Å; L40-Y151 HydrophobicContact CD1-CD2 4.45Å; L40-Y151 HydrophobicContact CD1-CE1 4.2Å; L40-Y151 HydrophobicContact CD1-CE2 4.29Å; L40-Y151 HydrophobicContact CD1-CG 4.48Å; L40-Y151 HydrophobicContact CD2-CD1 3.67Å; L40-Y151 HydrophobicContact CD2-CD2 4.02Å; L40-Y151 HydrophobicContact CD2-CE1 4.31Å; L40-Y151 HydrophobicContact CD2-CG 3.49Å; L40-Y151 VanDerWaalsContact CD2-CG 3.49Å; L40-Y151 HydrophobicContact CG-CD1 4.15Å; L40-Y151 HydrophobicContact CG-CD2 3.82Å; L40-Y151 HydrophobicContact CG-CE1 4.42Å; L40-Y151 HydrophobicContact CG-CE2 4.12Å; L40-Y151 HydrophobicContact CG-CG 3.83Å
41	K	92.5	Very high	91.5	Very high	83 Å²	83	56 Å²	56	36%	0.361	30%	0.297	S	S	.	.	H	α-helix	trans	-57.4	-46.9	174.2	-77	172.3	-177.6	173.1	0	112.2	T37 K39 L43 L45 V61 L64	T37-K41 HydrophobicContact CG2-CD 4.16Å; T37-K41 WeakPolarHBondContact O-CB 3.22Å; T37-K41 VanDerWaalsContact O-CG 3.23Å; T37-K41 WeakPolarHBondContact O-CG 3.24Å; T37-K41 PolarHBondContact O-N 2.86Å; K39-K41 PolarHBondContact O-N 3.18Å; K41-L43 PolarHBondContact O-N 2.85Å; K41-L45 WeakPolarHBondContact O-CB 3.46Å; K41-L45 VanDerWaalsContact O-CG 3.25Å; K41-L45 WeakPolarHBondContact O-CG 3.29Å; K41-L45 PolarHBondContact O-N 2.8Å; K41-L45 VanDerWaalsContact O-N 3.07Å; K41-V61 HydrophobicContact CB-CG2 4.39Å; K41-V61 HydrophobicContact CG-CB 4.16Å; K41-V61 HydrophobicContact CG-CG1 4.26Å; K41-V61 HydrophobicContact CG-CG2 4.05Å; K41-L64 HydrophobicContact CG-CD2 4.06Å
42	T	91.7	Very high	91.6	Very high	97 Å²	97	59.8 Å²	59.8	60%	0.595	31%	0.311	S	S	*	.	H	α-helix	trans	-61.5	-45.1	179.3	-58	0	0	0	0	111.5	D38 K39 L40 A46	D38-T42 WeakPolarHBondContact O-CB 3.28Å; D38-T42 PolarHBondContact O-N 2.76Å; D38-T42 PolarHBondContact O-OG1 2.72Å; K39-T42 PolarHBondContact O-N 2.81Å; L40-T42 VanDerWaalsContact C-N 3.34Å; L40-T42 PolarHBondContact O-N 2.75Å; T42-A46 PolarHBondContact O-N 3.25Å
43	L	94.5	Very high	91.4	Very high	28 Å²	28	62.4 Å²	62.4	15%	0.147	32%	0.323	C	S	.	.	H	α-helix	trans	-69.6	-43	-177.7	-69	166.8	0	0	0	112.1	K39 L40 K41 A46 A147 I150	K39-L43 HydrophobicContact CG-CD1 3.92Å; K39-L43 VanDerWaalsContact O-CG 3.28Å; K39-L43 WeakPolarHBondContact O-CG 3.46Å; K39-L43 PolarHBondContact O-N 2.74Å; L40-L43 PolarHBondContact O-N 3.19Å; K41-L43 PolarHBondContact O-N 2.85Å; L43-A46 PolarHBondContact O-N 3.03Å; L43-A147 HydrophobicContact CB-CB 4.04Å; L43-A147 WeakPolarHBondContact CD1-O 3.38Å; L43-I150 HydrophobicContact CD1-CB 4.35Å; L43-I150 HydrophobicContact CD1-CG2 4.09Å; L43-I150 HydrophobicContact CD2-CB 4.22Å; L43-I150 HydrophobicContact CD2-CG2 3.68Å
44	F	95.2	Very high	91.6	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-69.5	-39.6	180	-67	-41	0	0	0	112.9	L40 A46 V47 V58 V61 V85 L87 I105 L144 A147 M148	L40-F44 HydrophobicContact CB-CD2 4.24Å; L40-F44 HydrophobicContact CB-CE2 3.98Å; L40-F44 HydrophobicContact CD2-CE2 3.75Å; L40-F44 HydrophobicContact CD2-CZ 3.82Å; L40-F44 HydrophobicContact CG-CE2 4.4Å; L40-F44 WeakPolarHBondContact O-CB 3.47Å; L40-F44 WeakPolarHBondContact O-CD2 3.3Å; L40-F44 WeakPolarHBondContact O-CG 3.26Å; L40-F44 PolarHBondContact O-N 3.1Å; F44-A46 PolarHBondContact O-N 3.38Å; F44-V47 WeakPolarHBondContact O-CB 3.29Å; F44-V47 PolarHBondContact O-N 3.29Å; F44-V47 VanDerWaalsContact O-N 3.12Å; F44-V58 VanDerWaalsContact O-CB 3.3Å; F44-V58 WeakPolarHBondContact O-CB 3.15Å; F44-V61 HydrophobicContact CB-CG2 4.29Å; F44-V85 HydrophobicContact CD2-CG1 4.16Å; F44-V85 HydrophobicContact CE2-CG1 3.82Å; F44-V85 HydrophobicContact CE2-CG2 4.18Å; F44-L87 HydrophobicContact CB-CD1 4.15Å; F44-L87 HydrophobicContact CB-CD2 4.01Å; F44-L87 HydrophobicContact CD1-CD1 4.25Å; F44-L87 HydrophobicContact CD2-CD1 4.49Å; F44-L87 HydrophobicContact CD2-CD2 3.96Å; F44-L87 HydrophobicContact CG-CD1 4.07Å; F44-L87 HydrophobicContact CG-CD2 4.13Å; F44-I105 HydrophobicContact CE1-CD1 4.42Å; F44-I105 HydrophobicContact CZ-CD1 4.26Å; F44-L144 HydrophobicContact CD1-CD2 3.7Å; F44-L144 HydrophobicContact CE1-CD2 4.15Å; F44-A147 HydrophobicContact CD1-CB 4.15Å; F44-A147 HydrophobicContact CE1-CB 4.26Å; F44-M148 HydrophobicContact CE1-CG 3.85Å; F44-M148 HydrophobicContact CZ-CG 3.89Å
45	L	92.8	Very high	92	Very high	86 Å²	86	59.3 Å²	59.3	45%	0.45	30%	0.304	S	S	.	.	H	α-helix	trans	-67.4	-18.2	176.6	-70.2	171.9	0	0	0	113.3	K41 V47 V58 T59 V61	K41-L45 WeakPolarHBondContact O-CB 3.46Å; K41-L45 VanDerWaalsContact O-CG 3.25Å; K41-L45 WeakPolarHBondContact O-CG 3.29Å; K41-L45 PolarHBondContact O-N 2.8Å; K41-L45 VanDerWaalsContact O-N 3.07Å; L45-V47 VanDerWaalsContact C-N 3.28Å; L45-V58 HydrophobicContact CD2-CG1 4.48Å; L45-T59 WeakPolarHBondContact CD2-O 3.27Å; L45-V61 HydrophobicContact CD2-CG2 4.48Å; L45-V61 HydrophobicContact CG-CG2 4.27Å
46	A	92.8	Very high	92.1	Very high	75 Å²	75	56.3 Å²	56.3	62%	0.62	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-9.2	175	0	0	0	0	0	113.2	T42 L43 F44 Q48	T42-A46 PolarHBondContact O-N 3.25Å; L43-A46 PolarHBondContact O-N 3.03Å; F44-A46 PolarHBondContact O-N 3.38Å; A46-Q48 PolarHBondContact O-N 2.75Å
47	V	93.9	Very high	92.3	Very high	8 Å²	8	59.8 Å²	59.8	5%	0.048	31%	0.309	C	S	.	.			trans	-74.3	116	-177.6	176.6	0	0	0	0	110.6	F44 L45 E57 V58 L143 L144 A147	F44-V47 WeakPolarHBondContact O-CB 3.29Å; F44-V47 PolarHBondContact O-N 3.29Å; F44-V47 VanDerWaalsContact O-N 3.12Å; L45-V47 VanDerWaalsContact C-N 3.28Å; V47-E57 WeakPolarHBondContact O-CA 3.31Å; V47-V58 HydrophobicContact CB-CB 4.49Å; V47-V58 HydrophobicContact CB-CG2 3.92Å; V47-V58 HydrophobicContact CG1-CG2 4.16Å; V47-V58 PolarHBondContact O-N 3.03Å; V47-L143 HydrophobicContact CG1-CB 3.88Å; V47-L143 HydrophobicContact CG1-CD1 4.32Å; V47-L143 HydrophobicContact CG2-CB 4.38Å; V47-L144 HydrophobicContact CG1-CD2 4.49Å; V47-L144 HydrophobicContact CG1-CG 4.37Å; V47-L144 HydrophobicContact CG2-CD2 4.08Å; V47-A147 HydrophobicContact CG2-CB 4.46Å
48	Q	94.7	Very high	92.5	Very high	113 Å²	113	58.9 Å²	58.9	53%	0.528	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	141.8	171.3	57.3	168.9	28.1	0	0	110.2	A46 C56 E57 L143	A46-Q48 PolarHBondContact O-N 2.75Å; Q48-C56 CarbonylContact C-O 3.54Å; Q48-C56 VanDerWaalsContact CA-O 3.3Å; Q48-C56 WeakPolarHBondContact CA-O 3.25Å; Q48-E57 HydrophobicContact CB-CB 4.03Å; Q48-L143 VanDerWaalsContact O-CD1 3.26Å; Q48-L143 WeakPolarHBondContact O-CD1 3.47Å
49	V	94.3	Very high	92.9	Very high	8 Å²	8	57.2 Å²	57.2	5%	0.048	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	147.8	177.5	-65.5	0	0	0	0	110.1	K55 C56 L135 M136 E139 L143	V49-K55 CarbonylContact O-C 3.6Å; V49-K55 WeakPolarHBondContact O-CA 3.41Å; V49-C56 HydrophobicContact CG2-CB 3.7Å; V49-C56 PolarHBondContact N-O 2.83Å; V49-C56 PolarHBondContact O-N 2.88Å; V49-L135 HydrophobicContact CB-CD1 4.29Å; V49-L135 HydrophobicContact CB-CG 4.44Å; V49-L135 HydrophobicContact CG2-CD1 4.17Å; V49-L135 HydrophobicContact CG2-CD2 4Å; V49-L135 HydrophobicContact CG2-CG 3.79Å; V49-M136 HydrophobicContact CG2-SD 3.68Å; V49-E139 HydrophobicContact CB-CB 4.28Å; V49-E139 HydrophobicContact CG1-CB 3.84Å; V49-L143 HydrophobicContact CG1-CD1 3.55Å; V49-L143 HydrophobicContact CG1-CG 4.36Å
50	Q	92.9	Very high	93	Very high	146 Å²	146	59.9 Å²	59.9	68%	0.682	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.1	130.4	-179.4	-175.8	177.2	-4.9	0	0	110.7	G54 K55	Q50-G54 WeakPolarHBondContact CA-O 3.46Å; Q50-K55 HydrophobicContact CB-CG 4.35Å; Q50-K55 HydrophobicContact CG-CB 4.34Å
51	N	89.8	Confident	93	Very high	59 Å²	59	61 Å²	61	32%	0.316	32%	0.317	S	S	.	.			trans	-142.6	-164.1	174.4	75.4	-6	0	0	0	111.1	E53 G54 L135	N51-E53 PolarHBondContact O-N 3.38Å; N51-E53 WeakPolarHBondContact OD1-CA 3.29Å; N51-E53 WeakPolarHBondContact OD1-CB 3.44Å; N51-E53 PolarHBondContact OD1-N 2.91Å; N51-G54 PolarHBondContact N-O 2.9Å; N51-G54 PolarHBondContact O-N 3.38Å; N51-G54 PolarHBondContact OD1-N 3.03Å; N51-G54 PolarHBondContact OD1-O 3.11Å; N51-L135 HydrophobicContact CB-CD1 4.08Å; N51-L135 WeakPolarHBondContact ND2-CD1 3.35Å; N51-L135 WeakPolarHBondContact OD1-CD2 3.43Å
52	E	88.3	Confident	93.1	Very high	177 Å²	177	59.8 Å²	59.8	83%	0.827	32%	0.319	S	S	*	.	S	Bend	trans	-65.4	-23	178.2	-60.3	-173.9	169.4	0	0	114.2
53	E	85	Confident	93.1	Very high	56 Å²	56	58.9 Å²	58.9	26%	0.262	31%	0.306	S	S	.	.	S	Bend	trans	-84.4	-30.2	-179.1	-66	-63.7	118.4	0	0	112.3	N51 S93 K94 N131 L132	N51-E53 PolarHBondContact O-N 3.38Å; N51-E53 WeakPolarHBondContact OD1-CA 3.29Å; N51-E53 WeakPolarHBondContact OD1-CB 3.44Å; N51-E53 PolarHBondContact OD1-N 2.91Å; E53-S93 WeakPolarHBondContact O-CA 3.5Å; E53-K94 PolarHBondContact O-N 3.36Å; E53-K94 IonicContact OE1-NZ 3.34Å; E53-K94 PolarHBondContact OE1-NZ 2.94Å; E53-N131 HydrophobicContact CB-CB 4.32Å; E53-N131 HydrophobicContact CG-CB 3.99Å; E53-N131 VanDerWaalsContact OE2-CB 3.29Å; E53-N131 WeakPolarHBondContact OE2-CB 3.25Å; E53-N131 PolarHBondContact OE2-ND2 3.38Å; E53-L132 HydrophobicContact CB-CD2 4.44Å
54	G	91.3	Very high	93.1	Very high	8 Å²	8	58.6 Å²	58.6	8%	0.082	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.2	-161.8	173.9	0	0	0	0	0	114	Q50 N51 T92	Q50-G54 WeakPolarHBondContact CA-O 3.46Å; N51-G54 PolarHBondContact N-O 2.9Å; N51-G54 PolarHBondContact O-N 3.38Å; N51-G54 PolarHBondContact OD1-N 3.03Å; N51-G54 PolarHBondContact OD1-O 3.11Å; G54-T92 CarbonylContact C-O 3.58Å; G54-T92 WeakPolarHBondContact CA-O 3.39Å
55	K	94.1	Very high	92.9	Very high	69 Å²	69	62.9 Å²	62.9	30%	0.3	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	131.5	176.8	-173.3	-169	-175.8	-151.8	0	109.7	V49 Q50 E57 G91 T92	V49-K55 CarbonylContact O-C 3.6Å; V49-K55 WeakPolarHBondContact O-CA 3.41Å; Q50-K55 HydrophobicContact CB-CG 4.35Å; Q50-K55 HydrophobicContact CG-CB 4.34Å; K55-E57 IonicContact NZ-OE2 2.79Å; K55-E57 PolarHBondContact NZ-OE2 3.43Å; K55-G91 CarbonylContact O-C 3.5Å; K55-G91 VanDerWaalsContact O-CA 3.27Å; K55-G91 WeakPolarHBondContact O-CA 3.49Å; K55-T92 PolarHBondContact N-O 3.34Å; K55-T92 PolarHBondContact O-N 3.12Å
56	C	94.5	Very high	92.8	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	144	169.7	-57.5	0	0	0	0	110.8	Q48 V49 W89 T90 M136	Q48-C56 CarbonylContact C-O 3.54Å; Q48-C56 VanDerWaalsContact CA-O 3.3Å; Q48-C56 WeakPolarHBondContact CA-O 3.25Å; V49-C56 HydrophobicContact CG2-CB 3.7Å; V49-C56 PolarHBondContact N-O 2.83Å; V49-C56 PolarHBondContact O-N 2.88Å; C56-W89 HydrophobicContact CB-CE3 4.06Å; C56-W89 HydrophobicContact CB-CZ3 4.27Å; C56-T90 CarbonylContact C-O 3.58Å; C56-T90 VanDerWaalsContact CA-O 3.29Å; C56-T90 WeakPolarHBondContact CA-O 3.46Å; C56-M136 HydrophobicContact CB-CG 3.58Å; C56-M136 HydrophobicContact CB-SD 3.46Å; C56-M136 WeakPolarHBondContact CB-SD 3.34Å
57	E	95.6	Very high	92.7	Very high	73 Å²	73	64 Å²	64	34%	0.341	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	145.7	177.6	63.2	-170.6	-162.7	0	0	111.1	V47 Q48 K55 T59 W89 T90	V47-E57 WeakPolarHBondContact O-CA 3.31Å; Q48-E57 HydrophobicContact CB-CB 4.03Å; K55-E57 IonicContact NZ-OE2 2.79Å; K55-E57 PolarHBondContact NZ-OE2 3.43Å; E57-T59 HydrophobicContact CG-CG2 4.18Å; E57-T59 PolarHBondContact O-N 2.92Å; E57-W89 CarbonylContact O-C 3.55Å; E57-W89 VanDerWaalsContact O-CA 3.23Å; E57-W89 WeakPolarHBondContact O-CA 3.05Å; E57-W89 WeakPolarHBondContact O-CB 3.31Å; E57-T90 PolarHBondContact N-O 3.26Å; E57-T90 PolarHBondContact O-N 3.42Å
58	V	95.9	Very high	92.7	Very high	6 Å²	6	63.7 Å²	63.7	4%	0.036	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	121.6	172.1	177.6	0	0	0	0	108.2	F44 L45 V47 L87 M136	F44-V58 VanDerWaalsContact O-CB 3.3Å; F44-V58 WeakPolarHBondContact O-CB 3.15Å; L45-V58 HydrophobicContact CD2-CG1 4.48Å; V47-V58 HydrophobicContact CB-CB 4.49Å; V47-V58 HydrophobicContact CB-CG2 3.92Å; V47-V58 HydrophobicContact CG1-CG2 4.16Å; V47-V58 PolarHBondContact O-N 3.03Å; V58-L87 HydrophobicContact CG1-CB 4.11Å; V58-L87 HydrophobicContact CG1-CD1 4.35Å; V58-M136 HydrophobicContact CG2-CE 4.46Å
59	T	94.3	Very high	92.4	Very high	64 Å²	64	59.2 Å²	59.2	39%	0.393	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-24.4	-174.8	53.1	0	0	0	0	113.4	L45 E57 N88 T90	L45-T59 WeakPolarHBondContact CD2-O 3.27Å; E57-T59 HydrophobicContact CG-CG2 4.18Å; E57-T59 PolarHBondContact O-N 2.92Å; T59-N88 PolarHBondContact N-O 3.07Å; T59-N88 PolarHBondContact OG1-O 2.98Å; T59-T90 HydrophobicContact CG2-CG2 3.57Å; T59-T90 VanDerWaalsContact CG2-OG1 3.29Å; T59-T90 WeakPolarHBondContact CG2-OG1 3.3Å
60	E	94.2	Very high	92.3	Very high	102 Å²	102	58.9 Å²	58.9	48%	0.477	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	144.3	-174.7	-172	-175.7	-169.4	0	0	111.6	L87 N88	E60-L87 CarbonylContact O-C 3.54Å; E60-L87 WeakPolarHBondContact O-CA 3.32Å; E60-N88 HydrophobicContact CB-CB 4.13Å; E60-N88 PolarHBondContact N-O 2.78Å; E60-N88 PolarHBondContact O-N 2.8Å; E60-N88 PolarHBondContact OE2-ND2 3.46Å
61	V	94.9	Very high	91.9	Very high	24 Å²	24	52.1 Å²	52.1	15%	0.145	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	94.2	164.9	-174.8	0	0	0	0	107.8	K41 F44 L45 L64 V85 K86 L87	K41-V61 HydrophobicContact CB-CG2 4.39Å; K41-V61 HydrophobicContact CG-CB 4.16Å; K41-V61 HydrophobicContact CG-CG1 4.26Å; K41-V61 HydrophobicContact CG-CG2 4.05Å; F44-V61 HydrophobicContact CB-CG2 4.29Å; L45-V61 HydrophobicContact CD2-CG2 4.48Å; L45-V61 HydrophobicContact CG-CG2 4.27Å; V61-L64 HydrophobicContact CG1-CB 3.91Å; V61-L64 HydrophobicContact CG1-CD2 4.43Å; V61-V85 HydrophobicContact CG1-CG1 4.37Å; V61-K86 CarbonylContact C-O 3.54Å; V61-L87 HydrophobicContact CB-CD2 4.03Å; V61-L87 HydrophobicContact CG1-CD2 3.85Å; V61-L87 HydrophobicContact CG2-CD2 3.71Å
62	S	93.6	Very high	91.5	Very high	57 Å²	57	49.6 Å²	49.6	40%	0.399	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	-27	-173.5	56.6	0	0	0	0	113.2	K86	S62-K86 PolarHBondContact N-O 3.22Å; S62-K86 WeakPolarHBondContact OG-CB 3.25Å; S62-K86 PolarHBondContact OG-O 3.28Å; S62-K86 VanDerWaalsContact OG-O 3.12Å
63	K	93.4	Very high	90.9	Very high	77 Å²	77	48.3 Å²	48.3	34%	0.335	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	135	174.6	-166.1	-178.8	178.6	-173.2	0	110.2	D65 V85 K86	K63-D65 WeakPolarHBondContact CE-OD2 3.36Å; K63-D65 IonicContact NZ-OD2 2.63Å; K63-D65 PolarHBondContact NZ-OD2 2.81Å; K63-V85 CarbonylContact O-C 3.52Å; K63-V85 WeakPolarHBondContact O-CA 3.42Å; K63-K86 HydrophobicContact CB-CB 3.72Å; K63-K86 HydrophobicContact CB-CD 4.32Å; K63-K86 HydrophobicContact CB-CG 3.91Å; K63-K86 HydrophobicContact CD-CD 4.24Å; K63-K86 HydrophobicContact CD-CG 4.29Å; K63-K86 PolarHBondContact N-O 3.32Å; K63-K86 VanDerWaalsContact N-O 3.07Å; K63-K86 PolarHBondContact O-N 2.93Å
64	L	93.1	Very high	90.2	Very high	23 Å²	23	52.9 Å²	52.9	12%	0.12	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	83.5	172	-178.2	57.4	0	0	0	107.4	T37 L40 K41 V61 W83 V85	T37-L64 HydrophobicContact CG2-CD2 3.96Å; L40-L64 HydrophobicContact CB-CD2 3.9Å; L40-L64 HydrophobicContact CD1-CD1 4.05Å; L40-L64 HydrophobicContact CD1-CD2 4.43Å; K41-L64 HydrophobicContact CG-CD2 4.06Å; V61-L64 HydrophobicContact CG1-CB 3.91Å; V61-L64 HydrophobicContact CG1-CD2 4.43Å; L64-W83 HydrophobicContact CD1-CB 4.48Å; L64-W83 HydrophobicContact CD1-CD2 4.3Å; L64-W83 HydrophobicContact CD1-CE3 3.77Å; L64-W83 HydrophobicContact CD1-CZ3 4.48Å; L64-W83 HydrophobicContact CG-CE3 4.05Å; L64-W83 HydrophobicContact CG-CZ3 4.28Å; L64-V85 HydrophobicContact CD1-CB 4.34Å; L64-V85 HydrophobicContact CD1-CG1 4.15Å; L64-V85 HydrophobicContact CD1-CG2 3.62Å
65	D	90.6	Very high	89	Confident	90 Å²	90	54.1 Å²	54.1	48%	0.481	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	136.1	-178.4	-72.8	6.2	0	0	0	108.7	K63 W83 S84	K63-D65 WeakPolarHBondContact CE-OD2 3.36Å; K63-D65 IonicContact NZ-OD2 2.63Å; K63-D65 PolarHBondContact NZ-OD2 2.81Å; D65-W83 WeakPolarHBondContact O-CA 3.36Å; D65-S84 PolarHBondContact N-O 3.02Å; D65-S84 VanDerWaalsContact N-O 3.07Å; D65-S84 PolarHBondContact O-N 2.8Å
66	G	91.8	Very high	88.1	Confident	44 Å²	44	56.3 Å²	56.3	45%	0.454	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	153.5	-177.7	-177.1	0	0	0	0	0	111.9	E82 W83	G66-E82 CarbonylContact C-O 3.54Å; G66-E82 WeakPolarHBondContact CA-O 3.49Å; G66-W83 VanDerWaalsContact C-CZ3 3.4Å; G66-W83 WeakPolarHBondContact O-CZ3 3.08Å
67	E	90.6	Very high	87.6	Confident	140 Å²	140	58.1 Å²	58.1	65%	0.654	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142	156.7	177.1	62.9	-174.8	178.1	0	0	110.6	S33 Y81 E82	S33-E67 WeakPolarHBondContact OG-CA 3.47Å; E67-Y81 VanDerWaalsContact O-CA 3.29Å; E67-Y81 WeakPolarHBondContact O-CA 3.17Å; E67-E82 PolarHBondContact N-O 3.17Å; E67-E82 PolarHBondContact O-N 3.5Å
68	A	93.4	Very high	87.1	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.008	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	129.1	169.8	0	0	0	0	0	108.8	A32 S33 S36 F80 W83	A32-A68 CarbonylContact C-O 3.58Å; A32-A68 WeakPolarHBondContact CA-O 3.14Å; A32-A68 HydrophobicContact CB-CB 4.05Å; A32-A68 PolarHBondContact N-O 2.93Å; S33-A68 PolarHBondContact N-O 2.86Å; S33-A68 PolarHBondContact OG-N 3.32Å; S33-A68 PolarHBondContact OG-O 3Å; S36-A68 WeakPolarHBondContact OG-CB 3.27Å; A68-F80 CarbonylContact C-O 3.58Å; A68-F80 VanDerWaalsContact CA-O 3.24Å; A68-F80 WeakPolarHBondContact CA-O 3.29Å; A68-W83 HydrophobicContact CB-CZ2 3.86Å
69	S	89.8	Confident	86.8	Confident	20 Å²	20	59.3 Å²	59.3	14%	0.14	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	149.8	172.7	87.6	0	0	0	0	111.2	E29 R30 F80	E29-S69 VanDerWaalsContact OE1-CB 3.32Å; E29-S69 WeakPolarHBondContact OE1-CB 3.38Å; E29-S69 PolarHBondContact OE1-OG 3.5Å; R30-S69 WeakPolarHBondContact O-CA 3.49Å; S69-F80 PolarHBondContact N-O 2.85Å; S69-F80 PolarHBondContact O-N 3.1Å; S69-F80 VanDerWaalsContact O-O 3.12Å
70	I	91.4	Very high	86.7	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.005	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	120.3	179.4	-52.3	178.6	0	0	0	108.6	R30 A32 L77 I78 F79 L155 F159 T160 M163	R30-I70 PolarHBondContact N-O 2.87Å; R30-I70 PolarHBondContact O-N 2.86Å; A32-I70 HydrophobicContact CB-CD1 4.29Å; A32-I70 HydrophobicContact CB-CG1 4.27Å; I70-L77 HydrophobicContact CG2-CB 4.12Å; I70-L77 HydrophobicContact CG2-CD2 3.88Å; I70-L77 HydrophobicContact CG2-CG 4.48Å; I70-I78 CarbonylContact C-O 3.57Å; I70-I78 WeakPolarHBondContact CA-O 3.4Å; I70-F79 HydrophobicContact CD1-CD1 3.78Å; I70-F79 HydrophobicContact CD1-CE1 3.74Å; I70-F79 HydrophobicContact CG1-CD1 3.82Å; I70-F79 HydrophobicContact CG1-CE1 4.23Å; I70-F79 HydrophobicContact CG2-CD1 4.23Å; I70-F79 HydrophobicContact CG2-CE1 4.2Å; I70-L155 HydrophobicContact CD1-CD1 3.97Å; I70-L155 HydrophobicContact CD1-CG 4.26Å; I70-F159 HydrophobicContact CD1-CD1 3.26Å; I70-F159 HydrophobicContact CD1-CE1 3.66Å; I70-F159 HydrophobicContact CD1-CG 4.29Å; I70-F159 HydrophobicContact CG1-CD1 4.39Å; I70-F159 HydrophobicContact CG1-CE1 4.36Å; I70-T160 HydrophobicContact CD1-CG2 3.61Å; I70-T160 HydrophobicContact CG2-CG2 4.19Å; I70-M163 HydrophobicContact CB-CE 3.89Å; I70-M163 HydrophobicContact CB-SD 4.38Å; I70-M163 HydrophobicContact CD1-SD 4.37Å; I70-M163 HydrophobicContact CG2-CE 3.72Å; I70-M163 HydrophobicContact CG2-SD 4.22Å
71	N	84.9	Confident	86.7	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.016	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	121.6	-179	-79.1	-71.9	0	0	0	110.2	W27 T28 E29 L77 I78 F80	W27-N71 VanDerWaalsContact CE2-OD1 3.31Å; W27-N71 HydrophobicContact CZ2-CB 4.5Å; W27-N71 WeakPolarHBondContact CZ2-OD1 3.39Å; W27-N71 PolarHBondContact NE1-OD1 3.28Å; T28-N71 CarbonylContact O-C 3.55Å; T28-N71 WeakPolarHBondContact O-CA 3.38Å; E29-N71 WeakPolarHBondContact CB-OD1 3.23Å; E29-N71 WeakPolarHBondContact CG-OD1 3.26Å; N71-L77 CarbonylContact O-C 3.53Å; N71-L77 WeakPolarHBondContact O-CA 3.46Å; N71-I78 HydrophobicContact CB-CB 4.23Å; N71-I78 PolarHBondContact N-O 2.85Å; N71-I78 PolarHBondContact O-N 2.83Å; N71-F80 HydrophobicContact CB-CE2 4.41Å; N71-F80 WeakPolarHBondContact ND2-CD2 3.36Å; N71-F80 WeakPolarHBondContact ND2-CE2 3.23Å
72	N	80.4	Confident	86.6	Confident	6 Å²	6	61.2 Å²	61.2	3%	0.032	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	112.8	167.6	-177.2	-7.4	0	0	0	109.3	T28 G75 K76 L77 M163	T28-N72 PolarHBondContact N-O 2.96Å; T28-N72 PolarHBondContact O-N 3.12Å; N72-G75 VanDerWaalsContact OD1-CA 3.26Å; N72-G75 WeakPolarHBondContact OD1-CA 3.48Å; N72-G75 PolarHBondContact OD1-N 2.94Å; N72-K76 WeakPolarHBondContact CA-O 3.29Å; N72-L77 HydrophobicContact CB-CD2 3.87Å; N72-M163 PolarHBondContact ND2-O 3.45Å
73	R	75.3	Confident	86.6	Confident	150 Å²	150	58.6 Å²	58.6	57%	0.566	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119	108.2	173.6	-170.4	175.9	-175.9	-172.6	1.5	109.4	G75 K76 I78	R73-G75 PolarHBondContact O-N 3.15Å; R73-K76 PolarHBondContact N-O 3.04Å; R73-K76 PolarHBondContact O-N 2.9Å; R73-I78 HydrophobicContact CB-CD1 4.27Å
74	K	71.3	Confident	86.6	Confident	153 Å²	153	56.6 Å²	56.6	67%	0.665	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	38.8	178.7	-57	-178.4	176.6	-177.2	0	113.1	K76	K74-K76 VanDerWaalsContact C-N 3.32Å; K74-K76 PolarHBondContact O-N 2.99Å
75	G	65.9	Low	86.8	Confident	34 Å²	34	55.5 Å²	55.5	35%	0.351	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	82	3.8	-179.9	0	0	0	0	0	114.9	N72 R73	N72-G75 VanDerWaalsContact OD1-CA 3.26Å; N72-G75 WeakPolarHBondContact OD1-CA 3.48Å; N72-G75 PolarHBondContact OD1-N 2.94Å; R73-G75 PolarHBondContact O-N 3.15Å
76	K	76	Confident	87.1	Confident	115 Å²	115	54.7 Å²	54.7	50%	0.5	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	128.6	168.3	-65.7	-172.9	179.6	-174.7	0	109.5	N72 R73 K74 E313	N72-K76 WeakPolarHBondContact CA-O 3.29Å; R73-K76 PolarHBondContact N-O 3.04Å; R73-K76 PolarHBondContact O-N 2.9Å; K74-K76 VanDerWaalsContact C-N 3.32Å; K74-K76 PolarHBondContact O-N 2.99Å; K76-E313 IonicContact NZ-OE2 2.6Å; K76-E313 PolarHBondContact NZ-OE2 3.28Å
77	L	83.7	Confident	87.3	Confident	38 Å²	38	52.6 Å²	52.6	20%	0.199	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	128.7	173	-62.5	167.7	0	0	0	109.4	I70 N71 N72 F79 T160 M163 I164	I70-L77 HydrophobicContact CG2-CB 4.12Å; I70-L77 HydrophobicContact CG2-CD2 3.88Å; I70-L77 HydrophobicContact CG2-CG 4.48Å; N71-L77 CarbonylContact O-C 3.53Å; N71-L77 WeakPolarHBondContact O-CA 3.46Å; N72-L77 HydrophobicContact CB-CD2 3.87Å; L77-F79 HydrophobicContact CB-CE2 3.88Å; L77-F79 HydrophobicContact CB-CZ 4.01Å; L77-T160 HydrophobicContact CD1-CG2 3.6Å; L77-M163 HydrophobicContact CD2-CB 4.01Å; L77-M163 HydrophobicContact CD2-CE 3.96Å; L77-I164 HydrophobicContact CD1-CD1 3.74Å; L77-I164 HydrophobicContact CD1-CG1 4.01Å; L77-I164 HydrophobicContact CD2-CG1 4.22Å; L77-I164 HydrophobicContact CG-CD1 3.85Å; L77-I164 HydrophobicContact CG-CG1 4.02Å
78	I	84.9	Confident	87.6	Confident	63 Å²	63	47.5 Å²	47.5	32%	0.323	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.3	175.3	-53.1	171.2	0	0	0	105.8	I70 N71 R73 F80	I70-I78 CarbonylContact C-O 3.57Å; I70-I78 WeakPolarHBondContact CA-O 3.4Å; N71-I78 HydrophobicContact CB-CB 4.23Å; N71-I78 PolarHBondContact N-O 2.85Å; N71-I78 PolarHBondContact O-N 2.83Å; R73-I78 HydrophobicContact CB-CD1 4.27Å; I78-F80 HydrophobicContact CB-CE2 4.27Å; I78-F80 HydrophobicContact CG2-CD2 4.32Å; I78-F80 HydrophobicContact CG2-CE1 4.25Å; I78-F80 HydrophobicContact CG2-CE2 3.53Å; I78-F80 HydrophobicContact CG2-CZ 3.5Å
79	F	89.9	Confident	87.7	Confident	40 Å²	40	47.5 Å²	47.5	18%	0.175	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	132	-176.9	-57.5	-101	0	0	0	107.7	I70 L77 L155 K156 T160	I70-F79 HydrophobicContact CD1-CD1 3.78Å; I70-F79 HydrophobicContact CD1-CE1 3.74Å; I70-F79 HydrophobicContact CG1-CD1 3.82Å; I70-F79 HydrophobicContact CG1-CE1 4.23Å; I70-F79 HydrophobicContact CG2-CD1 4.23Å; I70-F79 HydrophobicContact CG2-CE1 4.2Å; L77-F79 HydrophobicContact CB-CE2 3.88Å; L77-F79 HydrophobicContact CB-CZ 4.01Å; F79-L155 HydrophobicContact CD1-CD2 4.09Å; F79-L155 HydrophobicContact CD1-CG 4.08Å; F79-L155 HydrophobicContact CE1-CG 4.36Å; F79-K156 HydrophobicContact CD1-CG 4.3Å; F79-K156 HydrophobicContact CE1-CB 4.31Å; F79-K156 HydrophobicContact CE1-CG 3.76Å; F79-K156 HydrophobicContact CE2-CG 4.08Å; F79-K156 HydrophobicContact CZ-CB 4.12Å; F79-K156 HydrophobicContact CZ-CG 3.66Å; F79-T160 HydrophobicContact CE1-CG2 3.55Å; F79-T160 HydrophobicContact CZ-CG2 3.76Å
80	F	91.6	Very high	88	Confident	93 Å²	93	48.1 Å²	48.1	41%	0.408	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	126.1	167.8	-61.7	-75.6	0	0	0	106.1	A68 S69 N71 I78	A68-F80 CarbonylContact C-O 3.58Å; A68-F80 VanDerWaalsContact CA-O 3.24Å; A68-F80 WeakPolarHBondContact CA-O 3.29Å; S69-F80 PolarHBondContact N-O 2.85Å; S69-F80 PolarHBondContact O-N 3.1Å; S69-F80 VanDerWaalsContact O-O 3.12Å; N71-F80 HydrophobicContact CB-CE2 4.41Å; N71-F80 WeakPolarHBondContact ND2-CD2 3.36Å; N71-F80 WeakPolarHBondContact ND2-CE2 3.23Å; I78-F80 HydrophobicContact CB-CE2 4.27Å; I78-F80 HydrophobicContact CG2-CD2 4.32Å; I78-F80 HydrophobicContact CG2-CE1 4.25Å; I78-F80 HydrophobicContact CG2-CE2 3.53Å; I78-F80 HydrophobicContact CG2-CZ 3.5Å
81	Y	93.6	Very high	88.2	Confident	16 Å²	16	48 Å²	48	6%	0.063	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	143.1	171.2	61.9	-95.1	0	0	0	109.8	E67 L108 S109 D110 Y151 I152 L155	E67-Y81 VanDerWaalsContact O-CA 3.29Å; E67-Y81 WeakPolarHBondContact O-CA 3.17Å; Y81-L108 HydrophobicContact CE2-CD1 4.07Å; Y81-L108 HydrophobicContact CE2-CG 4.37Å; Y81-S109 WeakPolarHBondContact CE2-O 3.43Å; Y81-S109 CarbonylContact O-C 3.51Å; Y81-S109 WeakPolarHBondContact O-CA 3.33Å; Y81-S109 PolarHBondContact OH-O 2.93Å; Y81-D110 HydrophobicContact CD1-CB 3.92Å; Y81-D110 HydrophobicContact CE1-CB 3.65Å; Y81-D110 HydrophobicContact CE2-CB 4.47Å; Y81-D110 HydrophobicContact CG-CB 4.45Å; Y81-D110 PolarHBondContact N-OD1 2.9Å; Y81-D110 PolarHBondContact O-N 3.12Å; Y81-D110 VanDerWaalsContact O-N 3.1Å; Y81-Y151 HydrophobicContact CD2-CE1 4.48Å; Y81-I152 HydrophobicContact CE2-CG1 4.4Å; Y81-I152 WeakPolarHBondContact OH-CD1 3.3Å; Y81-L155 HydrophobicContact CD1-CD2 3.95Å; Y81-L155 HydrophobicContact CE1-CD2 4.48Å
82	E	92.9	Very high	88.6	Confident	121 Å²	121	50.4 Å²	50.4	57%	0.565	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-146.5	126.1	174	-173.2	-179.8	164.7	0	0	108.2	G66 E67 L108	G66-E82 CarbonylContact C-O 3.54Å; G66-E82 WeakPolarHBondContact CA-O 3.49Å; E67-E82 PolarHBondContact N-O 3.17Å; E67-E82 PolarHBondContact O-N 3.5Å; E82-L108 CarbonylContact C-O 3.47Å; E82-L108 WeakPolarHBondContact CA-O 3.42Å
83	W	94.7	Very high	89.1	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.008	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	133.5	-177.9	-61.7	101.2	0	0	0	111.8	L40 L64 D65 G66 A68 V85 L108 Y151	L40-W83 HydrophobicContact CD1-CD2 3.97Å; L40-W83 HydrophobicContact CD1-CG 3.97Å; L64-W83 HydrophobicContact CD1-CB 4.48Å; L64-W83 HydrophobicContact CD1-CD2 4.3Å; L64-W83 HydrophobicContact CD1-CE3 3.77Å; L64-W83 HydrophobicContact CD1-CZ3 4.48Å; L64-W83 HydrophobicContact CG-CE3 4.05Å; L64-W83 HydrophobicContact CG-CZ3 4.28Å; D65-W83 WeakPolarHBondContact O-CA 3.36Å; G66-W83 VanDerWaalsContact C-CZ3 3.4Å; G66-W83 WeakPolarHBondContact O-CZ3 3.08Å; A68-W83 HydrophobicContact CB-CZ2 3.86Å; W83-V85 HydrophobicContact CB-CG2 4.29Å; W83-L108 HydrophobicContact CB-CB 4.2Å; W83-L108 HydrophobicContact CB-CD2 4.46Å; W83-L108 HydrophobicContact CB-CG 4.47Å; W83-L108 PolarHBondContact N-O 3.37Å; W83-L108 PolarHBondContact O-N 3.11Å; W83-Y151 AromaticContact NE1-CZ 3.78Å; W83-Y151 PolarHBondContact NE1-OH 3.23Å; W83-Y151 VanDerWaalsContact NE1-OH 3.07Å
84	S	93.6	Very high	89.7	Confident	35 Å²	35	51 Å²	51	25%	0.245	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	114.4	165.7	155.3	0	0	0	0	109	D65 I105	D65-S84 PolarHBondContact N-O 3.02Å; D65-S84 VanDerWaalsContact N-O 3.07Å; D65-S84 PolarHBondContact O-N 2.8Å; S84-I105 WeakPolarHBondContact CA-O 3.26Å
85	V	96.3	Very high	90.4	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	137.4	-173.1	-163.3	0	0	0	0	111.5	F44 V61 K63 L64 W83 L87 I105	F44-V85 HydrophobicContact CD2-CG1 4.16Å; F44-V85 HydrophobicContact CE2-CG1 3.82Å; F44-V85 HydrophobicContact CE2-CG2 4.18Å; V61-V85 HydrophobicContact CG1-CG1 4.37Å; K63-V85 CarbonylContact O-C 3.52Å; K63-V85 WeakPolarHBondContact O-CA 3.42Å; L64-V85 HydrophobicContact CD1-CB 4.34Å; L64-V85 HydrophobicContact CD1-CG1 4.15Å; L64-V85 HydrophobicContact CD1-CG2 3.62Å; W83-V85 HydrophobicContact CB-CG2 4.29Å; V85-L87 HydrophobicContact CG1-CD2 3.61Å; V85-L87 HydrophobicContact CG1-CG 4.03Å; V85-I105 HydrophobicContact CB-CB 4.06Å; V85-I105 HydrophobicContact CB-CD1 4.49Å; V85-I105 HydrophobicContact CB-CG1 4.47Å; V85-I105 HydrophobicContact CG2-CB 4.36Å; V85-I105 PolarHBondContact N-O 2.94Å; V85-I105 PolarHBondContact O-N 2.88Å
86	K	96.2	Very high	91.3	Very high	73 Å²	73	48.9 Å²	48.9	32%	0.317	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	131.9	162.8	-56	-168.9	176.9	-147.4	0	110.2	V61 S62 K63 V103 E104	V61-K86 CarbonylContact C-O 3.54Å; S62-K86 PolarHBondContact N-O 3.22Å; S62-K86 WeakPolarHBondContact OG-CB 3.25Å; S62-K86 PolarHBondContact OG-O 3.28Å; S62-K86 VanDerWaalsContact OG-O 3.12Å; K63-K86 HydrophobicContact CB-CB 3.72Å; K63-K86 HydrophobicContact CB-CD 4.32Å; K63-K86 HydrophobicContact CB-CG 3.91Å; K63-K86 HydrophobicContact CD-CD 4.24Å; K63-K86 HydrophobicContact CD-CG 4.29Å; K63-K86 PolarHBondContact N-O 3.32Å; K63-K86 VanDerWaalsContact N-O 3.07Å; K63-K86 PolarHBondContact O-N 2.93Å; K86-V103 CarbonylContact C-O 3.47Å; K86-V103 WeakPolarHBondContact CA-O 3.44Å; K86-E104 HydrophobicContact CD-CG 4.37Å; K86-E104 WeakPolarHBondContact CE-OE1 3.27Å; K86-E104 HydrophobicContact CG-CG 4.21Å; K86-E104 IonicContact NZ-OE1 3.69Å; K86-E104 PolarHBondContact NZ-OE1 3.49Å; K86-E104 IonicContact NZ-OE2 2.77Å
87	L	96.9	Very high	92	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	149.3	-179.5	-47.8	174.3	0	0	0	109.8	F44 V58 E60 V61 V85 H102 V103 L144	F44-L87 HydrophobicContact CB-CD1 4.15Å; F44-L87 HydrophobicContact CB-CD2 4.01Å; F44-L87 HydrophobicContact CD1-CD1 4.25Å; F44-L87 HydrophobicContact CD2-CD1 4.49Å; F44-L87 HydrophobicContact CD2-CD2 3.96Å; F44-L87 HydrophobicContact CG-CD1 4.07Å; F44-L87 HydrophobicContact CG-CD2 4.13Å; V58-L87 HydrophobicContact CG1-CB 4.11Å; V58-L87 HydrophobicContact CG1-CD1 4.35Å; E60-L87 CarbonylContact O-C 3.54Å; E60-L87 WeakPolarHBondContact O-CA 3.32Å; V61-L87 HydrophobicContact CB-CD2 4.03Å; V61-L87 HydrophobicContact CG1-CD2 3.85Å; V61-L87 HydrophobicContact CG2-CD2 3.71Å; V85-L87 HydrophobicContact CG1-CD2 3.61Å; V85-L87 HydrophobicContact CG1-CG 4.03Å; L87-H102 CarbonylContact O-C 3.51Å; L87-H102 VanDerWaalsContact O-CA 3.26Å; L87-H102 WeakPolarHBondContact O-CA 3.44Å; L87-V103 HydrophobicContact CB-CB 4.1Å; L87-V103 HydrophobicContact CD1-CB 4.34Å; L87-V103 HydrophobicContact CG-CB 4.47Å; L87-V103 PolarHBondContact N-O 2.88Å; L87-V103 PolarHBondContact O-N 3.32Å; L87-L144 HydrophobicContact CD1-CD2 3.55Å
88	N	96.4	Very high	92.3	Very high	32 Å²	32	51.6 Å²	51.6	17%	0.171	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	135.3	167	-59.2	-26.2	0	0	0	108.7	T59 E60 G101 H102	T59-N88 PolarHBondContact N-O 3.07Å; T59-N88 PolarHBondContact OG1-O 2.98Å; E60-N88 HydrophobicContact CB-CB 4.13Å; E60-N88 PolarHBondContact N-O 2.78Å; E60-N88 PolarHBondContact O-N 2.8Å; E60-N88 PolarHBondContact OE2-ND2 3.46Å; N88-G101 WeakPolarHBondContact CA-O 3.5Å; N88-H102 PolarHBondContact OD1-CE1 3.04Å; N88-H102 PolarHBondContact OD1-ND1 2.92Å
89	W	96.7	Very high	92.8	Very high	1 Å²	1	50 Å²	50	0%	0.004	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	151.3	175.6	67.1	-87.8	0	0	0	110.6	C56 E57 K100 G101 H102 V121 S122 L123 L132 V133 M136	C56-W89 HydrophobicContact CB-CE3 4.06Å; C56-W89 HydrophobicContact CB-CZ3 4.27Å; E57-W89 CarbonylContact O-C 3.55Å; E57-W89 VanDerWaalsContact O-CA 3.23Å; E57-W89 WeakPolarHBondContact O-CA 3.05Å; E57-W89 WeakPolarHBondContact O-CB 3.31Å; W89-K100 WeakPolarHBondContact O-CA 3.44Å; W89-G101 PolarHBondContact N-O 2.93Å; W89-G101 VanDerWaalsContact NE1-C 3.26Å; W89-G101 PolarHBondContact O-N 3.29Å; W89-H102 PolarHBondContact NE1-O 3.03Å; W89-V121 HydrophobicContact CZ2-CG1 4.47Å; W89-S122 PolarHBondContact NE1-O 3.39Å; W89-L123 HydrophobicContact CH2-CD2 3.89Å; W89-L123 HydrophobicContact CZ2-CD2 3.94Å; W89-L132 HydrophobicContact CH2-CB 4.32Å; W89-L132 HydrophobicContact CZ3-CB 4.33Å; W89-V133 HydrophobicContact CH2-CG2 4.32Å; W89-V133 HydrophobicContact CZ2-CG2 4.3Å; W89-M136 HydrophobicContact CB-CE 3.97Å; W89-M136 HydrophobicContact CD2-CE 4.29Å; W89-M136 HydrophobicContact CD2-CG 3.93Å; W89-M136 HydrophobicContact CE3-CG 3.82Å; W89-M136 HydrophobicContact CG-CE 3.92Å; W89-M136 HydrophobicContact CH2-CG 4.32Å; W89-M136 HydrophobicContact CZ2-CG 4.4Å; W89-M136 HydrophobicContact CZ3-CG 4.03Å
90	T	95.6	Very high	93	Very high	33 Å²	33	54.1 Å²	54.1	20%	0.202	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	145.4	170.6	67.3	0	0	0	0	109.9	C56 E57 T59 Y99 K100	C56-T90 CarbonylContact C-O 3.58Å; C56-T90 VanDerWaalsContact CA-O 3.29Å; C56-T90 WeakPolarHBondContact CA-O 3.46Å; E57-T90 PolarHBondContact N-O 3.26Å; E57-T90 PolarHBondContact O-N 3.42Å; T59-T90 HydrophobicContact CG2-CG2 3.57Å; T59-T90 VanDerWaalsContact CG2-OG1 3.29Å; T59-T90 WeakPolarHBondContact CG2-OG1 3.3Å; T90-Y99 CarbonylContact C-O 3.55Å; T90-Y99 VanDerWaalsContact CA-O 3.26Å; T90-Y99 WeakPolarHBondContact CA-O 3.49Å; T90-K100 HydrophobicContact CG2-CG 4.28Å
91	G	94.5	Very high	93.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	127.7	180	0	0	0	0	0	110.8	K55 Q98 Y99	K55-G91 CarbonylContact O-C 3.5Å; K55-G91 VanDerWaalsContact O-CA 3.27Å; K55-G91 WeakPolarHBondContact O-CA 3.49Å; G91-Q98 CarbonylContact O-C 3.59Å; G91-Q98 VanDerWaalsContact O-CA 3.29Å; G91-Q98 WeakPolarHBondContact O-CA 3.42Å; G91-Y99 PolarHBondContact N-O 3.34Å; G91-Y99 PolarHBondContact O-N 2.96Å
92	T	94	Very high	93.3	Very high	53 Å²	53	52.5 Å²	52.5	33%	0.325	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	115.1	171.4	-54.5	0	0	0	0	108.8	G54 K55 Q98	G54-T92 CarbonylContact C-O 3.58Å; G54-T92 WeakPolarHBondContact CA-O 3.39Å; K55-T92 PolarHBondContact N-O 3.34Å; K55-T92 PolarHBondContact O-N 3.12Å; T92-Q98 HydrophobicContact CG2-CG 4.47Å
93	S	90.9	Very high	93.5	Very high	15 Å²	15	46.8 Å²	46.8	11%	0.105	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	164.3	175.8	60.3	0	0	0	0	111.7	E53 S95 G96 V97	E53-S93 WeakPolarHBondContact O-CA 3.5Å; S93-S95 PolarHBondContact O-N 3.04Å; S93-S95 VanDerWaalsContact O-N 3.08Å; S93-S95 PolarHBondContact OG-OG 2.87Å; S93-S95 VanDerWaalsContact OG-OG 3.04Å; S93-G96 PolarHBondContact O-N 2.75Å; S93-V97 PolarHBondContact N-O 2.73Å; S93-V97 WeakPolarHBondContact OG-CB 3.27Å; S93-V97 PolarHBondContact OG-N 2.61Å; S93-V97 VanDerWaalsContact OG-N 3.16Å; S93-V97 PolarHBondContact OG-O 2.98Å
94	K	88.6	Confident	93.5	Very high	153 Å²	153	50.3 Å²	50.3	67%	0.665	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-25.6	174.3	66.6	-169.7	174	-157.6	0	115	E53 G96	E53-K94 PolarHBondContact O-N 3.36Å; E53-K94 IonicContact OE1-NZ 3.34Å; E53-K94 PolarHBondContact OE1-NZ 2.94Å; K94-G96 VanDerWaalsContact C-N 3.29Å
95	S	85.3	Confident	93.6	Very high	92 Å²	92	48.6 Å²	48.6	64%	0.643	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-0.6	176	52.8	0	0	0	0	113.6	S93 V97	S93-S95 PolarHBondContact O-N 3.04Å; S93-S95 VanDerWaalsContact O-N 3.08Å; S93-S95 PolarHBondContact OG-OG 2.87Å; S93-S95 VanDerWaalsContact OG-OG 3.04Å; S95-V97 VanDerWaalsContact C-N 3.34Å
96	G	85.1	Confident	93.3	Very high	51 Å²	51	51.9 Å²	51.9	53%	0.526	28%	0.279	S	S	.	.	S	Bend	trans	84	3.3	-178.8	0	0	0	0	0	114.5	S93 K94	S93-G96 PolarHBondContact O-N 2.75Å; K94-G96 VanDerWaalsContact C-N 3.29Å
97	V	89.9	Confident	92.9	Very high	72 Å²	72	51.6 Å²	51.6	44%	0.436	28%	0.281	S	S	.	.			trans	-74.3	128.9	175.2	-177.1	0	0	0	0	109.1	S93 S95 Y99	S93-V97 PolarHBondContact N-O 2.73Å; S93-V97 WeakPolarHBondContact OG-CB 3.27Å; S93-V97 PolarHBondContact OG-N 2.61Å; S93-V97 VanDerWaalsContact OG-N 3.16Å; S93-V97 PolarHBondContact OG-O 2.98Å; S95-V97 VanDerWaalsContact C-N 3.34Å; V97-Y99 HydrophobicContact CB-CE2 3.88Å; V97-Y99 HydrophobicContact CG1-CD2 4.32Å; V97-Y99 HydrophobicContact CG1-CE2 3.64Å; V97-Y99 WeakPolarHBondContact O-CD2 3.21Å
98	Q	91.4	Very high	92.7	Very high	137 Å²	137	51.6 Å²	51.6	64%	0.64	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	139.3	176.7	-70.5	-174.9	-12.3	0	0	111	G91 T92	G91-Q98 CarbonylContact O-C 3.59Å; G91-Q98 VanDerWaalsContact O-CA 3.29Å; G91-Q98 WeakPolarHBondContact O-CA 3.42Å; T92-Q98 HydrophobicContact CG2-CG 4.47Å
99	Y	93.8	Very high	92.4	Very high	29 Å²	29	50.4 Å²	50.4	11%	0.114	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	152.7	178.8	-64.9	-95.3	0	0	0	109.3	T90 G91 V97 E127 P128 T130 L132	T90-Y99 CarbonylContact C-O 3.55Å; T90-Y99 VanDerWaalsContact CA-O 3.26Å; T90-Y99 WeakPolarHBondContact CA-O 3.49Å; G91-Y99 PolarHBondContact N-O 3.34Å; G91-Y99 PolarHBondContact O-N 2.96Å; V97-Y99 HydrophobicContact CB-CE2 3.88Å; V97-Y99 HydrophobicContact CG1-CD2 4.32Å; V97-Y99 HydrophobicContact CG1-CE2 3.64Å; V97-Y99 WeakPolarHBondContact O-CD2 3.21Å; Y99-E127 HydrophobicContact CD1-CB 4.46Å; Y99-P128 HydrophobicContact CE1-CG 3.85Å; Y99-P128 WeakPolarHBondContact CE1-O 3.47Å; Y99-T130 HydrophobicContact CD1-CG2 3.64Å; Y99-T130 HydrophobicContact CD2-CG2 4.38Å; Y99-T130 HydrophobicContact CE1-CG2 3.86Å; Y99-T130 HydrophobicContact CG-CG2 3.91Å; Y99-L132 HydrophobicContact CD2-CD1 3.61Å; Y99-L132 HydrophobicContact CE2-CD1 4.23Å; Y99-L132 HydrophobicContact CG-CD1 4.32Å
100	K	94.4	Very high	91.9	Very high	128 Å²	128	53.8 Å²	53.8	56%	0.557	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.9	147.4	175	-60.4	-174.8	-179.6	176.3	0	111.1	W89 T90 A124 E127	W89-K100 WeakPolarHBondContact O-CA 3.44Å; T90-K100 HydrophobicContact CG2-CG 4.28Å; K100-A124 HydrophobicContact CB-CB 4.32Å; K100-A124 PolarHBondContact O-N 2.9Å; K100-E127 PolarHBondContact N-OE1 2.95Å
101	G	94.7	Very high	91.1	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	-177.2	174.8	0	0	0	0	0	113.4	N88 W89 S122	N88-G101 WeakPolarHBondContact CA-O 3.5Å; W89-G101 PolarHBondContact N-O 2.93Å; W89-G101 VanDerWaalsContact NE1-C 3.26Å; W89-G101 PolarHBondContact O-N 3.29Å; G101-S122 CarbonylContact C-O 3.53Å; G101-S122 WeakPolarHBondContact CA-O 3.43Å
102	H	96.6	Very high	90.3	Very high	74 Å²	74	61 Å²	61	34%	0.343	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	152	-177.2	-52.9	-66.5	0	0	0	110.8	L87 N88 W89 S122	L87-H102 CarbonylContact O-C 3.51Å; L87-H102 VanDerWaalsContact O-CA 3.26Å; L87-H102 WeakPolarHBondContact O-CA 3.44Å; N88-H102 PolarHBondContact OD1-CE1 3.04Å; N88-H102 PolarHBondContact OD1-ND1 2.92Å; W89-H102 PolarHBondContact NE1-O 3.03Å; H102-S122 PolarHBondContact N-O 3.07Å; H102-S122 PolarHBondContact O-N 3.35Å
103	V	97.1	Very high	89.6	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	133.7	165.8	-176.2	0	0	0	0	108.3	K86 L87 I105 I119 S120 V121 M136 L144	K86-V103 CarbonylContact C-O 3.47Å; K86-V103 WeakPolarHBondContact CA-O 3.44Å; L87-V103 HydrophobicContact CB-CB 4.1Å; L87-V103 HydrophobicContact CD1-CB 4.34Å; L87-V103 HydrophobicContact CG-CB 4.47Å; L87-V103 PolarHBondContact N-O 2.88Å; L87-V103 PolarHBondContact O-N 3.32Å; V103-I105 HydrophobicContact CG1-CG1 4.33Å; V103-I119 HydrophobicContact CG1-CG2 3.6Å; V103-S120 CarbonylContact C-O 3.53Å; V103-S120 WeakPolarHBondContact CA-O 3.26Å; V103-S120 WeakPolarHBondContact CG1-O 3.3Å; V103-V121 HydrophobicContact CG1-CG2 4.35Å; V103-V121 HydrophobicContact CG2-CG1 4.44Å; V103-V121 HydrophobicContact CG2-CG2 4.16Å; V103-M136 HydrophobicContact CG2-CE 4.36Å; V103-L144 HydrophobicContact CG1-CD1 3.87Å; V103-L144 HydrophobicContact CG2-CD1 4.32Å
104	E	96.1	Very high	89.1	Confident	76 Å²	76	61 Å²	61	36%	0.355	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	133.1	173.2	-47.7	-166	157.7	0	0	111.1	K86 S120	K86-E104 HydrophobicContact CD-CG 4.37Å; K86-E104 WeakPolarHBondContact CE-OE1 3.27Å; K86-E104 HydrophobicContact CG-CG 4.21Å; K86-E104 IonicContact NZ-OE1 3.69Å; K86-E104 PolarHBondContact NZ-OE1 3.49Å; K86-E104 IonicContact NZ-OE2 2.77Å; E104-S120 WeakPolarHBondContact CB-OG 3.28Å; E104-S120 PolarHBondContact N-O 2.83Å; E104-S120 PolarHBondContact O-N 2.86Å; E104-S120 PolarHBondContact O-OG 3.26Å
105	I	95.8	Very high	88.8	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	93.8	177.9	-49	179.4	0	0	0	106.5	F44 S84 V85 V103 L108 V117 I119 M148	F44-I105 HydrophobicContact CE1-CD1 4.42Å; F44-I105 HydrophobicContact CZ-CD1 4.26Å; S84-I105 WeakPolarHBondContact CA-O 3.26Å; V85-I105 HydrophobicContact CB-CB 4.06Å; V85-I105 HydrophobicContact CB-CD1 4.49Å; V85-I105 HydrophobicContact CB-CG1 4.47Å; V85-I105 HydrophobicContact CG2-CB 4.36Å; V85-I105 PolarHBondContact N-O 2.94Å; V85-I105 PolarHBondContact O-N 2.88Å; V103-I105 HydrophobicContact CG1-CG1 4.33Å; I105-L108 HydrophobicContact CG2-CB 4.39Å; I105-V117 HydrophobicContact CG2-CG1 3.42Å; I105-V117 VanDerWaalsContact CG2-CG1 3.42Å; I105-I119 HydrophobicContact CD1-CG1 4.45Å; I105-I119 HydrophobicContact CG1-CG1 4.21Å; I105-I119 HydrophobicContact CG1-CG2 4.28Å; I105-M148 HydrophobicContact CD1-SD 4.03Å; I105-M148 HydrophobicContact CG2-CE 4.21Å
106	P	89.8	Confident	88.7	Confident	70 Å²	70	60.9 Å²	60.9	46%	0.455	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	-25.6	-166.3	28.4	-33.7	0	0	0	114.2	E118	P106-E118 WeakPolarHBondContact CD-O 3.46Å
107	N	88.3	Confident	88.8	Confident	67 Å²	67	58.7 Å²	58.7	36%	0.358	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	78.3	-171.8	-177	19.8	0	0	0	111.6	N112	N107-N112 PolarHBondContact ND2-OD1 3.42Å; N107-N112 VanDerWaalsContact ND2-OD1 3.08Å
108	L	91.4	Very high	88.8	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	102	165.1	167.8	56	0	0	0	108.5	L40 Y81 E82 W83 I105 V117 M148 I152	L40-L108 HydrophobicContact CD2-CD2 4.36Å; Y81-L108 HydrophobicContact CE2-CD1 4.07Å; Y81-L108 HydrophobicContact CE2-CG 4.37Å; E82-L108 CarbonylContact C-O 3.47Å; E82-L108 WeakPolarHBondContact CA-O 3.42Å; W83-L108 HydrophobicContact CB-CB 4.2Å; W83-L108 HydrophobicContact CB-CD2 4.46Å; W83-L108 HydrophobicContact CB-CG 4.47Å; W83-L108 PolarHBondContact N-O 3.37Å; W83-L108 PolarHBondContact O-N 3.11Å; I105-L108 HydrophobicContact CG2-CB 4.39Å; L108-V117 HydrophobicContact CD1-CG2 4.41Å; L108-M148 HydrophobicContact CB-CE 4.15Å; L108-M148 HydrophobicContact CD1-CE 3.55Å; L108-M148 HydrophobicContact CD2-CB 4.5Å; L108-M148 HydrophobicContact CD2-CE 3.96Å; L108-M148 HydrophobicContact CD2-CG 4.08Å; L108-M148 HydrophobicContact CG-CE 4.07Å; L108-I152 HydrophobicContact CD1-CD1 4.45Å
109	S	90.9	Very high	88.9	Confident	7 Å²	7	56.6 Å²	56.6	5%	0.049	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	170	-177.3	72.7	0	0	0	0	113.4	Y81 E111 N112	Y81-S109 WeakPolarHBondContact CE2-O 3.43Å; Y81-S109 CarbonylContact O-C 3.51Å; Y81-S109 WeakPolarHBondContact O-CA 3.33Å; Y81-S109 PolarHBondContact OH-O 2.93Å; S109-E111 PolarHBondContact O-N 3.48Å; S109-E111 PolarHBondContact OG-N 2.87Å; S109-N112 PolarHBondContact O-N 3.42Å; S109-N112 PolarHBondContact OG-N 3.19Å; S109-N112 PolarHBondContact OG-OD1 2.99Å
110	D	86.6	Confident	88.9	Confident	72 Å²	72	57.2 Å²	57.2	39%	0.385	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-15.6	172.3	66	-81.6	0	0	0	113.6	Y81	Y81-D110 HydrophobicContact CD1-CB 3.92Å; Y81-D110 HydrophobicContact CE1-CB 3.65Å; Y81-D110 HydrophobicContact CE2-CB 4.47Å; Y81-D110 HydrophobicContact CG-CB 4.45Å; Y81-D110 PolarHBondContact N-OD1 2.9Å; Y81-D110 PolarHBondContact O-N 3.12Å; Y81-D110 VanDerWaalsContact O-N 3.1Å
111	E	77.9	Confident	89	Confident	138 Å²	138	51.6 Å²	51.6	65%	0.645	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-21	176.1	-61.5	-153.8	133.2	0	0	113.1	S109 R321	S109-E111 PolarHBondContact O-N 3.48Å; S109-E111 PolarHBondContact OG-N 2.87Å; E111-R321 IonicContact OE1-NH2 3.32Å
112	N	77.3	Confident	88.9	Confident	46 Å²	46	54.1 Å²	54.1	25%	0.246	29%	0.288	C	S	.	.	S	Bend	trans	-109	135.7	-177	-64.1	108.1	0	0	0	111.9	N107 S109 V117	N107-N112 PolarHBondContact ND2-OD1 3.42Å; N107-N112 VanDerWaalsContact ND2-OD1 3.08Å; S109-N112 PolarHBondContact O-N 3.42Å; S109-N112 PolarHBondContact OG-N 3.19Å; S109-N112 PolarHBondContact OG-OD1 2.99Å; N112-V117 HydrophobicContact CB-CG2 4.18Å
113	S	79.1	Confident	88.8	Confident	46 Å²	46	52.2 Å²	52.2	32%	0.322	28%	0.28	S	S	.	.			trans	-71.1	150.8	168.8	76	0	0	0	0	110.2	D115 E116 V117	S113-D115 PolarHBondContact O-N 3.3Å; S113-E116 PolarHBondContact O-N 3.38Å; S113-E116 VanDerWaalsContact OG-CG 3.27Å; S113-E116 WeakPolarHBondContact OG-CG 3.34Å; S113-E116 PolarHBondContact OG-OE1 2.94Å; S113-V117 PolarHBondContact O-N 3.26Å
114	V	81.9	Confident	88.5	Confident	23 Å²	23	53.3 Å²	53.3	14%	0.139	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-26.7	-179.5	179.6	0	0	0	0	111.9	R145 M148 I152	V114-R145 HydrophobicContact CG1-CB 3.86Å; V114-R145 HydrophobicContact CG1-CG 4.18Å; V114-R145 VanDerWaalsContact CG1-O 3.27Å; V114-R145 WeakPolarHBondContact CG1-O 3.49Å; V114-R145 PolarHBondContact O-NH1 3.35Å; V114-M148 HydrophobicContact CG1-CB 3.84Å; V114-M148 HydrophobicContact CG1-CE 4.27Å; V114-M148 HydrophobicContact CG1-SD 4.49Å; V114-M148 HydrophobicContact CG2-CB 4.35Å; V114-I152 HydrophobicContact CG2-CD1 3.34Å
115	D	81.6	Confident	87.8	Confident	128 Å²	128	59.8 Å²	59.8	68%	0.684	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-27.7	178.5	-59.6	-49.5	0	0	0	113	S113	S113-D115 PolarHBondContact O-N 3.3Å
116	E	82.9	Confident	87.3	Confident	114 Å²	114	67.5 Å²	67.5	53%	0.533	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-20.9	179.4	-72.6	158	-139.9	0	0	113	S113 E118	S113-E116 PolarHBondContact O-N 3.38Å; S113-E116 VanDerWaalsContact OG-CG 3.27Å; S113-E116 WeakPolarHBondContact OG-CG 3.34Å; S113-E116 PolarHBondContact OG-OE1 2.94Å; E116-E118 PolarHBondContact O-N 3.3Å
117	V	87.3	Confident	87.1	Confident	4 Å²	4	66.9 Å²	66.9	2%	0.024	35%	0.349	C	S	.	.	S	Bend	trans	-63.4	127.5	-179.1	179.6	0	0	0	0	110.2	I105 L108 N112 S113 R145 M148	I105-V117 HydrophobicContact CG2-CG1 3.42Å; I105-V117 VanDerWaalsContact CG2-CG1 3.42Å; L108-V117 HydrophobicContact CD1-CG2 4.41Å; N112-V117 HydrophobicContact CB-CG2 4.18Å; S113-V117 PolarHBondContact O-N 3.26Å; V117-R145 VanDerWaalsContact O-CZ 3.29Å; V117-R145 PolarHBondContact O-NH1 2.85Å; V117-R145 PolarHBondContact O-NH2 3.29Å; V117-M148 HydrophobicContact CB-CE 3.92Å; V117-M148 HydrophobicContact CG1-CE 3.81Å; V117-M148 HydrophobicContact CG2-CE 3.93Å
118	E	89	Confident	86.9	Confident	143 Å²	143	67.5 Å²	67.5	67%	0.668	36%	0.356	S	S	*	.			trans	-71.1	129.2	173.3	-171.8	178.7	177.4	0	0	110.2	P106 E116	P106-E118 WeakPolarHBondContact CD-O 3.46Å; E116-E118 PolarHBondContact O-N 3.3Å
119	I	94.5	Very high	86.6	Confident	22 Å²	22	74.5 Å²	74.5	11%	0.113	39%	0.394	C	S	.	.			trans	-123.8	111.8	175.5	-58.1	175.1	0	0	0	107.3	V103 I105 V141 L144 R145 M148	V103-I119 HydrophobicContact CG1-CG2 3.6Å; I105-I119 HydrophobicContact CD1-CG1 4.45Å; I105-I119 HydrophobicContact CG1-CG1 4.21Å; I105-I119 HydrophobicContact CG1-CG2 4.28Å; I119-V141 HydrophobicContact CB-CG1 4.18Å; I119-V141 HydrophobicContact CB-CG2 4.42Å; I119-V141 HydrophobicContact CD1-CG1 3.99Å; I119-V141 HydrophobicContact CG2-CG1 4.41Å; I119-V141 HydrophobicContact CG2-CG2 3.96Å; I119-L144 HydrophobicContact CD1-CB 4.4Å; I119-L144 HydrophobicContact CG2-CD1 4.24Å; I119-R145 HydrophobicContact CD1-CG 3.64Å; I119-M148 HydrophobicContact CD1-SD 4.1Å
120	S	93.9	Very high	86.5	Confident	43 Å²	43	75 Å²	75	30%	0.301	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	134	178.9	68.8	0	0	0	0	110.2	V103 E104	V103-S120 CarbonylContact C-O 3.53Å; V103-S120 WeakPolarHBondContact CA-O 3.26Å; V103-S120 WeakPolarHBondContact CG1-O 3.3Å; E104-S120 WeakPolarHBondContact CB-OG 3.28Å; E104-S120 PolarHBondContact N-O 2.83Å; E104-S120 PolarHBondContact O-N 2.86Å; E104-S120 PolarHBondContact O-OG 3.26Å
121	V	95.5	Very high	86.6	Confident	9 Å²	9	76.3 Å²	76.3	6%	0.055	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	128.3	178.6	-177.6	0	0	0	0	108.9	W89 V103 M136 K137 V141	W89-V121 HydrophobicContact CZ2-CG1 4.47Å; V103-V121 HydrophobicContact CG1-CG2 4.35Å; V103-V121 HydrophobicContact CG2-CG1 4.44Å; V103-V121 HydrophobicContact CG2-CG2 4.16Å; V121-M136 HydrophobicContact CG1-CB 3.78Å; V121-K137 HydrophobicContact CB-CG 3.74Å; V121-K137 HydrophobicContact CG1-CG 4.29Å; V121-K137 HydrophobicContact CG2-CG 4.15Å; V121-K137 WeakPolarHBondContact O-CE 3.41Å; V121-V141 HydrophobicContact CG2-CG2 3.83Å
122	S	93.9	Very high	87.2	Confident	54 Å²	54	69.8 Å²	69.8	38%	0.378	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	159.9	-179	64.6	0	0	0	0	112.5	W89 G101 H102	W89-S122 PolarHBondContact NE1-O 3.39Å; G101-S122 CarbonylContact C-O 3.53Å; G101-S122 WeakPolarHBondContact CA-O 3.43Å; H102-S122 PolarHBondContact N-O 3.07Å; H102-S122 PolarHBondContact O-N 3.35Å
123	L	93.7	Very high	87.9	Confident	34 Å²	34	68.3 Å²	68.3	18%	0.178	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	159.7	167	-72	166.5	0	0	0	111.2	W89 E127 T130 V133	W89-L123 HydrophobicContact CH2-CD2 3.89Å; W89-L123 HydrophobicContact CZ2-CD2 3.94Å; L123-E127 HydrophobicContact CB-CB 4.26Å; L123-E127 HydrophobicContact CD2-CB 4.38Å; L123-T130 HydrophobicContact CD1-CG2 4.02Å; L123-T130 HydrophobicContact CD2-CG2 3.86Å; L123-V133 HydrophobicContact CD1-CG2 3.49Å; L123-V133 VanDerWaalsContact CD1-CG2 3.49Å; L123-V133 HydrophobicContact CD2-CG2 3.52Å; L123-V133 HydrophobicContact CG-CG2 3.25Å
124	A	91.7	Very high	88.5	Confident	23 Å²	23	68.5 Å²	68.5	19%	0.19	37%	0.37	C	S	.	.			trans	-66.2	151.1	165.4	0	0	0	0	0	110.2	K100 D126 E127	K100-A124 HydrophobicContact CB-CB 4.32Å; K100-A124 PolarHBondContact O-N 2.9Å; A124-D126 PolarHBondContact O-N 3.49Å; A124-E127 HydrophobicContact CB-CG 3.96Å; A124-E127 PolarHBondContact O-N 3.31Å; A124-E127 VanDerWaalsContact O-N 3.11Å
125	K	81.6	Confident	89	Confident	212 Å²	212	67.7 Å²	67.7	92%	0.922	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.3	-168.6	-70.3	-178.3	179.1	177.2	0	115.4
126	D	83.5	Confident	89.6	Confident	163 Å²	163	61.6 Å²	61.6	87%	0.872	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	5.1	-175.3	-56.1	-49.8	0	0	0	113.1	A124	A124-D126 PolarHBondContact O-N 3.49Å
127	E	85.6	Confident	90.1	Very high	57 Å²	57	61.6 Å²	61.6	27%	0.266	33%	0.33	S	S	.	.	S	Bend	trans	-92.3	135.9	-177.6	-66.9	-71.9	178.2	0	0	111.3	Y99 K100 L123 A124	Y99-E127 HydrophobicContact CD1-CB 4.46Å; K100-E127 PolarHBondContact N-OE1 2.95Å; L123-E127 HydrophobicContact CB-CB 4.26Å; L123-E127 HydrophobicContact CD2-CB 4.38Å; A124-E127 HydrophobicContact CB-CG 3.96Å; A124-E127 PolarHBondContact O-N 3.31Å; A124-E127 VanDerWaalsContact O-N 3.11Å
128	P	85.8	Confident	90.3	Very high	79 Å²	79	67.7 Å²	67.7	51%	0.513	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-69.4	154.8	175.2	21.9	-20.6	0	0	0	111	Y99	Y99-P128 HydrophobicContact CE1-CG 3.85Å; Y99-P128 WeakPolarHBondContact CE1-O 3.47Å
129	D	84.1	Confident	90.5	Very high	148 Å²	148	64.5 Å²	64.5	79%	0.791	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-59.4	142.6	179.8	-164.1	20.5	0	0	0	111.5
130	T	88.3	Confident	90.5	Very high	18 Å²	18	63.5 Å²	63.5	11%	0.11	34%	0.339	C	S	.	.			trans	-154	144.2	-173.2	-179.4	0	0	0	0	112	Y99 L123 L132 V133	Y99-T130 HydrophobicContact CD1-CG2 3.64Å; Y99-T130 HydrophobicContact CD2-CG2 4.38Å; Y99-T130 HydrophobicContact CE1-CG2 3.86Å; Y99-T130 HydrophobicContact CG-CG2 3.91Å; L123-T130 HydrophobicContact CD1-CG2 4.02Å; L123-T130 HydrophobicContact CD2-CG2 3.86Å; T130-L132 HydrophobicContact CG2-CB 3.94Å; T130-L132 HydrophobicContact CG2-CG 4.49Å; T130-L132 PolarHBondContact O-N 2.98Å; T130-L132 VanDerWaalsContact O-N 3.11Å; T130-L132 WeakPolarHBondContact OG1-CG 3.05Å; T130-L132 PolarHBondContact OG1-N 2.96Å; T130-V133 HydrophobicContact CG2-CG2 4.05Å; T130-V133 PolarHBondContact O-N 3.05Å
131	N	89.6	Confident	90.6	Very high	99 Å²	99	62.3 Å²	62.3	53%	0.529	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-14.3	175.8	-66	-21.5	0	0	0	112.8	E53 V133 A134 L135	E53-N131 HydrophobicContact CB-CB 4.32Å; E53-N131 HydrophobicContact CG-CB 3.99Å; E53-N131 VanDerWaalsContact OE2-CB 3.29Å; E53-N131 WeakPolarHBondContact OE2-CB 3.25Å; E53-N131 PolarHBondContact OE2-ND2 3.38Å; N131-V133 PolarHBondContact O-N 2.84Å; N131-A134 WeakPolarHBondContact O-CB 3.37Å; N131-A134 PolarHBondContact O-N 3.3Å; N131-A134 VanDerWaalsContact O-N 3.12Å; N131-L135 PolarHBondContact O-N 3.22Å; N131-L135 VanDerWaalsContact O-N 3.09Å
132	L	90	Very high	90.5	Very high	1 Å²	1	68.8 Å²	68.8	1%	0.005	36%	0.357	C	S	.	.	H	α-helix	trans	-62.7	-26.3	174.8	-63.2	-179.5	0	0	0	113	E53 W89 Y99 T130 L135 M136	E53-L132 HydrophobicContact CB-CD2 4.44Å; W89-L132 HydrophobicContact CH2-CB 4.32Å; W89-L132 HydrophobicContact CZ3-CB 4.33Å; Y99-L132 HydrophobicContact CD2-CD1 3.61Å; Y99-L132 HydrophobicContact CE2-CD1 4.23Å; Y99-L132 HydrophobicContact CG-CD1 4.32Å; T130-L132 HydrophobicContact CG2-CB 3.94Å; T130-L132 HydrophobicContact CG2-CG 4.49Å; T130-L132 PolarHBondContact O-N 2.98Å; T130-L132 VanDerWaalsContact O-N 3.11Å; T130-L132 WeakPolarHBondContact OG1-CG 3.05Å; T130-L132 PolarHBondContact OG1-N 2.96Å; L132-L135 HydrophobicContact CD2-CD2 4.37Å; L132-M136 PolarHBondContact O-N 2.84Å
133	V	92.3	Very high	90.6	Very high	15 Å²	15	69 Å²	69	9%	0.091	35%	0.354	C	S	.	.	H	α-helix	trans	-67.9	-42.6	173.4	-176	0	0	0	0	110.9	W89 L123 T130 N131 L135 M136 K137	W89-V133 HydrophobicContact CH2-CG2 4.32Å; W89-V133 HydrophobicContact CZ2-CG2 4.3Å; L123-V133 HydrophobicContact CD1-CG2 3.49Å; L123-V133 VanDerWaalsContact CD1-CG2 3.49Å; L123-V133 HydrophobicContact CD2-CG2 3.52Å; L123-V133 HydrophobicContact CG-CG2 3.25Å; T130-V133 HydrophobicContact CG2-CG2 4.05Å; T130-V133 PolarHBondContact O-N 3.05Å; N131-V133 PolarHBondContact O-N 2.84Å; V133-L135 VanDerWaalsContact C-N 3.33Å; V133-M136 PolarHBondContact O-N 3.15Å; V133-K137 HydrophobicContact CG1-CD 4.13Å; V133-K137 HydrophobicContact CG1-CG 4.47Å; V133-K137 WeakPolarHBondContact O-CB 3.31Å; V133-K137 WeakPolarHBondContact O-CG 3.4Å; V133-K137 PolarHBondContact O-N 2.81Å
134	A	91.9	Very high	90.6	Very high	49 Å²	49	67.4 Å²	67.4	41%	0.405	35%	0.345	S	S	.	.	H	α-helix	trans	-63.6	-42.9	177.1	0	0	0	0	0	110.5	N131 M136 K137 E138	N131-A134 WeakPolarHBondContact O-CB 3.37Å; N131-A134 PolarHBondContact O-N 3.3Å; N131-A134 VanDerWaalsContact O-N 3.12Å; A134-M136 PolarHBondContact O-N 2.8Å; A134-K137 PolarHBondContact O-N 3.3Å; A134-K137 VanDerWaalsContact O-N 3.16Å; A134-E138 PolarHBondContact O-N 2.9Å
135	L	93.2	Very high	90.8	Very high	6 Å²	6	69 Å²	69	3%	0.031	35%	0.346	C	S	.	.	H	α-helix	trans	-55.6	-49.2	172.2	172.5	59.2	0	0	0	111.9	V49 N51 N131 L132 V133 K137 E138 E139 G140	V49-L135 HydrophobicContact CB-CD1 4.29Å; V49-L135 HydrophobicContact CB-CG 4.44Å; V49-L135 HydrophobicContact CG2-CD1 4.17Å; V49-L135 HydrophobicContact CG2-CD2 4Å; V49-L135 HydrophobicContact CG2-CG 3.79Å; N51-L135 HydrophobicContact CB-CD1 4.08Å; N51-L135 WeakPolarHBondContact ND2-CD1 3.35Å; N51-L135 WeakPolarHBondContact OD1-CD2 3.43Å; N131-L135 PolarHBondContact O-N 3.22Å; N131-L135 VanDerWaalsContact O-N 3.09Å; L132-L135 HydrophobicContact CD2-CD2 4.37Å; V133-L135 VanDerWaalsContact C-N 3.33Å; L135-K137 VanDerWaalsContact C-N 3.32Å; L135-K137 PolarHBondContact O-N 3.4Å; L135-E138 PolarHBondContact O-N 3.03Å; L135-E139 HydrophobicContact CD1-CB 3.98Å; L135-E139 HydrophobicContact CD1-CG 3.94Å; L135-E139 PolarHBondContact O-N 3.06Å; L135-G140 PolarHBondContact O-N 2.79Å
136	M	94.1	Very high	91.4	Very high	1 Å²	1	64.6 Å²	64.6	1%	0.005	33%	0.329	C	S	.	.	I	π-helix	trans	-65.2	-34.6	178	-81.3	-62.3	-72.9	0	0	112.7	V49 C56 V58 W89 V103 V121 L132 V133 A134 G140 V141	V49-M136 HydrophobicContact CG2-SD 3.68Å; C56-M136 HydrophobicContact CB-CG 3.58Å; C56-M136 HydrophobicContact CB-SD 3.46Å; C56-M136 WeakPolarHBondContact CB-SD 3.34Å; V58-M136 HydrophobicContact CG2-CE 4.46Å; W89-M136 HydrophobicContact CB-CE 3.97Å; W89-M136 HydrophobicContact CD2-CE 4.29Å; W89-M136 HydrophobicContact CD2-CG 3.93Å; W89-M136 HydrophobicContact CE3-CG 3.82Å; W89-M136 HydrophobicContact CG-CE 3.92Å; W89-M136 HydrophobicContact CH2-CG 4.32Å; W89-M136 HydrophobicContact CZ2-CG 4.4Å; W89-M136 HydrophobicContact CZ3-CG 4.03Å; V103-M136 HydrophobicContact CG2-CE 4.36Å; V121-M136 HydrophobicContact CG1-CB 3.78Å; L132-M136 PolarHBondContact O-N 2.84Å; V133-M136 PolarHBondContact O-N 3.15Å; A134-M136 PolarHBondContact O-N 2.8Å; M136-G140 CarbonylContact O-C 3.59Å; M136-G140 WeakPolarHBondContact O-CA 3.4Å; M136-G140 PolarHBondContact O-N 2.83Å; M136-G140 VanDerWaalsContact O-N 3.16Å; M136-V141 PolarHBondContact O-N 3.06Å
137	K	93.6	Very high	91.9	Very high	113 Å²	113	57.1 Å²	57.1	49%	0.491	29%	0.29	S	S	.	.	I	π-helix	trans	-69.5	-34.7	175.9	-77	177.8	178.1	-179.9	0	113.3	V121 V133 A134 L135 V141	V121-K137 HydrophobicContact CB-CG 3.74Å; V121-K137 HydrophobicContact CG1-CG 4.29Å; V121-K137 HydrophobicContact CG2-CG 4.15Å; V121-K137 WeakPolarHBondContact O-CE 3.41Å; V133-K137 HydrophobicContact CG1-CD 4.13Å; V133-K137 HydrophobicContact CG1-CG 4.47Å; V133-K137 WeakPolarHBondContact O-CB 3.31Å; V133-K137 WeakPolarHBondContact O-CG 3.4Å; V133-K137 PolarHBondContact O-N 2.81Å; A134-K137 PolarHBondContact O-N 3.3Å; A134-K137 VanDerWaalsContact O-N 3.16Å; L135-K137 VanDerWaalsContact C-N 3.32Å; L135-K137 PolarHBondContact O-N 3.4Å; K137-V141 VanDerWaalsContact O-CB 3.31Å; K137-V141 WeakPolarHBondContact O-CB 3.38Å; K137-V141 VanDerWaalsContact O-CG2 3.25Å; K137-V141 WeakPolarHBondContact O-CG2 3.33Å
138	E	91.4	Very high	92.4	Very high	132 Å²	132	54.4 Å²	54.4	62%	0.617	28%	0.277	S	S	*	.	I	π-helix	trans	-91.2	-51.7	-176.2	-71.5	-173.3	175.9	0	0	113.1	A134 L135 K142	A134-E138 PolarHBondContact O-N 2.9Å; L135-E138 PolarHBondContact O-N 3.03Å; E138-K142 VanDerWaalsContact O-CD 3.24Å; E138-K142 WeakPolarHBondContact O-CD 3.17Å; E138-K142 VanDerWaalsContact O-CE 3.22Å; E138-K142 WeakPolarHBondContact O-CE 3.41Å; E138-K142 VanDerWaalsContact O-CG 3.28Å; E138-K142 WeakPolarHBondContact O-CG 3.37Å
139	E	93.5	Very high	92.8	Very high	77 Å²	77	52.1 Å²	52.1	36%	0.36	27%	0.268	S	S	.	.	I	π-helix	trans	-95.8	-41.4	-177.5	-62.8	-172.2	-173	0	0	111.6	V49 L135 V141 K142 L143	V49-E139 HydrophobicContact CB-CB 4.28Å; V49-E139 HydrophobicContact CG1-CB 3.84Å; L135-E139 HydrophobicContact CD1-CB 3.98Å; L135-E139 HydrophobicContact CD1-CG 3.94Å; L135-E139 PolarHBondContact O-N 3.06Å; E139-V141 PolarHBondContact O-N 3.43Å; E139-K142 WeakPolarHBondContact O-CB 3.43Å; E139-K142 PolarHBondContact O-N 2.81Å; E139-K142 VanDerWaalsContact O-N 3.14Å; E139-L143 PolarHBondContact O-N 2.84Å; E139-L143 VanDerWaalsContact O-N 3.14Å
140	G	93.8	Very high	93.2	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.247	C	C	.	.	I	π-helix	trans	-61.3	-44.7	-179.1	0	0	0	0	0	111.8	L135 M136 K142 L143 L144	L135-G140 PolarHBondContact O-N 2.79Å; M136-G140 CarbonylContact O-C 3.59Å; M136-G140 WeakPolarHBondContact O-CA 3.4Å; M136-G140 PolarHBondContact O-N 2.83Å; M136-G140 VanDerWaalsContact O-N 3.16Å; G140-K142 VanDerWaalsContact C-N 3.31Å; G140-K142 PolarHBondContact O-N 3.31Å; G140-L143 PolarHBondContact O-N 3.42Å; G140-L144 WeakPolarHBondContact O-CB 3.27Å; G140-L144 VanDerWaalsContact O-CG 3.27Å; G140-L144 WeakPolarHBondContact O-CG 3.33Å; G140-L144 PolarHBondContact O-N 3.28Å
141	V	94.9	Very high	93.5	Very high	18 Å²	18	47.5 Å²	47.5	11%	0.109	24%	0.242	C	C	.	.	H	α-helix	trans	-60.3	-38.4	175.5	173.3	0	0	0	0	111.9	I119 V121 M136 K137 E139 L144 R145	I119-V141 HydrophobicContact CB-CG1 4.18Å; I119-V141 HydrophobicContact CB-CG2 4.42Å; I119-V141 HydrophobicContact CD1-CG1 3.99Å; I119-V141 HydrophobicContact CG2-CG1 4.41Å; I119-V141 HydrophobicContact CG2-CG2 3.96Å; V121-V141 HydrophobicContact CG2-CG2 3.83Å; M136-V141 PolarHBondContact O-N 3.06Å; K137-V141 VanDerWaalsContact O-CB 3.31Å; K137-V141 WeakPolarHBondContact O-CB 3.38Å; K137-V141 VanDerWaalsContact O-CG2 3.25Å; K137-V141 WeakPolarHBondContact O-CG2 3.33Å; E139-V141 PolarHBondContact O-N 3.43Å; V141-L144 PolarHBondContact O-N 3.41Å; V141-R145 WeakPolarHBondContact O-CG 3.47Å; V141-R145 PolarHBondContact O-N 3.31Å
142	K	94.9	Very high	93.6	Very high	145 Å²	145	43.7 Å²	43.7	63%	0.63	22%	0.221	S	C	*	.	H	α-helix	trans	-62.8	-46	176.9	-70.8	171.5	-172.4	168	0	111.4	E138 E139 G140 R145 E146	E138-K142 VanDerWaalsContact O-CD 3.24Å; E138-K142 WeakPolarHBondContact O-CD 3.17Å; E138-K142 VanDerWaalsContact O-CE 3.22Å; E138-K142 WeakPolarHBondContact O-CE 3.41Å; E138-K142 VanDerWaalsContact O-CG 3.28Å; E138-K142 WeakPolarHBondContact O-CG 3.37Å; E139-K142 WeakPolarHBondContact O-CB 3.43Å; E139-K142 PolarHBondContact O-N 2.81Å; E139-K142 VanDerWaalsContact O-N 3.14Å; G140-K142 VanDerWaalsContact C-N 3.31Å; G140-K142 PolarHBondContact O-N 3.31Å; K142-R145 PolarHBondContact O-N 2.75Å; K142-E146 PolarHBondContact O-N 3.2Å
143	L	95	Very high	93.6	Very high	60 Å²	60	46.8 Å²	46.8	31%	0.314	24%	0.243	S	C	.	.	H	α-helix	trans	-67.8	-35.7	177.2	-67.4	-175.1	0	0	0	112.5	V47 Q48 V49 E139 G140 E146 A147	V47-L143 HydrophobicContact CG1-CB 3.88Å; V47-L143 HydrophobicContact CG1-CD1 4.32Å; V47-L143 HydrophobicContact CG2-CB 4.38Å; Q48-L143 VanDerWaalsContact O-CD1 3.26Å; Q48-L143 WeakPolarHBondContact O-CD1 3.47Å; V49-L143 HydrophobicContact CG1-CD1 3.55Å; V49-L143 HydrophobicContact CG1-CG 4.36Å; E139-L143 PolarHBondContact O-N 2.84Å; E139-L143 VanDerWaalsContact O-N 3.14Å; G140-L143 PolarHBondContact O-N 3.42Å; L143-E146 PolarHBondContact O-N 3.32Å; L143-A147 WeakPolarHBondContact O-CB 3.32Å; L143-A147 PolarHBondContact O-N 2.71Å
144	L	95	Very high	93.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.3	-41.8	173.5	-73.5	166.2	0	0	0	111.6	F44 V47 L87 V103 I119 G140 V141 A147 M148	F44-L144 HydrophobicContact CD1-CD2 3.7Å; F44-L144 HydrophobicContact CE1-CD2 4.15Å; V47-L144 HydrophobicContact CG1-CD2 4.49Å; V47-L144 HydrophobicContact CG1-CG 4.37Å; V47-L144 HydrophobicContact CG2-CD2 4.08Å; L87-L144 HydrophobicContact CD1-CD2 3.55Å; V103-L144 HydrophobicContact CG1-CD1 3.87Å; V103-L144 HydrophobicContact CG2-CD1 4.32Å; I119-L144 HydrophobicContact CD1-CB 4.4Å; I119-L144 HydrophobicContact CG2-CD1 4.24Å; G140-L144 WeakPolarHBondContact O-CB 3.27Å; G140-L144 VanDerWaalsContact O-CG 3.27Å; G140-L144 WeakPolarHBondContact O-CG 3.33Å; G140-L144 PolarHBondContact O-N 3.28Å; V141-L144 PolarHBondContact O-N 3.41Å; L144-A147 WeakPolarHBondContact O-CB 3.39Å; L144-A147 PolarHBondContact O-N 2.85Å; L144-M148 VanDerWaalsContact O-CG 3.26Å; L144-M148 WeakPolarHBondContact O-CG 3.35Å; L144-M148 PolarHBondContact O-N 3.01Å
145	R	94.6	Very high	93.3	Very high	56 Å²	56	44.4 Å²	44.4	21%	0.211	22%	0.224	C	C	.	.	H	α-helix	trans	-62.9	-44.6	172.7	-72.8	-171.6	-169.3	-64.9	2.2	111.4	V114 V117 I119 V141 K142 A147 M148 G149	V114-R145 HydrophobicContact CG1-CB 3.86Å; V114-R145 HydrophobicContact CG1-CG 4.18Å; V114-R145 VanDerWaalsContact CG1-O 3.27Å; V114-R145 WeakPolarHBondContact CG1-O 3.49Å; V114-R145 PolarHBondContact O-NH1 3.35Å; V117-R145 VanDerWaalsContact O-CZ 3.29Å; V117-R145 PolarHBondContact O-NH1 2.85Å; V117-R145 PolarHBondContact O-NH2 3.29Å; I119-R145 HydrophobicContact CD1-CG 3.64Å; V141-R145 WeakPolarHBondContact O-CG 3.47Å; V141-R145 PolarHBondContact O-N 3.31Å; K142-R145 PolarHBondContact O-N 2.75Å; R145-A147 VanDerWaalsContact C-N 3.33Å; R145-A147 PolarHBondContact O-N 3.17Å; R145-M148 PolarHBondContact O-N 3.22Å; R145-G149 PolarHBondContact O-N 3.31Å
146	E	94.6	Very high	92.9	Very high	120 Å²	120	49.5 Å²	49.5	56%	0.561	25%	0.245	S	C	*	.	H	α-helix	trans	-59	-45	175.8	-172.4	177.2	175	0	0	111.6	K142 L143 M148 G149 I150	K142-E146 PolarHBondContact O-N 3.2Å; L143-E146 PolarHBondContact O-N 3.32Å; E146-M148 PolarHBondContact O-N 2.82Å; E146-G149 PolarHBondContact O-N 2.93Å; E146-G149 VanDerWaalsContact O-N 3.12Å; E146-I150 HydrophobicContact CG-CD1 4.16Å; E146-I150 WeakPolarHBondContact O-CG1 3.48Å; E146-I150 PolarHBondContact O-N 2.89Å
147	A	94.5	Very high	92.4	Very high	6 Å²	6	53.4 Å²	53.4	5%	0.05	27%	0.27	C	S	.	.	H	α-helix	trans	-56.8	-45.3	174.2	0	0	0	0	0	112.3	L43 F44 V47 L143 L144 R145 G149 I150 Y151	L43-A147 HydrophobicContact CB-CB 4.04Å; L43-A147 WeakPolarHBondContact CD1-O 3.38Å; F44-A147 HydrophobicContact CD1-CB 4.15Å; F44-A147 HydrophobicContact CE1-CB 4.26Å; V47-A147 HydrophobicContact CG2-CB 4.46Å; L143-A147 WeakPolarHBondContact O-CB 3.32Å; L143-A147 PolarHBondContact O-N 2.71Å; L144-A147 WeakPolarHBondContact O-CB 3.39Å; L144-A147 PolarHBondContact O-N 2.85Å; R145-A147 VanDerWaalsContact C-N 3.33Å; R145-A147 PolarHBondContact O-N 3.17Å; A147-G149 VanDerWaalsContact C-N 3.34Å; A147-G149 PolarHBondContact O-N 3.07Å; A147-I150 PolarHBondContact O-N 2.82Å; A147-Y151 PolarHBondContact O-N 2.79Å
148	M	95.2	Very high	91.9	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.1	-40.1	175.2	-66.3	160.6	64.8	0	0	112	F44 I105 L108 V114 V117 I119 L144 R145 E146 Y151 I152	F44-M148 HydrophobicContact CE1-CG 3.85Å; F44-M148 HydrophobicContact CZ-CG 3.89Å; I105-M148 HydrophobicContact CD1-SD 4.03Å; I105-M148 HydrophobicContact CG2-CE 4.21Å; L108-M148 HydrophobicContact CB-CE 4.15Å; L108-M148 HydrophobicContact CD1-CE 3.55Å; L108-M148 HydrophobicContact CD2-CB 4.5Å; L108-M148 HydrophobicContact CD2-CE 3.96Å; L108-M148 HydrophobicContact CD2-CG 4.08Å; L108-M148 HydrophobicContact CG-CE 4.07Å; V114-M148 HydrophobicContact CG1-CB 3.84Å; V114-M148 HydrophobicContact CG1-CE 4.27Å; V114-M148 HydrophobicContact CG1-SD 4.49Å; V114-M148 HydrophobicContact CG2-CB 4.35Å; V117-M148 HydrophobicContact CB-CE 3.92Å; V117-M148 HydrophobicContact CG1-CE 3.81Å; V117-M148 HydrophobicContact CG2-CE 3.93Å; I119-M148 HydrophobicContact CD1-SD 4.1Å; L144-M148 VanDerWaalsContact O-CG 3.26Å; L144-M148 WeakPolarHBondContact O-CG 3.35Å; L144-M148 PolarHBondContact O-N 3.01Å; R145-M148 PolarHBondContact O-N 3.22Å; E146-M148 PolarHBondContact O-N 2.82Å; M148-Y151 WeakPolarHBondContact O-CB 3.45Å; M148-Y151 PolarHBondContact O-N 3.49Å; M148-I152 WeakPolarHBondContact O-CG1 3.37Å; M148-I152 PolarHBondContact O-N 3.19Å
149	G	93.5	Very high	91.3	Very high	31 Å²	31	47.9 Å²	47.9	32%	0.32	25%	0.245	S	C	.	.	H	α-helix	trans	-62.1	-42.3	174.6	0	0	0	0	0	112.7	R145 E146 A147 I152 S153	R145-G149 PolarHBondContact O-N 3.31Å; E146-G149 PolarHBondContact O-N 2.93Å; E146-G149 VanDerWaalsContact O-N 3.12Å; A147-G149 VanDerWaalsContact C-N 3.34Å; A147-G149 PolarHBondContact O-N 3.07Å; G149-I152 PolarHBondContact O-N 3.12Å; G149-S153 WeakPolarHBondContact O-CB 3.14Å; G149-S153 PolarHBondContact O-N 2.8Å
150	I	92.4	Very high	90.7	Very high	69 Å²	69	45 Å²	45	35%	0.354	23%	0.232	S	C	.	.	H	α-helix	trans	-63.3	-43.5	174.8	-66.6	165.1	0	0	0	110.5	L43 E146 A147 I152 S153 T154	L43-I150 HydrophobicContact CD1-CB 4.35Å; L43-I150 HydrophobicContact CD1-CG2 4.09Å; L43-I150 HydrophobicContact CD2-CB 4.22Å; L43-I150 HydrophobicContact CD2-CG2 3.68Å; E146-I150 HydrophobicContact CG-CD1 4.16Å; E146-I150 WeakPolarHBondContact O-CG1 3.48Å; E146-I150 PolarHBondContact O-N 2.89Å; A147-I150 PolarHBondContact O-N 2.82Å; I150-I152 PolarHBondContact O-N 3.06Å; I150-S153 PolarHBondContact O-N 3.31Å; I150-T154 HydrophobicContact CG2-CG2 4.12Å; I150-T154 WeakPolarHBondContact O-CB 3.34Å; I150-T154 VanDerWaalsContact O-CG2 3.3Å; I150-T154 WeakPolarHBondContact O-CG2 3.37Å; I150-T154 PolarHBondContact O-N 2.86Å; I150-T154 PolarHBondContact O-OG1 3.48Å
151	Y	95.1	Very high	89.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-55.4	-52.4	174.2	162.1	-111	0	0	0	111.4	W35 S36 K39 L40 Y81 W83 A147 M148 S153 T154 L155	W35-Y151 HydrophobicContact CE3-CE2 4.49Å; W35-Y151 HydrophobicContact CZ3-CD2 4.18Å; W35-Y151 AromaticContact CZ3-CE2 3.87Å; W35-Y151 HydrophobicContact CZ3-CE2 3.87Å; S36-Y151 WeakPolarHBondContact CB-OH 3.48Å; S36-Y151 WeakPolarHBondContact OG-CE2 3.33Å; S36-Y151 PolarHBondContact OG-OH 2.84Å; K39-Y151 HydrophobicContact CB-CD2 4.38Å; K39-Y151 HydrophobicContact CG-CD2 4.32Å; L40-Y151 HydrophobicContact CD1-CD1 4.37Å; L40-Y151 HydrophobicContact CD1-CD2 4.45Å; L40-Y151 HydrophobicContact CD1-CE1 4.2Å; L40-Y151 HydrophobicContact CD1-CE2 4.29Å; L40-Y151 HydrophobicContact CD1-CG 4.48Å; L40-Y151 HydrophobicContact CD2-CD1 3.67Å; L40-Y151 HydrophobicContact CD2-CD2 4.02Å; L40-Y151 HydrophobicContact CD2-CE1 4.31Å; L40-Y151 HydrophobicContact CD2-CG 3.49Å; L40-Y151 VanDerWaalsContact CD2-CG 3.49Å; L40-Y151 HydrophobicContact CG-CD1 4.15Å; L40-Y151 HydrophobicContact CG-CD2 3.82Å; L40-Y151 HydrophobicContact CG-CE1 4.42Å; L40-Y151 HydrophobicContact CG-CE2 4.12Å; L40-Y151 HydrophobicContact CG-CG 3.83Å; Y81-Y151 HydrophobicContact CD2-CE1 4.48Å; W83-Y151 AromaticContact NE1-CZ 3.78Å; W83-Y151 PolarHBondContact NE1-OH 3.23Å; W83-Y151 VanDerWaalsContact NE1-OH 3.07Å; A147-Y151 PolarHBondContact O-N 2.79Å; M148-Y151 WeakPolarHBondContact O-CB 3.45Å; M148-Y151 PolarHBondContact O-N 3.49Å; Y151-S153 VanDerWaalsContact C-N 3.3Å; Y151-S153 PolarHBondContact O-N 3.24Å; Y151-T154 WeakPolarHBondContact CA-OG1 3.31Å; Y151-T154 PolarHBondContact O-N 3.24Å; Y151-T154 PolarHBondContact O-OG1 3.03Å; Y151-L155 HydrophobicContact CE2-CB 4.42Å; Y151-L155 WeakPolarHBondContact O-CB 3.49Å; Y151-L155 PolarHBondContact O-N 3.2Å
152	I	92.2	Very high	88.6	Confident	18 Å²	18	54.7 Å²	54.7	9%	0.092	29%	0.293	C	S	.	.	H	α-helix	trans	-61.5	-41.3	-179.5	-65.7	165	0	0	0	111	Y81 L108 V114 M148 G149 I150 K156	Y81-I152 HydrophobicContact CE2-CG1 4.4Å; Y81-I152 WeakPolarHBondContact OH-CD1 3.3Å; L108-I152 HydrophobicContact CD1-CD1 4.45Å; V114-I152 HydrophobicContact CG2-CD1 3.34Å; M148-I152 WeakPolarHBondContact O-CG1 3.37Å; M148-I152 PolarHBondContact O-N 3.19Å; G149-I152 PolarHBondContact O-N 3.12Å; I150-I152 PolarHBondContact O-N 3.06Å; I152-K156 HydrophobicContact CG2-CD 4.28Å; I152-K156 WeakPolarHBondContact O-CG 3.32Å; I152-K156 PolarHBondContact O-N 3.35Å
153	S	90.6	Very high	87.4	Confident	67 Å²	67	48.2 Å²	48.2	47%	0.469	27%	0.265	S	S	.	.	H	α-helix	trans	-63	-45.6	177.2	-174.7	0	0	0	0	111.7	G149 I150 Y151 K156 T157	G149-S153 WeakPolarHBondContact O-CB 3.14Å; G149-S153 PolarHBondContact O-N 2.8Å; I150-S153 PolarHBondContact O-N 3.31Å; Y151-S153 VanDerWaalsContact C-N 3.3Å; Y151-S153 PolarHBondContact O-N 3.24Å; S153-K156 PolarHBondContact O-N 3Å; S153-T157 WeakPolarHBondContact O-CG2 3.3Å; S153-T157 PolarHBondContact O-N 2.77Å; S153-T157 PolarHBondContact O-OG1 2.82Å; S153-T157 VanDerWaalsContact O-OG1 3.06Å
154	T	88.1	Confident	85.8	Confident	12 Å²	12	48.9 Å²	48.9	7%	0.074	27%	0.268	C	S	.	.	H	α-helix	trans	-73.1	-31.2	-177.9	52	0	0	0	0	112.2	W35 K39 I150 Y151 K156 T157 E158 F159	W35-T154 VanDerWaalsContact CH2-C 3.49Å; K39-T154 VanDerWaalsContact CE-OG1 3.32Å; K39-T154 WeakPolarHBondContact CE-OG1 3.39Å; I150-T154 HydrophobicContact CG2-CG2 4.12Å; I150-T154 WeakPolarHBondContact O-CB 3.34Å; I150-T154 VanDerWaalsContact O-CG2 3.3Å; I150-T154 WeakPolarHBondContact O-CG2 3.37Å; I150-T154 PolarHBondContact O-N 2.86Å; I150-T154 PolarHBondContact O-OG1 3.48Å; Y151-T154 WeakPolarHBondContact CA-OG1 3.31Å; Y151-T154 PolarHBondContact O-N 3.24Å; Y151-T154 PolarHBondContact O-OG1 3.03Å; T154-K156 PolarHBondContact O-N 3.43Å; T154-T157 PolarHBondContact O-N 3.11Å; T154-E158 HydrophobicContact CG2-CG 4.36Å; T154-E158 VanDerWaalsContact CG2-OE1 3.27Å; T154-E158 WeakPolarHBondContact CG2-OE1 3.34Å; T154-E158 WeakPolarHBondContact O-CA 3.4Å; T154-E158 WeakPolarHBondContact O-CB 3.36Å; T154-E158 PolarHBondContact O-N 2.81Å; T154-F159 PolarHBondContact O-N 3.44Å
155	L	88.4	Confident	83.5	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.01	29%	0.294	C	S	.	.	I	π-helix	trans	-59.5	-39.1	170.1	-175.4	68.5	0	0	0	110.6	A32 W35 I70 F79 Y81 Y151 F159 T160	A32-L155 HydrophobicContact CB-CD1 3.97Å; W35-L155 HydrophobicContact CE3-CD1 3.81Å; W35-L155 HydrophobicContact CH2-CB 4.27Å; W35-L155 HydrophobicContact CZ3-CB 3.85Å; W35-L155 HydrophobicContact CZ3-CD1 3.54Å; W35-L155 HydrophobicContact CZ3-CG 4.32Å; I70-L155 HydrophobicContact CD1-CD1 3.97Å; I70-L155 HydrophobicContact CD1-CG 4.26Å; F79-L155 HydrophobicContact CD1-CD2 4.09Å; F79-L155 HydrophobicContact CD1-CG 4.08Å; F79-L155 HydrophobicContact CE1-CG 4.36Å; Y81-L155 HydrophobicContact CD1-CD2 3.95Å; Y81-L155 HydrophobicContact CE1-CD2 4.48Å; Y151-L155 HydrophobicContact CE2-CB 4.42Å; Y151-L155 WeakPolarHBondContact O-CB 3.49Å; Y151-L155 PolarHBondContact O-N 3.2Å; L155-F159 HydrophobicContact CD1-CB 4.27Å; L155-F159 HydrophobicContact CD1-CG 4.4Å; L155-T160 WeakPolarHBondContact O-CG2 3.27Å
156	K	85.8	Confident	81	Confident	112 Å²	112	56.6 Å²	56.6	49%	0.487	32%	0.319	S	S	.	.	I	π-helix	trans	-80	-12.4	179.8	-69.6	174.3	-179.1	176.9	0	115	F79 I152 S153 T154 T160	F79-K156 HydrophobicContact CD1-CG 4.3Å; F79-K156 HydrophobicContact CE1-CB 4.31Å; F79-K156 HydrophobicContact CE1-CG 3.76Å; F79-K156 HydrophobicContact CE2-CG 4.08Å; F79-K156 HydrophobicContact CZ-CB 4.12Å; F79-K156 HydrophobicContact CZ-CG 3.66Å; I152-K156 HydrophobicContact CG2-CD 4.28Å; I152-K156 WeakPolarHBondContact O-CG 3.32Å; I152-K156 PolarHBondContact O-N 3.35Å; S153-K156 PolarHBondContact O-N 3Å; T154-K156 PolarHBondContact O-N 3.43Å; K156-T160 PolarHBondContact O-OG1 2.75Å
157	T	83.9	Confident	78.2	Confident	84 Å²	84	56.8 Å²	56.8	52%	0.515	33%	0.329	S	S	.	.	I	π-helix	trans	-121	-56.8	-176.2	57.6	0	0	0	0	112.5	S153 T154 Q161	S153-T157 WeakPolarHBondContact O-CG2 3.3Å; S153-T157 PolarHBondContact O-N 2.77Å; S153-T157 PolarHBondContact O-OG1 2.82Å; S153-T157 VanDerWaalsContact O-OG1 3.06Å; T154-T157 PolarHBondContact O-N 3.11Å; T157-Q161 PolarHBondContact O-N 3.41Å
158	E	81.6	Confident	75.2	Confident	91 Å²	91	62.8 Å²	62.8	43%	0.425	37%	0.365	S	S	.	.	I	π-helix	trans	-74.2	-53.4	-175.3	-63.3	178.2	-166.1	0	0	111.3	W35 K39 T154 T160 Q161	W35-E158 HydrophobicContact CZ2-CB 4.15Å; K39-E158 VanDerWaalsContact NZ-CD 3.32Å; K39-E158 IonicContact NZ-OE1 3.09Å; K39-E158 PolarHBondContact NZ-OE1 3.01Å; K39-E158 VanDerWaalsContact NZ-OE1 3.11Å; K39-E158 IonicContact NZ-OE2 2.61Å; K39-E158 PolarHBondContact NZ-OE2 3.31Å; T154-E158 HydrophobicContact CG2-CG 4.36Å; T154-E158 VanDerWaalsContact CG2-OE1 3.27Å; T154-E158 WeakPolarHBondContact CG2-OE1 3.34Å; T154-E158 WeakPolarHBondContact O-CA 3.4Å; T154-E158 WeakPolarHBondContact O-CB 3.36Å; T154-E158 PolarHBondContact O-N 2.81Å; E158-T160 VanDerWaalsContact C-N 3.31Å; E158-T160 PolarHBondContact O-N 2.86Å; E158-Q161 WeakPolarHBondContact O-CB 3.27Å; E158-Q161 PolarHBondContact O-N 3.17Å
159	F	80.2	Confident	72.2	Confident	38 Å²	38	70.1 Å²	70.1	17%	0.167	40%	0.404	C	S	.	.	I	π-helix	trans	-69	-33.5	-175.3	-174.2	-86.6	0	0	0	112.4	R30 D31 A32 W35 I70 T154 L155 Q161 M163	R30-F159 HydrophobicContact CB-CE1 4.3Å; D31-F159 WeakPolarHBondContact O-CZ 3.46Å; A32-F159 VanDerWaalsContact CA-CZ 3.43Å; A32-F159 HydrophobicContact CB-CD1 3.97Å; A32-F159 HydrophobicContact CB-CD2 4.3Å; A32-F159 HydrophobicContact CB-CE1 3.5Å; A32-F159 VanDerWaalsContact CB-CE1 3.5Å; A32-F159 HydrophobicContact CB-CE2 3.86Å; A32-F159 HydrophobicContact CB-CG 4.32Å; A32-F159 HydrophobicContact CB-CZ 3.43Å; A32-F159 VanDerWaalsContact CB-CZ 3.43Å; W35-F159 HydrophobicContact CB-CD2 3.59Å; W35-F159 HydrophobicContact CB-CE2 3.62Å; W35-F159 AromaticContact CD1-CD2 3.83Å; W35-F159 HydrophobicContact CD2-CB 3.98Å; W35-F159 AromaticContact CD2-CD2 3.54Å; W35-F159 HydrophobicContact CD2-CD2 3.54Å; W35-F159 HydrophobicContact CD2-CE2 4.46Å; W35-F159 HydrophobicContact CD2-CG 4.13Å; W35-F159 HydrophobicContact CE3-CB 4.04Å; W35-F159 AromaticContact CE3-CD2 3.96Å; W35-F159 HydrophobicContact CE3-CD2 3.96Å; W35-F159 HydrophobicContact CE3-CG 4.23Å; W35-F159 AromaticContact CG-CD2 3.35Å; W35-F159 HydrophobicContact CG-CD2 3.35Å; W35-F159 AromaticContact CG-CE2 3.93Å; W35-F159 HydrophobicContact CG-CE2 3.93Å; W35-F159 HydrophobicContact CG-CG 4.38Å; W35-F159 HydrophobicContact CH2-CB 4.29Å; W35-F159 HydrophobicContact CZ2-CB 4.17Å; W35-F159 HydrophobicContact CZ3-CB 4.21Å; I70-F159 HydrophobicContact CD1-CD1 3.26Å; I70-F159 HydrophobicContact CD1-CE1 3.66Å; I70-F159 HydrophobicContact CD1-CG 4.29Å; I70-F159 HydrophobicContact CG1-CD1 4.39Å; I70-F159 HydrophobicContact CG1-CE1 4.36Å; T154-F159 PolarHBondContact O-N 3.44Å; L155-F159 HydrophobicContact CD1-CB 4.27Å; L155-F159 HydrophobicContact CD1-CG 4.4Å; F159-Q161 VanDerWaalsContact C-N 3.25Å; F159-Q161 PolarHBondContact O-N 3.17Å; F159-M163 HydrophobicContact CD1-SD 4.04Å; F159-M163 HydrophobicContact CE1-SD 3.97Å
160	T	81	Confident	69.5	Low	15 Å²	15	72.3 Å²	72.3	9%	0.092	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-2.1	-179.1	50.9	0	0	0	0	114.1	I70 L77 F79 L155 K156 E158 G162 M163	I70-T160 HydrophobicContact CD1-CG2 3.61Å; I70-T160 HydrophobicContact CG2-CG2 4.19Å; L77-T160 HydrophobicContact CD1-CG2 3.6Å; F79-T160 HydrophobicContact CE1-CG2 3.55Å; F79-T160 HydrophobicContact CZ-CG2 3.76Å; L155-T160 WeakPolarHBondContact O-CG2 3.27Å; K156-T160 PolarHBondContact O-OG1 2.75Å; E158-T160 VanDerWaalsContact C-N 3.31Å; E158-T160 PolarHBondContact O-N 2.86Å; T160-G162 PolarHBondContact O-N 2.91Å; T160-M163 HydrophobicContact CG2-SD 4.05Å; T160-M163 WeakPolarHBondContact O-CB 3.37Å; T160-M163 PolarHBondContact O-N 2.79Å
161	Q	77	Confident	66.5	Low	161 Å²	161	77.8 Å²	77.8	75%	0.752	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	124.1	177.7	-166.5	173.9	8.3	0	0	110.1	T157 E158 F159 M163	T157-Q161 PolarHBondContact O-N 3.41Å; E158-Q161 WeakPolarHBondContact O-CB 3.27Å; E158-Q161 PolarHBondContact O-N 3.17Å; F159-Q161 VanDerWaalsContact C-N 3.25Å; F159-Q161 PolarHBondContact O-N 3.17Å; Q161-M163 PolarHBondContact O-N 3.49Å
162	G	66.1	Low	63.3	Low	61 Å²	61	83.3 Å²	83.3	63%	0.629	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	5	-177.3	0	0	0	0	0	115.4	T160	T160-G162 PolarHBondContact O-N 2.91Å
163	M	70.9	Confident	60.4	Low	9 Å²	9	89.1 Å²	89.1	4%	0.044	53%	0.525	C	S	.	.	S	Bend	trans	-74	-18.1	169.7	-70.2	-169.2	60.2	0	0	112.9	R30 I70 N72 L77 F159 T160 Q161	R30-M163 HydrophobicContact CB-CE 3.71Å; R30-M163 HydrophobicContact CB-SD 4.37Å; R30-M163 HydrophobicContact CG-CE 3.74Å; R30-M163 HydrophobicContact CG-SD 4.48Å; I70-M163 HydrophobicContact CB-CE 3.89Å; I70-M163 HydrophobicContact CB-SD 4.38Å; I70-M163 HydrophobicContact CD1-SD 4.37Å; I70-M163 HydrophobicContact CG2-CE 3.72Å; I70-M163 HydrophobicContact CG2-SD 4.22Å; N72-M163 PolarHBondContact ND2-O 3.45Å; L77-M163 HydrophobicContact CD2-CB 4.01Å; L77-M163 HydrophobicContact CD2-CE 3.96Å; F159-M163 HydrophobicContact CD1-SD 4.04Å; F159-M163 HydrophobicContact CE1-SD 3.97Å; T160-M163 HydrophobicContact CG2-SD 4.05Å; T160-M163 WeakPolarHBondContact O-CB 3.37Å; T160-M163 PolarHBondContact O-N 2.79Å; Q161-M163 PolarHBondContact O-N 3.49Å
164	I	60	Low	57.6	Low	75 Å²	75	92.7 Å²	92.7	39%	0.385	54%	0.539	S	S	.	.	S	Bend	trans	-118	119	172.3	-51.4	172.3	0	0	0	106.8	L77	L77-I164 HydrophobicContact CD1-CD1 3.74Å; L77-I164 HydrophobicContact CD1-CG1 4.01Å; L77-I164 HydrophobicContact CD2-CG1 4.22Å; L77-I164 HydrophobicContact CG-CD1 3.85Å; L77-I164 HydrophobicContact CG-CG1 4.02Å
165	L	47	Very low	55.6	Low	101 Å²	101	97.9 Å²	97.9	53%	0.529	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-66.5	137.1	170.6	-87.3	146.4	0	0	0	109.2	N23 T167	N23-L165 HydrophobicContact CB-CD1 4.01Å; L165-T167 PolarHBondContact O-N 3.02Å; L165-T167 VanDerWaalsContact O-N 3.08Å
166	P	42.6	Very low	52.9	Low	116 Å²	116	104.6 Å²	104.6	75%	0.753	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-57.2	120.3	171.2	21	-28.8	0	0	0	108.4	V168	P166-V168 PolarHBondContact O-N 3.2Å
167	T	36.4	Very low	50.2	Low	125 Å²	125	102.2 Å²	102.2	77%	0.767	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-63.1	129.6	165.7	21.3	0	0	0	0	106.4	L165 N169	L165-T167 PolarHBondContact O-N 3.02Å; L165-T167 VanDerWaalsContact O-N 3.08Å; T167-N169 VanDerWaalsContact C-N 3.26Å; T167-N169 PolarHBondContact O-N 3.21Å
168	V	31.7	Very low	48.1	Very low	131 Å²	131	107.5 Å²	107.5	79%	0.794	64%	0.64	S	S	*	*	S	Bend	trans	-55.7	89.5	177.5	-83.1	0	0	0	0	110.6	P166	P166-V168 PolarHBondContact O-N 3.2Å
169	N	31.7	Very low	45.9	Very low	155 Å²	155	109.4 Å²	109.4	83%	0.829	66%	0.66	S	S	*	*	S	Bend	trans	-176.6	95.2	148	-90.1	-12.7	0	0	0	105	T167 E171	T167-N169 VanDerWaalsContact C-N 3.26Å; T167-N169 PolarHBondContact O-N 3.21Å; N169-E171 PolarHBondContact O-N 3.24Å
170	G	37.8	Very low	43.5	Very low	77 Å²	77	112.5 Å²	112.5	79%	0.794	69%	0.692	S	S	*	*			trans	-57.5	128.4	-168.3	0	0	0	0	0	112.8
171	E	27.7	Very low	41	Very low	184 Å²	184	120 Å²	120	86%	0.86	73%	0.731	S	S	*	*			trans	-150.2	98.9	144.1	-103.4	169.4	-180	0	0	105.7	N169 V173	N169-E171 PolarHBondContact O-N 3.24Å; E171-V173 PolarHBondContact O-N 3.11Å
172	S	28	Very low	38.5	Very low	116 Å²	116	122.4 Å²	122.4	81%	0.811	74%	0.739	S	S	*	*			trans	-66.9	112.2	169.9	47.5	0	0	0	0	108.5	D174	S172-D174 PolarHBondContact O-N 3.39Å
173	V	33.1	Very low	36.7	Very low	139 Å²	139	125.5 Å²	125.5	84%	0.842	75%	0.746	S	S	*	*			trans	-90.3	95.1	171.7	-82.6	0	0	0	0	109.3	E171	E171-V173 PolarHBondContact O-N 3.11Å
174	D	29.7	Very low	34.5	Very low	143 Å²	143	133.5 Å²	133.5	77%	0.765	78%	0.783	S	S	*	*			trans	-97.4	153.6	155.2	-88	-51.4	0	0	0	110.3	S172	S172-D174 PolarHBondContact O-N 3.39Å
175	P	47.6	Very low	32.7	Very low	121 Å²	121	138.3 Å²	138.3	79%	0.786	80%	0.804	S	S	*	*			trans	-88.9	126.1	-161.4	32.9	-30.3	0	0	0	112.4
176	V	30.7	Very low	32	Very low	143 Å²	143	141.6 Å²	141.6	87%	0.867	82%	0.821	S	S	*	*			trans	-112.1	118.3	168.5	179.9	0	0	0	0	105.9
177	G	29	Very low	31.3	Very low	61 Å²	61	145.8 Å²	145.8	63%	0.629	83%	0.827	S	S	*	*			cis	99.2	97.6	44.3	0	0	0	0	0	108
178	Q	40.4	Very low	30.9	Very low	196 Å²	196	143.7 Å²	143.7	92%	0.916	82%	0.823	S	S	*	*			trans	-59.2	152.1	176.9	-67.4	178.1	-7.6	0	0	111.6
179	P	36.3	Very low	30.9	Very low	130 Å²	130	146.9 Å²	146.9	84%	0.844	83%	0.826	S	S	*	*			trans	-131.5	147.9	138.2	15.4	5.6	0	0	0	114.9
180	A	28.2	Very low	31	Very low	103 Å²	103	144.8 Å²	144.8	85%	0.851	82%	0.821	S	S	*	*			trans	-72	157.3	-173	0	0	0	0	0	115.6
181	L	29.1	Very low	30.5	Very low	173 Å²	173	145.6 Å²	145.6	91%	0.906	82%	0.82	S	S	*	*			trans	-69.1	137.9	173.7	-71	131.2	0	0	0	112.6
182	K	24.5	Very low	31	Very low	211 Å²	211	142.5 Å²	142.5	92%	0.917	82%	0.816	S	S	*	*			trans	-134.2	133.3	145.3	-89.1	-171.5	178.4	178.3	0	111.4
183	T	27.6	Very low	30.9	Very low	126 Å²	126	141.9 Å²	141.9	77%	0.773	81%	0.812	S	S	*	*			trans	-70.4	147.4	-173.2	-39	0	0	0	0	113
184	E	25.4	Very low	31.3	Very low	177 Å²	177	145.4 Å²	145.4	83%	0.827	82%	0.816	S	S	*	*				-175.4	125.1	121.3	-100.4	171.9	-178	0	0	114.8
185	E	23.4	Very low	31	Very low	177 Å²	177	144.7 Å²	144.7	83%	0.827	82%	0.817	S	S	*	*			trans	41.1	121.8	148.3	-72.7	179	105.8	0	0	125
186	L	31.8	Very low	30.4	Very low	170 Å²	170	147.4 Å²	147.4	89%	0.89	82%	0.819	S	S	*	*			trans	-95.2	140.4	162.9	-84.8	145.5	0	0	0	111.5
187	K	27.8	Very low	30.4	Very low	203 Å²	203	145.5 Å²	145.5	88%	0.883	82%	0.818	S	S	*	*			trans	-151.8	100.6	141.3	-102.9	171.4	-174.3	171.8	0	108.2
188	A	28.3	Very low	30.5	Very low	82 Å²	82	153.2 Å²	153.2	68%	0.678	83%	0.828	S	S	*	*				65	126	100.6	0	0	0	0	0	112.9
189	K	30.9	Very low	30.4	Very low	197 Å²	197	149.3 Å²	149.3	86%	0.857	82%	0.82	S	S	*	*				179.5	-175.7	50.1	-130.7	176.7	-165.4	-175.8	0	109
190	P	32.9	Very low	30.6	Very low	112 Å²	112	150.4 Å²	150.4	73%	0.727	82%	0.824	S	S	*	*				-125.3	170.4	-103.3	41.4	-25	0	0	0	118.1
191	A	28.8	Very low	31.3	Very low	93 Å²	93	148 Å²	148	77%	0.769	81%	0.809	S	S	*	*			trans	76.7	159.6	147.1	0	0	0	0	0	120.1
192	P	38.4	Very low	32.1	Very low	119 Å²	119	146.3 Å²	146.3	77%	0.773	81%	0.806	S	S	*	*			cis	-134	133.9	-28.6	30.7	-11.9	0	0	0	112.5
193	S	25.4	Very low	33.5	Very low	103 Å²	103	145 Å²	145	72%	0.72	80%	0.8	S	S	*	*			trans	-169.4	123.2	158.3	44.6	0	0	0	0	113.1	T195	S193-T195 PolarHBondContact O-OG1 3.23Å
194	K	41.8	Very low	35.5	Very low	213 Å²	213	141.6 Å²	141.6	93%	0.926	78%	0.777	S	S	*	*			trans	27.6	101.8	146.7	-64.4	178.7	179.3	178.5	0	114.7
195	T	23.3	Very low	38.1	Very low	128 Å²	128	137.3 Å²	137.3	79%	0.785	76%	0.764	S	S	*	*			trans	-142.1	119.6	170.7	-10.9	0	0	0	0	110.3	S193 A197	S193-T195 PolarHBondContact O-OG1 3.23Å; T195-A197 PolarHBondContact O-N 3.19Å
196	Q	34.6	Very low	40.9	Very low	178 Å²	178	132.6 Å²	132.6	83%	0.832	75%	0.747	S	S	*	*			trans	-47.3	131.8	166.8	-67.7	162.3	-14.4	0	0	109.5	R198	Q196-R198 PolarHBondContact O-N 3.3Å
197	A	30.3	Very low	43.3	Very low	103 Å²	103	125.5 Å²	125.5	85%	0.851	71%	0.712	S	S	*	*			trans	-57.6	111.8	171.5	0	0	0	0	0	108.8	T195	T195-A197 PolarHBondContact O-N 3.19Å
198	R	31.3	Very low	46.2	Very low	224 Å²	224	120.9 Å²	120.9	85%	0.845	69%	0.692	S	S	*	*			trans	-76	132.5	166.4	-70.3	-177.8	177.6	-176.2	-0.7	107.6	Q196 V200	Q196-R198 PolarHBondContact O-N 3.3Å; R198-V200 PolarHBondContact O-N 3.17Å
199	P	38.6	Very low	49.1	Very low	113 Å²	113	117 Å²	117	73%	0.734	66%	0.66	S	S	*	*			trans	-74.6	111.1	-178.8	29.6	-30.3	0	0	0	108.9
200	V	40.8	Very low	51.9	Low	153 Å²	153	110.5 Å²	110.5	93%	0.927	64%	0.637	S	S	*	*			trans	-85.6	107.8	161.4	-179.8	0	0	0	0	105.8	R198	R198-V200 PolarHBondContact O-N 3.17Å
201	G	43	Very low	54.4	Low	53 Å²	53	105.9 Å²	105.9	55%	0.546	61%	0.606	S	S	.	*	S	Bend	trans	171.3	122.2	178	0	0	0	0	0	109.3	K203	G201-K203 PolarHBondContact O-N 3.49Å
202	V	46.3	Very low	57.4	Low	138 Å²	138	107.5 Å²	107.5	84%	0.836	60%	0.595	S	S	*	*			trans	-52	116.5	159.1	178.2	0	0	0	0	105.4	I204	V202-I204 VanDerWaalsContact C-N 3.26Å; V202-I204 PolarHBondContact O-N 3.27Å
203	K	53.1	Low	59.9	Low	184 Å²	184	104.9 Å²	104.9	80%	0.8	57%	0.573	S	S	*	*			trans	-67.5	93.1	177.7	-72.2	-177.9	180	178.1	0	106.9	G201 P205	G201-K203 PolarHBondContact O-N 3.49Å; K203-P205 WeakPolarHBondContact O-CD 3.46Å; K203-P205 VanDerWaalsContact O-N 3.17Å
204	I	70	Confident	63	Low	54 Å²	54	102.2 Å²	102.2	28%	0.277	55%	0.552	S	S	.	*			trans	-60.9	118.8	171.6	-62.8	164.6	0	0	0	105.4	V202 T206 P280 H283 P308	V202-I204 VanDerWaalsContact C-N 3.26Å; V202-I204 PolarHBondContact O-N 3.27Å; I204-T206 PolarHBondContact O-N 3.03Å; I204-T206 VanDerWaalsContact O-N 3.11Å; I204-P280 HydrophobicContact CD1-CB 4.04Å; I204-P280 HydrophobicContact CD1-CG 3.9Å; I204-H283 HydrophobicContact CD1-CB 4.48Å; I204-P308 HydrophobicContact CG2-CB 4.06Å; I204-P308 HydrophobicContact CG2-CG 4.45Å
205	P	78.8	Confident	65.3	Low	86 Å²	86	92.1 Å²	92.1	56%	0.558	51%	0.508	S	S	*	.			trans	-61.6	120.6	175.7	24.8	-31.5	0	0	0	107.4	K203 A309	K203-P205 WeakPolarHBondContact O-CD 3.46Å; K203-P205 VanDerWaalsContact O-N 3.17Å; P205-A309 HydrophobicContact CB-CB 4.12Å; P205-A309 HydrophobicContact CG-CB 4.3Å; P205-A309 WeakPolarHBondContact O-CB 3.29Å; P205-A309 PolarHBondContact O-N 3.21Å
206	T	83.7	Confident	68.5	Low	78 Å²	78	88.5 Å²	88.5	48%	0.479	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	145.1	178.2	57.7	0	0	0	0	110.7	I204 I307	I204-T206 PolarHBondContact O-N 3.03Å; I204-T206 VanDerWaalsContact O-N 3.11Å; T206-I307 CarbonylContact C-O 3.56Å; T206-I307 WeakPolarHBondContact CA-O 3.4Å
207	C	82.1	Confident	71.2	Confident	22 Å²	22	80.8 Å²	80.8	15%	0.149	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	175.9	175.5	65.8	0	0	0	0	110.9	G306 I307 E312	C207-G306 PolarHBondContact O-N 2.93Å; C207-I307 PolarHBondContact N-O 2.83Å; C207-I307 PolarHBondContact O-N 3.41Å; C207-I307 PolarHBondContact SG-O 3.47Å; C207-E312 HydrophobicContact CB-CB 4.47Å; C207-E312 HydrophobicContact CB-CG 4.29Å; C207-E312 WeakPolarHBondContact CB-OE2 3.41Å; C207-E312 WeakPolarHBondContact SG-CB 3.41Å; C207-E312 WeakPolarHBondContact SG-CG 3.4Å
208	K	88.6	Confident	74.2	Confident	106 Å²	106	78.3 Å²	78.3	46%	0.461	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	128.1	173.5	177.9	-177.1	177	-177.5	0	108.7	E303 G304 R305	K208-E303 VanDerWaalsContact CE-CD 3.46Å; K208-E303 WeakPolarHBondContact CE-OE1 3.44Å; K208-E303 IonicContact NZ-OE1 3.46Å; K208-E303 PolarHBondContact NZ-OE1 2.69Å; K208-G304 CarbonylContact C-O 3.5Å; K208-G304 VanDerWaalsContact CA-O 3.26Å; K208-G304 WeakPolarHBondContact CA-O 3.48Å; K208-R305 HydrophobicContact CD-CG 4.44Å; K208-R305 HydrophobicContact CG-CG 4.21Å
209	I	87.4	Confident	77.1	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	137.5	173.1	-61.7	-178	0	0	0	108.4	L211 M302 E303 G304 I307 E312 T315 R316	I209-L211 HydrophobicContact CG2-CD1 4.34Å; I209-L211 HydrophobicContact CG2-CD2 4.5Å; I209-L211 HydrophobicContact CG2-CG 3.89Å; I209-M302 HydrophobicContact CG2-CE 4.09Å; I209-E303 CarbonylContact O-C 3.47Å; I209-E303 WeakPolarHBondContact O-CA 3.5Å; I209-G304 PolarHBondContact N-O 3.1Å; I209-G304 PolarHBondContact O-N 3.17Å; I209-I307 HydrophobicContact CB-CD1 3.8Å; I209-I307 HydrophobicContact CD1-CD1 3.5Å; I209-I307 VanDerWaalsContact CD1-CD1 3.5Å; I209-I307 HydrophobicContact CD1-CG2 4.35Å; I209-I307 HydrophobicContact CG1-CD1 3.58Å; I209-E312 HydrophobicContact CD1-CB 4.43Å; I209-E312 HydrophobicContact CD1-CG 3.6Å; I209-E312 WeakPolarHBondContact CD1-O 3.48Å; I209-E312 HydrophobicContact CG1-CG 3.57Å; I209-T315 HydrophobicContact CD1-CG2 4.14Å; I209-R316 HydrophobicContact CD1-CB 4.18Å
210	T	90.8	Very high	79.7	Confident	61 Å²	61	68 Å²	68	37%	0.374	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	126.3	166.9	-54.5	0	0	0	0	107.7	M302	T210-M302 CarbonylContact C-O 3.53Å; T210-M302 VanDerWaalsContact CA-O 3.31Å; T210-M302 WeakPolarHBondContact CA-O 3.22Å
211	L	86.4	Confident	82.1	Confident	14 Å²	14	63.5 Å²	63.5	7%	0.073	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	142.9	177	-66.7	-179.3	0	0	0	109	I209 C301 M302 R316 W319 Q320 F324	I209-L211 HydrophobicContact CG2-CD1 4.34Å; I209-L211 HydrophobicContact CG2-CD2 4.5Å; I209-L211 HydrophobicContact CG2-CG 3.89Å; L211-C301 CarbonylContact O-C 3.58Å; L211-C301 WeakPolarHBondContact O-CA 3.38Å; L211-M302 HydrophobicContact CB-CB 4.43Å; L211-M302 HydrophobicContact CB-CE 4.22Å; L211-M302 HydrophobicContact CD1-CE 3.63Å; L211-M302 HydrophobicContact CG-CE 3.99Å; L211-M302 PolarHBondContact N-O 2.71Å; L211-M302 PolarHBondContact O-N 3.22Å; L211-R316 HydrophobicContact CD1-CG 4.09Å; L211-R316 HydrophobicContact CD2-CG 3.85Å; L211-R316 VanDerWaalsContact CD2-NH1 3.31Å; L211-R316 HydrophobicContact CG-CG 4.39Å; L211-W319 HydrophobicContact CD1-CB 3.88Å; L211-Q320 HydrophobicContact CD1-CG 4.11Å; L211-F324 HydrophobicContact CB-CE2 3.75Å; L211-F324 HydrophobicContact CB-CZ 3.99Å; L211-F324 HydrophobicContact CD1-CE2 3.81Å; L211-F324 HydrophobicContact CD1-CZ 4.28Å; L211-F324 HydrophobicContact CG-CE2 4.39Å
212	K	91	Very high	84.5	Confident	128 Å²	128	61 Å²	61	56%	0.557	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.9	131	177.3	-64.2	-174	179.7	-171	0	108.2	L300 C301	K212-L300 WeakPolarHBondContact CA-O 3.33Å; K212-C301 HydrophobicContact CG-CB 4.25Å
213	E	90.4	Very high	86.7	Confident	64 Å²	64	55.8 Å²	55.8	30%	0.299	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	143.7	-179	-163.8	63.7	-125.2	0	0	109.9	F215 L300 F324 K328	E213-F215 HydrophobicContact CB-CE2 3.92Å; E213-F215 HydrophobicContact CB-CZ 4.46Å; E213-F215 HydrophobicContact CG-CE2 4.08Å; E213-F215 HydrophobicContact CG-CZ 4.28Å; E213-L300 PolarHBondContact N-O 3.44Å; E213-L300 PolarHBondContact O-N 2.86Å; E213-F324 HydrophobicContact CB-CD2 3.86Å; E213-F324 HydrophobicContact CB-CE2 4.12Å; E213-F324 HydrophobicContact CB-CG 4.12Å; E213-F324 HydrophobicContact CG-CB 4.16Å; E213-F324 HydrophobicContact CG-CD2 4.13Å; E213-F324 HydrophobicContact CG-CG 4.2Å; E213-K328 VanDerWaalsContact CD-NZ 3.3Å; E213-K328 IonicContact OE1-NZ 3.87Å; E213-K328 PolarHBondContact OE1-NZ 3.42Å
214	T	90.1	Very high	88.6	Confident	47 Å²	47	52.3 Å²	52.3	29%	0.288	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	137.2	179.3	-52.5	0	0	0	0	110.7	E297 K328	T214-E297 HydrophobicContact CG2-CB 3.86Å; T214-E297 WeakPolarHBondContact CG2-OE2 3.15Å; T214-K328 WeakPolarHBondContact O-CE 3.42Å; T214-K328 PolarHBondContact O-NZ 2.66Å
215	F	91.2	Very high	89.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	134.5	178.6	-65.2	-96.9	0	0	0	109.9	E213 T217 L222 E297 T298 L300 F324 I327 K328 Y333	E213-F215 HydrophobicContact CB-CE2 3.92Å; E213-F215 HydrophobicContact CB-CZ 4.46Å; E213-F215 HydrophobicContact CG-CE2 4.08Å; E213-F215 HydrophobicContact CG-CZ 4.28Å; F215-T217 HydrophobicContact CB-CG2 4.04Å; F215-T217 PolarHBondContact O-N 3.29Å; F215-L222 HydrophobicContact CB-CD1 4.33Å; F215-L222 HydrophobicContact CB-CD2 4.05Å; F215-L222 HydrophobicContact CD1-CD1 3.95Å; F215-L222 HydrophobicContact CD2-CD1 4.38Å; F215-L222 HydrophobicContact CD2-CD2 3.65Å; F215-L222 HydrophobicContact CE1-CD1 4.36Å; F215-L222 HydrophobicContact CE2-CD2 4.28Å; F215-L222 HydrophobicContact CG-CD1 3.96Å; F215-L222 HydrophobicContact CG-CD2 3.86Å; F215-E297 CarbonylContact O-C 3.34Å; F215-E297 WeakPolarHBondContact O-CA 3.35Å; F215-T298 PolarHBondContact N-O 3.01Å; F215-T298 PolarHBondContact O-N 2.81Å; F215-L300 HydrophobicContact CD2-CB 3.96Å; F215-L300 HydrophobicContact CE2-CB 3.72Å; F215-L300 HydrophobicContact CE2-CD2 3.85Å; F215-L300 HydrophobicContact CE2-CG 4.44Å; F215-L300 HydrophobicContact CZ-CD2 4.32Å; F215-F324 HydrophobicContact CE2-CD1 4.34Å; F215-F324 HydrophobicContact CZ-CB 4.02Å; F215-F324 AromaticContact CZ-CD1 3.84Å; F215-F324 HydrophobicContact CZ-CD1 3.84Å; F215-F324 HydrophobicContact CZ-CG 4.17Å; F215-I327 HydrophobicContact CD1-CG2 3.95Å; F215-I327 HydrophobicContact CE1-CB 3.99Å; F215-I327 HydrophobicContact CE1-CG2 3.7Å; F215-K328 HydrophobicContact CD1-CG 3.83Å; F215-K328 HydrophobicContact CE1-CD 4.49Å; F215-K328 HydrophobicContact CE1-CG 3.69Å; F215-Y333 HydrophobicContact CD1-CD2 4.35Å
216	L	90.5	Very high	90.4	Very high	52 Å²	52	46.1 Å²	46.1	27%	0.272	23%	0.231	S	C	.	.	S	Bend	trans	-79.9	61.9	178	-57.2	177.9	0	0	0	111	E297 Y333 A335 R336	L216-E297 HydrophobicContact CD2-CG 3.68Å; L216-E297 WeakPolarHBondContact CD2-OE1 3.11Å; L216-Y333 PolarHBondContact N-O 3.19Å; L216-A335 VanDerWaalsContact CD1-O 3.27Å; L216-A335 WeakPolarHBondContact CD1-O 3.35Å; L216-R336 HydrophobicContact CD1-CB 4.43Å; L216-R336 HydrophobicContact CD1-CG 3.59Å; L216-R336 HydrophobicContact CD2-CG 4.35Å
217	T	91.7	Very high	90.8	Very high	17 Å²	17	43.3 Å²	43.3	10%	0.104	21%	0.214	C	C	.	.	S	Bend	trans	-155.6	168.2	-180	-167.1	0	0	0	0	110.5	F215 E221 L222 E297 T298 Y333	F215-T217 HydrophobicContact CB-CG2 4.04Å; F215-T217 PolarHBondContact O-N 3.29Å; T217-E221 VanDerWaalsContact OG1-CB 3.31Å; T217-E221 WeakPolarHBondContact OG1-CB 3.19Å; T217-L222 HydrophobicContact CG2-CB 3.83Å; T217-L222 HydrophobicContact CG2-CD1 4.28Å; T217-L222 HydrophobicContact CG2-CG 4.5Å; T217-E297 CarbonylContact O-C 3.52Å; T217-T298 WeakPolarHBondContact O-CB 3.22Å; T217-T298 PolarHBondContact O-N 2.91Å; T217-T298 PolarHBondContact O-OG1 2.77Å; T217-Y333 HydrophobicContact CG2-CD1 4.24Å; T217-Y333 HydrophobicContact CG2-CD2 3.68Å; T217-Y333 HydrophobicContact CG2-CE1 4.34Å; T217-Y333 HydrophobicContact CG2-CE2 3.78Å; T217-Y333 HydrophobicContact CG2-CG 3.94Å
218	S	92.7	Very high	91.2	Very high	50 Å²	50	44.4 Å²	44.4	35%	0.35	22%	0.22	S	C	.	.			trans	-75.4	155.5	174.8	67.3	0	0	0	0	111.8	E220 E221 L222	S218-E220 PolarHBondContact O-N 2.92Å; S218-E221 PolarHBondContact O-N 2.97Å; S218-E221 PolarHBondContact OG-N 3.31Å; S218-L222 PolarHBondContact O-N 3.1Å
219	P	91.8	Very high	91.3	Very high	17 Å²	17	43 Å²	43	11%	0.11	22%	0.215	C	C	.	.	H	α-helix	trans	-59.4	-33.1	177.3	-26.1	34.1	0	0	0	113	Y223 E267 F291 D293 T298	P219-Y223 WeakPolarHBondContact O-CB 3.23Å; P219-Y223 PolarHBondContact O-N 2.97Å; P219-E267 HydrophobicContact CB-CB 4.41Å; P219-F291 HydrophobicContact CB-CB 4.17Å; P219-D293 HydrophobicContact CG-CB 3.81Å; P219-T298 WeakPolarHBondContact CA-OG1 3.2Å; P219-T298 HydrophobicContact CB-CG2 4.26Å; P219-T298 VanDerWaalsContact CD-OG1 3.22Å; P219-T298 WeakPolarHBondContact CD-OG1 3.45Å; P219-T298 HydrophobicContact CG-CG2 4.17Å; P219-T298 WeakPolarHBondContact CG-OG1 3.47Å
220	E	92.8	Very high	91.4	Very high	103 Å²	103	50.3 Å²	50.3	48%	0.481	25%	0.249	S	C	.	.	H	α-helix	trans	-60.4	-52.1	175.6	-175.8	-176.2	-179.2	0	0	111.6	S218 Y223 R224 E267	S218-E220 PolarHBondContact O-N 2.92Å; E220-Y223 WeakPolarHBondContact O-CB 3.12Å; E220-Y223 PolarHBondContact O-N 2.79Å; E220-R224 WeakPolarHBondContact O-CG 3.48Å; E220-R224 PolarHBondContact O-N 2.8Å; E220-E267 HydrophobicContact CB-CG 3.93Å; E220-E267 HydrophobicContact CG-CG 4.44Å
221	E	92.1	Very high	91.4	Very high	59 Å²	59	49.3 Å²	49.3	28%	0.276	24%	0.241	S	C	.	.	H	α-helix	trans	-65.9	-43	-179.5	-75.1	-60.1	124.7	0	0	111.4	T217 S218 Y223 R224 V225	T217-E221 VanDerWaalsContact OG1-CB 3.31Å; T217-E221 WeakPolarHBondContact OG1-CB 3.19Å; S218-E221 PolarHBondContact O-N 2.97Å; S218-E221 PolarHBondContact OG-N 3.31Å; E221-Y223 VanDerWaalsContact C-N 3.31Å; E221-Y223 PolarHBondContact O-N 2.82Å; E221-R224 WeakPolarHBondContact O-CB 3.45Å; E221-R224 PolarHBondContact O-N 2.78Å; E221-R224 IonicContact OE1-CZ 3.63Å; E221-R224 IonicContact OE1-NH1 2.71Å; E221-R224 PolarHBondContact OE1-NH1 2.7Å; E221-R224 IonicContact OE2-NH1 3.52Å; E221-R224 PolarHBondContact OE2-NH1 3.45Å; E221-V225 PolarHBondContact O-N 3.47Å
222	L	92.8	Very high	91.6	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64	-38.4	176.4	-164.4	62	0	0	0	111.6	F215 T217 S218 R224 V225 F226 F291 T298 L300 I327 Y333	F215-L222 HydrophobicContact CB-CD1 4.33Å; F215-L222 HydrophobicContact CB-CD2 4.05Å; F215-L222 HydrophobicContact CD1-CD1 3.95Å; F215-L222 HydrophobicContact CD2-CD1 4.38Å; F215-L222 HydrophobicContact CD2-CD2 3.65Å; F215-L222 HydrophobicContact CE1-CD1 4.36Å; F215-L222 HydrophobicContact CE2-CD2 4.28Å; F215-L222 HydrophobicContact CG-CD1 3.96Å; F215-L222 HydrophobicContact CG-CD2 3.86Å; T217-L222 HydrophobicContact CG2-CB 3.83Å; T217-L222 HydrophobicContact CG2-CD1 4.28Å; T217-L222 HydrophobicContact CG2-CG 4.5Å; S218-L222 PolarHBondContact O-N 3.1Å; L222-R224 VanDerWaalsContact C-N 3.32Å; L222-R224 PolarHBondContact O-N 3.02Å; L222-V225 WeakPolarHBondContact O-CB 3.07Å; L222-V225 PolarHBondContact O-N 3.25Å; L222-F226 HydrophobicContact CD1-CE2 4.33Å; L222-F226 HydrophobicContact CG-CE2 4.32Å; L222-F226 WeakPolarHBondContact O-CD2 3.22Å; L222-F291 HydrophobicContact CB-CD1 4.14Å; L222-F291 HydrophobicContact CB-CE1 4.13Å; L222-F291 HydrophobicContact CD2-CD1 3.96Å; L222-F291 HydrophobicContact CD2-CE1 4.07Å; L222-F291 HydrophobicContact CG-CD1 4.12Å; L222-F291 HydrophobicContact CG-CE1 3.87Å; L222-T298 HydrophobicContact CD2-CG2 3.8Å; L222-L300 HydrophobicContact CD2-CB 4.03Å; L222-L300 HydrophobicContact CD2-CD1 4.46Å; L222-L300 HydrophobicContact CD2-CD2 4.35Å; L222-I327 HydrophobicContact CD1-CG2 3.9Å; L222-Y333 HydrophobicContact CD1-CD2 4.13Å; L222-Y333 HydrophobicContact CD1-CE2 4.31Å
223	Y	93.6	Very high	91.4	Very high	29 Å²	29	46.1 Å²	46.1	11%	0.114	23%	0.228	C	C	.	.	H	α-helix	trans	-60.9	-41.3	175.4	-179	-87.6	0	0	0	111.7	P219 E220 E221 V225 F226 T227 V265 I270 F291	P219-Y223 WeakPolarHBondContact O-CB 3.23Å; P219-Y223 PolarHBondContact O-N 2.97Å; E220-Y223 WeakPolarHBondContact O-CB 3.12Å; E220-Y223 PolarHBondContact O-N 2.79Å; E221-Y223 VanDerWaalsContact C-N 3.31Å; E221-Y223 PolarHBondContact O-N 2.82Å; Y223-V225 VanDerWaalsContact C-N 3.3Å; Y223-V225 PolarHBondContact O-N 2.97Å; Y223-F226 PolarHBondContact O-N 2.82Å; Y223-T227 HydrophobicContact CD1-CG2 4.17Å; Y223-T227 HydrophobicContact CE1-CG2 3.68Å; Y223-T227 HydrophobicContact CE2-CG2 4.38Å; Y223-T227 PolarHBondContact O-N 2.79Å; Y223-T227 PolarHBondContact O-OG1 2.87Å; Y223-V265 WeakPolarHBondContact CE2-O 3.28Å; Y223-I270 HydrophobicContact CD2-CD1 3.8Å; Y223-I270 HydrophobicContact CD2-CG1 3.86Å; Y223-I270 HydrophobicContact CE2-CD1 3.75Å; Y223-I270 HydrophobicContact CE2-CG1 3.44Å; Y223-I270 VanDerWaalsContact CE2-CG1 3.44Å; Y223-F291 HydrophobicContact CD2-CD2 4.35Å; Y223-F291 AromaticContact CD2-CE2 3.92Å; Y223-F291 HydrophobicContact CD2-CE2 3.92Å; Y223-F291 HydrophobicContact CD2-CZ 4.24Å
224	R	92.9	Very high	91.3	Very high	112 Å²	112	44.9 Å²	44.9	42%	0.423	23%	0.229	S	C	.	.	H	α-helix	trans	-61	-37.3	176.3	-70.9	175.2	68	-151.4	-2	112.2	E220 E221 L222 F226 T227 T228 L231	E220-R224 WeakPolarHBondContact O-CG 3.48Å; E220-R224 PolarHBondContact O-N 2.8Å; E221-R224 WeakPolarHBondContact O-CB 3.45Å; E221-R224 PolarHBondContact O-N 2.78Å; E221-R224 IonicContact OE1-CZ 3.63Å; E221-R224 IonicContact OE1-NH1 2.71Å; E221-R224 PolarHBondContact OE1-NH1 2.7Å; E221-R224 IonicContact OE2-NH1 3.52Å; E221-R224 PolarHBondContact OE2-NH1 3.45Å; L222-R224 VanDerWaalsContact C-N 3.32Å; L222-R224 PolarHBondContact O-N 3.02Å; R224-F226 VanDerWaalsContact C-N 3.26Å; R224-F226 PolarHBondContact O-N 2.84Å; R224-T227 WeakPolarHBondContact CA-OG1 3.49Å; R224-T227 CarbonylContact O-C 3.5Å; R224-T227 PolarHBondContact O-N 2.86Å; R224-T227 VanDerWaalsContact O-N 3.11Å; R224-T227 PolarHBondContact O-OG1 3.45Å; R224-T228 WeakPolarHBondContact O-CB 3.45Å; R224-T228 PolarHBondContact O-N 3.32Å; R224-T228 PolarHBondContact O-OG1 3.45Å; R224-L231 HydrophobicContact CB-CD1 4.17Å
225	V	93.3	Very high	91	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.5	-36.1	177.5	176.8	0	0	0	0	112.3	E221 L222 Y223 L231 V232 F235 I327 F331 Y333	E221-V225 PolarHBondContact O-N 3.47Å; L222-V225 WeakPolarHBondContact O-CB 3.07Å; L222-V225 PolarHBondContact O-N 3.25Å; Y223-V225 VanDerWaalsContact C-N 3.3Å; Y223-V225 PolarHBondContact O-N 2.97Å; V225-L231 HydrophobicContact CG2-CD1 4.22Å; V225-V232 WeakPolarHBondContact O-CG2 3.46Å; V225-F235 HydrophobicContact CG1-CD1 3.61Å; V225-F235 HydrophobicContact CG1-CE1 3.68Å; V225-I327 HydrophobicContact CG1-CD1 3.7Å; V225-I327 HydrophobicContact CG1-CG1 3.72Å; V225-I327 HydrophobicContact CG1-CG2 4.23Å; V225-F331 HydrophobicContact CG1-CD2 4.26Å; V225-F331 HydrophobicContact CG1-CE2 3.67Å; V225-F331 HydrophobicContact CG1-CZ 4.45Å; V225-F331 HydrophobicContact CG2-CD2 4.09Å; V225-F331 HydrophobicContact CG2-CE2 3.95Å; V225-F331 HydrophobicContact CG2-CZ 4.43Å; V225-Y333 HydrophobicContact CG2-CE2 4.01Å
226	F	91.8	Very high	90.4	Very high	10 Å²	10	43.6 Å²	43.6	4%	0.044	22%	0.221	C	C	.	.	H	α-helix	trans	-84.9	-12.7	178.1	-74.5	-92.6	0	0	0	114.2	L222 Y223 R224 I270 L289 F291 L300 W319 Y323 I327	L222-F226 HydrophobicContact CD1-CE2 4.33Å; L222-F226 HydrophobicContact CG-CE2 4.32Å; L222-F226 WeakPolarHBondContact O-CD2 3.22Å; Y223-F226 PolarHBondContact O-N 2.82Å; R224-F226 VanDerWaalsContact C-N 3.26Å; R224-F226 PolarHBondContact O-N 2.84Å; F226-I270 HydrophobicContact CB-CD1 3.63Å; F226-I270 HydrophobicContact CG-CD1 4.47Å; F226-L289 HydrophobicContact CD1-CD1 3.48Å; F226-L289 VanDerWaalsContact CD1-CD1 3.48Å; F226-L289 HydrophobicContact CE1-CD1 3.5Å; F226-L289 HydrophobicContact CG-CD1 4.03Å; F226-L289 HydrophobicContact CZ-CD1 4.12Å; F226-F291 HydrophobicContact CD2-CE1 4.23Å; F226-F291 HydrophobicContact CD2-CZ 4.2Å; F226-L300 HydrophobicContact CE2-CD2 3.8Å; F226-L300 HydrophobicContact CZ-CD2 3.66Å; F226-W319 HydrophobicContact CE1-CH2 4.47Å; F226-W319 HydrophobicContact CE1-CZ3 4.12Å; F226-Y323 HydrophobicContact CD1-CD1 4.31Å; F226-Y323 AromaticContact CE1-CD1 3.52Å; F226-Y323 HydrophobicContact CE1-CD1 3.52Å; F226-Y323 HydrophobicContact CE1-CE1 4.08Å; F226-Y323 HydrophobicContact CZ-CD1 4.24Å; F226-I327 HydrophobicContact CD2-CD1 4.4Å; F226-I327 HydrophobicContact CE1-CD1 4.38Å; F226-I327 HydrophobicContact CE2-CD1 3.58Å; F226-I327 HydrophobicContact CZ-CD1 3.56Å
227	T	92.3	Very high	89.9	Confident	19 Å²	19	48.6 Å²	48.6	12%	0.117	24%	0.242	C	C	.	.	H	α-helix	trans	-119.6	-1.3	-173.1	54.4	0	0	0	0	113.8	Y223 R224 L242 A244 L264 I270	Y223-T227 HydrophobicContact CD1-CG2 4.17Å; Y223-T227 HydrophobicContact CE1-CG2 3.68Å; Y223-T227 HydrophobicContact CE2-CG2 4.38Å; Y223-T227 PolarHBondContact O-N 2.79Å; Y223-T227 PolarHBondContact O-OG1 2.87Å; R224-T227 WeakPolarHBondContact CA-OG1 3.49Å; R224-T227 CarbonylContact O-C 3.5Å; R224-T227 PolarHBondContact O-N 2.86Å; R224-T227 VanDerWaalsContact O-N 3.11Å; R224-T227 PolarHBondContact O-OG1 3.45Å; T227-L242 WeakPolarHBondContact O-CD2 3.47Å; T227-A244 WeakPolarHBondContact O-CB 3.2Å; T227-L264 HydrophobicContact CG2-CD2 4.23Å; T227-I270 HydrophobicContact CG2-CD1 3.8Å
228	T	91.3	Very high	89.3	Confident	45 Å²	45	48.7 Å²	48.7	28%	0.276	25%	0.245	S	C	.	.			trans	-114.5	120.6	178.6	-51.2	0	0	0	0	109.8	R224 E230 L231 V232	R224-T228 WeakPolarHBondContact O-CB 3.45Å; R224-T228 PolarHBondContact O-N 3.32Å; R224-T228 PolarHBondContact O-OG1 3.45Å; T228-E230 VanDerWaalsContact C-N 3.33Å; T228-E230 PolarHBondContact O-N 3.32Å; T228-L231 HydrophobicContact CG2-CD1 4.31Å; T228-L231 HydrophobicContact CG2-CG 4.06Å; T228-L231 PolarHBondContact O-N 2.92Å; T228-L231 VanDerWaalsContact O-N 3.15Å; T228-V232 PolarHBondContact O-N 3.08Å
229	Q	90.3	Very high	88.7	Confident	77 Å²	77	50.6 Å²	50.6	36%	0.36	26%	0.256	S	S	.	.	H	α-helix	trans	-54.4	-46.4	-176.9	-176.3	179.5	-69.1	0	0	113.1	L231 V232 Q233 A240 L242	Q229-L231 VanDerWaalsContact C-N 3.3Å; Q229-L231 PolarHBondContact O-N 3.47Å; Q229-V232 PolarHBondContact O-N 3.49Å; Q229-Q233 WeakPolarHBondContact O-CG 3.46Å; Q229-Q233 PolarHBondContact O-N 3.44Å; Q229-A240 WeakPolarHBondContact CG-O 3.36Å; Q229-L242 HydrophobicContact CB-CB 4.12Å; Q229-L242 HydrophobicContact CG-CB 4.36Å
230	E	90.4	Very high	88.4	Confident	152 Å²	152	50 Å²	50	71%	0.71	25%	0.253	S	S	*	.	H	α-helix	trans	-61.1	-39.1	-178.7	-63.4	178.6	178.1	0	0	112	T228 Q233 A234	T228-E230 VanDerWaalsContact C-N 3.33Å; T228-E230 PolarHBondContact O-N 3.32Å; E230-Q233 PolarHBondContact O-N 3.41Å; E230-A234 WeakPolarHBondContact O-CB 3.35Å; E230-A234 PolarHBondContact O-N 3.1Å
231	L	90.8	Very high	88.2	Confident	40 Å²	40	49 Å²	49	21%	0.209	25%	0.254	C	S	.	.	H	α-helix	trans	-70.8	-38.1	178.2	-59.9	-179.4	0	0	0	111.4	R224 V225 T228 Q229 A234 F235 F331	R224-L231 HydrophobicContact CB-CD1 4.17Å; V225-L231 HydrophobicContact CG2-CD1 4.22Å; T228-L231 HydrophobicContact CG2-CD1 4.31Å; T228-L231 HydrophobicContact CG2-CG 4.06Å; T228-L231 PolarHBondContact O-N 2.92Å; T228-L231 VanDerWaalsContact O-N 3.15Å; Q229-L231 VanDerWaalsContact C-N 3.3Å; Q229-L231 PolarHBondContact O-N 3.47Å; L231-A234 WeakPolarHBondContact O-CB 3.26Å; L231-A234 PolarHBondContact O-N 3.32Å; L231-F235 WeakPolarHBondContact O-CD1 3.07Å; L231-F235 PolarHBondContact O-N 2.8Å; L231-F331 HydrophobicContact CB-CZ 3.94Å; L231-F331 HydrophobicContact CD2-CE1 3.71Å; L231-F331 HydrophobicContact CD2-CZ 3.9Å; L231-F331 HydrophobicContact CG-CZ 4.48Å
232	V	88.8	Confident	88.1	Confident	4 Å²	4	47.2 Å²	47.2	2%	0.024	25%	0.246	C	C	.	.	H	α-helix	trans	-61.4	-48.6	173.7	176.3	0	0	0	0	111.1	V225 T228 Q229 A234 F235 T236 A240 L242 M252	V225-V232 WeakPolarHBondContact O-CG2 3.46Å; T228-V232 PolarHBondContact O-N 3.08Å; Q229-V232 PolarHBondContact O-N 3.49Å; V232-A234 PolarHBondContact O-N 3.07Å; V232-F235 VanDerWaalsContact CA-CE1 3.49Å; V232-F235 HydrophobicContact CB-CE1 4.09Å; V232-F235 HydrophobicContact CG1-CE1 4.22Å; V232-F235 HydrophobicContact CG1-CZ 4.19Å; V232-F235 HydrophobicContact CG2-CE1 3.91Å; V232-F235 HydrophobicContact CG2-CZ 4.41Å; V232-F235 PolarHBondContact O-N 2.93Å; V232-T236 HydrophobicContact CG1-CG2 4.16Å; V232-T236 WeakPolarHBondContact O-CG2 3.31Å; V232-T236 PolarHBondContact O-N 3.07Å; V232-T236 PolarHBondContact O-OG1 2.8Å; V232-A240 HydrophobicContact CG1-CB 3.86Å; V232-L242 HydrophobicContact CB-CD1 4.41Å; V232-L242 HydrophobicContact CG2-CD1 3.6Å; V232-M252 HydrophobicContact CG1-CB 4.34Å; V232-M252 HydrophobicContact CG1-CE 3.84Å
233	Q	88.1	Confident	88	Confident	72 Å²	72	52.1 Å²	52.1	34%	0.336	27%	0.269	S	S	.	.	H	α-helix	trans	-57.8	-39	176.7	-70.1	-177.1	14.2	0	0	111.9	Q229 E230 H237 A240	Q229-Q233 WeakPolarHBondContact O-CG 3.46Å; Q229-Q233 PolarHBondContact O-N 3.44Å; E230-Q233 PolarHBondContact O-N 3.41Å; Q233-H237 WeakPolarHBondContact O-CA 3.37Å; Q233-H237 PolarHBondContact O-N 3.38Å; Q233-A240 HydrophobicContact CG-CB 3.79Å; Q233-A240 PolarHBondContact NE2-O 2.84Å
234	A	86.9	Confident	87.8	Confident	38 Å²	38	52.8 Å²	52.8	31%	0.314	28%	0.28	S	S	.	.	H	α-helix	trans	-62.8	-45.3	-180	0	0	0	0	0	112.8	E230 L231 V232 H237 T330 F331	E230-A234 WeakPolarHBondContact O-CB 3.35Å; E230-A234 PolarHBondContact O-N 3.1Å; L231-A234 WeakPolarHBondContact O-CB 3.26Å; L231-A234 PolarHBondContact O-N 3.32Å; V232-A234 PolarHBondContact O-N 3.07Å; A234-H237 PolarHBondContact O-CE1 2.84Å; A234-T330 HydrophobicContact CB-CG2 4.06Å; A234-F331 HydrophobicContact CB-CE1 4.44Å; A234-F331 HydrophobicContact CB-CZ 4.07Å
235	F	84.7	Confident	87.5	Confident	5 Å²	5	53.1 Å²	53.1	2%	0.022	29%	0.291	C	S	.	.	H	α-helix	trans	-84.2	-23.7	-179	80.2	-107.2	0	0	0	113.8	V225 L231 V232 M252 Y322 Y323 I327 T330 F331	V225-F235 HydrophobicContact CG1-CD1 3.61Å; V225-F235 HydrophobicContact CG1-CE1 3.68Å; L231-F235 WeakPolarHBondContact O-CD1 3.07Å; L231-F235 PolarHBondContact O-N 2.8Å; V232-F235 VanDerWaalsContact CA-CE1 3.49Å; V232-F235 HydrophobicContact CB-CE1 4.09Å; V232-F235 HydrophobicContact CG1-CE1 4.22Å; V232-F235 HydrophobicContact CG1-CZ 4.19Å; V232-F235 HydrophobicContact CG2-CE1 3.91Å; V232-F235 HydrophobicContact CG2-CZ 4.41Å; V232-F235 PolarHBondContact O-N 2.93Å; F235-M252 HydrophobicContact CE2-CE 4.28Å; F235-M252 HydrophobicContact CZ-CE 4.1Å; F235-Y322 WeakPolarHBondContact CD2-O 3.42Å; F235-Y322 VanDerWaalsContact CE2-O 3.23Å; F235-Y322 WeakPolarHBondContact CE2-O 3.44Å; F235-Y323 HydrophobicContact CE2-CD1 4.17Å; F235-Y323 HydrophobicContact CE2-CG 4.44Å; F235-Y323 HydrophobicContact CZ-CD1 4.07Å; F235-Y323 HydrophobicContact CZ-CE1 4.45Å; F235-I327 HydrophobicContact CB-CG1 4.12Å; F235-I327 HydrophobicContact CD1-CD1 4.32Å; F235-I327 HydrophobicContact CD1-CG1 3.68Å; F235-I327 HydrophobicContact CD2-CG1 3.89Å; F235-I327 HydrophobicContact CE1-CD1 4.1Å; F235-I327 HydrophobicContact CE1-CG1 3.98Å; F235-I327 HydrophobicContact CE2-CD1 4.47Å; F235-I327 HydrophobicContact CE2-CG1 4.21Å; F235-I327 HydrophobicContact CG-CG1 3.64Å; F235-I327 HydrophobicContact CZ-CD1 4.22Å; F235-I327 HydrophobicContact CZ-CG1 4.26Å; F235-T330 WeakPolarHBondContact CA-OG1 3.02Å; F235-T330 HydrophobicContact CB-CG2 4.33Å; F235-F331 HydrophobicContact CB-CE2 3.91Å; F235-F331 HydrophobicContact CD1-CE2 4.13Å; F235-F331 HydrophobicContact CG-CE2 4.49Å
236	T	79.4	Confident	87.2	Confident	15 Å²	15	62 Å²	62	9%	0.092	32%	0.324	C	S	.	.	H	α-helix	trans	-85.2	-14.2	175.2	60.7	0	0	0	0	113.8	V232 A238 M252 V253	V232-T236 HydrophobicContact CG1-CG2 4.16Å; V232-T236 WeakPolarHBondContact O-CG2 3.31Å; V232-T236 PolarHBondContact O-N 3.07Å; V232-T236 PolarHBondContact O-OG1 2.8Å; T236-A238 PolarHBondContact O-N 2.86Å; T236-A238 VanDerWaalsContact O-N 3.1Å; T236-A238 PolarHBondContact OG1-O 3.27Å; T236-M252 HydrophobicContact CG2-CE 3.59Å; T236-V253 HydrophobicContact CG2-CG2 4.3Å
237	H	79.6	Confident	86.9	Confident	156 Å²	156	63.2 Å²	63.2	72%	0.722	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	29.2	-173.6	-59.4	-72.2	0	0	0	113.9	Q233 A234	Q233-H237 WeakPolarHBondContact O-CA 3.37Å; Q233-H237 PolarHBondContact O-N 3.38Å; A234-H237 PolarHBondContact O-CE1 2.84Å
238	A	78.1	Confident	86.8	Confident	20 Å²	20	62.5 Å²	62.5	17%	0.165	34%	0.336	C	S	.	.	S	Bend	trans	-145.6	154.4	-172.3	0	0	0	0	0	110.3	T236 A240	T236-A238 PolarHBondContact O-N 2.86Å; T236-A238 VanDerWaalsContact O-N 3.1Å; T236-A238 PolarHBondContact OG1-O 3.27Å; A238-A240 PolarHBondContact O-N 2.77Å
239	P	80.6	Confident	86.8	Confident	90 Å²	90	66.3 Å²	66.3	58%	0.584	35%	0.348	S	S	*	.			trans	-56.1	129.2	172.5	-23.7	34.2	0	0	0	111.1
240	A	84.9	Confident	86.8	Confident	4 Å²	4	62.8 Å²	62.8	3%	0.033	33%	0.332	C	S	.	.			trans	-137.2	136.8	176.4	0	0	0	0	0	110.1	Q229 V232 Q233 A238 H251 M252	Q229-A240 WeakPolarHBondContact CG-O 3.36Å; V232-A240 HydrophobicContact CG1-CB 3.86Å; Q233-A240 HydrophobicContact CG-CB 3.79Å; Q233-A240 PolarHBondContact NE2-O 2.84Å; A238-A240 PolarHBondContact O-N 2.77Å; A240-H251 CarbonylContact C-O 3.45Å; A240-H251 WeakPolarHBondContact CA-O 3.19Å; A240-M252 HydrophobicContact CB-CB 3.95Å
241	T	89	Confident	86.7	Confident	83 Å²	83	59.8 Å²	59.8	51%	0.509	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.6	171.6	-54.7	0	0	0	0	107.5	F250 H251	T241-F250 CarbonylContact O-C 3.47Å; T241-F250 VanDerWaalsContact O-CA 3.23Å; T241-F250 WeakPolarHBondContact O-CA 3.38Å; T241-H251 PolarHBondContact N-O 2.81Å; T241-H251 PolarHBondContact O-N 3.38Å
242	L	90.9	Very high	86.3	Confident	20 Å²	20	58.3 Å²	58.3	11%	0.105	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	121.6	-175	-171.4	150.7	0	0	0	110.7	T227 Q229 V232 A244 F250 F261	T227-L242 WeakPolarHBondContact O-CD2 3.47Å; Q229-L242 HydrophobicContact CB-CB 4.12Å; Q229-L242 HydrophobicContact CG-CB 4.36Å; V232-L242 HydrophobicContact CB-CD1 4.41Å; V232-L242 HydrophobicContact CG2-CD1 3.6Å; L242-A244 HydrophobicContact CD2-CB 3.76Å; L242-F250 HydrophobicContact CB-CB 4.46Å; L242-F250 HydrophobicContact CG-CB 4.23Å; L242-F261 HydrophobicContact CD1-CE2 4.38Å; L242-F261 HydrophobicContact CD1-CZ 4.17Å; L242-F261 HydrophobicContact CD2-CE2 4.14Å; L242-F261 HydrophobicContact CD2-CZ 4.44Å; L242-F261 HydrophobicContact CG-CE2 3.99Å; L242-F261 HydrophobicContact CG-CZ 4.27Å
243	E	91.1	Very high	85.7	Confident	104 Å²	104	59.5 Å²	59.5	49%	0.486	32%	0.317	S	S	.	.			trans	-103.6	104.8	171.5	-63.8	171.7	178.8	0	0	109.1	D245 G248 K249 F261	E243-D245 PolarHBondContact O-N 3.39Å; E243-G248 WeakPolarHBondContact O-CA 3.37Å; E243-K249 PolarHBondContact N-O 3.47Å; E243-K249 PolarHBondContact OE2-N 3.4Å; E243-K249 VanDerWaalsContact OE2-N 3.1Å; E243-F261 VanDerWaalsContact O-CD2 3.29Å; E243-F261 WeakPolarHBondContact O-CD2 3.48Å
244	A	88.1	Confident	85	Confident	43 Å²	43	61.8 Å²	61.8	36%	0.355	33%	0.332	S	S	.	.			trans	-81.4	36.6	-171.6	0	0	0	0	0	114.1	T227 L242 L264	T227-A244 WeakPolarHBondContact O-CB 3.2Å; L242-A244 HydrophobicContact CD2-CB 3.76Å; A244-L264 WeakPolarHBondContact O-CD1 3.15Å
245	D	86.5	Confident	84.5	Confident	119 Å²	119	61.2 Å²	61.2	64%	0.636	33%	0.329	S	S	*	.	S	Bend	trans	-115.7	160.3	-178.9	-73.5	-60.4	0	0	0	110.7	E243 G247 G248	E243-D245 PolarHBondContact O-N 3.39Å; D245-G247 PolarHBondContact O-N 3.42Å; D245-G248 WeakPolarHBondContact O-CA 3.49Å; D245-G248 PolarHBondContact O-N 3.47Å
246	R	87.9	Confident	84.1	Confident	187 Å²	187	64 Å²	64	71%	0.706	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	118.9	173.5	-166.9	-178.2	-167.4	172.1	8.8	109.8	G248 T262 D263	R246-G248 VanDerWaalsContact C-N 3.32Å; R246-T262 WeakPolarHBondContact CG-O 3.24Å; R246-T262 PolarHBondContact NE-O 2.85Å; R246-D263 IonicContact CZ-OD1 2.72Å; R246-D263 IonicContact NH2-OD1 2.8Å
247	G	86.2	Confident	84.5	Confident	35 Å²	35	63.5 Å²	63.5	36%	0.361	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	-2.8	-171.2	0	0	0	0	0	113.8	D245 F261	D245-G247 PolarHBondContact O-N 3.42Å; G247-F261 VanDerWaalsContact CA-O 3.29Å; G247-F261 WeakPolarHBondContact CA-O 3.35Å; G247-F261 PolarHBondContact N-O 3.3Å
248	G	89	Confident	85	Confident	4 Å²	4	57.1 Å²	57.1	4%	0.041	31%	0.314	C	S	.	.			trans	-66.4	143.5	175.9	0	0	0	0	0	111.4	E243 D245 R246 E260 F261	E243-G248 WeakPolarHBondContact O-CA 3.37Å; D245-G248 WeakPolarHBondContact O-CA 3.49Å; D245-G248 PolarHBondContact O-N 3.47Å; R246-G248 VanDerWaalsContact C-N 3.32Å; G248-E260 CarbonylContact O-C 3.55Å; G248-E260 WeakPolarHBondContact O-CA 3.41Å; G248-F261 PolarHBondContact O-N 3.41Å
249	K	90.8	Very high	85.7	Confident	124 Å²	124	56.5 Å²	56.5	54%	0.539	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	153.2	-179.4	-66.7	179	-176.4	174.9	0	111.3	E243 G259	E243-K249 PolarHBondContact N-O 3.47Å; E243-K249 PolarHBondContact OE2-N 3.4Å; E243-K249 VanDerWaalsContact OE2-N 3.1Å; K249-G259 WeakPolarHBondContact CA-O 3.21Å
250	F	90.8	Very high	86.3	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.018	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	147	170.5	63.9	-93	0	0	0	111.9	T241 L242 M252 V257 S258 G259 F261 M272 K273	T241-F250 CarbonylContact O-C 3.47Å; T241-F250 VanDerWaalsContact O-CA 3.23Å; T241-F250 WeakPolarHBondContact O-CA 3.38Å; L242-F250 HydrophobicContact CB-CB 4.46Å; L242-F250 HydrophobicContact CG-CB 4.23Å; F250-M252 HydrophobicContact CD2-CG 4.48Å; F250-M252 HydrophobicContact CD2-SD 4.18Å; F250-M252 HydrophobicContact CE2-SD 4.36Å; F250-V257 HydrophobicContact CE2-CG1 4.33Å; F250-S258 WeakPolarHBondContact O-CA 3.42Å; F250-G259 VanDerWaalsContact CE1-C 3.41Å; F250-G259 VanDerWaalsContact CZ-CA 3.44Å; F250-G259 PolarHBondContact N-O 3.33Å; F250-G259 PolarHBondContact O-N 3.41Å; F250-F261 HydrophobicContact CB-CE2 4.24Å; F250-F261 AromaticContact CD1-CD2 3.95Å; F250-F261 HydrophobicContact CD1-CD2 3.95Å; F250-F261 HydrophobicContact CD1-CE1 4.42Å; F250-F261 AromaticContact CD1-CE2 3.6Å; F250-F261 HydrophobicContact CD1-CE2 3.6Å; F250-F261 HydrophobicContact CD1-CG 4.5Å; F250-F261 AromaticContact CD1-CZ 3.87Å; F250-F261 HydrophobicContact CD1-CZ 3.87Å; F250-F261 HydrophobicContact CE1-CE1 4.48Å; F250-F261 HydrophobicContact CE1-CE2 4.38Å; F250-F261 HydrophobicContact CE1-CZ 4.35Å; F250-F261 HydrophobicContact CG-CE2 4.28Å; F250-M272 HydrophobicContact CE1-CB 3.94Å; F250-M272 HydrophobicContact CE1-CG 4.34Å; F250-M272 HydrophobicContact CE1-SD 3.71Å; F250-M272 HydrophobicContact CE2-SD 4.48Å; F250-M272 HydrophobicContact CZ-CB 4.34Å; F250-M272 HydrophobicContact CZ-CG 4.31Å; F250-M272 HydrophobicContact CZ-SD 3.56Å; F250-M272 VanDerWaalsContact CZ-SD 3.56Å; F250-K273 WeakPolarHBondContact CZ-O 3.48Å
251	H	88.2	Confident	86.7	Confident	88 Å²	88	55.1 Å²	55.1	41%	0.407	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	128	172.5	-71.5	-81.7	0	0	0	107.9	A240 T241 V257 S258	A240-H251 CarbonylContact C-O 3.45Å; A240-H251 WeakPolarHBondContact CA-O 3.19Å; T241-H251 PolarHBondContact N-O 2.81Å; T241-H251 PolarHBondContact O-N 3.38Å; H251-V257 WeakPolarHBondContact CA-O 3.48Å; H251-S258 WeakPolarHBondContact ND1-CB 3.23Å
252	M	83.2	Confident	86.8	Confident	10 Å²	10	53.2 Å²	53.2	5%	0.049	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	168.5	-176.8	61.8	-170	-66.3	0	0	111.2	V232 F235 T236 A240 F250 G255 N256 V257 Y323	V232-M252 HydrophobicContact CG1-CB 4.34Å; V232-M252 HydrophobicContact CG1-CE 3.84Å; F235-M252 HydrophobicContact CE2-CE 4.28Å; F235-M252 HydrophobicContact CZ-CE 4.1Å; T236-M252 HydrophobicContact CG2-CE 3.59Å; A240-M252 HydrophobicContact CB-CB 3.95Å; F250-M252 HydrophobicContact CD2-CG 4.48Å; F250-M252 HydrophobicContact CD2-SD 4.18Å; F250-M252 HydrophobicContact CE2-SD 4.36Å; M252-G255 PolarHBondContact O-N 3.37Å; M252-N256 PolarHBondContact O-N 3.26Å; M252-V257 HydrophobicContact CG-CB 3.73Å; M252-V257 HydrophobicContact CG-CG1 3.74Å; M252-V257 PolarHBondContact N-O 2.88Å; M252-V257 PolarHBondContact O-N 2.93Å; M252-V257 HydrophobicContact SD-CG1 4.19Å; M252-Y323 HydrophobicContact CE-CD1 4.48Å; M252-Y323 HydrophobicContact CE-CE1 3.63Å; M252-Y323 HydrophobicContact CE-CE2 4.24Å; M252-Y323 VanDerWaalsContact CE-CZ 3.49Å; M252-Y323 WeakPolarHBondContact CE-OH 3.34Å; M252-Y323 HydrophobicContact SD-CE1 4.14Å; M252-Y323 PolarHBondContact SD-OH 3.37Å
253	V	76.4	Confident	86.8	Confident	28 Å²	28	54.5 Å²	54.5	17%	0.17	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	52.4	-175.6	-164.7	0	0	0	0	110.2	T236 G255 N256 V257	T236-V253 HydrophobicContact CG2-CG2 4.3Å; V253-G255 PolarHBondContact O-N 3.36Å; V253-N256 VanDerWaalsContact O-CB 3.27Å; V253-N256 WeakPolarHBondContact O-CB 3.43Å; V253-N256 PolarHBondContact O-N 3.39Å; V253-N256 PolarHBondContact O-ND2 3.28Å; V253-V257 HydrophobicContact CG2-CG2 4.32Å
254	D	73.3	Confident	86.8	Confident	121 Å²	121	51 Å²	51	65%	0.647	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	36	-178.3	-156.1	33.4	0	0	0	113.8	N256	D254-N256 VanDerWaalsContact C-N 3.26Å; D254-N256 PolarHBondContact O-N 3.06Å
255	G	76.7	Confident	86.9	Confident	26 Å²	26	51.1 Å²	51.1	27%	0.268	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	4.4	-179.3	0	0	0	0	0	115	M252 V253 V257	M252-G255 PolarHBondContact O-N 3.37Å; V253-G255 PolarHBondContact O-N 3.36Å; G255-V257 VanDerWaalsContact C-N 3.26Å; G255-V257 PolarHBondContact O-N 3.24Å
256	N	75.9	Confident	87.1	Confident	64 Å²	64	49.5 Å²	49.5	34%	0.342	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-25.7	173.2	-80.5	-47.9	0	0	0	112.9	M252 V253 D254 F276 K277	M252-N256 PolarHBondContact O-N 3.26Å; V253-N256 VanDerWaalsContact O-CB 3.27Å; V253-N256 WeakPolarHBondContact O-CB 3.43Å; V253-N256 PolarHBondContact O-N 3.39Å; V253-N256 PolarHBondContact O-ND2 3.28Å; D254-N256 VanDerWaalsContact C-N 3.26Å; D254-N256 PolarHBondContact O-N 3.06Å; N256-F276 CarbonylContact O-C 3.39Å; N256-F276 VanDerWaalsContact O-CA 3.3Å; N256-F276 WeakPolarHBondContact O-CA 3.32Å; N256-K277 PolarHBondContact O-N 2.77Å
257	V	87.5	Confident	87.1	Confident	4 Å²	4	45.5 Å²	45.5	2%	0.024	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	132.8	175.2	173.9	0	0	0	0	109	F250 H251 M252 V253 G255 W274 R275 F276	F250-V257 HydrophobicContact CE2-CG1 4.33Å; H251-V257 WeakPolarHBondContact CA-O 3.48Å; M252-V257 HydrophobicContact CG-CB 3.73Å; M252-V257 HydrophobicContact CG-CG1 3.74Å; M252-V257 PolarHBondContact N-O 2.88Å; M252-V257 PolarHBondContact O-N 2.93Å; M252-V257 HydrophobicContact SD-CG1 4.19Å; V253-V257 HydrophobicContact CG2-CG2 4.32Å; G255-V257 VanDerWaalsContact C-N 3.26Å; G255-V257 PolarHBondContact O-N 3.24Å; V257-W274 HydrophobicContact CB-CZ2 4.34Å; V257-W274 HydrophobicContact CG1-CD2 4.28Å; V257-W274 VanDerWaalsContact CG1-CE2 3.44Å; V257-W274 HydrophobicContact CG1-CZ2 3.68Å; V257-W274 HydrophobicContact CG2-CH2 4.24Å; V257-W274 HydrophobicContact CG2-CZ2 3.66Å; V257-R275 WeakPolarHBondContact CA-O 3.4Å; V257-F276 HydrophobicContact CG2-CD1 3.77Å; V257-F276 HydrophobicContact CG2-CE1 3.74Å
258	S	90.8	Very high	87.2	Confident	21 Å²	21	50.4 Å²	50.4	15%	0.147	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	156.5	176.9	58.8	0	0	0	0	111.8	F250 H251 R275	F250-S258 WeakPolarHBondContact O-CA 3.42Å; H251-S258 WeakPolarHBondContact ND1-CB 3.23Å; S258-R275 PolarHBondContact N-O 2.98Å; S258-R275 PolarHBondContact O-N 2.8Å
259	G	92.6	Very high	87.4	Confident	8 Å²	8	52.7 Å²	52.7	8%	0.082	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.4	-170.7	-177.5	0	0	0	0	0	114.6	K249 F250 K273	K249-G259 WeakPolarHBondContact CA-O 3.21Å; F250-G259 VanDerWaalsContact CE1-C 3.41Å; F250-G259 VanDerWaalsContact CZ-CA 3.44Å; F250-G259 PolarHBondContact N-O 3.33Å; F250-G259 PolarHBondContact O-N 3.41Å; G259-K273 WeakPolarHBondContact CA-O 3.31Å
260	E	92.9	Very high	87.6	Confident	60 Å²	60	46.8 Å²	46.8	28%	0.28	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	131.2	-175.9	-178.6	-167.2	174.4	0	0	108.9	G248 T262 M272 K273	G248-E260 CarbonylContact O-C 3.55Å; G248-E260 WeakPolarHBondContact O-CA 3.41Å; E260-T262 PolarHBondContact O-N 3.26Å; E260-M272 CarbonylContact O-C 3.48Å; E260-M272 VanDerWaalsContact O-CA 3.25Å; E260-M272 WeakPolarHBondContact O-CA 3.31Å; E260-M272 WeakPolarHBondContact O-CB 3.36Å; E260-K273 HydrophobicContact CB-CB 4.44Å; E260-K273 PolarHBondContact N-O 3.06Å; E260-K273 PolarHBondContact O-N 3.25Å; E260-K273 IonicContact OE2-NZ 3.78Å; E260-K273 PolarHBondContact OE2-NZ 3.06Å
261	F	92.9	Very high	87.7	Confident	4 Å²	4	47.8 Å²	47.8	2%	0.018	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	124	173.5	-67.6	-74.3	0	0	0	110.3	L242 E243 G247 G248 F250 L264 I270 M272	L242-F261 HydrophobicContact CD1-CE2 4.38Å; L242-F261 HydrophobicContact CD1-CZ 4.17Å; L242-F261 HydrophobicContact CD2-CE2 4.14Å; L242-F261 HydrophobicContact CD2-CZ 4.44Å; L242-F261 HydrophobicContact CG-CE2 3.99Å; L242-F261 HydrophobicContact CG-CZ 4.27Å; E243-F261 VanDerWaalsContact O-CD2 3.29Å; E243-F261 WeakPolarHBondContact O-CD2 3.48Å; G247-F261 VanDerWaalsContact CA-O 3.29Å; G247-F261 WeakPolarHBondContact CA-O 3.35Å; G247-F261 PolarHBondContact N-O 3.3Å; G248-F261 PolarHBondContact O-N 3.41Å; F250-F261 HydrophobicContact CB-CE2 4.24Å; F250-F261 AromaticContact CD1-CD2 3.95Å; F250-F261 HydrophobicContact CD1-CD2 3.95Å; F250-F261 HydrophobicContact CD1-CE1 4.42Å; F250-F261 AromaticContact CD1-CE2 3.6Å; F250-F261 HydrophobicContact CD1-CE2 3.6Å; F250-F261 HydrophobicContact CD1-CG 4.5Å; F250-F261 AromaticContact CD1-CZ 3.87Å; F250-F261 HydrophobicContact CD1-CZ 3.87Å; F250-F261 HydrophobicContact CE1-CE1 4.48Å; F250-F261 HydrophobicContact CE1-CE2 4.38Å; F250-F261 HydrophobicContact CE1-CZ 4.35Å; F250-F261 HydrophobicContact CG-CE2 4.28Å; F261-L264 HydrophobicContact CB-CD1 4.01Å; F261-L264 HydrophobicContact CB-CD2 4.49Å; F261-L264 HydrophobicContact CB-CG 4.18Å; F261-L264 HydrophobicContact CD1-CD1 4.44Å; F261-L264 HydrophobicContact CD1-CD2 3.71Å; F261-L264 HydrophobicContact CD1-CG 4.32Å; F261-L264 HydrophobicContact CE1-CD2 4.23Å; F261-L264 HydrophobicContact CG-CD1 4.16Å; F261-L264 HydrophobicContact CG-CD2 4.26Å; F261-L264 HydrophobicContact CG-CG 4.42Å; F261-I270 HydrophobicContact CD1-CG2 3.83Å; F261-I270 HydrophobicContact CE1-CG2 3.81Å; F261-M272 HydrophobicContact CD1-CB 4.02Å; F261-M272 HydrophobicContact CD1-SD 4.49Å; F261-M272 HydrophobicContact CE1-CB 4.49Å; F261-M272 HydrophobicContact CE1-SD 4.04Å
262	T	90.8	Very high	88.1	Confident	44 Å²	44	43.9 Å²	43.9	27%	0.27	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	-30.6	-179.2	54.6	0	0	0	0	112.5	R246 E260 V271 K273	R246-T262 WeakPolarHBondContact CG-O 3.24Å; R246-T262 PolarHBondContact NE-O 2.85Å; E260-T262 PolarHBondContact O-N 3.26Å; T262-V271 PolarHBondContact N-O 2.89Å; T262-V271 WeakPolarHBondContact OG1-CB 2.98Å; T262-V271 VanDerWaalsContact OG1-CG1 3.3Å; T262-V271 WeakPolarHBondContact OG1-CG1 3.12Å; T262-V271 PolarHBondContact OG1-O 3.45Å; T262-V271 VanDerWaalsContact OG1-O 3.1Å; T262-K273 HydrophobicContact CG2-CG 4.12Å
263	D	91.3	Very high	88.6	Confident	47 Å²	47	47 Å²	47	25%	0.251	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	135.8	176.4	-160.1	37.2	0	0	0	110.7	R246 H269 V271	R246-D263 IonicContact CZ-OD1 2.72Å; R246-D263 IonicContact NH2-OD1 2.8Å; D263-H269 IonicContact OD2-CD2 3.39Å; D263-H269 IonicContact OD2-CE1 3.67Å; D263-H269 IonicContact OD2-NE2 3.02Å; D263-H269 PolarHBondContact OD2-NE2 3.4Å; D263-V271 HydrophobicContact CB-CB 3.93Å; D263-V271 HydrophobicContact CB-CG2 3.98Å; D263-V271 PolarHBondContact N-O 2.97Å; D263-V271 VanDerWaalsContact N-O 3.15Å; D263-V271 PolarHBondContact O-N 3.34Å
264	L	91.1	Very high	89.4	Confident	31 Å²	31	45.8 Å²	45.8	16%	0.162	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	110.7	-176.5	-73.1	172.4	0	0	0	107.9	T227 A244 F261 I270	T227-L264 HydrophobicContact CG2-CD2 4.23Å; A244-L264 WeakPolarHBondContact O-CD1 3.15Å; F261-L264 HydrophobicContact CB-CD1 4.01Å; F261-L264 HydrophobicContact CB-CD2 4.49Å; F261-L264 HydrophobicContact CB-CG 4.18Å; F261-L264 HydrophobicContact CD1-CD1 4.44Å; F261-L264 HydrophobicContact CD1-CD2 3.71Å; F261-L264 HydrophobicContact CD1-CG 4.32Å; F261-L264 HydrophobicContact CE1-CD2 4.23Å; F261-L264 HydrophobicContact CG-CD1 4.16Å; F261-L264 HydrophobicContact CG-CD2 4.26Å; F261-L264 HydrophobicContact CG-CG 4.42Å; L264-I270 HydrophobicContact CD2-CB 4.18Å; L264-I270 HydrophobicContact CD2-CD1 4.44Å; L264-I270 HydrophobicContact CD2-CG1 3.79Å; L264-I270 HydrophobicContact CD2-CG2 3.75Å
265	V	91.2	Very high	90.1	Very high	44 Å²	44	41.6 Å²	41.6	27%	0.267	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	111.5	174.3	-177.2	0	0	0	0	108	Y223 E267 K268 H269	Y223-V265 WeakPolarHBondContact CE2-O 3.28Å; V265-E267 PolarHBondContact O-N 2.9Å; V265-K268 HydrophobicContact CB-CB 4.29Å; V265-K268 HydrophobicContact CG1-CB 3.89Å; V265-K268 HydrophobicContact CG1-CD 3.94Å; V265-K268 HydrophobicContact CG1-CG 4.25Å; V265-K268 PolarHBondContact O-N 2.95Å; V265-K268 VanDerWaalsContact O-N 3.17Å; V265-H269 WeakPolarHBondContact CG2-CE1 3.49Å; V265-H269 PolarHBondContact N-O 2.89Å; V265-H269 PolarHBondContact O-N 3.37Å; V265-H269 VanDerWaalsContact O-N 3.17Å; V265-H269 VanDerWaalsContact O-O 3.12Å
266	P	89.2	Confident	90.5	Very high	86 Å²	86	41.2 Å²	41.2	56%	0.558	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.1	135.8	-179.2	-29.3	35.3	0	0	0	112.3	K268	P266-K268 PolarHBondContact O-N 2.86Å
267	E	88	Confident	90.7	Very high	102 Å²	102	45.1 Å²	45.1	48%	0.477	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	0.3	177	-60.5	166.5	-137.5	0	0	116.3	P219 E220 V265	P219-E267 HydrophobicContact CB-CB 4.41Å; E220-E267 HydrophobicContact CB-CG 3.93Å; E220-E267 HydrophobicContact CG-CG 4.44Å; V265-E267 PolarHBondContact O-N 2.9Å
268	K	89.3	Confident	90.2	Very high	139 Å²	139	48.2 Å²	48.2	60%	0.604	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.1	-60.9	-176.1	-69.1	-172.6	177.9	178.1	0	112.8	V265 P266 F291	V265-K268 HydrophobicContact CB-CB 4.29Å; V265-K268 HydrophobicContact CG1-CB 3.89Å; V265-K268 HydrophobicContact CG1-CD 3.94Å; V265-K268 HydrophobicContact CG1-CG 4.25Å; V265-K268 PolarHBondContact O-N 2.95Å; V265-K268 VanDerWaalsContact O-N 3.17Å; P266-K268 PolarHBondContact O-N 2.86Å; K268-F291 PolarHBondContact O-N 3.06Å
269	H	92.3	Very high	89.8	Confident	51 Å²	51	47.6 Å²	47.6	24%	0.236	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	154.7	-176.5	70.6	-99.6	0	0	0	113.7	D263 V265 L289	D263-H269 IonicContact OD2-CD2 3.39Å; D263-H269 IonicContact OD2-CE1 3.67Å; D263-H269 IonicContact OD2-NE2 3.02Å; D263-H269 PolarHBondContact OD2-NE2 3.4Å; V265-H269 WeakPolarHBondContact CG2-CE1 3.49Å; V265-H269 PolarHBondContact N-O 2.89Å; V265-H269 PolarHBondContact O-N 3.37Å; V265-H269 VanDerWaalsContact O-N 3.17Å; V265-H269 VanDerWaalsContact O-O 3.12Å; H269-L289 CarbonylContact C-O 3.52Å; H269-L289 WeakPolarHBondContact CA-O 3.5Å; H269-L289 WeakPolarHBondContact CB-O 3.49Å
270	I	94.6	Very high	89.1	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	125.5	172.1	-64.8	170.9	0	0	0	107.3	Y223 F226 T227 F261 L264 T288 L289 F291	Y223-I270 HydrophobicContact CD2-CD1 3.8Å; Y223-I270 HydrophobicContact CD2-CG1 3.86Å; Y223-I270 HydrophobicContact CE2-CD1 3.75Å; Y223-I270 HydrophobicContact CE2-CG1 3.44Å; Y223-I270 VanDerWaalsContact CE2-CG1 3.44Å; F226-I270 HydrophobicContact CB-CD1 3.63Å; F226-I270 HydrophobicContact CG-CD1 4.47Å; T227-I270 HydrophobicContact CG2-CD1 3.8Å; F261-I270 HydrophobicContact CD1-CG2 3.83Å; F261-I270 HydrophobicContact CE1-CG2 3.81Å; L264-I270 HydrophobicContact CD2-CB 4.18Å; L264-I270 HydrophobicContact CD2-CD1 4.44Å; L264-I270 HydrophobicContact CD2-CG1 3.79Å; L264-I270 HydrophobicContact CD2-CG2 3.75Å; I270-T288 CarbonylContact O-C 3.48Å; I270-T288 WeakPolarHBondContact O-CA 3.29Å; I270-L289 HydrophobicContact CB-CB 4.23Å; I270-L289 HydrophobicContact CB-CD1 4.45Å; I270-L289 PolarHBondContact N-O 3.09Å; I270-L289 PolarHBondContact O-N 2.99Å; I270-F291 HydrophobicContact CB-CE2 4.42Å; I270-F291 HydrophobicContact CD1-CE2 3.85Å; I270-F291 HydrophobicContact CD1-CZ 3.75Å; I270-F291 HydrophobicContact CG1-CE2 3.86Å; I270-F291 HydrophobicContact CG1-CZ 4.29Å
271	V	94.6	Very high	88.2	Confident	25 Å²	25	56.5 Å²	56.5	15%	0.152	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.5	170.2	-167	0	0	0	0	108.7	T262 D263 T286 I287 T288	T262-V271 PolarHBondContact N-O 2.89Å; T262-V271 WeakPolarHBondContact OG1-CB 2.98Å; T262-V271 VanDerWaalsContact OG1-CG1 3.3Å; T262-V271 WeakPolarHBondContact OG1-CG1 3.12Å; T262-V271 PolarHBondContact OG1-O 3.45Å; T262-V271 VanDerWaalsContact OG1-O 3.1Å; D263-V271 HydrophobicContact CB-CB 3.93Å; D263-V271 HydrophobicContact CB-CG2 3.98Å; D263-V271 PolarHBondContact N-O 2.97Å; D263-V271 VanDerWaalsContact N-O 3.15Å; D263-V271 PolarHBondContact O-N 3.34Å; V271-T286 HydrophobicContact CG1-CG2 3.86Å; V271-I287 WeakPolarHBondContact CA-O 3.32Å; V271-T288 HydrophobicContact CG2-CG2 4.17Å
272	M	94.9	Very high	87.6	Confident	6 Å²	6	59 Å²	59	3%	0.03	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	151.4	179.5	56.7	-177.2	161.9	0	0	112.1	F250 E260 F261 I287 L289 W319	F250-M272 HydrophobicContact CE1-CB 3.94Å; F250-M272 HydrophobicContact CE1-CG 4.34Å; F250-M272 HydrophobicContact CE1-SD 3.71Å; F250-M272 HydrophobicContact CE2-SD 4.48Å; F250-M272 HydrophobicContact CZ-CB 4.34Å; F250-M272 HydrophobicContact CZ-CG 4.31Å; F250-M272 HydrophobicContact CZ-SD 3.56Å; F250-M272 VanDerWaalsContact CZ-SD 3.56Å; E260-M272 CarbonylContact O-C 3.48Å; E260-M272 VanDerWaalsContact O-CA 3.25Å; E260-M272 WeakPolarHBondContact O-CA 3.31Å; E260-M272 WeakPolarHBondContact O-CB 3.36Å; F261-M272 HydrophobicContact CD1-CB 4.02Å; F261-M272 HydrophobicContact CD1-SD 4.49Å; F261-M272 HydrophobicContact CE1-CB 4.49Å; F261-M272 HydrophobicContact CE1-SD 4.04Å; M272-I287 HydrophobicContact CE-CB 4.35Å; M272-I287 HydrophobicContact CE-CG2 4.13Å; M272-I287 HydrophobicContact CG-CB 4.11Å; M272-I287 PolarHBondContact N-O 3.25Å; M272-I287 PolarHBondContact O-N 3.14Å; M272-L289 HydrophobicContact CE-CD1 3.77Å; M272-L289 HydrophobicContact CE-CG 4.26Å; M272-W319 HydrophobicContact CE-CH2 3.57Å; M272-W319 HydrophobicContact CE-CZ2 3.96Å
273	K	94.6	Very high	87.4	Confident	76 Å²	76	58.6 Å²	58.6	33%	0.33	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	141.6	160.2	-67.6	179.2	-164.3	151.9	0	108.7	F250 G259 E260 T262 F284 A285	F250-K273 WeakPolarHBondContact CZ-O 3.48Å; G259-K273 WeakPolarHBondContact CA-O 3.31Å; E260-K273 HydrophobicContact CB-CB 4.44Å; E260-K273 PolarHBondContact N-O 3.06Å; E260-K273 PolarHBondContact O-N 3.25Å; E260-K273 IonicContact OE2-NZ 3.78Å; E260-K273 PolarHBondContact OE2-NZ 3.06Å; T262-K273 HydrophobicContact CG2-CG 4.12Å; K273-F284 HydrophobicContact CB-CB 4.1Å; K273-F284 HydrophobicContact CB-CD1 3.98Å; K273-F284 HydrophobicContact CB-CG 4.27Å; K273-F284 HydrophobicContact CD-CB 4.46Å; K273-F284 HydrophobicContact CD-CG 4.44Å; K273-F284 HydrophobicContact CG-CB 4.41Å; K273-A285 CarbonylContact C-O 3.58Å; K273-A285 VanDerWaalsContact CA-O 3.31Å; K273-A285 WeakPolarHBondContact CA-O 3.31Å
274	W	93.3	Very high	87.3	Confident	3 Å²	3	60 Å²	60	1%	0.011	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	137.8	-175.1	-168.3	99	0	0	0	109.9	V257 F276 W279 A285 I287 T315 W319 Y323	V257-W274 HydrophobicContact CB-CZ2 4.34Å; V257-W274 HydrophobicContact CG1-CD2 4.28Å; V257-W274 VanDerWaalsContact CG1-CE2 3.44Å; V257-W274 HydrophobicContact CG1-CZ2 3.68Å; V257-W274 HydrophobicContact CG2-CH2 4.24Å; V257-W274 HydrophobicContact CG2-CZ2 3.66Å; W274-F276 AromaticContact CH2-CD1 3.96Å; W274-F276 HydrophobicContact CH2-CD1 3.96Å; W274-F276 AromaticContact CH2-CD2 3.75Å; W274-F276 HydrophobicContact CH2-CD2 3.75Å; W274-F276 AromaticContact CH2-CE1 3.73Å; W274-F276 HydrophobicContact CH2-CE1 3.73Å; W274-F276 AromaticContact CH2-CE2 3.52Å; W274-F276 HydrophobicContact CH2-CE2 3.52Å; W274-F276 AromaticContact CH2-CG 3.97Å; W274-F276 HydrophobicContact CH2-CG 3.97Å; W274-F276 AromaticContact CH2-CZ 3.53Å; W274-F276 HydrophobicContact CH2-CZ 3.53Å; W274-F276 HydrophobicContact CZ2-CE1 4.31Å; W274-F276 HydrophobicContact CZ2-CZ 4.36Å; W274-F276 AromaticContact CZ3-CD2 3.85Å; W274-F276 HydrophobicContact CZ3-CD2 3.85Å; W274-F276 AromaticContact CZ3-CE2 3.96Å; W274-F276 HydrophobicContact CZ3-CE2 3.96Å; W274-F276 HydrophobicContact CZ3-CG 4.21Å; W274-F276 HydrophobicContact CZ3-CZ 4.41Å; W274-W279 HydrophobicContact CE3-CH2 4.16Å; W274-W279 HydrophobicContact CE3-CZ2 4.45Å; W274-W279 HydrophobicContact CZ3-CH2 4.14Å; W274-W279 AromaticContact CZ3-CZ2 3.97Å; W274-W279 HydrophobicContact CZ3-CZ2 3.97Å; W274-A285 PolarHBondContact N-O 3.26Å; W274-A285 PolarHBondContact O-N 2.84Å; W274-I287 HydrophobicContact CB-CB 4.44Å; W274-I287 HydrophobicContact CB-CD1 4.37Å; W274-I287 HydrophobicContact CB-CG1 3.41Å; W274-I287 VanDerWaalsContact CB-CG1 3.41Å; W274-I287 HydrophobicContact CG-CG1 3.87Å; W274-T315 HydrophobicContact CE3-CG2 4.41Å; W274-T315 HydrophobicContact CH2-CG2 4.14Å; W274-T315 HydrophobicContact CZ3-CG2 3.79Å; W274-W319 AromaticContact CD1-CZ2 4Å; W274-W319 AromaticContact CE2-NE1 3.71Å; W274-W319 AromaticContact CZ2-NE1 3.84Å; W274-W319 AromaticContact NE1-CZ2 3.88Å; W274-W319 AromaticContact NE1-NE1 3.97Å; W274-Y323 AromaticContact NE1-CZ 3.89Å; W274-Y323 PolarHBondContact NE1-OH 2.63Å
275	R	88.7	Confident	87.4	Confident	32 Å²	32	58.5 Å²	58.5	12%	0.121	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	155.9	172.5	63.5	177.5	-72.1	-163.7	-1.5	111.6	V257 S258 W279 P280 H283 F284	V257-R275 WeakPolarHBondContact CA-O 3.4Å; S258-R275 PolarHBondContact N-O 2.98Å; S258-R275 PolarHBondContact O-N 2.8Å; R275-W279 HydrophobicContact CB-CB 4.49Å; R275-W279 HydrophobicContact CB-CD2 4.18Å; R275-W279 HydrophobicContact CB-CE3 3.67Å; R275-W279 HydrophobicContact CB-CZ3 4.23Å; R275-W279 PolarHBondContact NH2-O 3.19Å; R275-P280 PolarHBondContact NH2-O 2.61Å; R275-H283 WeakPolarHBondContact CB-O 3.39Å; R275-F284 HydrophobicContact CB-CD1 4.02Å; R275-F284 HydrophobicContact CB-CE1 4.46Å; R275-F284 HydrophobicContact CG-CD1 3.63Å; R275-F284 HydrophobicContact CG-CE1 3.59Å; R275-F284 HydrophobicContact CG-CG 4.49Å; R275-F284 HydrophobicContact CG-CZ 4.39Å
276	F	84.8	Confident	87.5	Confident	19 Å²	19	59.5 Å²	59.5	8%	0.083	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	153.1	158.4	-73.6	-63.2	0	0	0	111	N256 V257 W274 S278 W279 R314	N256-F276 CarbonylContact O-C 3.39Å; N256-F276 VanDerWaalsContact O-CA 3.3Å; N256-F276 WeakPolarHBondContact O-CA 3.32Å; V257-F276 HydrophobicContact CG2-CD1 3.77Å; V257-F276 HydrophobicContact CG2-CE1 3.74Å; W274-F276 AromaticContact CH2-CD1 3.96Å; W274-F276 HydrophobicContact CH2-CD1 3.96Å; W274-F276 AromaticContact CH2-CD2 3.75Å; W274-F276 HydrophobicContact CH2-CD2 3.75Å; W274-F276 AromaticContact CH2-CE1 3.73Å; W274-F276 HydrophobicContact CH2-CE1 3.73Å; W274-F276 AromaticContact CH2-CE2 3.52Å; W274-F276 HydrophobicContact CH2-CE2 3.52Å; W274-F276 AromaticContact CH2-CG 3.97Å; W274-F276 HydrophobicContact CH2-CG 3.97Å; W274-F276 AromaticContact CH2-CZ 3.53Å; W274-F276 HydrophobicContact CH2-CZ 3.53Å; W274-F276 HydrophobicContact CZ2-CE1 4.31Å; W274-F276 HydrophobicContact CZ2-CZ 4.36Å; W274-F276 AromaticContact CZ3-CD2 3.85Å; W274-F276 HydrophobicContact CZ3-CD2 3.85Å; W274-F276 AromaticContact CZ3-CE2 3.96Å; W274-F276 HydrophobicContact CZ3-CE2 3.96Å; W274-F276 HydrophobicContact CZ3-CG 4.21Å; W274-F276 HydrophobicContact CZ3-CZ 4.41Å; F276-S278 PolarHBondContact O-N 3.37Å; F276-W279 HydrophobicContact CB-CG 4.18Å; F276-W279 HydrophobicContact CD2-CZ2 4.31Å; F276-W279 AromaticContact CD2-NE1 3.52Å; F276-W279 WeakPolarHBondContact O-CB 3.4Å; F276-W279 PolarHBondContact O-N 3.41Å; F276-W279 VanDerWaalsContact O-N 3.12Å; F276-R314 HydrophobicContact CE2-CG 4.07Å; F276-R314 HydrophobicContact CZ-CG 4.38Å
277	K	80.6	Confident	87.8	Confident	145 Å²	145	55.4 Å²	55.4	63%	0.63	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-34.4	170.4	-174.2	179.6	178.8	-174.8	0	111.7	N256 W279	N256-K277 PolarHBondContact O-N 2.77Å; K277-W279 VanDerWaalsContact C-N 3.25Å; K277-W279 PolarHBondContact O-N 2.96Å
278	S	76.1	Confident	88.1	Confident	69 Å²	69	52.1 Å²	52.1	48%	0.483	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-8.1	177.9	64.3	0	0	0	0	114.6	F276 R314	F276-S278 PolarHBondContact O-N 3.37Å; S278-R314 PolarHBondContact OG-NH1 2.94Å
279	W	83.2	Confident	88.4	Confident	9 Å²	9	45.5 Å²	45.5	3%	0.034	24%	0.243	C	C	.	.	S	Bend	trans	-72.8	156.3	177.8	-74	12.2	0	0	0	111.7	W274 R275 F276 K277 H283 A285 I307 P308 E311 T315	W274-W279 HydrophobicContact CE3-CH2 4.16Å; W274-W279 HydrophobicContact CE3-CZ2 4.45Å; W274-W279 HydrophobicContact CZ3-CH2 4.14Å; W274-W279 AromaticContact CZ3-CZ2 3.97Å; W274-W279 HydrophobicContact CZ3-CZ2 3.97Å; R275-W279 HydrophobicContact CB-CB 4.49Å; R275-W279 HydrophobicContact CB-CD2 4.18Å; R275-W279 HydrophobicContact CB-CE3 3.67Å; R275-W279 HydrophobicContact CB-CZ3 4.23Å; R275-W279 PolarHBondContact NH2-O 3.19Å; F276-W279 HydrophobicContact CB-CG 4.18Å; F276-W279 HydrophobicContact CD2-CZ2 4.31Å; F276-W279 AromaticContact CD2-NE1 3.52Å; F276-W279 WeakPolarHBondContact O-CB 3.4Å; F276-W279 PolarHBondContact O-N 3.41Å; F276-W279 VanDerWaalsContact O-N 3.12Å; K277-W279 VanDerWaalsContact C-N 3.25Å; K277-W279 PolarHBondContact O-N 2.96Å; W279-H283 AromaticContact CE3-CD2 3.76Å; W279-A285 HydrophobicContact CH2-CB 3.75Å; W279-A285 HydrophobicContact CZ3-CB 3.7Å; W279-I307 HydrophobicContact CH2-CB 4.09Å; W279-I307 HydrophobicContact CH2-CG1 4.05Å; W279-I307 HydrophobicContact CH2-CG2 3.82Å; W279-I307 HydrophobicContact CZ2-CG2 3.85Å; W279-P308 HydrophobicContact CD2-CG 3.78Å; W279-P308 HydrophobicContact CE3-CG 3.9Å; W279-P308 HydrophobicContact CG-CG 4.27Å; W279-P308 HydrophobicContact CH2-CG 4.4Å; W279-P308 VanDerWaalsContact CZ2-CD 3.47Å; W279-P308 HydrophobicContact CZ2-CG 4.28Å; W279-P308 HydrophobicContact CZ3-CG 4.19Å; W279-E311 HydrophobicContact CZ2-CB 4.16Å; W279-E311 VanDerWaalsContact NE1-CG 3.35Å; W279-E311 PolarHBondContact NE1-OE2 2.82Å; W279-T315 WeakPolarHBondContact CZ2-OG1 3.48Å
280	P	76.3	Confident	88.5	Confident	64 Å²	64	45.6 Å²	45.6	42%	0.416	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-52.2	144.1	174.2	-27.2	36.3	0	0	0	112.3	I204 R275 G282 H283	I204-P280 HydrophobicContact CD1-CB 4.04Å; I204-P280 HydrophobicContact CD1-CG 3.9Å; R275-P280 PolarHBondContact NH2-O 2.61Å; P280-G282 PolarHBondContact O-N 2.87Å; P280-H283 HydrophobicContact CB-CB 4.17Å; P280-H283 WeakPolarHBondContact O-CB 2.89Å; P280-H283 PolarHBondContact O-N 3.23Å
281	E	74.9	Confident	88.4	Confident	191 Å²	191	46.1 Å²	46.1	89%	0.893	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	134	179.9	-164.6	177.6	177.8	0	0	111.1	H283	E281-H283 PolarHBondContact O-N 2.86Å
282	G	79.9	Confident	88.3	Confident	57 Å²	57	48.1 Å²	48.1	59%	0.588	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	-1.5	-177	0	0	0	0	0	115.3	P280 F284	P280-G282 PolarHBondContact O-N 2.87Å; G282-F284 WeakPolarHBondContact O-CD2 3.48Å
283	H	86.8	Confident	88.2	Confident	34 Å²	34	52.8 Å²	52.8	16%	0.157	28%	0.284	C	S	.	.			trans	-89.9	119.9	176.1	-161.9	86.2	0	0	0	111.4	I204 R275 W279 P280 E281 G306 P308	I204-H283 HydrophobicContact CD1-CB 4.48Å; R275-H283 WeakPolarHBondContact CB-O 3.39Å; W279-H283 AromaticContact CE3-CD2 3.76Å; P280-H283 HydrophobicContact CB-CB 4.17Å; P280-H283 WeakPolarHBondContact O-CB 2.89Å; P280-H283 PolarHBondContact O-N 3.23Å; E281-H283 PolarHBondContact O-N 2.86Å; H283-G306 PolarHBondContact NE2-O 2.87Å; H283-P308 VanDerWaalsContact CD2-CG 3.44Å; H283-P308 WeakPolarHBondContact CD2-CG 3.46Å; H283-P308 WeakPolarHBondContact NE2-CG 3.37Å
284	F	89.9	Confident	87.9	Confident	77 Å²	77	53.8 Å²	53.8	34%	0.338	29%	0.288	S	S	.	.			trans	-131.1	140.4	178.3	-65	-97.3	0	0	0	110.1	K273 R275 G282	K273-F284 HydrophobicContact CB-CB 4.1Å; K273-F284 HydrophobicContact CB-CD1 3.98Å; K273-F284 HydrophobicContact CB-CG 4.27Å; K273-F284 HydrophobicContact CD-CB 4.46Å; K273-F284 HydrophobicContact CD-CG 4.44Å; K273-F284 HydrophobicContact CG-CB 4.41Å; R275-F284 HydrophobicContact CB-CD1 4.02Å; R275-F284 HydrophobicContact CB-CE1 4.46Å; R275-F284 HydrophobicContact CG-CD1 3.63Å; R275-F284 HydrophobicContact CG-CE1 3.59Å; R275-F284 HydrophobicContact CG-CG 4.49Å; R275-F284 HydrophobicContact CG-CZ 4.39Å; G282-F284 WeakPolarHBondContact O-CD2 3.48Å
285	A	91.8	Very high	87.4	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	146.6	165.8	0	0	0	0	0	109.3	K273 W274 W279 I287 R305 I307	K273-A285 CarbonylContact C-O 3.58Å; K273-A285 VanDerWaalsContact CA-O 3.31Å; K273-A285 WeakPolarHBondContact CA-O 3.31Å; W274-A285 PolarHBondContact N-O 3.26Å; W274-A285 PolarHBondContact O-N 2.84Å; W279-A285 HydrophobicContact CH2-CB 3.75Å; W279-A285 HydrophobicContact CZ3-CB 3.7Å; A285-I287 HydrophobicContact CB-CD1 4.26Å; A285-R305 CarbonylContact C-O 3.58Å; A285-R305 WeakPolarHBondContact CA-O 3.43Å; A285-I307 HydrophobicContact CB-CB 4.43Å; A285-I307 HydrophobicContact CB-CG1 3.46Å; A285-I307 VanDerWaalsContact CB-CG1 3.46Å
286	T	94.2	Very high	86.9	Confident	65 Å²	65	62.8 Å²	62.8	40%	0.399	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	114	168.1	-55	0	0	0	0	108.1	V271 G304 R305	V271-T286 HydrophobicContact CG1-CG2 3.86Å; T286-G304 CarbonylContact O-C 3.54Å; T286-G304 WeakPolarHBondContact O-CA 3.03Å; T286-R305 PolarHBondContact N-O 3.09Å; T286-R305 PolarHBondContact O-N 2.88Å
287	I	95.3	Very high	87.1	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	129.2	174.6	-53.1	-58.3	0	0	0	108.8	V271 M272 W274 A285 L289 M302 E303 G304 I307 W319	V271-I287 WeakPolarHBondContact CA-O 3.32Å; M272-I287 HydrophobicContact CE-CB 4.35Å; M272-I287 HydrophobicContact CE-CG2 4.13Å; M272-I287 HydrophobicContact CG-CB 4.11Å; M272-I287 PolarHBondContact N-O 3.25Å; M272-I287 PolarHBondContact O-N 3.14Å; W274-I287 HydrophobicContact CB-CB 4.44Å; W274-I287 HydrophobicContact CB-CD1 4.37Å; W274-I287 HydrophobicContact CB-CG1 3.41Å; W274-I287 VanDerWaalsContact CB-CG1 3.41Å; W274-I287 HydrophobicContact CG-CG1 3.87Å; A285-I287 HydrophobicContact CB-CD1 4.26Å; I287-L289 HydrophobicContact CG2-CD2 4.23Å; I287-L289 HydrophobicContact CG2-CG 4.36Å; I287-M302 HydrophobicContact CD1-SD 4.29Å; I287-M302 HydrophobicContact CG2-CG 3.63Å; I287-M302 HydrophobicContact CG2-SD 3.96Å; I287-E303 CarbonylContact C-O 3.51Å; I287-E303 WeakPolarHBondContact CA-O 2.65Å; I287-G304 VanDerWaalsContact CD1-CA 3.45Å; I287-I307 HydrophobicContact CD1-CD1 4.47Å; I287-W319 HydrophobicContact CB-CZ2 4.32Å; I287-W319 HydrophobicContact CG1-CZ2 4.07Å; I287-W319 HydrophobicContact CG2-CH2 3.81Å; I287-W319 HydrophobicContact CG2-CZ2 3.63Å
288	T	94.9	Very high	87.7	Confident	33 Å²	33	57 Å²	57	20%	0.202	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	115.5	172.8	-57	0	0	0	0	108.5	I270 V271 M302 E303	I270-T288 CarbonylContact O-C 3.48Å; I270-T288 WeakPolarHBondContact O-CA 3.29Å; V271-T288 HydrophobicContact CG2-CG2 4.17Å; T288-M302 WeakPolarHBondContact O-CA 3.24Å; T288-E303 PolarHBondContact N-O 3.08Å; T288-E303 PolarHBondContact O-N 3.05Å
289	L	93.9	Very high	88.5	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	127.2	171.5	-61.2	177.7	0	0	0	108.4	F226 H269 I270 M272 I287 F291 L300 C301 M302 W319	F226-L289 HydrophobicContact CD1-CD1 3.48Å; F226-L289 VanDerWaalsContact CD1-CD1 3.48Å; F226-L289 HydrophobicContact CE1-CD1 3.5Å; F226-L289 HydrophobicContact CG-CD1 4.03Å; F226-L289 HydrophobicContact CZ-CD1 4.12Å; H269-L289 CarbonylContact C-O 3.52Å; H269-L289 WeakPolarHBondContact CA-O 3.5Å; H269-L289 WeakPolarHBondContact CB-O 3.49Å; I270-L289 HydrophobicContact CB-CB 4.23Å; I270-L289 HydrophobicContact CB-CD1 4.45Å; I270-L289 PolarHBondContact N-O 3.09Å; I270-L289 PolarHBondContact O-N 2.99Å; M272-L289 HydrophobicContact CE-CD1 3.77Å; M272-L289 HydrophobicContact CE-CG 4.26Å; I287-L289 HydrophobicContact CG2-CD2 4.23Å; I287-L289 HydrophobicContact CG2-CG 4.36Å; L289-F291 HydrophobicContact CB-CE2 4.15Å; L289-F291 HydrophobicContact CB-CZ 4.35Å; L289-L300 HydrophobicContact CB-CD1 4.06Å; L289-L300 HydrophobicContact CD2-CD1 4.3Å; L289-C301 CarbonylContact C-O 3.55Å; L289-C301 WeakPolarHBondContact CA-O 3.47Å; L289-M302 HydrophobicContact CD2-CB 3.54Å; L289-M302 HydrophobicContact CD2-CG 3.45Å; L289-M302 VanDerWaalsContact CD2-CG 3.45Å; L289-W319 HydrophobicContact CD1-CH2 4.23Å; L289-W319 HydrophobicContact CD1-CZ3 4.44Å; L289-W319 HydrophobicContact CD2-CH2 3.86Å; L289-W319 HydrophobicContact CD2-CZ3 3.69Å; L289-W319 HydrophobicContact CG-CH2 4.39Å
290	T	94.1	Very high	89	Confident	52 Å²	52	54.9 Å²	54.9	32%	0.319	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	127.7	174.4	-49.7	0	0	0	0	108.9	I292 L300 C301	T290-I292 HydrophobicContact CG2-CG1 4.18Å; T290-L300 WeakPolarHBondContact O-CA 3.46Å; T290-C301 PolarHBondContact N-O 3.29Å; T290-C301 PolarHBondContact O-N 2.99Å
291	F	93.7	Very high	89.8	Confident	11 Å²	11	52.9 Å²	52.9	5%	0.048	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	121.1	179.2	-55.6	-98.2	0	0	0	108.1	P219 L222 Y223 F226 K268 I270 L289 T298 L300	P219-F291 HydrophobicContact CB-CB 4.17Å; L222-F291 HydrophobicContact CB-CD1 4.14Å; L222-F291 HydrophobicContact CB-CE1 4.13Å; L222-F291 HydrophobicContact CD2-CD1 3.96Å; L222-F291 HydrophobicContact CD2-CE1 4.07Å; L222-F291 HydrophobicContact CG-CD1 4.12Å; L222-F291 HydrophobicContact CG-CE1 3.87Å; Y223-F291 HydrophobicContact CD2-CD2 4.35Å; Y223-F291 AromaticContact CD2-CE2 3.92Å; Y223-F291 HydrophobicContact CD2-CE2 3.92Å; Y223-F291 HydrophobicContact CD2-CZ 4.24Å; F226-F291 HydrophobicContact CD2-CE1 4.23Å; F226-F291 HydrophobicContact CD2-CZ 4.2Å; K268-F291 PolarHBondContact O-N 3.06Å; I270-F291 HydrophobicContact CB-CE2 4.42Å; I270-F291 HydrophobicContact CD1-CE2 3.85Å; I270-F291 HydrophobicContact CD1-CZ 3.75Å; I270-F291 HydrophobicContact CG1-CE2 3.86Å; I270-F291 HydrophobicContact CG1-CZ 4.29Å; L289-F291 HydrophobicContact CB-CE2 4.15Å; L289-F291 HydrophobicContact CB-CZ 4.35Å; F291-T298 HydrophobicContact CB-CG2 4.12Å; F291-T298 HydrophobicContact CD1-CG2 4.28Å; F291-L300 HydrophobicContact CD1-CD1 3.78Å; F291-L300 HydrophobicContact CE1-CD1 3.6Å; F291-L300 HydrophobicContact CE2-CD1 4.4Å; F291-L300 HydrophobicContact CG-CD1 4.26Å; F291-L300 HydrophobicContact CZ-CD1 3.93Å
292	I	92.4	Very high	90.7	Very high	68 Å²	68	43.8 Å²	43.8	35%	0.349	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	115.8	-178.3	-55	172.5	0	0	0	108.1	T290 K294 T298 E299	T290-I292 HydrophobicContact CG2-CG1 4.18Å; I292-K294 PolarHBondContact O-N 2.78Å; I292-T298 WeakPolarHBondContact O-CA 3.33Å; I292-E299 HydrophobicContact CB-CB 4.32Å; I292-E299 PolarHBondContact N-O 3.21Å; I292-E299 PolarHBondContact O-N 3.29Å
293	D	92	Very high	91.4	Very high	104 Å²	104	43.1 Å²	43.1	56%	0.556	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-66.8	125.3	173.3	-172.4	4.1	0	0	0	110.6	P219 N295	P219-D293 HydrophobicContact CG-CB 3.81Å; D293-N295 PolarHBondContact OD1-N 2.87Å
294	K	89.8	Confident	91.7	Very high	97 Å²	97	41.5 Å²	41.5	42%	0.422	23%	0.23	S	C	.	.			trans	-121.8	49.3	173	-69.2	-164.9	176.1	178.4	0	110.8	I292 E297 E299	I292-K294 PolarHBondContact O-N 2.78Å; K294-E297 CarbonylContact C-O 3.43Å; K294-E297 WeakPolarHBondContact CA-O 3.37Å; K294-E297 HydrophobicContact CB-CB 4.48Å; K294-E297 PolarHBondContact N-O 2.8Å; K294-E299 HydrophobicContact CD-CB 4.11Å; K294-E299 HydrophobicContact CG-CB 4.48Å; K294-E299 IonicContact NZ-OE1 2.66Å; K294-E299 PolarHBondContact NZ-OE1 3.49Å; K294-E299 IonicContact NZ-OE2 3.5Å; K294-E299 PolarHBondContact NZ-OE2 2.77Å
295	N	81.4	Confident	91.7	Very high	162 Å²	162	44.2 Å²	44.2	87%	0.866	24%	0.238	S	C	*	.	S	Bend	trans	58.7	57.1	163.4	-152.3	78.6	0	0	0	112.7	D293	D293-N295 PolarHBondContact OD1-N 2.87Å
296	G	78.5	Confident	91.4	Very high	61 Å²	61	45.3 Å²	45.3	63%	0.629	25%	0.25	S	C	*	.	S	Bend	trans	108.3	-4.9	-176.7	0	0	0	0	0	114.3
297	E	90.3	Very high	91	Very high	43 Å²	43	42.2 Å²	42.2	20%	0.201	23%	0.231	C	C	.	.	S	Bend	trans	-133.8	154.8	174.3	-54.9	-176.6	163.8	0	0	109.3	T214 F215 L216 T217 K294 R336	T214-E297 HydrophobicContact CG2-CB 3.86Å; T214-E297 WeakPolarHBondContact CG2-OE2 3.15Å; F215-E297 CarbonylContact O-C 3.34Å; F215-E297 WeakPolarHBondContact O-CA 3.35Å; L216-E297 HydrophobicContact CD2-CG 3.68Å; L216-E297 WeakPolarHBondContact CD2-OE1 3.11Å; T217-E297 CarbonylContact O-C 3.52Å; K294-E297 CarbonylContact C-O 3.43Å; K294-E297 WeakPolarHBondContact CA-O 3.37Å; K294-E297 HydrophobicContact CB-CB 4.48Å; K294-E297 PolarHBondContact N-O 2.8Å; E297-R336 IonicContact OE1-CZ 3.21Å; E297-R336 IonicContact OE1-NE 3.54Å; E297-R336 IonicContact OE1-NH2 2.82Å; E297-R336 PolarHBondContact OE1-NH2 2.72Å
298	T	92.3	Very high	90.5	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	121	174.8	-59.7	0	0	0	0	109.6	F215 T217 P219 L222 F291 I292	F215-T298 PolarHBondContact N-O 3.01Å; F215-T298 PolarHBondContact O-N 2.81Å; T217-T298 WeakPolarHBondContact O-CB 3.22Å; T217-T298 PolarHBondContact O-N 2.91Å; T217-T298 PolarHBondContact O-OG1 2.77Å; P219-T298 WeakPolarHBondContact CA-OG1 3.2Å; P219-T298 HydrophobicContact CB-CG2 4.26Å; P219-T298 VanDerWaalsContact CD-OG1 3.22Å; P219-T298 WeakPolarHBondContact CD-OG1 3.45Å; P219-T298 HydrophobicContact CG-CG2 4.17Å; P219-T298 WeakPolarHBondContact CG-OG1 3.47Å; L222-T298 HydrophobicContact CD2-CG2 3.8Å; F291-T298 HydrophobicContact CB-CG2 4.12Å; F291-T298 HydrophobicContact CD1-CG2 4.28Å; I292-T298 WeakPolarHBondContact O-CA 3.33Å
299	E	93.4	Very high	89.6	Confident	34 Å²	34	42.9 Å²	42.9	16%	0.159	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	115.4	166.5	-178.8	174	-85.2	0	0	108.9	I292 K294	I292-E299 HydrophobicContact CB-CB 4.32Å; I292-E299 PolarHBondContact N-O 3.21Å; I292-E299 PolarHBondContact O-N 3.29Å; K294-E299 HydrophobicContact CD-CB 4.11Å; K294-E299 HydrophobicContact CG-CB 4.48Å; K294-E299 IonicContact NZ-OE1 2.66Å; K294-E299 PolarHBondContact NZ-OE1 3.49Å; K294-E299 IonicContact NZ-OE2 3.5Å; K294-E299 PolarHBondContact NZ-OE2 2.77Å
300	L	94	Very high	88.8	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	115.3	172.9	-176.1	64.7	0	0	0	109	K212 E213 F215 L222 F226 L289 T290 F291 F324	K212-L300 WeakPolarHBondContact CA-O 3.33Å; E213-L300 PolarHBondContact N-O 3.44Å; E213-L300 PolarHBondContact O-N 2.86Å; F215-L300 HydrophobicContact CD2-CB 3.96Å; F215-L300 HydrophobicContact CE2-CB 3.72Å; F215-L300 HydrophobicContact CE2-CD2 3.85Å; F215-L300 HydrophobicContact CE2-CG 4.44Å; F215-L300 HydrophobicContact CZ-CD2 4.32Å; L222-L300 HydrophobicContact CD2-CB 4.03Å; L222-L300 HydrophobicContact CD2-CD1 4.46Å; L222-L300 HydrophobicContact CD2-CD2 4.35Å; F226-L300 HydrophobicContact CE2-CD2 3.8Å; F226-L300 HydrophobicContact CZ-CD2 3.66Å; L289-L300 HydrophobicContact CB-CD1 4.06Å; L289-L300 HydrophobicContact CD2-CD1 4.3Å; T290-L300 WeakPolarHBondContact O-CA 3.46Å; F291-L300 HydrophobicContact CD1-CD1 3.78Å; F291-L300 HydrophobicContact CE1-CD1 3.6Å; F291-L300 HydrophobicContact CE2-CD1 4.4Å; F291-L300 HydrophobicContact CG-CD1 4.26Å; F291-L300 HydrophobicContact CZ-CD1 3.93Å; L300-F324 HydrophobicContact CD2-CD1 4.25Å; L300-F324 HydrophobicContact CD2-CE1 3.79Å
301	C	92.7	Very high	88	Confident	22 Å²	22	47.7 Å²	47.7	15%	0.149	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	112	171.6	-175.7	0	0	0	0	109.4	L211 K212 L289 T290	L211-C301 CarbonylContact O-C 3.58Å; L211-C301 WeakPolarHBondContact O-CA 3.38Å; K212-C301 HydrophobicContact CG-CB 4.25Å; L289-C301 CarbonylContact C-O 3.55Å; L289-C301 WeakPolarHBondContact CA-O 3.47Å; T290-C301 PolarHBondContact N-O 3.29Å; T290-C301 PolarHBondContact O-N 2.99Å
302	M	94.3	Very high	87.3	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	123.2	172	-174.2	-80.2	-81.9	0	0	109.9	I209 T210 L211 I287 T288 L289 W319 F324	I209-M302 HydrophobicContact CG2-CE 4.09Å; T210-M302 CarbonylContact C-O 3.53Å; T210-M302 VanDerWaalsContact CA-O 3.31Å; T210-M302 WeakPolarHBondContact CA-O 3.22Å; L211-M302 HydrophobicContact CB-CB 4.43Å; L211-M302 HydrophobicContact CB-CE 4.22Å; L211-M302 HydrophobicContact CD1-CE 3.63Å; L211-M302 HydrophobicContact CG-CE 3.99Å; L211-M302 PolarHBondContact N-O 2.71Å; L211-M302 PolarHBondContact O-N 3.22Å; I287-M302 HydrophobicContact CD1-SD 4.29Å; I287-M302 HydrophobicContact CG2-CG 3.63Å; I287-M302 HydrophobicContact CG2-SD 3.96Å; T288-M302 WeakPolarHBondContact O-CA 3.24Å; L289-M302 HydrophobicContact CD2-CB 3.54Å; L289-M302 HydrophobicContact CD2-CG 3.45Å; L289-M302 VanDerWaalsContact CD2-CG 3.45Å; M302-W319 HydrophobicContact CE-CB 3.91Å; M302-W319 HydrophobicContact CE-CD2 3.6Å; M302-W319 HydrophobicContact CE-CE3 4.06Å; M302-W319 HydrophobicContact CE-CG 3.51Å; M302-W319 HydrophobicContact CG-CD2 4.16Å; M302-W319 HydrophobicContact CG-CE3 3.87Å; M302-W319 HydrophobicContact CG-CH2 4.13Å; M302-W319 HydrophobicContact CG-CZ2 4.41Å; M302-W319 HydrophobicContact CG-CZ3 3.86Å; M302-W319 HydrophobicContact SD-CD2 4.48Å; M302-F324 HydrophobicContact CB-CZ 4.14Å
303	E	94	Very high	86.3	Confident	42 Å²	42	49.9 Å²	49.9	20%	0.196	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	114.7	170.9	-171.9	-173.2	-121.6	0	0	109.9	K208 I209 I287 T288 R305	K208-E303 VanDerWaalsContact CE-CD 3.46Å; K208-E303 WeakPolarHBondContact CE-OE1 3.44Å; K208-E303 IonicContact NZ-OE1 3.46Å; K208-E303 PolarHBondContact NZ-OE1 2.69Å; I209-E303 CarbonylContact O-C 3.47Å; I209-E303 WeakPolarHBondContact O-CA 3.5Å; I287-E303 CarbonylContact C-O 3.51Å; I287-E303 WeakPolarHBondContact CA-O 2.65Å; T288-E303 PolarHBondContact N-O 3.08Å; T288-E303 PolarHBondContact O-N 3.05Å; E303-R305 VanDerWaalsContact CD-NH2 3.33Å; E303-R305 HydrophobicContact CG-CG 4.43Å; E303-R305 IonicContact OE1-CZ 2.84Å; E303-R305 IonicContact OE1-NE 3.83Å; E303-R305 IonicContact OE1-NH2 3.77Å; E303-R305 PolarHBondContact OE1-NH2 3.07Å; E303-R305 IonicContact OE2-CZ 2.88Å; E303-R305 IonicContact OE2-NE 3.42Å; E303-R305 PolarHBondContact OE2-NE 3.23Å; E303-R305 IonicContact OE2-NH2 3.06Å; E303-R305 PolarHBondContact OE2-NH2 3.34Å
304	G	91.9	Very high	85.6	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	125.2	174.7	0	0	0	0	0	111.7	K208 I209 T286 I287	K208-G304 CarbonylContact C-O 3.5Å; K208-G304 VanDerWaalsContact CA-O 3.26Å; K208-G304 WeakPolarHBondContact CA-O 3.48Å; I209-G304 PolarHBondContact N-O 3.1Å; I209-G304 PolarHBondContact O-N 3.17Å; T286-G304 CarbonylContact O-C 3.54Å; T286-G304 WeakPolarHBondContact O-CA 3.03Å; I287-G304 VanDerWaalsContact CD1-CA 3.45Å
305	R	90.3	Very high	85.2	Confident	135 Å²	135	46.3 Å²	46.3	51%	0.509	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	141.5	176.8	-60	-176.6	-173.5	-153.3	0.9	110.3	K208 A285 T286 E303	K208-R305 HydrophobicContact CD-CG 4.44Å; K208-R305 HydrophobicContact CG-CG 4.21Å; A285-R305 CarbonylContact C-O 3.58Å; A285-R305 WeakPolarHBondContact CA-O 3.43Å; T286-R305 PolarHBondContact N-O 3.09Å; T286-R305 PolarHBondContact O-N 2.88Å; E303-R305 VanDerWaalsContact CD-NH2 3.33Å; E303-R305 HydrophobicContact CG-CG 4.43Å; E303-R305 IonicContact OE1-CZ 2.84Å; E303-R305 IonicContact OE1-NE 3.83Å; E303-R305 IonicContact OE1-NH2 3.77Å; E303-R305 PolarHBondContact OE1-NH2 3.07Å; E303-R305 IonicContact OE2-CZ 2.88Å; E303-R305 IonicContact OE2-NE 3.42Å; E303-R305 PolarHBondContact OE2-NE 3.23Å; E303-R305 IonicContact OE2-NH2 3.06Å; E303-R305 PolarHBondContact OE2-NH2 3.34Å
306	G	85.3	Confident	85.2	Confident	23 Å²	23	41.4 Å²	41.4	24%	0.237	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	82.9	26.6	178.8	0	0	0	0	0	113.1	C207 H283	C207-G306 PolarHBondContact O-N 2.93Å; H283-G306 PolarHBondContact NE2-O 2.87Å
307	I	87.3	Confident	85.1	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	129.7	176.1	-62.9	164.4	0	0	0	107.4	T206 C207 I209 W279 A285 I287 A309 T315	T206-I307 CarbonylContact C-O 3.56Å; T206-I307 WeakPolarHBondContact CA-O 3.4Å; C207-I307 PolarHBondContact N-O 2.83Å; C207-I307 PolarHBondContact O-N 3.41Å; C207-I307 PolarHBondContact SG-O 3.47Å; I209-I307 HydrophobicContact CB-CD1 3.8Å; I209-I307 HydrophobicContact CD1-CD1 3.5Å; I209-I307 VanDerWaalsContact CD1-CD1 3.5Å; I209-I307 HydrophobicContact CD1-CG2 4.35Å; I209-I307 HydrophobicContact CG1-CD1 3.58Å; W279-I307 HydrophobicContact CH2-CB 4.09Å; W279-I307 HydrophobicContact CH2-CG1 4.05Å; W279-I307 HydrophobicContact CH2-CG2 3.82Å; W279-I307 HydrophobicContact CZ2-CG2 3.85Å; A285-I307 HydrophobicContact CB-CB 4.43Å; A285-I307 HydrophobicContact CB-CG1 3.46Å; A285-I307 VanDerWaalsContact CB-CG1 3.46Å; I287-I307 HydrophobicContact CD1-CD1 4.47Å; I307-A309 PolarHBondContact O-N 2.86Å; I307-T315 HydrophobicContact CD1-CG2 3.97Å; I307-T315 HydrophobicContact CG1-CG2 4.45Å; I307-T315 HydrophobicContact CG2-CG2 4.31Å
308	P	83.9	Confident	84.7	Confident	6 Å²	6	42.1 Å²	42.1	4%	0.039	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.1	127.3	173.6	-23.6	31.8	0	0	0	110.4	I204 W279 H283 P310 E311 E312	I204-P308 HydrophobicContact CG2-CB 4.06Å; I204-P308 HydrophobicContact CG2-CG 4.45Å; W279-P308 HydrophobicContact CD2-CG 3.78Å; W279-P308 HydrophobicContact CE3-CG 3.9Å; W279-P308 HydrophobicContact CG-CG 4.27Å; W279-P308 HydrophobicContact CH2-CG 4.4Å; W279-P308 VanDerWaalsContact CZ2-CD 3.47Å; W279-P308 HydrophobicContact CZ2-CG 4.28Å; W279-P308 HydrophobicContact CZ3-CG 4.19Å; H283-P308 VanDerWaalsContact CD2-CG 3.44Å; H283-P308 WeakPolarHBondContact CD2-CG 3.46Å; H283-P308 WeakPolarHBondContact NE2-CG 3.37Å; P308-P310 VanDerWaalsContact C-N 3.29Å; P308-E311 HydrophobicContact CB-CB 4.16Å; P308-E311 HydrophobicContact CB-CG 4.11Å; P308-E311 HydrophobicContact CG-CG 4.49Å; P308-E311 CarbonylContact O-C 3.59Å; P308-E311 WeakPolarHBondContact O-CA 3.44Å; P308-E311 PolarHBondContact O-N 2.97Å; P308-E312 PolarHBondContact O-N 3.47Å
309	A	76.2	Confident	84.5	Confident	41 Å²	41	42.1 Å²	42.1	34%	0.339	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-53.7	-37.6	-177.9	0	0	0	0	0	113.8	P205 I307 E311 E312	P205-A309 HydrophobicContact CB-CB 4.12Å; P205-A309 HydrophobicContact CG-CB 4.3Å; P205-A309 WeakPolarHBondContact O-CB 3.29Å; P205-A309 PolarHBondContact O-N 3.21Å; I307-A309 PolarHBondContact O-N 2.86Å; A309-E311 PolarHBondContact O-N 3.02Å; A309-E312 WeakPolarHBondContact O-CB 3.32Å; A309-E312 PolarHBondContact O-N 2.83Å
310	P	76.9	Confident	84	Confident	107 Å²	107	44 Å²	44	70%	0.695	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-63.3	-26.8	173.9	-22.6	34.9	0	0	0	113.8	P308	P308-P310 VanDerWaalsContact C-N 3.29Å
311	E	78.2	Confident	83.3	Confident	45 Å²	45	50.5 Å²	50.5	21%	0.21	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-98.1	3	-175.8	-61.6	-74.6	137.9	0	0	112.1	W279 P308 A309 E313 R314 T315	W279-E311 HydrophobicContact CZ2-CB 4.16Å; W279-E311 VanDerWaalsContact NE1-CG 3.35Å; W279-E311 PolarHBondContact NE1-OE2 2.82Å; P308-E311 HydrophobicContact CB-CB 4.16Å; P308-E311 HydrophobicContact CB-CG 4.11Å; P308-E311 HydrophobicContact CG-CG 4.49Å; P308-E311 CarbonylContact O-C 3.59Å; P308-E311 WeakPolarHBondContact O-CA 3.44Å; P308-E311 PolarHBondContact O-N 2.97Å; A309-E311 PolarHBondContact O-N 3.02Å; E311-E313 PolarHBondContact O-N 3.49Å; E311-R314 PolarHBondContact O-N 2.81Å; E311-R314 WeakPolarHBondContact OE2-CD 3.25Å; E311-R314 IonicContact OE2-NH1 3.82Å; E311-R314 PolarHBondContact OE2-NH1 2.88Å; E311-T315 VanDerWaalsContact O-CB 3.31Å; E311-T315 WeakPolarHBondContact O-CB 3.46Å; E311-T315 PolarHBondContact O-N 2.81Å; E311-T315 PolarHBondContact O-OG1 2.64Å
312	E	77.9	Confident	82.7	Confident	58 Å²	58	54.3 Å²	54.3	27%	0.271	26%	0.256	S	S	.	.	H	α-helix	trans	-55.4	-57.1	-176.3	-173	-175.9	152.7	0	0	111.5	C207 I209 P308 A309 R314 T315 R316	C207-E312 HydrophobicContact CB-CB 4.47Å; C207-E312 HydrophobicContact CB-CG 4.29Å; C207-E312 WeakPolarHBondContact CB-OE2 3.41Å; C207-E312 WeakPolarHBondContact SG-CB 3.41Å; C207-E312 WeakPolarHBondContact SG-CG 3.4Å; I209-E312 HydrophobicContact CD1-CB 4.43Å; I209-E312 HydrophobicContact CD1-CG 3.6Å; I209-E312 WeakPolarHBondContact CD1-O 3.48Å; I209-E312 HydrophobicContact CG1-CG 3.57Å; P308-E312 PolarHBondContact O-N 3.47Å; A309-E312 WeakPolarHBondContact O-CB 3.32Å; A309-E312 PolarHBondContact O-N 2.83Å; E312-R314 VanDerWaalsContact C-N 3.34Å; E312-R314 PolarHBondContact O-N 2.86Å; E312-T315 PolarHBondContact O-N 2.84Å; E312-R316 WeakPolarHBondContact O-CB 3.33Å; E312-R316 PolarHBondContact O-N 3.42Å; E312-R316 IonicContact OE1-NH2 2.75Å; E312-R316 PolarHBondContact OE1-NH2 3.35Å; E312-R316 VanDerWaalsContact OE1-NH2 3.09Å
313	E	72.1	Confident	82.4	Confident	68 Å²	68	54.6 Å²	54.6	32%	0.318	26%	0.258	S	S	.	.	H	α-helix	trans	-65.5	-39.9	-175.5	-171.5	66.6	-139	0	0	111.3	K76 E311 T315 R316 Q317	K76-E313 IonicContact NZ-OE2 2.6Å; K76-E313 PolarHBondContact NZ-OE2 3.28Å; E311-E313 PolarHBondContact O-N 3.49Å; E313-T315 VanDerWaalsContact C-N 3.33Å; E313-T315 PolarHBondContact O-N 2.86Å; E313-R316 WeakPolarHBondContact O-CB 3.45Å; E313-R316 PolarHBondContact O-N 2.98Å; E313-Q317 WeakPolarHBondContact O-CB 3.45Å; E313-Q317 WeakPolarHBondContact O-CG 3.47Å; E313-Q317 PolarHBondContact O-N 2.75Å; E313-Q317 PolarHBondContact OE1-NE2 3.07Å; E313-Q317 VanDerWaalsContact OE1-NE2 3.14Å
314	R	76.9	Confident	82.1	Confident	126 Å²	126	52.8 Å²	52.8	48%	0.475	25%	0.249	S	C	.	.	H	α-helix	trans	-62.2	-42.9	176	-171.7	-174.1	-176.2	-171	1	111.4	F276 S278 E311 E312 G318	F276-R314 HydrophobicContact CE2-CG 4.07Å; F276-R314 HydrophobicContact CZ-CG 4.38Å; S278-R314 PolarHBondContact OG-NH1 2.94Å; E311-R314 PolarHBondContact O-N 2.81Å; E311-R314 WeakPolarHBondContact OE2-CD 3.25Å; E311-R314 IonicContact OE2-NH1 3.82Å; E311-R314 PolarHBondContact OE2-NH1 2.88Å; E312-R314 VanDerWaalsContact C-N 3.34Å; E312-R314 PolarHBondContact O-N 2.86Å; R314-G318 PolarHBondContact O-N 2.94Å
315	T	81.6	Confident	81.7	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.4	-43.8	176	-53.7	0	0	0	0	110.1	I209 W274 W279 I307 E311 E312 E313 G318 W319	I209-T315 HydrophobicContact CD1-CG2 4.14Å; W274-T315 HydrophobicContact CE3-CG2 4.41Å; W274-T315 HydrophobicContact CH2-CG2 4.14Å; W274-T315 HydrophobicContact CZ3-CG2 3.79Å; W279-T315 WeakPolarHBondContact CZ2-OG1 3.48Å; I307-T315 HydrophobicContact CD1-CG2 3.97Å; I307-T315 HydrophobicContact CG1-CG2 4.45Å; I307-T315 HydrophobicContact CG2-CG2 4.31Å; E311-T315 VanDerWaalsContact O-CB 3.31Å; E311-T315 WeakPolarHBondContact O-CB 3.46Å; E311-T315 PolarHBondContact O-N 2.81Å; E311-T315 PolarHBondContact O-OG1 2.64Å; E312-T315 PolarHBondContact O-N 2.84Å; E313-T315 VanDerWaalsContact C-N 3.33Å; E313-T315 PolarHBondContact O-N 2.86Å; T315-G318 PolarHBondContact O-N 3.43Å; T315-W319 WeakPolarHBondContact O-CB 3.32Å; T315-W319 PolarHBondContact O-N 2.9Å
316	R	81.2	Confident	81.4	Confident	58 Å²	58	51.7 Å²	51.7	22%	0.219	25%	0.252	C	S	.	.	H	α-helix	trans	-57.9	-51.2	176.7	-168.9	-177.6	-67.6	-84.1	-0.6	112.1	I209 L211 E312 E313 W319 Q320	I209-R316 HydrophobicContact CD1-CB 4.18Å; L211-R316 HydrophobicContact CD1-CG 4.09Å; L211-R316 HydrophobicContact CD2-CG 3.85Å; L211-R316 VanDerWaalsContact CD2-NH1 3.31Å; L211-R316 HydrophobicContact CG-CG 4.39Å; E312-R316 WeakPolarHBondContact O-CB 3.33Å; E312-R316 PolarHBondContact O-N 3.42Å; E312-R316 IonicContact OE1-NH2 2.75Å; E312-R316 PolarHBondContact OE1-NH2 3.35Å; E312-R316 VanDerWaalsContact OE1-NH2 3.09Å; E313-R316 WeakPolarHBondContact O-CB 3.45Å; E313-R316 PolarHBondContact O-N 2.98Å; R316-W319 PolarHBondContact O-N 2.93Å; R316-Q320 WeakPolarHBondContact O-CG 3.26Å; R316-Q320 PolarHBondContact O-N 2.81Å
317	Q	77.3	Confident	81.7	Confident	110 Å²	110	50.6 Å²	50.6	51%	0.514	24%	0.241	S	C	.	.	H	α-helix	trans	-68.1	-40.7	-179	-70.5	178.5	10	0	0	111.7	E313 W319 Q320 R321	E313-Q317 WeakPolarHBondContact O-CB 3.45Å; E313-Q317 WeakPolarHBondContact O-CG 3.47Å; E313-Q317 PolarHBondContact O-N 2.75Å; E313-Q317 PolarHBondContact OE1-NE2 3.07Å; E313-Q317 VanDerWaalsContact OE1-NE2 3.14Å; Q317-W319 VanDerWaalsContact C-N 3.3Å; Q317-W319 PolarHBondContact O-N 3.07Å; Q317-Q320 PolarHBondContact O-N 2.84Å; Q317-R321 WeakPolarHBondContact O-CB 3.45Å; Q317-R321 PolarHBondContact O-N 3.46Å
318	G	80.9	Confident	81.7	Confident	10 Å²	10	52.8 Å²	52.8	10%	0.103	25%	0.25	C	S	.	.	H	α-helix	trans	-61	-39.9	174.8	0	0	0	0	0	112.3	R314 T315 Y322	R314-G318 PolarHBondContact O-N 2.94Å; T315-G318 PolarHBondContact O-N 3.43Å; G318-Y322 WeakPolarHBondContact O-CB 3.39Å; G318-Y322 WeakPolarHBondContact O-CD2 3.39Å; G318-Y322 PolarHBondContact O-N 2.6Å
319	W	88.7	Confident	81.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	28%	0.283	C	S	.	.	I	π-helix	trans	-65.7	-41.5	173.1	-90.3	87.9	0	0	0	112.8	L211 F226 M272 W274 I287 L289 M302 T315 R316 Q317 Y323 F324	L211-W319 HydrophobicContact CD1-CB 3.88Å; F226-W319 HydrophobicContact CE1-CH2 4.47Å; F226-W319 HydrophobicContact CE1-CZ3 4.12Å; M272-W319 HydrophobicContact CE-CH2 3.57Å; M272-W319 HydrophobicContact CE-CZ2 3.96Å; W274-W319 AromaticContact CD1-CZ2 4Å; W274-W319 AromaticContact CE2-NE1 3.71Å; W274-W319 AromaticContact CZ2-NE1 3.84Å; W274-W319 AromaticContact NE1-CZ2 3.88Å; W274-W319 AromaticContact NE1-NE1 3.97Å; I287-W319 HydrophobicContact CB-CZ2 4.32Å; I287-W319 HydrophobicContact CG1-CZ2 4.07Å; I287-W319 HydrophobicContact CG2-CH2 3.81Å; I287-W319 HydrophobicContact CG2-CZ2 3.63Å; L289-W319 HydrophobicContact CD1-CH2 4.23Å; L289-W319 HydrophobicContact CD1-CZ3 4.44Å; L289-W319 HydrophobicContact CD2-CH2 3.86Å; L289-W319 HydrophobicContact CD2-CZ3 3.69Å; L289-W319 HydrophobicContact CG-CH2 4.39Å; M302-W319 HydrophobicContact CE-CB 3.91Å; M302-W319 HydrophobicContact CE-CD2 3.6Å; M302-W319 HydrophobicContact CE-CE3 4.06Å; M302-W319 HydrophobicContact CE-CG 3.51Å; M302-W319 HydrophobicContact CG-CD2 4.16Å; M302-W319 HydrophobicContact CG-CE3 3.87Å; M302-W319 HydrophobicContact CG-CH2 4.13Å; M302-W319 HydrophobicContact CG-CZ2 4.41Å; M302-W319 HydrophobicContact CG-CZ3 3.86Å; M302-W319 HydrophobicContact SD-CD2 4.48Å; T315-W319 WeakPolarHBondContact O-CB 3.32Å; T315-W319 PolarHBondContact O-N 2.9Å; R316-W319 PolarHBondContact O-N 2.93Å; Q317-W319 VanDerWaalsContact C-N 3.3Å; Q317-W319 PolarHBondContact O-N 3.07Å; W319-Y323 HydrophobicContact CD2-CD2 4.04Å; W319-Y323 HydrophobicContact CD2-CE2 4.28Å; W319-Y323 HydrophobicContact CD2-CG 4.32Å; W319-Y323 HydrophobicContact CE3-CD1 4.19Å; W319-Y323 AromaticContact CE3-CD2 3.98Å; W319-Y323 HydrophobicContact CE3-CD2 3.98Å; W319-Y323 HydrophobicContact CE3-CE2 4.49Å; W319-Y323 AromaticContact CE3-CG 3.78Å; W319-Y323 HydrophobicContact CE3-CG 3.78Å; W319-Y323 HydrophobicContact CG-CD2 4.39Å; W319-Y323 HydrophobicContact CH2-CD1 4.14Å; W319-Y323 AromaticContact CH2-CE1 3.97Å; W319-Y323 HydrophobicContact CH2-CE1 3.97Å; W319-Y323 HydrophobicContact CH2-CG 4.5Å; W319-Y323 HydrophobicContact CZ2-CE1 4.36Å; W319-Y323 HydrophobicContact CZ2-CE2 4.48Å; W319-Y323 AromaticContact CZ3-CD1 3.8Å; W319-Y323 HydrophobicContact CZ3-CD1 3.8Å; W319-Y323 HydrophobicContact CZ3-CD2 4.37Å; W319-Y323 HydrophobicContact CZ3-CE1 4.11Å; W319-Y323 AromaticContact CZ3-CG 3.89Å; W319-Y323 HydrophobicContact CZ3-CG 3.89Å; W319-Y323 VanDerWaalsContact O-CB 3.31Å; W319-Y323 WeakPolarHBondContact O-CB 3.2Å; W319-Y323 PolarHBondContact O-N 3.41Å; W319-F324 HydrophobicContact CE3-CE1 4.05Å; W319-F324 HydrophobicContact CE3-CZ 4.29Å; W319-F324 HydrophobicContact CZ3-CE1 4.48Å; W319-F324 PolarHBondContact O-N 3.45Å; W319-F324 VanDerWaalsContact O-N 3.09Å
320	Q	82.2	Confident	82.2	Confident	74 Å²	74	60.2 Å²	60.2	35%	0.346	28%	0.281	S	S	.	.	I	π-helix	trans	-65.8	-53.2	176.6	-74.4	175.8	-22.6	0	0	112.1	L211 R316 Q317 F324 E325	L211-Q320 HydrophobicContact CD1-CG 4.11Å; R316-Q320 WeakPolarHBondContact O-CG 3.26Å; R316-Q320 PolarHBondContact O-N 2.81Å; Q317-Q320 PolarHBondContact O-N 2.84Å; Q320-F324 HydrophobicContact CG-CD2 4.22Å; Q320-F324 WeakPolarHBondContact O-CB 3.43Å; Q320-F324 PolarHBondContact O-N 3.35Å; Q320-E325 WeakPolarHBondContact O-CG 3.44Å; Q320-E325 PolarHBondContact O-N 3.19Å
321	R	78.9	Confident	82.7	Confident	135 Å²	135	57.7 Å²	57.7	51%	0.509	26%	0.259	S	S	.	.	I	π-helix	trans	-70	-53.5	-174.9	-171.3	175.2	179.7	176.4	-1.1	112.2	E111 Q317 E325 G326	E111-R321 IonicContact OE1-NH2 3.32Å; Q317-R321 WeakPolarHBondContact O-CB 3.45Å; Q317-R321 PolarHBondContact O-N 3.46Å; R321-E325 WeakPolarHBondContact O-CB 3.44Å; R321-G326 PolarHBondContact O-N 2.99Å
322	Y	81.4	Confident	83.1	Confident	102 Å²	102	57.7 Å²	57.7	40%	0.4	27%	0.271	S	S	.	.	I	π-helix	trans	-86.2	-30.5	-170.3	-59.8	-68	0	0	0	113.7	F235 G318	F235-Y322 WeakPolarHBondContact CD2-O 3.42Å; F235-Y322 VanDerWaalsContact CE2-O 3.23Å; F235-Y322 WeakPolarHBondContact CE2-O 3.44Å; G318-Y322 WeakPolarHBondContact O-CB 3.39Å; G318-Y322 WeakPolarHBondContact O-CD2 3.39Å; G318-Y322 PolarHBondContact O-N 2.6Å
323	Y	87.7	Confident	83.5	Confident	7 Å²	7	56.3 Å²	56.3	3%	0.027	26%	0.263	C	S	.	.	I	π-helix	trans	-95.1	-60.4	177.5	-65.8	-104.2	0	0	0	110.4	F226 F235 M252 W274 W319 I327	F226-Y323 HydrophobicContact CD1-CD1 4.31Å; F226-Y323 AromaticContact CE1-CD1 3.52Å; F226-Y323 HydrophobicContact CE1-CD1 3.52Å; F226-Y323 HydrophobicContact CE1-CE1 4.08Å; F226-Y323 HydrophobicContact CZ-CD1 4.24Å; F235-Y323 HydrophobicContact CE2-CD1 4.17Å; F235-Y323 HydrophobicContact CE2-CG 4.44Å; F235-Y323 HydrophobicContact CZ-CD1 4.07Å; F235-Y323 HydrophobicContact CZ-CE1 4.45Å; M252-Y323 HydrophobicContact CE-CD1 4.48Å; M252-Y323 HydrophobicContact CE-CE1 3.63Å; M252-Y323 HydrophobicContact CE-CE2 4.24Å; M252-Y323 VanDerWaalsContact CE-CZ 3.49Å; M252-Y323 WeakPolarHBondContact CE-OH 3.34Å; M252-Y323 HydrophobicContact SD-CE1 4.14Å; M252-Y323 PolarHBondContact SD-OH 3.37Å; W274-Y323 AromaticContact NE1-CZ 3.89Å; W274-Y323 PolarHBondContact NE1-OH 2.63Å; W319-Y323 HydrophobicContact CD2-CD2 4.04Å; W319-Y323 HydrophobicContact CD2-CE2 4.28Å; W319-Y323 HydrophobicContact CD2-CG 4.32Å; W319-Y323 HydrophobicContact CE3-CD1 4.19Å; W319-Y323 AromaticContact CE3-CD2 3.98Å; W319-Y323 HydrophobicContact CE3-CD2 3.98Å; W319-Y323 HydrophobicContact CE3-CE2 4.49Å; W319-Y323 AromaticContact CE3-CG 3.78Å; W319-Y323 HydrophobicContact CE3-CG 3.78Å; W319-Y323 HydrophobicContact CG-CD2 4.39Å; W319-Y323 HydrophobicContact CH2-CD1 4.14Å; W319-Y323 AromaticContact CH2-CE1 3.97Å; W319-Y323 HydrophobicContact CH2-CE1 3.97Å; W319-Y323 HydrophobicContact CH2-CG 4.5Å; W319-Y323 HydrophobicContact CZ2-CE1 4.36Å; W319-Y323 HydrophobicContact CZ2-CE2 4.48Å; W319-Y323 AromaticContact CZ3-CD1 3.8Å; W319-Y323 HydrophobicContact CZ3-CD1 3.8Å; W319-Y323 HydrophobicContact CZ3-CD2 4.37Å; W319-Y323 HydrophobicContact CZ3-CE1 4.11Å; W319-Y323 AromaticContact CZ3-CG 3.89Å; W319-Y323 HydrophobicContact CZ3-CG 3.89Å; W319-Y323 VanDerWaalsContact O-CB 3.31Å; W319-Y323 WeakPolarHBondContact O-CB 3.2Å; W319-Y323 PolarHBondContact O-N 3.41Å; Y323-I327 WeakPolarHBondContact O-CB 3.41Å; Y323-I327 VanDerWaalsContact O-CD1 3.24Å; Y323-I327 WeakPolarHBondContact O-CD1 3.21Å; Y323-I327 WeakPolarHBondContact O-CG1 3.22Å; Y323-I327 PolarHBondContact O-N 3.08Å
324	F	87.7	Confident	83.5	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.018	27%	0.27	C	S	.	.	I	π-helix	trans	-73.1	-54.1	-170.3	-55.5	-21.5	0	0	0	113	L211 E213 F215 L300 M302 W319 Q320 K328	L211-F324 HydrophobicContact CB-CE2 3.75Å; L211-F324 HydrophobicContact CB-CZ 3.99Å; L211-F324 HydrophobicContact CD1-CE2 3.81Å; L211-F324 HydrophobicContact CD1-CZ 4.28Å; L211-F324 HydrophobicContact CG-CE2 4.39Å; E213-F324 HydrophobicContact CB-CD2 3.86Å; E213-F324 HydrophobicContact CB-CE2 4.12Å; E213-F324 HydrophobicContact CB-CG 4.12Å; E213-F324 HydrophobicContact CG-CB 4.16Å; E213-F324 HydrophobicContact CG-CD2 4.13Å; E213-F324 HydrophobicContact CG-CG 4.2Å; F215-F324 HydrophobicContact CE2-CD1 4.34Å; F215-F324 HydrophobicContact CZ-CB 4.02Å; F215-F324 AromaticContact CZ-CD1 3.84Å; F215-F324 HydrophobicContact CZ-CD1 3.84Å; F215-F324 HydrophobicContact CZ-CG 4.17Å; L300-F324 HydrophobicContact CD2-CD1 4.25Å; L300-F324 HydrophobicContact CD2-CE1 3.79Å; M302-F324 HydrophobicContact CB-CZ 4.14Å; W319-F324 HydrophobicContact CE3-CE1 4.05Å; W319-F324 HydrophobicContact CE3-CZ 4.29Å; W319-F324 HydrophobicContact CZ3-CE1 4.48Å; W319-F324 PolarHBondContact O-N 3.45Å; W319-F324 VanDerWaalsContact O-N 3.09Å; Q320-F324 HydrophobicContact CG-CD2 4.22Å; Q320-F324 WeakPolarHBondContact O-CB 3.43Å; Q320-F324 PolarHBondContact O-N 3.35Å; F324-K328 VanDerWaalsContact O-CB 3.32Å; F324-K328 WeakPolarHBondContact O-CB 3.22Å; F324-K328 VanDerWaalsContact O-CG 3.25Å; F324-K328 WeakPolarHBondContact O-CG 3.46Å; F324-K328 PolarHBondContact O-N 3.33Å
325	E	82.6	Confident	82.8	Confident	102 Å²	102	52 Å²	52	48%	0.477	27%	0.271	S	S	.	.	I	π-helix	trans	-66.5	-44.3	178.9	-68	177.9	171.1	0	0	111	Q320 R321 I327 K328 Q329	Q320-E325 WeakPolarHBondContact O-CG 3.44Å; Q320-E325 PolarHBondContact O-N 3.19Å; R321-E325 WeakPolarHBondContact O-CB 3.44Å; E325-I327 PolarHBondContact O-N 3.25Å; E325-K328 PolarHBondContact O-N 2.99Å; E325-Q329 WeakPolarHBondContact O-CB 3.27Å; E325-Q329 WeakPolarHBondContact O-CG 3.15Å; E325-Q329 PolarHBondContact O-N 3.33Å
326	G	85.3	Confident	81.5	Confident	9 Å²	9	59.6 Å²	59.6	9%	0.093	30%	0.3	C	S	.	.	H	α-helix	trans	-52.4	-54.1	173.6	0	0	0	0	0	112.4	R321 K328 Q329 T330	R321-G326 PolarHBondContact O-N 2.99Å; G326-K328 PolarHBondContact O-N 2.87Å; G326-Q329 PolarHBondContact O-N 3.49Å; G326-T330 VanDerWaalsContact O-CB 3.28Å; G326-T330 WeakPolarHBondContact O-CB 3.18Å; G326-T330 PolarHBondContact O-N 2.79Å; G326-T330 PolarHBondContact O-OG1 3.21Å
327	I	89.9	Confident	79.7	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.2	-42.7	178.8	-68	170.9	0	0	0	111.4	F215 L222 V225 F226 F235 Y323 E325 Q329 F331 Y333	F215-I327 HydrophobicContact CD1-CG2 3.95Å; F215-I327 HydrophobicContact CE1-CB 3.99Å; F215-I327 HydrophobicContact CE1-CG2 3.7Å; L222-I327 HydrophobicContact CD1-CG2 3.9Å; V225-I327 HydrophobicContact CG1-CD1 3.7Å; V225-I327 HydrophobicContact CG1-CG1 3.72Å; V225-I327 HydrophobicContact CG1-CG2 4.23Å; F226-I327 HydrophobicContact CD2-CD1 4.4Å; F226-I327 HydrophobicContact CE1-CD1 4.38Å; F226-I327 HydrophobicContact CE2-CD1 3.58Å; F226-I327 HydrophobicContact CZ-CD1 3.56Å; F235-I327 HydrophobicContact CB-CG1 4.12Å; F235-I327 HydrophobicContact CD1-CD1 4.32Å; F235-I327 HydrophobicContact CD1-CG1 3.68Å; F235-I327 HydrophobicContact CD2-CG1 3.89Å; F235-I327 HydrophobicContact CE1-CD1 4.1Å; F235-I327 HydrophobicContact CE1-CG1 3.98Å; F235-I327 HydrophobicContact CE2-CD1 4.47Å; F235-I327 HydrophobicContact CE2-CG1 4.21Å; F235-I327 HydrophobicContact CG-CG1 3.64Å; F235-I327 HydrophobicContact CZ-CD1 4.22Å; F235-I327 HydrophobicContact CZ-CG1 4.26Å; Y323-I327 WeakPolarHBondContact O-CB 3.41Å; Y323-I327 VanDerWaalsContact O-CD1 3.24Å; Y323-I327 WeakPolarHBondContact O-CD1 3.21Å; Y323-I327 WeakPolarHBondContact O-CG1 3.22Å; Y323-I327 PolarHBondContact O-N 3.08Å; E325-I327 PolarHBondContact O-N 3.25Å; I327-Q329 PolarHBondContact O-N 3.3Å; I327-F331 HydrophobicContact CB-CD2 4.49Å; I327-F331 HydrophobicContact CG2-CD2 4.05Å; I327-F331 PolarHBondContact O-N 3.25Å; I327-Y333 HydrophobicContact CG2-CD2 3.65Å; I327-Y333 HydrophobicContact CG2-CE2 4.16Å
328	K	87.9	Confident	78.1	Confident	46 Å²	46	71.9 Å²	71.9	20%	0.2	36%	0.361	C	S	.	.	H	α-helix	trans	-62.7	-40.7	179.5	-80.6	-178.4	178.5	-171.7	0	112.8	E213 T214 F215 F324 E325 G326 G332 Y333 G334	E213-K328 VanDerWaalsContact CD-NZ 3.3Å; E213-K328 IonicContact OE1-NZ 3.87Å; E213-K328 PolarHBondContact OE1-NZ 3.42Å; T214-K328 WeakPolarHBondContact O-CE 3.42Å; T214-K328 PolarHBondContact O-NZ 2.66Å; F215-K328 HydrophobicContact CD1-CG 3.83Å; F215-K328 HydrophobicContact CE1-CD 4.49Å; F215-K328 HydrophobicContact CE1-CG 3.69Å; F324-K328 VanDerWaalsContact O-CB 3.32Å; F324-K328 WeakPolarHBondContact O-CB 3.22Å; F324-K328 VanDerWaalsContact O-CG 3.25Å; F324-K328 WeakPolarHBondContact O-CG 3.46Å; F324-K328 PolarHBondContact O-N 3.33Å; E325-K328 PolarHBondContact O-N 2.99Å; G326-K328 PolarHBondContact O-N 2.87Å; K328-G332 CarbonylContact O-C 3.52Å; K328-G332 WeakPolarHBondContact O-CA 3.42Å; K328-G332 PolarHBondContact O-N 2.86Å; K328-G332 VanDerWaalsContact O-N 3.1Å; K328-Y333 PolarHBondContact O-N 3.13Å; K328-G334 PolarHBondContact O-N 3.43Å
329	Q	84.4	Confident	77.9	Confident	154 Å²	154	75 Å²	75	72%	0.72	37%	0.374	S	S	*	.	H	α-helix	trans	-76.4	-46.8	-179.2	-71	179.7	3.8	0	0	111.3	E325 G326 I327	E325-Q329 WeakPolarHBondContact O-CB 3.27Å; E325-Q329 WeakPolarHBondContact O-CG 3.15Å; E325-Q329 PolarHBondContact O-N 3.33Å; G326-Q329 PolarHBondContact O-N 3.49Å; I327-Q329 PolarHBondContact O-N 3.3Å
330	T	87.4	Confident	77.3	Confident	50 Å²	50	78.9 Å²	78.9	31%	0.307	39%	0.393	S	S	.	.	H	α-helix	trans	-68.2	-41.5	-175.4	-58.5	0	0	0	0	112.6	A234 F235 G326	A234-T330 HydrophobicContact CB-CG2 4.06Å; F235-T330 WeakPolarHBondContact CA-OG1 3.02Å; F235-T330 HydrophobicContact CB-CG2 4.33Å; G326-T330 VanDerWaalsContact O-CB 3.28Å; G326-T330 WeakPolarHBondContact O-CB 3.18Å; G326-T330 PolarHBondContact O-N 2.79Å; G326-T330 PolarHBondContact O-OG1 3.21Å
331	F	87.6	Confident	77.1	Confident	54 Å²	54	79.2 Å²	79.2	24%	0.237	40%	0.396	C	S	.	.	S	Bend	trans	-105.2	1.9	-176.7	-55.9	-68.9	0	0	0	113.6	V225 L231 A234 F235 I327 Y333	V225-F331 HydrophobicContact CG1-CD2 4.26Å; V225-F331 HydrophobicContact CG1-CE2 3.67Å; V225-F331 HydrophobicContact CG1-CZ 4.45Å; V225-F331 HydrophobicContact CG2-CD2 4.09Å; V225-F331 HydrophobicContact CG2-CE2 3.95Å; V225-F331 HydrophobicContact CG2-CZ 4.43Å; L231-F331 HydrophobicContact CB-CZ 3.94Å; L231-F331 HydrophobicContact CD2-CE1 3.71Å; L231-F331 HydrophobicContact CD2-CZ 3.9Å; L231-F331 HydrophobicContact CG-CZ 4.48Å; A234-F331 HydrophobicContact CB-CE1 4.44Å; A234-F331 HydrophobicContact CB-CZ 4.07Å; F235-F331 HydrophobicContact CB-CE2 3.91Å; F235-F331 HydrophobicContact CD1-CE2 4.13Å; F235-F331 HydrophobicContact CG-CE2 4.49Å; I327-F331 HydrophobicContact CB-CD2 4.49Å; I327-F331 HydrophobicContact CG2-CD2 4.05Å; I327-F331 PolarHBondContact O-N 3.25Å; F331-Y333 HydrophobicContact CB-CD1 3.93Å; F331-Y333 HydrophobicContact CB-CD2 3.93Å; F331-Y333 HydrophobicContact CB-CE1 3.66Å; F331-Y333 HydrophobicContact CB-CE2 3.66Å; F331-Y333 HydrophobicContact CB-CG 4.05Å; F331-Y333 HydrophobicContact CD2-CE2 4.31Å; F331-Y333 HydrophobicContact CG-CE2 4.19Å; F331-Y333 VanDerWaalsContact O-CD1 3.29Å; F331-Y333 WeakPolarHBondContact O-CD1 3.45Å; F331-Y333 WeakPolarHBondContact O-CE1 3.42Å; F331-Y333 PolarHBondContact O-N 3.44Å
332	G	84.9	Confident	77	Confident	44 Å²	44	75.9 Å²	75.9	45%	0.454	39%	0.389	S	S	.	.	S	Bend	trans	72.8	11.9	179.3	0	0	0	0	0	114.7	K328 G334	K328-G332 CarbonylContact O-C 3.52Å; K328-G332 WeakPolarHBondContact O-CA 3.42Å; K328-G332 PolarHBondContact O-N 2.86Å; K328-G332 VanDerWaalsContact O-N 3.1Å; G332-G334 PolarHBondContact O-N 2.87Å; G332-G334 VanDerWaalsContact O-N 3.07Å
333	Y	86.4	Confident	76.7	Confident	29 Å²	29	74.3 Å²	74.3	11%	0.114	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	0.3	-177.1	-58.1	-19.1	0	0	0	114.3	F215 L216 T217 L222 V225 I327 K328 F331	F215-Y333 HydrophobicContact CD1-CD2 4.35Å; L216-Y333 PolarHBondContact N-O 3.19Å; T217-Y333 HydrophobicContact CG2-CD1 4.24Å; T217-Y333 HydrophobicContact CG2-CD2 3.68Å; T217-Y333 HydrophobicContact CG2-CE1 4.34Å; T217-Y333 HydrophobicContact CG2-CE2 3.78Å; T217-Y333 HydrophobicContact CG2-CG 3.94Å; L222-Y333 HydrophobicContact CD1-CD2 4.13Å; L222-Y333 HydrophobicContact CD1-CE2 4.31Å; V225-Y333 HydrophobicContact CG2-CE2 4.01Å; I327-Y333 HydrophobicContact CG2-CD2 3.65Å; I327-Y333 HydrophobicContact CG2-CE2 4.16Å; K328-Y333 PolarHBondContact O-N 3.13Å; F331-Y333 HydrophobicContact CB-CD1 3.93Å; F331-Y333 HydrophobicContact CB-CD2 3.93Å; F331-Y333 HydrophobicContact CB-CE1 3.66Å; F331-Y333 HydrophobicContact CB-CE2 3.66Å; F331-Y333 HydrophobicContact CB-CG 4.05Å; F331-Y333 HydrophobicContact CD2-CE2 4.31Å; F331-Y333 HydrophobicContact CG-CE2 4.19Å; F331-Y333 VanDerWaalsContact O-CD1 3.29Å; F331-Y333 WeakPolarHBondContact O-CD1 3.45Å; F331-Y333 WeakPolarHBondContact O-CE1 3.42Å; F331-Y333 PolarHBondContact O-N 3.44Å
334	G	73.3	Confident	76	Confident	44 Å²	44	78.7 Å²	78.7	45%	0.454	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-13.2	-180	0	0	0	0	0	115.9	K328 G332	K328-G334 PolarHBondContact O-N 3.43Å; G332-G334 PolarHBondContact O-N 2.87Å; G332-G334 VanDerWaalsContact O-N 3.07Å
335	A	60.5	Low	75.1	Confident	61 Å²	61	84.1 Å²	84.1	50%	0.504	44%	0.441	S	S	.	.			trans	-114.2	123.1	-170.3	0	0	0	0	0	111.8	L216 L337	L216-A335 VanDerWaalsContact CD1-O 3.27Å; L216-A335 WeakPolarHBondContact CD1-O 3.35Å; A335-L337 PolarHBondContact O-N 3.09Å
336	R	54.8	Low	74.5	Confident	158 Å²	158	82.7 Å²	82.7	60%	0.596	44%	0.438	S	S	*	.			trans	-81.3	105.3	155.9	-67.8	-173.3	-179	174	0.7	106.2	L216 E297 F338	L216-R336 HydrophobicContact CD1-CB 4.43Å; L216-R336 HydrophobicContact CD1-CG 3.59Å; L216-R336 HydrophobicContact CD2-CG 4.35Å; E297-R336 IonicContact OE1-CZ 3.21Å; E297-R336 IonicContact OE1-NE 3.54Å; E297-R336 IonicContact OE1-NH2 2.82Å; E297-R336 PolarHBondContact OE1-NH2 2.72Å; R336-F338 HydrophobicContact CB-CD2 4.39Å; R336-F338 HydrophobicContact CB-CE2 3.96Å; R336-F338 HydrophobicContact CB-CZ 4.28Å; R336-F338 WeakPolarHBondContact O-CD2 3.15Å; R336-F338 PolarHBondContact O-N 3.15Å; R336-F338 VanDerWaalsContact O-N 3.13Å
337	L	43.8	Very low	73.6	Confident	174 Å²	174	88.8 Å²	88.8	91%	0.911	47%	0.467	S	S	*	.			trans	-64.2	110.1	167.5	-73.7	163.6	0	0	0	106.9	A335	A335-L337 PolarHBondContact O-N 3.09Å
338	F	42.8	Very low	72.2	Confident	252 Å²	252	96.9 Å²	96.9	100%	1.105	51%	0.509	S	S	*	.			trans	-90.2	0	170.8	-73.9	-77.1	0	0	0	110.4	R336	R336-F338 HydrophobicContact CB-CD2 4.39Å; R336-F338 HydrophobicContact CB-CE2 3.96Å; R336-F338 HydrophobicContact CB-CZ 4.28Å; R336-F338 WeakPolarHBondContact O-CD2 3.15Å; R336-F338 PolarHBondContact O-N 3.15Å; R336-F338 VanDerWaalsContact O-N 3.13Å

Retrieved 338 of 338 residues in 66.6 ms (Link to these results)

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