G4VRR5_SCHMA Loading...

IRS-type PTB domain-containing protein

AlphaFold DB , UniProt , Accession G4VRR5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 328 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	31.7	Very low	44.8	Very low	165 Å²	165	77.3 Å²	77.3	81%	0.813	44%	0.441	S	S	*	.				0	100.7	0	-81	-122.3	-74.7	0	0	108.1	K109	M1-K109 HydrophobicContact CE-CD 3.63Å; M1-K109 HydrophobicContact CE-CG 4.3Å; M1-K109 HydrophobicContact SD-CD 4.17Å; M1-K109 WeakPolarHBondContact SD-CE 3.28Å; M1-K109 PolarHBondContact SD-NZ 2.88Å
2	G	40.7	Very low	45.3	Very low	65 Å²	65	77.6 Å²	77.6	67%	0.67	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-67.3	136.8	-164.7	0	0	0	0	0	114.5
3	L	34.3	Very low	45.7	Very low	64 Å²	64	71.6 Å²	71.6	34%	0.335	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-65.8	139.1	161.7	-70	172.3	0	0	0	108.2	N108 L113	L3-N108 HydrophobicContact CD2-CB 4.27Å; L3-L113 HydrophobicContact CD2-CD2 3.93Å
4	I	42.4	Very low	46.3	Very low	77 Å²	77	68.6 Å²	68.6	40%	0.395	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116.2	167.3	60.3	131.7	0	0	0	108.6	G106 R107	I4-G106 WeakPolarHBondContact O-CA 3.38Å; I4-R107 HydrophobicContact CD1-CG 3.69Å; I4-R107 VanDerWaalsContact CD1-NE 3.32Å; I4-R107 HydrophobicContact CG1-CG 3.53Å; I4-R107 PolarHBondContact N-O 3.15Å; I4-R107 PolarHBondContact O-N 3.5Å
5	N	43.3	Very low	46.5	Very low	83 Å²	83	68 Å²	68	44%	0.444	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	148.3	-178.6	-64	-22.1	0	0	0	110.1
6	S	48.5	Very low	46.4	Very low	20 Å²	20	66.4 Å²	66.4	14%	0.14	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-98.1	145.5	163.1	83.8	0	0	0	0	110	Y105	S6-Y105 PolarHBondContact N-O 3.31Å; S6-Y105 WeakPolarHBondContact OG-CE1 3.21Å; S6-Y105 VanDerWaalsContact OG-CE2 3.31Å; S6-Y105 WeakPolarHBondContact OG-CE2 3.4Å; S6-Y105 PolarHBondContact OG-OH 3.28Å
7	V	43.3	Very low	46.5	Very low	118 Å²	118	66.1 Å²	66.1	72%	0.715	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-51.2	139.7	173.3	-176.2	0	0	0	0	111.6	K9	V7-K9 WeakPolarHBondContact O-CG 3Å; V7-K9 PolarHBondContact O-N 3.39Å
8	N	49.7	Very low	46.6	Very low	92 Å²	92	68 Å²	68	49%	0.492	38%	0.381	S	S	.	.			trans	-52.3	103.8	172.8	-72.5	-34.8	0	0	0	110.6	R103	N8-R103 PolarHBondContact OD1-O 3.32Å
9	K	51.4	Low	46.2	Very low	51 Å²	51	69.5 Å²	69.5	22%	0.222	39%	0.385	C	S	.	.			trans	-107.7	7.8	178.5	-72.9	177.2	-178	179.7	0	113.1	V7 D11 L13 I145 N146 L149	V7-K9 WeakPolarHBondContact O-CG 3Å; V7-K9 PolarHBondContact O-N 3.39Å; K9-D11 PolarHBondContact O-N 3.39Å; K9-L13 PolarHBondContact O-N 3Å; K9-I145 HydrophobicContact CB-CG2 3.92Å; K9-I145 HydrophobicContact CD-CG2 3.52Å; K9-I145 HydrophobicContact CG-CG2 4.35Å; K9-N146 PolarHBondContact NZ-OD1 3.42Å; K9-L149 HydrophobicContact CD-CD1 3.98Å; K9-L149 HydrophobicContact CG-CD1 4.35Å
10	S	52.1	Low	45.7	Very low	9 Å²	9	75.1 Å²	75.1	6%	0.063	40%	0.401	C	S	.	.	H	α-helix	trans	-64.8	-38.6	-171.9	64.7	0	0	0	0	113.3	Q14 L102 R119	S10-Q14 PolarHBondContact O-N 2.97Å; S10-Q14 VanDerWaalsContact O-N 3.14Å; S10-L102 WeakPolarHBondContact CB-O 3.47Å; S10-R119 PolarHBondContact O-NH1 2.98Å; S10-R119 PolarHBondContact OG-NH2 3.05Å
11	D	55.5	Low	45	Very low	106 Å²	106	81.1 Å²	81.1	57%	0.567	42%	0.424	S	S	*	.	H	α-helix	trans	-79.8	-36.1	-169.6	-60.4	-10.6	0	0	0	110.9	K9 L13 Q14 R119	K9-D11 PolarHBondContact O-N 3.39Å; D11-L13 VanDerWaalsContact C-N 3.31Å; D11-L13 PolarHBondContact O-N 3.44Å; D11-Q14 VanDerWaalsContact O-CB 3.23Å; D11-Q14 WeakPolarHBondContact O-CB 3.36Å; D11-Q14 PolarHBondContact O-N 3.26Å; D11-R119 IonicContact OD1-NH1 2.9Å; D11-R119 IonicContact OD1-NH2 3.88Å; D11-R119 PolarHBondContact OD1-NH2 2.84Å
12	D	51.1	Low	44.9	Very low	81 Å²	81	76 Å²	76	43%	0.433	40%	0.402	S	S	.	.	H	α-helix	trans	-63.3	-36.6	173.2	-70.5	-13.2	0	0	0	112.5	L149	D12-L149 HydrophobicContact CB-CD2 3.29Å
13	L	49.8	Very low	44.2	Very low	0 Å²	0	81.4 Å²	81.4	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-74.8	-28.3	176.8	-70	-179	0	0	0	112.3	K9 D11 C15 L16 F17 L99 H100 I145 L148 L149	K9-L13 PolarHBondContact O-N 3Å; D11-L13 VanDerWaalsContact C-N 3.31Å; D11-L13 PolarHBondContact O-N 3.44Å; L13-C15 VanDerWaalsContact C-N 3.25Å; L13-C15 PolarHBondContact O-N 2.89Å; L13-L16 WeakPolarHBondContact O-CB 3.46Å; L13-L16 PolarHBondContact O-N 3.45Å; L13-F17 VanDerWaalsContact O-CD2 3.28Å; L13-F17 WeakPolarHBondContact O-CD2 3.29Å; L13-L99 HydrophobicContact CD1-CB 4.29Å; L13-H100 HydrophobicContact CB-CB 3.62Å; L13-I145 HydrophobicContact CD1-CB 4.39Å; L13-I145 HydrophobicContact CD1-CG1 4.02Å; L13-I145 HydrophobicContact CD1-CG2 3.97Å; L13-I145 HydrophobicContact CG-CG2 4.45Å; L13-L148 HydrophobicContact CD2-CB 3.44Å; L13-L148 VanDerWaalsContact CD2-CB 3.44Å; L13-L148 HydrophobicContact CD2-CD1 4.27Å; L13-L148 HydrophobicContact CD2-CG 4.5Å; L13-L149 HydrophobicContact CD2-CD2 3.72Å; L13-L149 HydrophobicContact CD2-CG 3.88Å; L13-L149 HydrophobicContact CG-CD2 4.06Å; L13-L149 HydrophobicContact CG-CG 4.45Å
14	Q	54.7	Low	44	Very low	29 Å²	29	83.6 Å²	83.6	14%	0.136	41%	0.413	C	S	.	.	H	α-helix	trans	-56.1	-41.4	-177.3	-172.2	61.3	13.5	0	0	112.1	S10 D11 L16 F17 D18 H100	S10-Q14 PolarHBondContact O-N 2.97Å; S10-Q14 VanDerWaalsContact O-N 3.14Å; D11-Q14 VanDerWaalsContact O-CB 3.23Å; D11-Q14 WeakPolarHBondContact O-CB 3.36Å; D11-Q14 PolarHBondContact O-N 3.26Å; Q14-L16 PolarHBondContact O-N 3.06Å; Q14-L16 VanDerWaalsContact O-N 3.08Å; Q14-F17 PolarHBondContact O-N 3.33Å; Q14-D18 WeakPolarHBondContact CG-OD2 3.41Å; Q14-D18 PolarHBondContact NE2-OD1 3.36Å; Q14-D18 PolarHBondContact NE2-OD2 2.82Å; Q14-D18 PolarHBondContact O-N 3.35Å; Q14-H100 PolarHBondContact OE1-CD2 3.44Å; Q14-H100 VanDerWaalsContact OE1-CD2 3.31Å
15	C	48.4	Very low	43.2	Very low	60 Å²	60	86.6 Å²	86.6	41%	0.405	42%	0.423	S	S	.	.	H	α-helix	trans	-62.1	-18.3	179.1	-60.9	0	0	0	0	114.2	L13 Y152	L13-C15 VanDerWaalsContact C-N 3.25Å; L13-C15 PolarHBondContact O-N 2.89Å; C15-Y152 HydrophobicContact CB-CD2 4.2Å; C15-Y152 HydrophobicContact CB-CE1 4.22Å; C15-Y152 HydrophobicContact CB-CE2 3.3Å; C15-Y152 WeakPolarHBondContact CB-OH 3.42Å
16	L	45.6	Very low	42.5	Very low	43 Å²	43	87.1 Å²	87.1	23%	0.225	44%	0.439	C	S	.	.	H	α-helix	trans	-81.8	-23.9	174.7	-166.9	133.2	0	0	0	112.5	L13 Q14 L151 Y152	L13-L16 WeakPolarHBondContact O-CB 3.46Å; L13-L16 PolarHBondContact O-N 3.45Å; Q14-L16 PolarHBondContact O-N 3.06Å; Q14-L16 VanDerWaalsContact O-N 3.08Å; L16-L151 HydrophobicContact CD1-CB 4.38Å; L16-Y152 HydrophobicContact CB-CD2 4.16Å; L16-Y152 HydrophobicContact CD1-CD2 4.44Å
17	F	48.8	Very low	41.6	Very low	60 Å²	60	96.1 Å²	96.1	26%	0.263	48%	0.476	S	S	.	.	H	α-helix	trans	-110.6	-20.7	-175.3	-62.9	-86.1	0	0	0	114.3	L13 Q14 E19 Y80 H100	L13-F17 VanDerWaalsContact O-CD2 3.28Å; L13-F17 WeakPolarHBondContact O-CD2 3.29Å; Q14-F17 PolarHBondContact O-N 3.33Å; F17-E19 PolarHBondContact O-N 3.26Å; F17-Y80 AromaticContact CE1-CD1 3.9Å; F17-Y80 HydrophobicContact CE1-CD1 3.9Å; F17-Y80 HydrophobicContact CE1-CG 4.16Å; F17-Y80 AromaticContact CZ-CD1 3.63Å; F17-Y80 HydrophobicContact CZ-CD1 3.63Å; F17-Y80 HydrophobicContact CZ-CE1 4.4Å; F17-Y80 HydrophobicContact CZ-CG 4.2Å; F17-H100 AromaticContact CD1-CE1 3.67Å; F17-H100 AromaticContact CD1-ND1 3.63Å; F17-H100 HydrophobicContact CD2-CB 3.61Å; F17-H100 AromaticContact CD2-CE1 3.71Å; F17-H100 AromaticContact CD2-CG 3.39Å; F17-H100 AromaticContact CD2-ND1 2.97Å; F17-H100 WeakPolarHBondContact CD2-ND1 3.25Å; F17-H100 AromaticContact CE1-ND1 3.81Å; F17-H100 HydrophobicContact CE2-CB 3.81Å; F17-H100 AromaticContact CE2-CG 3.8Å; F17-H100 AromaticContact CE2-ND1 3.2Å; F17-H100 WeakPolarHBondContact CE2-ND1 3.27Å; F17-H100 AromaticContact CG-CE1 3.42Å; F17-H100 VanDerWaalsContact CG-CE1 3.42Å; F17-H100 WeakPolarHBondContact CG-CE1 3.43Å; F17-H100 AromaticContact CG-CG 3.88Å; F17-H100 AromaticContact CG-ND1 3.2Å; F17-H100 WeakPolarHBondContact CG-ND1 3.41Å; F17-H100 AromaticContact CZ-ND1 3.6Å
18	D	47.9	Very low	41.2	Very low	101 Å²	101	93.4 Å²	93.4	54%	0.54	47%	0.466	S	S	.	.	S	Bend	trans	-75	77.9	169.8	-76.6	-9.9	0	0	0	110.1	Q14 Y20	Q14-D18 WeakPolarHBondContact CG-OD2 3.41Å; Q14-D18 PolarHBondContact NE2-OD1 3.36Å; Q14-D18 PolarHBondContact NE2-OD2 2.82Å; Q14-D18 PolarHBondContact O-N 3.35Å; D18-Y20 PolarHBondContact O-N 3.46Å
19	E	38.3	Very low	40.4	Very low	96 Å²	96	97.8 Å²	97.8	45%	0.449	48%	0.483	S	S	.	.			trans	-78.4	104.8	-174.5	-169.5	165.8	-113.9	0	0	111.9	F17 R23	F17-E19 PolarHBondContact O-N 3.26Å; E19-R23 VanDerWaalsContact CD-NH2 3.29Å; E19-R23 HydrophobicContact CG-CG 4.3Å; E19-R23 WeakPolarHBondContact OE1-CD 3.49Å; E19-R23 IonicContact OE1-CZ 2.81Å; E19-R23 IonicContact OE1-NE 2.78Å; E19-R23 PolarHBondContact OE1-NE 2.91Å; E19-R23 IonicContact OE1-NH1 3.35Å; E19-R23 IonicContact OE1-NH2 2.68Å; E19-R23 PolarHBondContact OE1-NH2 3.15Å; E19-R23 IonicContact OE2-CZ 3.15Å; E19-R23 IonicContact OE2-NE 3.74Å; E19-R23 IonicContact OE2-NH1 3.65Å; E19-R23 PolarHBondContact OE2-NH1 3.24Å; E19-R23 IonicContact OE2-NH2 3.17Å; E19-R23 PolarHBondContact OE2-NH2 2.93Å
20	Y	35.8	Very low	39.9	Very low	182 Å²	182	101.3 Å²	101.3	71%	0.714	50%	0.503	S	S	*	.	S	Bend	trans	-155.8	-29.9	144.4	-132.1	-92.6	0	0	0	113.2	D18 I24	D18-Y20 PolarHBondContact O-N 3.46Å; Y20-I24 HydrophobicContact CD1-CD1 3.67Å; Y20-I24 HydrophobicContact CE1-CD1 3.42Å; Y20-I24 VanDerWaalsContact CE1-CD1 3.42Å
21	K	32.2	Very low	39.2	Very low	201 Å²	201	104.5 Å²	104.5	87%	0.874	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-21.3	-178	-77.8	-177.1	178.8	176.3	0	115.5
22	T	29.4	Very low	38.9	Very low	59 Å²	59	105.3 Å²	105.3	36%	0.362	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-19.9	-179.6	42.2	0	0	0	0	114.2	I159	T22-I159 HydrophobicContact CG2-CD1 4.02Å
23	R	26.4	Very low	38.9	Very low	177 Å²	177	108.3 Å²	108.3	67%	0.668	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-23.9	175.5	-82.2	-167.6	179.2	161.8	15.2	114.9	E19	E19-R23 VanDerWaalsContact CD-NH2 3.29Å; E19-R23 HydrophobicContact CG-CG 4.3Å; E19-R23 WeakPolarHBondContact OE1-CD 3.49Å; E19-R23 IonicContact OE1-CZ 2.81Å; E19-R23 IonicContact OE1-NE 2.78Å; E19-R23 PolarHBondContact OE1-NE 2.91Å; E19-R23 IonicContact OE1-NH1 3.35Å; E19-R23 IonicContact OE1-NH2 2.68Å; E19-R23 PolarHBondContact OE1-NH2 3.15Å; E19-R23 IonicContact OE2-CZ 3.15Å; E19-R23 IonicContact OE2-NE 3.74Å; E19-R23 IonicContact OE2-NH1 3.65Å; E19-R23 PolarHBondContact OE2-NH1 3.24Å; E19-R23 IonicContact OE2-NH2 3.17Å; E19-R23 PolarHBondContact OE2-NH2 2.93Å
24	I	29	Very low	38.8	Very low	110 Å²	110	110.3 Å²	110.3	56%	0.564	57%	0.567	S	S	*	*	S	Bend	trans	-92.4	-9.7	-167.1	-62.8	-170.2	0	0	0	115.5	Y20	Y20-I24 HydrophobicContact CD1-CD1 3.67Å; Y20-I24 HydrophobicContact CE1-CD1 3.42Å; Y20-I24 VanDerWaalsContact CE1-CD1 3.42Å
25	K	26.5	Very low	38.7	Very low	140 Å²	140	111.5 Å²	111.5	61%	0.609	58%	0.578	S	S	*	*	S	Bend	trans	-113.7	5.2	-179.3	-75.7	-168.7	175.4	-171.8	0	117.6	K27 A28	K25-K27 PolarHBondContact O-N 3.42Å; K25-A28 PolarHBondContact O-N 3.43Å
26	A	28.8	Very low	38.9	Very low	94 Å²	94	116.9 Å²	116.9	78%	0.777	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-3.5	172.7	0	0	0	0	0	114.2
27	K	28.8	Very low	39.4	Very low	209 Å²	209	118.8 Å²	118.8	91%	0.909	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-0.4	174	-109.1	-175.4	179.3	-177	0	114.7	K25 H29	K25-K27 PolarHBondContact O-N 3.42Å; K27-H29 PolarHBondContact O-N 3.35Å
28	A	34.3	Very low	39.6	Very low	62 Å²	62	119.6 Å²	119.6	51%	0.512	62%	0.616	S	S	.	*	S	Bend	trans	-84.4	105.6	173.2	0	0	0	0	0	109.2	K25 L30	K25-A28 PolarHBondContact O-N 3.43Å; A28-L30 PolarHBondContact O-N 2.91Å
29	H	34.6	Very low	40.1	Very low	184 Å²	184	119 Å²	119	85%	0.852	61%	0.613	S	S	*	*			trans	17.1	92.2	166.6	-72.5	-77.2	0	0	0	116	K27 P31	K27-H29 PolarHBondContact O-N 3.35Å; H29-P31 VanDerWaalsContact O-CD 3.28Å; H29-P31 WeakPolarHBondContact O-CD 3.43Å
30	L	39.5	Very low	41.1	Very low	124 Å²	124	121.1 Å²	121.1	65%	0.649	62%	0.622	S	S	*	*			trans	-59.2	117.1	166.4	-165.7	75.4	0	0	0	108	A28 P34 L162	A28-L30 PolarHBondContact O-N 2.91Å; L30-P34 HydrophobicContact CD1-CG 4.16Å; L30-P34 HydrophobicContact CG-CG 4.25Å; L30-L162 HydrophobicContact CD1-CD1 4.17Å; L30-L162 HydrophobicContact CD1-CD2 3.72Å
31	P	38.1	Very low	42.2	Very low	77 Å²	77	113.8 Å²	113.8	50%	0.5	59%	0.594	S	S	.	*			trans	-60.7	143.2	172.1	23.4	-29.6	0	0	0	108.4	H29 N33 P34 L162	H29-P31 VanDerWaalsContact O-CD 3.28Å; H29-P31 WeakPolarHBondContact O-CD 3.43Å; P31-N33 PolarHBondContact O-N 2.79Å; P31-P34 WeakPolarHBondContact O-CD 3.22Å; P31-L162 HydrophobicContact CG-CD2 4.42Å
32	S	49.4	Very low	43.4	Very low	122 Å²	122	108.8 Å²	108.8	85%	0.853	58%	0.576	S	S	*	*	S	Bend	trans	-67.8	13.4	-163.2	51.8	0	0	0	0	116.5
33	N	50.8	Low	44.9	Very low	144 Å²	144	111.3 Å²	111.3	77%	0.77	58%	0.584	S	S	*	*			trans	-160.5	67.9	173.4	-119.3	-22.2	0	0	0	118.4	P31	P31-N33 PolarHBondContact O-N 2.79Å
34	P	47.4	Very low	46.3	Very low	42 Å²	42	105 Å²	105	27%	0.273	57%	0.567	S	S	.	*			trans	-115.8	30.4	167.9	30.5	-7.8	0	0	0	111.7	L30 P31 P37 L162	L30-P34 HydrophobicContact CD1-CG 4.16Å; L30-P34 HydrophobicContact CG-CG 4.25Å; P31-P34 WeakPolarHBondContact O-CD 3.22Å; P34-P37 WeakPolarHBondContact O-CD 3.41Å; P34-L162 HydrophobicContact CG-CD2 4.23Å
35	S	53	Low	47.4	Very low	54 Å²	54	100.8 Å²	100.8	38%	0.378	55%	0.546	S	S	.	.	H	α-helix	trans	-72	-37	-168.6	50.9	0	0	0	0	114.1	I39	S35-I39 WeakPolarHBondContact O-CB 3.42Å; S35-I39 WeakPolarHBondContact O-CD1 3.5Å; S35-I39 WeakPolarHBondContact O-CG1 3.21Å; S35-I39 PolarHBondContact O-N 3.03Å
36	K	53.1	Low	48.8	Very low	174 Å²	174	96.5 Å²	96.5	76%	0.757	53%	0.534	S	S	*	.	H	α-helix	trans	-62.5	-52	-177.5	-68.9	-176.1	180	179.5	0	114.4	L38 I39 Q40	K36-L38 PolarHBondContact O-N 3.47Å; K36-I39 PolarHBondContact O-N 3.47Å; K36-Q40 WeakPolarHBondContact O-CB 3.32Å; K36-Q40 PolarHBondContact O-N 3.28Å
37	P	54.8	Low	50.1	Low	82 Å²	82	98.5 Å²	98.5	53%	0.532	53%	0.527	S	S	.	.	H	α-helix	trans	-67.8	-34.2	-179.3	23.8	-32.3	0	0	0	112.8	P34 F41	P34-P37 WeakPolarHBondContact O-CD 3.41Å; P37-F41 VanDerWaalsContact O-CB 3.22Å; P37-F41 WeakPolarHBondContact O-CB 3.25Å; P37-F41 PolarHBondContact O-N 2.92Å
38	L	54.5	Low	51.2	Low	77 Å²	77	90.9 Å²	90.9	40%	0.403	50%	0.501	S	S	.	.	H	α-helix	trans	-67.1	-46.1	176.8	-169.9	88.4	0	0	0	111.5	K36 F41 L42 V158	K36-L38 PolarHBondContact O-N 3.47Å; L38-F41 WeakPolarHBondContact O-CB 3.34Å; L38-F41 PolarHBondContact O-N 3.32Å; L38-L42 HydrophobicContact CD2-CD1 4.26Å; L38-L42 HydrophobicContact CG-CD1 4.2Å; L38-L42 WeakPolarHBondContact O-CB 3.42Å; L38-L42 VanDerWaalsContact O-CG 3.3Å; L38-L42 WeakPolarHBondContact O-CG 3.46Å; L38-L42 PolarHBondContact O-N 3.5Å; L38-V158 HydrophobicContact CD1-CG1 4.15Å
39	I	58.4	Low	52.1	Low	90 Å²	90	88.8 Å²	88.8	46%	0.462	48%	0.48	S	S	.	.	H	α-helix	trans	-64	-46	179.6	-69.2	166.8	0	0	0	110.5	S35 K36 F41 L42 Q43	S35-I39 WeakPolarHBondContact O-CB 3.42Å; S35-I39 WeakPolarHBondContact O-CD1 3.5Å; S35-I39 WeakPolarHBondContact O-CG1 3.21Å; S35-I39 PolarHBondContact O-N 3.03Å; K36-I39 PolarHBondContact O-N 3.47Å; I39-F41 VanDerWaalsContact C-N 3.31Å; I39-F41 PolarHBondContact O-N 3.26Å; I39-L42 PolarHBondContact O-N 3.06Å; I39-Q43 HydrophobicContact CG2-CG 4.39Å; I39-Q43 WeakPolarHBondContact O-CB 3.21Å; I39-Q43 WeakPolarHBondContact O-CG 3.49Å; I39-Q43 PolarHBondContact O-N 3Å
40	Q	59	Low	53	Low	139 Å²	139	87.1 Å²	87.1	65%	0.65	47%	0.471	S	S	*	.	H	α-helix	trans	-63.1	-38.7	176.9	-169.1	177.2	8.2	0	0	111.7	K36 S44	K36-Q40 WeakPolarHBondContact O-CB 3.32Å; K36-Q40 PolarHBondContact O-N 3.28Å; Q40-S44 WeakPolarHBondContact O-CB 3.46Å; Q40-S44 PolarHBondContact O-N 2.96Å; Q40-S44 PolarHBondContact O-OG 2.87Å
41	F	58.8	Low	53.6	Low	29 Å²	29	85.9 Å²	85.9	13%	0.127	47%	0.465	C	S	.	.	H	α-helix	trans	-59.3	-57.8	171.3	172.2	-115.1	0	0	0	110.4	P37 L38 I39 Q43 S44 V45 L151 N154	P37-F41 VanDerWaalsContact O-CB 3.22Å; P37-F41 WeakPolarHBondContact O-CB 3.25Å; P37-F41 PolarHBondContact O-N 2.92Å; L38-F41 WeakPolarHBondContact O-CB 3.34Å; L38-F41 PolarHBondContact O-N 3.32Å; I39-F41 VanDerWaalsContact C-N 3.31Å; I39-F41 PolarHBondContact O-N 3.26Å; F41-Q43 VanDerWaalsContact C-N 3.27Å; F41-Q43 PolarHBondContact O-N 2.88Å; F41-S44 CarbonylContact O-C 3.57Å; F41-S44 WeakPolarHBondContact O-CA 3.48Å; F41-S44 WeakPolarHBondContact O-CB 3.3Å; F41-S44 PolarHBondContact O-N 3.07Å; F41-S44 PolarHBondContact O-OG 3.38Å; F41-V45 HydrophobicContact CD1-CG2 4.03Å; F41-V45 HydrophobicContact CD2-CG2 3.76Å; F41-V45 HydrophobicContact CE1-CG2 3.73Å; F41-V45 HydrophobicContact CE2-CG2 3.38Å; F41-V45 HydrophobicContact CG-CG2 4.07Å; F41-V45 HydrophobicContact CZ-CG2 3.41Å; F41-V45 VanDerWaalsContact CZ-CG2 3.41Å; F41-V45 WeakPolarHBondContact O-CG2 3.42Å; F41-V45 PolarHBondContact O-N 3.19Å; F41-L151 HydrophobicContact CE2-CD2 4.12Å; F41-L151 HydrophobicContact CZ-CD2 4.03Å; F41-N154 HydrophobicContact CD2-CB 3.48Å; F41-N154 VanDerWaalsContact CD2-CB 3.48Å; F41-N154 HydrophobicContact CE2-CB 3.13Å; F41-N154 HydrophobicContact CG-CB 4.34Å; F41-N154 HydrophobicContact CZ-CB 3.72Å
42	L	56.7	Low	54	Low	95 Å²	95	92.4 Å²	92.4	50%	0.497	49%	0.486	S	S	.	.	H	α-helix	trans	-56.7	-37.9	-179.3	-69.7	174.7	0	0	0	112.8	L38 I39 V45 S46	L38-L42 HydrophobicContact CD2-CD1 4.26Å; L38-L42 HydrophobicContact CG-CD1 4.2Å; L38-L42 WeakPolarHBondContact O-CB 3.42Å; L38-L42 VanDerWaalsContact O-CG 3.3Å; L38-L42 WeakPolarHBondContact O-CG 3.46Å; L38-L42 PolarHBondContact O-N 3.5Å; I39-L42 PolarHBondContact O-N 3.06Å; L42-V45 WeakPolarHBondContact O-CB 3.23Å; L42-V45 PolarHBondContact O-N 3.33Å; L42-S46 WeakPolarHBondContact O-CB 3.11Å; L42-S46 PolarHBondContact O-N 2.85Å
43	Q	60.3	Low	54.2	Low	112 Å²	112	96.3 Å²	96.3	52%	0.523	48%	0.482	S	S	.	.	H	α-helix	trans	-62.6	-49.2	172.4	-75.7	174.1	-23.9	0	0	111.2	I39 F41 V45 S46 E47	I39-Q43 HydrophobicContact CG2-CG 4.39Å; I39-Q43 WeakPolarHBondContact O-CB 3.21Å; I39-Q43 WeakPolarHBondContact O-CG 3.49Å; I39-Q43 PolarHBondContact O-N 3Å; F41-Q43 VanDerWaalsContact C-N 3.27Å; F41-Q43 PolarHBondContact O-N 2.88Å; Q43-V45 VanDerWaalsContact C-N 3.34Å; Q43-V45 PolarHBondContact O-N 3Å; Q43-S46 WeakPolarHBondContact O-CB 3.16Å; Q43-S46 PolarHBondContact O-N 2.87Å; Q43-S46 PolarHBondContact O-OG 3.33Å; Q43-E47 PolarHBondContact O-N 2.78Å
44	S	55.7	Low	54.5	Low	44 Å²	44	98.1 Å²	98.1	31%	0.308	48%	0.483	S	S	.	.	H	α-helix	trans	-62.4	-37.5	176.4	77.7	0	0	0	0	113.3	Q40 F41 S46 S48	Q40-S44 WeakPolarHBondContact O-CB 3.46Å; Q40-S44 PolarHBondContact O-N 2.96Å; Q40-S44 PolarHBondContact O-OG 2.87Å; F41-S44 CarbonylContact O-C 3.57Å; F41-S44 WeakPolarHBondContact O-CA 3.48Å; F41-S44 WeakPolarHBondContact O-CB 3.3Å; F41-S44 PolarHBondContact O-N 3.07Å; F41-S44 PolarHBondContact O-OG 3.38Å; S44-S46 VanDerWaalsContact C-N 3.32Å; S44-S48 VanDerWaalsContact O-CB 3.28Å; S44-S48 WeakPolarHBondContact O-CB 3.48Å; S44-S48 PolarHBondContact O-N 2.9Å; S44-S48 VanDerWaalsContact O-N 3.08Å
45	V	53.3	Low	55.1	Low	22 Å²	22	100.5 Å²	100.5	13%	0.133	50%	0.5	C	S	.	.	H	α-helix	trans	-59.8	-47.3	171.9	173.1	0	0	0	0	109.3	F41 L42 Q43 E47 S48 M49 L151	F41-V45 HydrophobicContact CD1-CG2 4.03Å; F41-V45 HydrophobicContact CD2-CG2 3.76Å; F41-V45 HydrophobicContact CE1-CG2 3.73Å; F41-V45 HydrophobicContact CE2-CG2 3.38Å; F41-V45 HydrophobicContact CG-CG2 4.07Å; F41-V45 HydrophobicContact CZ-CG2 3.41Å; F41-V45 VanDerWaalsContact CZ-CG2 3.41Å; F41-V45 WeakPolarHBondContact O-CG2 3.42Å; F41-V45 PolarHBondContact O-N 3.19Å; L42-V45 WeakPolarHBondContact O-CB 3.23Å; L42-V45 PolarHBondContact O-N 3.33Å; Q43-V45 VanDerWaalsContact C-N 3.34Å; Q43-V45 PolarHBondContact O-N 3Å; V45-E47 PolarHBondContact O-N 3.43Å; V45-S48 PolarHBondContact O-N 3.5Å; V45-M49 HydrophobicContact CG1-CG 3.92Å; V45-M49 WeakPolarHBondContact O-CB 3.28Å; V45-M49 WeakPolarHBondContact O-CG 3.34Å; V45-M49 PolarHBondContact O-N 2.96Å; V45-L151 HydrophobicContact CB-CD2 3.63Å; V45-L151 HydrophobicContact CG1-CD1 4.01Å; V45-L151 HydrophobicContact CG1-CD2 3.39Å; V45-L151 HydrophobicContact CG1-CG 4.35Å; V45-L151 HydrophobicContact CG2-CD2 3.1Å
46	S	56.5	Low	56.4	Low	51 Å²	51	101.7 Å²	101.7	36%	0.357	50%	0.501	S	S	.	.	H	α-helix	trans	-65.1	-41.8	-175.8	82.6	0	0	0	0	111.8	L42 Q43 S44 F50	L42-S46 WeakPolarHBondContact O-CB 3.11Å; L42-S46 PolarHBondContact O-N 2.85Å; Q43-S46 WeakPolarHBondContact O-CB 3.16Å; Q43-S46 PolarHBondContact O-N 2.87Å; Q43-S46 PolarHBondContact O-OG 3.33Å; S44-S46 VanDerWaalsContact C-N 3.32Å; S46-F50 WeakPolarHBondContact O-CA 3.47Å; S46-F50 WeakPolarHBondContact O-CB 2.7Å; S46-F50 WeakPolarHBondContact O-CD2 2.82Å; S46-F50 PolarHBondContact O-N 2.92Å
47	E	54.8	Low	58.2	Low	135 Å²	135	96.5 Å²	96.5	63%	0.631	49%	0.486	S	S	*	.	H	α-helix	trans	-69	-38	179.6	-71.2	178.5	179	0	0	112.2	Q43 V45 N51	Q43-E47 PolarHBondContact O-N 2.78Å; V45-E47 PolarHBondContact O-N 3.43Å; E47-N51 WeakPolarHBondContact O-CA 3.28Å; E47-N51 VanDerWaalsContact O-CB 3.25Å; E47-N51 WeakPolarHBondContact O-CB 3.49Å; E47-N51 PolarHBondContact O-N 3.28Å; E47-N51 PolarHBondContact O-ND2 3.29Å
48	S	52	Low	60.2	Low	50 Å²	50	93.2 Å²	93.2	35%	0.35	46%	0.463	S	S	.	.	H	α-helix	trans	-73.5	-42.5	178.1	179.2	0	0	0	0	112.6	S44 V45 S147	S44-S48 VanDerWaalsContact O-CB 3.28Å; S44-S48 WeakPolarHBondContact O-CB 3.48Å; S44-S48 PolarHBondContact O-N 2.9Å; S44-S48 VanDerWaalsContact O-N 3.08Å; V45-S48 PolarHBondContact O-N 3.5Å; S48-S147 WeakPolarHBondContact OG-CB 3.31Å; S48-S147 PolarHBondContact OG-OG 3.03Å
49	M	53.9	Low	62.2	Low	17 Å²	17	93.8 Å²	93.8	8%	0.084	47%	0.474	C	S	.	.	H	α-helix	trans	-84.1	-37.6	-174.6	-65.9	-78.6	-83.4	0	0	113	V45 V79 Y80 R144 L148 L151	V45-M49 HydrophobicContact CG1-CG 3.92Å; V45-M49 WeakPolarHBondContact O-CB 3.28Å; V45-M49 WeakPolarHBondContact O-CG 3.34Å; V45-M49 PolarHBondContact O-N 2.96Å; M49-V79 HydrophobicContact CE-CG1 3.94Å; M49-Y80 HydrophobicContact CE-CE1 3.99Å; M49-R144 PolarHBondContact O-NH1 3.46Å; M49-R144 VanDerWaalsContact SD-CZ 3.54Å; M49-R144 PolarHBondContact SD-NH2 2.83Å; M49-L148 HydrophobicContact CE-CD2 4.03Å; M49-L148 HydrophobicContact SD-CD2 4.37Å; M49-L151 HydrophobicContact CE-CD1 3.59Å; M49-L151 HydrophobicContact CG-CD1 4.01Å; M49-L151 HydrophobicContact SD-CD1 3.7Å
50	F	53.9	Low	64	Low	149 Å²	149	89.7 Å²	89.7	65%	0.654	45%	0.453	S	S	*	.			trans	-110.8	22.9	-176.7	-53.2	-75.3	0	0	0	112.8	S46 K52	S46-F50 WeakPolarHBondContact O-CA 3.47Å; S46-F50 WeakPolarHBondContact O-CB 2.7Å; S46-F50 WeakPolarHBondContact O-CD2 2.82Å; S46-F50 PolarHBondContact O-N 2.92Å; F50-K52 VanDerWaalsContact C-N 3.3Å; F50-K52 WeakPolarHBondContact O-CA 3.49Å; F50-K52 WeakPolarHBondContact O-CG 3.41Å; F50-K52 PolarHBondContact O-N 3.05Å
51	N	51.2	Low	65.6	Low	99 Å²	99	83.8 Å²	83.8	53%	0.529	43%	0.427	S	S	.	.			trans	-50.2	104.8	165.3	-131.8	-33.8	0	0	0	106.4	E47 R53	E47-N51 WeakPolarHBondContact O-CA 3.28Å; E47-N51 VanDerWaalsContact O-CB 3.25Å; E47-N51 WeakPolarHBondContact O-CB 3.49Å; E47-N51 PolarHBondContact O-N 3.28Å; E47-N51 PolarHBondContact O-ND2 3.29Å; N51-R53 PolarHBondContact O-N 3.48Å
52	K	47.9	Very low	67.1	Low	213 Å²	213	83.6 Å²	83.6	93%	0.926	43%	0.427	S	S	*	.			trans	-64.1	10.9	-166.7	-70.9	-179.6	177.8	175.7	0	113	F50 K54	F50-K52 VanDerWaalsContact C-N 3.3Å; F50-K52 WeakPolarHBondContact O-CA 3.49Å; F50-K52 WeakPolarHBondContact O-CG 3.41Å; F50-K52 PolarHBondContact O-N 3.05Å; K52-K54 VanDerWaalsContact C-N 3.34Å; K52-K54 PolarHBondContact O-N 3.25Å
53	R	52.7	Low	68.3	Low	205 Å²	205	80 Å²	80	77%	0.774	41%	0.408	S	S	*	.	S	Bend	trans	-70	93.4	173.9	-63.6	-173.8	-179.5	168.2	1.2	107.9	N51	N51-R53 PolarHBondContact O-N 3.48Å
54	K	57.4	Low	69.1	Low	182 Å²	182	76.7 Å²	76.7	79%	0.791	39%	0.394	S	S	*	.			trans	26.6	108.2	151.1	-157.2	171.8	-171.1	173.7	0	113.3	K52 M56	K52-K54 VanDerWaalsContact C-N 3.34Å; K52-K54 PolarHBondContact O-N 3.25Å; K54-M56 WeakPolarHBondContact O-CG 3.34Å; K54-M56 PolarHBondContact O-N 3.49Å
55	S	59.4	Low	70.1	Confident	91 Å²	91	79.6 Å²	79.6	64%	0.636	40%	0.403	S	S	*	.			trans	-34.8	117.3	165.2	43.3	0	0	0	0	110.1	C57	S55-C57 PolarHBondContact O-N 3.18Å
56	M	80	Confident	71.1	Confident	79 Å²	79	82.3 Å²	82.3	39%	0.389	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	97.8	-168.7	-62.3	-172.2	84.9	0	0	108	K54 F58 V77 C140	K54-M56 WeakPolarHBondContact O-CG 3.34Å; K54-M56 PolarHBondContact O-N 3.49Å; M56-F58 HydrophobicContact CB-CE2 3.83Å; M56-F58 HydrophobicContact CB-CZ 4.13Å; M56-F58 WeakPolarHBondContact O-CD2 3.43Å; M56-F58 VanDerWaalsContact O-CE2 3.31Å; M56-F58 WeakPolarHBondContact O-CE2 3.16Å; M56-V77 PolarHBondContact O-N 3.08Å; M56-C140 VanDerWaalsContact CE-SG 3.57Å; M56-C140 HydrophobicContact SD-CB 4.37Å; M56-C140 PolarHBondContact SD-SG 3.26Å
57	C	91.4	Very high	72	Confident	66 Å²	66	85.9 Å²	85.9	45%	0.446	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	136.3	-177.6	-169.5	0	0	0	0	110.3	S55 I75	S55-C57 PolarHBondContact O-N 3.18Å; C57-I75 CarbonylContact C-O 3.6Å; C57-I75 VanDerWaalsContact CA-O 3.31Å; C57-I75 WeakPolarHBondContact CA-O 3.22Å
58	F	96.1	Very high	73.2	Confident	12 Å²	12	85.7 Å²	85.7	5%	0.053	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	126.5	-176	-59.8	-90.1	0	0	0	109.7	M56 V60 L74 I75 V77 H133 R136 L137	M56-F58 HydrophobicContact CB-CE2 3.83Å; M56-F58 HydrophobicContact CB-CZ 4.13Å; M56-F58 WeakPolarHBondContact O-CD2 3.43Å; M56-F58 VanDerWaalsContact O-CE2 3.31Å; M56-F58 WeakPolarHBondContact O-CE2 3.16Å; F58-V60 HydrophobicContact CB-CG1 4.2Å; F58-L74 CarbonylContact O-C 3.48Å; F58-L74 WeakPolarHBondContact O-CA 3.14Å; F58-I75 PolarHBondContact N-O 3.25Å; F58-I75 PolarHBondContact O-N 2.81Å; F58-V77 HydrophobicContact CE2-CG2 4.4Å; F58-H133 HydrophobicContact CD1-CB 4.42Å; F58-H133 HydrophobicContact CE1-CB 4.48Å; F58-R136 HydrophobicContact CE1-CB 3.87Å; F58-R136 HydrophobicContact CZ-CB 4.31Å; F58-L137 HydrophobicContact CB-CD1 4.17Å; F58-L137 HydrophobicContact CD1-CB 4.19Å; F58-L137 HydrophobicContact CD2-CB 4.29Å; F58-L137 HydrophobicContact CD2-CD1 4.18Å; F58-L137 HydrophobicContact CD2-CG 3.91Å; F58-L137 HydrophobicContact CE1-CB 4.08Å; F58-L137 HydrophobicContact CE2-CB 4.19Å; F58-L137 HydrophobicContact CE2-CG 4.08Å; F58-L137 HydrophobicContact CG-CB 4.3Å; F58-L137 HydrophobicContact CG-CD1 4.07Å; F58-L137 HydrophobicContact CG-CG 4.17Å; F58-L137 HydrophobicContact CZ-CB 4.08Å; F58-L137 HydrophobicContact CZ-CG 4.49Å
59	S	97.5	Very high	74.9	Confident	90 Å²	90	87.5 Å²	87.5	63%	0.629	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	126.6	167.4	175.3	0	0	0	0	109.8
60	V	96.4	Very high	76.3	Confident	4 Å²	4	90.9 Å²	90.9	2%	0.024	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	163.3	-175.8	-59.2	0	0	0	0	111.9	F58 G73 I75 F84 F129 K130 C131 L137	F58-V60 HydrophobicContact CB-CG1 4.2Å; V60-G73 PolarHBondContact N-O 3.17Å; V60-G73 PolarHBondContact O-N 3.17Å; V60-G73 VanDerWaalsContact O-O 3.13Å; V60-I75 HydrophobicContact CB-CD1 4.47Å; V60-I75 HydrophobicContact CG1-CB 4.44Å; V60-I75 HydrophobicContact CG1-CD1 4.17Å; V60-I75 HydrophobicContact CG1-CG1 4.46Å; V60-I75 HydrophobicContact CG2-CB 4.25Å; V60-I75 HydrophobicContact CG2-CD1 3.78Å; V60-I75 HydrophobicContact CG2-CG1 3.66Å; V60-F84 HydrophobicContact CG2-CD2 3.99Å; V60-F84 HydrophobicContact CG2-CE2 3.73Å; V60-F129 HydrophobicContact CB-CB 4.23Å; V60-F129 HydrophobicContact CB-CD1 4.22Å; V60-F129 HydrophobicContact CG2-CD1 3.69Å; V60-F129 HydrophobicContact CG2-CE1 4.32Å; V60-F129 HydrophobicContact CG2-CG 4.43Å; V60-K130 CarbonylContact C-O 3.54Å; V60-K130 WeakPolarHBondContact CA-O 3.43Å; V60-K130 WeakPolarHBondContact CB-O 3.45Å; V60-C131 HydrophobicContact CG1-CB 3.82Å; V60-L137 HydrophobicContact CG1-CD1 4.44Å
61	S	92.6	Very high	78	Confident	14 Å²	14	88.2 Å²	88.2	10%	0.098	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	125.2	169.7	-47.3	0	0	0	0	110.8	E69 R71 F129 K130	S61-E69 VanDerWaalsContact CB-CD 3.42Å; S61-E69 WeakPolarHBondContact CB-OE2 3.28Å; S61-E69 VanDerWaalsContact OG-CD 3.27Å; S61-E69 PolarHBondContact OG-OE2 3.24Å; S61-R71 CarbonylContact C-O 3.52Å; S61-R71 WeakPolarHBondContact CA-O 3.49Å; S61-F129 CarbonylContact O-C 3.53Å; S61-F129 WeakPolarHBondContact O-CA 2.97Å; S61-K130 PolarHBondContact N-O 3.42Å; S61-K130 PolarHBondContact O-N 2.86Å
62	L	90.5	Very high	80.1	Confident	25 Å²	25	89.6 Å²	89.6	13%	0.131	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	133.9	171.6	178.5	65.5	0	0	0	110	I70 R71 F84 F127 F129	L62-I70 HydrophobicContact CG-CD1 4.38Å; L62-I70 PolarHBondContact O-N 2.88Å; L62-R71 PolarHBondContact N-O 2.91Å; L62-R71 PolarHBondContact O-N 2.95Å; L62-F84 HydrophobicContact CB-CE1 4.24Å; L62-F84 HydrophobicContact CB-CZ 4.16Å; L62-F84 HydrophobicContact CD2-CE1 4.37Å; L62-F127 HydrophobicContact CD1-CD1 4.34Å; L62-F129 HydrophobicContact CB-CD1 4.19Å; L62-F129 HydrophobicContact CB-CE1 3.97Å; L62-F129 HydrophobicContact CD1-CD1 4.29Å; L62-F129 HydrophobicContact CD1-CE1 3.8Å; L62-F129 HydrophobicContact CD1-CE2 4.39Å; L62-F129 HydrophobicContact CD1-CZ 3.85Å; L62-F129 HydrophobicContact CG-CE1 4.45Å
63	L	80.6	Confident	82.4	Confident	19 Å²	19	80.1 Å²	80.1	10%	0.099	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	153.8	-177.8	-52.2	-176.3	0	0	0	112.5	F67 K68 E69 L111 I128 K130	L63-F67 HydrophobicContact CD1-CB 4.47Å; L63-F67 HydrophobicContact CD1-CD1 4.12Å; L63-K68 CarbonylContact C-O 3.51Å; L63-K68 WeakPolarHBondContact CA-O 3.31Å; L63-E69 HydrophobicContact CD2-CB 4.29Å; L63-L111 HydrophobicContact CD1-CD2 3.76Å; L63-I128 HydrophobicContact CB-CB 4.42Å; L63-I128 HydrophobicContact CB-CG2 4.48Å; L63-I128 HydrophobicContact CD1-CG2 4Å; L63-I128 PolarHBondContact N-O 2.78Å; L63-K130 HydrophobicContact CD1-CB 4.41Å; L63-K130 HydrophobicContact CD2-CB 4.23Å
64	D	76.8	Confident	84.4	Confident	44 Å²	44	74 Å²	74	24%	0.235	38%	0.377	C	S	.	.			trans	-89.2	-173.4	169.4	69.1	13.3	0	0	0	112.5	D66 F67 K68 I70	D64-D66 PolarHBondContact O-N 2.85Å; D64-D66 VanDerWaalsContact OD1-C 3.3Å; D64-D66 WeakPolarHBondContact OD1-CA 3.35Å; D64-D66 WeakPolarHBondContact OD1-CB 3.47Å; D64-D66 PolarHBondContact OD1-N 3Å; D64-F67 PolarHBondContact O-N 2.99Å; D64-F67 VanDerWaalsContact O-N 3.08Å; D64-F67 PolarHBondContact OD1-N 3.08Å; D64-K68 PolarHBondContact N-O 2.7Å; D64-K68 PolarHBondContact OD1-N 3.28Å; D64-I70 HydrophobicContact CB-CD1 3.72Å; D64-I70 HydrophobicContact CB-CG1 3.8Å
65	H	77.1	Confident	86.3	Confident	105 Å²	105	65.3 Å²	65.3	49%	0.486	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-22	178.7	62.9	64.5	0	0	0	113.5	R290	H65-R290 PolarHBondContact CE1-NH1 3.4Å; H65-R290 PolarHBondContact NE2-NH1 3.19Å; H65-R290 VanDerWaalsContact NE2-NH1 3.15Å
66	D	73.8	Confident	87.9	Confident	79 Å²	79	61.6 Å²	61.6	42%	0.422	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	9	174.7	-63.7	-26.5	0	0	0	111.2	D64 K68	D64-D66 PolarHBondContact O-N 2.85Å; D64-D66 VanDerWaalsContact OD1-C 3.3Å; D64-D66 WeakPolarHBondContact OD1-CA 3.35Å; D64-D66 WeakPolarHBondContact OD1-CB 3.47Å; D64-D66 PolarHBondContact OD1-N 3Å; D66-K68 HydrophobicContact CB-CD 4.26Å; D66-K68 HydrophobicContact CB-CG 4.17Å; D66-K68 PolarHBondContact O-N 3.14Å
67	F	76	Confident	88.4	Confident	126 Å²	126	58.6 Å²	58.6	55%	0.553	30%	0.298	S	S	*	.	S	Bend	trans	58.5	20.9	-173.1	-63.1	-92.2	0	0	0	114.3	L63 D64 L111 I128	L63-F67 HydrophobicContact CD1-CB 4.47Å; L63-F67 HydrophobicContact CD1-CD1 4.12Å; D64-F67 PolarHBondContact O-N 2.99Å; D64-F67 VanDerWaalsContact O-N 3.08Å; D64-F67 PolarHBondContact OD1-N 3.08Å; F67-L111 HydrophobicContact CD1-CD1 4.48Å; F67-L111 HydrophobicContact CE1-CD1 4.25Å; F67-I128 HydrophobicContact CE1-CD1 4.04Å; F67-I128 HydrophobicContact CE1-CG2 4.35Å; F67-I128 HydrophobicContact CZ-CD1 4.42Å
68	K	80.8	Confident	88	Confident	131 Å²	131	59.9 Å²	59.9	57%	0.57	29%	0.294	S	S	*	.			trans	-81.4	148.6	172.2	-63	174.1	-179.2	164.9	0	110	L63 D64 D66 I70	L63-K68 CarbonylContact C-O 3.51Å; L63-K68 WeakPolarHBondContact CA-O 3.31Å; D64-K68 PolarHBondContact N-O 2.7Å; D64-K68 PolarHBondContact OD1-N 3.28Å; D66-K68 HydrophobicContact CB-CD 4.26Å; D66-K68 HydrophobicContact CB-CG 4.17Å; D66-K68 PolarHBondContact O-N 3.14Å; K68-I70 PolarHBondContact O-N 2.82Å
69	E	86.8	Confident	87.2	Confident	88 Å²	88	62 Å²	62	41%	0.411	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	121.5	-178.9	-179.8	167.3	129.6	0	0	111.4	S61 L63 Q72	S61-E69 VanDerWaalsContact CB-CD 3.42Å; S61-E69 WeakPolarHBondContact CB-OE2 3.28Å; S61-E69 VanDerWaalsContact OG-CD 3.27Å; S61-E69 PolarHBondContact OG-OE2 3.24Å; L63-E69 HydrophobicContact CD2-CB 4.29Å; E69-Q72 WeakPolarHBondContact OE1-CG 3.41Å; E69-Q72 PolarHBondContact OE1-NE2 2.68Å
70	I	84.6	Confident	86.3	Confident	88 Å²	88	62.6 Å²	62.6	45%	0.451	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-51.3	175.6	-46.5	178.3	0	0	0	110.2	L62 D64 K68	L62-I70 HydrophobicContact CG-CD1 4.38Å; L62-I70 PolarHBondContact O-N 2.88Å; D64-I70 HydrophobicContact CB-CD1 3.72Å; D64-I70 HydrophobicContact CB-CG1 3.8Å; K68-I70 PolarHBondContact O-N 2.82Å
71	R	89.5	Confident	85.7	Confident	92 Å²	92	63.4 Å²	63.4	35%	0.347	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	134	-172.9	-66.3	-63.1	-179.1	-165.5	-3.9	112.3	S61 L62 F84 Y86 H88	S61-R71 CarbonylContact C-O 3.52Å; S61-R71 WeakPolarHBondContact CA-O 3.49Å; L62-R71 PolarHBondContact N-O 2.91Å; L62-R71 PolarHBondContact O-N 2.95Å; R71-F84 HydrophobicContact CB-CZ 4.46Å; R71-Y86 HydrophobicContact CB-CD2 4.42Å; R71-Y86 HydrophobicContact CG-CD2 4.18Å; R71-Y86 HydrophobicContact CG-CE2 4.11Å; R71-H88 PolarHBondContact NH2-CE1 3.23Å; R71-H88 PolarHBondContact NH2-ND1 3.02Å; R71-H88 VanDerWaalsContact NH2-ND1 3.14Å
72	Q	95.2	Very high	85.6	Confident	129 Å²	129	62.8 Å²	62.8	60%	0.603	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	146.7	166.7	-60.5	-171.9	-9.4	0	0	111.2	E69 Y86	E69-Q72 WeakPolarHBondContact OE1-CG 3.41Å; E69-Q72 PolarHBondContact OE1-NE2 2.68Å; Q72-Y86 WeakPolarHBondContact O-CB 2.97Å
73	G	94.7	Very high	85.5	Confident	13 Å²	13	63.6 Å²	63.6	13%	0.134	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.3	-159.5	176.3	0	0	0	0	0	113.6	V60 Q85	V60-G73 PolarHBondContact N-O 3.17Å; V60-G73 PolarHBondContact O-N 3.17Å; V60-G73 VanDerWaalsContact O-O 3.13Å; G73-Q85 CarbonylContact C-O 3.56Å; G73-Q85 WeakPolarHBondContact CA-O 3.2Å
74	L	96.4	Very high	86	Confident	76 Å²	76	62.7 Å²	62.7	40%	0.398	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	122.7	-177	-65.4	177.5	0	0	0	110	F58 F84 Q85	F58-L74 CarbonylContact O-C 3.48Å; F58-L74 WeakPolarHBondContact O-CA 3.14Å; L74-F84 WeakPolarHBondContact O-CA 3.21Å; L74-Q85 PolarHBondContact N-O 3.27Å; L74-Q85 PolarHBondContact O-N 2.87Å
75	I	96.7	Very high	86.5	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	126.4	164	-78.3	174.8	0	0	0	109	C57 F58 V60 I82 K83 F84 F112 F129 L137	C57-I75 CarbonylContact C-O 3.6Å; C57-I75 VanDerWaalsContact CA-O 3.31Å; C57-I75 WeakPolarHBondContact CA-O 3.22Å; F58-I75 PolarHBondContact N-O 3.25Å; F58-I75 PolarHBondContact O-N 2.81Å; V60-I75 HydrophobicContact CB-CD1 4.47Å; V60-I75 HydrophobicContact CG1-CB 4.44Å; V60-I75 HydrophobicContact CG1-CD1 4.17Å; V60-I75 HydrophobicContact CG1-CG1 4.46Å; V60-I75 HydrophobicContact CG2-CB 4.25Å; V60-I75 HydrophobicContact CG2-CD1 3.78Å; V60-I75 HydrophobicContact CG2-CG1 3.66Å; I75-I82 HydrophobicContact CG2-CG2 3.92Å; I75-K83 CarbonylContact C-O 3.53Å; I75-K83 VanDerWaalsContact CA-O 3.28Å; I75-K83 WeakPolarHBondContact CA-O 3.29Å; I75-F84 HydrophobicContact CG1-CB 4.25Å; I75-F84 HydrophobicContact CG1-CD2 3.94Å; I75-F112 HydrophobicContact CD1-CD1 3.99Å; I75-F112 HydrophobicContact CD1-CE1 4.02Å; I75-F129 HydrophobicContact CD1-CB 4.43Å; I75-F129 HydrophobicContact CD1-CD1 3.78Å; I75-F129 HydrophobicContact CD1-CD2 3.88Å; I75-F129 HydrophobicContact CD1-CE1 3.91Å; I75-F129 HydrophobicContact CD1-CE2 4.02Å; I75-F129 HydrophobicContact CD1-CG 3.76Å; I75-F129 HydrophobicContact CD1-CZ 4.03Å; I75-F129 HydrophobicContact CG1-CE1 4.45Å; I75-L137 HydrophobicContact CB-CD1 4.44Å; I75-L137 HydrophobicContact CD1-CD1 4.31Å; I75-L137 HydrophobicContact CG2-CD1 4.07Å; I75-L137 HydrophobicContact CG2-CG 4.44Å
76	T	93.6	Very high	86.9	Confident	14 Å²	14	60.5 Å²	60.5	9%	0.086	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	121.8	166.9	-53	0	0	0	0	108.9	R78 K83	T76-R78 HydrophobicContact CG2-CG 4Å; T76-R78 PolarHBondContact O-N 2.91Å; T76-K83 PolarHBondContact N-O 2.98Å; T76-K83 PolarHBondContact O-N 3.2Å
77	V	89.1	Confident	87.5	Confident	15 Å²	15	61.1 Å²	61.1	9%	0.091	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	106.7	169.3	-176.4	0	0	0	0	107.6	M56 F58 L137 C140 I141 R144	M56-V77 PolarHBondContact O-N 3.08Å; F58-V77 HydrophobicContact CE2-CG2 4.4Å; V77-L137 HydrophobicContact CG2-CD2 4.47Å; V77-C140 HydrophobicContact CB-CB 4.19Å; V77-C140 HydrophobicContact CG1-CB 4.28Å; V77-C140 HydrophobicContact CG2-CB 4.02Å; V77-I141 HydrophobicContact CG1-CG1 4.13Å; V77-I141 HydrophobicContact CG2-CG1 3.89Å; V77-R144 HydrophobicContact CG1-CB 4.3Å; V77-R144 HydrophobicContact CG1-CG 4.5Å
78	R	83.4	Confident	87.8	Confident	94 Å²	94	58.2 Å²	58.2	36%	0.355	28%	0.276	S	S	.	.			trans	-93.2	-172.9	-179	-61.6	-159.9	-60	164	-0.5	111	T76 Y80 D81 K83 L96 R144	T76-R78 HydrophobicContact CG2-CG 4Å; T76-R78 PolarHBondContact O-N 2.91Å; R78-Y80 VanDerWaalsContact C-N 3.33Å; R78-Y80 PolarHBondContact O-N 2.68Å; R78-D81 WeakPolarHBondContact CA-O 3.42Å; R78-D81 WeakPolarHBondContact CB-O 2.97Å; R78-D81 IonicContact CZ-OD1 3.17Å; R78-D81 IonicContact CZ-OD2 3.29Å; R78-D81 VanDerWaalsContact CZ-OD2 3.29Å; R78-D81 PolarHBondContact N-O 2.99Å; R78-D81 IonicContact NE-OD1 2.65Å; R78-D81 PolarHBondContact NE-OD1 2.98Å; R78-D81 IonicContact NE-OD2 3.46Å; R78-D81 PolarHBondContact NE-OD2 3.06Å; R78-D81 IonicContact NH2-OD1 2.92Å; R78-D81 PolarHBondContact NH2-OD1 2.74Å; R78-D81 IonicContact NH2-OD2 2.62Å; R78-D81 PolarHBondContact NH2-OD2 3.41Å; R78-K83 HydrophobicContact CG-CB 4.27Å; R78-L96 VanDerWaalsContact NH2-CD2 3.29Å; R78-R144 WeakPolarHBondContact O-CD 3.34Å; R78-R144 WeakPolarHBondContact O-CG 3.33Å
79	V	78.4	Confident	88.2	Confident	55 Å²	55	58 Å²	58	33%	0.333	28%	0.281	S	S	.	.	S	Bend	trans	-64.2	-37.4	-175.5	166.1	0	0	0	0	112.3	M49 R144	M49-V79 HydrophobicContact CE-CG1 3.94Å; V79-R144 VanDerWaalsContact C-NE 3.33Å; V79-R144 VanDerWaalsContact CA-NE 3.26Å; V79-R144 VanDerWaalsContact O-CZ 3.24Å; V79-R144 PolarHBondContact O-NE 2.81Å; V79-R144 PolarHBondContact O-NH2 2.92Å
80	Y	80	Confident	88.3	Confident	103 Å²	103	61.6 Å²	61.6	40%	0.404	30%	0.303	S	S	.	.	S	Bend	trans	-132.5	-1.1	-173.3	-62.2	-61.4	0	0	0	114	F17 M49 R78 L99 L148	F17-Y80 AromaticContact CE1-CD1 3.9Å; F17-Y80 HydrophobicContact CE1-CD1 3.9Å; F17-Y80 HydrophobicContact CE1-CG 4.16Å; F17-Y80 AromaticContact CZ-CD1 3.63Å; F17-Y80 HydrophobicContact CZ-CD1 3.63Å; F17-Y80 HydrophobicContact CZ-CE1 4.4Å; F17-Y80 HydrophobicContact CZ-CG 4.2Å; M49-Y80 HydrophobicContact CE-CE1 3.99Å; R78-Y80 VanDerWaalsContact C-N 3.33Å; R78-Y80 PolarHBondContact O-N 2.68Å; Y80-L99 PolarHBondContact O-N 2.89Å; Y80-L148 HydrophobicContact CD1-CD1 4.29Å; Y80-L148 HydrophobicContact CD1-CD2 3.54Å; Y80-L148 HydrophobicContact CE1-CD2 3.38Å
81	D	83.7	Confident	88.2	Confident	22 Å²	22	64.1 Å²	64.1	12%	0.118	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	166.5	-173.9	57.6	69.7	0	0	0	112.2	R78 W97	R78-D81 WeakPolarHBondContact CA-O 3.42Å; R78-D81 WeakPolarHBondContact CB-O 2.97Å; R78-D81 IonicContact CZ-OD1 3.17Å; R78-D81 IonicContact CZ-OD2 3.29Å; R78-D81 VanDerWaalsContact CZ-OD2 3.29Å; R78-D81 PolarHBondContact N-O 2.99Å; R78-D81 IonicContact NE-OD1 2.65Å; R78-D81 PolarHBondContact NE-OD1 2.98Å; R78-D81 IonicContact NE-OD2 3.46Å; R78-D81 PolarHBondContact NE-OD2 3.06Å; R78-D81 IonicContact NH2-OD1 2.92Å; R78-D81 PolarHBondContact NH2-OD1 2.74Å; R78-D81 IonicContact NH2-OD2 2.62Å; R78-D81 PolarHBondContact NH2-OD2 3.41Å; D81-W97 CarbonylContact C-O 3.54Å; D81-W97 WeakPolarHBondContact CA-O 3.04Å; D81-W97 WeakPolarHBondContact CB-O 3.45Å
82	I	89.2	Confident	88.2	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	126.7	164.1	-56.8	177.4	0	0	0	107.2	I75 L96 W97 L99 L102 F112 F114 I141	I75-I82 HydrophobicContact CG2-CG2 3.92Å; I82-L96 WeakPolarHBondContact O-CA 3.2Å; I82-W97 HydrophobicContact CB-CE3 4.27Å; I82-W97 HydrophobicContact CG2-CE3 4.22Å; I82-W97 PolarHBondContact N-O 3.08Å; I82-W97 PolarHBondContact O-N 2.92Å; I82-L99 HydrophobicContact CD1-CD2 4.36Å; I82-L99 HydrophobicContact CG1-CD2 3.8Å; I82-L102 HydrophobicContact CD1-CD1 3.64Å; I82-L102 HydrophobicContact CG1-CD1 4.41Å; I82-F112 HydrophobicContact CD1-CZ 4.18Å; I82-F114 HydrophobicContact CD1-CD1 4.23Å; I82-F114 HydrophobicContact CD1-CE1 4.3Å; I82-I141 HydrophobicContact CD1-CD1 3.65Å; I82-I141 HydrophobicContact CD1-CG1 4.33Å; I82-I141 HydrophobicContact CG1-CD1 4.37Å
83	K	88.3	Confident	87.7	Confident	43 Å²	43	59.5 Å²	59.5	19%	0.187	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	121.9	172.2	-179.8	-178.5	70.7	149	0	109.9	I75 T76 R78 V94 L95 L96	I75-K83 CarbonylContact C-O 3.53Å; I75-K83 VanDerWaalsContact CA-O 3.28Å; I75-K83 WeakPolarHBondContact CA-O 3.29Å; T76-K83 PolarHBondContact N-O 2.98Å; T76-K83 PolarHBondContact O-N 3.2Å; R78-K83 HydrophobicContact CG-CB 4.27Å; K83-V94 HydrophobicContact CD-CG1 3.81Å; K83-V94 HydrophobicContact CG-CG1 3.66Å; K83-L95 CarbonylContact C-O 3.49Å; K83-L95 WeakPolarHBondContact CA-O 3.42Å; K83-L96 HydrophobicContact CB-CD2 3.64Å; K83-L96 HydrophobicContact CD-CD2 4.27Å; K83-L96 HydrophobicContact CG-CD2 3.64Å
84	F	91.7	Very high	87.4	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	126.5	165.1	176.4	-121.5	0	0	0	109.7	V60 L62 R71 L74 I75 Y86 V94 L95 W97 F129	V60-F84 HydrophobicContact CG2-CD2 3.99Å; V60-F84 HydrophobicContact CG2-CE2 3.73Å; L62-F84 HydrophobicContact CB-CE1 4.24Å; L62-F84 HydrophobicContact CB-CZ 4.16Å; L62-F84 HydrophobicContact CD2-CE1 4.37Å; R71-F84 HydrophobicContact CB-CZ 4.46Å; L74-F84 WeakPolarHBondContact O-CA 3.21Å; I75-F84 HydrophobicContact CG1-CB 4.25Å; I75-F84 HydrophobicContact CG1-CD2 3.94Å; F84-Y86 AromaticContact CD1-CD1 3.84Å; F84-Y86 HydrophobicContact CD1-CD1 3.84Å; F84-Y86 HydrophobicContact CD1-CE1 4.27Å; F84-Y86 AromaticContact CE1-CD1 3.43Å; F84-Y86 HydrophobicContact CE1-CD1 3.43Å; F84-Y86 VanDerWaalsContact CE1-CD1 3.43Å; F84-Y86 AromaticContact CE1-CE1 3.97Å; F84-Y86 HydrophobicContact CE1-CE1 3.97Å; F84-Y86 HydrophobicContact CE1-CG 4.2Å; F84-Y86 HydrophobicContact CZ-CD1 4.09Å; F84-Y86 HydrophobicContact CZ-CG 4.47Å; F84-V94 WeakPolarHBondContact O-CA 3.39Å; F84-L95 HydrophobicContact CB-CB 4.46Å; F84-L95 HydrophobicContact CD1-CD1 4.18Å; F84-L95 PolarHBondContact N-O 3.5Å; F84-L95 PolarHBondContact O-N 3.47Å; F84-W97 HydrophobicContact CB-CH2 3.75Å; F84-W97 HydrophobicContact CB-CZ3 3.48Å; F84-W97 VanDerWaalsContact CB-CZ3 3.48Å; F84-W97 HydrophobicContact CD1-CH2 4.48Å; F84-F129 HydrophobicContact CD1-CE1 4.2Å; F84-F129 AromaticContact CD2-CE1 3.87Å; F84-F129 HydrophobicContact CD2-CE1 3.87Å; F84-F129 HydrophobicContact CE1-CE1 4.31Å; F84-F129 HydrophobicContact CE2-CD1 4.48Å; F84-F129 AromaticContact CE2-CE1 4Å; F84-F129 HydrophobicContact CE2-CE1 4Å; F84-F129 AromaticContact CG-CE1 3.97Å; F84-F129 HydrophobicContact CG-CE1 3.97Å; F84-F129 HydrophobicContact CG-CZ 4.4Å; F84-F129 HydrophobicContact CZ-CE1 4.22Å
85	Q	88.1	Confident	86.9	Confident	61 Å²	61	60.3 Å²	60.3	29%	0.285	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	130.8	-177.2	-179.9	176.6	-16.4	0	0	110.1	G73 L74 T92 V93 V94	G73-Q85 CarbonylContact C-O 3.56Å; G73-Q85 WeakPolarHBondContact CA-O 3.2Å; L74-Q85 PolarHBondContact N-O 3.27Å; L74-Q85 PolarHBondContact O-N 2.87Å; Q85-T92 HydrophobicContact CG-CG2 3.6Å; Q85-T92 VanDerWaalsContact NE2-CG2 3.27Å; Q85-V93 WeakPolarHBondContact CA-O 3.15Å; Q85-V94 HydrophobicContact CG-CG2 4.17Å
86	Y	84.7	Confident	86.4	Confident	41 Å²	41	63.8 Å²	63.8	16%	0.161	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	168.4	178.1	66	-84.7	0	0	0	111.1	R71 Q72 F84 H88 T92 V93 L95	R71-Y86 HydrophobicContact CB-CD2 4.42Å; R71-Y86 HydrophobicContact CG-CD2 4.18Å; R71-Y86 HydrophobicContact CG-CE2 4.11Å; Q72-Y86 WeakPolarHBondContact O-CB 2.97Å; F84-Y86 AromaticContact CD1-CD1 3.84Å; F84-Y86 HydrophobicContact CD1-CD1 3.84Å; F84-Y86 HydrophobicContact CD1-CE1 4.27Å; F84-Y86 AromaticContact CE1-CD1 3.43Å; F84-Y86 HydrophobicContact CE1-CD1 3.43Å; F84-Y86 VanDerWaalsContact CE1-CD1 3.43Å; F84-Y86 AromaticContact CE1-CE1 3.97Å; F84-Y86 HydrophobicContact CE1-CE1 3.97Å; F84-Y86 HydrophobicContact CE1-CG 4.2Å; F84-Y86 HydrophobicContact CZ-CD1 4.09Å; F84-Y86 HydrophobicContact CZ-CG 4.47Å; Y86-H88 HydrophobicContact CD2-CB 4.22Å; Y86-H88 HydrophobicContact CE2-CB 3.85Å; Y86-T92 WeakPolarHBondContact O-CA 3.04Å; Y86-V93 HydrophobicContact CD1-CB 4.13Å; Y86-V93 HydrophobicContact CD1-CG1 4.44Å; Y86-V93 HydrophobicContact CD2-CB 4.27Å; Y86-V93 HydrophobicContact CE1-CB 3.67Å; Y86-V93 HydrophobicContact CE1-CG1 3.59Å; Y86-V93 HydrophobicContact CE2-CB 3.82Å; Y86-V93 HydrophobicContact CE2-CG1 4.31Å; Y86-V93 HydrophobicContact CE2-CG2 3.95Å; Y86-V93 HydrophobicContact CG-CB 4.41Å; Y86-V93 PolarHBondContact N-O 3.49Å; Y86-V93 PolarHBondContact O-N 3.42Å; Y86-V93 WeakPolarHBondContact OH-CG1 3.04Å; Y86-L95 HydrophobicContact CE1-CD1 4.45Å; Y86-L95 HydrophobicContact CE1-CG 4.39Å
87	V	85.8	Confident	86.2	Confident	93 Å²	93	63.2 Å²	63.2	56%	0.564	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.7	132.4	176.4	-179.8	0	0	0	0	109.5	Q91	V87-Q91 CarbonylContact C-O 3.51Å; V87-Q91 WeakPolarHBondContact CA-O 3.27Å
88	H	82.3	Confident	85.8	Confident	64 Å²	64	64.1 Å²	64.1	30%	0.296	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	126	173.6	-178.5	47.5	0	0	0	109.4	R71 Y86 N90 Q91 V93	R71-H88 PolarHBondContact NH2-CE1 3.23Å; R71-H88 PolarHBondContact NH2-ND1 3.02Å; R71-H88 VanDerWaalsContact NH2-ND1 3.14Å; Y86-H88 HydrophobicContact CD2-CB 4.22Å; Y86-H88 HydrophobicContact CE2-CB 3.85Å; H88-N90 VanDerWaalsContact C-N 3.31Å; H88-N90 PolarHBondContact O-N 3.2Å; H88-Q91 PolarHBondContact N-O 2.84Å; H88-Q91 WeakPolarHBondContact O-CA 3.44Å; H88-Q91 WeakPolarHBondContact O-CB 3.38Å; H88-Q91 PolarHBondContact O-N 3.4Å; H88-V93 HydrophobicContact CB-CG2 4.11Å
89	N	90	Very high	85.8	Confident	127 Å²	127	59.8 Å²	59.8	68%	0.679	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	47.7	-178.7	-57	-12.7	0	0	0	113	Q91	N89-Q91 PolarHBondContact O-N 3.43Å
90	N	88.9	Confident	85.7	Confident	163 Å²	163	58.4 Å²	58.4	87%	0.872	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	11.4	-174.4	-64.8	-8.7	0	0	0	115.7	H88	H88-N90 VanDerWaalsContact C-N 3.31Å; H88-N90 PolarHBondContact O-N 3.2Å
91	Q	83.1	Confident	85.5	Confident	141 Å²	141	53.5 Å²	53.5	66%	0.659	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.4	142.2	175.1	-62.8	-179.3	1.7	0	0	110.8	V87 H88 N89	V87-Q91 CarbonylContact C-O 3.51Å; V87-Q91 WeakPolarHBondContact CA-O 3.27Å; H88-Q91 PolarHBondContact N-O 2.84Å; H88-Q91 WeakPolarHBondContact O-CA 3.44Å; H88-Q91 WeakPolarHBondContact O-CB 3.38Å; H88-Q91 PolarHBondContact O-N 3.4Å; N89-Q91 PolarHBondContact O-N 3.43Å
92	T	89.5	Confident	85.4	Confident	83 Å²	83	52.6 Å²	52.6	51%	0.509	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	119.7	174.7	-66.1	0	0	0	0	109.7	Q85 Y86 V94	Q85-T92 HydrophobicContact CG-CG2 3.6Å; Q85-T92 VanDerWaalsContact NE2-CG2 3.27Å; Y86-T92 WeakPolarHBondContact O-CA 3.04Å; T92-V94 HydrophobicContact CG2-CG2 4.17Å
93	V	85	Confident	84.9	Confident	42 Å²	42	57.9 Å²	57.9	26%	0.255	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	139.3	173.8	-175.5	0	0	0	0	109.7	Q85 Y86 H88 L95	Q85-V93 WeakPolarHBondContact CA-O 3.15Å; Y86-V93 HydrophobicContact CD1-CB 4.13Å; Y86-V93 HydrophobicContact CD1-CG1 4.44Å; Y86-V93 HydrophobicContact CD2-CB 4.27Å; Y86-V93 HydrophobicContact CE1-CB 3.67Å; Y86-V93 HydrophobicContact CE1-CG1 3.59Å; Y86-V93 HydrophobicContact CE2-CB 3.82Å; Y86-V93 HydrophobicContact CE2-CG1 4.31Å; Y86-V93 HydrophobicContact CE2-CG2 3.95Å; Y86-V93 HydrophobicContact CG-CB 4.41Å; Y86-V93 PolarHBondContact N-O 3.49Å; Y86-V93 PolarHBondContact O-N 3.42Å; Y86-V93 WeakPolarHBondContact OH-CG1 3.04Å; H88-V93 HydrophobicContact CB-CG2 4.11Å; V93-L95 HydrophobicContact CG1-CD2 4.43Å
94	V	87.5	Confident	84.7	Confident	68 Å²	68	57.2 Å²	57.2	41%	0.412	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	120.9	-178.4	-176.6	0	0	0	0	110.1	K83 F84 Q85 T92 L96	K83-V94 HydrophobicContact CD-CG1 3.81Å; K83-V94 HydrophobicContact CG-CG1 3.66Å; F84-V94 WeakPolarHBondContact O-CA 3.39Å; Q85-V94 HydrophobicContact CG-CG2 4.17Å; T92-V94 HydrophobicContact CG2-CG2 4.17Å; V94-L96 HydrophobicContact CG1-CD2 4Å; V94-L96 HydrophobicContact CG1-CG 4.17Å
95	L	85.8	Confident	84.3	Confident	37 Å²	37	57.4 Å²	57.4	19%	0.194	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	137.7	171.1	-54.2	-175.5	0	0	0	109.7	K83 F84 Y86 V93 W97 L122	K83-L95 CarbonylContact C-O 3.49Å; K83-L95 WeakPolarHBondContact CA-O 3.42Å; F84-L95 HydrophobicContact CB-CB 4.46Å; F84-L95 HydrophobicContact CD1-CD1 4.18Å; F84-L95 PolarHBondContact N-O 3.5Å; F84-L95 PolarHBondContact O-N 3.47Å; Y86-L95 HydrophobicContact CE1-CD1 4.45Å; Y86-L95 HydrophobicContact CE1-CG 4.39Å; V93-L95 HydrophobicContact CG1-CD2 4.43Å; L95-W97 HydrophobicContact CB-CH2 3.47Å; L95-W97 VanDerWaalsContact CB-CH2 3.47Å; L95-W97 HydrophobicContact CB-CZ2 3.86Å; L95-W97 HydrophobicContact CB-CZ3 3.88Å; L95-W97 HydrophobicContact CD1-CH2 3.88Å; L95-W97 HydrophobicContact CD1-CZ2 3.99Å; L95-W97 HydrophobicContact CG-CH2 4.32Å; L95-L122 HydrophobicContact CB-CD1 4.43Å; L95-L122 HydrophobicContact CD1-CD1 4.24Å; L95-L122 HydrophobicContact CD2-CD1 4.27Å
96	L	86.2	Confident	83.8	Confident	74 Å²	74	54.6 Å²	54.6	39%	0.387	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	128.3	-176.5	-63.5	178.7	0	0	0	110.5	R78 I82 K83 V94	R78-L96 VanDerWaalsContact NH2-CD2 3.29Å; I82-L96 WeakPolarHBondContact O-CA 3.2Å; K83-L96 HydrophobicContact CB-CD2 3.64Å; K83-L96 HydrophobicContact CD-CD2 4.27Å; K83-L96 HydrophobicContact CG-CD2 3.64Å; V94-L96 HydrophobicContact CG1-CD2 4Å; V94-L96 HydrophobicContact CG1-CG 4.17Å
97	W	88.6	Confident	83.7	Confident	1 Å²	1	55.1 Å²	55.1	0%	0.004	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	109.6	172.2	-58.4	-92.1	0	0	0	110	D81 I82 F84 L95 L99 L102 F114 L122 F127 F129	D81-W97 CarbonylContact C-O 3.54Å; D81-W97 WeakPolarHBondContact CA-O 3.04Å; D81-W97 WeakPolarHBondContact CB-O 3.45Å; I82-W97 HydrophobicContact CB-CE3 4.27Å; I82-W97 HydrophobicContact CG2-CE3 4.22Å; I82-W97 PolarHBondContact N-O 3.08Å; I82-W97 PolarHBondContact O-N 2.92Å; F84-W97 HydrophobicContact CB-CH2 3.75Å; F84-W97 HydrophobicContact CB-CZ3 3.48Å; F84-W97 VanDerWaalsContact CB-CZ3 3.48Å; F84-W97 HydrophobicContact CD1-CH2 4.48Å; L95-W97 HydrophobicContact CB-CH2 3.47Å; L95-W97 VanDerWaalsContact CB-CH2 3.47Å; L95-W97 HydrophobicContact CB-CZ2 3.86Å; L95-W97 HydrophobicContact CB-CZ3 3.88Å; L95-W97 HydrophobicContact CD1-CH2 3.88Å; L95-W97 HydrophobicContact CD1-CZ2 3.99Å; L95-W97 HydrophobicContact CG-CH2 4.32Å; W97-L99 PolarHBondContact O-N 2.91Å; W97-L102 HydrophobicContact CB-CD2 3.95Å; W97-F114 HydrophobicContact CB-CE2 4.29Å; W97-F114 HydrophobicContact CB-CZ 4.45Å; W97-F114 AromaticContact CD1-CE2 3.72Å; W97-F114 AromaticContact CD2-CE2 3.89Å; W97-F114 HydrophobicContact CD2-CE2 3.89Å; W97-F114 AromaticContact CD2-CZ 3.46Å; W97-F114 HydrophobicContact CD2-CZ 3.46Å; W97-F114 VanDerWaalsContact CD2-CZ 3.46Å; W97-F114 AromaticContact CE2-CE2 3.99Å; W97-F114 AromaticContact CE2-CZ 3.63Å; W97-F114 HydrophobicContact CE3-CE1 4.48Å; W97-F114 AromaticContact CE3-CZ 3.72Å; W97-F114 HydrophobicContact CE3-CZ 3.72Å; W97-F114 AromaticContact CG-CE2 3.73Å; W97-F114 HydrophobicContact CG-CE2 3.73Å; W97-F114 AromaticContact CG-CZ 3.8Å; W97-F114 HydrophobicContact CG-CZ 3.8Å; W97-F114 HydrophobicContact CH2-CZ 4.27Å; W97-F114 HydrophobicContact CZ2-CZ 4.06Å; W97-F114 HydrophobicContact CZ3-CZ 4.11Å; W97-F114 AromaticContact NE1-CE2 3.85Å; W97-F114 AromaticContact NE1-CZ 3.99Å; W97-L122 HydrophobicContact CZ2-CD1 3.87Å; W97-F127 AromaticContact CE2-CE2 3.95Å; W97-F127 AromaticContact CE2-CZ 3.92Å; W97-F127 AromaticContact CZ2-CD1 3.8Å; W97-F127 HydrophobicContact CZ2-CD1 3.8Å; W97-F127 HydrophobicContact CZ2-CD2 4.4Å; W97-F127 AromaticContact CZ2-CE1 3.63Å; W97-F127 HydrophobicContact CZ2-CE1 3.63Å; W97-F127 HydrophobicContact CZ2-CE2 4.24Å; W97-F127 HydrophobicContact CZ2-CG 4.19Å; W97-F127 AromaticContact CZ2-CZ 3.87Å; W97-F127 HydrophobicContact CZ2-CZ 3.87Å; W97-F127 AromaticContact NE1-CD2 3.83Å; W97-F127 AromaticContact NE1-CE2 3.23Å; W97-F127 AromaticContact NE1-CZ 3.4Å; W97-F129 HydrophobicContact CH2-CZ 4.25Å
98	P	82.4	Confident	83.4	Confident	35 Å²	35	52.3 Å²	52.3	23%	0.227	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	137	172.5	-21.8	31.8	0	0	0	111.1	H100 G101	P98-H100 WeakPolarHBondContact CB-CE1 3.47Å; P98-H100 PolarHBondContact O-N 3Å; P98-G101 WeakPolarHBondContact O-CA 3.25Å; P98-G101 PolarHBondContact O-N 2.86Å
99	L	81.9	Confident	83.4	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.01	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-61.8	-32.1	-177.4	-69.6	174.1	0	0	0	112.3	L13 Y80 I82 W97 G101 L102 I141 R144 I145 L148	L13-L99 HydrophobicContact CD1-CB 4.29Å; Y80-L99 PolarHBondContact O-N 2.89Å; I82-L99 HydrophobicContact CD1-CD2 4.36Å; I82-L99 HydrophobicContact CG1-CD2 3.8Å; W97-L99 PolarHBondContact O-N 2.91Å; L99-G101 VanDerWaalsContact C-N 3.27Å; L99-G101 PolarHBondContact O-N 3.02Å; L99-L102 HydrophobicContact CD2-CD1 4.06Å; L99-I141 HydrophobicContact CD2-CG2 4.31Å; L99-R144 HydrophobicContact CD1-CB 3.97Å; L99-R144 HydrophobicContact CD1-CG 3.42Å; L99-R144 VanDerWaalsContact CD1-CG 3.42Å; L99-I145 HydrophobicContact CB-CG1 4.36Å; L99-I145 HydrophobicContact CD1-CG1 4.39Å; L99-L148 HydrophobicContact CB-CD1 4.49Å; L99-L148 HydrophobicContact CD1-CD1 3.93Å
100	H	77	Confident	83.3	Confident	26 Å²	26	53.6 Å²	53.6	12%	0.12	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-72	-19.5	174.6	65.2	-98.7	0	0	0	113.4	L13 Q14 F17 P98 R119	L13-H100 HydrophobicContact CB-CB 3.62Å; Q14-H100 PolarHBondContact OE1-CD2 3.44Å; Q14-H100 VanDerWaalsContact OE1-CD2 3.31Å; F17-H100 AromaticContact CD1-CE1 3.67Å; F17-H100 AromaticContact CD1-ND1 3.63Å; F17-H100 HydrophobicContact CD2-CB 3.61Å; F17-H100 AromaticContact CD2-CE1 3.71Å; F17-H100 AromaticContact CD2-CG 3.39Å; F17-H100 AromaticContact CD2-ND1 2.97Å; F17-H100 WeakPolarHBondContact CD2-ND1 3.25Å; F17-H100 AromaticContact CE1-ND1 3.81Å; F17-H100 HydrophobicContact CE2-CB 3.81Å; F17-H100 AromaticContact CE2-CG 3.8Å; F17-H100 AromaticContact CE2-ND1 3.2Å; F17-H100 WeakPolarHBondContact CE2-ND1 3.27Å; F17-H100 AromaticContact CG-CE1 3.42Å; F17-H100 VanDerWaalsContact CG-CE1 3.42Å; F17-H100 WeakPolarHBondContact CG-CE1 3.43Å; F17-H100 AromaticContact CG-CG 3.88Å; F17-H100 AromaticContact CG-ND1 3.2Å; F17-H100 WeakPolarHBondContact CG-ND1 3.41Å; F17-H100 AromaticContact CZ-ND1 3.6Å; P98-H100 WeakPolarHBondContact CB-CE1 3.47Å; P98-H100 PolarHBondContact O-N 3Å; H100-R119 VanDerWaalsContact O-CZ 3.3Å; H100-R119 PolarHBondContact O-NH1 3.46Å
101	G	76.2	Confident	83.1	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-86.7	-10.2	179.4	0	0	0	0	0	113.6	P98 L99 G117 C120	P98-G101 WeakPolarHBondContact O-CA 3.25Å; P98-G101 PolarHBondContact O-N 2.86Å; L99-G101 VanDerWaalsContact C-N 3.27Å; L99-G101 PolarHBondContact O-N 3.02Å; G101-G117 PolarHBondContact O-N 3.15Å; G101-C120 PolarHBondContact O-SG 3.03Å
102	L	81	Confident	83.2	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.021	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	135.5	174.6	-54.3	-177.1	0	0	0	109.3	S10 I82 W97 L99 F114 Q115	S10-L102 WeakPolarHBondContact CB-O 3.47Å; I82-L102 HydrophobicContact CD1-CD1 3.64Å; I82-L102 HydrophobicContact CG1-CD1 4.41Å; W97-L102 HydrophobicContact CB-CD2 3.95Å; L99-L102 HydrophobicContact CD2-CD1 4.06Å; L102-F114 HydrophobicContact CD2-CD2 3.46Å; L102-F114 VanDerWaalsContact CD2-CD2 3.46Å; L102-F114 HydrophobicContact CD2-CE2 3.8Å; L102-F114 HydrophobicContact CD2-CG 4.14Å; L102-Q115 CarbonylContact C-O 3.59Å; L102-Q115 WeakPolarHBondContact CA-O 3.5Å
103	R	79.5	Confident	83.1	Confident	110 Å²	110	37.1 Å²	37.1	42%	0.415	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-54.2	170.7	-69	-177	170.3	-174.9	-0.8	109.9	N8 Q115	N8-R103 PolarHBondContact OD1-O 3.32Å; R103-Q115 HydrophobicContact CB-CB 4.38Å; R103-Q115 HydrophobicContact CB-CG 4.47Å; R103-Q115 PolarHBondContact N-O 3.2Å
104	W	82.5	Confident	83.1	Confident	29 Å²	29	35.1 Å²	35.1	11%	0.11	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	164.2	176.7	61	-93.7	0	0	0	111	L113 F114 Q115 L126	W104-L113 HydrophobicContact CH2-CD1 3.41Å; W104-L113 VanDerWaalsContact CH2-CD1 3.41Å; W104-L113 HydrophobicContact CH2-CG 4.34Å; W104-L113 HydrophobicContact CZ3-CD1 3.52Å; W104-L113 HydrophobicContact CZ3-CG 4Å; W104-F114 VanDerWaalsContact O-CA 3.29Å; W104-F114 WeakPolarHBondContact O-CA 3.35Å; W104-F114 WeakPolarHBondContact O-CB 3.38Å; W104-Q115 HydrophobicContact CD2-CB 4.14Å; W104-Q115 HydrophobicContact CG-CB 4.21Å; W104-Q115 HydrophobicContact CZ2-CB 4.11Å; W104-Q115 VanDerWaalsContact NE1-CB 3.26Å; W104-Q115 PolarHBondContact O-N 3.1Å; W104-L126 HydrophobicContact CH2-CD1 3.86Å; W104-L126 HydrophobicContact CZ2-CD1 3.85Å
105	Y	83.8	Confident	82.8	Confident	5 Å²	5	34.4 Å²	34.4	2%	0.02	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	155.1	172.1	56.5	-87	0	0	0	109.9	S6 L113 V138 I141 E142 I145	S6-Y105 PolarHBondContact N-O 3.31Å; S6-Y105 WeakPolarHBondContact OG-CE1 3.21Å; S6-Y105 VanDerWaalsContact OG-CE2 3.31Å; S6-Y105 WeakPolarHBondContact OG-CE2 3.4Å; S6-Y105 PolarHBondContact OG-OH 3.28Å; Y105-L113 CarbonylContact C-O 3.58Å; Y105-L113 WeakPolarHBondContact CA-O 3.22Å; Y105-V138 HydrophobicContact CD2-CG1 4.16Å; Y105-V138 HydrophobicContact CE2-CG1 3.99Å; Y105-I141 HydrophobicContact CD1-CG2 4.04Å; Y105-I141 HydrophobicContact CD2-CG2 4.16Å; Y105-I141 HydrophobicContact CE1-CG2 3.85Å; Y105-I141 HydrophobicContact CE2-CB 4.49Å; Y105-I141 HydrophobicContact CE2-CG2 3.96Å; Y105-I141 HydrophobicContact CG-CG2 4.2Å; Y105-E142 HydrophobicContact CE2-CG 3.87Å; Y105-E142 WeakPolarHBondContact OH-CG 3.5Å; Y105-I145 HydrophobicContact CD1-CD1 4.31Å; Y105-I145 HydrophobicContact CE1-CD1 3.44Å; Y105-I145 VanDerWaalsContact CE1-CD1 3.44Å
106	G	79.2	Confident	82.5	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.01	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	174	-175.1	0	0	0	0	0	112.9	I4 F112 L113	I4-G106 WeakPolarHBondContact O-CA 3.38Å; G106-F112 WeakPolarHBondContact O-CD2 3.49Å; G106-L113 PolarHBondContact N-O 3.4Å; G106-L113 PolarHBondContact O-N 3.35Å
107	R	82.4	Confident	82	Confident	52 Å²	52	29.2 Å²	29.2	20%	0.196	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	158.5	175.5	61.1	164.3	-174.4	75.4	5.7	113.7	I4 L111 P134 K135 V138	I4-R107 HydrophobicContact CD1-CG 3.69Å; I4-R107 VanDerWaalsContact CD1-NE 3.32Å; I4-R107 HydrophobicContact CG1-CG 3.53Å; I4-R107 PolarHBondContact N-O 3.15Å; I4-R107 PolarHBondContact O-N 3.5Å; R107-L111 CarbonylContact C-O 3.46Å; R107-L111 VanDerWaalsContact CA-O 3.25Å; R107-L111 WeakPolarHBondContact CA-O 3.32Å; R107-L111 WeakPolarHBondContact CB-O 3.49Å; R107-P134 HydrophobicContact CB-CB 3.97Å; R107-K135 VanDerWaalsContact NE-CG 3.31Å; R107-V138 HydrophobicContact CB-CG2 3.82Å; R107-V138 HydrophobicContact CG-CG2 3.91Å
108	N	79.3	Confident	81.3	Confident	35 Å²	35	33.5 Å²	33.5	19%	0.187	17%	0.169	C	C	.	.			trans	-122.2	-166.2	160.9	-159.4	-19.4	0	0	0	110	L3 S110 L111 P134	L3-N108 HydrophobicContact CD2-CB 4.27Å; N108-S110 VanDerWaalsContact C-N 3.28Å; N108-S110 PolarHBondContact O-N 3.46Å; N108-L111 HydrophobicContact CB-CB 4.3Å; N108-L111 PolarHBondContact N-O 3.46Å; N108-P134 WeakPolarHBondContact O-CG 3.49Å
109	K	81.9	Confident	80.6	Confident	156 Å²	156	35.6 Å²	35.6	68%	0.678	17%	0.172	S	C	*	.	S	Bend	trans	-57.2	-38.7	179.3	-68.1	-172.3	-177.5	172.9	0	112.5	M1 P134	M1-K109 HydrophobicContact CE-CD 3.63Å; M1-K109 HydrophobicContact CE-CG 4.3Å; M1-K109 HydrophobicContact SD-CD 4.17Å; M1-K109 WeakPolarHBondContact SD-CE 3.28Å; M1-K109 PolarHBondContact SD-NZ 2.88Å; K109-P134 WeakPolarHBondContact O-CG 3.32Å
110	S	87.1	Confident	80	Confident	62 Å²	62	35.8 Å²	35.8	43%	0.434	17%	0.173	S	C	.	.	S	Bend	trans	-128.4	0.2	-174.8	55.4	0	0	0	0	114.2	N108 K130 C131	N108-S110 VanDerWaalsContact C-N 3.28Å; N108-S110 PolarHBondContact O-N 3.46Å; S110-K130 WeakPolarHBondContact O-CA 3.24Å; S110-C131 CarbonylContact C-O 3.58Å; S110-C131 PolarHBondContact O-N 2.74Å; S110-C131 VanDerWaalsContact O-O 3.09Å
111	L	84.3	Confident	79.7	Confident	32 Å²	32	44.6 Å²	44.6	17%	0.168	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	139.4	-174.9	-59.5	179.7	0	0	0	110.9	L63 F67 R107 N108 I128 F129 K130 P134	L63-L111 HydrophobicContact CD1-CD2 3.76Å; F67-L111 HydrophobicContact CD1-CD1 4.48Å; F67-L111 HydrophobicContact CE1-CD1 4.25Å; R107-L111 CarbonylContact C-O 3.46Å; R107-L111 VanDerWaalsContact CA-O 3.25Å; R107-L111 WeakPolarHBondContact CA-O 3.32Å; R107-L111 WeakPolarHBondContact CB-O 3.49Å; N108-L111 HydrophobicContact CB-CB 4.3Å; N108-L111 PolarHBondContact N-O 3.46Å; L111-I128 HydrophobicContact CD1-CG2 4.42Å; L111-I128 HydrophobicContact CD2-CG2 4.4Å; L111-F129 CarbonylContact C-O 3.51Å; L111-F129 VanDerWaalsContact CA-O 3.31Å; L111-F129 WeakPolarHBondContact CA-O 3.48Å; L111-K130 HydrophobicContact CD2-CB 4.43Å; L111-P134 VanDerWaalsContact O-CB 3.29Å; L111-P134 WeakPolarHBondContact O-CB 3.09Å
112	F	86.8	Confident	79.5	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	137.5	162.3	164.5	-110.4	0	0	0	107.6	I75 I82 G106 F114 F129 P134 L137 V138 I141	I75-F112 HydrophobicContact CD1-CD1 3.99Å; I75-F112 HydrophobicContact CD1-CE1 4.02Å; I82-F112 HydrophobicContact CD1-CZ 4.18Å; G106-F112 WeakPolarHBondContact O-CD2 3.49Å; F112-F114 AromaticContact CE1-CD1 3.64Å; F112-F114 HydrophobicContact CE1-CD1 3.64Å; F112-F114 HydrophobicContact CE1-CE1 4.06Å; F112-F114 HydrophobicContact CZ-CB 4.49Å; F112-F114 AromaticContact CZ-CD1 3.67Å; F112-F114 HydrophobicContact CZ-CD1 3.67Å; F112-F114 HydrophobicContact CZ-CE1 4.44Å; F112-F129 HydrophobicContact CD1-CB 4.3Å; F112-F129 AromaticContact CD1-CD2 3.91Å; F112-F129 HydrophobicContact CD1-CD2 3.91Å; F112-F129 HydrophobicContact CD1-CG 4.41Å; F112-F129 HydrophobicContact CE1-CD2 4.23Å; F112-F129 PolarHBondContact N-O 3.02Å; F112-F129 WeakPolarHBondContact O-CA 3.42Å; F112-F129 PolarHBondContact O-N 3.01Å; F112-P134 HydrophobicContact CB-CB 4.23Å; F112-L137 HydrophobicContact CB-CD1 4.21Å; F112-L137 HydrophobicContact CD1-CD1 3.76Å; F112-L137 HydrophobicContact CD1-CD2 3.77Å; F112-L137 HydrophobicContact CD1-CG 4.43Å; F112-L137 HydrophobicContact CD2-CD2 3.59Å; F112-L137 HydrophobicContact CE1-CD1 4.3Å; F112-L137 HydrophobicContact CE1-CD2 3.66Å; F112-L137 HydrophobicContact CE2-CD2 3.48Å; F112-L137 VanDerWaalsContact CE2-CD2 3.48Å; F112-L137 HydrophobicContact CG-CD1 3.89Å; F112-L137 HydrophobicContact CG-CD2 3.73Å; F112-L137 HydrophobicContact CG-CG 4.37Å; F112-L137 HydrophobicContact CZ-CD2 3.52Å; F112-V138 HydrophobicContact CD2-CG2 3.86Å; F112-V138 HydrophobicContact CE2-CG2 4.17Å; F112-I141 HydrophobicContact CE1-CD1 4.42Å; F112-I141 HydrophobicContact CE2-CD1 3.52Å; F112-I141 HydrophobicContact CZ-CD1 3.36Å
113	L	87.5	Confident	79.1	Confident	8 Å²	8	49.5 Å²	49.5	4%	0.042	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	156.5	179.3	61.3	152.2	0	0	0	111.4	L3 W104 Y105 G106 L126 F127 I128	L3-L113 HydrophobicContact CD2-CD2 3.93Å; W104-L113 HydrophobicContact CH2-CD1 3.41Å; W104-L113 VanDerWaalsContact CH2-CD1 3.41Å; W104-L113 HydrophobicContact CH2-CG 4.34Å; W104-L113 HydrophobicContact CZ3-CD1 3.52Å; W104-L113 HydrophobicContact CZ3-CG 4Å; Y105-L113 CarbonylContact C-O 3.58Å; Y105-L113 WeakPolarHBondContact CA-O 3.22Å; G106-L113 PolarHBondContact N-O 3.4Å; G106-L113 PolarHBondContact O-N 3.35Å; L113-L126 HydrophobicContact CD1-CD1 4.2Å; L113-F127 CarbonylContact C-O 3.57Å; L113-F127 WeakPolarHBondContact CA-O 3.31Å; L113-F127 WeakPolarHBondContact CB-O 3.3Å; L113-I128 HydrophobicContact CB-CB 4.5Å; L113-I128 HydrophobicContact CB-CG1 4.2Å
114	F	84.9	Confident	79	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	154.6	171	65.5	-95	0	0	0	111.2	I82 W97 L102 W104 F112 F127 F129	I82-F114 HydrophobicContact CD1-CD1 4.23Å; I82-F114 HydrophobicContact CD1-CE1 4.3Å; W97-F114 HydrophobicContact CB-CE2 4.29Å; W97-F114 HydrophobicContact CB-CZ 4.45Å; W97-F114 AromaticContact CD1-CE2 3.72Å; W97-F114 AromaticContact CD2-CE2 3.89Å; W97-F114 HydrophobicContact CD2-CE2 3.89Å; W97-F114 AromaticContact CD2-CZ 3.46Å; W97-F114 HydrophobicContact CD2-CZ 3.46Å; W97-F114 VanDerWaalsContact CD2-CZ 3.46Å; W97-F114 AromaticContact CE2-CE2 3.99Å; W97-F114 AromaticContact CE2-CZ 3.63Å; W97-F114 HydrophobicContact CE3-CE1 4.48Å; W97-F114 AromaticContact CE3-CZ 3.72Å; W97-F114 HydrophobicContact CE3-CZ 3.72Å; W97-F114 AromaticContact CG-CE2 3.73Å; W97-F114 HydrophobicContact CG-CE2 3.73Å; W97-F114 AromaticContact CG-CZ 3.8Å; W97-F114 HydrophobicContact CG-CZ 3.8Å; W97-F114 HydrophobicContact CH2-CZ 4.27Å; W97-F114 HydrophobicContact CZ2-CZ 4.06Å; W97-F114 HydrophobicContact CZ3-CZ 4.11Å; W97-F114 AromaticContact NE1-CE2 3.85Å; W97-F114 AromaticContact NE1-CZ 3.99Å; L102-F114 HydrophobicContact CD2-CD2 3.46Å; L102-F114 VanDerWaalsContact CD2-CD2 3.46Å; L102-F114 HydrophobicContact CD2-CE2 3.8Å; L102-F114 HydrophobicContact CD2-CG 4.14Å; W104-F114 VanDerWaalsContact O-CA 3.29Å; W104-F114 WeakPolarHBondContact O-CA 3.35Å; W104-F114 WeakPolarHBondContact O-CB 3.38Å; F112-F114 AromaticContact CE1-CD1 3.64Å; F112-F114 HydrophobicContact CE1-CD1 3.64Å; F112-F114 HydrophobicContact CE1-CE1 4.06Å; F112-F114 HydrophobicContact CZ-CB 4.49Å; F112-F114 AromaticContact CZ-CD1 3.67Å; F112-F114 HydrophobicContact CZ-CD1 3.67Å; F112-F114 HydrophobicContact CZ-CE1 4.44Å; F114-F127 HydrophobicContact CD1-CB 4.37Å; F114-F127 HydrophobicContact CD2-CB 4.44Å; F114-F127 HydrophobicContact CD2-CD2 4.02Å; F114-F127 HydrophobicContact CE1-CB 3.95Å; F114-F127 HydrophobicContact CE2-CB 4.02Å; F114-F127 AromaticContact CE2-CD2 3.33Å; F114-F127 HydrophobicContact CE2-CD2 3.33Å; F114-F127 HydrophobicContact CE2-CE2 4.07Å; F114-F127 AromaticContact CE2-CG 3.92Å; F114-F127 HydrophobicContact CE2-CG 3.92Å; F114-F127 HydrophobicContact CZ-CB 3.74Å; F114-F127 AromaticContact CZ-CD2 3.73Å; F114-F127 HydrophobicContact CZ-CD2 3.73Å; F114-F127 AromaticContact CZ-CG 3.83Å; F114-F127 HydrophobicContact CZ-CG 3.83Å; F114-F127 PolarHBondContact N-O 2.94Å; F114-F127 PolarHBondContact O-N 3.31Å; F114-F129 HydrophobicContact CD1-CE2 4.3Å; F114-F129 HydrophobicContact CE1-CD2 4.39Å; F114-F129 AromaticContact CE1-CE2 3.58Å; F114-F129 HydrophobicContact CE1-CE2 3.58Å; F114-F129 HydrophobicContact CE1-CZ 4.4Å; F114-F129 HydrophobicContact CZ-CE2 4.28Å
115	Q	81.6	Confident	78.7	Confident	54 Å²	54	48.2 Å²	48.2	25%	0.252	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.1	169.5	-171.6	-176.5	43.3	0	0	109.6	L102 R103 W104 A125	L102-Q115 CarbonylContact C-O 3.59Å; L102-Q115 WeakPolarHBondContact CA-O 3.5Å; R103-Q115 HydrophobicContact CB-CB 4.38Å; R103-Q115 HydrophobicContact CB-CG 4.47Å; R103-Q115 PolarHBondContact N-O 3.2Å; W104-Q115 HydrophobicContact CD2-CB 4.14Å; W104-Q115 HydrophobicContact CG-CB 4.21Å; W104-Q115 HydrophobicContact CZ2-CB 4.11Å; W104-Q115 VanDerWaalsContact NE1-CB 3.26Å; W104-Q115 PolarHBondContact O-N 3.1Å; Q115-A125 CarbonylContact C-O 3.56Å; Q115-A125 VanDerWaalsContact CA-O 3.31Å; Q115-A125 WeakPolarHBondContact CA-O 3.09Å
116	S	79.1	Confident	78.6	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	152.3	167.6	59.5	0	0	0	0	110.9	G123 P124 A125 F127	S116-G123 WeakPolarHBondContact CB-O 3.27Å; S116-G123 PolarHBondContact OG-O 2.87Å; S116-P124 VanDerWaalsContact O-CA 3.24Å; S116-P124 WeakPolarHBondContact O-CA 3.34Å; S116-A125 PolarHBondContact N-O 3.06Å; S116-A125 PolarHBondContact O-N 2.96Å; S116-A125 PolarHBondContact OG-N 3.48Å; S116-A125 PolarHBondContact OG-O 3.02Å; S116-F127 WeakPolarHBondContact OG-CE2 3.4Å
117	G	74.4	Confident	78.9	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.01	28%	0.275	C	S	.	.			trans	-99.2	180	168.4	0	0	0	0	0	112.6	G101 R119 C120 G123	G101-G117 PolarHBondContact O-N 3.15Å; G117-R119 PolarHBondContact O-N 3.18Å; G117-C120 PolarHBondContact O-N 2.71Å; G117-G123 CarbonylContact O-C 3.37Å
118	S	74.5	Confident	79.1	Confident	92 Å²	92	51.1 Å²	51.1	64%	0.643	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-17	175	49.8	0	0	0	0	114.7	C120	S118-C120 VanDerWaalsContact C-N 3.31Å
119	R	68.1	Low	79.7	Confident	79 Å²	79	49.4 Å²	49.4	30%	0.298	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-19.1	175.5	-64.1	175.5	-78.4	-165.1	-14	113.3	S10 D11 H100 G117	S10-R119 PolarHBondContact O-NH1 2.98Å; S10-R119 PolarHBondContact OG-NH2 3.05Å; D11-R119 IonicContact OD1-NH1 2.9Å; D11-R119 IonicContact OD1-NH2 3.88Å; D11-R119 PolarHBondContact OD1-NH2 2.84Å; H100-R119 VanDerWaalsContact O-CZ 3.3Å; H100-R119 PolarHBondContact O-NH1 3.46Å; G117-R119 PolarHBondContact O-N 3.18Å
120	C	68.6	Low	80.1	Confident	5 Å²	5	47.6 Å²	47.6	3%	0.034	26%	0.255	C	S	.	.	S	Bend	trans	-78.8	144.4	174.4	-66.9	0	0	0	0	110.2	G101 G117 S118 L122 G123	G101-C120 PolarHBondContact O-SG 3.03Å; G117-C120 PolarHBondContact O-N 2.71Å; S118-C120 VanDerWaalsContact C-N 3.31Å; C120-L122 PolarHBondContact O-N 3.11Å; C120-L122 VanDerWaalsContact O-N 3.16Å; C120-G123 WeakPolarHBondContact O-CA 3.38Å; C120-G123 PolarHBondContact O-N 2.74Å
121	K	71.5	Confident	80.2	Confident	211 Å²	211	45 Å²	45	92%	0.917	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-30.6	178.6	-68.3	-171.8	177.2	-172.7	0	113.7	G123	K121-G123 PolarHBondContact O-N 3.29Å
122	L	72.3	Confident	80.7	Confident	90 Å²	90	52 Å²	52	47%	0.471	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	3.1	175.9	-62.2	177.2	0	0	0	113	L95 W97 C120 F127	L95-L122 HydrophobicContact CB-CD1 4.43Å; L95-L122 HydrophobicContact CD1-CD1 4.24Å; L95-L122 HydrophobicContact CD2-CD1 4.27Å; W97-L122 HydrophobicContact CZ2-CD1 3.87Å; C120-L122 PolarHBondContact O-N 3.11Å; C120-L122 VanDerWaalsContact O-N 3.16Å; L122-F127 HydrophobicContact CB-CZ 4.45Å; L122-F127 HydrophobicContact CD1-CE1 4.46Å; L122-F127 HydrophobicContact CD1-CZ 4.09Å
123	G	71.9	Confident	81.1	Confident	18 Å²	18	56.5 Å²	56.5	19%	0.186	29%	0.287	C	S	.	.			trans	72.2	-171	-176.9	0	0	0	0	0	114.1	S116 G117 C120 K121	S116-G123 WeakPolarHBondContact CB-O 3.27Å; S116-G123 PolarHBondContact OG-O 2.87Å; G117-G123 CarbonylContact O-C 3.37Å; C120-G123 WeakPolarHBondContact O-CA 3.38Å; C120-G123 PolarHBondContact O-N 2.74Å; K121-G123 PolarHBondContact O-N 3.29Å
124	P	76.9	Confident	81	Confident	75 Å²	75	56.4 Å²	56.4	49%	0.487	29%	0.286	S	S	.	.	S	Bend	trans	-76	122.6	177.7	30.9	-31.2	0	0	0	111.2	S116	S116-P124 VanDerWaalsContact O-CA 3.24Å; S116-P124 WeakPolarHBondContact O-CA 3.34Å
125	A	77.8	Confident	81.1	Confident	36 Å²	36	63.1 Å²	63.1	30%	0.298	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	160.8	-179.4	0	0	0	0	0	111.5	Q115 S116 F127	Q115-A125 CarbonylContact C-O 3.56Å; Q115-A125 VanDerWaalsContact CA-O 3.31Å; Q115-A125 WeakPolarHBondContact CA-O 3.09Å; S116-A125 PolarHBondContact N-O 3.06Å; S116-A125 PolarHBondContact O-N 2.96Å; S116-A125 PolarHBondContact OG-N 3.48Å; S116-A125 PolarHBondContact OG-O 3.02Å; A125-F127 HydrophobicContact CB-CD2 4.42Å; A125-F127 HydrophobicContact CB-CE2 3.69Å; A125-F127 HydrophobicContact CB-CZ 3.9Å
126	L	81.3	Confident	81.6	Confident	68 Å²	68	67.3 Å²	67.3	36%	0.356	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	123.5	171.9	179.9	62.7	0	0	0	109.7	W104 L113 I128 Y223	W104-L126 HydrophobicContact CH2-CD1 3.86Å; W104-L126 HydrophobicContact CZ2-CD1 3.85Å; L113-L126 HydrophobicContact CD1-CD1 4.2Å; L126-I128 HydrophobicContact CD2-CD1 4.09Å; L126-I128 HydrophobicContact CD2-CG1 4.35Å; L126-I128 HydrophobicContact CG-CD1 4.35Å; L126-I128 HydrophobicContact CG-CG1 4.08Å; L126-Y223 HydrophobicContact CD2-CE1 4.34Å
127	F	85	Confident	82.1	Confident	27 Å²	27	67.3 Å²	67.3	12%	0.118	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	125.8	176.7	-62.6	-87.8	0	0	0	110.3	L62 W97 L113 F114 S116 L122 A125 F129	L62-F127 HydrophobicContact CD1-CD1 4.34Å; W97-F127 AromaticContact CE2-CE2 3.95Å; W97-F127 AromaticContact CE2-CZ 3.92Å; W97-F127 AromaticContact CZ2-CD1 3.8Å; W97-F127 HydrophobicContact CZ2-CD1 3.8Å; W97-F127 HydrophobicContact CZ2-CD2 4.4Å; W97-F127 AromaticContact CZ2-CE1 3.63Å; W97-F127 HydrophobicContact CZ2-CE1 3.63Å; W97-F127 HydrophobicContact CZ2-CE2 4.24Å; W97-F127 HydrophobicContact CZ2-CG 4.19Å; W97-F127 AromaticContact CZ2-CZ 3.87Å; W97-F127 HydrophobicContact CZ2-CZ 3.87Å; W97-F127 AromaticContact NE1-CD2 3.83Å; W97-F127 AromaticContact NE1-CE2 3.23Å; W97-F127 AromaticContact NE1-CZ 3.4Å; L113-F127 CarbonylContact C-O 3.57Å; L113-F127 WeakPolarHBondContact CA-O 3.31Å; L113-F127 WeakPolarHBondContact CB-O 3.3Å; F114-F127 HydrophobicContact CD1-CB 4.37Å; F114-F127 HydrophobicContact CD2-CB 4.44Å; F114-F127 HydrophobicContact CD2-CD2 4.02Å; F114-F127 HydrophobicContact CE1-CB 3.95Å; F114-F127 HydrophobicContact CE2-CB 4.02Å; F114-F127 AromaticContact CE2-CD2 3.33Å; F114-F127 HydrophobicContact CE2-CD2 3.33Å; F114-F127 HydrophobicContact CE2-CE2 4.07Å; F114-F127 AromaticContact CE2-CG 3.92Å; F114-F127 HydrophobicContact CE2-CG 3.92Å; F114-F127 HydrophobicContact CZ-CB 3.74Å; F114-F127 AromaticContact CZ-CD2 3.73Å; F114-F127 HydrophobicContact CZ-CD2 3.73Å; F114-F127 AromaticContact CZ-CG 3.83Å; F114-F127 HydrophobicContact CZ-CG 3.83Å; F114-F127 PolarHBondContact N-O 2.94Å; F114-F127 PolarHBondContact O-N 3.31Å; S116-F127 WeakPolarHBondContact OG-CE2 3.4Å; L122-F127 HydrophobicContact CB-CZ 4.45Å; L122-F127 HydrophobicContact CD1-CE1 4.46Å; L122-F127 HydrophobicContact CD1-CZ 4.09Å; A125-F127 HydrophobicContact CB-CD2 4.42Å; A125-F127 HydrophobicContact CB-CE2 3.69Å; A125-F127 HydrophobicContact CB-CZ 3.9Å; F127-F129 HydrophobicContact CB-CE2 3.7Å; F127-F129 HydrophobicContact CB-CZ 4.34Å
128	I	86.4	Confident	82.7	Confident	24 Å²	24	67.5 Å²	67.5	12%	0.123	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.4	-177.6	-52.1	176.1	0	0	0	108.9	L63 F67 L111 L113 L126	L63-I128 HydrophobicContact CB-CB 4.42Å; L63-I128 HydrophobicContact CB-CG2 4.48Å; L63-I128 HydrophobicContact CD1-CG2 4Å; L63-I128 PolarHBondContact N-O 2.78Å; F67-I128 HydrophobicContact CE1-CD1 4.04Å; F67-I128 HydrophobicContact CE1-CG2 4.35Å; F67-I128 HydrophobicContact CZ-CD1 4.42Å; L111-I128 HydrophobicContact CD1-CG2 4.42Å; L111-I128 HydrophobicContact CD2-CG2 4.4Å; L113-I128 HydrophobicContact CB-CB 4.5Å; L113-I128 HydrophobicContact CB-CG1 4.2Å; L126-I128 HydrophobicContact CD2-CD1 4.09Å; L126-I128 HydrophobicContact CD2-CG1 4.35Å; L126-I128 HydrophobicContact CG-CD1 4.35Å; L126-I128 HydrophobicContact CG-CG1 4.08Å
129	F	91.2	Very high	83.2	Confident	0 Å²	0	65 Å²	65	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	128.7	-178.6	-63.5	-89.8	0	0	0	111.4	V60 S61 L62 I75 F84 W97 L111 F112 F114 F127	V60-F129 HydrophobicContact CB-CB 4.23Å; V60-F129 HydrophobicContact CB-CD1 4.22Å; V60-F129 HydrophobicContact CG2-CD1 3.69Å; V60-F129 HydrophobicContact CG2-CE1 4.32Å; V60-F129 HydrophobicContact CG2-CG 4.43Å; S61-F129 CarbonylContact O-C 3.53Å; S61-F129 WeakPolarHBondContact O-CA 2.97Å; L62-F129 HydrophobicContact CB-CD1 4.19Å; L62-F129 HydrophobicContact CB-CE1 3.97Å; L62-F129 HydrophobicContact CD1-CD1 4.29Å; L62-F129 HydrophobicContact CD1-CE1 3.8Å; L62-F129 HydrophobicContact CD1-CE2 4.39Å; L62-F129 HydrophobicContact CD1-CZ 3.85Å; L62-F129 HydrophobicContact CG-CE1 4.45Å; I75-F129 HydrophobicContact CD1-CB 4.43Å; I75-F129 HydrophobicContact CD1-CD1 3.78Å; I75-F129 HydrophobicContact CD1-CD2 3.88Å; I75-F129 HydrophobicContact CD1-CE1 3.91Å; I75-F129 HydrophobicContact CD1-CE2 4.02Å; I75-F129 HydrophobicContact CD1-CG 3.76Å; I75-F129 HydrophobicContact CD1-CZ 4.03Å; I75-F129 HydrophobicContact CG1-CE1 4.45Å; F84-F129 HydrophobicContact CD1-CE1 4.2Å; F84-F129 AromaticContact CD2-CE1 3.87Å; F84-F129 HydrophobicContact CD2-CE1 3.87Å; F84-F129 HydrophobicContact CE1-CE1 4.31Å; F84-F129 HydrophobicContact CE2-CD1 4.48Å; F84-F129 AromaticContact CE2-CE1 4Å; F84-F129 HydrophobicContact CE2-CE1 4Å; F84-F129 AromaticContact CG-CE1 3.97Å; F84-F129 HydrophobicContact CG-CE1 3.97Å; F84-F129 HydrophobicContact CG-CZ 4.4Å; F84-F129 HydrophobicContact CZ-CE1 4.22Å; W97-F129 HydrophobicContact CH2-CZ 4.25Å; L111-F129 CarbonylContact C-O 3.51Å; L111-F129 VanDerWaalsContact CA-O 3.31Å; L111-F129 WeakPolarHBondContact CA-O 3.48Å; F112-F129 HydrophobicContact CD1-CB 4.3Å; F112-F129 AromaticContact CD1-CD2 3.91Å; F112-F129 HydrophobicContact CD1-CD2 3.91Å; F112-F129 HydrophobicContact CD1-CG 4.41Å; F112-F129 HydrophobicContact CE1-CD2 4.23Å; F112-F129 PolarHBondContact N-O 3.02Å; F112-F129 WeakPolarHBondContact O-CA 3.42Å; F112-F129 PolarHBondContact O-N 3.01Å; F114-F129 HydrophobicContact CD1-CE2 4.3Å; F114-F129 HydrophobicContact CE1-CD2 4.39Å; F114-F129 AromaticContact CE1-CE2 3.58Å; F114-F129 HydrophobicContact CE1-CE2 3.58Å; F114-F129 HydrophobicContact CE1-CZ 4.4Å; F114-F129 HydrophobicContact CZ-CE2 4.28Å; F127-F129 HydrophobicContact CB-CE2 3.7Å; F127-F129 HydrophobicContact CB-CZ 4.34Å
130	K	90	Very high	84.3	Confident	117 Å²	117	61.9 Å²	61.9	51%	0.509	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	127.5	161.6	-171.2	177.2	179.4	179.4	0	109.1	V60 S61 L63 S110 L111	V60-K130 CarbonylContact C-O 3.54Å; V60-K130 WeakPolarHBondContact CA-O 3.43Å; V60-K130 WeakPolarHBondContact CB-O 3.45Å; S61-K130 PolarHBondContact N-O 3.42Å; S61-K130 PolarHBondContact O-N 2.86Å; L63-K130 HydrophobicContact CD1-CB 4.41Å; L63-K130 HydrophobicContact CD2-CB 4.23Å; S110-K130 WeakPolarHBondContact O-CA 3.24Å; L111-K130 HydrophobicContact CD2-CB 4.43Å
131	C	90.7	Very high	85.1	Confident	8 Å²	8	61.7 Å²	61.7	5%	0.054	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	141	-176.9	-175.8	0	0	0	0	110.7	V60 S110 H133 P134	V60-C131 HydrophobicContact CG1-CB 3.82Å; S110-C131 CarbonylContact C-O 3.58Å; S110-C131 PolarHBondContact O-N 2.74Å; S110-C131 VanDerWaalsContact O-O 3.09Å; C131-H133 VanDerWaalsContact C-N 3.32Å; C131-H133 PolarHBondContact SG-N 3.41Å; C131-P134 HydrophobicContact CB-CB 4.46Å; C131-P134 WeakPolarHBondContact O-CD 3.46Å
132	K	94.7	Very high	85.7	Confident	180 Å²	180	54.8 Å²	54.8	78%	0.783	27%	0.272	S	S	*	.	S	Bend	trans	-72.2	-25	174.1	-67.1	-175.3	179.7	179.8	0	113.2	P134	K132-P134 VanDerWaalsContact C-CD 3.49Å
133	H	94.2	Very high	86.3	Confident	94 Å²	94	57 Å²	57	44%	0.435	28%	0.278	S	S	.	.			trans	-132.9	53.3	-172.7	-56	-52.8	0	0	0	113.5	F58 C131 K135 R136 L137	F58-H133 HydrophobicContact CD1-CB 4.42Å; F58-H133 HydrophobicContact CE1-CB 4.48Å; C131-H133 VanDerWaalsContact C-N 3.32Å; C131-H133 PolarHBondContact SG-N 3.41Å; H133-K135 VanDerWaalsContact C-N 3.26Å; H133-K135 PolarHBondContact O-N 3.04Å; H133-R136 HydrophobicContact CB-CB 4.18Å; H133-R136 HydrophobicContact CB-CG 4.44Å; H133-R136 PolarHBondContact O-N 3.39Å; H133-L137 PolarHBondContact O-N 3.24Å; H133-L137 VanDerWaalsContact O-N 3.08Å
134	P	85.9	Confident	86.6	Confident	5 Å²	5	57.5 Å²	57.5	3%	0.032	27%	0.274	C	S	.	.	H	α-helix	trans	-64.2	-32.4	-174.1	28.5	-35.9	0	0	0	112.3	R107 N108 K109 L111 F112 C131 K132 R136 L137 V138	R107-P134 HydrophobicContact CB-CB 3.97Å; N108-P134 WeakPolarHBondContact O-CG 3.49Å; K109-P134 WeakPolarHBondContact O-CG 3.32Å; L111-P134 VanDerWaalsContact O-CB 3.29Å; L111-P134 WeakPolarHBondContact O-CB 3.09Å; F112-P134 HydrophobicContact CB-CB 4.23Å; C131-P134 HydrophobicContact CB-CB 4.46Å; C131-P134 WeakPolarHBondContact O-CD 3.46Å; K132-P134 VanDerWaalsContact C-CD 3.49Å; P134-R136 PolarHBondContact O-N 2.83Å; P134-L137 PolarHBondContact O-N 3.39Å; P134-V138 WeakPolarHBondContact O-CG2 3.38Å; P134-V138 PolarHBondContact O-N 3.4Å
135	K	87.6	Confident	86.8	Confident	142 Å²	142	54.1 Å²	54.1	62%	0.617	25%	0.252	S	S	*	.	H	α-helix	trans	-54	-47.7	170.6	-82.3	177.8	178.9	-173.3	0	112.8	R107 H133 S139	R107-K135 VanDerWaalsContact NE-CG 3.31Å; H133-K135 VanDerWaalsContact C-N 3.26Å; H133-K135 PolarHBondContact O-N 3.04Å; K135-S139 WeakPolarHBondContact O-CB 3.44Å; K135-S139 PolarHBondContact O-N 2.82Å; K135-S139 VanDerWaalsContact O-N 3.13Å
136	R	91.2	Very high	86.8	Confident	141 Å²	141	56 Å²	56	53%	0.532	26%	0.257	S	S	.	.	H	α-helix	trans	-69.6	-41.9	-179.8	-70.2	177.4	64.4	-172.9	1.7	110.6	F58 H133 P134 S139 C140	F58-R136 HydrophobicContact CE1-CB 3.87Å; F58-R136 HydrophobicContact CZ-CB 4.31Å; H133-R136 HydrophobicContact CB-CB 4.18Å; H133-R136 HydrophobicContact CB-CG 4.44Å; H133-R136 PolarHBondContact O-N 3.39Å; P134-R136 PolarHBondContact O-N 2.83Å; R136-S139 PolarHBondContact O-N 2.71Å; R136-C140 PolarHBondContact O-N 2.91Å; R136-C140 PolarHBondContact O-SG 3.17Å
137	L	90.4	Very high	86.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.9	-50.6	179.1	-165.3	167.5	0	0	0	111.2	F58 V60 I75 V77 F112 H133 P134 S139 C140 I141	F58-L137 HydrophobicContact CB-CD1 4.17Å; F58-L137 HydrophobicContact CD1-CB 4.19Å; F58-L137 HydrophobicContact CD2-CB 4.29Å; F58-L137 HydrophobicContact CD2-CD1 4.18Å; F58-L137 HydrophobicContact CD2-CG 3.91Å; F58-L137 HydrophobicContact CE1-CB 4.08Å; F58-L137 HydrophobicContact CE2-CB 4.19Å; F58-L137 HydrophobicContact CE2-CG 4.08Å; F58-L137 HydrophobicContact CG-CB 4.3Å; F58-L137 HydrophobicContact CG-CD1 4.07Å; F58-L137 HydrophobicContact CG-CG 4.17Å; F58-L137 HydrophobicContact CZ-CB 4.08Å; F58-L137 HydrophobicContact CZ-CG 4.49Å; V60-L137 HydrophobicContact CG1-CD1 4.44Å; I75-L137 HydrophobicContact CB-CD1 4.44Å; I75-L137 HydrophobicContact CD1-CD1 4.31Å; I75-L137 HydrophobicContact CG2-CD1 4.07Å; I75-L137 HydrophobicContact CG2-CG 4.44Å; V77-L137 HydrophobicContact CG2-CD2 4.47Å; F112-L137 HydrophobicContact CB-CD1 4.21Å; F112-L137 HydrophobicContact CD1-CD1 3.76Å; F112-L137 HydrophobicContact CD1-CD2 3.77Å; F112-L137 HydrophobicContact CD1-CG 4.43Å; F112-L137 HydrophobicContact CD2-CD2 3.59Å; F112-L137 HydrophobicContact CE1-CD1 4.3Å; F112-L137 HydrophobicContact CE1-CD2 3.66Å; F112-L137 HydrophobicContact CE2-CD2 3.48Å; F112-L137 VanDerWaalsContact CE2-CD2 3.48Å; F112-L137 HydrophobicContact CG-CD1 3.89Å; F112-L137 HydrophobicContact CG-CD2 3.73Å; F112-L137 HydrophobicContact CG-CG 4.37Å; F112-L137 HydrophobicContact CZ-CD2 3.52Å; H133-L137 PolarHBondContact O-N 3.24Å; H133-L137 VanDerWaalsContact O-N 3.08Å; P134-L137 PolarHBondContact O-N 3.39Å; L137-S139 PolarHBondContact O-N 3.03Å; L137-C140 VanDerWaalsContact O-CB 3.31Å; L137-C140 WeakPolarHBondContact O-CB 3.24Å; L137-C140 PolarHBondContact O-N 3.17Å; L137-I141 HydrophobicContact CD2-CD1 3.44Å; L137-I141 VanDerWaalsContact CD2-CD1 3.44Å; L137-I141 HydrophobicContact CD2-CG1 4.15Å; L137-I141 PolarHBondContact O-N 2.96Å; L137-I141 VanDerWaalsContact O-N 3.1Å
138	V	86.1	Confident	86	Confident	5 Å²	5	52.3 Å²	52.3	3%	0.03	24%	0.24	C	C	.	.	H	α-helix	trans	-58.8	-45.4	175.8	169.8	0	0	0	0	111.5	Y105 R107 F112 P134 C140 I141 E142	Y105-V138 HydrophobicContact CD2-CG1 4.16Å; Y105-V138 HydrophobicContact CE2-CG1 3.99Å; R107-V138 HydrophobicContact CB-CG2 3.82Å; R107-V138 HydrophobicContact CG-CG2 3.91Å; F112-V138 HydrophobicContact CD2-CG2 3.86Å; F112-V138 HydrophobicContact CE2-CG2 4.17Å; P134-V138 WeakPolarHBondContact O-CG2 3.38Å; P134-V138 PolarHBondContact O-N 3.4Å; V138-C140 PolarHBondContact O-N 2.8Å; V138-I141 PolarHBondContact O-N 2.85Å; V138-E142 HydrophobicContact CG1-CG 4.22Å; V138-E142 WeakPolarHBondContact CG1-OE1 3.11Å; V138-E142 WeakPolarHBondContact O-CG 3.31Å; V138-E142 PolarHBondContact O-N 3.2Å
139	S	86.3	Confident	85.3	Confident	41 Å²	41	51.8 Å²	51.8	29%	0.287	24%	0.238	S	C	.	.	H	α-helix	trans	-59.7	-32.3	176.4	-174.8	0	0	0	0	113	K135 R136 L137 K143	K135-S139 WeakPolarHBondContact O-CB 3.44Å; K135-S139 PolarHBondContact O-N 2.82Å; K135-S139 VanDerWaalsContact O-N 3.13Å; R136-S139 PolarHBondContact O-N 2.71Å; L137-S139 PolarHBondContact O-N 3.03Å; S139-K143 WeakPolarHBondContact O-CB 3.41Å; S139-K143 VanDerWaalsContact O-CG 3.24Å; S139-K143 WeakPolarHBondContact O-CG 3.36Å; S139-K143 PolarHBondContact O-N 3.48Å
140	C	89.4	Confident	84.5	Confident	13 Å²	13	56.1 Å²	56.1	9%	0.088	26%	0.258	C	S	.	.	H	α-helix	trans	-68	-44.7	174.5	-61	0	0	0	0	111.4	M56 V77 R136 L137 V138 R144	M56-C140 VanDerWaalsContact CE-SG 3.57Å; M56-C140 HydrophobicContact SD-CB 4.37Å; M56-C140 PolarHBondContact SD-SG 3.26Å; V77-C140 HydrophobicContact CB-CB 4.19Å; V77-C140 HydrophobicContact CG1-CB 4.28Å; V77-C140 HydrophobicContact CG2-CB 4.02Å; R136-C140 PolarHBondContact O-N 2.91Å; R136-C140 PolarHBondContact O-SG 3.17Å; L137-C140 VanDerWaalsContact O-CB 3.31Å; L137-C140 WeakPolarHBondContact O-CB 3.24Å; L137-C140 PolarHBondContact O-N 3.17Å; V138-C140 PolarHBondContact O-N 2.8Å; C140-R144 VanDerWaalsContact O-CB 3.31Å; C140-R144 WeakPolarHBondContact O-CB 3.4Å; C140-R144 PolarHBondContact O-N 3.21Å
141	I	86.4	Confident	83.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.3	-48.3	177	-67.6	171.2	0	0	0	110.2	V77 I82 L99 Y105 F112 L137 V138 K143 R144 I145	V77-I141 HydrophobicContact CG1-CG1 4.13Å; V77-I141 HydrophobicContact CG2-CG1 3.89Å; I82-I141 HydrophobicContact CD1-CD1 3.65Å; I82-I141 HydrophobicContact CD1-CG1 4.33Å; I82-I141 HydrophobicContact CG1-CD1 4.37Å; L99-I141 HydrophobicContact CD2-CG2 4.31Å; Y105-I141 HydrophobicContact CD1-CG2 4.04Å; Y105-I141 HydrophobicContact CD2-CG2 4.16Å; Y105-I141 HydrophobicContact CE1-CG2 3.85Å; Y105-I141 HydrophobicContact CE2-CB 4.49Å; Y105-I141 HydrophobicContact CE2-CG2 3.96Å; Y105-I141 HydrophobicContact CG-CG2 4.2Å; F112-I141 HydrophobicContact CE1-CD1 4.42Å; F112-I141 HydrophobicContact CE2-CD1 3.52Å; F112-I141 HydrophobicContact CZ-CD1 3.36Å; L137-I141 HydrophobicContact CD2-CD1 3.44Å; L137-I141 VanDerWaalsContact CD2-CD1 3.44Å; L137-I141 HydrophobicContact CD2-CG1 4.15Å; L137-I141 PolarHBondContact O-N 2.96Å; L137-I141 VanDerWaalsContact O-N 3.1Å; V138-I141 PolarHBondContact O-N 2.85Å; I141-K143 PolarHBondContact O-N 3.45Å; I141-R144 WeakPolarHBondContact O-CB 3.49Å; I141-R144 PolarHBondContact O-N 3.26Å; I141-R144 VanDerWaalsContact O-N 3.1Å; I141-I145 HydrophobicContact CG2-CD1 3.61Å; I141-I145 HydrophobicContact CG2-CG1 4.22Å; I141-I145 WeakPolarHBondContact O-CB 3.29Å; I141-I145 WeakPolarHBondContact O-CG1 3.36Å; I141-I145 PolarHBondContact O-N 3.25Å
142	E	84.2	Confident	82.2	Confident	66 Å²	66	53.8 Å²	53.8	31%	0.308	25%	0.246	S	C	.	.	H	α-helix	trans	-57.7	-48.6	178.6	-74.8	171.8	172.8	0	0	111.9	Y105 V138 R144 I145 N146	Y105-E142 HydrophobicContact CE2-CG 3.87Å; Y105-E142 WeakPolarHBondContact OH-CG 3.5Å; V138-E142 HydrophobicContact CG1-CG 4.22Å; V138-E142 WeakPolarHBondContact CG1-OE1 3.11Å; V138-E142 WeakPolarHBondContact O-CG 3.31Å; V138-E142 PolarHBondContact O-N 3.2Å; E142-R144 VanDerWaalsContact C-N 3.27Å; E142-R144 PolarHBondContact O-N 2.85Å; E142-I145 PolarHBondContact O-N 3.28Å; E142-N146 VanDerWaalsContact O-CB 3.25Å; E142-N146 WeakPolarHBondContact O-CB 3.46Å; E142-N146 PolarHBondContact O-N 3Å; E142-N146 PolarHBondContact O-ND2 3.04Å
143	K	83.5	Confident	80.8	Confident	138 Å²	138	53.1 Å²	53.1	60%	0.6	24%	0.239	S	C	*	.	H	α-helix	trans	-57.5	-45.1	175.4	-76.5	175.4	-175.8	-177.1	0	110.7	S139 I141 N146 S147	S139-K143 WeakPolarHBondContact O-CB 3.41Å; S139-K143 VanDerWaalsContact O-CG 3.24Å; S139-K143 WeakPolarHBondContact O-CG 3.36Å; S139-K143 PolarHBondContact O-N 3.48Å; I141-K143 PolarHBondContact O-N 3.45Å; K143-N146 PolarHBondContact O-N 3.26Å; K143-S147 WeakPolarHBondContact O-CB 3.31Å; K143-S147 PolarHBondContact O-N 3.28Å; K143-S147 PolarHBondContact O-OG 3.23Å
144	R	79.8	Confident	79.4	Confident	28 Å²	28	51 Å²	51	11%	0.106	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-47.1	-178.9	-161.5	69.5	-145	173.1	-6.9	112.5	M49 V77 R78 V79 L99 C140 I141 E142 S147 L148	M49-R144 PolarHBondContact O-NH1 3.46Å; M49-R144 VanDerWaalsContact SD-CZ 3.54Å; M49-R144 PolarHBondContact SD-NH2 2.83Å; V77-R144 HydrophobicContact CG1-CB 4.3Å; V77-R144 HydrophobicContact CG1-CG 4.5Å; R78-R144 WeakPolarHBondContact O-CD 3.34Å; R78-R144 WeakPolarHBondContact O-CG 3.33Å; V79-R144 VanDerWaalsContact C-NE 3.33Å; V79-R144 VanDerWaalsContact CA-NE 3.26Å; V79-R144 VanDerWaalsContact O-CZ 3.24Å; V79-R144 PolarHBondContact O-NE 2.81Å; V79-R144 PolarHBondContact O-NH2 2.92Å; L99-R144 HydrophobicContact CD1-CB 3.97Å; L99-R144 HydrophobicContact CD1-CG 3.42Å; L99-R144 VanDerWaalsContact CD1-CG 3.42Å; C140-R144 VanDerWaalsContact O-CB 3.31Å; C140-R144 WeakPolarHBondContact O-CB 3.4Å; C140-R144 PolarHBondContact O-N 3.21Å; I141-R144 WeakPolarHBondContact O-CB 3.49Å; I141-R144 PolarHBondContact O-N 3.26Å; I141-R144 VanDerWaalsContact O-N 3.1Å; E142-R144 VanDerWaalsContact C-N 3.27Å; E142-R144 PolarHBondContact O-N 2.85Å; R144-S147 PolarHBondContact O-N 3.45Å; R144-L148 VanDerWaalsContact O-CG 3.32Å; R144-L148 WeakPolarHBondContact O-CG 3.36Å; R144-L148 PolarHBondContact O-N 2.76Å
145	I	80.1	Confident	78.2	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-46.7	176.2	-70.2	177	0	0	0	110.3	K9 L13 L99 Y105 I141 E142 S147 L148 L149	K9-I145 HydrophobicContact CB-CG2 3.92Å; K9-I145 HydrophobicContact CD-CG2 3.52Å; K9-I145 HydrophobicContact CG-CG2 4.35Å; L13-I145 HydrophobicContact CD1-CB 4.39Å; L13-I145 HydrophobicContact CD1-CG1 4.02Å; L13-I145 HydrophobicContact CD1-CG2 3.97Å; L13-I145 HydrophobicContact CG-CG2 4.45Å; L99-I145 HydrophobicContact CB-CG1 4.36Å; L99-I145 HydrophobicContact CD1-CG1 4.39Å; Y105-I145 HydrophobicContact CD1-CD1 4.31Å; Y105-I145 HydrophobicContact CE1-CD1 3.44Å; Y105-I145 VanDerWaalsContact CE1-CD1 3.44Å; I141-I145 HydrophobicContact CG2-CD1 3.61Å; I141-I145 HydrophobicContact CG2-CG1 4.22Å; I141-I145 WeakPolarHBondContact O-CB 3.29Å; I141-I145 WeakPolarHBondContact O-CG1 3.36Å; I141-I145 PolarHBondContact O-N 3.25Å; E142-I145 PolarHBondContact O-N 3.28Å; I145-S147 VanDerWaalsContact C-N 3.33Å; I145-S147 PolarHBondContact O-N 3.38Å; I145-L148 PolarHBondContact O-N 3.44Å; I145-L148 VanDerWaalsContact O-N 3.15Å; I145-L149 HydrophobicContact CG2-CD1 3.91Å; I145-L149 HydrophobicContact CG2-CG 4.26Å; I145-L149 VanDerWaalsContact O-CG 3.31Å; I145-L149 WeakPolarHBondContact O-CG 3.16Å; I145-L149 PolarHBondContact O-N 3.12Å
146	N	78.5	Confident	76.6	Confident	76 Å²	76	49.8 Å²	49.8	41%	0.406	23%	0.23	S	C	.	.	H	α-helix	trans	-62.7	-39.9	179.1	-69	-18.3	0	0	0	111.9	K9 E142 K143 L149 H150	K9-N146 PolarHBondContact NZ-OD1 3.42Å; E142-N146 VanDerWaalsContact O-CB 3.25Å; E142-N146 WeakPolarHBondContact O-CB 3.46Å; E142-N146 PolarHBondContact O-N 3Å; E142-N146 PolarHBondContact O-ND2 3.04Å; K143-N146 PolarHBondContact O-N 3.26Å; N146-L149 PolarHBondContact O-N 2.88Å; N146-H150 WeakPolarHBondContact O-CB 3.49Å; N146-H150 PolarHBondContact O-N 3.16Å
147	S	75.7	Confident	75	Confident	17 Å²	17	45.3 Å²	45.3	12%	0.119	22%	0.221	C	C	.	.	H	α-helix	trans	-58.6	-49.5	172.1	-66.5	0	0	0	0	110.6	S48 K143 R144 I145 L149 H150 L151	S48-S147 WeakPolarHBondContact OG-CB 3.31Å; S48-S147 PolarHBondContact OG-OG 3.03Å; K143-S147 WeakPolarHBondContact O-CB 3.31Å; K143-S147 PolarHBondContact O-N 3.28Å; K143-S147 PolarHBondContact O-OG 3.23Å; R144-S147 PolarHBondContact O-N 3.45Å; I145-S147 VanDerWaalsContact C-N 3.33Å; I145-S147 PolarHBondContact O-N 3.38Å; S147-L149 PolarHBondContact O-N 2.67Å; S147-H150 WeakPolarHBondContact O-CB 3.46Å; S147-H150 PolarHBondContact O-N 3.46Å; S147-L151 WeakPolarHBondContact O-CG 3.15Å; S147-L151 PolarHBondContact O-N 2.87Å
148	L	72.8	Confident	73.2	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.2	-41.3	178.4	-68.4	172.3	0	0	0	112.8	L13 M49 Y80 L99 R144 I145 H150 L151 Y152	L13-L148 HydrophobicContact CD2-CB 3.44Å; L13-L148 VanDerWaalsContact CD2-CB 3.44Å; L13-L148 HydrophobicContact CD2-CD1 4.27Å; L13-L148 HydrophobicContact CD2-CG 4.5Å; M49-L148 HydrophobicContact CE-CD2 4.03Å; M49-L148 HydrophobicContact SD-CD2 4.37Å; Y80-L148 HydrophobicContact CD1-CD1 4.29Å; Y80-L148 HydrophobicContact CD1-CD2 3.54Å; Y80-L148 HydrophobicContact CE1-CD2 3.38Å; L99-L148 HydrophobicContact CB-CD1 4.49Å; L99-L148 HydrophobicContact CD1-CD1 3.93Å; R144-L148 VanDerWaalsContact O-CG 3.32Å; R144-L148 WeakPolarHBondContact O-CG 3.36Å; R144-L148 PolarHBondContact O-N 2.76Å; I145-L148 PolarHBondContact O-N 3.44Å; I145-L148 VanDerWaalsContact O-N 3.15Å; L148-H150 PolarHBondContact O-N 3.33Å; L148-L151 WeakPolarHBondContact O-CB 3.45Å; L148-L151 PolarHBondContact O-N 3.14Å; L148-Y152 PolarHBondContact O-N 2.67Å
149	L	72.9	Confident	71.7	Confident	13 Å²	13	50.4 Å²	50.4	7%	0.068	25%	0.249	C	C	.	.	H	α-helix	trans	-63.4	-40.3	175.2	-69.5	174.8	0	0	0	112.2	K9 D12 L13 I145 N146 S147 L151 Y152 R153	K9-L149 HydrophobicContact CD-CD1 3.98Å; K9-L149 HydrophobicContact CG-CD1 4.35Å; D12-L149 HydrophobicContact CB-CD2 3.29Å; L13-L149 HydrophobicContact CD2-CD2 3.72Å; L13-L149 HydrophobicContact CD2-CG 3.88Å; L13-L149 HydrophobicContact CG-CD2 4.06Å; L13-L149 HydrophobicContact CG-CG 4.45Å; I145-L149 HydrophobicContact CG2-CD1 3.91Å; I145-L149 HydrophobicContact CG2-CG 4.26Å; I145-L149 VanDerWaalsContact O-CG 3.31Å; I145-L149 WeakPolarHBondContact O-CG 3.16Å; I145-L149 PolarHBondContact O-N 3.12Å; N146-L149 PolarHBondContact O-N 2.88Å; S147-L149 PolarHBondContact O-N 2.67Å; L149-L151 VanDerWaalsContact C-N 3.31Å; L149-L151 PolarHBondContact O-N 2.82Å; L149-Y152 PolarHBondContact O-N 3.48Å; L149-R153 WeakPolarHBondContact O-CG 3.34Å; L149-R153 PolarHBondContact O-N 2.93Å
150	H	74.3	Confident	70.1	Confident	90 Å²	90	55.7 Å²	55.7	42%	0.417	27%	0.267	S	S	.	.	H	α-helix	trans	-62.2	-39.6	174.6	179.1	-89.7	0	0	0	111.7	N146 S147 L148 N154	N146-H150 WeakPolarHBondContact O-CB 3.49Å; N146-H150 PolarHBondContact O-N 3.16Å; S147-H150 WeakPolarHBondContact O-CB 3.46Å; S147-H150 PolarHBondContact O-N 3.46Å; L148-H150 PolarHBondContact O-N 3.33Å; H150-N154 PolarHBondContact CE1-ND2 2.85Å; H150-N154 PolarHBondContact ND1-ND2 3.41Å; H150-N154 PolarHBondContact NE2-ND2 2.82Å; H150-N154 WeakPolarHBondContact O-CB 3.24Å; H150-N154 PolarHBondContact O-N 2.94Å; H150-N154 PolarHBondContact O-ND2 3.35Å
151	L	68.2	Low	68.1	Low	17 Å²	17	64.5 Å²	64.5	9%	0.089	30%	0.299	C	S	.	.	H	α-helix	trans	-61.7	-47	173.7	-59.6	-170.6	0	0	0	111.7	L16 F41 V45 M49 S147 L148 L149 N154 M155	L16-L151 HydrophobicContact CD1-CB 4.38Å; F41-L151 HydrophobicContact CE2-CD2 4.12Å; F41-L151 HydrophobicContact CZ-CD2 4.03Å; V45-L151 HydrophobicContact CB-CD2 3.63Å; V45-L151 HydrophobicContact CG1-CD1 4.01Å; V45-L151 HydrophobicContact CG1-CD2 3.39Å; V45-L151 HydrophobicContact CG1-CG 4.35Å; V45-L151 HydrophobicContact CG2-CD2 3.1Å; M49-L151 HydrophobicContact CE-CD1 3.59Å; M49-L151 HydrophobicContact CG-CD1 4.01Å; M49-L151 HydrophobicContact SD-CD1 3.7Å; S147-L151 WeakPolarHBondContact O-CG 3.15Å; S147-L151 PolarHBondContact O-N 2.87Å; L148-L151 WeakPolarHBondContact O-CB 3.45Å; L148-L151 PolarHBondContact O-N 3.14Å; L149-L151 VanDerWaalsContact C-N 3.31Å; L149-L151 PolarHBondContact O-N 2.82Å; L151-N154 PolarHBondContact O-N 3.2Å; L151-M155 VanDerWaalsContact O-CB 3.25Å; L151-M155 WeakPolarHBondContact O-CB 3.1Å; L151-M155 PolarHBondContact O-N 2.91Å
152	Y	63.6	Low	66.1	Low	60 Å²	60	67.6 Å²	67.6	24%	0.235	32%	0.316	C	S	.	.	H	α-helix	trans	-59.8	-53.6	179.7	-179.8	-104.7	0	0	0	111.4	C15 L16 L148 L149 N154 M155 T156	C15-Y152 HydrophobicContact CB-CD2 4.2Å; C15-Y152 HydrophobicContact CB-CE1 4.22Å; C15-Y152 HydrophobicContact CB-CE2 3.3Å; C15-Y152 WeakPolarHBondContact CB-OH 3.42Å; L16-Y152 HydrophobicContact CB-CD2 4.16Å; L16-Y152 HydrophobicContact CD1-CD2 4.44Å; L148-Y152 PolarHBondContact O-N 2.67Å; L149-Y152 PolarHBondContact O-N 3.48Å; Y152-N154 VanDerWaalsContact C-N 3.3Å; Y152-N154 PolarHBondContact O-N 2.99Å; Y152-M155 PolarHBondContact O-N 3.17Å; Y152-T156 PolarHBondContact O-N 3.38Å; Y152-T156 PolarHBondContact O-OG1 3.43Å
153	R	64.8	Low	64	Low	165 Å²	165	68.5 Å²	68.5	62%	0.623	32%	0.319	S	S	*	.	H	α-helix	trans	-55.3	-44.7	-179.2	-74.3	179.9	177.4	176.1	-0.5	112.4	L149 S157	L149-R153 WeakPolarHBondContact O-CG 3.34Å; L149-R153 PolarHBondContact O-N 2.93Å; R153-S157 PolarHBondContact O-N 2.9Å; R153-S157 PolarHBondContact O-OG 3.36Å
154	N	64.4	Low	62	Low	49 Å²	49	66.6 Å²	66.6	26%	0.262	32%	0.321	S	S	.	.	H	α-helix	trans	-75	-36.9	-179.4	-73.2	-38.6	0	0	0	113	F41 H150 L151 Y152 T156 S157 V158	F41-N154 HydrophobicContact CD2-CB 3.48Å; F41-N154 VanDerWaalsContact CD2-CB 3.48Å; F41-N154 HydrophobicContact CE2-CB 3.13Å; F41-N154 HydrophobicContact CG-CB 4.34Å; F41-N154 HydrophobicContact CZ-CB 3.72Å; H150-N154 PolarHBondContact CE1-ND2 2.85Å; H150-N154 PolarHBondContact ND1-ND2 3.41Å; H150-N154 PolarHBondContact NE2-ND2 2.82Å; H150-N154 WeakPolarHBondContact O-CB 3.24Å; H150-N154 PolarHBondContact O-N 2.94Å; H150-N154 PolarHBondContact O-ND2 3.35Å; L151-N154 PolarHBondContact O-N 3.2Å; Y152-N154 VanDerWaalsContact C-N 3.3Å; Y152-N154 PolarHBondContact O-N 2.99Å; N154-T156 VanDerWaalsContact C-N 3.32Å; N154-T156 PolarHBondContact O-N 2.97Å; N154-S157 WeakPolarHBondContact O-CB 3.22Å; N154-S157 PolarHBondContact O-N 2.7Å; N154-V158 WeakPolarHBondContact O-CG2 3.11Å; N154-V158 PolarHBondContact O-N 3.27Å
155	M	62.4	Low	60	Low	83 Å²	83	70.8 Å²	70.8	41%	0.409	35%	0.35	S	S	.	.	H	α-helix	trans	-61.4	-43.7	172.7	-174.1	-172	-75.4	0	0	110.5	L151 Y152 V158 I159	L151-M155 VanDerWaalsContact O-CB 3.25Å; L151-M155 WeakPolarHBondContact O-CB 3.1Å; L151-M155 PolarHBondContact O-N 2.91Å; Y152-M155 PolarHBondContact O-N 3.17Å; M155-V158 PolarHBondContact O-N 3.21Å; M155-I159 HydrophobicContact CG-CD1 4.02Å; M155-I159 VanDerWaalsContact O-CG1 3.27Å; M155-I159 WeakPolarHBondContact O-CG1 3.02Å; M155-I159 PolarHBondContact O-N 2.85Å
156	T	54.2	Low	57.9	Low	39 Å²	39	81.6 Å²	81.6	24%	0.239	39%	0.39	C	S	.	.	H	α-helix	trans	-62.1	-42.5	174.3	-53.6	0	0	0	0	111.8	Y152 N154 I159 K160	Y152-T156 PolarHBondContact O-N 3.38Å; Y152-T156 PolarHBondContact O-OG1 3.43Å; N154-T156 VanDerWaalsContact C-N 3.32Å; N154-T156 PolarHBondContact O-N 2.97Å; T156-I159 PolarHBondContact O-N 3.05Å; T156-K160 HydrophobicContact CG2-CD 4.47Å; T156-K160 WeakPolarHBondContact O-CG 3.25Å; T156-K160 PolarHBondContact O-N 3.06Å
157	S	56.2	Low	55.9	Low	48 Å²	48	86.3 Å²	86.3	34%	0.336	41%	0.41	S	S	.	.	H	α-helix	trans	-59.2	-48.2	174.3	-64.9	0	0	0	0	111.5	R153 N154 I159 K160 Y161	R153-S157 PolarHBondContact O-N 2.9Å; R153-S157 PolarHBondContact O-OG 3.36Å; N154-S157 WeakPolarHBondContact O-CB 3.22Å; N154-S157 PolarHBondContact O-N 2.7Å; S157-I159 VanDerWaalsContact C-N 3.35Å; S157-I159 PolarHBondContact O-N 2.71Å; S157-K160 WeakPolarHBondContact O-CB 3.47Å; S157-K160 PolarHBondContact O-N 3.1Å; S157-K160 VanDerWaalsContact O-N 3.15Å; S157-Y161 WeakPolarHBondContact O-CD2 3.37Å; S157-Y161 PolarHBondContact O-N 3.09Å
158	V	53.5	Low	53.7	Low	39 Å²	39	90 Å²	90	24%	0.236	44%	0.436	C	S	.	.	H	α-helix	trans	-59.7	-44.3	177	172.2	0	0	0	0	111.2	L38 N154 M155 K160 Y161 L162	L38-V158 HydrophobicContact CD1-CG1 4.15Å; N154-V158 WeakPolarHBondContact O-CG2 3.11Å; N154-V158 PolarHBondContact O-N 3.27Å; M155-V158 PolarHBondContact O-N 3.21Å; V158-K160 VanDerWaalsContact C-N 3.32Å; V158-K160 PolarHBondContact O-N 2.99Å; V158-Y161 PolarHBondContact O-N 2.92Å; V158-L162 HydrophobicContact CG1-CD1 3.73Å; V158-L162 HydrophobicContact CG1-CG 4.21Å; V158-L162 WeakPolarHBondContact O-CB 3.35Å; V158-L162 VanDerWaalsContact O-CG 3.29Å; V158-L162 WeakPolarHBondContact O-CG 3.44Å; V158-L162 PolarHBondContact O-N 2.9Å
159	I	54.1	Low	51.7	Low	73 Å²	73	95.7 Å²	95.7	37%	0.374	47%	0.474	S	S	.	.	H	α-helix	trans	-61	-41.1	176.4	-68.7	166.6	0	0	0	111.1	T22 M155 T156 S157 L162 H163	T22-I159 HydrophobicContact CG2-CD1 4.02Å; M155-I159 HydrophobicContact CG-CD1 4.02Å; M155-I159 VanDerWaalsContact O-CG1 3.27Å; M155-I159 WeakPolarHBondContact O-CG1 3.02Å; M155-I159 PolarHBondContact O-N 2.85Å; T156-I159 PolarHBondContact O-N 3.05Å; S157-I159 VanDerWaalsContact C-N 3.35Å; S157-I159 PolarHBondContact O-N 2.71Å; I159-L162 PolarHBondContact O-N 3.3Å; I159-H163 WeakPolarHBondContact O-CB 3.31Å; I159-H163 PolarHBondContact O-N 3.45Å
160	K	52.3	Low	49.7	Very low	152 Å²	152	103.2 Å²	103.2	66%	0.661	51%	0.513	S	S	*	.	H	α-helix	trans	-64.2	-41.3	175.2	-73.7	177.6	177.7	-175.7	0	112.4	T156 S157 V158 H163	T156-K160 HydrophobicContact CG2-CD 4.47Å; T156-K160 WeakPolarHBondContact O-CG 3.25Å; T156-K160 PolarHBondContact O-N 3.06Å; S157-K160 WeakPolarHBondContact O-CB 3.47Å; S157-K160 PolarHBondContact O-N 3.1Å; S157-K160 VanDerWaalsContact O-N 3.15Å; V158-K160 VanDerWaalsContact C-N 3.32Å; V158-K160 PolarHBondContact O-N 2.99Å; K160-H163 CarbonylContact O-C 3.38Å; K160-H163 PolarHBondContact O-N 3.1Å; K160-H163 VanDerWaalsContact O-O 3.13Å
161	Y	47.6	Very low	47.5	Very low	197 Å²	197	105.8 Å²	105.8	77%	0.773	53%	0.53	S	S	*	.	H	α-helix	trans	-68.1	-37.1	176.8	-76.7	-67.9	0	0	0	112.8	S157 V158 H163	S157-Y161 WeakPolarHBondContact O-CD2 3.37Å; S157-Y161 PolarHBondContact O-N 3.09Å; V158-Y161 PolarHBondContact O-N 2.92Å; Y161-H163 VanDerWaalsContact C-N 3.3Å
162	L	44.5	Very low	45.7	Very low	66 Å²	66	116.3 Å²	116.3	35%	0.346	57%	0.569	S	S	.	*	H	α-helix	trans	-75.3	-19.8	178.5	-70.4	176.7	0	0	0	113.1	L30 P31 P34 V158 I159	L30-L162 HydrophobicContact CD1-CD1 4.17Å; L30-L162 HydrophobicContact CD1-CD2 3.72Å; P31-L162 HydrophobicContact CG-CD2 4.42Å; P34-L162 HydrophobicContact CG-CD2 4.23Å; V158-L162 HydrophobicContact CG1-CD1 3.73Å; V158-L162 HydrophobicContact CG1-CG 4.21Å; V158-L162 WeakPolarHBondContact O-CB 3.35Å; V158-L162 VanDerWaalsContact O-CG 3.29Å; V158-L162 WeakPolarHBondContact O-CG 3.44Å; V158-L162 PolarHBondContact O-N 2.9Å; I159-L162 PolarHBondContact O-N 3.3Å
163	H	39.9	Very low	44	Very low	84 Å²	84	122.5 Å²	122.5	39%	0.389	60%	0.597	S	S	.	*	S	Bend	trans	-125.4	82.6	-178.9	-147.9	-63.6	0	0	0	109.3	I159 K160 Y161 V165	I159-H163 WeakPolarHBondContact O-CB 3.31Å; I159-H163 PolarHBondContact O-N 3.45Å; K160-H163 CarbonylContact O-C 3.38Å; K160-H163 PolarHBondContact O-N 3.1Å; K160-H163 VanDerWaalsContact O-O 3.13Å; Y161-H163 VanDerWaalsContact C-N 3.3Å; H163-V165 PolarHBondContact O-N 2.85Å
164	P	41.9	Very low	42.2	Very low	98 Å²	98	123 Å²	123	64%	0.636	61%	0.606	S	S	*	*			trans	-54.4	118.4	167.4	-17.6	29.6	0	0	0	107.1	R166	P164-R166 PolarHBondContact O-N 2.85Å
165	V	37.6	Very low	40.3	Very low	116 Å²	116	126.2 Å²	126.2	70%	0.703	63%	0.628	S	S	*	*			trans	-59	109.9	169.4	177.3	0	0	0	0	105.1	H163 E167	H163-V165 PolarHBondContact O-N 2.85Å; V165-E167 HydrophobicContact CG1-CG 4.08Å; V165-E167 PolarHBondContact O-N 2.9Å
166	R	36.3	Very low	38.7	Very low	232 Å²	232	133.5 Å²	133.5	88%	0.875	65%	0.653	S	S	*	*			trans	-69.1	80.2	169.7	-73.7	-172.7	178.1	-174.3	-1.2	107.8	P164 S168	P164-R166 PolarHBondContact O-N 2.85Å; R166-S168 VanDerWaalsContact C-N 3.31Å; R166-S168 PolarHBondContact O-N 2.94Å
167	E	36.3	Very low	37.2	Very low	175 Å²	175	137 Å²	137	82%	0.818	68%	0.679	S	S	*	*			trans	-85.4	83	155.5	-88.5	175.4	-178.3	0	0	107.4	V165	V165-E167 HydrophobicContact CG1-CG 4.08Å; V165-E167 PolarHBondContact O-N 2.9Å
168	S	30.2	Very low	35.7	Very low	95 Å²	95	139.9 Å²	139.9	66%	0.664	70%	0.699	S	S	*	*			trans	157.7	126.5	166.9	43.2	0	0	0	0	106.1	R166	R166-S168 VanDerWaalsContact C-N 3.31Å; R166-S168 PolarHBondContact O-N 2.94Å
169	C	29.8	Very low	34.3	Very low	118 Å²	118	143 Å²	143	80%	0.797	72%	0.722	S	S	*	*			cis	-137.7	140	24.8	-68.7	0	0	0	0	110.5
170	L	31.4	Very low	33	Very low	172 Å²	172	150.7 Å²	150.7	90%	0.901	75%	0.746	S	S	*	*			trans	-54.9	148	142.2	-70.4	161.2	0	0	0	108.9
171	D	27.9	Very low	31.5	Very low	144 Å²	144	148.2 Å²	148.2	77%	0.77	75%	0.748	S	S	*	*			trans	96.2	93.6	161.4	-145.8	19.2	0	0	0	117.4
172	R	31.5	Very low	30.3	Very low	237 Å²	237	147 Å²	147	89%	0.894	75%	0.749	S	S	*	*				-170.1	121.3	109.3	-103.2	175.9	-176	174.5	0	111.7
173	K	26.9	Very low	29.4	Very low	191 Å²	191	151.4 Å²	151.4	83%	0.83	77%	0.773	S	S	*	*			trans	-57.1	142.4	155.2	-69.8	169.4	172.6	174.7	0	109.7
174	E	26.9	Very low	28.4	Very low	175 Å²	175	154.4 Å²	154.4	82%	0.818	79%	0.787	S	S	*	*			trans	162.8	97.9	135.6	-89.4	173.3	-167.9	0	0	108.3
175	T	24.1	Very low	27.5	Very low	117 Å²	117	157.7 Å²	157.7	72%	0.718	80%	0.797	S	S	*	*				47.5	101.9	105.5	41.2	0	0	0	0	114.6
176	Y	30.8	Very low	26.7	Very low	236 Å²	236	160.9 Å²	160.9	93%	0.925	80%	0.796	S	S	*	*				-155.4	119.3	117	-110	-80.5	0	0	0	110.3
177	S	21.9	Very low	26	Very low	113 Å²	113	155.4 Å²	155.4	79%	0.79	79%	0.794	S	S	*	*			trans	-70.1	135.5	173.3	-46.3	0	0	0	0	111.1
178	S	25.6	Very low	25.3	Very low	108 Å²	108	153.5 Å²	153.5	76%	0.755	79%	0.788	S	S	*	*			trans	-172.6	113.7	135.1	-160.4	0	0	0	0	112.7
179	S	22.4	Very low	24.8	Very low	103 Å²	103	151.9 Å²	151.9	72%	0.72	79%	0.786	S	S	*	*			trans	55.4	105.1	137.1	62.7	0	0	0	0	122.8
180	R	26.6	Very low	24.5	Very low	236 Å²	236	155.7 Å²	155.7	89%	0.891	79%	0.79	S	S	*	*				179.1	100.9	124.1	-104.6	-179.6	159.1	176.9	-5.4	109
181	S	21.6	Very low	23.8	Very low	99 Å²	99	152 Å²	152	69%	0.692	78%	0.778	S	S	*	*				43.6	123.5	92.5	67.2	0	0	0	0	112.9
182	E	22.6	Very low	23.6	Very low	172 Å²	172	152.9 Å²	152.9	80%	0.804	78%	0.783	S	S	*	*			cis	-149.1	152.7	4.7	-83.8	156	143.5	0	0	103.9
183	L	24.8	Very low	23.2	Very low	159 Å²	159	147 Å²	147	83%	0.832	78%	0.778	S	S	*	*				-175.4	120.4	81.6	-82	167.4	0	0	0	107.3	I185	L183-I185 PolarHBondContact O-N 2.62Å
184	E	19.7	Very low	23	Very low	147 Å²	147	145 Å²	145	69%	0.687	78%	0.775	S	S	*	*			trans	-69.6	117.6	171.3	-70.3	-173.7	133.7	0	0	109.9	R186	E184-R186 HydrophobicContact CB-CG 4.4Å; E184-R186 IonicContact OE1-CZ 3.45Å; E184-R186 IonicContact OE1-NE 3.15Å; E184-R186 PolarHBondContact OE1-NE 3.46Å; E184-R186 VanDerWaalsContact OE1-NE 3.15Å; E184-R186 IonicContact OE1-NH2 2.88Å; E184-R186 PolarHBondContact OE1-NH2 2.65Å; E184-R186 IonicContact OE2-CZ 3.69Å; E184-R186 IonicContact OE2-NE 3.28Å; E184-R186 PolarHBondContact OE2-NE 2.92Å; E184-R186 IonicContact OE2-NH2 3.58Å
185	I	23.6	Very low	23	Very low	166 Å²	166	144 Å²	144	85%	0.851	78%	0.776	S	S	*	*			trans	-105.2	85.7	154.6	-58.5	178.5	0	0	0	105.9	L183 S187	L183-I185 PolarHBondContact O-N 2.62Å; I185-S187 PolarHBondContact O-N 3.11Å
186	R	19.3	Very low	23	Very low	183 Å²	183	146.1 Å²	146.1	69%	0.691	78%	0.775	S	S	*	*			trans	-64.2	123.1	169.1	-73.7	179.9	-178.7	-166.6	0.1	108.1	E184 I188	E184-R186 HydrophobicContact CB-CG 4.4Å; E184-R186 IonicContact OE1-CZ 3.45Å; E184-R186 IonicContact OE1-NE 3.15Å; E184-R186 PolarHBondContact OE1-NE 3.46Å; E184-R186 VanDerWaalsContact OE1-NE 3.15Å; E184-R186 IonicContact OE1-NH2 2.88Å; E184-R186 PolarHBondContact OE1-NH2 2.65Å; E184-R186 IonicContact OE2-CZ 3.69Å; E184-R186 IonicContact OE2-NE 3.28Å; E184-R186 PolarHBondContact OE2-NE 2.92Å; E184-R186 IonicContact OE2-NH2 3.58Å; R186-I188 PolarHBondContact O-N 3.37Å
187	S	21.6	Very low	22.5	Very low	117 Å²	117	142.1 Å²	142.1	82%	0.818	77%	0.765	S	S	*	*			trans	-56	108.5	165.9	43.3	0	0	0	0	109.1	I185 G189	I185-S187 PolarHBondContact O-N 3.11Å; S187-G189 VanDerWaalsContact C-N 3.33Å; S187-G189 PolarHBondContact O-N 2.98Å
188	I	21.4	Very low	22.7	Very low	136 Å²	136	144.6 Å²	144.6	70%	0.697	77%	0.769	S	S	*	*			trans	-68.9	96.6	169.8	-61.8	173.1	0	0	0	106.5	R186 F190	R186-I188 PolarHBondContact O-N 3.37Å; I188-F190 HydrophobicContact CB-CE2 4.45Å; I188-F190 HydrophobicContact CG2-CD2 3.74Å; I188-F190 HydrophobicContact CG2-CE1 4.46Å; I188-F190 HydrophobicContact CG2-CE2 3.48Å; I188-F190 VanDerWaalsContact CG2-CE2 3.48Å; I188-F190 HydrophobicContact CG2-CG 4.35Å; I188-F190 HydrophobicContact CG2-CZ 3.88Å; I188-F190 PolarHBondContact O-N 3.28Å
189	G	19.6	Very low	22.5	Very low	61 Å²	61	148.5 Å²	148.5	63%	0.629	78%	0.775	S	S	*	*			trans	-65.5	115.2	156	0	0	0	0	0	107.9	S187 S191	S187-G189 VanDerWaalsContact C-N 3.33Å; S187-G189 PolarHBondContact O-N 2.98Å; G189-S191 PolarHBondContact O-N 2.84Å
190	F	23.4	Very low	22.7	Very low	198 Å²	198	152.6 Å²	152.6	87%	0.868	78%	0.783	S	S	*	*			trans	-82	91.8	160	-79.3	-82.2	0	0	0	107.6	I188	I188-F190 HydrophobicContact CB-CE2 4.45Å; I188-F190 HydrophobicContact CG2-CD2 3.74Å; I188-F190 HydrophobicContact CG2-CE1 4.46Å; I188-F190 HydrophobicContact CG2-CE2 3.48Å; I188-F190 VanDerWaalsContact CG2-CE2 3.48Å; I188-F190 HydrophobicContact CG2-CG 4.35Å; I188-F190 HydrophobicContact CG2-CZ 3.88Å; I188-F190 PolarHBondContact O-N 3.28Å
191	S	18.8	Very low	22.5	Very low	94 Å²	94	151.2 Å²	151.2	66%	0.657	78%	0.784	S	S	*	*			trans	-108.4	142.5	155	46.7	0	0	0	0	108.3	G189	G189-S191 PolarHBondContact O-N 2.84Å
192	N	22.1	Very low	22.5	Very low	163 Å²	163	151.6 Å²	151.6	87%	0.872	79%	0.787	S	S	*	*			trans	97.7	112.1	173.8	-54.2	-13.8	0	0	0	115.3
193	S	24.4	Very low	22.7	Very low	112 Å²	112	151.1 Å²	151.1	78%	0.783	78%	0.784	S	S	*	*				-172.2	135.6	78.5	-170.8	0	0	0	0	111.5
194	L	21.2	Very low	22.6	Very low	149 Å²	149	149 Å²	149	78%	0.78	78%	0.782	S	S	*	*			trans	-47	142.3	155.1	-92.2	77	0	0	0	111.4
195	N	27.4	Very low	22.9	Very low	155 Å²	155	147.7 Å²	147.7	83%	0.829	78%	0.779	S	S	*	*			trans	-151.7	98.5	139.6	-83.2	-28.9	0	0	0	105
196	K	24.2	Very low	23	Very low	161 Å²	161	148.5 Å²	148.5	70%	0.7	78%	0.779	S	S	*	*				59.6	111.2	96.8	-89.4	-164	172.3	-161.5	0	115.1
197	E	21	Very low	23.3	Very low	152 Å²	152	145.4 Å²	145.4	71%	0.71	79%	0.785	S	S	*	*			trans	52.1	105.5	130.6	-65.1	167.6	169.7	0	0	117
198	N	26	Very low	23.6	Very low	166 Å²	166	146.6 Å²	146.6	89%	0.888	78%	0.782	S	S	*	*				-158.3	130.1	114.7	-91.6	-24.5	0	0	0	110.9
199	E	21.9	Very low	23.7	Very low	189 Å²	189	151.8 Å²	151.8	88%	0.883	79%	0.793	S	S	*	*			trans	-60.1	136.7	172	-57.6	170.7	130.8	0	0	110.2
200	E	25.1	Very low	24.1	Very low	189 Å²	189	154 Å²	154	88%	0.883	80%	0.798	S	S	*	*			trans	-158.6	128.7	135.9	-113.8	169.7	-164	0	0	111.3	S202	E200-S202 PolarHBondContact O-N 2.82Å
201	K	23.1	Very low	24.2	Very low	207 Å²	207	146.2 Å²	146.2	90%	0.9	77%	0.768	S	S	*	*			trans	-43.4	115.9	179.8	-70.2	157.7	173.4	169.7	0	112.5
202	S	22	Very low	24.7	Very low	108 Å²	108	143.7 Å²	143.7	76%	0.755	75%	0.751	S	S	*	*			trans	-130.5	113.5	150.8	40.6	0	0	0	0	109.6	E200	E200-S202 PolarHBondContact O-N 2.82Å
203	H	25.3	Very low	25.2	Very low	161 Å²	161	138.6 Å²	138.6	75%	0.745	73%	0.727	S	S	*	*			trans	-24.8	132.5	165.8	-69.2	-88.4	0	0	0	114.3	I205	H203-I205 VanDerWaalsContact C-N 3.34Å; H203-I205 WeakPolarHBondContact O-CG1 3.33Å; H203-I205 PolarHBondContact O-N 2.8Å
204	S	22.8	Very low	25.6	Very low	115 Å²	115	134.5 Å²	134.5	80%	0.804	70%	0.698	S	S	*	*			trans	-6.8	80.8	145.7	49.5	0	0	0	0	115.1	E206	S204-E206 PolarHBondContact O-N 2.77Å
205	I	25.9	Very low	26	Very low	119 Å²	119	128.5 Å²	128.5	61%	0.61	67%	0.667	S	S	*	*			trans	-90.2	91.4	159.9	-60.3	179.2	0	0	0	105	H203 S207 L208	H203-I205 VanDerWaalsContact C-N 3.34Å; H203-I205 WeakPolarHBondContact O-CG1 3.33Å; H203-I205 PolarHBondContact O-N 2.8Å; I205-S207 PolarHBondContact O-N 2.83Å; I205-S207 VanDerWaalsContact O-N 3.07Å; I205-L208 HydrophobicContact CG2-CD1 4.1Å; I205-L208 HydrophobicContact CG2-CD2 3.97Å; I205-L208 HydrophobicContact CG2-CG 3.68Å
206	E	27.2	Very low	26.5	Very low	183 Å²	183	122.7 Å²	122.7	86%	0.855	64%	0.635	S	S	*	*			trans	-14.2	107.3	142.9	-159.1	163.7	-150.4	0	0	110.5	S204 L208	S204-E206 PolarHBondContact O-N 2.77Å; E206-L208 PolarHBondContact O-N 2.86Å
207	S	25.8	Very low	26.7	Very low	118 Å²	118	117.1 Å²	117.1	83%	0.825	61%	0.612	S	S	*	*			trans	-36	106.6	-172.2	-177.2	0	0	0	0	110.9	I205 R209	I205-S207 PolarHBondContact O-N 2.83Å; I205-S207 VanDerWaalsContact O-N 3.07Å; S207-R209 PolarHBondContact O-N 3.13Å
208	L	26.4	Very low	27.2	Very low	143 Å²	143	111.7 Å²	111.7	75%	0.749	59%	0.59	S	S	*	*			trans	-44.1	102.8	-178.5	-73.9	148	0	0	0	109.1	I205 E206 S210	I205-L208 HydrophobicContact CG2-CD1 4.1Å; I205-L208 HydrophobicContact CG2-CD2 3.97Å; I205-L208 HydrophobicContact CG2-CG 3.68Å; E206-L208 PolarHBondContact O-N 2.86Å; L208-S210 PolarHBondContact O-N 2.74Å
209	R	24.8	Very low	27.3	Very low	244 Å²	244	104.5 Å²	104.5	92%	0.921	56%	0.555	S	S	*	*			trans	-45.5	126.7	179.7	-157.7	176	-161	163.2	2.7	108.8	S207	S207-R209 PolarHBondContact O-N 3.13Å
210	S	26.6	Very low	27.8	Very low	107 Å²	107	102.1 Å²	102.1	75%	0.748	56%	0.556	S	S	*	*			trans	-47.7	143.3	-168.7	-62	0	0	0	0	113.2	L208	L208-S210 PolarHBondContact O-N 2.74Å
211	P	25.9	Very low	28.2	Very low	35 Å²	35	97 Å²	97	23%	0.227	54%	0.535	C	S	.	.			trans	-73.3	147.8	-164.1	35.8	-42.3	0	0	0	112	S213 L260	P211-S213 PolarHBondContact O-N 3.32Å; P211-L260 WeakPolarHBondContact CB-O 3.32Å; P211-L260 WeakPolarHBondContact CG-O 3.15Å
212	S	30.5	Very low	28.6	Very low	42 Å²	42	92.2 Å²	92.2	29%	0.294	52%	0.519	S	S	.	.			trans	-50.9	107.4	-162.4	52.9	0	0	0	0	113.6	V214 L260 G263 N264 Y265	S212-V214 PolarHBondContact O-N 3.21Å; S212-L260 WeakPolarHBondContact O-CD1 3.4Å; S212-G263 PolarHBondContact OG-O 2.69Å; S212-N264 PolarHBondContact OG-O 3.13Å; S212-Y265 WeakPolarHBondContact OG-CA 3.48Å; S212-Y265 VanDerWaalsContact OG-CB 3.29Å; S212-Y265 WeakPolarHBondContact OG-CB 3.4Å; S212-Y265 PolarHBondContact OG-N 3.42Å; S212-Y265 VanDerWaalsContact OG-N 3.11Å
213	S	31.6	Very low	28.9	Very low	55 Å²	55	91.8 Å²	91.8	39%	0.385	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-81.6	117.1	-179.6	59.7	0	0	0	0	109.9	P211 I229	P211-S213 PolarHBondContact O-N 3.32Å; S213-I229 WeakPolarHBondContact O-CD1 3.39Å
214	V	34	Very low	29.1	Very low	27 Å²	27	89 Å²	89	16%	0.164	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-92.9	117.1	169.9	179.9	0	0	0	0	108.8	S212 F216 L260 L266	S212-V214 PolarHBondContact O-N 3.21Å; V214-F216 HydrophobicContact CB-CE2 4.5Å; V214-F216 HydrophobicContact CG1-CE2 3.99Å; V214-F216 HydrophobicContact CG1-CZ 4.06Å; V214-L260 HydrophobicContact CG2-CD1 4.42Å; V214-L266 HydrophobicContact CB-CB 4.5Å; V214-L266 HydrophobicContact CB-CD1 4.09Å; V214-L266 HydrophobicContact CB-CG 4.34Å; V214-L266 HydrophobicContact CG1-CD1 4.35Å; V214-L266 HydrophobicContact CG2-CB 3.99Å; V214-L266 HydrophobicContact CG2-CD1 4.39Å; V214-L266 HydrophobicContact CG2-CG 4.09Å
215	V	29.5	Very low	29.6	Very low	22 Å²	22	88.8 Å²	88.8	13%	0.133	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-97.4	121.7	-179.7	-178.6	0	0	0	0	110.2	R227 I229 Q255 Y257	V215-R227 PolarHBondContact O-N 2.93Å; V215-I229 HydrophobicContact CG2-CD1 4.33Å; V215-Q255 HydrophobicContact CG1-CG 4.26Å; V215-Y257 HydrophobicContact CG2-CE1 4.49Å
216	F	36.8	Very low	29.8	Very low	34 Å²	34	87.8 Å²	87.8	15%	0.149	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	129.5	172.2	-62.7	-91.5	0	0	0	109.7	V214 L224 P226 L258 L266	V214-F216 HydrophobicContact CB-CE2 4.5Å; V214-F216 HydrophobicContact CG1-CE2 3.99Å; V214-F216 HydrophobicContact CG1-CZ 4.06Å; F216-L224 HydrophobicContact CB-CD2 4.01Å; F216-L224 HydrophobicContact CD1-CB 4.15Å; F216-P226 HydrophobicContact CE1-CB 4.41Å; F216-L258 HydrophobicContact CD2-CD1 4.45Å; F216-L258 HydrophobicContact CE2-CD1 3.81Å; F216-L266 HydrophobicContact CE2-CD1 3.96Å; F216-L266 HydrophobicContact CZ-CD1 3.85Å
217	I	29.3	Very low	29.8	Very low	44 Å²	44	87 Å²	87	23%	0.226	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	124	171	-60.9	178.1	0	0	0	108.2	G219 L225 R227 I253	I217-G219 PolarHBondContact O-N 2.95Å; I217-L225 PolarHBondContact N-O 3.32Å; I217-L225 PolarHBondContact O-N 3.44Å; I217-R227 HydrophobicContact CD1-CB 4.4Å; I217-R227 HydrophobicContact CD1-CG 4.13Å; I217-I253 HydrophobicContact CG2-CG2 4.31Å
218	C	30.6	Very low	30	Very low	37 Å²	37	88.7 Å²	88.7	25%	0.25	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	103.8	164.2	-157.2	0	0	0	0	107.4	D222	C218-D222 PolarHBondContact SG-OD1 2.85Å
219	G	27.4	Very low	30.1	Very low	15 Å²	15	86.1 Å²	86.1	16%	0.155	46%	0.457	C	S	.	.			trans	-65.6	168.1	172.1	0	0	0	0	0	111.2	I217 D221 D222 Y223	I217-G219 PolarHBondContact O-N 2.95Å; G219-D221 PolarHBondContact O-N 3.06Å; G219-D222 PolarHBondContact O-N 3Å; G219-Y223 PolarHBondContact N-O 3.02Å
220	P	32.5	Very low	30.1	Very low	139 Å²	139	78.6 Å²	78.6	90%	0.903	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-5.7	-179.8	21.9	-31.4	0	0	0	115.2
221	D	33.9	Very low	30.4	Very low	82 Å²	82	82.6 Å²	82.6	44%	0.439	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	20.2	175.8	-66.9	-42.1	0	0	0	113.7	G219 Y223	G219-D221 PolarHBondContact O-N 3.06Å; D221-Y223 HydrophobicContact CB-CD2 3.88Å; D221-Y223 HydrophobicContact CB-CE2 4.24Å; D221-Y223 WeakPolarHBondContact O-CD2 3.28Å; D221-Y223 PolarHBondContact O-N 3.02Å; D221-Y223 VanDerWaalsContact O-N 3.09Å
222	D	31.1	Very low	30.5	Very low	106 Å²	106	88.7 Å²	88.7	57%	0.567	48%	0.475	S	S	*	.	S	Bend	trans	59.2	19.3	178.4	-68.2	-30.5	0	0	0	116	C218 G219	C218-D222 PolarHBondContact SG-OD1 2.85Å; G219-D222 PolarHBondContact O-N 3Å
223	Y	28.3	Very low	30.2	Very low	99 Å²	99	93.1 Å²	93.1	39%	0.388	50%	0.495	S	S	.	.			trans	-80.7	136.3	167	-73.7	-89.8	0	0	0	110.7	L126 G219 D221 L225	L126-Y223 HydrophobicContact CD2-CE1 4.34Å; G219-Y223 PolarHBondContact N-O 3.02Å; D221-Y223 HydrophobicContact CB-CD2 3.88Å; D221-Y223 HydrophobicContact CB-CE2 4.24Å; D221-Y223 WeakPolarHBondContact O-CD2 3.28Å; D221-Y223 PolarHBondContact O-N 3.02Å; D221-Y223 VanDerWaalsContact O-N 3.09Å; Y223-L225 PolarHBondContact O-N 3.01Å
224	L	31	Very low	29.9	Very low	104 Å²	104	96.2 Å²	96.2	55%	0.545	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	111.1	169.1	-62.1	176.9	0	0	0	108.7	F216 I256	F216-L224 HydrophobicContact CB-CD2 4.01Å; F216-L224 HydrophobicContact CD1-CB 4.15Å; L224-I256 HydrophobicContact CD2-CD1 4.48Å
225	L	31.6	Very low	29.6	Very low	110 Å²	110	101.3 Å²	101.3	58%	0.576	54%	0.538	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.1	168.6	-65.2	173.3	0	0	0	108.6	I217 Y223 R227	I217-L225 PolarHBondContact N-O 3.32Å; I217-L225 PolarHBondContact O-N 3.44Å; Y223-L225 PolarHBondContact O-N 3.01Å; L225-R227 PolarHBondContact O-N 3.3Å
226	P	30.5	Very low	29.3	Very low	98 Å²	98	107 Å²	107	64%	0.636	57%	0.567	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-67.8	126.3	171.9	27.3	-30.9	0	0	0	108.8	F216	F216-P226 HydrophobicContact CE1-CB 4.41Å
227	R	28.8	Very low	28.8	Very low	165 Å²	165	114.3 Å²	114.3	62%	0.623	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-97.3	116.7	169.3	-143.5	-162.5	-159.9	174.3	0.5	107.8	V215 I217 L225 I229	V215-R227 PolarHBondContact O-N 2.93Å; I217-R227 HydrophobicContact CD1-CB 4.4Å; I217-R227 HydrophobicContact CD1-CG 4.13Å; L225-R227 PolarHBondContact O-N 3.3Å; R227-I229 PolarHBondContact O-N 2.94Å
228	N	29	Very low	28.5	Very low	155 Å²	155	119.3 Å²	119.3	83%	0.829	63%	0.627	S	S	*	*			trans	-72.9	114.6	170.1	-159.6	-8.8	0	0	0	107.6	S230	N228-S230 PolarHBondContact O-N 2.8Å; N228-S230 VanDerWaalsContact O-N 3.11Å
229	I	27.8	Very low	28.7	Very low	88 Å²	88	122.7 Å²	122.7	45%	0.451	65%	0.648	S	S	.	*			trans	-76.7	97.2	172.9	-51.6	173.8	0	0	0	105	S213 V215 R227 E231	S213-I229 WeakPolarHBondContact O-CD1 3.39Å; V215-I229 HydrophobicContact CG2-CD1 4.33Å; R227-I229 PolarHBondContact O-N 2.94Å; I229-E231 PolarHBondContact O-N 3.03Å; I229-E231 VanDerWaalsContact O-N 3.12Å
230	S	26.2	Very low	28.6	Very low	86 Å²	86	128.4 Å²	128.4	60%	0.601	68%	0.679	S	S	*	*			trans	-59.9	118.8	163.9	-178.8	0	0	0	0	106.6	N228 Q232 N233	N228-S230 PolarHBondContact O-N 2.8Å; N228-S230 VanDerWaalsContact O-N 3.11Å; S230-Q232 PolarHBondContact O-N 2.89Å; S230-N233 PolarHBondContact O-N 2.83Å
231	E	32.4	Very low	28.5	Very low	192 Å²	192	127.4 Å²	127.4	90%	0.897	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	11.7	-169.8	-66.6	-170.5	155.8	0	0	115.4	I229	I229-E231 PolarHBondContact O-N 3.03Å; I229-E231 VanDerWaalsContact O-N 3.12Å
232	Q	27.1	Very low	28.2	Very low	163 Å²	163	132.1 Å²	132.1	76%	0.762	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	-7.4	-179	-71.8	-171.9	-12.8	0	0	116.1	S230 T234	S230-Q232 PolarHBondContact O-N 2.89Å; Q232-T234 VanDerWaalsContact C-N 3.29Å; Q232-T234 PolarHBondContact O-N 3.05Å
233	N	25.2	Very low	27.8	Very low	134 Å²	134	134.9 Å²	134.9	72%	0.717	70%	0.702	S	S	*	*			trans	-93.3	68.7	178.5	-72	-1.9	0	0	0	111.7	S230 L235	S230-N233 PolarHBondContact O-N 2.83Å; N233-L235 VanDerWaalsContact C-N 3.3Å; N233-L235 PolarHBondContact O-N 2.97Å
234	T	25.2	Very low	27.9	Very low	121 Å²	121	135.5 Å²	135.5	74%	0.742	72%	0.718	S	S	*	*			trans	-52.2	104.8	142.4	-44	0	0	0	0	105.3	Q232 N236	Q232-T234 VanDerWaalsContact C-N 3.29Å; Q232-T234 PolarHBondContact O-N 3.05Å; T234-N236 PolarHBondContact O-N 3.41Å
235	L	27.3	Very low	27.6	Very low	134 Å²	134	137.4 Å²	137.4	70%	0.702	73%	0.728	S	S	*	*			trans	-68.1	79.6	177.4	-77.3	168.4	0	0	0	108.5	N233 F237	N233-L235 VanDerWaalsContact C-N 3.3Å; N233-L235 PolarHBondContact O-N 2.97Å; L235-F237 PolarHBondContact O-N 3.32Å
236	N	23.1	Very low	27.4	Very low	140 Å²	140	136.4 Å²	136.4	75%	0.749	73%	0.731	S	S	*	*			trans	-66.2	106.3	150.7	-81.4	-10.4	0	0	0	105.7	T234 D238	T234-N236 PolarHBondContact O-N 3.41Å; N236-D238 PolarHBondContact O-N 3.16Å
237	F	25.7	Very low	27.2	Very low	188 Å²	188	142.8 Å²	142.8	83%	0.825	74%	0.742	S	S	*	*			trans	-61	112	164.6	-71.8	-92	0	0	0	107.1	L235	L235-F237 PolarHBondContact O-N 3.32Å
238	D	24	Very low	27.2	Very low	150 Å²	150	141 Å²	141	80%	0.802	75%	0.75	S	S	*	*			trans	-123.3	124.9	153.3	-99.3	-35.6	0	0	0	109.7	N236	N236-D238 PolarHBondContact O-N 3.16Å
239	P	34.7	Very low	27	Very low	108 Å²	108	141.2 Å²	141.2	70%	0.701	75%	0.745	S	S	*	*			trans	-83.9	140.9	-178.2	35.2	-30.4	0	0	0	108.1
240	V	25.9	Very low	27	Very low	134 Å²	134	143.2 Å²	143.2	81%	0.812	76%	0.757	S	S	*	*			trans	177	113.1	144.5	148.8	0	0	0	0	108.3
241	T	29.4	Very low	27.1	Very low	118 Å²	118	143.1 Å²	143.1	72%	0.724	76%	0.756	S	S	*	*			trans	68.7	97.6	149.3	-28.2	0	0	0	0	118.9
242	E	28.1	Very low	27.1	Very low	182 Å²	182	140.5 Å²	140.5	85%	0.85	75%	0.753	S	S	*	*				-179.5	126.2	106.7	-96.5	-176.7	170	0	0	110.2
243	M	23.7	Very low	27.1	Very low	164 Å²	164	136.3 Å²	136.3	81%	0.808	74%	0.735	S	S	*	*			trans	-79.6	131.2	171.6	-82.7	-98.7	61.5	0	0	109.7
244	P	28.8	Very low	27.3	Very low	111 Å²	111	140 Å²	140	72%	0.721	74%	0.739	S	S	*	*				-132.9	142.6	114.7	35	-25.1	0	0	0	114.3
245	D	25.2	Very low	27.6	Very low	144 Å²	144	138.9 Å²	138.9	77%	0.77	73%	0.725	S	S	*	*			trans	54.4	99.9	150.8	-83.5	-31.3	0	0	0	122.7
246	S	27.4	Very low	28.1	Very low	90 Å²	90	137 Å²	137	63%	0.629	72%	0.715	S	S	*	*			trans	31.7	102.5	132.7	66.6	0	0	0	0	119.3
247	R	26.2	Very low	28.7	Very low	232 Å²	232	137.4 Å²	137.4	88%	0.875	71%	0.707	S	S	*	*			trans	61.4	65.4	137.2	-61.8	-179.5	177.3	153.2	-0.8	116.4
248	V	28.4	Very low	29.5	Very low	128 Å²	128	130.9 Å²	130.9	78%	0.776	68%	0.681	S	S	*	*			trans	-93.9	94.6	133.2	-179.2	0	0	0	0	105.6	L250	V248-L250 PolarHBondContact O-N 3.45Å
249	E	24.6	Very low	30.4	Very low	158 Å²	158	130.5 Å²	130.5	74%	0.738	68%	0.679	S	S	*	*			trans	-57	104.6	167.8	-90.6	-178.6	170.1	0	0	107.9	S251	E249-S251 PolarHBondContact O-N 3.22Å
250	L	27.8	Very low	30.9	Very low	131 Å²	131	125.8 Å²	125.8	69%	0.686	65%	0.647	S	S	*	*			trans	-64.5	7.3	178.5	-72.1	162.5	0	0	0	113.2	V248 T252 I253	V248-L250 PolarHBondContact O-N 3.45Å; L250-T252 VanDerWaalsContact C-N 3.31Å; L250-T252 PolarHBondContact O-N 3.23Å; L250-I253 HydrophobicContact CB-CD1 4.46Å; L250-I253 HydrophobicContact CD2-CD1 3.87Å
251	S	30	Very low	31.8	Very low	83 Å²	83	122.8 Å²	122.8	58%	0.58	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	63.6	-174.9	38	0	0	0	0	112.4	E249	E249-S251 PolarHBondContact O-N 3.22Å
252	T	31.1	Very low	32.8	Very low	137 Å²	137	123.8 Å²	123.8	84%	0.84	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-175.5	43.7	140.1	18.7	0	0	0	0	112.5	L250 R254	L250-T252 VanDerWaalsContact C-N 3.31Å; L250-T252 PolarHBondContact O-N 3.23Å; T252-R254 PolarHBondContact O-N 3.38Å; T252-R254 VanDerWaalsContact O-N 3.1Å
253	I	28.2	Very low	33.7	Very low	76 Å²	76	116.1 Å²	116.1	39%	0.39	60%	0.601	S	S	.	*			trans	-69.5	105.5	166.9	-60.8	169.2	0	0	0	107.9	I217 L250 Q255	I217-I253 HydrophobicContact CG2-CG2 4.31Å; L250-I253 HydrophobicContact CB-CD1 4.46Å; L250-I253 HydrophobicContact CD2-CD1 3.87Å; I253-Q255 HydrophobicContact CG2-CG 4.35Å; I253-Q255 PolarHBondContact O-N 3.25Å
254	R	28.8	Very low	34.8	Very low	210 Å²	210	109.3 Å²	109.3	79%	0.792	57%	0.568	S	S	*	*			trans	-80.8	104.2	169.8	-75.5	-168	178.9	-167.7	0.5	109.1	T252	T252-R254 PolarHBondContact O-N 3.38Å; T252-R254 VanDerWaalsContact O-N 3.1Å
255	Q	30.6	Very low	35.8	Very low	99 Å²	99	107.6 Å²	107.6	46%	0.463	55%	0.548	S	S	.	.			trans	-73.5	135.1	169.3	-71	170.1	-24	0	0	109.4	V215 I253 Y257	V215-Q255 HydrophobicContact CG1-CG 4.26Å; I253-Q255 HydrophobicContact CG2-CG 4.35Å; I253-Q255 PolarHBondContact O-N 3.25Å; Q255-Y257 HydrophobicContact CB-CD2 4.24Å; Q255-Y257 HydrophobicContact CB-CE2 3.79Å; Q255-Y257 PolarHBondContact OE1-OH 3.17Å
256	I	38.5	Very low	36.9	Very low	93 Å²	93	102 Å²	102	48%	0.477	52%	0.518	S	S	.	.	B	Isolated β-bridge	trans	-103.9	111.6	169.3	-59	173.9	0	0	0	106.3	L224	L224-I256 HydrophobicContact CD2-CD1 4.48Å
257	Y	36.5	Very low	37.9	Very low	149 Å²	149	102.3 Å²	102.3	58%	0.584	51%	0.509	S	S	*	.			trans	-85.7	124.7	173.6	-72.5	-92.1	0	0	0	108.8	V215 Q255	V215-Y257 HydrophobicContact CG2-CE1 4.49Å; Q255-Y257 HydrophobicContact CB-CD2 4.24Å; Q255-Y257 HydrophobicContact CB-CE2 3.79Å; Q255-Y257 PolarHBondContact OE1-OH 3.17Å
258	L	41.6	Very low	38.7	Very low	52 Å²	52	94.4 Å²	94.4	27%	0.272	49%	0.493	S	S	.	.			trans	-109.9	107.2	168.9	-68.4	173.3	0	0	0	107.5	F216 L260 L266 I322	F216-L258 HydrophobicContact CD2-CD1 4.45Å; F216-L258 HydrophobicContact CE2-CD1 3.81Å; L258-L260 PolarHBondContact O-N 3.44Å; L258-L266 HydrophobicContact CD1-CD1 4.04Å; L258-I322 HydrophobicContact CD1-CD1 4.48Å
259	D	43.2	Very low	39.4	Very low	142 Å²	142	89.4 Å²	89.4	76%	0.759	47%	0.466	S	S	*	.			trans	-76.5	97.1	169	-74.3	-21.8	0	0	0	108.2
260	L	44.9	Very low	40.3	Very low	8 Å²	8	85.3 Å²	85.3	4%	0.042	45%	0.448	C	S	.	.			trans	-81.7	125.4	175.4	-63.4	166.7	0	0	0	107.6	P211 S212 V214 L258 N264 L266 A295	P211-L260 WeakPolarHBondContact CB-O 3.32Å; P211-L260 WeakPolarHBondContact CG-O 3.15Å; S212-L260 WeakPolarHBondContact O-CD1 3.4Å; V214-L260 HydrophobicContact CG2-CD1 4.42Å; L258-L260 PolarHBondContact O-N 3.44Å; L260-N264 HydrophobicContact CB-CB 4.17Å; L260-N264 WeakPolarHBondContact CB-O 3.34Å; L260-N264 WeakPolarHBondContact CD1-O 3.04Å; L260-L266 HydrophobicContact CD1-CD1 4.33Å; L260-L266 HydrophobicContact CD1-CD2 3.84Å; L260-L266 HydrophobicContact CD1-CG 3.63Å; L260-L266 HydrophobicContact CD2-CD2 3.8Å; L260-L266 HydrophobicContact CD2-CG 4.37Å; L260-A295 HydrophobicContact CD2-CB 4.28Å
261	P	44.9	Very low	41.3	Very low	71 Å²	71	79.6 Å²	79.6	46%	0.461	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-63.6	156.8	-178.4	22.6	-31.5	0	0	0	113.4	G263 N264	P261-G263 PolarHBondContact O-N 2.9Å; P261-N264 VanDerWaalsContact O-CB 3.28Å; P261-N264 WeakPolarHBondContact O-CB 3.47Å; P261-N264 PolarHBondContact O-N 3.04Å; P261-N264 PolarHBondContact O-ND2 3.36Å
262	N	50.6	Low	42.1	Very low	140 Å²	140	80.8 Å²	80.8	75%	0.749	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	59.2	29.2	163.8	-57.3	-14.9	0	0	0	118.7	N264	N262-N264 VanDerWaalsContact C-N 3.32Å
263	G	46.7	Very low	42.8	Very low	21 Å²	21	79.2 Å²	79.2	22%	0.216	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	88.3	1.2	178.6	0	0	0	0	0	113.4	S212 P261 P298	S212-G263 PolarHBondContact OG-O 2.69Å; P261-G263 PolarHBondContact O-N 2.9Å; G263-P298 WeakPolarHBondContact O-CD 3.4Å
264	N	47.5	Very low	43.8	Very low	20 Å²	20	76.7 Å²	76.7	11%	0.107	40%	0.4	C	S	.	.			trans	-68.2	134.7	-168.8	-63.3	-17	0	0	0	112.8	S212 L260 P261 N262 L296 S297	S212-N264 PolarHBondContact OG-O 3.13Å; L260-N264 HydrophobicContact CB-CB 4.17Å; L260-N264 WeakPolarHBondContact CB-O 3.34Å; L260-N264 WeakPolarHBondContact CD1-O 3.04Å; P261-N264 VanDerWaalsContact O-CB 3.28Å; P261-N264 WeakPolarHBondContact O-CB 3.47Å; P261-N264 PolarHBondContact O-N 3.04Å; P261-N264 PolarHBondContact O-ND2 3.36Å; N262-N264 VanDerWaalsContact C-N 3.32Å; N264-L296 CarbonylContact C-O 3.52Å; N264-L296 WeakPolarHBondContact CA-O 3.14Å; N264-L296 WeakPolarHBondContact CB-O 3.35Å; N264-S297 WeakPolarHBondContact OD1-CA 3.2Å; N264-S297 VanDerWaalsContact OD1-CB 3.27Å; N264-S297 WeakPolarHBondContact OD1-CB 3.4Å
265	Y	49.1	Very low	44.6	Very low	75 Å²	75	68.1 Å²	68.1	29%	0.294	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	161.5	-179.9	61.4	-85.3	0	0	0	111.5	S212 E267 A295 L296	S212-Y265 WeakPolarHBondContact OG-CA 3.48Å; S212-Y265 VanDerWaalsContact OG-CB 3.29Å; S212-Y265 WeakPolarHBondContact OG-CB 3.4Å; S212-Y265 PolarHBondContact OG-N 3.42Å; S212-Y265 VanDerWaalsContact OG-N 3.11Å; Y265-E267 HydrophobicContact CE2-CB 4.31Å; Y265-A295 CarbonylContact O-C 3.59Å; Y265-A295 VanDerWaalsContact O-CA 3.27Å; Y265-A295 WeakPolarHBondContact O-CA 3.48Å; Y265-L296 WeakPolarHBondContact CD1-O 3.29Å; Y265-L296 HydrophobicContact CE1-CB 4.03Å; Y265-L296 HydrophobicContact CE2-CB 4.1Å; Y265-L296 HydrophobicContact CE2-CD1 4.19Å; Y265-L296 PolarHBondContact N-O 2.86Å; Y265-L296 PolarHBondContact O-N 3.34Å
266	L	49.2	Very low	45.4	Very low	27 Å²	27	66.3 Å²	66.3	14%	0.141	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	129.1	177.1	-58.8	177.5	0	0	0	112	V214 F216 L258 L260 V293 I294 A295 I322	V214-L266 HydrophobicContact CB-CB 4.5Å; V214-L266 HydrophobicContact CB-CD1 4.09Å; V214-L266 HydrophobicContact CB-CG 4.34Å; V214-L266 HydrophobicContact CG1-CD1 4.35Å; V214-L266 HydrophobicContact CG2-CB 3.99Å; V214-L266 HydrophobicContact CG2-CD1 4.39Å; V214-L266 HydrophobicContact CG2-CG 4.09Å; F216-L266 HydrophobicContact CE2-CD1 3.96Å; F216-L266 HydrophobicContact CZ-CD1 3.85Å; L258-L266 HydrophobicContact CD1-CD1 4.04Å; L260-L266 HydrophobicContact CD1-CD1 4.33Å; L260-L266 HydrophobicContact CD1-CD2 3.84Å; L260-L266 HydrophobicContact CD1-CG 3.63Å; L260-L266 HydrophobicContact CD2-CD2 3.8Å; L260-L266 HydrophobicContact CD2-CG 4.37Å; L266-V293 HydrophobicContact CB-CG1 3.71Å; L266-V293 HydrophobicContact CD1-CG1 4.1Å; L266-V293 HydrophobicContact CD2-CG1 4.01Å; L266-V293 HydrophobicContact CG-CG1 4.13Å; L266-I294 CarbonylContact C-O 3.6Å; L266-I294 VanDerWaalsContact CA-O 3.31Å; L266-I294 WeakPolarHBondContact CA-O 3.31Å; L266-A295 HydrophobicContact CD2-CB 3.75Å; L266-I322 HydrophobicContact CD2-CG2 4.3Å
267	E	47	Very low	45.5	Very low	96 Å²	96	66.4 Å²	66.4	45%	0.449	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	141.8	173	-171.7	175.9	173.9	0	0	111.1	Y265 V293 I294 L296	Y265-E267 HydrophobicContact CE2-CB 4.31Å; E267-V293 CarbonylContact O-C 3.43Å; E267-V293 WeakPolarHBondContact O-CA 3.34Å; E267-I294 PolarHBondContact N-O 3.25Å; E267-I294 PolarHBondContact O-N 3.32Å; E267-L296 HydrophobicContact CB-CD1 4.2Å; E267-L296 VanDerWaalsContact OE2-CD1 3.24Å; E267-L296 WeakPolarHBondContact OE2-CD1 3.5Å
268	A	43.6	Very low	45.9	Very low	66 Å²	66	63.3 Å²	63.3	55%	0.545	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	115.5	172.3	0	0	0	0	0	109.9	V292	A268-V292 CarbonylContact C-O 3.58Å; A268-V292 WeakPolarHBondContact CA-O 3.47Å
269	A	43.9	Very low	45.7	Very low	23 Å²	23	68.2 Å²	68.2	19%	0.19	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	151.8	-179.7	0	0	0	0	0	111.6	A271 Y291 V292 I294	A269-A271 PolarHBondContact O-N 3.02Å; A269-Y291 CarbonylContact O-C 3.5Å; A269-Y291 WeakPolarHBondContact O-CA 3.21Å; A269-V292 PolarHBondContact N-O 3.45Å; A269-V292 PolarHBondContact O-N 2.77Å; A269-I294 HydrophobicContact CB-CD1 3.24Å; A269-I294 HydrophobicContact CB-CG1 3.78Å
270	L	43.5	Very low	45.4	Very low	72 Å²	72	66.3 Å²	66.3	38%	0.377	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	120.6	173.8	-81.3	163.9	0	0	0	110.4	P272 N273 R290 Y291	L270-P272 VanDerWaalsContact C-N 3.35Å; L270-N273 PolarHBondContact O-N 3.08Å; L270-N273 VanDerWaalsContact O-N 3.16Å; L270-R290 WeakPolarHBondContact CA-O 3.35Å; L270-R290 WeakPolarHBondContact CD2-O 3.31Å; L270-Y291 HydrophobicContact CD1-CE1 4.49Å; L270-Y291 HydrophobicContact CD2-CD1 3.94Å; L270-Y291 HydrophobicContact CD2-CE1 3.51Å; L270-Y291 HydrophobicContact CD2-CE2 4.18Å; L270-Y291 HydrophobicContact CD2-CG 4.45Å; L270-Y291 HydrophobicContact CG-CD1 4Å; L270-Y291 HydrophobicContact CG-CE1 3.6Å
271	A	47.8	Very low	44.9	Very low	11 Å²	11	75.5 Å²	75.5	9%	0.091	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-56	-35.8	-177.7	0	0	0	0	0	115.6	A269 N273 L274 H288 G289 R290 V292	A269-A271 PolarHBondContact O-N 3.02Å; A271-N273 PolarHBondContact O-N 2.75Å; A271-L274 PolarHBondContact O-N 2.85Å; A271-H288 HydrophobicContact CB-CB 3.5Å; A271-G289 WeakPolarHBondContact CB-O 3.31Å; A271-R290 PolarHBondContact N-O 3.15Å; A271-V292 HydrophobicContact CB-CG1 3.94Å
272	P	47.5	Very low	44.4	Very low	108 Å²	108	77.6 Å²	77.6	70%	0.701	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-64.7	-19.7	179.3	-23.3	34.6	0	0	0	114.9	L270 L274	L270-P272 VanDerWaalsContact C-N 3.35Å; P272-L274 VanDerWaalsContact C-N 3.34Å
273	N	45.9	Very low	43.5	Very low	104 Å²	104	78.6 Å²	78.6	56%	0.556	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-91.5	7.6	-174.5	-66.3	-12	0	0	0	113.1	L270 A271	L270-N273 PolarHBondContact O-N 3.08Å; L270-N273 VanDerWaalsContact O-N 3.16Å; A271-N273 PolarHBondContact O-N 2.75Å
274	L	48.3	Very low	43	Very low	24 Å²	24	82.7 Å²	82.7	13%	0.126	46%	0.458	C	S	.	.			trans	-99.4	123.4	-177.8	-74.2	167.7	0	0	0	112.9	A271 P272 L276 V292 I294 F315	A271-L274 PolarHBondContact O-N 2.85Å; P272-L274 VanDerWaalsContact C-N 3.34Å; L274-L276 HydrophobicContact CB-CD1 4.48Å; L274-L276 HydrophobicContact CB-CG 4.29Å; L274-L276 PolarHBondContact O-N 2.85Å; L274-L276 VanDerWaalsContact O-N 3.13Å; L274-V292 HydrophobicContact CD1-CG2 3.37Å; L274-I294 HydrophobicContact CD1-CD1 3.91Å; L274-I294 HydrophobicContact CD1-CG1 4.33Å; L274-I294 HydrophobicContact CD2-CD1 3.5Å; L274-I294 VanDerWaalsContact CD2-CD1 3.5Å; L274-I294 HydrophobicContact CG-CD1 4.17Å; L274-F315 HydrophobicContact CD2-CB 4.44Å; L274-F315 HydrophobicContact CD2-CD1 4.32Å; L274-F315 HydrophobicContact CD2-CD2 3.37Å; L274-F315 HydrophobicContact CD2-CE1 4.47Å; L274-F315 HydrophobicContact CD2-CE2 3.56Å; L274-F315 HydrophobicContact CD2-CG 3.8Å; L274-F315 HydrophobicContact CD2-CZ 4.13Å
275	P	45.9	Very low	42.4	Very low	29 Å²	29	89.2 Å²	89.2	19%	0.188	49%	0.492	C	S	.	.			trans	-75.1	97.2	169.3	34.5	-40.4	0	0	0	110.7	H312 P313 F315	P275-H312 HydrophobicContact CB-CB 3.59Å; P275-H312 HydrophobicContact CG-CB 3.45Å; P275-H312 VanDerWaalsContact CG-CB 3.45Å; P275-P313 WeakPolarHBondContact CG-O 3.47Å; P275-F315 HydrophobicContact CG-CD2 4.27Å; P275-F315 PolarHBondContact O-N 3.41Å
276	L	48.1	Very low	42	Very low	61 Å²	61	89.9 Å²	89.9	32%	0.319	51%	0.508	S	S	.	.	B	Isolated β-bridge	trans	-95.6	142.1	-179.4	-70.9	158.1	0	0	0	111.1	L274 S278 Y323	L274-L276 HydrophobicContact CB-CD1 4.48Å; L274-L276 HydrophobicContact CB-CG 4.29Å; L274-L276 PolarHBondContact O-N 2.85Å; L274-L276 VanDerWaalsContact O-N 3.13Å; L276-S278 PolarHBondContact O-N 2.78Å; L276-S278 VanDerWaalsContact O-N 3.17Å; L276-Y323 HydrophobicContact CD2-CD1 3.66Å; L276-Y323 HydrophobicContact CD2-CE1 3.46Å; L276-Y323 VanDerWaalsContact CD2-CE1 3.46Å
277	I	40.6	Very low	41.8	Very low	95 Å²	95	95.3 Å²	95.3	49%	0.487	53%	0.533	S	S	.	.			trans	-72.1	105.4	170.8	-63.8	168.3	0	0	0	108.1
278	S	45.1	Very low	41.5	Very low	85 Å²	85	93.1 Å²	93.1	59%	0.594	52%	0.522	S	S	*	.			trans	-123.7	85.5	161.8	63.3	0	0	0	0	109.6	L276 T280	L276-S278 PolarHBondContact O-N 2.78Å; L276-S278 VanDerWaalsContact O-N 3.17Å; S278-T280 PolarHBondContact O-N 2.89Å
279	D	37	Very low	41.4	Very low	155 Å²	155	92.4 Å²	92.4	83%	0.829	52%	0.521	S	S	*	.			trans	-71.3	71	156.7	-79.1	-32.7	0	0	0	108.2
280	T	35.7	Very low	41.1	Very low	101 Å²	101	98.8 Å²	98.8	62%	0.62	54%	0.54	S	S	*	.	S	Bend	trans	-176.3	123.5	161.9	12.8	0	0	0	0	105.9	S278 N282	S278-T280 PolarHBondContact O-N 2.89Å; T280-N282 PolarHBondContact O-N 2.89Å
281	Q	34	Very low	40.9	Very low	201 Å²	201	102.3 Å²	102.3	94%	0.939	55%	0.549	S	S	*	.			trans	-63.9	64.2	176.2	-75.4	-119.9	3	0	0	112.1
282	N	34.8	Very low	40.8	Very low	116 Å²	116	102.5 Å²	102.5	62%	0.62	55%	0.55	S	S	*	.			trans	-115.8	101.7	168.4	-90.8	-26.3	0	0	0	107.2	T280 N284	T280-N282 PolarHBondContact O-N 2.89Å; N282-N284 PolarHBondContact O-N 2.83Å
283	N	32.4	Very low	40.8	Very low	160 Å²	160	100 Å²	100	86%	0.856	53%	0.532	S	S	*	.			trans	-62.8	40.2	171.5	-90.8	-25.5	0	0	0	113.3	N285	N283-N285 PolarHBondContact O-N 3.37Å
284	N	36.4	Very low	40.9	Very low	108 Å²	108	95.5 Å²	95.5	58%	0.578	51%	0.508	S	S	*	.			trans	-97.8	72.9	178	-74	-16.9	0	0	0	109.7	N282 S286	N282-N284 PolarHBondContact O-N 2.83Å; N284-S286 PolarHBondContact O-N 3.08Å
285	N	35.5	Very low	41	Very low	156 Å²	156	94.3 Å²	94.3	83%	0.834	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	15.4	161.8	-76	-6.8	0	0	0	112.9	N283	N283-N285 PolarHBondContact O-N 3.37Å
286	S	40.4	Very low	41.1	Very low	90 Å²	90	93.8 Å²	93.8	63%	0.629	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-9.1	-164.8	57.4	0	0	0	0	115.3	N284 H288	N284-S286 PolarHBondContact O-N 3.08Å; S286-H288 VanDerWaalsContact C-N 3.26Å; S286-H288 PolarHBondContact O-N 3.04Å
287	E	43.5	Very low	41.2	Very low	141 Å²	141	92.3 Å²	92.3	66%	0.659	49%	0.492	S	S	*	.	S	Bend	trans	-74.5	-14.8	178.8	-82	-160.3	172.1	0	0	114.1	K317	E287-K317 IonicContact OE2-NZ 3.17Å; E287-K317 PolarHBondContact OE2-NZ 2.78Å
288	H	40.8	Very low	41.6	Very low	50 Å²	50	91.3 Å²	91.3	23%	0.231	49%	0.492	C	S	.	.	S	Bend	trans	-109	131.4	-172	-51.2	87.9	0	0	0	110.3	A271 S286 V292 Y323	A271-H288 HydrophobicContact CB-CB 3.5Å; S286-H288 VanDerWaalsContact C-N 3.26Å; S286-H288 PolarHBondContact O-N 3.04Å; H288-V292 HydrophobicContact CB-CG1 4.09Å; H288-Y323 AromaticContact CD2-CZ 3.59Å; H288-Y323 PolarHBondContact CD2-OH 3.17Å; H288-Y323 AromaticContact NE2-CE1 3.82Å; H288-Y323 AromaticContact NE2-CZ 3.44Å; H288-Y323 PolarHBondContact NE2-OH 3.14Å
289	G	43	Very low	41.9	Very low	50 Å²	50	95 Å²	95	52%	0.515	50%	0.5	S	S	.	.			trans	-63.7	172.6	168.2	0	0	0	0	0	111.2	A271 Y291	A271-G289 WeakPolarHBondContact CB-O 3.31Å; G289-Y291 PolarHBondContact O-N 2.81Å
290	R	37.6	Very low	42.5	Very low	157 Å²	157	91.1 Å²	91.1	59%	0.592	48%	0.475	S	S	*	.	S	Bend	trans	-50.7	-37.1	178.5	-89.3	-170.2	-175.2	166.3	7.9	112.5	H65 L270 A271	H65-R290 PolarHBondContact CE1-NH1 3.4Å; H65-R290 PolarHBondContact NE2-NH1 3.19Å; H65-R290 VanDerWaalsContact NE2-NH1 3.15Å; L270-R290 WeakPolarHBondContact CA-O 3.35Å; L270-R290 WeakPolarHBondContact CD2-O 3.31Å; A271-R290 PolarHBondContact N-O 3.15Å
291	Y	38.7	Very low	42.6	Very low	146 Å²	146	93.4 Å²	93.4	57%	0.573	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	145.7	176.4	-59.1	-92.4	0	0	0	111.1	A269 L270 G289	A269-Y291 CarbonylContact O-C 3.5Å; A269-Y291 WeakPolarHBondContact O-CA 3.21Å; L270-Y291 HydrophobicContact CD1-CE1 4.49Å; L270-Y291 HydrophobicContact CD2-CD1 3.94Å; L270-Y291 HydrophobicContact CD2-CE1 3.51Å; L270-Y291 HydrophobicContact CD2-CE2 4.18Å; L270-Y291 HydrophobicContact CD2-CG 4.45Å; L270-Y291 HydrophobicContact CG-CD1 4Å; L270-Y291 HydrophobicContact CG-CE1 3.6Å; G289-Y291 PolarHBondContact O-N 2.81Å
292	V	45.3	Very low	42.6	Very low	16 Å²	16	88.3 Å²	88.3	10%	0.097	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	159.2	170.5	-68.9	0	0	0	0	109.5	A268 A269 A271 L274 H288 I294 Y323	A268-V292 CarbonylContact C-O 3.58Å; A268-V292 WeakPolarHBondContact CA-O 3.47Å; A269-V292 PolarHBondContact N-O 3.45Å; A269-V292 PolarHBondContact O-N 2.77Å; A271-V292 HydrophobicContact CB-CG1 3.94Å; L274-V292 HydrophobicContact CD1-CG2 3.37Å; H288-V292 HydrophobicContact CB-CG1 4.09Å; V292-I294 HydrophobicContact CG2-CG1 4.26Å; V292-Y323 HydrophobicContact CB-CD2 4.21Å; V292-Y323 HydrophobicContact CB-CE2 4.2Å; V292-Y323 HydrophobicContact CG1-CE2 4.11Å; V292-Y323 HydrophobicContact CG2-CD2 4.49Å
293	V	48.3	Very low	42.6	Very low	55 Å²	55	87.1 Å²	87.1	33%	0.333	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	120.7	175.8	-176.5	0	0	0	0	108.8	L266 E267 Y323	L266-V293 HydrophobicContact CB-CG1 3.71Å; L266-V293 HydrophobicContact CD1-CG1 4.1Å; L266-V293 HydrophobicContact CD2-CG1 4.01Å; L266-V293 HydrophobicContact CG-CG1 4.13Å; E267-V293 CarbonylContact O-C 3.43Å; E267-V293 WeakPolarHBondContact O-CA 3.34Å; V293-Y323 PolarHBondContact O-N 3.3Å
294	I	47.8	Very low	42.5	Very low	9 Å²	9	84 Å²	84	5%	0.046	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	137.1	179	-50.3	-178.2	0	0	0	108.7	L266 E267 A269 L274 V292 L296 F315 Y323	L266-I294 CarbonylContact C-O 3.6Å; L266-I294 VanDerWaalsContact CA-O 3.31Å; L266-I294 WeakPolarHBondContact CA-O 3.31Å; E267-I294 PolarHBondContact N-O 3.25Å; E267-I294 PolarHBondContact O-N 3.32Å; A269-I294 HydrophobicContact CB-CD1 3.24Å; A269-I294 HydrophobicContact CB-CG1 3.78Å; L274-I294 HydrophobicContact CD1-CD1 3.91Å; L274-I294 HydrophobicContact CD1-CG1 4.33Å; L274-I294 HydrophobicContact CD2-CD1 3.5Å; L274-I294 VanDerWaalsContact CD2-CD1 3.5Å; L274-I294 HydrophobicContact CG-CD1 4.17Å; V292-I294 HydrophobicContact CG2-CG1 4.26Å; I294-L296 HydrophobicContact CG2-CD2 3.66Å; I294-L296 HydrophobicContact CG2-CG 4.04Å; I294-F315 HydrophobicContact CD1-CE1 4.48Å; I294-F315 HydrophobicContact CG2-CD1 3.87Å; I294-F315 HydrophobicContact CG2-CE1 3.58Å; I294-Y323 CarbonylContact C-O 3.34Å; I294-Y323 WeakPolarHBondContact CA-O 3.21Å; I294-Y323 WeakPolarHBondContact CG2-O 3.2Å
295	A	49.6	Very low	42.4	Very low	0 Å²	0	85.3 Å²	85.3	0%	0	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	115.2	168.2	0	0	0	0	0	109.8	L260 Y265 L266 I322 Y323 F324 P325	L260-A295 HydrophobicContact CD2-CB 4.28Å; Y265-A295 CarbonylContact O-C 3.59Å; Y265-A295 VanDerWaalsContact O-CA 3.27Å; Y265-A295 WeakPolarHBondContact O-CA 3.48Å; L266-A295 HydrophobicContact CD2-CB 3.75Å; A295-I322 HydrophobicContact CB-CG2 4.19Å; A295-Y323 PolarHBondContact N-O 2.83Å; A295-F324 HydrophobicContact CB-CD1 3.64Å; A295-F324 HydrophobicContact CB-CE1 3.45Å; A295-F324 VanDerWaalsContact CB-CE1 3.45Å; A295-F324 HydrophobicContact CB-CG 4.3Å; A295-F324 HydrophobicContact CB-CZ 3.96Å; A295-P325 WeakPolarHBondContact O-CD 3.37Å
296	L	48.2	Very low	42.1	Very low	17 Å²	17	84.7 Å²	84.7	9%	0.089	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	146.5	-176.9	-64.8	177.7	0	0	0	111.6	N264 Y265 E267 I294 F300 F315 P325	N264-L296 CarbonylContact C-O 3.52Å; N264-L296 WeakPolarHBondContact CA-O 3.14Å; N264-L296 WeakPolarHBondContact CB-O 3.35Å; Y265-L296 WeakPolarHBondContact CD1-O 3.29Å; Y265-L296 HydrophobicContact CE1-CB 4.03Å; Y265-L296 HydrophobicContact CE2-CB 4.1Å; Y265-L296 HydrophobicContact CE2-CD1 4.19Å; Y265-L296 PolarHBondContact N-O 2.86Å; Y265-L296 PolarHBondContact O-N 3.34Å; E267-L296 HydrophobicContact CB-CD1 4.2Å; E267-L296 VanDerWaalsContact OE2-CD1 3.24Å; E267-L296 WeakPolarHBondContact OE2-CD1 3.5Å; I294-L296 HydrophobicContact CG2-CD2 3.66Å; I294-L296 HydrophobicContact CG2-CG 4.04Å; L296-F300 HydrophobicContact CD2-CD1 4.5Å; L296-F315 HydrophobicContact CD2-CE1 4.13Å; L296-P325 HydrophobicContact CD2-CG 4.3Å
297	S	49.9	Very low	41.5	Very low	30 Å²	30	86.6 Å²	86.6	21%	0.21	47%	0.471	C	S	.	.			trans	-83.1	144.2	173.6	-177.9	0	0	0	0	111.5	N264 H299 F300	N264-S297 WeakPolarHBondContact OD1-CA 3.2Å; N264-S297 VanDerWaalsContact OD1-CB 3.27Å; N264-S297 WeakPolarHBondContact OD1-CB 3.4Å; S297-H299 PolarHBondContact O-N 2.94Å; S297-F300 WeakPolarHBondContact O-CB 3.44Å; S297-F300 PolarHBondContact O-N 2.73Å
298	P	49.8	Very low	40.6	Very low	74 Å²	74	86 Å²	86	48%	0.481	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-21.8	176.1	21.4	-31	0	0	0	113.9	G263 F300	G263-P298 WeakPolarHBondContact O-CD 3.4Å; P298-F300 VanDerWaalsContact C-N 3.26Å
299	H	50.3	Low	40.1	Very low	164 Å²	164	89.5 Å²	89.5	76%	0.759	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-3.9	173	-61.8	-56.2	0	0	0	113.7	S297 N301	S297-H299 PolarHBondContact O-N 2.94Å; H299-N301 VanDerWaalsContact C-N 3.32Å; H299-N301 PolarHBondContact O-N 2.79Å
300	F	49.5	Very low	39.6	Very low	72 Å²	72	94.4 Å²	94.4	32%	0.316	51%	0.51	S	S	.	.	S	Bend	trans	-76.5	88.5	175.1	-151.2	-92.7	0	0	0	107.7	L296 S297 P298 S302 P313 P325	L296-F300 HydrophobicContact CD2-CD1 4.5Å; S297-F300 WeakPolarHBondContact O-CB 3.44Å; S297-F300 PolarHBondContact O-N 2.73Å; P298-F300 VanDerWaalsContact C-N 3.26Å; F300-S302 PolarHBondContact O-N 2.99Å; F300-P313 HydrophobicContact CE1-CG 4.48Å; F300-P313 HydrophobicContact CZ-CB 4.13Å; F300-P313 HydrophobicContact CZ-CG 3.75Å; F300-P325 HydrophobicContact CD2-CB 4.5Å; F300-P325 HydrophobicContact CD2-CG 4.49Å; F300-P325 HydrophobicContact CE2-CB 3.9Å; F300-P325 HydrophobicContact CE2-CG 4.36Å; F300-P325 HydrophobicContact CZ-CB 4.33Å
301	N	39	Very low	39.5	Very low	150 Å²	150	92.2 Å²	92.2	80%	0.802	52%	0.519	S	S	*	.			trans	-55.2	102	176.4	-79.6	-19.8	0	0	0	109.1	H299 P303	H299-N301 VanDerWaalsContact C-N 3.32Å; H299-N301 PolarHBondContact O-N 2.79Å; N301-P303 VanDerWaalsContact O-CD 3.22Å; N301-P303 WeakPolarHBondContact O-CD 3.45Å
302	S	33.8	Very low	39.6	Very low	93 Å²	93	89.8 Å²	89.8	65%	0.65	51%	0.512	S	S	*	.			trans	-63.1	117.1	179.5	55.7	0	0	0	0	110.1	F300 S304	F300-S302 PolarHBondContact O-N 2.99Å; S302-S304 PolarHBondContact O-N 3.2Å
303	P	35.2	Very low	39.7	Very low	91 Å²	91	90.8 Å²	90.8	59%	0.591	52%	0.519	S	S	*	.			trans	-82	103.2	163.3	-0.2	20.6	0	0	0	106.7	N301 T305 L307	N301-P303 VanDerWaalsContact O-CD 3.22Å; N301-P303 WeakPolarHBondContact O-CD 3.45Å; P303-T305 PolarHBondContact O-N 2.88Å; P303-L307 HydrophobicContact CB-CD1 4.02Å
304	S	30.7	Very low	40	Very low	96 Å²	96	95.9 Å²	95.9	67%	0.671	53%	0.532	S	S	*	.			trans	-35.3	117.4	161.7	44.1	0	0	0	0	112.6	S302 D306	S302-S304 PolarHBondContact O-N 3.2Å; S304-D306 VanDerWaalsContact C-N 3.27Å; S304-D306 PolarHBondContact O-N 2.79Å
305	T	33.3	Very low	40.3	Very low	135 Å²	135	96.2 Å²	96.2	83%	0.828	53%	0.534	S	S	*	.	S	Bend	trans	53	-17.6	146.3	-7	0	0	0	0	122.3	P303	P303-T305 PolarHBondContact O-N 2.88Å
306	D	29.2	Very low	40.6	Very low	142 Å²	142	102.3 Å²	102.3	76%	0.759	56%	0.56	S	S	*	*			trans	-147.5	75.5	-173.4	-80	-46.5	0	0	0	112.3	S304	S304-D306 VanDerWaalsContact C-N 3.27Å; S304-D306 PolarHBondContact O-N 2.79Å
307	L	27.1	Very low	40.7	Very low	131 Å²	131	105.8 Å²	105.8	69%	0.686	58%	0.575	S	S	*	*			trans	-138.7	98	164	-83.6	173.4	0	0	0	112.1	P303 I309	P303-L307 HydrophobicContact CB-CD1 4.02Å; L307-I309 PolarHBondContact O-N 3.06Å
308	V	25	Very low	40.7	Very low	127 Å²	127	106.2 Å²	106.2	77%	0.77	58%	0.577	S	S	*	*				26.1	97.8	118.8	-171.7	0	0	0	0	113.8	N310	V308-N310 PolarHBondContact O-N 2.88Å; V308-N310 VanDerWaalsContact O-N 3.17Å
309	I	30	Very low	40.2	Very low	125 Å²	125	108 Å²	108	64%	0.641	59%	0.589	S	S	*	*	S	Bend	trans	-19.4	109.7	152.7	-48.4	168.4	0	0	0	110.4	L307	L307-I309 PolarHBondContact O-N 3.06Å
310	N	33.9	Very low	39.9	Very low	152 Å²	152	107.2 Å²	107.2	81%	0.813	59%	0.59	S	S	*	*	S	Bend	trans	169.7	-4	135	-82.7	-30.2	0	0	0	116.4	V308	V308-N310 PolarHBondContact O-N 2.88Å; V308-N310 VanDerWaalsContact O-N 3.17Å
311	S	34.9	Very low	39.8	Very low	112 Å²	112	108.2 Å²	108.2	78%	0.783	60%	0.599	S	S	*	*			trans	-131.7	74.3	170.4	62.6	0	0	0	0	111.1	P313	S311-P313 WeakPolarHBondContact O-CD 3.17Å
312	H	41	Very low	40.2	Very low	94 Å²	94	102.4 Å²	102.4	44%	0.435	57%	0.567	S	S	.	*			trans	-88.9	111	-172.1	-109.4	-23.4	0	0	0	109.4	P275 R314	P275-H312 HydrophobicContact CB-CB 3.59Å; P275-H312 HydrophobicContact CG-CB 3.45Å; P275-H312 VanDerWaalsContact CG-CB 3.45Å; H312-R314 PolarHBondContact O-N 2.9Å
313	P	47	Very low	41.1	Very low	37 Å²	37	98.1 Å²	98.1	24%	0.24	54%	0.537	C	S	.	.			trans	-61.8	130.9	173.9	21.5	-28.4	0	0	0	109.7	P275 F300 S311 F315	P275-P313 WeakPolarHBondContact CG-O 3.47Å; F300-P313 HydrophobicContact CE1-CG 4.48Å; F300-P313 HydrophobicContact CZ-CB 4.13Å; F300-P313 HydrophobicContact CZ-CG 3.75Å; S311-P313 WeakPolarHBondContact O-CD 3.17Å; P313-F315 HydrophobicContact CG-CE2 4.41Å; P313-F315 WeakPolarHBondContact O-CD2 3.36Å; P313-F315 WeakPolarHBondContact O-CE2 3.07Å
314	R	53.9	Low	42.1	Very low	162 Å²	162	96.5 Å²	96.5	61%	0.611	52%	0.521	S	S	*	.			trans	-77.8	138.4	-171.4	-66.7	-178.8	-178.9	177.9	-0.2	111	H312 E326	H312-R314 PolarHBondContact O-N 2.9Å; R314-E326 PolarHBondContact O-N 3.06Å
315	F	55.3	Low	43	Very low	16 Å²	16	93.2 Å²	93.2	7%	0.07	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	136.4	-179.4	-68.6	-94.5	0	0	0	111.5	L274 P275 I294 L296 P313 F324 P325	L274-F315 HydrophobicContact CD2-CB 4.44Å; L274-F315 HydrophobicContact CD2-CD1 4.32Å; L274-F315 HydrophobicContact CD2-CD2 3.37Å; L274-F315 HydrophobicContact CD2-CE1 4.47Å; L274-F315 HydrophobicContact CD2-CE2 3.56Å; L274-F315 HydrophobicContact CD2-CG 3.8Å; L274-F315 HydrophobicContact CD2-CZ 4.13Å; P275-F315 HydrophobicContact CG-CD2 4.27Å; P275-F315 PolarHBondContact O-N 3.41Å; I294-F315 HydrophobicContact CD1-CE1 4.48Å; I294-F315 HydrophobicContact CG2-CD1 3.87Å; I294-F315 HydrophobicContact CG2-CE1 3.58Å; L296-F315 HydrophobicContact CD2-CE1 4.13Å; P313-F315 HydrophobicContact CG-CE2 4.41Å; P313-F315 WeakPolarHBondContact O-CD2 3.36Å; P313-F315 WeakPolarHBondContact O-CE2 3.07Å; F315-F324 WeakPolarHBondContact CA-O 3.47Å; F315-P325 HydrophobicContact CD1-CB 4Å; F315-P325 HydrophobicContact CE1-CB 3.55Å; F315-P325 HydrophobicContact CE1-CG 4.1Å; F315-P325 HydrophobicContact CZ-CB 4.15Å
316	K	55.5	Low	43.6	Very low	128 Å²	128	90.9 Å²	90.9	56%	0.557	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.8	132.2	176.8	-171.6	174.4	-179.8	175.4	0	111.1	Y323 F324	K316-Y323 WeakPolarHBondContact O-CA 3.34Å; K316-F324 PolarHBondContact N-O 3.31Å; K316-F324 PolarHBondContact O-N 2.89Å; K316-F324 VanDerWaalsContact O-N 3.14Å
317	K	49.8	Very low	44.4	Very low	90 Å²	90	90 Å²	90	39%	0.391	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	123	173.8	-172.7	177.7	-175.9	177.8	0	110.2	E287 N321 Y323	E287-K317 IonicContact OE2-NZ 3.17Å; E287-K317 PolarHBondContact OE2-NZ 2.78Å; K317-N321 WeakPolarHBondContact CE-OD1 3.2Å; K317-Y323 HydrophobicContact CB-CD1 4.09Å; K317-Y323 HydrophobicContact CB-CE1 3.61Å; K317-Y323 HydrophobicContact CD-CE1 4.26Å; K317-Y323 WeakPolarHBondContact CD-OH 3.35Å; K317-Y323 HydrophobicContact CG-CE1 3.81Å
318	C	49.7	Very low	45.1	Very low	40 Å²	40	95.3 Å²	95.3	27%	0.27	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	166.6	173.7	-74.7	0	0	0	0	111.6	N321 I322 F324	C318-N321 PolarHBondContact O-N 3.48Å; C318-I322 WeakPolarHBondContact CB-O 3.49Å; C318-I322 PolarHBondContact N-O 3.1Å; C318-F324 HydrophobicContact CB-CD2 4.02Å; C318-F324 HydrophobicContact CB-CE2 3.92Å; C318-F324 WeakPolarHBondContact SG-CD2 2.86Å
319	P	40.2	Very low	46.1	Very low	111 Å²	111	93.8 Å²	93.8	72%	0.721	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	144.2	175	-22.4	32.5	0	0	0	111.3
320	N	44.3	Very low	46.9	Very low	147 Å²	147	92.1 Å²	92.1	79%	0.786	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	15.9	-172.6	-48.6	-38.6	0	0	0	116.4	I322	N320-I322 VanDerWaalsContact C-N 3.34Å; N320-I322 PolarHBondContact O-N 2.83Å
321	N	48.2	Very low	47.7	Very low	93 Å²	93	88.8 Å²	88.8	50%	0.497	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	33.2	178.3	-64.2	-25.3	0	0	0	114.3	K317 C318 Y323	K317-N321 WeakPolarHBondContact CE-OD1 3.2Å; C318-N321 PolarHBondContact O-N 3.48Å; N321-Y323 VanDerWaalsContact O-CE2 3.3Å; N321-Y323 WeakPolarHBondContact O-CE2 3.37Å
322	I	46.7	Very low	48.4	Very low	28 Å²	28	87.4 Å²	87.4	14%	0.144	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	138	170.6	-58.2	174.8	0	0	0	108.6	L258 L266 A295 C318 N320 F324	L258-I322 HydrophobicContact CD1-CD1 4.48Å; L266-I322 HydrophobicContact CD2-CG2 4.3Å; A295-I322 HydrophobicContact CB-CG2 4.19Å; C318-I322 WeakPolarHBondContact CB-O 3.49Å; C318-I322 PolarHBondContact N-O 3.1Å; N320-I322 VanDerWaalsContact C-N 3.34Å; N320-I322 PolarHBondContact O-N 2.83Å; I322-F324 HydrophobicContact CG2-CE2 4.07Å; I322-F324 HydrophobicContact CG2-CZ 4.44Å
323	Y	53	Low	48.9	Very low	3 Å²	3	87 Å²	87	1%	0.012	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	135.4	-177	-63.2	-99.6	0	0	0	110.6	L276 H288 V292 V293 I294 A295 K316 K317 N321	L276-Y323 HydrophobicContact CD2-CD1 3.66Å; L276-Y323 HydrophobicContact CD2-CE1 3.46Å; L276-Y323 VanDerWaalsContact CD2-CE1 3.46Å; H288-Y323 AromaticContact CD2-CZ 3.59Å; H288-Y323 PolarHBondContact CD2-OH 3.17Å; H288-Y323 AromaticContact NE2-CE1 3.82Å; H288-Y323 AromaticContact NE2-CZ 3.44Å; H288-Y323 PolarHBondContact NE2-OH 3.14Å; V292-Y323 HydrophobicContact CB-CD2 4.21Å; V292-Y323 HydrophobicContact CB-CE2 4.2Å; V292-Y323 HydrophobicContact CG1-CE2 4.11Å; V292-Y323 HydrophobicContact CG2-CD2 4.49Å; V293-Y323 PolarHBondContact O-N 3.3Å; I294-Y323 CarbonylContact C-O 3.34Å; I294-Y323 WeakPolarHBondContact CA-O 3.21Å; I294-Y323 WeakPolarHBondContact CG2-O 3.2Å; A295-Y323 PolarHBondContact N-O 2.83Å; K316-Y323 WeakPolarHBondContact O-CA 3.34Å; K317-Y323 HydrophobicContact CB-CD1 4.09Å; K317-Y323 HydrophobicContact CB-CE1 3.61Å; K317-Y323 HydrophobicContact CD-CE1 4.26Å; K317-Y323 WeakPolarHBondContact CD-OH 3.35Å; K317-Y323 HydrophobicContact CG-CE1 3.81Å; N321-Y323 VanDerWaalsContact O-CE2 3.3Å; N321-Y323 WeakPolarHBondContact O-CE2 3.37Å
324	F	54.6	Low	49	Very low	58 Å²	58	90.3 Å²	90.3	25%	0.254	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	141.5	176.1	-68.9	-96.2	0	0	0	110.8	A295 F315 K316 C318 I322	A295-F324 HydrophobicContact CB-CD1 3.64Å; A295-F324 HydrophobicContact CB-CE1 3.45Å; A295-F324 VanDerWaalsContact CB-CE1 3.45Å; A295-F324 HydrophobicContact CB-CG 4.3Å; A295-F324 HydrophobicContact CB-CZ 3.96Å; F315-F324 WeakPolarHBondContact CA-O 3.47Å; K316-F324 PolarHBondContact N-O 3.31Å; K316-F324 PolarHBondContact O-N 2.89Å; K316-F324 VanDerWaalsContact O-N 3.14Å; C318-F324 HydrophobicContact CB-CD2 4.02Å; C318-F324 HydrophobicContact CB-CE2 3.92Å; C318-F324 WeakPolarHBondContact SG-CD2 2.86Å; I322-F324 HydrophobicContact CG2-CE2 4.07Å; I322-F324 HydrophobicContact CG2-CZ 4.44Å
325	P	50.5	Low	48.6	Very low	27 Å²	27	85.2 Å²	85.2	18%	0.175	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	136	171	25.6	-29.2	0	0	0	110.5	A295 L296 F300 F315	A295-P325 WeakPolarHBondContact O-CD 3.37Å; L296-P325 HydrophobicContact CD2-CG 4.3Å; F300-P325 HydrophobicContact CD2-CB 4.5Å; F300-P325 HydrophobicContact CD2-CG 4.49Å; F300-P325 HydrophobicContact CE2-CB 3.9Å; F300-P325 HydrophobicContact CE2-CG 4.36Å; F300-P325 HydrophobicContact CZ-CB 4.33Å; F315-P325 HydrophobicContact CD1-CB 4Å; F315-P325 HydrophobicContact CE1-CB 3.55Å; F315-P325 HydrophobicContact CE1-CG 4.1Å; F315-P325 HydrophobicContact CZ-CB 4.15Å
326	E	46.7	Very low	48.1	Very low	85 Å²	85	90.5 Å²	90.5	40%	0.397	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-73.5	137.2	170.6	-73.6	-168.3	154.5	0	0	110.7	R314 M328	R314-E326 PolarHBondContact O-N 3.06Å; E326-M328 PolarHBondContact O-N 2.69Å
327	P	46.1	Very low	47.5	Very low	125 Å²	125	87.4 Å²	87.4	81%	0.812	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-63.4	133.6	167.6	25.7	-29.5	0	0	0	109.1
328	M	40.5	Very low	47.3	Very low	242 Å²	242	87.2 Å²	87.2	100%	1.192	48%	0.478	S	S	*	.			trans	-64.9	0	178.1	-78.6	-149.1	143.3	0	0	113.2	E326	E326-M328 PolarHBondContact O-N 2.69Å

Retrieved 328 of 328 residues in 55.4 ms (Link to these results)

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