A0A087Y2K2_POEFO Loading...

Aryl hydrocarbon receptor repressor

Mediates dioxin toxicity and is involved in regulation of cell growth and differentiation. Represses the transcription activity of AHR by competing with this transcription factor for heterodimer formation with the ARNT and subsequently binding to the xenobiotic response element (XRE) sequence present in the promoter regulatory region of variety of genes. Represses CYP1A1 by binding the XRE sequence and recruiting ANKRA2, HDAC4 and/or HDAC5. Autoregulates its expression by associating with its own XRE site.

AlphaFold DB , UniProt , Accession A0A087Y2K2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 682 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.2	Very low	43.9	Very low	236 Å²	236	139.5 Å²	139.5	100%	1.163	82%	0.824	S	S	*	*				0	138.7	0	-71.2	159.1	62.5	0	0	108.2
2	I	36.4	Very low	44.5	Very low	152 Å²	152	147.9 Å²	147.9	78%	0.779	83%	0.83	S	S	*	*			trans	-141.9	120.5	171.4	-51.1	176.3	0	0	0	108.1	P4	I2-P4 HydrophobicContact CG2-CG 4Å
3	P	44.5	Very low	45.1	Very low	121 Å²	121	151.8 Å²	151.8	79%	0.786	83%	0.833	S	S	*	*			trans	-105.4	104.9	155.2	32	-20.6	0	0	0	108.9	G5	P3-G5 PolarHBondContact O-N 2.72Å
4	P	49.3	Very low	45.7	Very low	117 Å²	117	158.3 Å²	158.3	76%	0.76	84%	0.839	S	S	*	*			trans	-73.1	112.3	170.9	-6.7	23.8	0	0	0	108.4	I2	I2-P4 HydrophobicContact CG2-CG 4Å
5	G	44.4	Very low	46.7	Very low	64 Å²	64	163.3 Å²	163.3	66%	0.66	84%	0.842	S	S	*	*			trans	-71.3	154.7	172.3	0	0	0	0	0	112	P3 C7	P3-G5 PolarHBondContact O-N 2.72Å; G5-C7 PolarHBondContact O-N 2.79Å
6	D	49.1	Very low	47.2	Very low	160 Å²	160	164.9 Å²	164.9	86%	0.856	84%	0.841	S	S	*	*			trans	-60.4	128.5	-177.6	-64	-81.1	0	0	0	113.4
7	C	44.6	Very low	47.1	Very low	127 Å²	127	162.4 Å²	162.4	86%	0.858	84%	0.838	S	S	*	*			trans	-128.8	75.8	169.3	-84.4	0	0	0	0	110.1	G5 Y9	G5-C7 PolarHBondContact O-N 2.79Å; C7-Y9 PolarHBondContact O-N 2.77Å
8	M	48.3	Very low	47.4	Very low	175 Å²	175	160.5 Å²	160.5	86%	0.862	83%	0.834	S	S	*	*			trans	-69.3	105.6	172.3	-78.8	-122.2	-70.7	0	0	111.1
9	Y	39.8	Very low	47.9	Very low	227 Å²	227	161.7 Å²	161.7	89%	0.89	84%	0.835	S	S	*	*			trans	-142.1	123.8	163.3	-123.2	-90.6	0	0	0	114.4	C7 G11	C7-Y9 PolarHBondContact O-N 2.77Å; Y9-G11 PolarHBondContact O-N 3.48Å
10	A	45.7	Very low	48	Very low	79 Å²	79	163.2 Å²	163.2	65%	0.653	84%	0.835	S	S	*	*			trans	44.8	66.1	157.6	0	0	0	0	0	118.6	R12	A10-R12 VanDerWaalsContact C-N 3.33Å; A10-R12 PolarHBondContact O-N 3.27Å
11	G	41.5	Very low	48.3	Very low	77 Å²	77	164.3 Å²	164.3	79%	0.794	84%	0.837	S	S	*	*			trans	-63.7	82.2	167.9	0	0	0	0	0	114	Y9 K13	Y9-G11 PolarHBondContact O-N 3.48Å; G11-K13 VanDerWaalsContact C-N 3.27Å; G11-K13 PolarHBondContact O-N 2.99Å
12	R	51.3	Low	48.6	Very low	240 Å²	240	161.8 Å²	161.8	91%	0.906	82%	0.82	S	S	*	*			trans	-67.7	79.1	172.3	-75.3	-170.7	176.7	-172.4	0.6	111	A10 R14	A10-R12 VanDerWaalsContact C-N 3.33Å; A10-R12 PolarHBondContact O-N 3.27Å; R12-R14 PolarHBondContact O-N 3.33Å
13	K	52.6	Low	49	Very low	198 Å²	198	160 Å²	160	86%	0.861	82%	0.818	S	S	*	*			trans	-56.9	102.4	168.3	-74.6	-172.4	177.2	-179.6	0	109.3	G11 R15	G11-K13 VanDerWaalsContact C-N 3.27Å; G11-K13 PolarHBondContact O-N 2.99Å; K13-R15 VanDerWaalsContact C-N 3.35Å; K13-R15 PolarHBondContact O-N 3.46Å
14	R	52.9	Low	49.1	Very low	243 Å²	243	159.7 Å²	159.7	92%	0.917	82%	0.819	S	S	*	*			trans	-59.3	94.3	172.9	-176.6	-178.8	-176.7	-175.8	2	108.6	R12 K16	R12-R14 PolarHBondContact O-N 3.33Å; R14-K16 PolarHBondContact O-N 3.15Å; R14-K16 VanDerWaalsContact O-N 3.14Å
15	R	60.2	Low	49.2	Very low	234 Å²	234	158.3 Å²	158.3	88%	0.883	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-53.1	121.9	172.3	-76.1	-176	171.3	-175.3	-3.1	107.4	K13	K13-R15 VanDerWaalsContact C-N 3.35Å; K13-R15 PolarHBondContact O-N 3.46Å
16	K	55.3	Low	49.7	Very low	189 Å²	189	160.6 Å²	160.6	82%	0.822	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-54.2	134.9	165.7	-67.4	-175.8	178.6	-177.5	0	106.8	R14 V18	R14-K16 PolarHBondContact O-N 3.15Å; R14-K16 VanDerWaalsContact O-N 3.14Å; K16-V18 PolarHBondContact O-N 2.85Å
17	P	46.4	Very low	50	Low	122 Å²	122	158.6 Å²	158.6	79%	0.792	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-60.8	116.1	176.2	25.5	-32.5	0	0	0	107.8	Q19	P17-Q19 PolarHBondContact O-N 3.29Å
18	V	52.4	Low	50.7	Low	128 Å²	128	160.6 Å²	160.6	78%	0.776	81%	0.811	S	S	*	*			trans	-62.8	112	168.6	175.6	0	0	0	0	105.6	K16 K20	K16-V18 PolarHBondContact O-N 2.85Å; V18-K20 PolarHBondContact O-N 3.18Å
19	Q	55.7	Low	51.8	Low	183 Å²	183	161 Å²	161	86%	0.855	81%	0.808	S	S	*	*			trans	-61.3	96.2	163.7	-82.8	-177.9	-31.1	0	0	106.7	P17 Q21	P17-Q19 PolarHBondContact O-N 3.29Å; Q19-Q21 PolarHBondContact O-N 2.69Å
20	K	50.8	Low	53.4	Low	192 Å²	192	152.4 Å²	152.4	84%	0.835	78%	0.78	S	S	*	*			trans	-55.6	111.2	156.2	-77.8	-172.6	173.3	-174.6	0	105.1	V18 K22	V18-K20 PolarHBondContact O-N 3.18Å; K20-K22 PolarHBondContact O-N 3.28Å
21	Q	54.1	Low	55.5	Low	186 Å²	186	153.5 Å²	153.5	87%	0.869	78%	0.775	S	S	*	*			trans	-56.4	102.5	159.1	-76.9	-178.2	-19.5	0	0	105.7	Q19 P23	Q19-Q21 PolarHBondContact O-N 2.69Å; Q21-P23 WeakPolarHBondContact O-CD 3.34Å
22	K	45	Very low	57.9	Low	184 Å²	184	154.8 Å²	154.8	80%	0.8	77%	0.769	S	S	*	*			trans	-64.1	119	172.1	-164.1	179.4	-174	-175	0	104.2	K20 S24	K20-K22 PolarHBondContact O-N 3.28Å; K22-S24 PolarHBondContact O-N 3.12Å; K22-S24 VanDerWaalsContact O-N 3.15Å
23	P	45.3	Very low	59.9	Low	115 Å²	115	147 Å²	147	75%	0.747	75%	0.752	S	S	*	*			trans	-54.5	129	178.4	23.1	-32.8	0	0	0	107.2	Q21 S25	Q21-P23 WeakPolarHBondContact O-CD 3.34Å; P23-S25 PolarHBondContact O-N 3.04Å
24	S	46.8	Very low	61.9	Low	114 Å²	114	142.4 Å²	142.4	80%	0.797	73%	0.732	S	S	*	*			trans	-61	99.8	-173.7	50.6	0	0	0	0	108.7	K22 A26	K22-S24 PolarHBondContact O-N 3.12Å; K22-S24 VanDerWaalsContact O-N 3.15Å; S24-A26 PolarHBondContact O-N 3.21Å
25	S	50.4	Low	63.9	Low	87 Å²	87	136.3 Å²	136.3	61%	0.608	71%	0.709	S	S	*	*			trans	-60.2	110.9	-179.8	48.1	0	0	0	0	107.8	P23 N27 E28	P23-S25 PolarHBondContact O-N 3.04Å; S25-N27 PolarHBondContact O-N 3.34Å; S25-E28 PolarHBondContact O-N 2.72Å
26	A	56	Low	65.6	Low	113 Å²	113	130.5 Å²	130.5	93%	0.934	69%	0.692	S	S	*	*	S	Bend	trans	-71.8	36.8	-172.1	0	0	0	0	0	113.6	S24	S24-A26 PolarHBondContact O-N 3.21Å
27	N	54.1	Low	67.6	Low	117 Å²	117	127.7 Å²	127.7	63%	0.626	68%	0.676	S	S	*	*			trans	-150.6	43.2	-180	-154.6	-8.4	0	0	0	110.2	S25 K29	S25-N27 PolarHBondContact O-N 3.34Å; N27-K29 PolarHBondContact O-N 3.06Å; N27-K29 VanDerWaalsContact O-N 3.14Å
28	E	60.9	Low	70	Confident	170 Å²	170	124.8 Å²	124.8	79%	0.794	65%	0.654	S	S	*	*			trans	-55.1	117.9	152.9	-72.3	-168.4	164.1	0	0	107.2	S25 S30	S25-E28 PolarHBondContact O-N 2.72Å; E28-S30 PolarHBondContact O-N 2.99Å
29	K	69.7	Low	72.1	Confident	184 Å²	184	126.6 Å²	126.6	80%	0.8	65%	0.647	S	S	*	*			trans	-71.2	76.9	179.4	-66.7	-175.6	-178.5	-178.8	0	109.1	N27 N31	N27-K29 PolarHBondContact O-N 3.06Å; N27-K29 VanDerWaalsContact O-N 3.14Å; K29-N31 PolarHBondContact O-N 2.93Å
30	S	73.8	Confident	74	Confident	46 Å²	46	122 Å²	122	32%	0.322	63%	0.628	S	S	.	*			trans	-48	129.2	-177.3	48.2	0	0	0	0	111	E28 R35	E28-S30 PolarHBondContact O-N 2.99Å; S30-R35 VanDerWaalsContact O-CD 3.31Å; S30-R35 WeakPolarHBondContact O-CD 3.26Å; S30-R35 WeakPolarHBondContact O-CG 3.42Å; S30-R35 PolarHBondContact O-NE 3.33Å; S30-R35 WeakPolarHBondContact OG-CG 3.36Å; S30-R35 PolarHBondContact OG-NE 3.11Å; S30-R35 PolarHBondContact OG-NH2 3.21Å
31	N	89.8	Confident	76.2	Confident	101 Å²	101	114.6 Å²	114.6	54%	0.54	60%	0.597	S	S	.	*			trans	-42.3	132.3	-173.1	177.4	-36.8	0	0	0	111.5	K29 S33 K34 R35	K29-N31 PolarHBondContact O-N 2.93Å; N31-S33 PolarHBondContact O-N 2.99Å; N31-S33 VanDerWaalsContact O-N 3.13Å; N31-S33 VanDerWaalsContact OD1-CB 3.31Å; N31-S33 WeakPolarHBondContact OD1-CB 3.43Å; N31-S33 PolarHBondContact OD1-N 3.07Å; N31-K34 HydrophobicContact CB-CB 4.19Å; N31-K34 CarbonylContact O-C 3.56Å; N31-K34 WeakPolarHBondContact O-CA 3.29Å; N31-K34 WeakPolarHBondContact O-CB 3.48Å; N31-K34 PolarHBondContact O-N 2.89Å; N31-R35 PolarHBondContact O-N 3.42Å
32	P	92.4	Very high	78.2	Confident	104 Å²	104	108.3 Å²	108.3	68%	0.675	58%	0.577	S	S	*	*	H	α-helix	trans	-50.7	-37	179.6	-29.8	36.3	0	0	0	114.6	R35 H36	P32-R35 CarbonylContact O-C 3.54Å; P32-R35 PolarHBondContact O-N 3.18Å; P32-H36 WeakPolarHBondContact O-CB 3.48Å; P32-H36 PolarHBondContact O-N 3.46Å
33	S	94.3	Very high	80.7	Confident	78 Å²	78	104.8 Å²	104.8	55%	0.545	56%	0.563	S	S	.	*	H	α-helix	trans	-64.8	-43.2	173.8	176.1	0	0	0	0	112.1	N31 H36 R37	N31-S33 PolarHBondContact O-N 2.99Å; N31-S33 VanDerWaalsContact O-N 3.13Å; N31-S33 VanDerWaalsContact OD1-CB 3.31Å; N31-S33 WeakPolarHBondContact OD1-CB 3.43Å; N31-S33 PolarHBondContact OD1-N 3.07Å; S33-H36 PolarHBondContact O-N 3.17Å; S33-R37 WeakPolarHBondContact O-CB 3.47Å; S33-R37 PolarHBondContact O-N 3.32Å
34	K	94.4	Very high	83.2	Confident	101 Å²	101	100.2 Å²	100.2	44%	0.439	53%	0.533	S	S	.	.	H	α-helix	trans	-59.3	-48.7	170.6	176.1	171.7	178.4	-179.5	0	110.4	N31 H36 R37 D38	N31-K34 HydrophobicContact CB-CB 4.19Å; N31-K34 CarbonylContact O-C 3.56Å; N31-K34 WeakPolarHBondContact O-CA 3.29Å; N31-K34 WeakPolarHBondContact O-CB 3.48Å; N31-K34 PolarHBondContact O-N 2.89Å; K34-H36 VanDerWaalsContact C-N 3.26Å; K34-H36 PolarHBondContact O-N 3.2Å; K34-R37 PolarHBondContact O-N 3.22Å; K34-D38 WeakPolarHBondContact CE-OD2 3.36Å; K34-D38 WeakPolarHBondContact CG-OD2 3.46Å; K34-D38 VanDerWaalsContact O-CB 3.25Å; K34-D38 WeakPolarHBondContact O-CB 3.42Å; K34-D38 PolarHBondContact O-N 2.88Å
35	R	95.1	Very high	85.5	Confident	114 Å²	114	99.4 Å²	99.4	43%	0.43	52%	0.519	S	S	.	.	H	α-helix	trans	-61.2	-29.2	176.8	-69.2	-177.5	177.8	-146.5	-7.4	113.8	S30 N31 P32 R39	S30-R35 VanDerWaalsContact O-CD 3.31Å; S30-R35 WeakPolarHBondContact O-CD 3.26Å; S30-R35 WeakPolarHBondContact O-CG 3.42Å; S30-R35 PolarHBondContact O-NE 3.33Å; S30-R35 WeakPolarHBondContact OG-CG 3.36Å; S30-R35 PolarHBondContact OG-NE 3.11Å; S30-R35 PolarHBondContact OG-NH2 3.21Å; N31-R35 PolarHBondContact O-N 3.42Å; P32-R35 CarbonylContact O-C 3.54Å; P32-R35 PolarHBondContact O-N 3.18Å; R35-R39 WeakPolarHBondContact O-CG 3.21Å; R35-R39 PolarHBondContact O-N 3.21Å; R35-R39 PolarHBondContact O-NE 2.89Å
36	H	95.8	Very high	87.8	Confident	113 Å²	113	102.2 Å²	102.2	52%	0.523	52%	0.517	S	S	.	.	H	α-helix	trans	-74.6	-52.1	173.9	175.1	70.4	0	0	0	111.2	P32 S33 K34 D38 R39 L40	P32-H36 WeakPolarHBondContact O-CB 3.48Å; P32-H36 PolarHBondContact O-N 3.46Å; S33-H36 PolarHBondContact O-N 3.17Å; K34-H36 VanDerWaalsContact C-N 3.26Å; K34-H36 PolarHBondContact O-N 3.2Å; H36-D38 VanDerWaalsContact C-N 3.33Å; H36-D38 PolarHBondContact O-N 3.12Å; H36-R39 PolarHBondContact O-N 3.31Å; H36-L40 PolarHBondContact O-N 2.83Å
37	R	96.5	Very high	89.7	Confident	130 Å²	130	99.5 Å²	99.5	49%	0.491	49%	0.486	S	S	.	.	H	α-helix	trans	-60.2	-41	178.2	-175.7	-169.9	63.1	-150	-4.5	112.5	S33 K34 R39 L40 N41	S33-R37 WeakPolarHBondContact O-CB 3.47Å; S33-R37 PolarHBondContact O-N 3.32Å; K34-R37 PolarHBondContact O-N 3.22Å; R37-R39 VanDerWaalsContact C-N 3.32Å; R37-R39 PolarHBondContact O-N 2.81Å; R37-L40 PolarHBondContact O-N 3.4Å; R37-N41 WeakPolarHBondContact O-CB 3.4Å; R37-N41 PolarHBondContact O-N 3.16Å; R37-N41 PolarHBondContact O-ND2 3.35Å
38	D	96.1	Very high	91.8	Very high	61 Å²	61	94.4 Å²	94.4	33%	0.326	46%	0.461	S	S	.	.	H	α-helix	trans	-69.9	-31.3	-178.4	-61.5	-1.9	0	0	0	110.9	K34 H36 A42	K34-D38 WeakPolarHBondContact CE-OD2 3.36Å; K34-D38 WeakPolarHBondContact CG-OD2 3.46Å; K34-D38 VanDerWaalsContact O-CB 3.25Å; K34-D38 WeakPolarHBondContact O-CB 3.42Å; K34-D38 PolarHBondContact O-N 2.88Å; H36-D38 VanDerWaalsContact C-N 3.33Å; H36-D38 PolarHBondContact O-N 3.12Å; D38-A42 PolarHBondContact O-N 2.69Å; D38-A42 VanDerWaalsContact O-N 3.12Å
39	R	96.6	Very high	93.5	Very high	166 Å²	166	90.3 Å²	90.3	63%	0.626	45%	0.45	S	S	*	.	H	α-helix	trans	-68.5	-43.7	167.8	-79.4	179.7	-70.3	166.8	-0.8	112.7	R35 H36 R37 N41 A42 E43	R35-R39 WeakPolarHBondContact O-CG 3.21Å; R35-R39 PolarHBondContact O-N 3.21Å; R35-R39 PolarHBondContact O-NE 2.89Å; H36-R39 PolarHBondContact O-N 3.31Å; R37-R39 VanDerWaalsContact C-N 3.32Å; R37-R39 PolarHBondContact O-N 2.81Å; R39-N41 VanDerWaalsContact C-N 3.3Å; R39-N41 PolarHBondContact O-N 3.32Å; R39-A42 PolarHBondContact O-N 3.28Å; R39-E43 PolarHBondContact O-N 2.99Å; R39-E43 VanDerWaalsContact O-N 3.13Å
40	L	95.9	Very high	94.8	Very high	86 Å²	86	87.3 Å²	87.3	45%	0.45	44%	0.443	S	S	.	.	H	α-helix	trans	-62.1	-40	176.9	-177	152	0	0	0	111.2	H36 R37 E43 L44	H36-L40 PolarHBondContact O-N 2.83Å; R37-L40 PolarHBondContact O-N 3.4Å; L40-E43 PolarHBondContact O-N 3.41Å; L40-L44 HydrophobicContact CD2-CD1 3.62Å; L40-L44 HydrophobicContact CD2-CG 4.18Å; L40-L44 WeakPolarHBondContact O-CG 3.22Å; L40-L44 PolarHBondContact O-N 3.23Å
41	N	96.6	Very high	95.9	Very high	36 Å²	36	85.7 Å²	85.7	19%	0.193	43%	0.43	C	S	.	.	H	α-helix	trans	-59.6	-49.7	172	-69.5	-26.6	0	0	0	111.1	R37 R39 E43 L44 D45 K63	R37-N41 WeakPolarHBondContact O-CB 3.4Å; R37-N41 PolarHBondContact O-N 3.16Å; R37-N41 PolarHBondContact O-ND2 3.35Å; R39-N41 VanDerWaalsContact C-N 3.3Å; R39-N41 PolarHBondContact O-N 3.32Å; N41-E43 VanDerWaalsContact C-N 3.3Å; N41-E43 PolarHBondContact O-N 3.37Å; N41-L44 CarbonylContact O-C 3.59Å; N41-L44 WeakPolarHBondContact O-CA 3.47Å; N41-L44 WeakPolarHBondContact O-CB 3.24Å; N41-L44 PolarHBondContact O-N 3.21Å; N41-D45 PolarHBondContact O-N 3.42Å; N41-K63 VanDerWaalsContact CG-NZ 3.3Å; N41-K63 PolarHBondContact OD1-NZ 2.98Å
42	A	96.9	Very high	96.1	Very high	55 Å²	55	84.7 Å²	84.7	46%	0.455	43%	0.429	S	S	.	.	H	α-helix	trans	-58	-38.4	-179.7	0	0	0	0	0	113.3	D38 R39 R46	D38-A42 PolarHBondContact O-N 2.69Å; D38-A42 VanDerWaalsContact O-N 3.12Å; R39-A42 PolarHBondContact O-N 3.28Å; A42-R46 VanDerWaalsContact O-CB 3.23Å; A42-R46 WeakPolarHBondContact O-CB 3.4Å; A42-R46 PolarHBondContact O-N 2.91Å
43	E	97.8	Very high	96.2	Very high	109 Å²	109	81.7 Å²	81.7	51%	0.509	41%	0.406	S	S	.	.	H	α-helix	trans	-74.3	-29.2	174.1	-64.8	-64	165.7	0	0	113.1	R39 L40 N41 R46 L47	R39-E43 PolarHBondContact O-N 2.99Å; R39-E43 VanDerWaalsContact O-N 3.13Å; L40-E43 PolarHBondContact O-N 3.41Å; N41-E43 VanDerWaalsContact C-N 3.3Å; N41-E43 PolarHBondContact O-N 3.37Å; E43-R46 IonicContact OE1-NH1 3.65Å; E43-R46 PolarHBondContact OE1-NH1 3Å; E43-R46 WeakPolarHBondContact OE2-CD 3.46Å; E43-R46 IonicContact OE2-CZ 3.86Å; E43-R46 IonicContact OE2-NE 3.28Å; E43-R46 IonicContact OE2-NH1 3.53Å; E43-R46 PolarHBondContact OE2-NH1 2.89Å; E43-L47 VanDerWaalsContact O-CB 3.24Å; E43-L47 WeakPolarHBondContact O-CB 3.4Å; E43-L47 PolarHBondContact O-N 3.5Å
44	L	96.7	Very high	96.2	Very high	20 Å²	20	81.4 Å²	81.4	11%	0.105	40%	0.402	C	S	.	.	H	α-helix	trans	-68.7	-42.3	169.9	-74.3	177.8	0	0	0	112.2	L40 N41 R46 L47 A48 K63 L67	L40-L44 HydrophobicContact CD2-CD1 3.62Å; L40-L44 HydrophobicContact CD2-CG 4.18Å; L40-L44 WeakPolarHBondContact O-CG 3.22Å; L40-L44 PolarHBondContact O-N 3.23Å; N41-L44 CarbonylContact O-C 3.59Å; N41-L44 WeakPolarHBondContact O-CA 3.47Å; N41-L44 WeakPolarHBondContact O-CB 3.24Å; N41-L44 PolarHBondContact O-N 3.21Å; L44-R46 VanDerWaalsContact C-N 3.34Å; L44-L47 WeakPolarHBondContact O-CB 2.87Å; L44-L47 PolarHBondContact O-N 3.36Å; L44-A48 WeakPolarHBondContact O-CB 3.29Å; L44-A48 PolarHBondContact O-N 2.91Å; L44-K63 HydrophobicContact CD1-CB 4.14Å; L44-K63 HydrophobicContact CD1-CD 3.9Å; L44-K63 HydrophobicContact CD1-CG 4.06Å; L44-L67 HydrophobicContact CD2-CD1 4.18Å; L44-L67 HydrophobicContact CD2-CD2 3.68Å; L44-L67 HydrophobicContact CD2-CG 3.81Å
45	D	96.6	Very high	96.2	Very high	96 Å²	96	81 Å²	81	51%	0.513	41%	0.41	S	S	.	.	H	α-helix	trans	-68.3	-38.4	179.7	-57.3	-28.7	0	0	0	109.8	N41 A48 S49	N41-D45 PolarHBondContact O-N 3.42Å; D45-A48 WeakPolarHBondContact O-CB 3.19Å; D45-A48 PolarHBondContact O-N 3.24Å; D45-S49 PolarHBondContact O-N 3.26Å; D45-S49 VanDerWaalsContact O-N 3.08Å
46	R	97.2	Very high	96.2	Very high	146 Å²	146	80.8 Å²	80.8	55%	0.551	42%	0.417	S	S	*	.	H	α-helix	trans	-61.2	-47.2	167.8	-175.5	-166.8	-176.7	-174.3	2.9	111.9	A42 E43 L44 A48 S49 L50	A42-R46 VanDerWaalsContact O-CB 3.23Å; A42-R46 WeakPolarHBondContact O-CB 3.4Å; A42-R46 PolarHBondContact O-N 2.91Å; E43-R46 IonicContact OE1-NH1 3.65Å; E43-R46 PolarHBondContact OE1-NH1 3Å; E43-R46 WeakPolarHBondContact OE2-CD 3.46Å; E43-R46 IonicContact OE2-CZ 3.86Å; E43-R46 IonicContact OE2-NE 3.28Å; E43-R46 IonicContact OE2-NH1 3.53Å; E43-R46 PolarHBondContact OE2-NH1 2.89Å; L44-R46 VanDerWaalsContact C-N 3.34Å; R46-A48 VanDerWaalsContact C-N 3.29Å; R46-A48 PolarHBondContact O-N 3.27Å; R46-S49 PolarHBondContact O-N 2.95Å; R46-S49 PolarHBondContact O-OG 2.74Å; R46-L50 WeakPolarHBondContact O-CG 3.45Å; R46-L50 PolarHBondContact O-N 2.79Å
47	L	97.6	Very high	96.2	Very high	56 Å²	56	76.5 Å²	76.5	29%	0.293	40%	0.399	S	S	.	.	H	α-helix	trans	-60.2	-39.7	176.9	180	61.5	0	0	0	111.7	E43 L44 L50 V66 L67 A70	E43-L47 VanDerWaalsContact O-CB 3.24Å; E43-L47 WeakPolarHBondContact O-CB 3.4Å; E43-L47 PolarHBondContact O-N 3.5Å; L44-L47 WeakPolarHBondContact O-CB 2.87Å; L44-L47 PolarHBondContact O-N 3.36Å; L47-L50 PolarHBondContact O-N 3.22Å; L47-L50 VanDerWaalsContact O-N 3.15Å; L47-V66 HydrophobicContact CB-CG1 4.35Å; L47-V66 HydrophobicContact CD2-CG1 4.23Å; L47-V66 HydrophobicContact CG-CG1 4.12Å; L47-L67 HydrophobicContact CD2-CD2 4.16Å; L47-A70 HydrophobicContact CD1-CB 3.9Å; L47-A70 HydrophobicContact CD2-CB 3.84Å; L47-A70 HydrophobicContact CG-CB 4.03Å
48	A	97.3	Very high	96.1	Very high	11 Å²	11	71.8 Å²	71.8	9%	0.091	38%	0.383	C	S	.	.	H	α-helix	trans	-60.3	-44.3	175.1	0	0	0	0	0	111.5	L44 D45 R46 L50 L51 I58 V66	L44-A48 WeakPolarHBondContact O-CB 3.29Å; L44-A48 PolarHBondContact O-N 2.91Å; D45-A48 WeakPolarHBondContact O-CB 3.19Å; D45-A48 PolarHBondContact O-N 3.24Å; R46-A48 VanDerWaalsContact C-N 3.29Å; R46-A48 PolarHBondContact O-N 3.27Å; A48-L50 PolarHBondContact O-N 3Å; A48-L51 WeakPolarHBondContact O-CB 3.5Å; A48-L51 PolarHBondContact O-N 2.74Å; A48-L51 VanDerWaalsContact O-N 3.14Å; A48-I58 HydrophobicContact CB-CG2 3.84Å; A48-I58 WeakPolarHBondContact O-CG2 3.38Å; A48-V66 HydrophobicContact CB-CG1 3.89Å; A48-V66 HydrophobicContact CB-CG2 3.74Å
49	S	96.6	Very high	96.1	Very high	83 Å²	83	73.2 Å²	73.2	58%	0.58	40%	0.398	S	S	*	.	H	α-helix	trans	-64.9	-14	176.1	74.6	0	0	0	0	115.1	D45 R46	D45-S49 PolarHBondContact O-N 3.26Å; D45-S49 VanDerWaalsContact O-N 3.08Å; R46-S49 PolarHBondContact O-N 2.95Å; R46-S49 PolarHBondContact O-OG 2.74Å
50	L	97.1	Very high	96	Very high	122 Å²	122	73.2 Å²	73.2	64%	0.639	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	0.1	177.3	-66.5	171.4	0	0	0	113.2	R46 L47 A48	R46-L50 WeakPolarHBondContact O-CG 3.45Å; R46-L50 PolarHBondContact O-N 2.79Å; L47-L50 PolarHBondContact O-N 3.22Å; L47-L50 VanDerWaalsContact O-N 3.15Å; A48-L50 PolarHBondContact O-N 3Å
51	L	96.5	Very high	96.1	Very high	12 Å²	12	70.5 Å²	70.5	6%	0.063	39%	0.388	C	S	.	.	S	Bend	trans	-75.6	144.8	175	-64	177	0	0	0	111.1	A48 F53 L61 V66 L69 A70	A48-L51 WeakPolarHBondContact O-CB 3.5Å; A48-L51 PolarHBondContact O-N 2.74Å; A48-L51 VanDerWaalsContact O-N 3.14Å; L51-F53 HydrophobicContact CB-CD2 3.82Å; L51-F53 HydrophobicContact CB-CE2 4.31Å; L51-F53 HydrophobicContact CD1-CD2 4.48Å; L51-F53 PolarHBondContact O-N 2.96Å; L51-L61 HydrophobicContact CD1-CD1 3.8Å; L51-V66 HydrophobicContact CD1-CG1 4.44Å; L51-L69 HydrophobicContact CD1-CB 4.14Å; L51-L69 HydrophobicContact CD2-CB 4.29Å; L51-A70 HydrophobicContact CD2-CB 4.16Å
52	P	94.7	Very high	96.1	Very high	80 Å²	80	72.7 Å²	72.7	52%	0.519	40%	0.4	S	S	.	.	S	Bend	trans	-80.7	57.5	-177.3	36.1	-39	0	0	0	112.4	Y73	P52-Y73 HydrophobicContact CG-CD2 3.78Å; P52-Y73 HydrophobicContact CG-CE2 3.9Å; P52-Y73 HydrophobicContact CG-CG 4.42Å
53	F	94.6	Very high	96	Very high	40 Å²	40	74.3 Å²	74.3	18%	0.175	40%	0.397	C	S	.	.	S	Bend	trans	-133.7	158.8	179.3	-60.3	-64.9	0	0	0	111.4	L51 V57 I58 L69 T152	L51-F53 HydrophobicContact CB-CD2 3.82Å; L51-F53 HydrophobicContact CB-CE2 4.31Å; L51-F53 HydrophobicContact CD1-CD2 4.48Å; L51-F53 PolarHBondContact O-N 2.96Å; F53-V57 HydrophobicContact CB-CB 4.22Å; F53-V57 HydrophobicContact CB-CG1 4.11Å; F53-V57 HydrophobicContact CG-CG1 4.38Å; F53-I58 HydrophobicContact CB-CD1 4.41Å; F53-I58 HydrophobicContact CB-CG1 3.98Å; F53-I58 VanDerWaalsContact O-CD1 3.22Å; F53-I58 WeakPolarHBondContact O-CD1 3.3Å; F53-L69 HydrophobicContact CE2-CB 4.36Å; F53-L69 HydrophobicContact CE2-CD1 4.02Å; F53-L69 HydrophobicContact CE2-CD2 4.21Å; F53-L69 HydrophobicContact CE2-CG 4.43Å; F53-L69 HydrophobicContact CZ-CD2 4.19Å; F53-T152 HydrophobicContact CD1-CG2 4.16Å; F53-T152 HydrophobicContact CD2-CG2 4.21Å; F53-T152 HydrophobicContact CE1-CG2 3.97Å; F53-T152 HydrophobicContact CE2-CG2 4.04Å; F53-T152 HydrophobicContact CG-CG2 4.29Å; F53-T152 HydrophobicContact CZ-CG2 3.91Å
54	P	94.3	Very high	96	Very high	72 Å²	72	75.3 Å²	75.3	47%	0.468	41%	0.405	S	S	.	.			trans	-60.5	151.2	171.7	-23.3	34.4	0	0	0	112.6	D56 V57 I58	P54-D56 PolarHBondContact O-N 3.1Å; P54-V57 HydrophobicContact CB-CG2 4.35Å; P54-V57 HydrophobicContact CG-CG2 4.32Å; P54-V57 WeakPolarHBondContact O-CA 3.2Å; P54-V57 WeakPolarHBondContact O-CB 3.23Å; P54-V57 PolarHBondContact O-N 3.28Å; P54-I58 WeakPolarHBondContact O-CG1 3.37Å; P54-I58 PolarHBondContact O-N 3.46Å
55	P	94.3	Very high	96	Very high	94 Å²	94	75.3 Å²	75.3	61%	0.61	41%	0.406	S	S	*	.	H	α-helix	trans	-60	-31.3	178.1	25.3	-34.6	0	0	0	112.6	V57 I58 S59	P55-V57 PolarHBondContact O-N 3.29Å; P55-I58 PolarHBondContact O-N 3.43Å; P55-S59 VanDerWaalsContact O-CB 3.3Å; P55-S59 WeakPolarHBondContact O-CB 3.33Å; P55-S59 PolarHBondContact O-N 3.38Å; P55-S59 PolarHBondContact O-OG 2.93Å
56	D	95.1	Very high	96.1	Very high	109 Å²	109	71 Å²	71	58%	0.583	38%	0.384	S	S	*	.	H	α-helix	trans	-69.4	-14	176.1	-49.9	-53	0	0	0	113.6	P54 K60	P54-D56 PolarHBondContact O-N 3.1Å; D56-K60 VanDerWaalsContact O-CD 3.29Å; D56-K60 WeakPolarHBondContact O-CD 3.43Å; D56-K60 WeakPolarHBondContact O-CE 3.44Å; D56-K60 PolarHBondContact O-NZ 3.27Å
57	V	95	Very high	96.1	Very high	23 Å²	23	67.9 Å²	67.9	14%	0.139	38%	0.377	C	S	.	.	H	α-helix	trans	-94.1	-49.9	170.2	175.6	0	0	0	0	109.3	F53 P54 P55 S59 K60 T152	F53-V57 HydrophobicContact CB-CB 4.22Å; F53-V57 HydrophobicContact CB-CG1 4.11Å; F53-V57 HydrophobicContact CG-CG1 4.38Å; P54-V57 HydrophobicContact CB-CG2 4.35Å; P54-V57 HydrophobicContact CG-CG2 4.32Å; P54-V57 WeakPolarHBondContact O-CA 3.2Å; P54-V57 WeakPolarHBondContact O-CB 3.23Å; P54-V57 PolarHBondContact O-N 3.28Å; P55-V57 PolarHBondContact O-N 3.29Å; V57-S59 VanDerWaalsContact C-N 3.28Å; V57-S59 PolarHBondContact O-N 3.46Å; V57-K60 PolarHBondContact O-N 3.26Å; V57-T152 HydrophobicContact CG1-CG2 3.56Å
58	I	95.3	Very high	96.1	Very high	31 Å²	31	66.8 Å²	66.8	16%	0.159	37%	0.369	C	S	.	.	H	α-helix	trans	-55.9	-43.1	-177.7	-65	168.8	0	0	0	111.4	A48 F53 P54 P55 K60 L61	A48-I58 HydrophobicContact CB-CG2 3.84Å; A48-I58 WeakPolarHBondContact O-CG2 3.38Å; F53-I58 HydrophobicContact CB-CD1 4.41Å; F53-I58 HydrophobicContact CB-CG1 3.98Å; F53-I58 VanDerWaalsContact O-CD1 3.22Å; F53-I58 WeakPolarHBondContact O-CD1 3.3Å; P54-I58 WeakPolarHBondContact O-CG1 3.37Å; P54-I58 PolarHBondContact O-N 3.46Å; P55-I58 PolarHBondContact O-N 3.43Å; I58-K60 PolarHBondContact O-N 3.4Å; I58-K60 VanDerWaalsContact O-N 3.11Å; I58-L61 WeakPolarHBondContact O-CB 3.31Å; I58-L61 PolarHBondContact O-N 3.4Å; I58-L61 VanDerWaalsContact O-N 3.08Å
59	S	95.1	Very high	96.2	Very high	90 Å²	90	66.5 Å²	66.5	63%	0.629	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-12.8	178.3	52.4	0	0	0	0	115.3	P55 V57	P55-S59 VanDerWaalsContact O-CB 3.3Å; P55-S59 WeakPolarHBondContact O-CB 3.33Å; P55-S59 PolarHBondContact O-N 3.38Å; P55-S59 PolarHBondContact O-OG 2.93Å; V57-S59 VanDerWaalsContact C-N 3.28Å; V57-S59 PolarHBondContact O-N 3.46Å
60	K	95.9	Very high	96.2	Very high	166 Å²	166	63 Å²	63	72%	0.722	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-6.9	177.2	-61.6	171.5	-175.6	137.4	0	113	D56 V57 I58	D56-K60 VanDerWaalsContact O-CD 3.29Å; D56-K60 WeakPolarHBondContact O-CD 3.43Å; D56-K60 WeakPolarHBondContact O-CE 3.44Å; D56-K60 PolarHBondContact O-NZ 3.27Å; V57-K60 PolarHBondContact O-N 3.26Å; I58-K60 PolarHBondContact O-N 3.4Å; I58-K60 VanDerWaalsContact O-N 3.11Å
61	L	96.6	Very high	96.2	Very high	30 Å²	30	60.2 Å²	60.2	16%	0.157	33%	0.33	C	S	.	.			trans	-76.9	133.8	-177.8	-62.3	177.8	0	0	0	111.5	L51 I58 V66 L69 T152	L51-L61 HydrophobicContact CD1-CD1 3.8Å; I58-L61 WeakPolarHBondContact O-CB 3.31Å; I58-L61 PolarHBondContact O-N 3.4Å; I58-L61 VanDerWaalsContact O-N 3.08Å; L61-V66 HydrophobicContact CB-CG2 3.88Å; L61-V66 HydrophobicContact CD1-CG2 4.31Å; L61-L69 HydrophobicContact CD1-CD1 3.77Å; L61-L69 HydrophobicContact CD2-CD1 3.8Å; L61-L69 HydrophobicContact CG-CD1 4.45Å; L61-T152 HydrophobicContact CD2-CG2 4.06Å
62	D	96.8	Very high	96.2	Very high	81 Å²	81	59.8 Å²	59.8	43%	0.433	33%	0.328	S	S	.	.			trans	-77	165	166.2	92.5	-76.4	0	0	0	111.2	L64 S65 V66	D62-L64 VanDerWaalsContact C-N 3.31Å; D62-L64 PolarHBondContact O-N 3.22Å; D62-L64 WeakPolarHBondContact OD2-CA 3.29Å; D62-L64 VanDerWaalsContact OD2-CB 3.25Å; D62-L64 WeakPolarHBondContact OD2-CB 3.34Å; D62-L64 PolarHBondContact OD2-N 3.13Å; D62-S65 WeakPolarHBondContact O-CB 3.36Å; D62-S65 PolarHBondContact O-N 3.42Å; D62-S65 VanDerWaalsContact O-N 3.1Å; D62-S65 WeakPolarHBondContact OD1-CB 3.3Å; D62-S65 PolarHBondContact OD1-N 3.18Å; D62-S65 PolarHBondContact OD1-OG 2.58Å; D62-V66 WeakPolarHBondContact O-CG2 3.36Å; D62-V66 PolarHBondContact O-N 3.1Å
63	K	96	Very high	96.3	Very high	90 Å²	90	60.7 Å²	60.7	39%	0.391	32%	0.322	S	S	.	.	H	α-helix	trans	-65.1	-30	-175.1	-70.9	177.8	176.7	177.3	0	114	N41 L44 L67	N41-K63 VanDerWaalsContact CG-NZ 3.3Å; N41-K63 PolarHBondContact OD1-NZ 2.98Å; L44-K63 HydrophobicContact CD1-CB 4.14Å; L44-K63 HydrophobicContact CD1-CD 3.9Å; L44-K63 HydrophobicContact CD1-CG 4.06Å; K63-L67 WeakPolarHBondContact O-CG 3.29Å; K63-L67 PolarHBondContact O-N 3.49Å
64	L	96.9	Very high	96.3	Very high	130 Å²	130	64 Å²	64	68%	0.681	34%	0.341	S	S	*	.	H	α-helix	trans	-73.5	-39.4	173.2	-57	177.9	0	0	0	110.5	D62 L67 R68	D62-L64 VanDerWaalsContact C-N 3.31Å; D62-L64 PolarHBondContact O-N 3.22Å; D62-L64 WeakPolarHBondContact OD2-CA 3.29Å; D62-L64 VanDerWaalsContact OD2-CB 3.25Å; D62-L64 WeakPolarHBondContact OD2-CB 3.34Å; D62-L64 PolarHBondContact OD2-N 3.13Å; L64-L67 PolarHBondContact O-N 3.07Å; L64-R68 VanDerWaalsContact O-CB 3.23Å; L64-R68 WeakPolarHBondContact O-CB 3.23Å; L64-R68 PolarHBondContact O-N 3.42Å
65	S	97.3	Very high	96.3	Very high	19 Å²	19	64.3 Å²	64.3	13%	0.133	33%	0.333	C	S	.	.	H	α-helix	trans	-63.6	-39.9	172.5	-66.1	0	0	0	0	113	D62 L67 R68 L69	D62-S65 WeakPolarHBondContact O-CB 3.36Å; D62-S65 PolarHBondContact O-N 3.42Å; D62-S65 VanDerWaalsContact O-N 3.1Å; D62-S65 WeakPolarHBondContact OD1-CB 3.3Å; D62-S65 PolarHBondContact OD1-N 3.18Å; D62-S65 PolarHBondContact OD1-OG 2.58Å; S65-L67 PolarHBondContact O-N 2.9Å; S65-R68 VanDerWaalsContact CB-NH2 3.31Å; S65-R68 PolarHBondContact O-N 2.79Å; S65-R68 PolarHBondContact OG-NH2 3.16Å; S65-L69 VanDerWaalsContact O-CB 3.25Å; S65-L69 WeakPolarHBondContact O-CB 3.36Å; S65-L69 WeakPolarHBondContact O-CD1 3.41Å; S65-L69 WeakPolarHBondContact O-CG 3.25Å; S65-L69 PolarHBondContact O-N 2.85Å
66	V	97.9	Very high	96.3	Very high	7 Å²	7	60.8 Å²	60.8	4%	0.042	31%	0.309	C	S	.	.	H	α-helix	trans	-57.6	-48.5	173.4	171	0	0	0	0	111	L47 A48 L51 L61 D62 A70	L47-V66 HydrophobicContact CB-CG1 4.35Å; L47-V66 HydrophobicContact CD2-CG1 4.23Å; L47-V66 HydrophobicContact CG-CG1 4.12Å; A48-V66 HydrophobicContact CB-CG1 3.89Å; A48-V66 HydrophobicContact CB-CG2 3.74Å; L51-V66 HydrophobicContact CD1-CG1 4.44Å; L61-V66 HydrophobicContact CB-CG2 3.88Å; L61-V66 HydrophobicContact CD1-CG2 4.31Å; D62-V66 WeakPolarHBondContact O-CG2 3.36Å; D62-V66 PolarHBondContact O-N 3.1Å; V66-A70 VanDerWaalsContact O-CB 3.32Å; V66-A70 WeakPolarHBondContact O-CB 3.39Å; V66-A70 PolarHBondContact O-N 2.94Å
67	L	98.1	Very high	96.2	Very high	79 Å²	79	60.2 Å²	60.2	41%	0.414	30%	0.302	S	S	.	.	H	α-helix	trans	-64.4	-45.5	177.4	-73	170.4	0	0	0	112.5	L44 L47 K63 L64 S65 L69 A70 V71	L44-L67 HydrophobicContact CD2-CD1 4.18Å; L44-L67 HydrophobicContact CD2-CD2 3.68Å; L44-L67 HydrophobicContact CD2-CG 3.81Å; L47-L67 HydrophobicContact CD2-CD2 4.16Å; K63-L67 WeakPolarHBondContact O-CG 3.29Å; K63-L67 PolarHBondContact O-N 3.49Å; L64-L67 PolarHBondContact O-N 3.07Å; S65-L67 PolarHBondContact O-N 2.9Å; L67-L69 PolarHBondContact O-N 3.32Å; L67-A70 PolarHBondContact O-N 3.42Å; L67-V71 WeakPolarHBondContact O-CG2 3.3Å; L67-V71 PolarHBondContact O-N 2.77Å
68	R	97.6	Very high	96.1	Very high	33 Å²	33	60 Å²	60	13%	0.125	30%	0.302	C	S	.	.	H	α-helix	trans	-58	-46.5	177.2	175	176.2	55.7	80.5	-0.5	111.6	L64 S65 V71 S72 T152 M155 H156 Q157	L64-R68 VanDerWaalsContact O-CB 3.23Å; L64-R68 WeakPolarHBondContact O-CB 3.23Å; L64-R68 PolarHBondContact O-N 3.42Å; S65-R68 VanDerWaalsContact CB-NH2 3.31Å; S65-R68 PolarHBondContact O-N 2.79Å; S65-R68 PolarHBondContact OG-NH2 3.16Å; R68-V71 PolarHBondContact O-N 2.85Å; R68-S72 VanDerWaalsContact O-CB 3.32Å; R68-S72 WeakPolarHBondContact O-CB 3.41Å; R68-S72 PolarHBondContact O-N 2.85Å; R68-T152 VanDerWaalsContact CZ-O 3.28Å; R68-T152 PolarHBondContact NH1-O 3.05Å; R68-T152 PolarHBondContact NH2-O 2.85Å; R68-M155 PolarHBondContact NH1-O 2.84Å; R68-H156 HydrophobicContact CG-CB 4.02Å; R68-Q157 VanDerWaalsContact CD-OE1 3.32Å
69	L	98	Very high	95.9	Very high	5 Å²	5	59.7 Å²	59.7	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-72.1	-36.3	-179.5	-68.7	167.1	0	0	0	112.1	L51 F53 L61 S65 L67 S72 Y73 T152 M155	L51-L69 HydrophobicContact CD1-CB 4.14Å; L51-L69 HydrophobicContact CD2-CB 4.29Å; F53-L69 HydrophobicContact CE2-CB 4.36Å; F53-L69 HydrophobicContact CE2-CD1 4.02Å; F53-L69 HydrophobicContact CE2-CD2 4.21Å; F53-L69 HydrophobicContact CE2-CG 4.43Å; F53-L69 HydrophobicContact CZ-CD2 4.19Å; L61-L69 HydrophobicContact CD1-CD1 3.77Å; L61-L69 HydrophobicContact CD2-CD1 3.8Å; L61-L69 HydrophobicContact CG-CD1 4.45Å; S65-L69 VanDerWaalsContact O-CB 3.25Å; S65-L69 WeakPolarHBondContact O-CB 3.36Å; S65-L69 WeakPolarHBondContact O-CD1 3.41Å; S65-L69 WeakPolarHBondContact O-CG 3.25Å; S65-L69 PolarHBondContact O-N 2.85Å; L67-L69 PolarHBondContact O-N 3.32Å; L69-S72 WeakPolarHBondContact O-CB 3.15Å; L69-S72 PolarHBondContact O-N 2.64Å; L69-Y73 WeakPolarHBondContact O-CB 3.38Å; L69-Y73 PolarHBondContact O-N 2.78Å; L69-T152 HydrophobicContact CD1-CG2 3.92Å; L69-M155 HydrophobicContact CD2-CB 3.79Å
70	A	97.8	Very high	95.6	Very high	10 Å²	10	61.2 Å²	61.2	8%	0.083	29%	0.294	C	S	.	.	H	α-helix	trans	-61.8	-46.9	171.9	0	0	0	0	0	111.9	L47 L51 V66 L67 S72 Y73 L74	L47-A70 HydrophobicContact CD1-CB 3.9Å; L47-A70 HydrophobicContact CD2-CB 3.84Å; L47-A70 HydrophobicContact CG-CB 4.03Å; L51-A70 HydrophobicContact CD2-CB 4.16Å; V66-A70 VanDerWaalsContact O-CB 3.32Å; V66-A70 WeakPolarHBondContact O-CB 3.39Å; V66-A70 PolarHBondContact O-N 2.94Å; L67-A70 PolarHBondContact O-N 3.42Å; A70-S72 VanDerWaalsContact C-N 3.34Å; A70-S72 PolarHBondContact O-N 3.13Å; A70-Y73 PolarHBondContact O-N 2.85Å; A70-L74 WeakPolarHBondContact O-CB 3.25Å; A70-L74 VanDerWaalsContact O-CG 3.29Å; A70-L74 WeakPolarHBondContact O-CG 3.28Å; A70-L74 PolarHBondContact O-N 3.15Å
71	V	96	Very high	95.3	Very high	63 Å²	63	58.2 Å²	58.2	38%	0.382	28%	0.283	S	S	.	.	H	α-helix	trans	-61.6	-42.8	174.5	170.8	0	0	0	0	111.1	L67 R68 L74 R75	L67-V71 WeakPolarHBondContact O-CG2 3.3Å; L67-V71 PolarHBondContact O-N 2.77Å; R68-V71 PolarHBondContact O-N 2.85Å; V71-L74 PolarHBondContact O-N 3.15Å; V71-R75 WeakPolarHBondContact O-CG 3.4Å; V71-R75 PolarHBondContact O-N 3.31Å
72	S	96.4	Very high	94.5	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-59.6	-50.8	176.9	-168.4	0	0	0	0	112	R68 L69 A70 L74 R75 V76 M155	R68-S72 VanDerWaalsContact O-CB 3.32Å; R68-S72 WeakPolarHBondContact O-CB 3.41Å; R68-S72 PolarHBondContact O-N 2.85Å; L69-S72 WeakPolarHBondContact O-CB 3.15Å; L69-S72 PolarHBondContact O-N 2.64Å; A70-S72 VanDerWaalsContact C-N 3.34Å; A70-S72 PolarHBondContact O-N 3.13Å; S72-L74 PolarHBondContact O-N 2.87Å; S72-R75 PolarHBondContact O-N 2.78Å; S72-V76 WeakPolarHBondContact O-CG2 3.34Å; S72-V76 PolarHBondContact O-N 3.37Å; S72-M155 WeakPolarHBondContact OG-CE 3.2Å
73	Y	96.5	Very high	93.1	Very high	99 Å²	99	56.9 Å²	56.9	39%	0.388	28%	0.284	S	S	.	.	H	α-helix	trans	-61.1	-42.6	178.6	177.7	-108.6	0	0	0	112.3	P52 L69 A70 R75 V76 K77	P52-Y73 HydrophobicContact CG-CD2 3.78Å; P52-Y73 HydrophobicContact CG-CE2 3.9Å; P52-Y73 HydrophobicContact CG-CG 4.42Å; L69-Y73 WeakPolarHBondContact O-CB 3.38Å; L69-Y73 PolarHBondContact O-N 2.78Å; A70-Y73 PolarHBondContact O-N 2.85Å; Y73-R75 PolarHBondContact O-N 2.93Å; Y73-V76 PolarHBondContact O-N 3.26Å; Y73-K77 HydrophobicContact CE1-CD 4.31Å; Y73-K77 VanDerWaalsContact O-CB 3.32Å; Y73-K77 WeakPolarHBondContact O-CB 3.39Å; Y73-K77 PolarHBondContact O-N 2.87Å
74	L	95.6	Very high	91.5	Very high	109 Å²	109	60.1 Å²	60.1	57%	0.571	30%	0.301	S	S	*	.	H	α-helix	trans	-64.5	-38.1	176.1	-70.9	172.2	0	0	0	112.5	A70 V71 S72 S78	A70-L74 WeakPolarHBondContact O-CB 3.25Å; A70-L74 VanDerWaalsContact O-CG 3.29Å; A70-L74 WeakPolarHBondContact O-CG 3.28Å; A70-L74 PolarHBondContact O-N 3.15Å; V71-L74 PolarHBondContact O-N 3.15Å; S72-L74 PolarHBondContact O-N 2.87Å; L74-S78 VanDerWaalsContact O-CB 3.25Å; L74-S78 WeakPolarHBondContact O-CB 3.46Å; L74-S78 PolarHBondContact O-N 3.41Å
75	R	93.9	Very high	89.5	Confident	79 Å²	79	60 Å²	60	30%	0.298	30%	0.301	S	S	.	.	H	α-helix	trans	-65.9	-41.6	174.4	-75.6	-177.5	-172.3	-150.9	8.5	112.6	V71 S72 Y73 F79 F137 Q258	V71-R75 WeakPolarHBondContact O-CG 3.4Å; V71-R75 PolarHBondContact O-N 3.31Å; S72-R75 PolarHBondContact O-N 2.78Å; Y73-R75 PolarHBondContact O-N 2.93Å; R75-F79 WeakPolarHBondContact O-CB 3.47Å; R75-F79 PolarHBondContact O-N 2.88Å; R75-F137 HydrophobicContact CB-CE2 3.99Å; R75-Q258 PolarHBondContact O-NE2 2.76Å
76	V	94.3	Very high	87.4	Confident	20 Å²	20	62.2 Å²	62.2	12%	0.121	31%	0.308	C	S	.	.	H	α-helix	trans	-64.4	-46.7	175	172.7	0	0	0	0	110.6	S72 Y73 S78 F79 F80 F137	S72-V76 WeakPolarHBondContact O-CG2 3.34Å; S72-V76 PolarHBondContact O-N 3.37Å; Y73-V76 PolarHBondContact O-N 3.26Å; V76-S78 PolarHBondContact O-N 3.23Å; V76-F79 WeakPolarHBondContact O-CB 3.31Å; V76-F79 PolarHBondContact O-N 3.28Å; V76-F80 HydrophobicContact CG1-CD2 3.92Å; V76-F80 HydrophobicContact CG1-CE2 3.7Å; V76-F80 VanDerWaalsContact O-CD2 3.26Å; V76-F80 WeakPolarHBondContact O-CD2 3.39Å; V76-F80 PolarHBondContact O-N 2.96Å; V76-F80 VanDerWaalsContact O-N 3.13Å; V76-F137 HydrophobicContact CB-CE1 4.44Å; V76-F137 HydrophobicContact CB-CZ 4.45Å; V76-F137 HydrophobicContact CG2-CD1 4.22Å; V76-F137 HydrophobicContact CG2-CE1 3.81Å; V76-F137 HydrophobicContact CG2-CZ 4.01Å; V76-F137 WeakPolarHBondContact CG2-O 3.44Å
77	K	93.5	Very high	84.5	Confident	98 Å²	98	67.7 Å²	67.7	43%	0.426	34%	0.344	S	S	.	.	H	α-helix	trans	-61.6	-44.4	177.1	-172.8	172.1	-178	173.3	0	112.3	Y73 F79 F80 Q81	Y73-K77 HydrophobicContact CE1-CD 4.31Å; Y73-K77 VanDerWaalsContact O-CB 3.32Å; Y73-K77 WeakPolarHBondContact O-CB 3.39Å; Y73-K77 PolarHBondContact O-N 2.87Å; K77-F79 VanDerWaalsContact C-N 3.33Å; K77-F79 PolarHBondContact O-N 3Å; K77-F80 PolarHBondContact O-N 2.81Å; K77-Q81 WeakPolarHBondContact O-CG 3.49Å; K77-Q81 PolarHBondContact O-N 3.29Å
78	S	92.9	Very high	81.5	Confident	19 Å²	19	68.4 Å²	68.4	13%	0.133	36%	0.355	C	S	.	.	H	α-helix	trans	-67.4	-31	178.4	-169	0	0	0	0	112.6	L74 V76 A82 G257	L74-S78 VanDerWaalsContact O-CB 3.25Å; L74-S78 WeakPolarHBondContact O-CB 3.46Å; L74-S78 PolarHBondContact O-N 3.41Å; V76-S78 PolarHBondContact O-N 3.23Å; S78-A82 WeakPolarHBondContact O-CB 3.41Å; S78-A82 PolarHBondContact O-N 2.95Å; S78-A82 VanDerWaalsContact O-N 3.07Å; S78-G257 WeakPolarHBondContact CB-O 3.5Å; S78-G257 PolarHBondContact OG-O 3.25Å
79	F	91.3	Very high	78.7	Confident	23 Å²	23	76.3 Å²	76.3	10%	0.101	39%	0.385	C	S	.	.	H	α-helix	trans	-63.8	-48.5	170.3	165.7	-95.6	0	0	0	111.8	R75 V76 K77 A82 S83 F137 L255 H256 F275	R75-F79 WeakPolarHBondContact O-CB 3.47Å; R75-F79 PolarHBondContact O-N 2.88Å; V76-F79 WeakPolarHBondContact O-CB 3.31Å; V76-F79 PolarHBondContact O-N 3.28Å; K77-F79 VanDerWaalsContact C-N 3.33Å; K77-F79 PolarHBondContact O-N 3Å; F79-A82 PolarHBondContact O-N 3.19Å; F79-S83 WeakPolarHBondContact O-CB 3.04Å; F79-S83 PolarHBondContact O-N 3.27Å; F79-F137 HydrophobicContact CB-CE1 4.28Å; F79-F137 HydrophobicContact CB-CZ 3.7Å; F79-F137 HydrophobicContact CD1-CE1 4.38Å; F79-F137 HydrophobicContact CG-CE1 4.27Å; F79-F137 HydrophobicContact CG-CZ 4.11Å; F79-L255 HydrophobicContact CD2-CD2 4.18Å; F79-L255 HydrophobicContact CE2-CD2 4.21Å; F79-H256 HydrophobicContact CD2-CB 4.37Å; F79-F275 HydrophobicContact CE1-CE1 4.38Å; F79-F275 HydrophobicContact CE1-CZ 4.31Å; F79-F275 HydrophobicContact CE2-CZ 4.01Å; F79-F275 HydrophobicContact CZ-CE1 4.06Å; F79-F275 AromaticContact CZ-CZ 3.65Å; F79-F275 HydrophobicContact CZ-CZ 3.65Å
80	F	89.3	Confident	75.7	Confident	122 Å²	122	84.3 Å²	84.3	54%	0.535	42%	0.42	S	S	.	.	H	α-helix	trans	-66.5	-38.8	179	-75.9	-64.6	0	0	0	112.6	V76 K77 S83 Q84	V76-F80 HydrophobicContact CG1-CD2 3.92Å; V76-F80 HydrophobicContact CG1-CE2 3.7Å; V76-F80 VanDerWaalsContact O-CD2 3.26Å; V76-F80 WeakPolarHBondContact O-CD2 3.39Å; V76-F80 PolarHBondContact O-N 2.96Å; V76-F80 VanDerWaalsContact O-N 3.13Å; K77-F80 PolarHBondContact O-N 2.81Å; F80-S83 PolarHBondContact O-N 3.02Å; F80-Q84 WeakPolarHBondContact O-CG 3.36Å; F80-Q84 PolarHBondContact O-N 3.08Å; F80-Q84 VanDerWaalsContact O-N 3.12Å
81	Q	88.6	Confident	72.7	Confident	103 Å²	103	91 Å²	91	48%	0.481	45%	0.449	S	S	.	.	H	α-helix	trans	-57.7	-55.6	172.8	-73.3	174.5	-39.8	0	0	111.2	K77 S83 Q84 D85	K77-Q81 WeakPolarHBondContact O-CG 3.49Å; K77-Q81 PolarHBondContact O-N 3.29Å; Q81-S83 PolarHBondContact O-N 3.23Å; Q81-Q84 PolarHBondContact O-N 2.82Å; Q81-D85 PolarHBondContact O-N 3.16Å
82	A	80.8	Confident	70.1	Confident	28 Å²	28	95.7 Å²	95.7	23%	0.231	47%	0.47	C	S	.	.	H	α-helix	trans	-64.3	-11.5	178.4	0	0	0	0	0	114.6	S78 F79 H256	S78-A82 WeakPolarHBondContact O-CB 3.41Å; S78-A82 PolarHBondContact O-N 2.95Å; S78-A82 VanDerWaalsContact O-N 3.07Å; F79-A82 PolarHBondContact O-N 3.19Å; A82-H256 HydrophobicContact CB-CB 4.04Å
83	S	67.3	Low	67.3	Low	55 Å²	55	99.7 Å²	99.7	39%	0.385	50%	0.495	S	S	.	.	H	α-helix	trans	-92.2	-19.9	171.9	-169.6	0	0	0	0	113.6	F79 F80 Q81	F79-S83 WeakPolarHBondContact O-CB 3.04Å; F79-S83 PolarHBondContact O-N 3.27Å; F80-S83 PolarHBondContact O-N 3.02Å; Q81-S83 PolarHBondContact O-N 3.23Å
84	Q	61.4	Low	64.3	Low	158 Å²	158	101 Å²	101	74%	0.738	51%	0.513	S	S	*	.	H	α-helix	trans	-90.1	-29.4	175	-66.6	-71.7	-0.8	0	0	111.7	F80 Q81 K86	F80-Q84 WeakPolarHBondContact O-CG 3.36Å; F80-Q84 PolarHBondContact O-N 3.08Å; F80-Q84 VanDerWaalsContact O-N 3.12Å; Q81-Q84 PolarHBondContact O-N 2.82Å; Q84-K86 PolarHBondContact O-N 3.09Å; Q84-K86 VanDerWaalsContact O-N 3.09Å
85	D	54.6	Low	62	Low	129 Å²	129	101.5 Å²	101.5	69%	0.69	52%	0.523	S	S	*	.	S	Bend	trans	-66.6	-6.2	175.9	-62	-34.4	0	0	0	113.5	Q81 P87	Q81-D85 PolarHBondContact O-N 3.16Å; D85-P87 WeakPolarHBondContact O-CD 3.31Å
86	K	53.1	Low	59.1	Low	64 Å²	64	102.7 Å²	102.7	28%	0.278	55%	0.549	S	S	.	.	S	Bend	trans	-70.4	115.6	169	-70.6	-171	171.1	-169	0	109.2	Q84 S88 G215 E216	Q84-K86 PolarHBondContact O-N 3.09Å; Q84-K86 VanDerWaalsContact O-N 3.09Å; K86-S88 PolarHBondContact O-N 3.48Å; K86-G215 PolarHBondContact NZ-O 3.37Å; K86-E216 IonicContact NZ-OE1 3.73Å; K86-E216 PolarHBondContact NZ-OE1 3.38Å
87	P	37.9	Very low	56.3	Low	123 Å²	123	107.8 Å²	107.8	80%	0.799	59%	0.586	S	S	*	*			trans	-66.9	105	-178.3	27	-34	0	0	0	110.1	D85 R89	D85-P87 WeakPolarHBondContact O-CD 3.31Å; P87-R89 PolarHBondContact O-N 2.86Å
88	S	35.5	Very low	53.5	Low	93 Å²	93	107.7 Å²	107.7	65%	0.65	60%	0.598	S	S	*	*			trans	-52.6	116.3	172.2	63.5	0	0	0	0	109.1	K86 K90	K86-S88 PolarHBondContact O-N 3.48Å; S88-K90 PolarHBondContact O-N 2.81Å
89	R	37.5	Very low	50.7	Low	199 Å²	199	113.8 Å²	113.8	75%	0.751	63%	0.629	S	S	*	*			trans	-72.7	71.2	-173.4	-173.8	176.7	-79	-170.6	-6.9	110.1	P87 H91 E213	P87-R89 PolarHBondContact O-N 2.86Å; R89-H91 PolarHBondContact O-N 2.85Å; R89-E213 IonicContact CZ-OE1 3.87Å; R89-E213 IonicContact NH1-OE1 3.42Å; R89-E213 PolarHBondContact NH1-OE1 2.94Å; R89-E213 IonicContact NH2-OE1 2.8Å; R89-E213 PolarHBondContact NH2-OE1 2.85Å
90	K	36.7	Very low	48.3	Very low	174 Å²	174	118.8 Å²	118.8	76%	0.757	66%	0.664	S	S	*	*			trans	-59.4	108.7	170.4	-72.4	-173.4	178.8	-179.1	0	107.9	S88 I92	S88-K90 PolarHBondContact O-N 2.81Å; K90-I92 PolarHBondContact O-N 2.79Å
91	H	33.1	Very low	45.6	Very low	151 Å²	151	119.3 Å²	119.3	70%	0.699	67%	0.668	S	S	*	*			trans	-73.9	86.6	-173.9	-173.4	-81	0	0	0	110.6	R89 T93	R89-H91 PolarHBondContact O-N 2.85Å; H91-T93 VanDerWaalsContact CE1-CG2 3.4Å; H91-T93 WeakPolarHBondContact CE1-CG2 3.21Å; H91-T93 PolarHBondContact CE1-OG1 2.87Å; H91-T93 PolarHBondContact ND1-OG1 2.73Å; H91-T93 PolarHBondContact O-N 2.87Å; H91-T93 VanDerWaalsContact O-N 3.13Å
92	I	41.1	Very low	43.6	Very low	161 Å²	161	120.1 Å²	120.1	83%	0.826	68%	0.682	S	S	*	*			trans	-77.8	98.6	177.3	-60.6	179.3	0	0	0	109.7	K90	K90-I92 PolarHBondContact O-N 2.79Å
93	T	38	Very low	41.4	Very low	86 Å²	86	128 Å²	128	53%	0.528	71%	0.706	S	S	.	*			trans	-138.4	126.7	163.8	49.9	0	0	0	0	106.7	H91	H91-T93 VanDerWaalsContact CE1-CG2 3.4Å; H91-T93 WeakPolarHBondContact CE1-CG2 3.21Å; H91-T93 PolarHBondContact CE1-OG1 2.87Å; H91-T93 PolarHBondContact ND1-OG1 2.73Å; H91-T93 PolarHBondContact O-N 2.87Å; H91-T93 VanDerWaalsContact O-N 3.13Å
94	T	34.2	Very low	40.3	Very low	128 Å²	128	134.6 Å²	134.6	79%	0.785	73%	0.727	S	S	*	*			cis	-154	-177.7	3.4	-1.5	0	0	0	0	107.8
95	P	48.2	Very low	38.9	Very low	119 Å²	119	133.9 Å²	133.9	77%	0.773	73%	0.729	S	S	*	*			trans	-86.1	171.7	-152.8	35.4	-40.4	0	0	0	117.4
96	A	33	Very low	38	Very low	103 Å²	103	132.6 Å²	132.6	85%	0.851	73%	0.729	S	S	*	*			trans	77.9	101.1	155.8	0	0	0	0	0	119.8
97	S	33.5	Very low	37.4	Very low	127 Å²	127	137.1 Å²	137.1	89%	0.888	76%	0.756	S	S	*	*				-163.2	167.6	122.2	-161.9	0	0	0	0	110.7
98	S	36.3	Very low	37.8	Very low	96 Å²	96	136.8 Å²	136.8	67%	0.671	75%	0.754	S	S	*	*			trans	-99.6	125.6	-169	54.8	0	0	0	0	114.6
99	N	33.9	Very low	38.3	Very low	148 Å²	148	140.1 Å²	140.1	79%	0.791	76%	0.763	S	S	*	*				157.4	140.8	127.7	-81.9	-5.6	0	0	0	112.3
100	P	40.7	Very low	38.6	Very low	128 Å²	128	133.8 Å²	133.8	83%	0.831	76%	0.76	S	S	*	*			trans	-87.6	135.7	167.7	34.4	-30.9	0	0	0	111.6
101	E	32.5	Very low	39	Very low	133 Å²	133	130.6 Å²	130.6	62%	0.621	76%	0.755	S	S	*	*			trans	-147.5	114.6	175	-128.3	-79.3	101.9	0	0	107.8	R103	E101-R103 PolarHBondContact O-N 3.24Å; E101-R103 IonicContact OE2-CZ 3.56Å; E101-R103 IonicContact OE2-NE 3.51Å; E101-R103 IonicContact OE2-NH2 3.66Å; E101-R103 PolarHBondContact OE2-NH2 3.19Å
102	P	45.3	Very low	39.9	Very low	119 Å²	119	127.8 Å²	127.8	77%	0.773	75%	0.749	S	S	*	*			trans	-85.5	80.5	-163.2	33.4	-36.4	0	0	0	113	K104	P102-K104 PolarHBondContact O-N 3.14Å
103	R	35.5	Very low	40.5	Very low	195 Å²	195	126.4 Å²	126.4	74%	0.736	74%	0.742	S	S	*	*			trans	-75.6	122.2	176.5	-64.1	-163.8	179.6	148.3	11.6	112.5	E101 D105	E101-R103 PolarHBondContact O-N 3.24Å; E101-R103 IonicContact OE2-CZ 3.56Å; E101-R103 IonicContact OE2-NE 3.51Å; E101-R103 IonicContact OE2-NH2 3.66Å; E101-R103 PolarHBondContact OE2-NH2 3.19Å; R103-D105 PolarHBondContact O-N 3.21Å
104	K	44.5	Very low	41.6	Very low	193 Å²	193	127.4 Å²	127.4	84%	0.839	74%	0.744	S	S	*	*			trans	-95	51.3	-161.9	-166.7	-176.9	174.9	180	0	111.9	P102 S106	P102-K104 PolarHBondContact O-N 3.14Å; K104-S106 VanDerWaalsContact C-N 3.28Å; K104-S106 PolarHBondContact O-N 3.21Å; K104-S106 VanDerWaalsContact O-N 3.15Å
105	D	32.5	Very low	43.6	Very low	143 Å²	143	127 Å²	127	77%	0.765	73%	0.733	S	S	*	*			trans	-90.7	57.7	-178.3	-66.2	-54.3	0	0	0	112.1	R103 L107	R103-D105 PolarHBondContact O-N 3.21Å; D105-L107 PolarHBondContact O-N 3.31Å
106	S	35.8	Very low	45.2	Very low	101 Å²	101	125 Å²	125	71%	0.706	72%	0.722	S	S	*	*			trans	-75.9	85.7	169.6	59.1	0	0	0	0	110.1	K104	K104-S106 VanDerWaalsContact C-N 3.28Å; K104-S106 PolarHBondContact O-N 3.21Å; K104-S106 VanDerWaalsContact O-N 3.15Å
107	L	40.2	Very low	47.6	Very low	160 Å²	160	123 Å²	123	84%	0.838	70%	0.702	S	S	*	*			trans	-55.1	137.2	169.3	-72.8	170.6	0	0	0	110	D105 L109	D105-L107 PolarHBondContact O-N 3.31Å; L107-L109 PolarHBondContact O-N 3.33Å
108	P	45	Very low	50.2	Low	115 Å²	115	121.7 Å²	121.7	75%	0.747	68%	0.684	S	S	*	*			trans	-68.3	126.8	-169.2	25.5	-34	0	0	0	112.5	G110	P108-G110 VanDerWaalsContact C-N 3.28Å; P108-G110 PolarHBondContact O-N 2.99Å
109	L	47	Very low	52.7	Low	163 Å²	163	122.8 Å²	122.8	85%	0.853	68%	0.682	S	S	*	*	S	Bend	trans	-69.3	79.4	173	-178.5	66	0	0	0	110.3	L107	L107-L109 PolarHBondContact O-N 3.33Å
110	G	43.1	Very low	55.4	Low	66 Å²	66	117.7 Å²	117.7	68%	0.68	66%	0.655	S	S	*	*			trans	-126.8	-21.3	-171.3	0	0	0	0	0	117.3	P108	P108-G110 VanDerWaalsContact C-N 3.28Å; P108-G110 PolarHBondContact O-N 2.99Å
111	T	44.8	Very low	57.6	Low	107 Å²	107	118.8 Å²	118.8	66%	0.656	65%	0.649	S	S	*	*	S	Bend	trans	-111.9	-22.3	-166.6	13.5	0	0	0	0	115.9	I113 N114	T111-I113 PolarHBondContact O-N 3.18Å; T111-N114 PolarHBondContact O-N 3.32Å
112	T	52.7	Low	60.4	Low	92 Å²	92	117.1 Å²	117.1	56%	0.564	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-12.5	-169	51.3	0	0	0	0	115.5
113	I	53.9	Low	62.6	Low	132 Å²	132	113.9 Å²	113.9	68%	0.677	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-35.4	-177.3	-64	176.1	0	0	0	111.2	T111 S116	T111-I113 PolarHBondContact O-N 3.18Å; I113-S116 PolarHBondContact O-OG 3.04Å
114	N	60.8	Low	65.3	Low	107 Å²	107	109.6 Å²	109.6	57%	0.572	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-18.2	-169.3	-65.6	9.6	0	0	0	114.2	T111 S116 S117 L118	T111-N114 PolarHBondContact O-N 3.32Å; N114-S116 VanDerWaalsContact C-N 3.27Å; N114-S116 PolarHBondContact O-N 2.88Å; N114-S117 PolarHBondContact O-N 2.92Å; N114-S117 PolarHBondContact O-OG 2.79Å; N114-L118 WeakPolarHBondContact O-CG 3.41Å; N114-L118 PolarHBondContact O-N 3.38Å
115	E	76.9	Confident	67.7	Low	120 Å²	120	100.4 Å²	100.4	56%	0.561	58%	0.583	S	S	*	*	H	α-helix	trans	-61.5	-37.8	179.2	-64.1	-178.3	169.7	0	0	111.7	L118 L119	E115-L118 PolarHBondContact O-N 2.91Å; E115-L119 WeakPolarHBondContact O-CB 3.05Å; E115-L119 WeakPolarHBondContact O-CD1 3.11Å; E115-L119 VanDerWaalsContact O-CG 3.23Å; E115-L119 WeakPolarHBondContact O-CG 3.41Å; E115-L119 PolarHBondContact O-N 2.91Å
116	S	82.1	Confident	70.8	Confident	77 Å²	77	93.8 Å²	93.8	54%	0.538	55%	0.547	S	S	.	.	H	α-helix	trans	-68.2	-36.4	-176.9	69.4	0	0	0	0	113.7	I113 N114 L120	I113-S116 PolarHBondContact O-OG 3.04Å; N114-S116 VanDerWaalsContact C-N 3.27Å; N114-S116 PolarHBondContact O-N 2.88Å; S116-L120 WeakPolarHBondContact O-CG 3.24Å; S116-L120 PolarHBondContact O-N 3.4Å
117	S	82.8	Confident	73.7	Confident	62 Å²	62	89.8 Å²	89.8	43%	0.434	52%	0.521	S	S	.	.	H	α-helix	trans	-73.2	-44.5	174.9	49.4	0	0	0	0	111.3	N114 L119 L120 E121	N114-S117 PolarHBondContact O-N 2.92Å; N114-S117 PolarHBondContact O-OG 2.79Å; S117-L119 VanDerWaalsContact C-N 3.28Å; S117-L119 PolarHBondContact O-N 3.28Å; S117-L120 PolarHBondContact O-N 3.25Å; S117-L120 VanDerWaalsContact O-N 3.08Å; S117-E121 WeakPolarHBondContact O-CB 3.33Å; S117-E121 PolarHBondContact O-N 3.44Å
118	L	87.3	Confident	76.5	Confident	98 Å²	98	82.6 Å²	82.6	51%	0.513	48%	0.483	S	S	.	.	H	α-helix	trans	-61.4	-36.4	176.8	-68.8	170.6	0	0	0	112	N114 E115 S122	N114-L118 WeakPolarHBondContact O-CG 3.41Å; N114-L118 PolarHBondContact O-N 3.38Å; E115-L118 PolarHBondContact O-N 2.91Å; L118-S122 VanDerWaalsContact O-CB 3.23Å; L118-S122 WeakPolarHBondContact O-CB 3.33Å; L118-S122 PolarHBondContact O-N 3.37Å; L118-S122 PolarHBondContact O-OG 2.73Å
119	L	89.9	Confident	79	Confident	119 Å²	119	77.8 Å²	77.8	62%	0.623	45%	0.451	S	S	*	.	H	α-helix	trans	-63.9	-40.6	172.5	-80	166.5	0	0	0	112.7	E115 S117 L123	E115-L119 WeakPolarHBondContact O-CB 3.05Å; E115-L119 WeakPolarHBondContact O-CD1 3.11Å; E115-L119 VanDerWaalsContact O-CG 3.23Å; E115-L119 WeakPolarHBondContact O-CG 3.41Å; E115-L119 PolarHBondContact O-N 2.91Å; S117-L119 VanDerWaalsContact C-N 3.28Å; S117-L119 PolarHBondContact O-N 3.28Å; L119-L123 WeakPolarHBondContact O-CG 3.43Å
120	L	89.3	Confident	81.4	Confident	42 Å²	42	70 Å²	70	22%	0.22	41%	0.411	C	S	.	.	H	α-helix	trans	-71.2	-37.4	177	-72.8	176.2	0	0	0	112.7	S116 S117 L123 A127	S116-L120 WeakPolarHBondContact O-CG 3.24Å; S116-L120 PolarHBondContact O-N 3.4Å; S117-L120 PolarHBondContact O-N 3.25Å; S117-L120 VanDerWaalsContact O-N 3.08Å; L120-L123 HydrophobicContact CD2-CD1 4.25Å; L120-L123 PolarHBondContact O-N 3.45Å; L120-A127 HydrophobicContact CD2-CB 4.43Å
121	E	88.4	Confident	83.9	Confident	151 Å²	151	67.3 Å²	67.3	71%	0.706	38%	0.382	S	S	*	.	H	α-helix	trans	-71	-30.9	177	-170.9	174.4	-172.6	0	0	112.2	S117 L123	S117-E121 WeakPolarHBondContact O-CB 3.33Å; S117-E121 PolarHBondContact O-N 3.44Å; E121-L123 VanDerWaalsContact C-N 3.27Å; E121-L123 PolarHBondContact O-N 2.85Å
122	S	91.4	Very high	86.1	Confident	97 Å²	97	64.8 Å²	64.8	68%	0.678	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-9	175.2	-59.8	0	0	0	0	114.2	L118	L118-S122 VanDerWaalsContact O-CB 3.23Å; L118-S122 WeakPolarHBondContact O-CB 3.33Å; L118-S122 PolarHBondContact O-N 3.37Å; L118-S122 PolarHBondContact O-OG 2.73Å
123	L	90.9	Very high	87.9	Confident	52 Å²	52	63.5 Å²	63.5	27%	0.272	36%	0.358	S	S	.	.			trans	-81.7	127.4	176.7	-73.8	170.2	0	0	0	110.9	L119 L120 E121 G125 Y146 I277	L119-L123 WeakPolarHBondContact O-CG 3.43Å; L120-L123 HydrophobicContact CD2-CD1 4.25Å; L120-L123 PolarHBondContact O-N 3.45Å; E121-L123 VanDerWaalsContact C-N 3.27Å; E121-L123 PolarHBondContact O-N 2.85Å; L123-G125 PolarHBondContact O-N 3.45Å; L123-Y146 PolarHBondContact O-OH 2.96Å; L123-I277 HydrophobicContact CD1-CD1 3.92Å; L123-I277 HydrophobicContact CD2-CD1 4.37Å; L123-I277 HydrophobicContact CD2-CG1 4.32Å; L123-I277 HydrophobicContact CD2-CG2 4.31Å
124	T	91.8	Very high	89.9	Confident	105 Å²	105	57.2 Å²	57.2	64%	0.644	33%	0.326	S	S	*	.	S	Bend	trans	-75.5	47.8	167.7	55.7	0	0	0	0	111.5	V279 P280	T124-V279 WeakPolarHBondContact O-CG1 3.48Å; T124-P280 WeakPolarHBondContact O-CD 3.44Å
125	G	94.6	Very high	91.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.309	C	S	.	.	S	Bend	trans	169.3	-165	-175.7	0	0	0	0	0	111.9	L123 Y146 A278	L123-G125 PolarHBondContact O-N 3.45Å; G125-Y146 PolarHBondContact N-OH 3Å; G125-Y146 VanDerWaalsContact O-CE2 3.28Å; G125-Y146 WeakPolarHBondContact O-CE2 3.45Å; G125-A278 CarbonylContact C-O 3.55Å; G125-A278 WeakPolarHBondContact CA-O 3.48Å
126	F	97.2	Very high	92.6	Very high	3 Å²	3	48.6 Å²	48.6	1%	0.013	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	151.1	174.8	64.1	-95.4	0	0	0	111.7	L128 S140 I143 Y146 L147 M246 I277 A278	F126-L128 HydrophobicContact CD2-CB 4.3Å; F126-L128 HydrophobicContact CE2-CB 4.09Å; F126-L128 HydrophobicContact CE2-CD1 4.32Å; F126-L128 HydrophobicContact CE2-CD2 4.43Å; F126-S140 WeakPolarHBondContact CB-OG 3.25Å; F126-I143 HydrophobicContact CB-CB 4.29Å; F126-I143 HydrophobicContact CD1-CB 4.29Å; F126-I143 HydrophobicContact CD1-CG1 4.08Å; F126-I143 HydrophobicContact CD2-CB 4.04Å; F126-I143 HydrophobicContact CD2-CD1 4.04Å; F126-I143 HydrophobicContact CD2-CG1 3.94Å; F126-I143 HydrophobicContact CE1-CG1 3.96Å; F126-I143 HydrophobicContact CE2-CB 4.45Å; F126-I143 HydrophobicContact CE2-CD1 3.64Å; F126-I143 HydrophobicContact CE2-CG1 3.83Å; F126-I143 HydrophobicContact CG-CB 3.97Å; F126-I143 HydrophobicContact CG-CG1 4.07Å; F126-I143 HydrophobicContact CZ-CD1 3.93Å; F126-I143 HydrophobicContact CZ-CG1 3.84Å; F126-Y146 HydrophobicContact CB-CD2 4.43Å; F126-Y146 HydrophobicContact CD1-CD2 4.06Å; F126-Y146 HydrophobicContact CD1-CG 4.36Å; F126-L147 HydrophobicContact CE1-CD1 3.58Å; F126-L147 HydrophobicContact CE1-CG 3.97Å; F126-L147 HydrophobicContact CZ-CD1 3.58Å; F126-L147 HydrophobicContact CZ-CG 4.46Å; F126-M246 HydrophobicContact CD1-CE 4.13Å; F126-M246 HydrophobicContact CE1-CE 3.59Å; F126-M246 HydrophobicContact CE1-SD 3.67Å; F126-M246 HydrophobicContact CZ-CE 4.41Å; F126-M246 HydrophobicContact CZ-SD 4.09Å; F126-I277 WeakPolarHBondContact O-CA 3.39Å; F126-A278 HydrophobicContact CD1-CB 4.31Å; F126-A278 HydrophobicContact CD2-CB 4.19Å; F126-A278 HydrophobicContact CE1-CB 3.91Å; F126-A278 HydrophobicContact CE2-CB 3.76Å; F126-A278 HydrophobicContact CG-CB 4.44Å; F126-A278 HydrophobicContact CZ-CB 3.6Å; F126-A278 PolarHBondContact N-O 3.32Å; F126-A278 PolarHBondContact O-N 2.88Å
127	A	97.5	Very high	93.3	Very high	18 Å²	18	45.6 Å²	45.6	15%	0.149	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	134.8	175.9	0	0	0	0	0	110.1	L120 A139 S140 I277	L120-A127 HydrophobicContact CD2-CB 4.43Å; A127-A139 CarbonylContact O-C 3.57Å; A127-A139 VanDerWaalsContact O-CA 3.31Å; A127-A139 WeakPolarHBondContact O-CA 3.43Å; A127-S140 PolarHBondContact N-OG 3.05Å; A127-S140 PolarHBondContact O-N 2.89Å; A127-I277 HydrophobicContact CB-CD1 3.87Å
128	L	98.3	Very high	94	Very high	9 Å²	9	46.2 Å²	46.2	5%	0.047	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	135.2	-178	-174.4	72.5	0	0	0	111	F126 V130 V136 Y138 A139 F248 C276	F126-L128 HydrophobicContact CD2-CB 4.3Å; F126-L128 HydrophobicContact CE2-CB 4.09Å; F126-L128 HydrophobicContact CE2-CD1 4.32Å; F126-L128 HydrophobicContact CE2-CD2 4.43Å; L128-V130 HydrophobicContact CD1-CG2 4.44Å; L128-V130 HydrophobicContact CD2-CG2 3.82Å; L128-V130 HydrophobicContact CG-CG2 3.85Å; L128-V136 HydrophobicContact CD1-CG1 3.83Å; L128-Y138 CarbonylContact C-O 3.55Å; L128-Y138 WeakPolarHBondContact CA-O 3.17Å; L128-A139 HydrophobicContact CD1-CB 4.03Å; L128-F248 HydrophobicContact CD2-CD1 4.38Å; L128-F248 HydrophobicContact CD2-CE1 3.76Å; L128-C276 PolarHBondContact N-O 2.83Å; L128-C276 PolarHBondContact O-N 3.31Å; L128-C276 VanDerWaalsContact O-O 3.07Å; L128-C276 PolarHBondContact O-SG 3.21Å
129	V	98.2	Very high	94.5	Very high	13 Å²	13	41.6 Å²	41.6	8%	0.079	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	126.3	172.3	-170	0	0	0	0	109.4	F137 Y138 L255 L274 F275	V129-F137 HydrophobicContact CB-CB 4.18Å; V129-F137 HydrophobicContact CB-CD1 4.24Å; V129-F137 HydrophobicContact CG1-CB 3.98Å; V129-F137 HydrophobicContact CG1-CD1 3.9Å; V129-F137 HydrophobicContact CG1-CG 4.29Å; V129-F137 PolarHBondContact O-N 2.86Å; V129-Y138 HydrophobicContact CG2-CD1 4.42Å; V129-Y138 PolarHBondContact N-O 2.83Å; V129-Y138 PolarHBondContact O-N 3Å; V129-L255 HydrophobicContact CG1-CD2 4.22Å; V129-L274 CarbonylContact C-O 3.53Å; V129-L274 VanDerWaalsContact CA-O 3.23Å; V129-L274 WeakPolarHBondContact CA-O 3.46Å; V129-F275 HydrophobicContact CB-CD1 4.38Å; V129-F275 HydrophobicContact CB-CE1 4.49Å; V129-F275 HydrophobicContact CG1-CD1 3.88Å; V129-F275 HydrophobicContact CG1-CD2 3.97Å; V129-F275 HydrophobicContact CG1-CE1 3.76Å; V129-F275 HydrophobicContact CG1-CE2 3.84Å; V129-F275 HydrophobicContact CG1-CG 3.99Å; V129-F275 HydrophobicContact CG1-CZ 3.73Å; V129-F275 HydrophobicContact CG2-CD1 3.53Å; V129-F275 HydrophobicContact CG2-CE1 3.83Å; V129-F275 HydrophobicContact CG2-CG 4.13Å
130	V	98	Very high	94.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	129.4	-178.3	-171.7	0	0	0	0	109.5	L128 M135 V159 F171 L175 G273 L274	L128-V130 HydrophobicContact CD1-CG2 4.44Å; L128-V130 HydrophobicContact CD2-CG2 3.82Å; L128-V130 HydrophobicContact CG-CG2 3.85Å; V130-M135 WeakPolarHBondContact CA-O 3.17Å; V130-V159 HydrophobicContact CG1-CB 4.11Å; V130-V159 HydrophobicContact CG1-CG1 3.96Å; V130-V159 HydrophobicContact CG2-CG2 4.23Å; V130-F171 HydrophobicContact CG1-CE1 4.47Å; V130-F171 HydrophobicContact CG2-CZ 4.47Å; V130-L175 HydrophobicContact CB-CD2 4.09Å; V130-L175 HydrophobicContact CG1-CD1 4.12Å; V130-L175 HydrophobicContact CG1-CD2 4.05Å; V130-G273 CarbonylContact O-C 3.53Å; V130-G273 VanDerWaalsContact O-C 3.31Å; V130-G273 WeakPolarHBondContact O-CA 3.44Å; V130-L274 PolarHBondContact N-O 2.89Å; V130-L274 PolarHBondContact O-N 3.22Å
131	S	95.1	Very high	95.1	Very high	10 Å²	10	37 Å²	37	7%	0.07	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	162.9	175.2	37.2	0	0	0	0	112.6	D133 G134 M135	S131-D133 VanDerWaalsContact CB-OD1 3.24Å; S131-D133 WeakPolarHBondContact CB-OD1 3.36Å; S131-D133 PolarHBondContact O-N 2.87Å; S131-D133 VanDerWaalsContact O-N 3.11Å; S131-D133 PolarHBondContact OG-OD1 2.95Å; S131-G134 PolarHBondContact O-N 2.91Å; S131-M135 PolarHBondContact N-O 3.42Å; S131-M135 PolarHBondContact OG-O 3.11Å; S131-M135 VanDerWaalsContact OG-O 3.11Å
132	S	91.5	Very high	95.4	Very high	53 Å²	53	30.7 Å²	30.7	37%	0.371	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-25.3	178.5	55.3	0	0	0	0	114.8	G134 L272	S132-G134 PolarHBondContact O-N 2.7Å; S132-L272 WeakPolarHBondContact CB-O 3.48Å; S132-L272 PolarHBondContact N-O 3.03Å
133	D	90.8	Very high	95.7	Very high	66 Å²	66	26.3 Å²	26.3	35%	0.353	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	1.3	173.7	52.1	27.7	0	0	0	114	S131 M135 K260	S131-D133 VanDerWaalsContact CB-OD1 3.24Å; S131-D133 WeakPolarHBondContact CB-OD1 3.36Å; S131-D133 PolarHBondContact O-N 2.87Å; S131-D133 VanDerWaalsContact O-N 3.11Å; S131-D133 PolarHBondContact OG-OD1 2.95Å; D133-M135 VanDerWaalsContact C-N 3.33Å; D133-M135 WeakPolarHBondContact OD1-CB 3.5Å; D133-M135 WeakPolarHBondContact OD1-CG 3.28Å; D133-M135 PolarHBondContact OD1-N 2.55Å; D133-K260 IonicContact OD2-NZ 3.39Å; D133-K260 PolarHBondContact OD2-NZ 2.77Å
134	G	94.6	Very high	96	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.152	C	C	.	.	S	Bend	trans	83.4	-0.1	-180	0	0	0	0	0	114.6	S131 S132 V159	S131-G134 PolarHBondContact O-N 2.91Å; S132-G134 PolarHBondContact O-N 2.7Å; G134-V159 WeakPolarHBondContact O-CB 3.25Å; G134-V159 VanDerWaalsContact O-CG1 3.31Å; G134-V159 WeakPolarHBondContact O-CG1 3.29Å; G134-V159 PolarHBondContact O-N 2.78Å
135	M	96.8	Very high	96.2	Very high	45 Å²	45	26.4 Å²	26.4	22%	0.222	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-74.8	135.8	178.9	-58.4	-59.3	-65	0	0	111.4	V130 S131 D133 F137 H156 Q157 N158	V130-M135 WeakPolarHBondContact CA-O 3.17Å; S131-M135 PolarHBondContact N-O 3.42Å; S131-M135 PolarHBondContact OG-O 3.11Å; S131-M135 VanDerWaalsContact OG-O 3.11Å; D133-M135 VanDerWaalsContact C-N 3.33Å; D133-M135 WeakPolarHBondContact OD1-CB 3.5Å; D133-M135 WeakPolarHBondContact OD1-CG 3.28Å; D133-M135 PolarHBondContact OD1-N 2.55Å; M135-F137 PolarHBondContact O-N 3.02Å; M135-F137 VanDerWaalsContact O-N 3.17Å; M135-H156 WeakPolarHBondContact CE-O 3.41Å; M135-Q157 WeakPolarHBondContact CA-O 3.38Å; M135-N158 HydrophobicContact SD-CB 4.18Å
136	V	98.1	Very high	96.2	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	110.9	172.4	179.1	0	0	0	0	108.8	L128 A139 V154 H156 Q157 V159	L128-V136 HydrophobicContact CD1-CG1 3.83Å; V136-A139 HydrophobicContact CG1-CB 4.43Å; V136-V154 HydrophobicContact CG1-CG1 4.27Å; V136-V154 HydrophobicContact CG2-CG1 4.1Å; V136-H156 WeakPolarHBondContact O-CA 3.23Å; V136-H156 PolarHBondContact O-N 2.78Å; V136-Q157 PolarHBondContact N-O 3.17Å; V136-V159 HydrophobicContact CG2-CB 4.02Å; V136-V159 HydrophobicContact CG2-CG2 4.23Å
137	F	97.2	Very high	96.2	Very high	13 Å²	13	29.4 Å²	29.4	6%	0.057	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-39.9	179.6	-175.7	-95.8	0	0	0	111.7	R75 V76 F79 V129 M135 M155 L255	R75-F137 HydrophobicContact CB-CE2 3.99Å; V76-F137 HydrophobicContact CB-CE1 4.44Å; V76-F137 HydrophobicContact CB-CZ 4.45Å; V76-F137 HydrophobicContact CG2-CD1 4.22Å; V76-F137 HydrophobicContact CG2-CE1 3.81Å; V76-F137 HydrophobicContact CG2-CZ 4.01Å; V76-F137 WeakPolarHBondContact CG2-O 3.44Å; F79-F137 HydrophobicContact CB-CE1 4.28Å; F79-F137 HydrophobicContact CB-CZ 3.7Å; F79-F137 HydrophobicContact CD1-CE1 4.38Å; F79-F137 HydrophobicContact CG-CE1 4.27Å; F79-F137 HydrophobicContact CG-CZ 4.11Å; V129-F137 HydrophobicContact CB-CB 4.18Å; V129-F137 HydrophobicContact CB-CD1 4.24Å; V129-F137 HydrophobicContact CG1-CB 3.98Å; V129-F137 HydrophobicContact CG1-CD1 3.9Å; V129-F137 HydrophobicContact CG1-CG 4.29Å; V129-F137 PolarHBondContact O-N 2.86Å; M135-F137 PolarHBondContact O-N 3.02Å; M135-F137 VanDerWaalsContact O-N 3.17Å; F137-M155 WeakPolarHBondContact O-CE 3.45Å; F137-L255 HydrophobicContact CD1-CD2 3.96Å; F137-L255 HydrophobicContact CD2-CD1 4.41Å; F137-L255 HydrophobicContact CD2-CD2 4.26Å; F137-L255 HydrophobicContact CE1-CD2 3.99Å; F137-L255 HydrophobicContact CE2-CD2 4.29Å; F137-L255 HydrophobicContact CG-CD2 4.1Å; F137-L255 HydrophobicContact CZ-CD2 4.16Å
138	Y	97.7	Very high	96.2	Very high	76 Å²	76	29.6 Å²	29.6	30%	0.298	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	144.8	175.4	178.2	-95.7	0	0	0	110.9	L128 V129 M155	L128-Y138 CarbonylContact C-O 3.55Å; L128-Y138 WeakPolarHBondContact CA-O 3.17Å; V129-Y138 HydrophobicContact CG2-CD1 4.42Å; V129-Y138 PolarHBondContact N-O 2.83Å; V129-Y138 PolarHBondContact O-N 3Å; Y138-M155 VanDerWaalsContact CA-SD 3.57Å; Y138-M155 HydrophobicContact CD2-CE 4.18Å; Y138-M155 HydrophobicContact CD2-SD 4.39Å
139	A	97.8	Very high	96.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	143.9	163.8	0	0	0	0	0	108.4	A127 L128 V136 I143 Q151 M155	A127-A139 CarbonylContact O-C 3.57Å; A127-A139 VanDerWaalsContact O-CA 3.31Å; A127-A139 WeakPolarHBondContact O-CA 3.43Å; L128-A139 HydrophobicContact CD1-CB 4.03Å; V136-A139 HydrophobicContact CG1-CB 4.43Å; A139-I143 HydrophobicContact CB-CD1 4.05Å; A139-Q151 PolarHBondContact O-NE2 2.9Å; A139-M155 HydrophobicContact CB-SD 4.35Å; A139-M155 PolarHBondContact N-SD 3.3Å
140	S	96.7	Very high	96.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.179	C	C	.	.			trans	-70.8	157.9	171.9	56.9	0	0	0	0	111.6	F126 A127 T142 I143	F126-S140 WeakPolarHBondContact CB-OG 3.25Å; A127-S140 PolarHBondContact N-OG 3.05Å; A127-S140 PolarHBondContact O-N 2.89Å; S140-T142 PolarHBondContact O-N 2.81Å; S140-T142 PolarHBondContact OG-OG1 3.5Å; S140-I143 VanDerWaalsContact O-CG2 3.24Å; S140-I143 WeakPolarHBondContact O-CG2 3.2Å; S140-I143 PolarHBondContact O-N 3.34Å
141	S	94.4	Very high	96	Very high	64 Å²	64	34.4 Å²	34.4	45%	0.448	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-35.6	175.6	44	0	0	0	0	112.7	I143 V144	S141-I143 PolarHBondContact O-N 3.22Å; S141-V144 PolarHBondContact O-N 2.72Å
142	T	95.9	Very high	96.1	Very high	20 Å²	20	34.1 Å²	34.1	12%	0.123	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-7.7	-179.8	53.9	0	0	0	0	115.5	S140 V144 D145 Y146	S140-T142 PolarHBondContact O-N 2.81Å; S140-T142 PolarHBondContact OG-OG1 3.5Å; T142-V144 PolarHBondContact O-N 3.33Å; T142-D145 VanDerWaalsContact CA-OD2 3.29Å; T142-D145 WeakPolarHBondContact CA-OD2 3.33Å; T142-D145 PolarHBondContact O-N 3.23Å; T142-D145 VanDerWaalsContact O-N 3.16Å; T142-Y146 VanDerWaalsContact O-CD2 3.28Å; T142-Y146 WeakPolarHBondContact O-CD2 3.28Å
143	I	97.1	Very high	96.3	Very high	4 Å²	4	34.9 Å²	34.9	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-56.7	-30.2	173.7	-168.6	167.2	0	0	0	112.9	F126 A139 S140 S141 D145 Y146 L147 V154	F126-I143 HydrophobicContact CB-CB 4.29Å; F126-I143 HydrophobicContact CD1-CB 4.29Å; F126-I143 HydrophobicContact CD1-CG1 4.08Å; F126-I143 HydrophobicContact CD2-CB 4.04Å; F126-I143 HydrophobicContact CD2-CD1 4.04Å; F126-I143 HydrophobicContact CD2-CG1 3.94Å; F126-I143 HydrophobicContact CE1-CG1 3.96Å; F126-I143 HydrophobicContact CE2-CB 4.45Å; F126-I143 HydrophobicContact CE2-CD1 3.64Å; F126-I143 HydrophobicContact CE2-CG1 3.83Å; F126-I143 HydrophobicContact CG-CB 3.97Å; F126-I143 HydrophobicContact CG-CG1 4.07Å; F126-I143 HydrophobicContact CZ-CD1 3.93Å; F126-I143 HydrophobicContact CZ-CG1 3.84Å; A139-I143 HydrophobicContact CB-CD1 4.05Å; S140-I143 VanDerWaalsContact O-CG2 3.24Å; S140-I143 WeakPolarHBondContact O-CG2 3.2Å; S140-I143 PolarHBondContact O-N 3.34Å; S141-I143 PolarHBondContact O-N 3.22Å; I143-D145 VanDerWaalsContact C-N 3.33Å; I143-D145 PolarHBondContact O-N 3.14Å; I143-Y146 PolarHBondContact O-N 2.82Å; I143-L147 HydrophobicContact CD1-CD1 4.45Å; I143-L147 HydrophobicContact CG1-CD1 4.09Å; I143-L147 PolarHBondContact O-N 2.85Å; I143-V154 HydrophobicContact CD1-CB 4.45Å; I143-V154 HydrophobicContact CD1-CG1 4.2Å; I143-V154 HydrophobicContact CD1-CG2 4.2Å
144	V	96.6	Very high	96.7	Very high	50 Å²	50	32 Å²	32	30%	0.303	17%	0.169	S	C	.	.	H	α-helix	trans	-67	-33.9	179.4	72.5	0	0	0	0	112.3	S141 T142 Y146 G148 F149	S141-V144 PolarHBondContact O-N 2.72Å; T142-V144 PolarHBondContact O-N 3.33Å; V144-Y146 VanDerWaalsContact C-N 3.31Å; V144-Y146 PolarHBondContact O-N 3.2Å; V144-G148 WeakPolarHBondContact O-CA 3.2Å; V144-G148 PolarHBondContact O-N 3.49Å; V144-F149 VanDerWaalsContact CA-O 3.25Å; V144-F149 WeakPolarHBondContact CA-O 3.44Å; V144-F149 WeakPolarHBondContact CB-O 3.42Å; V144-F149 PolarHBondContact N-O 3.21Å
145	D	95.4	Very high	96.8	Very high	109 Å²	109	32.8 Å²	32.8	58%	0.583	17%	0.173	S	C	*	.	H	α-helix	trans	-73.3	-26.1	-176.5	-50.4	-54.6	0	0	0	112.2	T142 I143 L237	T142-D145 VanDerWaalsContact CA-OD2 3.29Å; T142-D145 WeakPolarHBondContact CA-OD2 3.33Å; T142-D145 PolarHBondContact O-N 3.23Å; T142-D145 VanDerWaalsContact O-N 3.16Å; I143-D145 VanDerWaalsContact C-N 3.33Å; I143-D145 PolarHBondContact O-N 3.14Å; D145-L237 WeakPolarHBondContact O-CD1 3.33Å
146	Y	95.7	Very high	96.8	Very high	62 Å²	62	32 Å²	32	24%	0.243	17%	0.169	C	C	.	.	H	α-helix	trans	-98.7	-30.5	-179.8	-65.1	-75.7	0	0	0	113.9	L123 G125 F126 T142 I143 V144 L244 P280	L123-Y146 PolarHBondContact O-OH 2.96Å; G125-Y146 PolarHBondContact N-OH 3Å; G125-Y146 VanDerWaalsContact O-CE2 3.28Å; G125-Y146 WeakPolarHBondContact O-CE2 3.45Å; F126-Y146 HydrophobicContact CB-CD2 4.43Å; F126-Y146 HydrophobicContact CD1-CD2 4.06Å; F126-Y146 HydrophobicContact CD1-CG 4.36Å; T142-Y146 VanDerWaalsContact O-CD2 3.28Å; T142-Y146 WeakPolarHBondContact O-CD2 3.28Å; I143-Y146 PolarHBondContact O-N 2.82Å; V144-Y146 VanDerWaalsContact C-N 3.31Å; V144-Y146 PolarHBondContact O-N 3.2Å; Y146-L244 WeakPolarHBondContact O-CD2 3.28Å; Y146-P280 HydrophobicContact CD1-CG 3.83Å; Y146-P280 HydrophobicContact CE1-CG 3.92Å
147	L	97.1	Very high	96.8	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-126.6	-9.5	-172.7	-61.7	178.3	0	0	0	115	F126 I143 F149 V233 C235 L236 L244 M246	F126-L147 HydrophobicContact CE1-CD1 3.58Å; F126-L147 HydrophobicContact CE1-CG 3.97Å; F126-L147 HydrophobicContact CZ-CD1 3.58Å; F126-L147 HydrophobicContact CZ-CG 4.46Å; I143-L147 HydrophobicContact CD1-CD1 4.45Å; I143-L147 HydrophobicContact CG1-CD1 4.09Å; I143-L147 PolarHBondContact O-N 2.85Å; L147-F149 HydrophobicContact CB-CD2 4.16Å; L147-F149 PolarHBondContact O-N 2.86Å; L147-V233 HydrophobicContact CD1-CB 4.31Å; L147-V233 HydrophobicContact CD1-CG1 3.62Å; L147-V233 HydrophobicContact CD2-CB 4.22Å; L147-V233 HydrophobicContact CD2-CG1 4.32Å; L147-C235 HydrophobicContact CD2-CB 3.92Å; L147-L236 PolarHBondContact O-N 3.04Å; L147-L244 HydrophobicContact CD2-CB 4.04Å; L147-L244 HydrophobicContact CD2-CD2 4.02Å; L147-M246 HydrophobicContact CD1-SD 4.29Å; L147-M246 HydrophobicContact CD2-SD 3.93Å; L147-M246 HydrophobicContact CG-SD 4.34Å
148	G	96.8	Very high	96.8	Very high	22 Å²	22	37.1 Å²	37.1	23%	0.227	19%	0.194	C	C	.	.	S	Bend	trans	73.5	-4.7	-177.8	0	0	0	0	0	115.6	V144	V144-G148 WeakPolarHBondContact O-CA 3.2Å; V144-G148 PolarHBondContact O-N 3.49Å
149	F	97.3	Very high	96.8	Very high	26 Å²	26	33.8 Å²	33.8	11%	0.114	18%	0.182	C	C	.	.			trans	-81.6	132.9	172.4	-71.8	-75.5	0	0	0	110.8	V144 L147 V154 Y162 R234 L236	V144-F149 VanDerWaalsContact CA-O 3.25Å; V144-F149 WeakPolarHBondContact CA-O 3.44Å; V144-F149 WeakPolarHBondContact CB-O 3.42Å; V144-F149 PolarHBondContact N-O 3.21Å; L147-F149 HydrophobicContact CB-CD2 4.16Å; L147-F149 PolarHBondContact O-N 2.86Å; F149-V154 HydrophobicContact CB-CG2 3.73Å; F149-V154 HydrophobicContact CG-CG2 4.36Å; F149-Y162 HydrophobicContact CD1-CE1 4.09Å; F149-Y162 HydrophobicContact CD2-CD1 4.26Å; F149-Y162 HydrophobicContact CD2-CE1 4.45Å; F149-Y162 HydrophobicContact CE1-CD1 4.44Å; F149-Y162 HydrophobicContact CE1-CE1 4.07Å; F149-Y162 HydrophobicContact CE2-CD1 4.06Å; F149-Y162 HydrophobicContact CE2-CE1 4.44Å; F149-Y162 HydrophobicContact CG-CE1 4.29Å; F149-Y162 HydrophobicContact CZ-CD1 4.16Å; F149-Y162 HydrophobicContact CZ-CE1 4.25Å; F149-R234 HydrophobicContact CE2-CB 4.19Å; F149-R234 HydrophobicContact CE2-CG 4.05Å; F149-R234 WeakPolarHBondContact CE2-O 3.13Å; F149-R234 HydrophobicContact CZ-CG 4.03Å; F149-L236 HydrophobicContact CD1-CD1 3.89Å; F149-L236 HydrophobicContact CD1-CG 4.35Å; F149-L236 HydrophobicContact CD2-CG 4.26Å; F149-L236 HydrophobicContact CE1-CD1 3.78Å; F149-L236 HydrophobicContact CE1-CD2 4.11Å; F149-L236 HydrophobicContact CE1-CG 3.99Å; F149-L236 HydrophobicContact CE2-CD1 4.45Å; F149-L236 HydrophobicContact CE2-CD2 4.2Å; F149-L236 HydrophobicContact CE2-CG 3.88Å; F149-L236 HydrophobicContact CG-CD1 4.28Å; F149-L236 HydrophobicContact CG-CG 4.48Å; F149-L236 HydrophobicContact CZ-CD1 4.08Å; F149-L236 HydrophobicContact CZ-CD2 3.7Å; F149-L236 HydrophobicContact CZ-CG 3.74Å
150	H	97.1	Very high	96.8	Very high	66 Å²	66	34.5 Å²	34.5	31%	0.306	19%	0.185	S	C	.	.			trans	-76.2	149.9	175.5	-168.7	-108.3	0	0	0	110.8	T152 D153	H150-T152 PolarHBondContact ND1-OG1 3.01Å; H150-T152 PolarHBondContact O-N 3.47Å; H150-T152 VanDerWaalsContact O-N 3.16Å; H150-D153 WeakPolarHBondContact CB-OD2 3.08Å; H150-D153 PolarHBondContact N-OD2 3.24Å; H150-D153 WeakPolarHBondContact O-CB 3.43Å; H150-D153 PolarHBondContact O-N 2.99Å
151	Q	96.7	Very high	96.9	Very high	32 Å²	32	39.2 Å²	39.2	15%	0.15	21%	0.21	C	C	.	.	H	α-helix	trans	-53.7	-40.2	-177.2	-168.3	-169.4	26.7	0	0	112.1	A139 D153 V154 M155	A139-Q151 PolarHBondContact O-NE2 2.9Å; Q151-D153 PolarHBondContact O-N 2.86Å; Q151-D153 VanDerWaalsContact O-N 3.11Å; Q151-V154 PolarHBondContact O-N 3.11Å; Q151-M155 HydrophobicContact CG-CG 3.98Å; Q151-M155 HydrophobicContact CG-SD 4.46Å; Q151-M155 WeakPolarHBondContact O-CG 3.5Å; Q151-M155 PolarHBondContact O-N 3.47Å; Q151-M155 VanDerWaalsContact O-N 3.17Å
152	T	97.2	Very high	97	Very high	4 Å²	4	37.8 Å²	37.8	3%	0.025	20%	0.195	C	C	.	.	H	α-helix	trans	-59	-22.7	177.7	48.9	0	0	0	0	114.3	F53 V57 L61 R68 L69 H150	F53-T152 HydrophobicContact CD1-CG2 4.16Å; F53-T152 HydrophobicContact CD2-CG2 4.21Å; F53-T152 HydrophobicContact CE1-CG2 3.97Å; F53-T152 HydrophobicContact CE2-CG2 4.04Å; F53-T152 HydrophobicContact CG-CG2 4.29Å; F53-T152 HydrophobicContact CZ-CG2 3.91Å; V57-T152 HydrophobicContact CG1-CG2 3.56Å; L61-T152 HydrophobicContact CD2-CG2 4.06Å; R68-T152 VanDerWaalsContact CZ-O 3.28Å; R68-T152 PolarHBondContact NH1-O 3.05Å; R68-T152 PolarHBondContact NH2-O 2.85Å; L69-T152 HydrophobicContact CD1-CG2 3.92Å; H150-T152 PolarHBondContact ND1-OG1 3.01Å; H150-T152 PolarHBondContact O-N 3.47Å; H150-T152 VanDerWaalsContact O-N 3.16Å
153	D	96.4	Very high	97.1	Very high	69 Å²	69	37 Å²	37	37%	0.369	19%	0.19	S	C	.	.	H	α-helix	trans	-92.3	-25.2	-168.6	-47.1	-16.4	0	0	0	110.4	H150 Q151 Q157 Y162	H150-D153 WeakPolarHBondContact CB-OD2 3.08Å; H150-D153 PolarHBondContact N-OD2 3.24Å; H150-D153 WeakPolarHBondContact O-CB 3.43Å; H150-D153 PolarHBondContact O-N 2.99Å; Q151-D153 PolarHBondContact O-N 2.86Å; Q151-D153 VanDerWaalsContact O-N 3.11Å; D153-Q157 WeakPolarHBondContact O-CG 3.5Å; D153-Y162 PolarHBondContact O-OH 3.04Å
154	V	97.3	Very high	97.2	Very high	6 Å²	6	38.6 Å²	38.6	4%	0.036	20%	0.197	C	C	.	.	H	α-helix	trans	-99.9	-33.2	-176.3	-170.2	0	0	0	0	112.2	V136 I143 F149 Q151 H156 Q157 Y162	V136-V154 HydrophobicContact CG1-CG1 4.27Å; V136-V154 HydrophobicContact CG2-CG1 4.1Å; I143-V154 HydrophobicContact CD1-CB 4.45Å; I143-V154 HydrophobicContact CD1-CG1 4.2Å; I143-V154 HydrophobicContact CD1-CG2 4.2Å; F149-V154 HydrophobicContact CB-CG2 3.73Å; F149-V154 HydrophobicContact CG-CG2 4.36Å; Q151-V154 PolarHBondContact O-N 3.11Å; V154-H156 PolarHBondContact O-N 2.84Å; V154-Q157 WeakPolarHBondContact O-CB 3.24Å; V154-Q157 PolarHBondContact O-N 2.87Å; V154-Q157 VanDerWaalsContact O-N 3.11Å; V154-Y162 HydrophobicContact CG1-CE2 4.17Å; V154-Y162 HydrophobicContact CG2-CE1 3.97Å
155	M	97.4	Very high	97.2	Very high	15 Å²	15	41.7 Å²	41.7	7%	0.074	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	126.3	-178.8	-72	-71.5	-63.6	0	0	112.3	R68 L69 S72 F137 Y138 A139 Q151 Q157	R68-M155 PolarHBondContact NH1-O 2.84Å; L69-M155 HydrophobicContact CD2-CB 3.79Å; S72-M155 WeakPolarHBondContact OG-CE 3.2Å; F137-M155 WeakPolarHBondContact O-CE 3.45Å; Y138-M155 VanDerWaalsContact CA-SD 3.57Å; Y138-M155 HydrophobicContact CD2-CE 4.18Å; Y138-M155 HydrophobicContact CD2-SD 4.39Å; A139-M155 HydrophobicContact CB-SD 4.35Å; A139-M155 PolarHBondContact N-SD 3.3Å; Q151-M155 HydrophobicContact CG-CG 3.98Å; Q151-M155 HydrophobicContact CG-SD 4.46Å; Q151-M155 WeakPolarHBondContact O-CG 3.5Å; Q151-M155 PolarHBondContact O-N 3.47Å; Q151-M155 VanDerWaalsContact O-N 3.17Å; M155-Q157 PolarHBondContact O-N 3.11Å
156	H	96.8	Very high	97.3	Very high	30 Å²	30	41.2 Å²	41.2	14%	0.139	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	27.2	-177.7	-156.5	37.9	0	0	0	115.3	R68 M135 V136 V154	R68-H156 HydrophobicContact CG-CB 4.02Å; M135-H156 WeakPolarHBondContact CE-O 3.41Å; V136-H156 WeakPolarHBondContact O-CA 3.23Å; V136-H156 PolarHBondContact O-N 2.78Å; V154-H156 PolarHBondContact O-N 2.84Å
157	Q	97.4	Very high	97.4	Very high	71 Å²	71	39.6 Å²	39.6	33%	0.332	20%	0.204	S	C	.	.	S	Bend	trans	-96.2	174.8	160	-59.2	-68.6	50.6	0	0	111	R68 M135 V136 D153 V154 M155 Y162	R68-Q157 VanDerWaalsContact CD-OE1 3.32Å; M135-Q157 WeakPolarHBondContact CA-O 3.38Å; V136-Q157 PolarHBondContact N-O 3.17Å; D153-Q157 WeakPolarHBondContact O-CG 3.5Å; V154-Q157 WeakPolarHBondContact O-CB 3.24Å; V154-Q157 PolarHBondContact O-N 2.87Å; V154-Q157 VanDerWaalsContact O-N 3.11Å; M155-Q157 PolarHBondContact O-N 3.11Å; Q157-Y162 HydrophobicContact CB-CE2 4.07Å
158	N	97.6	Very high	97.4	Very high	50 Å²	50	42.7 Å²	42.7	27%	0.267	22%	0.215	S	C	.	.	B	Isolated β-bridge	trans	-81.8	126.2	175.2	-173	-19.1	0	0	0	110.6	M135 F160 D161 Y162	M135-N158 HydrophobicContact SD-CB 4.18Å; N158-F160 PolarHBondContact O-N 2.96Å; N158-F160 WeakPolarHBondContact OD1-CD2 3.43Å; N158-F160 PolarHBondContact OD1-N 3.19Å; N158-D161 PolarHBondContact O-N 2.95Å; N158-Y162 WeakPolarHBondContact O-CD2 3.25Å; N158-Y162 WeakPolarHBondContact O-CE2 3.44Å
159	V	98.1	Very high	97.4	Very high	6 Å²	6	47.7 Å²	47.7	4%	0.036	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-59.7	-32.4	-179.9	78.1	0	0	0	0	112	V130 G134 V136 D161 Y162 I163 F171	V130-V159 HydrophobicContact CG1-CB 4.11Å; V130-V159 HydrophobicContact CG1-CG1 3.96Å; V130-V159 HydrophobicContact CG2-CG2 4.23Å; G134-V159 WeakPolarHBondContact O-CB 3.25Å; G134-V159 VanDerWaalsContact O-CG1 3.31Å; G134-V159 WeakPolarHBondContact O-CG1 3.29Å; G134-V159 PolarHBondContact O-N 2.78Å; V136-V159 HydrophobicContact CG2-CB 4.02Å; V136-V159 HydrophobicContact CG2-CG2 4.23Å; V159-D161 PolarHBondContact O-N 2.92Å; V159-Y162 PolarHBondContact O-N 2.82Å; V159-I163 HydrophobicContact CG2-CG1 4.27Å; V159-I163 PolarHBondContact O-N 3.31Å; V159-F171 HydrophobicContact CG1-CD1 4.04Å; V159-F171 HydrophobicContact CG1-CE1 3.72Å; V159-F171 HydrophobicContact CG1-CZ 4.3Å; V159-F171 HydrophobicContact CG2-CE1 4.13Å; V159-F171 HydrophobicContact CG2-CE2 4.45Å; V159-F171 HydrophobicContact CG2-CZ 3.86Å
160	F	98	Very high	97.3	Very high	15 Å²	15	49.5 Å²	49.5	7%	0.066	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-66.1	-22.5	-175.5	-57	-55.5	0	0	0	112.7	N158 Y162 I163 R168 F171 R172 L175	N158-F160 PolarHBondContact O-N 2.96Å; N158-F160 WeakPolarHBondContact OD1-CD2 3.43Å; N158-F160 PolarHBondContact OD1-N 3.19Å; F160-Y162 PolarHBondContact O-N 3.49Å; F160-I163 PolarHBondContact O-N 3.41Å; F160-R168 HydrophobicContact CB-CG 4.28Å; F160-R168 HydrophobicContact CD1-CB 4.24Å; F160-R168 HydrophobicContact CD1-CG 4.29Å; F160-R168 PolarHBondContact O-NE 3.34Å; F160-R168 PolarHBondContact O-NH2 3.43Å; F160-F171 HydrophobicContact CE1-CB 4.09Å; F160-F171 AromaticContact CE1-CD1 3.86Å; F160-F171 HydrophobicContact CE1-CD1 3.86Å; F160-F171 HydrophobicContact CE1-CG 4.29Å; F160-R172 HydrophobicContact CE1-CG 3.6Å; F160-R172 HydrophobicContact CE2-CG 4.04Å; F160-R172 HydrophobicContact CZ-CB 4.44Å; F160-R172 HydrophobicContact CZ-CG 3.3Å; F160-L175 HydrophobicContact CZ-CD1 4.02Å
161	D	97.7	Very high	97.3	Very high	98 Å²	98	46.4 Å²	46.4	52%	0.524	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-67.4	-20.6	175	-61.1	-30.2	0	0	0	112.4	N158 V159	N158-D161 PolarHBondContact O-N 2.95Å; V159-D161 PolarHBondContact O-N 2.92Å
162	Y	98	Very high	97.2	Very high	34 Å²	34	49.2 Å²	49.2	13%	0.133	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-16.5	175.7	-51.5	-92.2	0	0	0	113	F149 D153 V154 Q157 N158 V159 F160 V233 R234	F149-Y162 HydrophobicContact CD1-CE1 4.09Å; F149-Y162 HydrophobicContact CD2-CD1 4.26Å; F149-Y162 HydrophobicContact CD2-CE1 4.45Å; F149-Y162 HydrophobicContact CE1-CD1 4.44Å; F149-Y162 HydrophobicContact CE1-CE1 4.07Å; F149-Y162 HydrophobicContact CE2-CD1 4.06Å; F149-Y162 HydrophobicContact CE2-CE1 4.44Å; F149-Y162 HydrophobicContact CG-CE1 4.29Å; F149-Y162 HydrophobicContact CZ-CD1 4.16Å; F149-Y162 HydrophobicContact CZ-CE1 4.25Å; D153-Y162 PolarHBondContact O-OH 3.04Å; V154-Y162 HydrophobicContact CG1-CE2 4.17Å; V154-Y162 HydrophobicContact CG2-CE1 3.97Å; Q157-Y162 HydrophobicContact CB-CE2 4.07Å; N158-Y162 WeakPolarHBondContact O-CD2 3.25Å; N158-Y162 WeakPolarHBondContact O-CE2 3.44Å; V159-Y162 PolarHBondContact O-N 2.82Å; F160-Y162 PolarHBondContact O-N 3.49Å; Y162-V233 CarbonylContact O-C 3.59Å; Y162-V233 WeakPolarHBondContact O-CA 3.48Å; Y162-R234 WeakPolarHBondContact O-CB 3.23Å; Y162-R234 PolarHBondContact O-N 3.01Å
163	I	98.4	Very high	97.1	Very high	3 Å²	3	53.5 Å²	53.5	2%	0.015	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-90.7	133.7	179	-59.3	-60.3	0	0	0	110.8	V159 F160 D167 R168 F171 A231 V233 F248	V159-I163 HydrophobicContact CG2-CG1 4.27Å; V159-I163 PolarHBondContact O-N 3.31Å; F160-I163 PolarHBondContact O-N 3.41Å; I163-D167 HydrophobicContact CG2-CB 3.79Å; I163-R168 HydrophobicContact CB-CG 4.23Å; I163-R168 HydrophobicContact CG2-CG 4.09Å; I163-R168 PolarHBondContact O-NE 3.34Å; I163-F171 HydrophobicContact CD1-CD2 3.71Å; I163-F171 HydrophobicContact CD1-CE2 3.73Å; I163-F171 HydrophobicContact CG1-CD2 3.76Å; I163-F171 HydrophobicContact CG1-CE2 4.05Å; I163-F171 HydrophobicContact CG1-CG 4.26Å; I163-F171 HydrophobicContact CG2-CB 4.44Å; I163-F171 HydrophobicContact CG2-CD2 4.43Å; I163-A231 HydrophobicContact CD1-CB 4.48Å; I163-A231 HydrophobicContact CG2-CB 4.5Å; I163-V233 HydrophobicContact CD1-CG1 4.44Å; I163-V233 HydrophobicContact CD1-CG2 4.08Å; I163-F248 HydrophobicContact CD1-CZ 4.34Å
164	H	97.8	Very high	97.1	Very high	39 Å²	39	50.8 Å²	50.8	18%	0.181	24%	0.237	C	C	.	.			trans	-53.8	141.3	176.3	-170.9	-80.2	0	0	0	111.5	D166 D167 R168 R232 F243	H164-D166 IonicContact CE1-OD1 2.79Å; H164-D166 IonicContact CE1-OD2 3.56Å; H164-D166 PolarHBondContact CE1-OD2 2.83Å; H164-D166 IonicContact ND1-OD1 2.72Å; H164-D166 IonicContact ND1-OD2 3.56Å; H164-D166 PolarHBondContact ND1-OD2 2.8Å; H164-D166 VanDerWaalsContact ND1-OD2 3.12Å; H164-D166 PolarHBondContact O-N 2.92Å; H164-D167 PolarHBondContact O-N 2.88Å; H164-R168 PolarHBondContact O-N 3.11Å; H164-R232 HydrophobicContact CB-CB 3.67Å; H164-R232 PolarHBondContact CE1-NH1 2.91Å; H164-R232 PolarHBondContact N-O 3.46Å; H164-R232 VanDerWaalsContact ND1-CZ 3.32Å; H164-R232 PolarHBondContact ND1-NH1 3.46Å; H164-R232 PolarHBondContact ND1-NH2 3.12Å; H164-F243 HydrophobicContact CB-CD1 3.93Å; H164-F243 HydrophobicContact CB-CE1 3.73Å; H164-F243 HydrophobicContact CB-CZ 4.32Å; H164-F243 AromaticContact CD2-CD2 3.89Å; H164-F243 AromaticContact CD2-CE1 3.87Å; H164-F243 AromaticContact CD2-CE2 3.67Å; H164-F243 AromaticContact CD2-CZ 3.66Å
165	I	97.3	Very high	96.9	Very high	114 Å²	114	50.9 Å²	50.9	59%	0.585	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	-45.4	-163.8	-170.5	167.4	0	0	0	114.1	D167 R168	I165-D167 VanDerWaalsContact C-N 3.32Å; I165-D167 PolarHBondContact O-N 3.17Å; I165-R168 WeakPolarHBondContact O-CB 3.06Å; I165-R168 PolarHBondContact O-N 2.86Å
166	D	97.4	Very high	96.7	Very high	99 Å²	99	51.4 Å²	51.4	53%	0.529	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-40.4	176.7	-23.5	-36.9	0	0	0	112.2	H164 R168 R232	H164-D166 IonicContact CE1-OD1 2.79Å; H164-D166 IonicContact CE1-OD2 3.56Å; H164-D166 PolarHBondContact CE1-OD2 2.83Å; H164-D166 IonicContact ND1-OD1 2.72Å; H164-D166 IonicContact ND1-OD2 3.56Å; H164-D166 PolarHBondContact ND1-OD2 2.8Å; H164-D166 VanDerWaalsContact ND1-OD2 3.12Å; H164-D166 PolarHBondContact O-N 2.92Å; D166-R168 VanDerWaalsContact C-N 3.27Å; D166-R168 PolarHBondContact O-N 3.48Å; D166-R232 IonicContact OD2-CZ 2.91Å; D166-R232 IonicContact OD2-NH1 3.72Å; D166-R232 PolarHBondContact OD2-NH1 3.11Å; D166-R232 IonicContact OD2-NH2 3.5Å; D166-R232 PolarHBondContact OD2-NH2 3.27Å
167	D	97.9	Very high	96.2	Very high	28 Å²	28	52.9 Å²	52.9	15%	0.15	24%	0.244	C	C	.	.	H	α-helix	trans	-76.7	-14.9	-173.3	-59.4	-5.9	0	0	0	112	I163 H164 I165 Q169 E170 F171 A231 R232	I163-D167 HydrophobicContact CG2-CB 3.79Å; H164-D167 PolarHBondContact O-N 2.88Å; I165-D167 VanDerWaalsContact C-N 3.32Å; I165-D167 PolarHBondContact O-N 3.17Å; D167-Q169 VanDerWaalsContact C-N 3.27Å; D167-Q169 PolarHBondContact O-N 3.32Å; D167-E170 PolarHBondContact O-N 3.47Å; D167-F171 PolarHBondContact O-N 3.14Å; D167-A231 HydrophobicContact CB-CB 4.13Å; D167-R232 IonicContact OD1-CZ 2.69Å; D167-R232 IonicContact OD1-NE 3.39Å; D167-R232 PolarHBondContact OD1-NE 2.95Å; D167-R232 IonicContact OD1-NH2 3.12Å; D167-R232 PolarHBondContact OD1-NH2 2.91Å; D167-R232 VanDerWaalsContact OD2-CB 3.31Å; D167-R232 WeakPolarHBondContact OD2-CB 3.25Å; D167-R232 IonicContact OD2-CZ 3.43Å; D167-R232 PolarHBondContact OD2-N 3.06Å; D167-R232 IonicContact OD2-NE 3.04Å; D167-R232 PolarHBondContact OD2-NE 3.27Å; D167-R232 IonicContact OD2-NH2 3.28Å
168	R	97.1	Very high	95.8	Very high	69 Å²	69	51.6 Å²	51.6	26%	0.26	25%	0.245	S	C	.	.	H	α-helix	trans	-59.2	-34.8	-178.8	-68.7	173.9	177.6	-173.1	-14.9	113	F160 I163 H164 I165 D166 R172	F160-R168 HydrophobicContact CB-CG 4.28Å; F160-R168 HydrophobicContact CD1-CB 4.24Å; F160-R168 HydrophobicContact CD1-CG 4.29Å; F160-R168 PolarHBondContact O-NE 3.34Å; F160-R168 PolarHBondContact O-NH2 3.43Å; I163-R168 HydrophobicContact CB-CG 4.23Å; I163-R168 HydrophobicContact CG2-CG 4.09Å; I163-R168 PolarHBondContact O-NE 3.34Å; H164-R168 PolarHBondContact O-N 3.11Å; I165-R168 WeakPolarHBondContact O-CB 3.06Å; I165-R168 PolarHBondContact O-N 2.86Å; D166-R168 VanDerWaalsContact C-N 3.27Å; D166-R168 PolarHBondContact O-N 3.48Å; R168-R172 WeakPolarHBondContact O-CG 3.5Å; R168-R172 PolarHBondContact O-N 2.61Å
169	Q	95.8	Very high	95.3	Very high	127 Å²	127	51.1 Å²	51.1	59%	0.593	24%	0.242	S	C	*	.	H	α-helix	trans	-73.9	-39.3	179.9	-56.9	-63.5	23.8	0	0	111.7	D167 R172 R173	D167-Q169 VanDerWaalsContact C-N 3.27Å; D167-Q169 PolarHBondContact O-N 3.32Å; Q169-R172 PolarHBondContact O-N 2.56Å; Q169-R173 WeakPolarHBondContact O-CB 3.38Å; Q169-R173 PolarHBondContact O-N 3.37Å
170	E	95.6	Very high	94.6	Very high	64 Å²	64	55.4 Å²	55.4	30%	0.299	27%	0.271	S	S	.	.	H	α-helix	trans	-64.2	-41.2	171.9	178.1	56.8	-161.3	0	0	111	D167 R172 R173 Q174	D167-E170 PolarHBondContact O-N 3.47Å; E170-R172 PolarHBondContact O-N 2.85Å; E170-R173 WeakPolarHBondContact O-CA 3.11Å; E170-R173 VanDerWaalsContact O-CB 3.22Å; E170-R173 WeakPolarHBondContact O-CB 3.24Å; E170-R173 PolarHBondContact O-N 3.11Å; E170-R173 VanDerWaalsContact O-N 3.1Å; E170-R173 IonicContact OE1-CZ 2.94Å; E170-R173 IonicContact OE1-NE 3.51Å; E170-R173 IonicContact OE1-NH2 2.69Å; E170-R173 PolarHBondContact OE1-NH2 3.39Å; E170-R173 IonicContact OE2-CZ 2.74Å; E170-R173 IonicContact OE2-NE 2.7Å; E170-R173 PolarHBondContact OE2-NE 2.99Å; E170-R173 IonicContact OE2-NH2 2.61Å; E170-R173 PolarHBondContact OE2-NH2 3.16Å; E170-Q174 VanDerWaalsContact O-CG 3.24Å; E170-Q174 WeakPolarHBondContact O-CG 3.49Å; E170-Q174 PolarHBondContact O-N 3.17Å; E170-Q174 PolarHBondContact OE1-NE2 3.19Å
171	F	97.1	Very high	93.8	Very high	1 Å²	1	56.8 Å²	56.8	0%	0.004	28%	0.282	C	S	.	.	H	α-helix	trans	-62.3	-42.6	176	-156.9	-68.6	0	0	0	112	V130 V159 F160 I163 D167 R173 Q174 L175 F229 A231 F248	V130-F171 HydrophobicContact CG1-CE1 4.47Å; V130-F171 HydrophobicContact CG2-CZ 4.47Å; V159-F171 HydrophobicContact CG1-CD1 4.04Å; V159-F171 HydrophobicContact CG1-CE1 3.72Å; V159-F171 HydrophobicContact CG1-CZ 4.3Å; V159-F171 HydrophobicContact CG2-CE1 4.13Å; V159-F171 HydrophobicContact CG2-CE2 4.45Å; V159-F171 HydrophobicContact CG2-CZ 3.86Å; F160-F171 HydrophobicContact CE1-CB 4.09Å; F160-F171 AromaticContact CE1-CD1 3.86Å; F160-F171 HydrophobicContact CE1-CD1 3.86Å; F160-F171 HydrophobicContact CE1-CG 4.29Å; I163-F171 HydrophobicContact CD1-CD2 3.71Å; I163-F171 HydrophobicContact CD1-CE2 3.73Å; I163-F171 HydrophobicContact CG1-CD2 3.76Å; I163-F171 HydrophobicContact CG1-CE2 4.05Å; I163-F171 HydrophobicContact CG1-CG 4.26Å; I163-F171 HydrophobicContact CG2-CB 4.44Å; I163-F171 HydrophobicContact CG2-CD2 4.43Å; D167-F171 PolarHBondContact O-N 3.14Å; F171-R173 VanDerWaalsContact C-N 3.3Å; F171-R173 PolarHBondContact O-N 2.91Å; F171-Q174 PolarHBondContact O-N 3.23Å; F171-L175 HydrophobicContact CD1-CD1 4.06Å; F171-L175 HydrophobicContact CD1-CG 4.07Å; F171-L175 HydrophobicContact CE1-CD1 4.09Å; F171-L175 HydrophobicContact CE1-CD2 4.11Å; F171-L175 HydrophobicContact CE1-CG 4.06Å; F171-L175 PolarHBondContact O-N 2.78Å; F171-L175 VanDerWaalsContact O-N 3.09Å; F171-F229 AromaticContact CD2-CE2 3.61Å; F171-F229 HydrophobicContact CD2-CE2 3.61Å; F171-F229 AromaticContact CD2-CZ 3.89Å; F171-F229 HydrophobicContact CD2-CZ 3.89Å; F171-F229 AromaticContact CE2-CE2 3.86Å; F171-F229 HydrophobicContact CE2-CE2 3.86Å; F171-F229 AromaticContact CE2-CZ 3.77Å; F171-F229 HydrophobicContact CE2-CZ 3.77Å; F171-F229 HydrophobicContact CG-CE2 4.28Å; F171-F229 HydrophobicContact CG-CZ 4.41Å; F171-F229 HydrophobicContact CZ-CZ 4.22Å; F171-A231 HydrophobicContact CD2-CB 4.37Å; F171-F248 HydrophobicContact CE2-CD1 4.35Å; F171-F248 HydrophobicContact CE2-CE1 4.06Å; F171-F248 HydrophobicContact CE2-CE2 4.25Å; F171-F248 AromaticContact CE2-CZ 4Å; F171-F248 HydrophobicContact CE2-CZ 4Å; F171-F248 HydrophobicContact CZ-CE1 4.5Å
172	R	95.5	Very high	92.5	Very high	92 Å²	92	56.1 Å²	56.1	35%	0.347	28%	0.283	S	S	.	.	H	α-helix	trans	-58.8	-41.6	171	-76	177.6	-171.1	118.2	6.7	112.2	F160 R168 Q169 E170 Q174 L175 H176	F160-R172 HydrophobicContact CE1-CG 3.6Å; F160-R172 HydrophobicContact CE2-CG 4.04Å; F160-R172 HydrophobicContact CZ-CB 4.44Å; F160-R172 HydrophobicContact CZ-CG 3.3Å; R168-R172 WeakPolarHBondContact O-CG 3.5Å; R168-R172 PolarHBondContact O-N 2.61Å; Q169-R172 PolarHBondContact O-N 2.56Å; E170-R172 PolarHBondContact O-N 2.85Å; R172-Q174 VanDerWaalsContact C-N 3.33Å; R172-Q174 PolarHBondContact O-N 3.03Å; R172-L175 PolarHBondContact O-N 2.86Å; R172-H176 PolarHBondContact O-N 2.74Å
173	R	94.9	Very high	90.9	Very high	93 Å²	93	63.2 Å²	63.2	35%	0.351	32%	0.317	S	S	.	.	H	α-helix	trans	-58.6	-45.2	176.7	-157.8	-178.5	66.6	93.9	2.1	111.4	Q169 E170 F171 L175 H176 M179	Q169-R173 WeakPolarHBondContact O-CB 3.38Å; Q169-R173 PolarHBondContact O-N 3.37Å; E170-R173 WeakPolarHBondContact O-CA 3.11Å; E170-R173 VanDerWaalsContact O-CB 3.22Å; E170-R173 WeakPolarHBondContact O-CB 3.24Å; E170-R173 PolarHBondContact O-N 3.11Å; E170-R173 VanDerWaalsContact O-N 3.1Å; E170-R173 IonicContact OE1-CZ 2.94Å; E170-R173 IonicContact OE1-NE 3.51Å; E170-R173 IonicContact OE1-NH2 2.69Å; E170-R173 PolarHBondContact OE1-NH2 3.39Å; E170-R173 IonicContact OE2-CZ 2.74Å; E170-R173 IonicContact OE2-NE 2.7Å; E170-R173 PolarHBondContact OE2-NE 2.99Å; E170-R173 IonicContact OE2-NH2 2.61Å; E170-R173 PolarHBondContact OE2-NH2 3.16Å; F171-R173 VanDerWaalsContact C-N 3.3Å; F171-R173 PolarHBondContact O-N 2.91Å; R173-L175 PolarHBondContact O-N 2.85Å; R173-H176 PolarHBondContact O-N 3.16Å; R173-M179 WeakPolarHBondContact CD-O 3.23Å; R173-M179 HydrophobicContact CG-CB 4.36Å; R173-M179 WeakPolarHBondContact CG-O 3.43Å; R173-M179 VanDerWaalsContact O-SD 3.42Å
174	Q	95.6	Very high	88.7	Confident	12 Å²	12	72.2 Å²	72.2	6%	0.056	36%	0.359	C	S	.	.	H	α-helix	trans	-67.8	-30.2	179.1	-63.3	-81.9	-18.6	0	0	113.3	E170 F171 R172 H176 M179 R227 F229	E170-Q174 VanDerWaalsContact O-CG 3.24Å; E170-Q174 WeakPolarHBondContact O-CG 3.49Å; E170-Q174 PolarHBondContact O-N 3.17Å; E170-Q174 PolarHBondContact OE1-NE2 3.19Å; F171-Q174 PolarHBondContact O-N 3.23Å; R172-Q174 VanDerWaalsContact C-N 3.33Å; R172-Q174 PolarHBondContact O-N 3.03Å; Q174-H176 VanDerWaalsContact C-N 3.33Å; Q174-M179 VanDerWaalsContact CD-CE 3.5Å; Q174-M179 HydrophobicContact CG-CE 4.19Å; Q174-R227 VanDerWaalsContact O-CD 3.23Å; Q174-R227 WeakPolarHBondContact O-CD 3.35Å; Q174-R227 PolarHBondContact O-NE 3.23Å; Q174-R227 VanDerWaalsContact OE1-CD 3.24Å; Q174-F229 HydrophobicContact CB-CD1 3.87Å; Q174-F229 HydrophobicContact CB-CE1 3.63Å; Q174-F229 HydrophobicContact CB-CE2 4.46Å; Q174-F229 HydrophobicContact CB-CG 4.38Å; Q174-F229 HydrophobicContact CB-CZ 3.95Å; Q174-F229 VanDerWaalsContact CD-CG 3.48Å; Q174-F229 HydrophobicContact CG-CB 4.07Å; Q174-F229 HydrophobicContact CG-CD1 3.5Å; Q174-F229 HydrophobicContact CG-CD2 3.94Å; Q174-F229 HydrophobicContact CG-CE1 3.78Å; Q174-F229 HydrophobicContact CG-CE2 4.2Å; Q174-F229 HydrophobicContact CG-CG 3.58Å; Q174-F229 HydrophobicContact CG-CZ 4.12Å
175	L	94.3	Very high	86.1	Confident	9 Å²	9	78.6 Å²	78.6	5%	0.047	39%	0.388	C	S	.	.	H	α-helix	trans	-71.9	-24.7	173	-68	178.6	0	0	0	113.4	V130 F160 F171 R172 R173 L274	V130-L175 HydrophobicContact CB-CD2 4.09Å; V130-L175 HydrophobicContact CG1-CD1 4.12Å; V130-L175 HydrophobicContact CG1-CD2 4.05Å; F160-L175 HydrophobicContact CZ-CD1 4.02Å; F171-L175 HydrophobicContact CD1-CD1 4.06Å; F171-L175 HydrophobicContact CD1-CG 4.07Å; F171-L175 HydrophobicContact CE1-CD1 4.09Å; F171-L175 HydrophobicContact CE1-CD2 4.11Å; F171-L175 HydrophobicContact CE1-CG 4.06Å; F171-L175 PolarHBondContact O-N 2.78Å; F171-L175 VanDerWaalsContact O-N 3.09Å; R172-L175 PolarHBondContact O-N 2.86Å; R173-L175 PolarHBondContact O-N 2.85Å; L175-L274 HydrophobicContact CD2-CB 3.7Å; L175-L274 HydrophobicContact CD2-CD2 4.25Å
176	H	92.3	Very high	83.5	Confident	26 Å²	26	77.4 Å²	77.4	12%	0.12	40%	0.396	C	S	.	.	S	Bend	trans	-76.7	144.7	-179	-168.6	-111.7	0	0	0	112.5	R172 R173 Q174 A178 M179 C180 P181 R227	R172-H176 PolarHBondContact O-N 2.74Å; R173-H176 PolarHBondContact O-N 3.16Å; Q174-H176 VanDerWaalsContact C-N 3.33Å; H176-A178 PolarHBondContact ND1-N 3.39Å; H176-M179 PolarHBondContact O-N 3.36Å; H176-C180 PolarHBondContact CE1-O 2.92Å; H176-C180 VanDerWaalsContact ND1-C 3.29Å; H176-C180 PolarHBondContact ND1-N 2.84Å; H176-C180 PolarHBondContact ND1-O 2.77Å; H176-P181 HydrophobicContact CB-CB 4.06Å; H176-R227 PolarHBondContact O-NH2 2.95Å
177	W	87.6	Confident	80.9	Confident	61 Å²	61	81.9 Å²	81.9	23%	0.231	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-48.6	-175.9	70.4	-84.2	0	0	0	112.4	V204 V205 M208 F209 R227 L272	W177-V204 HydrophobicContact CH2-CG1 3.86Å; W177-V204 HydrophobicContact CZ2-CG1 3.81Å; W177-V205 HydrophobicContact CD2-CG2 4.05Å; W177-V205 HydrophobicContact CG-CG2 3.8Å; W177-M208 HydrophobicContact CH2-CE 4.39Å; W177-M208 HydrophobicContact CH2-SD 3.81Å; W177-M208 HydrophobicContact CZ3-SD 3.67Å; W177-F209 AromaticContact CE3-CE2 3.9Å; W177-F209 HydrophobicContact CE3-CE2 3.9Å; W177-F209 HydrophobicContact CE3-CZ 4.3Å; W177-F209 HydrophobicContact CZ3-CE2 4.47Å; W177-R227 PolarHBondContact O-NH2 3.07Å; W177-L272 HydrophobicContact CB-CD1 3.68Å
178	A	87.4	Confident	77.8	Confident	43 Å²	43	84.7 Å²	84.7	36%	0.355	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	9.8	-179.9	0	0	0	0	0	114.1	H176 C180	H176-A178 PolarHBondContact ND1-N 3.39Å; A178-C180 PolarHBondContact O-N 3.21Å
179	M	87.2	Confident	75.2	Confident	40 Å²	40	85.5 Å²	85.5	20%	0.197	47%	0.467	C	S	.	.	S	Bend	trans	58.9	13.2	-177.2	-51.9	-69	-74.9	0	0	115.5	R173 Q174 H176 R227	R173-M179 WeakPolarHBondContact CD-O 3.23Å; R173-M179 HydrophobicContact CG-CB 4.36Å; R173-M179 WeakPolarHBondContact CG-O 3.43Å; R173-M179 VanDerWaalsContact O-SD 3.42Å; Q174-M179 VanDerWaalsContact CD-CE 3.5Å; Q174-M179 HydrophobicContact CG-CE 4.19Å; H176-M179 PolarHBondContact O-N 3.36Å; M179-R227 PolarHBondContact SD-NE 2.84Å; M179-R227 PolarHBondContact SD-NH2 2.71Å; M179-R227 VanDerWaalsContact SD-NH2 3.4Å
180	C	84.9	Confident	72	Confident	96 Å²	96	88.3 Å²	88.3	65%	0.649	48%	0.481	S	S	*	.			trans	-126.7	78.9	173	-62.2	0	0	0	0	110.1	H176 A178	H176-C180 PolarHBondContact CE1-O 2.92Å; H176-C180 VanDerWaalsContact ND1-C 3.29Å; H176-C180 PolarHBondContact ND1-N 2.84Å; H176-C180 PolarHBondContact ND1-O 2.77Å; A178-C180 PolarHBondContact O-N 3.21Å
181	P	79.4	Confident	69.5	Low	44 Å²	44	91.3 Å²	91.3	29%	0.286	51%	0.506	S	S	.	.			trans	-65.7	145.9	177.7	27.5	-33.8	0	0	0	110.7	H176 Q183	H176-P181 HydrophobicContact CB-CB 4.06Å; P181-Q183 PolarHBondContact O-N 2.9Å
182	P	72.1	Confident	66.5	Low	84 Å²	84	99.5 Å²	99.5	55%	0.545	55%	0.55	S	S	.	.			trans	-59.9	114.3	176.1	23.5	-33.2	0	0	0	110.2
183	Q	63.9	Low	63.5	Low	183 Å²	183	98.3 Å²	98.3	86%	0.855	57%	0.566	S	S	*	*			trans	-72	134.5	178.7	-65.3	-176.8	-5	0	0	109.6	P181 Q185	P181-Q183 PolarHBondContact O-N 2.9Å; Q183-Q185 PolarHBondContact O-N 3.48Å
184	H	51.9	Low	61	Low	192 Å²	192	103.5 Å²	103.5	89%	0.889	59%	0.594	S	S	*	*			trans	-57	122.3	169.9	-102.3	-90.3	0	0	0	109.5	A186	H184-A186 VanDerWaalsContact C-N 3.31Å; H184-A186 PolarHBondContact O-N 3.34Å
185	Q	43.5	Very low	58.1	Low	173 Å²	173	111 Å²	111	81%	0.808	63%	0.634	S	S	*	*			trans	-68.4	86.5	175.9	-71.1	177.6	-16.6	0	0	110.8	Q183	Q183-Q185 PolarHBondContact O-N 3.48Å
186	A	41.2	Very low	55.4	Low	90 Å²	90	114 Å²	114	74%	0.744	66%	0.659	S	S	*	*			trans	-80.1	138.7	153.7	0	0	0	0	0	108.5	H184	H184-A186 VanDerWaalsContact C-N 3.31Å; H184-A186 PolarHBondContact O-N 3.34Å
187	M	43	Very low	53	Low	192 Å²	192	116.6 Å²	116.6	95%	0.946	69%	0.686	S	S	*	*	S	Bend	trans	69.5	56.6	178.8	-62.3	169.7	50	0	0	117.6
188	S	33	Very low	51.2	Low	88 Å²	88	115.6 Å²	115.6	62%	0.615	70%	0.695	S	S	*	*			trans	-150.1	112.3	138.8	60.4	0	0	0	0	110.9	Q190	S188-Q190 PolarHBondContact O-N 3.49Å
189	G	42.3	Very low	49.5	Very low	85 Å²	85	118.5 Å²	118.5	88%	0.876	71%	0.708	S	S	*	*			trans	-88.9	89.9	-176.8	0	0	0	0	0	113.6
190	Q	30.1	Very low	48.1	Very low	187 Å²	187	120.5 Å²	120.5	87%	0.874	73%	0.726	S	S	*	*			trans	-144.2	130	155.3	-76.2	-157.4	-66.8	0	0	110.2	S188	S188-Q190 PolarHBondContact O-N 3.49Å
191	P	42.1	Very low	47.1	Very low	127 Å²	127	119.4 Å²	119.4	83%	0.825	71%	0.711	S	S	*	*			trans	-97.3	96.4	169.3	34.5	-26.8	0	0	0	110.4
192	D	33.3	Very low	46.4	Very low	173 Å²	173	120 Å²	120	93%	0.925	71%	0.712	S	S	*	*			trans	-167.6	148.3	146.8	-107.3	-31.9	0	0	0	111.1
193	G	33.3	Very low	46	Very low	67 Å²	67	122.9 Å²	122.9	69%	0.691	72%	0.716	S	S	*	*			trans	102.2	63.2	-179.9	0	0	0	0	0	115.4	L195	G193-L195 PolarHBondContact O-N 3.03Å
194	Q	42	Very low	46.3	Very low	202 Å²	202	116.4 Å²	116.4	94%	0.944	69%	0.689	S	S	*	*			trans	-69.4	87.3	168.5	-69.4	-174.4	5.4	0	0	111.8
195	L	35.6	Very low	47.4	Very low	169 Å²	169	108.2 Å²	108.2	89%	0.885	65%	0.652	S	S	*	*			trans	-97.8	124.8	159.6	-69.6	177	0	0	0	109.2	G193 A197	G193-L195 PolarHBondContact O-N 3.03Å; L195-A197 PolarHBondContact O-N 2.69Å; L195-A197 VanDerWaalsContact O-N 3.1Å
196	A	37.9	Very low	48.5	Very low	71 Å²	71	102 Å²	102	59%	0.587	63%	0.628	S	S	*	*			trans	-69.9	106.6	-173.2	0	0	0	0	0	111.5	G198 T199	A196-G198 PolarHBondContact O-N 3.22Å; A196-T199 PolarHBondContact O-N 2.97Å; A196-T199 PolarHBondContact O-OG1 3.07Å; A196-T199 VanDerWaalsContact O-OG1 3.13Å
197	A	42.2	Very low	49.8	Very low	82 Å²	82	101.9 Å²	101.9	68%	0.678	62%	0.622	S	S	*	*	H	α-helix	trans	-53.7	-26.8	-175.1	0	0	0	0	0	114.9	L195	L195-A197 PolarHBondContact O-N 2.69Å; L195-A197 VanDerWaalsContact O-N 3.1Å
198	G	48.8	Very low	50.8	Low	40 Å²	40	97.3 Å²	97.3	41%	0.412	60%	0.599	S	S	.	*	H	α-helix	trans	-66.7	-38.2	179.4	0	0	0	0	0	114.9	A196 S200 D202	A196-G198 PolarHBondContact O-N 3.22Å; G198-S200 VanDerWaalsContact C-N 3.34Å; G198-S200 PolarHBondContact O-N 3.4Å; G198-D202 VanDerWaalsContact O-CB 3.3Å; G198-D202 WeakPolarHBondContact O-CB 3.48Å; G198-D202 PolarHBondContact O-N 2.99Å
199	T	51.8	Low	52.4	Low	104 Å²	104	93.5 Å²	93.5	64%	0.638	57%	0.572	S	S	*	*	H	α-helix	trans	-72.1	-25.5	-168.7	49.3	0	0	0	0	114	A196 F203	A196-T199 PolarHBondContact O-N 2.97Å; A196-T199 PolarHBondContact O-OG1 3.07Å; A196-T199 VanDerWaalsContact O-OG1 3.13Å; T199-F203 VanDerWaalsContact O-CB 3.25Å; T199-F203 WeakPolarHBondContact O-CB 3.31Å; T199-F203 PolarHBondContact O-N 2.94Å
200	S	56.8	Low	53.3	Low	82 Å²	82	92 Å²	92	57%	0.573	54%	0.544	S	S	*	.	H	α-helix	trans	-78.2	-44.1	177.9	-169.6	0	0	0	0	112.1	G198 F203 V204	G198-S200 VanDerWaalsContact C-N 3.34Å; G198-S200 PolarHBondContact O-N 3.4Å; S200-F203 PolarHBondContact O-N 2.69Å; S200-V204 WeakPolarHBondContact O-CG2 3.48Å; S200-V204 PolarHBondContact O-N 3.39Å; S200-V204 VanDerWaalsContact O-N 3.07Å
201	E	64.4	Low	54.2	Low	73 Å²	73	86.2 Å²	86.2	34%	0.341	52%	0.524	S	S	.	.	H	α-helix	trans	-73.6	-40.8	178.8	-65.4	-168.8	158.5	0	0	112.1	F203 V204 V205	E201-F203 PolarHBondContact O-N 2.79Å; E201-V204 PolarHBondContact O-N 3.41Å; E201-V205 WeakPolarHBondContact O-CG2 3.32Å; E201-V205 PolarHBondContact O-N 2.91Å
202	D	65.8	Low	54.6	Low	57 Å²	57	86.8 Å²	86.8	31%	0.305	53%	0.527	S	S	.	.	H	α-helix	trans	-60.2	-34.7	172.8	-79.4	-28.7	0	0	0	111.2	G198 S206	G198-D202 VanDerWaalsContact O-CB 3.3Å; G198-D202 WeakPolarHBondContact O-CB 3.48Å; G198-D202 PolarHBondContact O-N 2.99Å; D202-S206 WeakPolarHBondContact O-CB 3.44Å; D202-S206 PolarHBondContact O-N 3.1Å
203	F	62.9	Low	55	Low	143 Å²	143	85.3 Å²	85.3	63%	0.627	52%	0.515	S	S	*	.	H	α-helix	trans	-67.8	-44.4	173.7	-179.8	-93.5	0	0	0	112.4	T199 S200 E201 S206 S207	T199-F203 VanDerWaalsContact O-CB 3.25Å; T199-F203 WeakPolarHBondContact O-CB 3.31Å; T199-F203 PolarHBondContact O-N 2.94Å; S200-F203 PolarHBondContact O-N 2.69Å; E201-F203 PolarHBondContact O-N 2.79Å; F203-S206 PolarHBondContact O-N 3.32Å; F203-S207 VanDerWaalsContact O-CB 3.28Å; F203-S207 WeakPolarHBondContact O-CB 3.39Å; F203-S207 PolarHBondContact O-N 3.08Å
204	V	70.3	Confident	55.7	Low	48 Å²	48	84.4 Å²	84.4	29%	0.291	50%	0.501	S	S	.	.	H	α-helix	trans	-64.4	-46.5	177.6	171.3	0	0	0	0	111.1	W177 S200 E201 S206 S207 M208	W177-V204 HydrophobicContact CH2-CG1 3.86Å; W177-V204 HydrophobicContact CZ2-CG1 3.81Å; S200-V204 WeakPolarHBondContact O-CG2 3.48Å; S200-V204 PolarHBondContact O-N 3.39Å; S200-V204 VanDerWaalsContact O-N 3.07Å; E201-V204 PolarHBondContact O-N 3.41Å; V204-S206 VanDerWaalsContact C-N 3.33Å; V204-S206 PolarHBondContact O-N 3.08Å; V204-S207 PolarHBondContact O-N 2.68Å; V204-M208 HydrophobicContact CG1-CE 3.88Å; V204-M208 HydrophobicContact CG1-CG 4.38Å; V204-M208 HydrophobicContact CG1-SD 3.83Å; V204-M208 WeakPolarHBondContact O-CB 3.48Å; V204-M208 WeakPolarHBondContact O-CG 3.35Å; V204-M208 PolarHBondContact O-N 2.92Å
205	V	74.1	Confident	56.3	Low	19 Å²	19	76 Å²	76	12%	0.115	47%	0.469	C	S	.	.	H	α-helix	trans	-62.4	-41.5	176.4	174.5	0	0	0	0	110.6	W177 E201 F209 F254 L272	W177-V205 HydrophobicContact CD2-CG2 4.05Å; W177-V205 HydrophobicContact CG-CG2 3.8Å; E201-V205 WeakPolarHBondContact O-CG2 3.32Å; E201-V205 PolarHBondContact O-N 2.91Å; V205-F209 HydrophobicContact CG1-CD2 4.12Å; V205-F209 WeakPolarHBondContact O-CB 3.45Å; V205-F209 WeakPolarHBondContact O-CD2 3.29Å; V205-F209 PolarHBondContact O-N 2.9Å; V205-F254 HydrophobicContact CG1-CE1 4.03Å; V205-F254 HydrophobicContact CG1-CZ 4.04Å; V205-L272 HydrophobicContact CG1-CD1 4.45Å
206	S	68.3	Low	57.5	Low	42 Å²	42	73.7 Å²	73.7	29%	0.294	45%	0.454	S	S	.	.	H	α-helix	trans	-64.3	-45.1	174.6	-167.2	0	0	0	0	112	D202 F203 V204 M208 F209 N210	D202-S206 WeakPolarHBondContact O-CB 3.44Å; D202-S206 PolarHBondContact O-N 3.1Å; F203-S206 PolarHBondContact O-N 3.32Å; V204-S206 VanDerWaalsContact C-N 3.33Å; V204-S206 PolarHBondContact O-N 3.08Å; S206-M208 VanDerWaalsContact C-N 3.34Å; S206-M208 PolarHBondContact O-N 2.91Å; S206-F209 PolarHBondContact O-N 3.3Å; S206-N210 WeakPolarHBondContact CA-ND2 3.46Å; S206-N210 WeakPolarHBondContact O-CA 3.44Å; S206-N210 VanDerWaalsContact O-CB 3.28Å; S206-N210 WeakPolarHBondContact O-CB 3.48Å; S206-N210 PolarHBondContact O-N 3.25Å; S206-N210 PolarHBondContact OG-ND2 3.36Å
207	S	66.9	Low	59	Low	88 Å²	88	71.8 Å²	71.8	62%	0.615	43%	0.433	S	S	*	.	H	α-helix	trans	-69.5	-26.7	-178.4	-172	0	0	0	0	114	F203 V204	F203-S207 VanDerWaalsContact O-CB 3.28Å; F203-S207 WeakPolarHBondContact O-CB 3.39Å; F203-S207 PolarHBondContact O-N 3.08Å; V204-S207 PolarHBondContact O-N 2.68Å
208	M	65	Low	60.4	Low	97 Å²	97	69.7 Å²	69.7	48%	0.478	41%	0.413	S	S	.	.	H	α-helix	trans	-88.8	-28.6	177.9	-71.5	-176.7	173.5	0	0	113.2	W177 V204 S206 L221	W177-M208 HydrophobicContact CH2-CE 4.39Å; W177-M208 HydrophobicContact CH2-SD 3.81Å; W177-M208 HydrophobicContact CZ3-SD 3.67Å; V204-M208 HydrophobicContact CG1-CE 3.88Å; V204-M208 HydrophobicContact CG1-CG 4.38Å; V204-M208 HydrophobicContact CG1-SD 3.83Å; V204-M208 WeakPolarHBondContact O-CB 3.48Å; V204-M208 WeakPolarHBondContact O-CG 3.35Å; V204-M208 PolarHBondContact O-N 2.92Å; S206-M208 VanDerWaalsContact C-N 3.34Å; S206-M208 PolarHBondContact O-N 2.91Å; M208-L221 VanDerWaalsContact O-CD1 3.25Å; M208-L221 WeakPolarHBondContact O-CD1 3.23Å
209	F	67.4	Low	61.5	Low	7 Å²	7	73.2 Å²	73.2	3%	0.031	43%	0.429	C	S	.	.	H	α-helix	trans	-125.5	-12.6	-168.4	-60.6	-84.5	0	0	0	115.7	W177 V205 S206 I217 L221 L225 F254	W177-F209 AromaticContact CE3-CE2 3.9Å; W177-F209 HydrophobicContact CE3-CE2 3.9Å; W177-F209 HydrophobicContact CE3-CZ 4.3Å; W177-F209 HydrophobicContact CZ3-CE2 4.47Å; V205-F209 HydrophobicContact CG1-CD2 4.12Å; V205-F209 WeakPolarHBondContact O-CB 3.45Å; V205-F209 WeakPolarHBondContact O-CD2 3.29Å; V205-F209 PolarHBondContact O-N 2.9Å; S206-F209 PolarHBondContact O-N 3.3Å; F209-I217 HydrophobicContact CD1-CB 4.49Å; F209-I217 HydrophobicContact CD1-CG1 4.14Å; F209-I217 HydrophobicContact CD1-CG2 4.06Å; F209-I217 HydrophobicContact CE1-CG2 4.29Å; F209-L221 HydrophobicContact CD1-CB 4.3Å; F209-L221 HydrophobicContact CD1-CD1 3.97Å; F209-L221 HydrophobicContact CE1-CB 3.76Å; F209-L221 HydrophobicContact CE1-CD1 3.83Å; F209-L221 HydrophobicContact CE1-CG 4.42Å; F209-L221 HydrophobicContact CZ-CD1 4.37Å; F209-L225 HydrophobicContact CD1-CD1 4.26Å; F209-L225 HydrophobicContact CE1-CD1 3.78Å; F209-L225 HydrophobicContact CE1-CD2 4.2Å; F209-L225 HydrophobicContact CE1-CG 4.07Å; F209-L225 HydrophobicContact CZ-CD1 4.39Å; F209-L225 HydrophobicContact CZ-CD2 4.04Å; F209-L225 HydrophobicContact CZ-CG 4.42Å; F209-F254 HydrophobicContact CB-CE2 3.69Å; F209-F254 HydrophobicContact CB-CZ 3.64Å; F209-F254 HydrophobicContact CG-CZ 4.35Å
210	N	60.3	Low	62.7	Low	54 Å²	54	76 Å²	76	29%	0.289	44%	0.435	S	S	.	.			trans	-100.4	87.6	169.8	-66.3	-42.2	0	0	0	110.4	S206	S206-N210 WeakPolarHBondContact CA-ND2 3.46Å; S206-N210 WeakPolarHBondContact O-CA 3.44Å; S206-N210 VanDerWaalsContact O-CB 3.28Å; S206-N210 WeakPolarHBondContact O-CB 3.48Å; S206-N210 PolarHBondContact O-N 3.25Å; S206-N210 PolarHBondContact OG-ND2 3.36Å
211	S	49	Very low	63.7	Low	65 Å²	65	74.6 Å²	74.6	46%	0.455	42%	0.42	S	S	.	.	B	Isolated β-bridge	trans	-66.1	133.8	159	-179.6	0	0	0	0	108.8	E213 A214	S211-E213 PolarHBondContact O-N 3.47Å; S211-A214 CarbonylContact O-C 3.53Å; S211-A214 PolarHBondContact O-N 3.48Å; S211-A214 VanDerWaalsContact O-O 3.07Å
212	P	49.7	Very low	64.4	Low	139 Å²	139	72.2 Å²	72.2	90%	0.903	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-11.9	-173.3	26	-35.2	0	0	0	114.5
213	E	41.7	Very low	65.2	Low	142 Å²	142	73 Å²	73	66%	0.664	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-17.9	-179.4	-143.9	-170.3	124.5	0	0	113.9	R89 S211	R89-E213 IonicContact CZ-OE1 3.87Å; R89-E213 IonicContact NH1-OE1 3.42Å; R89-E213 PolarHBondContact NH1-OE1 2.94Å; R89-E213 IonicContact NH2-OE1 2.8Å; R89-E213 PolarHBondContact NH2-OE1 2.85Å; S211-E213 PolarHBondContact O-N 3.47Å
214	A	48.7	Very low	66.4	Low	48 Å²	48	73 Å²	73	40%	0.397	42%	0.421	S	S	.	.	B	Isolated β-bridge	trans	-160.8	129.2	174.3	0	0	0	0	0	111.3	S211 E216	S211-A214 CarbonylContact O-C 3.53Å; S211-A214 PolarHBondContact O-N 3.48Å; S211-A214 VanDerWaalsContact O-O 3.07Å; A214-E216 HydrophobicContact CB-CG 4.42Å; A214-E216 PolarHBondContact O-N 2.98Å
215	G	54.1	Low	67.4	Low	27 Å²	27	70.8 Å²	70.8	28%	0.278	41%	0.407	S	S	.	.	S	Bend	trans	-72.6	61.9	171.8	0	0	0	0	0	112.3	K86	K86-G215 PolarHBondContact NZ-O 3.37Å
216	E	60.9	Low	68.3	Low	119 Å²	119	73.3 Å²	73.3	56%	0.556	42%	0.42	S	S	*	.	S	Bend	trans	-136.5	131.7	-176.5	-62.9	-165.4	172.4	0	0	110.4	K86 A214 P218	K86-E216 IonicContact NZ-OE1 3.73Å; K86-E216 PolarHBondContact NZ-OE1 3.38Å; A214-E216 HydrophobicContact CB-CG 4.42Å; A214-E216 PolarHBondContact O-N 2.98Å; E216-P218 WeakPolarHBondContact O-CD 3.48Å
217	I	69.3	Low	69.7	Low	31 Å²	31	71.8 Å²	71.8	16%	0.159	41%	0.408	C	S	.	.			trans	-59.1	123.3	178.7	-69.3	143.9	0	0	0	108.6	F209 L221 L225 F254	F209-I217 HydrophobicContact CD1-CB 4.49Å; F209-I217 HydrophobicContact CD1-CG1 4.14Å; F209-I217 HydrophobicContact CD1-CG2 4.06Å; F209-I217 HydrophobicContact CE1-CG2 4.29Å; I217-L221 HydrophobicContact CG2-CB 4.32Å; I217-L225 HydrophobicContact CB-CD1 4.49Å; I217-L225 HydrophobicContact CD1-CD1 3.61Å; I217-L225 HydrophobicContact CG1-CD1 3.82Å; I217-L225 HydrophobicContact CG2-CD1 3.88Å; I217-F254 HydrophobicContact CD1-CD2 4.23Å; I217-F254 HydrophobicContact CD1-CE2 4.39Å; I217-F254 HydrophobicContact CG1-CD2 4.1Å; I217-F254 HydrophobicContact CG1-CE2 3.87Å
218	P	73	Confident	71.1	Confident	38 Å²	38	71.2 Å²	71.2	25%	0.247	40%	0.403	C	S	.	.			trans	-51	138.5	176.3	-28.9	35.5	0	0	0	111.5	E216 E220 L221 S222	E216-P218 WeakPolarHBondContact O-CD 3.48Å; P218-E220 PolarHBondContact O-N 2.99Å; P218-E220 VanDerWaalsContact O-N 3.14Å; P218-L221 HydrophobicContact CB-CB 4.48Å; P218-L221 HydrophobicContact CB-CD1 4.41Å; P218-L221 HydrophobicContact CB-CG 4.29Å; P218-L221 HydrophobicContact CG-CD1 4.15Å; P218-L221 PolarHBondContact O-N 2.97Å; P218-S222 PolarHBondContact O-N 3.2Å
219	P	71.4	Confident	72.6	Confident	115 Å²	115	67.3 Å²	67.3	75%	0.747	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-34.1	-173	22	-32.7	0	0	0	112.4	L221 S222	P219-L221 PolarHBondContact O-N 3.43Å; P219-S222 VanDerWaalsContact O-CB 3.25Å; P219-S222 WeakPolarHBondContact O-CB 3.32Å; P219-S222 PolarHBondContact O-N 3.43Å
220	E	76.1	Confident	74.1	Confident	163 Å²	163	71.6 Å²	71.6	76%	0.762	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-37.3	174.4	-63.4	170	-167.4	0	0	112.9	P218 C223	P218-E220 PolarHBondContact O-N 2.99Å; P218-E220 VanDerWaalsContact O-N 3.14Å; E220-C223 PolarHBondContact O-SG 2.85Å
221	L	77.9	Confident	75.8	Confident	52 Å²	52	69.1 Å²	69.1	27%	0.272	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-13.3	177.4	-59.2	-177.2	0	0	0	112.8	M208 F209 I217 P218 P219 C223 F224	M208-L221 VanDerWaalsContact O-CD1 3.25Å; M208-L221 WeakPolarHBondContact O-CD1 3.23Å; F209-L221 HydrophobicContact CD1-CB 4.3Å; F209-L221 HydrophobicContact CD1-CD1 3.97Å; F209-L221 HydrophobicContact CE1-CB 3.76Å; F209-L221 HydrophobicContact CE1-CD1 3.83Å; F209-L221 HydrophobicContact CE1-CG 4.42Å; F209-L221 HydrophobicContact CZ-CD1 4.37Å; I217-L221 HydrophobicContact CG2-CB 4.32Å; P218-L221 HydrophobicContact CB-CB 4.48Å; P218-L221 HydrophobicContact CB-CD1 4.41Å; P218-L221 HydrophobicContact CB-CG 4.29Å; P218-L221 HydrophobicContact CG-CD1 4.15Å; P218-L221 PolarHBondContact O-N 2.97Å; P219-L221 PolarHBondContact O-N 3.43Å; L221-C223 PolarHBondContact O-N 2.98Å; L221-F224 HydrophobicContact CD2-CD2 4.45Å; L221-F224 PolarHBondContact O-N 3.45Å
222	S	80.6	Confident	78.2	Confident	22 Å²	22	69.6 Å²	69.6	15%	0.154	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-23.6	-175	-140.7	0	0	0	0	113.6	P218 P219 R251	P218-S222 PolarHBondContact O-N 3.2Å; P219-S222 VanDerWaalsContact O-CB 3.25Å; P219-S222 WeakPolarHBondContact O-CB 3.32Å; P219-S222 PolarHBondContact O-N 3.43Å; S222-R251 PolarHBondContact O-NE 2.88Å; S222-R251 PolarHBondContact OG-NH1 3.39Å
223	C	82.8	Confident	80.5	Confident	75 Å²	75	63.3 Å²	63.3	51%	0.507	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-38.7	175.6	60.2	0	0	0	0	112.8	E220 L221 L225 N226	E220-C223 PolarHBondContact O-SG 2.85Å; L221-C223 PolarHBondContact O-N 2.98Å; C223-L225 PolarHBondContact O-N 3.36Å; C223-N226 WeakPolarHBondContact O-CB 3.19Å; C223-N226 PolarHBondContact O-N 2.9Å; C223-N226 VanDerWaalsContact O-N 3.14Å; C223-N226 PolarHBondContact O-ND2 2.86Å
224	F	86.2	Confident	83.1	Confident	143 Å²	143	62.6 Å²	62.6	63%	0.627	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-20.2	178.7	-64.2	-92.6	0	0	0	113.3	L221 R227	L221-F224 HydrophobicContact CD2-CD2 4.45Å; L221-F224 PolarHBondContact O-N 3.45Å; F224-R227 PolarHBondContact O-NH1 3.49Å
225	L	91.4	Very high	85.5	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.005	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-4.3	177	-63.3	-170.6	0	0	0	114	F209 I217 C223 R251 L252 L272	F209-L225 HydrophobicContact CD1-CD1 4.26Å; F209-L225 HydrophobicContact CE1-CD1 3.78Å; F209-L225 HydrophobicContact CE1-CD2 4.2Å; F209-L225 HydrophobicContact CE1-CG 4.07Å; F209-L225 HydrophobicContact CZ-CD1 4.39Å; F209-L225 HydrophobicContact CZ-CD2 4.04Å; F209-L225 HydrophobicContact CZ-CG 4.42Å; I217-L225 HydrophobicContact CB-CD1 4.49Å; I217-L225 HydrophobicContact CD1-CD1 3.61Å; I217-L225 HydrophobicContact CG1-CD1 3.82Å; I217-L225 HydrophobicContact CG2-CD1 3.88Å; C223-L225 PolarHBondContact O-N 3.36Å; L225-R251 HydrophobicContact CB-CG 3.97Å; L225-R251 CarbonylContact O-C 3.51Å; L225-R251 VanDerWaalsContact O-CA 3.3Å; L225-R251 WeakPolarHBondContact O-CA 3.46Å; L225-R251 WeakPolarHBondContact O-CG 3.45Å; L225-L252 HydrophobicContact CB-CB 4.17Å; L225-L252 HydrophobicContact CD2-CB 4.32Å; L225-L252 HydrophobicContact CD2-CD1 4.27Å; L225-L252 PolarHBondContact O-N 3.49Å; L225-L272 HydrophobicContact CD1-CD2 4.4Å; L225-L272 HydrophobicContact CD2-CD1 4.49Å
226	N	94.5	Very high	87.5	Confident	72 Å²	72	64 Å²	64	39%	0.385	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	145.7	171.3	-68.4	-41.5	0	0	0	110.3	C223 R251	C223-N226 WeakPolarHBondContact O-CB 3.19Å; C223-N226 PolarHBondContact O-N 2.9Å; C223-N226 VanDerWaalsContact O-N 3.14Å; C223-N226 PolarHBondContact O-ND2 2.86Å; N226-R251 VanDerWaalsContact OD1-CZ 3.27Å; N226-R251 PolarHBondContact OD1-NE 2.82Å; N226-R251 PolarHBondContact OD1-NH2 3.34Å
227	R	96.3	Very high	89.2	Confident	10 Å²	10	63.4 Å²	63.4	4%	0.038	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	132.1	177.3	-60.8	-65.5	176.5	-105.3	11.2	109.3	Q174 H176 W177 M179 F224 F229 G250 L252 L274	Q174-R227 VanDerWaalsContact O-CD 3.23Å; Q174-R227 WeakPolarHBondContact O-CD 3.35Å; Q174-R227 PolarHBondContact O-NE 3.23Å; Q174-R227 VanDerWaalsContact OE1-CD 3.24Å; H176-R227 PolarHBondContact O-NH2 2.95Å; W177-R227 PolarHBondContact O-NH2 3.07Å; M179-R227 PolarHBondContact SD-NE 2.84Å; M179-R227 PolarHBondContact SD-NH2 2.71Å; M179-R227 VanDerWaalsContact SD-NH2 3.4Å; F224-R227 PolarHBondContact O-NH1 3.49Å; R227-F229 HydrophobicContact CB-CD1 4.37Å; R227-F229 HydrophobicContact CB-CE1 4.42Å; R227-G250 PolarHBondContact N-O 3.13Å; R227-G250 PolarHBondContact O-N 3.3Å; R227-L252 HydrophobicContact CG-CD2 4.33Å; R227-L252 HydrophobicContact CG-CG 4.24Å; R227-L252 VanDerWaalsContact NH2-CD1 3.34Å; R227-L274 HydrophobicContact CB-CD1 3.86Å; R227-L274 HydrophobicContact CG-CD1 3.94Å
228	C	96.7	Very high	90.2	Very high	76 Å²	76	63.8 Å²	63.8	51%	0.514	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	108.4	175.5	-170.7	0	0	0	0	107.2	Q247 F248	C228-Q247 PolarHBondContact SG-NE2 2.98Å; C228-F248 VanDerWaalsContact CA-O 3.29Å; C228-F248 WeakPolarHBondContact CA-O 3.34Å
229	F	97.3	Very high	91.1	Very high	14 Å²	14	68 Å²	68	6%	0.061	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	172.5	-174	67.7	-85	0	0	0	111.7	F171 Q174 R227 A231 Q247 F248 L274	F171-F229 AromaticContact CD2-CE2 3.61Å; F171-F229 HydrophobicContact CD2-CE2 3.61Å; F171-F229 AromaticContact CD2-CZ 3.89Å; F171-F229 HydrophobicContact CD2-CZ 3.89Å; F171-F229 AromaticContact CE2-CE2 3.86Å; F171-F229 HydrophobicContact CE2-CE2 3.86Å; F171-F229 AromaticContact CE2-CZ 3.77Å; F171-F229 HydrophobicContact CE2-CZ 3.77Å; F171-F229 HydrophobicContact CG-CE2 4.28Å; F171-F229 HydrophobicContact CG-CZ 4.41Å; F171-F229 HydrophobicContact CZ-CZ 4.22Å; Q174-F229 HydrophobicContact CB-CD1 3.87Å; Q174-F229 HydrophobicContact CB-CE1 3.63Å; Q174-F229 HydrophobicContact CB-CE2 4.46Å; Q174-F229 HydrophobicContact CB-CG 4.38Å; Q174-F229 HydrophobicContact CB-CZ 3.95Å; Q174-F229 VanDerWaalsContact CD-CG 3.48Å; Q174-F229 HydrophobicContact CG-CB 4.07Å; Q174-F229 HydrophobicContact CG-CD1 3.5Å; Q174-F229 HydrophobicContact CG-CD2 3.94Å; Q174-F229 HydrophobicContact CG-CE1 3.78Å; Q174-F229 HydrophobicContact CG-CE2 4.2Å; Q174-F229 HydrophobicContact CG-CG 3.58Å; Q174-F229 HydrophobicContact CG-CZ 4.12Å; R227-F229 HydrophobicContact CB-CD1 4.37Å; R227-F229 HydrophobicContact CB-CE1 4.42Å; F229-A231 HydrophobicContact CD2-CB 4.48Å; F229-A231 HydrophobicContact CE2-CB 4.3Å; F229-Q247 CarbonylContact O-C 3.57Å; F229-Q247 WeakPolarHBondContact O-CA 3.36Å; F229-F248 HydrophobicContact CD1-CB 3.92Å; F229-F248 HydrophobicContact CD2-CB 4.31Å; F229-F248 HydrophobicContact CD2-CD2 4.26Å; F229-F248 HydrophobicContact CE1-CB 3.53Å; F229-F248 HydrophobicContact CE1-CG 4.29Å; F229-F248 HydrophobicContact CE2-CB 3.94Å; F229-F248 AromaticContact CE2-CD2 3.75Å; F229-F248 HydrophobicContact CE2-CD2 3.75Å; F229-F248 AromaticContact CE2-CG 3.95Å; F229-F248 HydrophobicContact CE2-CG 3.95Å; F229-F248 HydrophobicContact CG-CB 4.31Å; F229-F248 HydrophobicContact CZ-CB 3.54Å; F229-F248 HydrophobicContact CZ-CD1 4.45Å; F229-F248 HydrophobicContact CZ-CD2 4.09Å; F229-F248 AromaticContact CZ-CG 3.78Å; F229-F248 HydrophobicContact CZ-CG 3.78Å; F229-F248 PolarHBondContact N-O 3.19Å; F229-F248 VanDerWaalsContact N-O 3.08Å; F229-F248 PolarHBondContact O-N 3.47Å; F229-L274 HydrophobicContact CE1-CD2 3.91Å; F229-L274 HydrophobicContact CZ-CD2 4.14Å
230	I	97.6	Very high	92.1	Very high	97 Å²	97	68.9 Å²	68.9	50%	0.497	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	136.4	-178.9	-58.2	173.6	0	0	0	108.2	T245 M246 L281	I230-T245 HydrophobicContact CG2-CG2 3.45Å; I230-T245 VanDerWaalsContact CG2-CG2 3.45Å; I230-M246 WeakPolarHBondContact CA-O 3.36Å; I230-L281 HydrophobicContact CB-CD1 4.41Å; I230-L281 HydrophobicContact CD1-CD1 3.52Å; I230-L281 HydrophobicContact CG1-CD1 3.71Å; I230-L281 HydrophobicContact CG2-CD1 3.85Å
231	A	97.8	Very high	92.8	Very high	3 Å²	3	64.7 Å²	64.7	3%	0.025	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	151.2	169.7	0	0	0	0	0	110.7	I163 D167 F171 F229 M246 F248	I163-A231 HydrophobicContact CD1-CB 4.48Å; I163-A231 HydrophobicContact CG2-CB 4.5Å; D167-A231 HydrophobicContact CB-CB 4.13Å; F171-A231 HydrophobicContact CD2-CB 4.37Å; F229-A231 HydrophobicContact CD2-CB 4.48Å; F229-A231 HydrophobicContact CE2-CB 4.3Å; A231-M246 PolarHBondContact N-O 2.75Å; A231-M246 PolarHBondContact O-N 3.27Å; A231-F248 HydrophobicContact CB-CD2 4.36Å; A231-F248 HydrophobicContact CB-CE2 3.99Å
232	R	97.6	Very high	93.7	Very high	74 Å²	74	63.3 Å²	63.3	28%	0.279	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	118.7	172.6	-68.5	165.5	-71.8	171.5	-7.7	109.5	H164 D166 D167 F243	H164-R232 HydrophobicContact CB-CB 3.67Å; H164-R232 PolarHBondContact CE1-NH1 2.91Å; H164-R232 PolarHBondContact N-O 3.46Å; H164-R232 VanDerWaalsContact ND1-CZ 3.32Å; H164-R232 PolarHBondContact ND1-NH1 3.46Å; H164-R232 PolarHBondContact ND1-NH2 3.12Å; D166-R232 IonicContact OD2-CZ 2.91Å; D166-R232 IonicContact OD2-NH1 3.72Å; D166-R232 PolarHBondContact OD2-NH1 3.11Å; D166-R232 IonicContact OD2-NH2 3.5Å; D166-R232 PolarHBondContact OD2-NH2 3.27Å; D167-R232 IonicContact OD1-CZ 2.69Å; D167-R232 IonicContact OD1-NE 3.39Å; D167-R232 PolarHBondContact OD1-NE 2.95Å; D167-R232 IonicContact OD1-NH2 3.12Å; D167-R232 PolarHBondContact OD1-NH2 2.91Å; D167-R232 VanDerWaalsContact OD2-CB 3.31Å; D167-R232 WeakPolarHBondContact OD2-CB 3.25Å; D167-R232 IonicContact OD2-CZ 3.43Å; D167-R232 PolarHBondContact OD2-N 3.06Å; D167-R232 IonicContact OD2-NE 3.04Å; D167-R232 PolarHBondContact OD2-NE 3.27Å; D167-R232 IonicContact OD2-NH2 3.28Å; R232-F243 HydrophobicContact CB-CB 4.28Å; R232-F243 HydrophobicContact CB-CD1 4.24Å
233	V	98.1	Very high	94.4	Very high	8 Å²	8	65.1 Å²	65.1	5%	0.048	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	135.8	177.7	-162.9	0	0	0	0	108.6	L147 Y162 I163 C235 F243 L244 M246 F248	L147-V233 HydrophobicContact CD1-CB 4.31Å; L147-V233 HydrophobicContact CD1-CG1 3.62Å; L147-V233 HydrophobicContact CD2-CB 4.22Å; L147-V233 HydrophobicContact CD2-CG1 4.32Å; Y162-V233 CarbonylContact O-C 3.59Å; Y162-V233 WeakPolarHBondContact O-CA 3.48Å; I163-V233 HydrophobicContact CD1-CG1 4.44Å; I163-V233 HydrophobicContact CD1-CG2 4.08Å; V233-C235 PolarHBondContact O-N 3.06Å; V233-F243 CarbonylContact O-C 3.31Å; V233-F243 VanDerWaalsContact O-CA 3.3Å; V233-F243 WeakPolarHBondContact O-CA 3.26Å; V233-L244 PolarHBondContact N-O 3.2Å; V233-L244 PolarHBondContact O-N 3.28Å; V233-M246 HydrophobicContact CB-CG 4.44Å; V233-M246 HydrophobicContact CB-SD 4.31Å; V233-M246 HydrophobicContact CG2-CB 3.98Å; V233-M246 HydrophobicContact CG2-CG 3.82Å; V233-M246 HydrophobicContact CG2-SD 3.89Å; V233-F248 HydrophobicContact CG2-CE2 3.79Å; V233-F248 HydrophobicContact CG2-CZ 3.52Å
234	R	98	Very high	95.1	Very high	126 Å²	126	63.7 Å²	63.7	48%	0.475	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	133	175.6	-172.3	175.5	179.8	171.5	2	109.3	F149 Y162 G242 F243	F149-R234 HydrophobicContact CE2-CB 4.19Å; F149-R234 HydrophobicContact CE2-CG 4.05Å; F149-R234 WeakPolarHBondContact CE2-O 3.13Å; F149-R234 HydrophobicContact CZ-CG 4.03Å; Y162-R234 WeakPolarHBondContact O-CB 3.23Å; Y162-R234 PolarHBondContact O-N 3.01Å; R234-G242 CarbonylContact C-O 3.59Å; R234-G242 WeakPolarHBondContact CA-O 3.32Å; R234-F243 HydrophobicContact CB-CD1 4.28Å; R234-F243 HydrophobicContact CB-CE1 4.01Å
235	C	97.5	Very high	95.6	Very high	6 Å²	6	59.2 Å²	59.2	4%	0.041	33%	0.329	C	S	.	.			trans	-134	125.5	-175.8	-177.8	0	0	0	0	109.1	L147 V233 L237 D238 G242 L244	L147-C235 HydrophobicContact CD2-CB 3.92Å; V233-C235 PolarHBondContact O-N 3.06Å; C235-L237 VanDerWaalsContact C-N 3.28Å; C235-L237 PolarHBondContact SG-N 3.09Å; C235-L237 VanDerWaalsContact SG-N 3.37Å; C235-D238 HydrophobicContact CB-CB 4.27Å; C235-G242 PolarHBondContact N-O 2.73Å; C235-G242 CarbonylContact O-C 3.5Å; C235-L244 HydrophobicContact CB-CB 3.77Å
236	L	97.1	Very high	95.9	Very high	99 Å²	99	59.1 Å²	59.1	52%	0.518	33%	0.329	S	S	.	.	S	Bend	trans	-81.7	-9.7	175.3	-55.6	-176.9	0	0	0	112.6	L147 F149	L147-L236 PolarHBondContact O-N 3.04Å; F149-L236 HydrophobicContact CD1-CD1 3.89Å; F149-L236 HydrophobicContact CD1-CG 4.35Å; F149-L236 HydrophobicContact CD2-CG 4.26Å; F149-L236 HydrophobicContact CE1-CD1 3.78Å; F149-L236 HydrophobicContact CE1-CD2 4.11Å; F149-L236 HydrophobicContact CE1-CG 3.99Å; F149-L236 HydrophobicContact CE2-CD1 4.45Å; F149-L236 HydrophobicContact CE2-CD2 4.2Å; F149-L236 HydrophobicContact CE2-CG 3.88Å; F149-L236 HydrophobicContact CG-CD1 4.28Å; F149-L236 HydrophobicContact CG-CG 4.48Å; F149-L236 HydrophobicContact CZ-CD1 4.08Å; F149-L236 HydrophobicContact CZ-CD2 3.7Å; F149-L236 HydrophobicContact CZ-CG 3.74Å
237	L	95.3	Very high	96	Very high	107 Å²	107	58.6 Å²	58.6	56%	0.56	32%	0.324	S	S	*	.	S	Bend	trans	-92.7	-17.6	178.7	-49	178.2	0	0	0	112.7	D145 C235	D145-L237 WeakPolarHBondContact O-CD1 3.33Å; C235-L237 VanDerWaalsContact C-N 3.28Å; C235-L237 PolarHBondContact SG-N 3.09Å; C235-L237 VanDerWaalsContact SG-N 3.37Å
238	D	92	Very high	96.1	Very high	39 Å²	39	58.2 Å²	58.2	21%	0.209	32%	0.323	C	S	.	.			trans	-86.7	117.2	172.3	173	40.6	0	0	0	111	C235 T240 S241 G242 F243	C235-D238 HydrophobicContact CB-CB 4.27Å; D238-T240 WeakPolarHBondContact OD1-CA 3.39Å; D238-T240 WeakPolarHBondContact OD1-CB 3.29Å; D238-T240 PolarHBondContact OD1-N 2.91Å; D238-T240 PolarHBondContact OD1-OG1 3.03Å; D238-S241 WeakPolarHBondContact OD2-CA 3.45Å; D238-S241 WeakPolarHBondContact OD2-CB 3.36Å; D238-S241 PolarHBondContact OD2-N 3.04Å; D238-S241 PolarHBondContact OD2-OG 3.21Å; D238-G242 PolarHBondContact OD2-N 3.06Å; D238-F243 PolarHBondContact OD2-N 3.11Å
239	S	91.6	Very high	96.1	Very high	127 Å²	127	59.1 Å²	59.1	89%	0.888	32%	0.32	S	S	*	.	S	Bend	trans	-88.3	-4.1	175.1	53.1	0	0	0	0	114.2
240	T	91.1	Very high	96.1	Very high	132 Å²	132	59.4 Å²	59.4	81%	0.81	33%	0.327	S	S	*	.	S	Bend	trans	-90.7	-47.6	-174.2	-34.5	0	0	0	0	112.5	D238	D238-T240 WeakPolarHBondContact OD1-CA 3.39Å; D238-T240 WeakPolarHBondContact OD1-CB 3.29Å; D238-T240 PolarHBondContact OD1-N 2.91Å; D238-T240 PolarHBondContact OD1-OG1 3.03Å
241	S	92.3	Very high	96	Very high	75 Å²	75	59 Å²	59	52%	0.524	32%	0.319	S	S	.	.	S	Bend	trans	-130.4	-19.6	-174.9	72.7	0	0	0	0	113.4	D238 F243	D238-S241 WeakPolarHBondContact OD2-CA 3.45Å; D238-S241 WeakPolarHBondContact OD2-CB 3.36Å; D238-S241 PolarHBondContact OD2-N 3.04Å; D238-S241 PolarHBondContact OD2-OG 3.21Å; S241-F243 VanDerWaalsContact C-N 3.28Å; S241-F243 WeakPolarHBondContact O-CD2 3.25Å; S241-F243 PolarHBondContact OG-N 2.99Å; S241-F243 VanDerWaalsContact OG-N 3.15Å; S241-F243 PolarHBondContact OG-O 2.72Å
242	G	95.7	Very high	95.8	Very high	24 Å²	24	58.9 Å²	58.9	25%	0.247	32%	0.318	C	S	.	.	S	Bend	trans	75.2	15.8	-170.1	0	0	0	0	0	113.3	R234 C235 D238	R234-G242 CarbonylContact C-O 3.59Å; R234-G242 WeakPolarHBondContact CA-O 3.32Å; C235-G242 PolarHBondContact N-O 2.73Å; C235-G242 CarbonylContact O-C 3.5Å; D238-G242 PolarHBondContact OD2-N 3.06Å
243	F	96.7	Very high	95.6	Very high	60 Å²	60	60.3 Å²	60.3	26%	0.263	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	136.5	-178.8	-70.8	-88	0	0	0	111.9	H164 R232 V233 R234 D238 S241	H164-F243 HydrophobicContact CB-CD1 3.93Å; H164-F243 HydrophobicContact CB-CE1 3.73Å; H164-F243 HydrophobicContact CB-CZ 4.32Å; H164-F243 AromaticContact CD2-CD2 3.89Å; H164-F243 AromaticContact CD2-CE1 3.87Å; H164-F243 AromaticContact CD2-CE2 3.67Å; H164-F243 AromaticContact CD2-CZ 3.66Å; R232-F243 HydrophobicContact CB-CB 4.28Å; R232-F243 HydrophobicContact CB-CD1 4.24Å; V233-F243 CarbonylContact O-C 3.31Å; V233-F243 VanDerWaalsContact O-CA 3.3Å; V233-F243 WeakPolarHBondContact O-CA 3.26Å; R234-F243 HydrophobicContact CB-CD1 4.28Å; R234-F243 HydrophobicContact CB-CE1 4.01Å; D238-F243 PolarHBondContact OD2-N 3.11Å; S241-F243 VanDerWaalsContact C-N 3.28Å; S241-F243 WeakPolarHBondContact O-CD2 3.25Å; S241-F243 PolarHBondContact OG-N 2.99Å; S241-F243 VanDerWaalsContact OG-N 3.15Å; S241-F243 PolarHBondContact OG-O 2.72Å
244	L	96.3	Very high	95.2	Very high	45 Å²	45	60.3 Å²	60.3	24%	0.236	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.3	171.6	-175.9	58.2	0	0	0	109.4	Y146 L147 V233 C235 M246 P280	Y146-L244 WeakPolarHBondContact O-CD2 3.28Å; L147-L244 HydrophobicContact CD2-CB 4.04Å; L147-L244 HydrophobicContact CD2-CD2 4.02Å; V233-L244 PolarHBondContact N-O 3.2Å; V233-L244 PolarHBondContact O-N 3.28Å; C235-L244 HydrophobicContact CB-CB 3.77Å; L244-M246 HydrophobicContact CD2-CG 4.46Å; L244-M246 HydrophobicContact CG-CG 4.17Å; L244-M246 PolarHBondContact O-N 2.94Å; L244-P280 HydrophobicContact CD2-CB 3.97Å; L244-P280 HydrophobicContact CG-CB 4.39Å
245	T	96.8	Very high	94.9	Very high	48 Å²	48	54.6 Å²	54.6	29%	0.294	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	120.4	174.1	-59	0	0	0	0	108.8	I230 L281	I230-T245 HydrophobicContact CG2-CG2 3.45Å; I230-T245 VanDerWaalsContact CG2-CG2 3.45Å; T245-L281 HydrophobicContact CG2-CB 4.3Å; T245-L281 HydrophobicContact CG2-CD1 4.23Å; T245-L281 PolarHBondContact O-N 2.94Å
246	M	97.1	Very high	94.5	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	144	-178.4	-57.2	-162	81.7	0	0	111.8	F126 L147 I230 A231 V233 L244 F248 A278 V279 P280	F126-M246 HydrophobicContact CD1-CE 4.13Å; F126-M246 HydrophobicContact CE1-CE 3.59Å; F126-M246 HydrophobicContact CE1-SD 3.67Å; F126-M246 HydrophobicContact CZ-CE 4.41Å; F126-M246 HydrophobicContact CZ-SD 4.09Å; L147-M246 HydrophobicContact CD1-SD 4.29Å; L147-M246 HydrophobicContact CD2-SD 3.93Å; L147-M246 HydrophobicContact CG-SD 4.34Å; I230-M246 WeakPolarHBondContact CA-O 3.36Å; A231-M246 PolarHBondContact N-O 2.75Å; A231-M246 PolarHBondContact O-N 3.27Å; V233-M246 HydrophobicContact CB-CG 4.44Å; V233-M246 HydrophobicContact CB-SD 4.31Å; V233-M246 HydrophobicContact CG2-CB 3.98Å; V233-M246 HydrophobicContact CG2-CG 3.82Å; V233-M246 HydrophobicContact CG2-SD 3.89Å; L244-M246 HydrophobicContact CD2-CG 4.46Å; L244-M246 HydrophobicContact CG-CG 4.17Å; L244-M246 PolarHBondContact O-N 2.94Å; M246-F248 HydrophobicContact CB-CE2 4.03Å; M246-F248 HydrophobicContact CB-CZ 4.47Å; M246-A278 HydrophobicContact CE-CB 3.95Å; M246-A278 WeakPolarHBondContact CE-O 3.46Å; M246-A278 HydrophobicContact SD-CB 4.25Å; M246-V279 CarbonylContact C-O 3.55Å; M246-V279 VanDerWaalsContact CA-O 3.29Å; M246-V279 WeakPolarHBondContact CA-O 3.35Å; M246-P280 HydrophobicContact CE-CB 4.27Å
247	Q	97.7	Very high	93.9	Very high	60 Å²	60	52.5 Å²	52.5	28%	0.28	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	125.3	168.1	-174.6	173.7	12.8	0	0	109.5	C228 F229 A278 V279 L281	C228-Q247 PolarHBondContact SG-NE2 2.98Å; F229-Q247 CarbonylContact O-C 3.57Å; F229-Q247 WeakPolarHBondContact O-CA 3.36Å; Q247-A278 WeakPolarHBondContact O-CA 3.46Å; Q247-V279 PolarHBondContact N-O 3.01Å; Q247-V279 PolarHBondContact O-N 3.26Å; Q247-L281 HydrophobicContact CB-CD1 4.13Å; Q247-L281 HydrophobicContact CB-CD2 3.94Å; Q247-L281 HydrophobicContact CB-CG 3.91Å
248	F	98.1	Very high	93.5	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.009	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	113.1	175.6	-68.7	-93.5	0	0	0	108.9	L128 I163 F171 C228 F229 A231 V233 M246 A278	L128-F248 HydrophobicContact CD2-CD1 4.38Å; L128-F248 HydrophobicContact CD2-CE1 3.76Å; I163-F248 HydrophobicContact CD1-CZ 4.34Å; F171-F248 HydrophobicContact CE2-CD1 4.35Å; F171-F248 HydrophobicContact CE2-CE1 4.06Å; F171-F248 HydrophobicContact CE2-CE2 4.25Å; F171-F248 AromaticContact CE2-CZ 4Å; F171-F248 HydrophobicContact CE2-CZ 4Å; F171-F248 HydrophobicContact CZ-CE1 4.5Å; C228-F248 VanDerWaalsContact CA-O 3.29Å; C228-F248 WeakPolarHBondContact CA-O 3.34Å; F229-F248 HydrophobicContact CD1-CB 3.92Å; F229-F248 HydrophobicContact CD2-CB 4.31Å; F229-F248 HydrophobicContact CD2-CD2 4.26Å; F229-F248 HydrophobicContact CE1-CB 3.53Å; F229-F248 HydrophobicContact CE1-CG 4.29Å; F229-F248 HydrophobicContact CE2-CB 3.94Å; F229-F248 AromaticContact CE2-CD2 3.75Å; F229-F248 HydrophobicContact CE2-CD2 3.75Å; F229-F248 AromaticContact CE2-CG 3.95Å; F229-F248 HydrophobicContact CE2-CG 3.95Å; F229-F248 HydrophobicContact CG-CB 4.31Å; F229-F248 HydrophobicContact CZ-CB 3.54Å; F229-F248 HydrophobicContact CZ-CD1 4.45Å; F229-F248 HydrophobicContact CZ-CD2 4.09Å; F229-F248 AromaticContact CZ-CG 3.78Å; F229-F248 HydrophobicContact CZ-CG 3.78Å; F229-F248 PolarHBondContact N-O 3.19Å; F229-F248 VanDerWaalsContact N-O 3.08Å; F229-F248 PolarHBondContact O-N 3.47Å; A231-F248 HydrophobicContact CB-CD2 4.36Å; A231-F248 HydrophobicContact CB-CE2 3.99Å; V233-F248 HydrophobicContact CG2-CE2 3.79Å; V233-F248 HydrophobicContact CG2-CZ 3.52Å; M246-F248 HydrophobicContact CB-CE2 4.03Å; M246-F248 HydrophobicContact CB-CZ 4.47Å; F248-A278 HydrophobicContact CD1-CB 3.98Å; F248-A278 HydrophobicContact CE1-CB 3.76Å; F248-A278 HydrophobicContact CZ-CB 4.34Å
249	Q	97.5	Very high	93.2	Very high	95 Å²	95	54.9 Å²	54.9	44%	0.444	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	123.7	179.5	-172.6	176.9	-4.2	0	0	110.5	C276 I277	Q249-C276 CarbonylContact O-C 3.47Å; Q249-C276 WeakPolarHBondContact O-CA 3.4Å; Q249-C276 VanDerWaalsContact O-CB 3.31Å; Q249-C276 WeakPolarHBondContact O-CB 3.45Å; Q249-I277 PolarHBondContact N-O 3.34Å; Q249-I277 PolarHBondContact O-N 3.48Å
250	G	96.4	Very high	92.8	Very high	21 Å²	21	51.8 Å²	51.8	22%	0.216	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178	-159.7	-171.2	0	0	0	0	0	115.8	R227 F275	R227-G250 PolarHBondContact N-O 3.13Å; R227-G250 PolarHBondContact O-N 3.3Å; G250-F275 CarbonylContact C-O 3.59Å; G250-F275 WeakPolarHBondContact CA-O 3.16Å
251	R	95.4	Very high	92.5	Very high	87 Å²	87	52.6 Å²	52.6	33%	0.328	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	144.7	177.1	-171.7	178.9	-65.3	173.9	7.7	111.3	S222 L225 N226 F275	S222-R251 PolarHBondContact O-NE 2.88Å; S222-R251 PolarHBondContact OG-NH1 3.39Å; L225-R251 HydrophobicContact CB-CG 3.97Å; L225-R251 CarbonylContact O-C 3.51Å; L225-R251 VanDerWaalsContact O-CA 3.3Å; L225-R251 WeakPolarHBondContact O-CA 3.46Å; L225-R251 WeakPolarHBondContact O-CG 3.45Å; N226-R251 VanDerWaalsContact OD1-CZ 3.27Å; N226-R251 PolarHBondContact OD1-NE 2.82Å; N226-R251 PolarHBondContact OD1-NH2 3.34Å; R251-F275 PolarHBondContact N-O 3.36Å; R251-F275 PolarHBondContact O-N 2.94Å
252	L	94.6	Very high	92.1	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	129.2	166.6	-56.6	-175.3	0	0	0	110.5	L225 R227 L272 G273 L274	L225-L252 HydrophobicContact CB-CB 4.17Å; L225-L252 HydrophobicContact CD2-CB 4.32Å; L225-L252 HydrophobicContact CD2-CD1 4.27Å; L225-L252 PolarHBondContact O-N 3.49Å; R227-L252 HydrophobicContact CG-CD2 4.33Å; R227-L252 HydrophobicContact CG-CG 4.24Å; R227-L252 VanDerWaalsContact NH2-CD1 3.34Å; L252-L272 HydrophobicContact CB-CB 4.46Å; L252-L272 HydrophobicContact CB-CD2 4.35Å; L252-L272 HydrophobicContact CD1-CD1 4.39Å; L252-G273 CarbonylContact C-O 3.53Å; L252-G273 WeakPolarHBondContact CA-O 3.46Å; L252-L274 HydrophobicContact CD2-CB 3.75Å; L252-L274 HydrophobicContact CD2-CD1 4.24Å
253	K	92.2	Very high	91.4	Very high	104 Å²	104	56.6 Å²	56.6	45%	0.452	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	156.2	175	-56.6	-179.9	-179	179.3	0	110.3	L255 L272 G273 F275	K253-L255 PolarHBondContact O-N 3.48Å; K253-L272 CarbonylContact O-C 3.57Å; K253-L272 WeakPolarHBondContact O-CA 3.35Å; K253-G273 PolarHBondContact N-O 2.74Å; K253-G273 PolarHBondContact O-N 3.47Å; K253-F275 HydrophobicContact CB-CD2 3.73Å; K253-F275 HydrophobicContact CB-CE2 3.79Å; K253-F275 HydrophobicContact CD-CD2 4.07Å; K253-F275 HydrophobicContact CD-CE2 4.5Å; K253-F275 HydrophobicContact CD-CG 4.21Å; K253-F275 HydrophobicContact CG-CD2 4.07Å
254	F	90.8	Very high	90.8	Very high	8 Å²	8	58.2 Å²	58.2	4%	0.035	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	123.8	178.5	-74	-68.2	0	0	0	113.2	V205 F209 I217 H256 A270 L272	V205-F254 HydrophobicContact CG1-CE1 4.03Å; V205-F254 HydrophobicContact CG1-CZ 4.04Å; F209-F254 HydrophobicContact CB-CE2 3.69Å; F209-F254 HydrophobicContact CB-CZ 3.64Å; F209-F254 HydrophobicContact CG-CZ 4.35Å; I217-F254 HydrophobicContact CD1-CD2 4.23Å; I217-F254 HydrophobicContact CD1-CE2 4.39Å; I217-F254 HydrophobicContact CG1-CD2 4.1Å; I217-F254 HydrophobicContact CG1-CE2 3.87Å; F254-H256 PolarHBondContact O-N 2.83Å; F254-H256 VanDerWaalsContact O-N 3.11Å; F254-H256 PolarHBondContact O-ND1 3.46Å; F254-A270 HydrophobicContact CB-CB 4.14Å; F254-A270 HydrophobicContact CD1-CB 4.19Å; F254-A270 WeakPolarHBondContact CD1-O 3.5Å; F254-A270 WeakPolarHBondContact CE1-O 3.32Å; F254-A270 HydrophobicContact CG-CB 4.48Å; F254-L272 HydrophobicContact CD1-CD2 3.78Å; F254-L272 HydrophobicContact CD1-CG 4.1Å; F254-L272 HydrophobicContact CD2-CD2 4.12Å; F254-L272 HydrophobicContact CE1-CD2 3.71Å; F254-L272 HydrophobicContact CE1-CG 3.78Å; F254-L272 HydrophobicContact CE2-CD2 4.04Å; F254-L272 HydrophobicContact CG-CD2 3.99Å; F254-L272 HydrophobicContact CZ-CD2 3.83Å; F254-L272 HydrophobicContact CZ-CG 4.19Å
255	L	90.6	Very high	90.2	Very high	7 Å²	7	58.2 Å²	58.2	4%	0.037	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	88	168.9	-68	170.2	0	0	0	109.1	F79 V129 F137 K253 Q258 Q271 F275	F79-L255 HydrophobicContact CD2-CD2 4.18Å; F79-L255 HydrophobicContact CE2-CD2 4.21Å; V129-L255 HydrophobicContact CG1-CD2 4.22Å; F137-L255 HydrophobicContact CD1-CD2 3.96Å; F137-L255 HydrophobicContact CD2-CD1 4.41Å; F137-L255 HydrophobicContact CD2-CD2 4.26Å; F137-L255 HydrophobicContact CE1-CD2 3.99Å; F137-L255 HydrophobicContact CE2-CD2 4.29Å; F137-L255 HydrophobicContact CG-CD2 4.1Å; F137-L255 HydrophobicContact CZ-CD2 4.16Å; K253-L255 PolarHBondContact O-N 3.48Å; L255-Q258 HydrophobicContact CB-CG 4.1Å; L255-Q258 WeakPolarHBondContact O-CG 3.3Å; L255-Q271 PolarHBondContact N-O 3.23Å; L255-F275 HydrophobicContact CD2-CE2 3.8Å; L255-F275 HydrophobicContact CD2-CZ 3.64Å; L255-F275 HydrophobicContact CG-CE2 4.41Å
256	H	89.1	Confident	89.7	Confident	41 Å²	41	60 Å²	60	19%	0.19	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	166.7	173.7	-65.8	75.5	0	0	0	111.7	F79 A82 F254 Q258	F79-H256 HydrophobicContact CD2-CB 4.37Å; A82-H256 HydrophobicContact CB-CB 4.04Å; F254-H256 PolarHBondContact O-N 2.83Å; F254-H256 VanDerWaalsContact O-N 3.11Å; F254-H256 PolarHBondContact O-ND1 3.46Å; H256-Q258 PolarHBondContact O-N 3.4Å; H256-Q258 VanDerWaalsContact O-N 3.07Å; H256-Q258 PolarHBondContact O-NE2 3.22Å
257	G	85.3	Confident	88.9	Confident	19 Å²	19	65.7 Å²	65.7	20%	0.196	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	3.7	169.2	0	0	0	0	0	116.6	S78 K259	S78-G257 WeakPolarHBondContact CB-O 3.5Å; S78-G257 PolarHBondContact OG-O 3.25Å; G257-K259 VanDerWaalsContact C-N 3.34Å; G257-K259 PolarHBondContact O-N 2.84Å
258	Q	87.3	Confident	88.1	Confident	39 Å²	39	64.7 Å²	64.7	18%	0.182	35%	0.353	C	S	.	.			trans	-74.1	-18.8	-173.3	-61.5	-50.8	-65.4	0	0	115	R75 L255 H256 K260	R75-Q258 PolarHBondContact O-NE2 2.76Å; L255-Q258 HydrophobicContact CB-CG 4.1Å; L255-Q258 WeakPolarHBondContact O-CG 3.3Å; H256-Q258 PolarHBondContact O-N 3.4Å; H256-Q258 VanDerWaalsContact O-N 3.07Å; H256-Q258 PolarHBondContact O-NE2 3.22Å; Q258-K260 HydrophobicContact CB-CG 4.43Å; Q258-K260 PolarHBondContact O-N 3.4Å
259	K	84.3	Confident	87.4	Confident	158 Å²	158	67.3 Å²	67.3	69%	0.687	37%	0.37	S	S	*	.			trans	50.9	27.8	174.6	-62.3	171.4	-176.9	171.6	0	114.3	G257	G257-K259 VanDerWaalsContact C-N 3.34Å; G257-K259 PolarHBondContact O-N 2.84Å
260	K	84.1	Confident	86.8	Confident	61 Å²	61	64.3 Å²	64.3	27%	0.265	36%	0.362	S	S	.	.			trans	-56.9	139	172.5	-73.6	-173.4	177.4	-173.5	0	109	D133 Q258 V268	D133-K260 IonicContact OD2-NZ 3.39Å; D133-K260 PolarHBondContact OD2-NZ 2.77Å; Q258-K260 HydrophobicContact CB-CG 4.43Å; Q258-K260 PolarHBondContact O-N 3.4Å; K260-V268 HydrophobicContact CB-CB 4Å; K260-V268 HydrophobicContact CB-CG2 4.22Å; K260-V268 PolarHBondContact O-N 3.14Å
261	K	85.4	Confident	86.3	Confident	150 Å²	150	65.6 Å²	65.6	65%	0.652	36%	0.362	S	S	*	.	B	Isolated β-bridge	trans	-115.2	143.7	173	-68.4	-177.3	178.7	-174	0	110.1	T266 L267	K261-T266 CarbonylContact C-O 3.5Å; K261-T266 VanDerWaalsContact CA-O 3.24Å; K261-T266 WeakPolarHBondContact CA-O 3.4Å; K261-L267 HydrophobicContact CG-CD2 4.04Å
262	S	83.4	Confident	86.1	Confident	33 Å²	33	62 Å²	62	23%	0.231	35%	0.35	C	S	.	.			trans	-72.9	167.9	169.6	61.1	0	0	0	0	110.8	S264 G265 T266	S262-S264 PolarHBondContact O-N 3.15Å; S262-S264 PolarHBondContact OG-OG 2.86Å; S262-G265 PolarHBondContact O-N 2.88Å; S262-T266 PolarHBondContact N-O 3.18Å; S262-T266 WeakPolarHBondContact OG-CB 3.45Å; S262-T266 PolarHBondContact OG-N 3.33Å; S262-T266 PolarHBondContact OG-O 2.85Å
263	P	80.9	Confident	86.1	Confident	150 Å²	150	62 Å²	62	97%	0.974	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-25.8	170.5	-26.4	36.3	0	0	0	113.8	G265	P263-G265 PolarHBondContact O-N 3.13Å
264	S	84.5	Confident	86.4	Confident	94 Å²	94	57.1 Å²	57.1	66%	0.657	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	7.3	172.7	59.8	0	0	0	0	114.3	S262 T266	S262-S264 PolarHBondContact O-N 3.15Å; S262-S264 PolarHBondContact OG-OG 2.86Å; S264-T266 PolarHBondContact O-N 3.31Å; S264-T266 VanDerWaalsContact O-N 3.11Å; S264-T266 PolarHBondContact OG-OG1 2.92Å
265	G	83.5	Confident	86.7	Confident	45 Å²	45	59 Å²	59	46%	0.464	34%	0.336	S	S	.	.	S	Bend	trans	74.1	-8.1	-178.6	0	0	0	0	0	115.3	S262 P263	S262-G265 PolarHBondContact O-N 2.88Å; P263-G265 PolarHBondContact O-N 3.13Å
266	T	85.1	Confident	87.1	Confident	86 Å²	86	59 Å²	59	53%	0.528	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-65	145.2	178.5	-34.4	0	0	0	0	110.6	K261 S262 S264 V268	K261-T266 CarbonylContact C-O 3.5Å; K261-T266 VanDerWaalsContact CA-O 3.24Å; K261-T266 WeakPolarHBondContact CA-O 3.4Å; S262-T266 PolarHBondContact N-O 3.18Å; S262-T266 WeakPolarHBondContact OG-CB 3.45Å; S262-T266 PolarHBondContact OG-N 3.33Å; S262-T266 PolarHBondContact OG-O 2.85Å; S264-T266 PolarHBondContact O-N 3.31Å; S264-T266 VanDerWaalsContact O-N 3.11Å; S264-T266 PolarHBondContact OG-OG1 2.92Å; T266-V268 PolarHBondContact O-N 3.22Å
267	L	81.4	Confident	87.5	Confident	118 Å²	118	59.4 Å²	59.4	62%	0.618	34%	0.34	S	S	*	.	B	Isolated β-bridge	trans	-72.4	128.2	174.6	-71.8	168	0	0	0	110.2	K261	K261-L267 HydrophobicContact CG-CD2 4.04Å
268	V	80.9	Confident	88.1	Confident	39 Å²	39	58.5 Å²	58.5	24%	0.236	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-77.2	138.4	173.6	-177.4	0	0	0	0	108.2	K260 T266	K260-V268 HydrophobicContact CB-CB 4Å; K260-V268 HydrophobicContact CB-CG2 4.22Å; K260-V268 PolarHBondContact O-N 3.14Å; T266-V268 PolarHBondContact O-N 3.22Å
269	P	81.9	Confident	88.5	Confident	57 Å²	57	58.4 Å²	58.4	37%	0.37	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-59.3	166	175.1	25.2	-35	0	0	0	112.4	Q271	P269-Q271 PolarHBondContact O-N 2.95Å
270	A	84.9	Confident	89.1	Confident	33 Å²	33	52.1 Å²	52.1	27%	0.273	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-60.1	129.4	172.1	0	0	0	0	0	109.6	F254	F254-A270 HydrophobicContact CB-CB 4.14Å; F254-A270 HydrophobicContact CD1-CB 4.19Å; F254-A270 WeakPolarHBondContact CD1-O 3.5Å; F254-A270 WeakPolarHBondContact CE1-O 3.32Å; F254-A270 HydrophobicContact CG-CB 4.48Å
271	Q	87.5	Confident	89.4	Confident	47 Å²	47	51.5 Å²	51.5	22%	0.22	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	153.9	179.3	-67.5	-178	-43.7	0	0	110.4	L255 P269	L255-Q271 PolarHBondContact N-O 3.23Å; P269-Q271 PolarHBondContact O-N 2.95Å
272	L	91.1	Very high	89	Confident	13 Å²	13	51.9 Å²	51.9	7%	0.068	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	148	175.2	-69.6	170.5	0	0	0	111.3	S132 W177 V205 L225 L252 K253 F254	S132-L272 WeakPolarHBondContact CB-O 3.48Å; S132-L272 PolarHBondContact N-O 3.03Å; W177-L272 HydrophobicContact CB-CD1 3.68Å; V205-L272 HydrophobicContact CG1-CD1 4.45Å; L225-L272 HydrophobicContact CD1-CD2 4.4Å; L225-L272 HydrophobicContact CD2-CD1 4.49Å; L252-L272 HydrophobicContact CB-CB 4.46Å; L252-L272 HydrophobicContact CB-CD2 4.35Å; L252-L272 HydrophobicContact CD1-CD1 4.39Å; K253-L272 CarbonylContact O-C 3.57Å; K253-L272 WeakPolarHBondContact O-CA 3.35Å; F254-L272 HydrophobicContact CD1-CD2 3.78Å; F254-L272 HydrophobicContact CD1-CG 4.1Å; F254-L272 HydrophobicContact CD2-CD2 4.12Å; F254-L272 HydrophobicContact CE1-CD2 3.71Å; F254-L272 HydrophobicContact CE1-CG 3.78Å; F254-L272 HydrophobicContact CE2-CD2 4.04Å; F254-L272 HydrophobicContact CG-CD2 3.99Å; F254-L272 HydrophobicContact CZ-CD2 3.83Å; F254-L272 HydrophobicContact CZ-CG 4.19Å
273	G	94.8	Very high	87.8	Confident	1 Å²	1	57 Å²	57	1%	0.01	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	147.2	166.8	0	0	0	0	0	110.5	V130 L252 K253 F275	V130-G273 CarbonylContact O-C 3.53Å; V130-G273 VanDerWaalsContact O-C 3.31Å; V130-G273 WeakPolarHBondContact O-CA 3.44Å; L252-G273 CarbonylContact C-O 3.53Å; L252-G273 WeakPolarHBondContact CA-O 3.46Å; K253-G273 PolarHBondContact N-O 2.74Å; K253-G273 PolarHBondContact O-N 3.47Å; G273-F275 WeakPolarHBondContact O-CD2 3.42Å; G273-F275 PolarHBondContact O-N 3.13Å
274	L	97.4	Very high	86.5	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	119.1	174.9	174.2	58.6	0	0	0	109.7	V129 V130 L175 R227 F229 L252 C276	V129-L274 CarbonylContact C-O 3.53Å; V129-L274 VanDerWaalsContact CA-O 3.23Å; V129-L274 WeakPolarHBondContact CA-O 3.46Å; V130-L274 PolarHBondContact N-O 2.89Å; V130-L274 PolarHBondContact O-N 3.22Å; L175-L274 HydrophobicContact CD2-CB 3.7Å; L175-L274 HydrophobicContact CD2-CD2 4.25Å; R227-L274 HydrophobicContact CB-CD1 3.86Å; R227-L274 HydrophobicContact CG-CD1 3.94Å; F229-L274 HydrophobicContact CE1-CD2 3.91Å; F229-L274 HydrophobicContact CZ-CD2 4.14Å; L252-L274 HydrophobicContact CD2-CB 3.75Å; L252-L274 HydrophobicContact CD2-CD1 4.24Å; L274-C276 HydrophobicContact CD1-CB 3.99Å; L274-C276 HydrophobicContact CD2-CB 4.42Å; L274-C276 HydrophobicContact CG-CB 3.99Å
275	F	97.7	Very high	85.2	Confident	46 Å²	46	51 Å²	51	20%	0.202	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	115.5	166.6	-71.3	-108.5	0	0	0	107.8	F79 V129 G250 R251 K253 L255 G273	F79-F275 HydrophobicContact CE1-CE1 4.38Å; F79-F275 HydrophobicContact CE1-CZ 4.31Å; F79-F275 HydrophobicContact CE2-CZ 4.01Å; F79-F275 HydrophobicContact CZ-CE1 4.06Å; F79-F275 AromaticContact CZ-CZ 3.65Å; F79-F275 HydrophobicContact CZ-CZ 3.65Å; V129-F275 HydrophobicContact CB-CD1 4.38Å; V129-F275 HydrophobicContact CB-CE1 4.49Å; V129-F275 HydrophobicContact CG1-CD1 3.88Å; V129-F275 HydrophobicContact CG1-CD2 3.97Å; V129-F275 HydrophobicContact CG1-CE1 3.76Å; V129-F275 HydrophobicContact CG1-CE2 3.84Å; V129-F275 HydrophobicContact CG1-CG 3.99Å; V129-F275 HydrophobicContact CG1-CZ 3.73Å; V129-F275 HydrophobicContact CG2-CD1 3.53Å; V129-F275 HydrophobicContact CG2-CE1 3.83Å; V129-F275 HydrophobicContact CG2-CG 4.13Å; G250-F275 CarbonylContact C-O 3.59Å; G250-F275 WeakPolarHBondContact CA-O 3.16Å; R251-F275 PolarHBondContact N-O 3.36Å; R251-F275 PolarHBondContact O-N 2.94Å; K253-F275 HydrophobicContact CB-CD2 3.73Å; K253-F275 HydrophobicContact CB-CE2 3.79Å; K253-F275 HydrophobicContact CD-CD2 4.07Å; K253-F275 HydrophobicContact CD-CE2 4.5Å; K253-F275 HydrophobicContact CD-CG 4.21Å; K253-F275 HydrophobicContact CG-CD2 4.07Å; L255-F275 HydrophobicContact CD2-CE2 3.8Å; L255-F275 HydrophobicContact CD2-CZ 3.64Å; L255-F275 HydrophobicContact CG-CE2 4.41Å; G273-F275 WeakPolarHBondContact O-CD2 3.42Å; G273-F275 PolarHBondContact O-N 3.13Å
276	C	97.8	Very high	84.1	Confident	8 Å²	8	55.1 Å²	55.1	5%	0.054	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	164.3	-172.7	63.3	0	0	0	0	113.4	L128 Q249 L274	L128-C276 PolarHBondContact N-O 2.83Å; L128-C276 PolarHBondContact O-N 3.31Å; L128-C276 VanDerWaalsContact O-O 3.07Å; L128-C276 PolarHBondContact O-SG 3.21Å; Q249-C276 CarbonylContact O-C 3.47Å; Q249-C276 WeakPolarHBondContact O-CA 3.4Å; Q249-C276 VanDerWaalsContact O-CB 3.31Å; Q249-C276 WeakPolarHBondContact O-CB 3.45Å; L274-C276 HydrophobicContact CD1-CB 3.99Å; L274-C276 HydrophobicContact CD2-CB 4.42Å; L274-C276 HydrophobicContact CG-CB 3.99Å
277	I	98	Very high	83	Confident	50 Å²	50	54.7 Å²	54.7	26%	0.256	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	135.8	160.4	-49.8	-54.2	0	0	0	107.4	L123 F126 A127 Q249 V279	L123-I277 HydrophobicContact CD1-CD1 3.92Å; L123-I277 HydrophobicContact CD2-CD1 4.37Å; L123-I277 HydrophobicContact CD2-CG1 4.32Å; L123-I277 HydrophobicContact CD2-CG2 4.31Å; F126-I277 WeakPolarHBondContact O-CA 3.39Å; A127-I277 HydrophobicContact CB-CD1 3.87Å; Q249-I277 PolarHBondContact N-O 3.34Å; Q249-I277 PolarHBondContact O-N 3.48Å; I277-V279 HydrophobicContact CG2-CG2 3.98Å
278	A	97.8	Very high	82	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	114.1	171.1	0	0	0	0	0	109.1	G125 F126 M246 Q247 F248	G125-A278 CarbonylContact C-O 3.55Å; G125-A278 WeakPolarHBondContact CA-O 3.48Å; F126-A278 HydrophobicContact CD1-CB 4.31Å; F126-A278 HydrophobicContact CD2-CB 4.19Å; F126-A278 HydrophobicContact CE1-CB 3.91Å; F126-A278 HydrophobicContact CE2-CB 3.76Å; F126-A278 HydrophobicContact CG-CB 4.44Å; F126-A278 HydrophobicContact CZ-CB 3.6Å; F126-A278 PolarHBondContact N-O 3.32Å; F126-A278 PolarHBondContact O-N 2.88Å; M246-A278 HydrophobicContact CE-CB 3.95Å; M246-A278 WeakPolarHBondContact CE-O 3.46Å; M246-A278 HydrophobicContact SD-CB 4.25Å; Q247-A278 WeakPolarHBondContact O-CA 3.46Å; F248-A278 HydrophobicContact CD1-CB 3.98Å; F248-A278 HydrophobicContact CE1-CB 3.76Å; F248-A278 HydrophobicContact CZ-CB 4.34Å
279	V	96.9	Very high	81	Confident	36 Å²	36	57.9 Å²	57.9	22%	0.218	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.4	-176.9	172.1	0	0	0	0	109.1	T124 M246 Q247 I277 L281	T124-V279 WeakPolarHBondContact O-CG1 3.48Å; M246-V279 CarbonylContact C-O 3.55Å; M246-V279 VanDerWaalsContact CA-O 3.29Å; M246-V279 WeakPolarHBondContact CA-O 3.35Å; Q247-V279 PolarHBondContact N-O 3.01Å; Q247-V279 PolarHBondContact O-N 3.26Å; I277-V279 HydrophobicContact CG2-CG2 3.98Å; V279-L281 PolarHBondContact O-N 3.29Å
280	P	95.4	Very high	79.8	Confident	26 Å²	26	61.7 Å²	61.7	17%	0.169	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	129.7	177.2	30.8	-35.5	0	0	0	110.7	T124 Y146 L244 M246 L282	T124-P280 WeakPolarHBondContact O-CD 3.44Å; Y146-P280 HydrophobicContact CD1-CG 3.83Å; Y146-P280 HydrophobicContact CE1-CG 3.92Å; L244-P280 HydrophobicContact CD2-CB 3.97Å; L244-P280 HydrophobicContact CG-CB 4.39Å; M246-P280 HydrophobicContact CE-CB 4.27Å; P280-L282 PolarHBondContact O-N 3.22Å; P280-L282 VanDerWaalsContact O-N 3.13Å
281	L	90.6	Very high	78.9	Confident	48 Å²	48	64.8 Å²	64.8	25%	0.251	35%	0.347	S	S	.	.			trans	-84.3	90.1	174.7	-74.9	-176.8	0	0	0	110.5	I230 T245 Q247 V279 L283	I230-L281 HydrophobicContact CB-CD1 4.41Å; I230-L281 HydrophobicContact CD1-CD1 3.52Å; I230-L281 HydrophobicContact CG1-CD1 3.71Å; I230-L281 HydrophobicContact CG2-CD1 3.85Å; T245-L281 HydrophobicContact CG2-CB 4.3Å; T245-L281 HydrophobicContact CG2-CD1 4.23Å; T245-L281 PolarHBondContact O-N 2.94Å; Q247-L281 HydrophobicContact CB-CD1 4.13Å; Q247-L281 HydrophobicContact CB-CD2 3.94Å; Q247-L281 HydrophobicContact CB-CG 3.91Å; V279-L281 PolarHBondContact O-N 3.29Å; L281-L283 PolarHBondContact O-N 3.12Å
282	L	76.6	Confident	77.3	Confident	159 Å²	159	69.1 Å²	69.1	83%	0.832	37%	0.365	S	S	*	.			trans	-64.5	85.7	162.2	-64.2	176.3	0	0	0	109.4	P280 P284	P280-L282 PolarHBondContact O-N 3.22Å; P280-L282 VanDerWaalsContact O-N 3.13Å; L282-P284 WeakPolarHBondContact O-CD 3.31Å
283	L	60.3	Low	75.7	Confident	141 Å²	141	72.7 Å²	72.7	74%	0.738	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-59.8	117.6	164.8	-69.3	175.6	0	0	0	107.6	L281 S285	L281-L283 PolarHBondContact O-N 3.12Å; L283-S285 PolarHBondContact O-N 2.81Å
284	P	52.8	Low	74	Confident	72 Å²	72	78.4 Å²	78.4	47%	0.468	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-62.4	132.1	-177.7	25.8	-33.8	0	0	0	109.3	L282 E288	L282-P284 WeakPolarHBondContact O-CD 3.31Å; P284-E288 HydrophobicContact CB-CB 4.34Å
285	S	56.9	Low	72.1	Confident	45 Å²	45	84.2 Å²	84.2	32%	0.315	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-57.7	155.3	-179.7	65.1	0	0	0	0	111	L283 S287 E288 M289	L283-S285 PolarHBondContact O-N 2.81Å; S285-S287 WeakPolarHBondContact CB-OG 2.98Å; S285-S287 PolarHBondContact O-N 3.31Å; S285-S287 VanDerWaalsContact O-N 3.07Å; S285-S287 PolarHBondContact OG-OG 3.06Å; S285-E288 WeakPolarHBondContact CB-OE2 3.05Å; S285-E288 PolarHBondContact N-OE2 2.86Å; S285-E288 PolarHBondContact O-N 2.88Å; S285-E288 VanDerWaalsContact OG-CD 3.31Å; S285-E288 VanDerWaalsContact OG-CG 3.29Å; S285-E288 WeakPolarHBondContact OG-CG 3.41Å; S285-E288 PolarHBondContact OG-N 3.27Å; S285-E288 VanDerWaalsContact OG-N 3.16Å; S285-E288 PolarHBondContact OG-OE2 2.99Å; S285-M289 WeakPolarHBondContact O-CB 3.48Å; S285-M289 PolarHBondContact O-N 2.96Å
286	I	61.3	Low	70.1	Confident	132 Å²	132	88.6 Å²	88.6	68%	0.677	47%	0.466	S	S	*	.	H	α-helix	trans	-56.7	-30.2	178.4	-61	173.5	0	0	0	111	K290	I286-K290 VanDerWaalsContact O-CG 3.26Å; I286-K290 WeakPolarHBondContact O-CG 3.48Å; I286-K290 PolarHBondContact O-N 2.66Å; I286-K290 VanDerWaalsContact O-N 3.17Å
287	S	60.8	Low	67.9	Low	77 Å²	77	97.5 Å²	97.5	54%	0.538	50%	0.499	S	S	.	.	H	α-helix	trans	-61.4	-56.4	168	19.6	0	0	0	0	113.1	S285 M289 K290 V291	S285-S287 WeakPolarHBondContact CB-OG 2.98Å; S285-S287 PolarHBondContact O-N 3.31Å; S285-S287 VanDerWaalsContact O-N 3.07Å; S285-S287 PolarHBondContact OG-OG 3.06Å; S287-M289 VanDerWaalsContact C-N 3.35Å; S287-M289 PolarHBondContact O-N 3.19Å; S287-K290 WeakPolarHBondContact O-CB 3.25Å; S287-K290 PolarHBondContact O-N 3.08Å; S287-V291 WeakPolarHBondContact O-CG2 3.24Å; S287-V291 PolarHBondContact O-N 3.4Å
288	E	59.8	Low	65.7	Low	114 Å²	114	97.6 Å²	97.6	53%	0.533	51%	0.512	S	S	.	.	H	α-helix	trans	-65.8	-37.3	-179.8	-68.9	160.7	114.8	0	0	112	P284 S285 K290 V291 K292	P284-E288 HydrophobicContact CB-CB 4.34Å; S285-E288 WeakPolarHBondContact CB-OE2 3.05Å; S285-E288 PolarHBondContact N-OE2 2.86Å; S285-E288 PolarHBondContact O-N 2.88Å; S285-E288 VanDerWaalsContact OG-CD 3.31Å; S285-E288 VanDerWaalsContact OG-CG 3.29Å; S285-E288 WeakPolarHBondContact OG-CG 3.41Å; S285-E288 PolarHBondContact OG-N 3.27Å; S285-E288 VanDerWaalsContact OG-N 3.16Å; S285-E288 PolarHBondContact OG-OE2 2.99Å; E288-K290 VanDerWaalsContact C-N 3.28Å; E288-K290 PolarHBondContact O-N 2.8Å; E288-V291 PolarHBondContact O-N 2.97Å; E288-K292 VanDerWaalsContact O-CB 3.23Å; E288-K292 WeakPolarHBondContact O-CB 3.22Å; E288-K292 PolarHBondContact O-N 3Å
289	M	59.8	Low	63.5	Low	110 Å²	110	106.2 Å²	106.2	54%	0.542	55%	0.55	S	S	.	.	H	α-helix	trans	-63.5	-33.6	175.2	-171.8	176.4	177.7	0	0	111.7	S285 S287 N293	S285-M289 WeakPolarHBondContact O-CB 3.48Å; S285-M289 PolarHBondContact O-N 2.96Å; S287-M289 VanDerWaalsContact C-N 3.35Å; S287-M289 PolarHBondContact O-N 3.19Å; M289-N293 WeakPolarHBondContact O-CB 3.34Å; M289-N293 PolarHBondContact O-N 3.46Å; M289-N293 VanDerWaalsContact O-N 3.12Å; M289-N293 PolarHBondContact O-ND2 3.13Å
290	K	57.7	Low	61.2	Low	136 Å²	136	111.5 Å²	111.5	59%	0.591	58%	0.577	S	S	*	*	H	α-helix	trans	-68.5	-49.4	169.4	-76.2	170.3	-179	178.5	0	111.6	I286 S287 E288 K292 N293 I294	I286-K290 VanDerWaalsContact O-CG 3.26Å; I286-K290 WeakPolarHBondContact O-CG 3.48Å; I286-K290 PolarHBondContact O-N 2.66Å; I286-K290 VanDerWaalsContact O-N 3.17Å; S287-K290 WeakPolarHBondContact O-CB 3.25Å; S287-K290 PolarHBondContact O-N 3.08Å; E288-K290 VanDerWaalsContact C-N 3.28Å; E288-K290 PolarHBondContact O-N 2.8Å; K290-K292 PolarHBondContact O-N 3.42Å; K290-N293 WeakPolarHBondContact O-CB 3.23Å; K290-N293 PolarHBondContact O-N 2.87Å; K290-I294 VanDerWaalsContact O-CG1 3.29Å; K290-I294 WeakPolarHBondContact O-CG1 3.35Å; K290-I294 PolarHBondContact O-N 2.89Å
291	V	65.9	Low	58.8	Low	98 Å²	98	119.5 Å²	119.5	59%	0.594	61%	0.609	S	S	*	*	H	α-helix	trans	-59.9	-43.7	179	174.2	0	0	0	0	111.7	S287 E288 N293 I294 L295	S287-V291 WeakPolarHBondContact O-CG2 3.24Å; S287-V291 PolarHBondContact O-N 3.4Å; E288-V291 PolarHBondContact O-N 2.97Å; V291-N293 PolarHBondContact O-N 2.73Å; V291-I294 PolarHBondContact O-N 2.87Å; V291-L295 PolarHBondContact O-N 3.14Å
292	K	55.1	Low	56.5	Low	139 Å²	139	121 Å²	121	60%	0.604	64%	0.636	S	S	*	*	H	α-helix	trans	-66.5	-35.9	177.8	-158.2	168.1	-173.3	172.9	0	111.7	E288 K290 M296	E288-K292 VanDerWaalsContact O-CB 3.23Å; E288-K292 WeakPolarHBondContact O-CB 3.22Å; E288-K292 PolarHBondContact O-N 3Å; K290-K292 PolarHBondContact O-N 3.42Å; K292-M296 WeakPolarHBondContact O-CB 3.4Å; K292-M296 WeakPolarHBondContact O-CG 3.31Å; K292-M296 PolarHBondContact O-N 3.41Å
293	N	56	Low	54.6	Low	88 Å²	88	116.9 Å²	116.9	47%	0.471	63%	0.631	S	S	.	*	H	α-helix	trans	-66.1	-41	169.9	-94.7	-77.2	0	0	0	113	M289 K290 V291 M296 R297	M289-N293 WeakPolarHBondContact O-CB 3.34Å; M289-N293 PolarHBondContact O-N 3.46Å; M289-N293 VanDerWaalsContact O-N 3.12Å; M289-N293 PolarHBondContact O-ND2 3.13Å; K290-N293 WeakPolarHBondContact O-CB 3.23Å; K290-N293 PolarHBondContact O-N 2.87Å; V291-N293 PolarHBondContact O-N 2.73Å; N293-M296 PolarHBondContact O-N 3.14Å; N293-R297 WeakPolarHBondContact O-CB 3.14Å; N293-R297 PolarHBondContact O-N 2.84Å
294	I	59.1	Low	53.2	Low	120 Å²	120	113.9 Å²	113.9	62%	0.615	64%	0.635	S	S	*	*	H	α-helix	trans	-63.1	-44.9	176.8	-69.2	161.8	0	0	0	110	K290 V291 R297 G298	K290-I294 VanDerWaalsContact O-CG1 3.29Å; K290-I294 WeakPolarHBondContact O-CG1 3.35Å; K290-I294 PolarHBondContact O-N 2.89Å; V291-I294 PolarHBondContact O-N 2.87Å; I294-R297 PolarHBondContact O-N 3.27Å; I294-G298 PolarHBondContact O-N 2.9Å
295	L	57.7	Low	52.5	Low	124 Å²	124	118.4 Å²	118.4	65%	0.649	65%	0.653	S	S	*	*	H	α-helix	trans	-64.6	-40.1	176.9	-174.3	62.5	0	0	0	112.6	V291 G298	V291-L295 PolarHBondContact O-N 3.14Å; L295-G298 PolarHBondContact O-N 3.02Å
296	M	55.6	Low	51.5	Low	138 Å²	138	124.2 Å²	124.2	68%	0.68	68%	0.679	S	S	*	*	H	α-helix	trans	-65.9	-40.1	173.9	-72.8	-68.8	-168.8	0	0	112.3	K292 N293	K292-M296 WeakPolarHBondContact O-CB 3.4Å; K292-M296 WeakPolarHBondContact O-CG 3.31Å; K292-M296 PolarHBondContact O-N 3.41Å; N293-M296 PolarHBondContact O-N 3.14Å
297	R	53	Low	50	Low	194 Å²	194	122.8 Å²	122.8	73%	0.732	68%	0.681	S	S	*	*	H	α-helix	trans	-69.6	-31.5	173.8	-81.3	-170.4	169	-134.7	-3.3	113	N293 I294 K299 N300	N293-R297 WeakPolarHBondContact O-CB 3.14Å; N293-R297 PolarHBondContact O-N 2.84Å; I294-R297 PolarHBondContact O-N 3.27Å; R297-K299 VanDerWaalsContact C-N 3.28Å; R297-K299 PolarHBondContact O-N 2.99Å; R297-N300 PolarHBondContact O-N 2.82Å; R297-N300 VanDerWaalsContact O-N 3.16Å
298	G	51.2	Low	49	Very low	52 Å²	52	125.2 Å²	125.2	54%	0.536	70%	0.695	S	S	.	*	H	α-helix	trans	-58.5	-36.5	-179.7	0	0	0	0	0	113.4	I294 L295 N300	I294-G298 PolarHBondContact O-N 2.9Å; L295-G298 PolarHBondContact O-N 3.02Å; G298-N300 VanDerWaalsContact C-N 3.28Å; G298-N300 PolarHBondContact O-N 3.04Å
299	K	50.7	Low	47.5	Very low	182 Å²	182	129.2 Å²	129.2	79%	0.791	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-11	179.1	-75.7	-169.8	171	-175.5	0	115.2	R297	R297-K299 VanDerWaalsContact C-N 3.28Å; R297-K299 PolarHBondContact O-N 2.99Å
300	N	50.2	Low	46.1	Very low	146 Å²	146	131.5 Å²	131.5	78%	0.781	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.9	15.2	-179.2	-82.4	37.6	0	0	0	114.1	R297 G298	R297-N300 PolarHBondContact O-N 2.82Å; R297-N300 VanDerWaalsContact O-N 3.16Å; G298-N300 VanDerWaalsContact C-N 3.28Å; G298-N300 PolarHBondContact O-N 3.04Å
301	K	43.5	Very low	44.8	Very low	195 Å²	195	133.3 Å²	133.3	85%	0.848	74%	0.736	S	S	*	*			trans	-114.9	51	171.6	-77.6	-162.1	167	-164.7	0	112.8
302	G	42.9	Very low	43	Very low	80 Å²	80	132.6 Å²	132.6	83%	0.825	75%	0.748	S	S	*	*			trans	-112.2	20.4	171.6	0	0	0	0	0	114.3
303	G	36	Very low	41.8	Very low	71 Å²	71	134.2 Å²	134.2	73%	0.732	76%	0.758	S	S	*	*			trans	-104.3	104.1	176.4	0	0	0	0	0	111
304	G	32.4	Very low	40.6	Very low	79 Å²	79	141.4 Å²	141.4	81%	0.814	78%	0.778	S	S	*	*			trans	-75.3	141.5	175.9	0	0	0	0	0	112.2
305	I	36.7	Very low	39.1	Very low	166 Å²	166	138.8 Å²	138.8	85%	0.851	78%	0.781	S	S	*	*			trans	-96.8	122.7	171.8	-62.5	169	0	0	0	108.2
306	I	35.4	Very low	37.9	Very low	167 Å²	167	142 Å²	142	86%	0.856	79%	0.792	S	S	*	*			trans	-137.1	144.1	158.6	-39.1	179	0	0	0	107.5
307	S	31.3	Very low	36.7	Very low	103 Å²	103	143 Å²	143	72%	0.72	80%	0.795	S	S	*	*			trans	-70.3	158.7	-167.2	-59.3	0	0	0	0	115.1
308	P	38.2	Very low	35.6	Very low	128 Å²	128	141.7 Å²	141.7	83%	0.831	80%	0.802	S	S	*	*			trans	-72.8	146.3	170.5	31.8	-35.9	0	0	0	112.2
309	M	29.1	Very low	34.5	Very low	197 Å²	197	148.1 Å²	148.1	97%	0.97	81%	0.81	S	S	*	*			trans	-147.3	171.7	156.9	-124.9	176.5	82.4	0	0	109.6
310	E	31.1	Very low	33.4	Very low	159 Å²	159	147.6 Å²	147.6	74%	0.743	80%	0.803	S	S	*	*			trans	-126.7	166.2	-147.3	-153.9	-177.1	-138.8	0	0	113.1
311	H	30	Very low	32.4	Very low	174 Å²	174	148.2 Å²	148.2	81%	0.806	80%	0.801	S	S	*	*			trans	69.4	145.7	170.3	-67.2	86.5	0	0	0	119
312	G	28.2	Very low	31.7	Very low	82 Å²	82	143.5 Å²	143.5	85%	0.845	79%	0.792	S	S	*	*			trans	147.8	123.4	166.9	0	0	0	0	0	114.9
313	E	30.1	Very low	31.1	Very low	174 Å²	174	146.5 Å²	146.5	81%	0.813	80%	0.795	S	S	*	*			trans	-108.3	166.7	178.2	-57.9	-177.1	98.4	0	0	113.6
314	R	30.9	Very low	30.7	Very low	239 Å²	239	147 Å²	147	90%	0.902	80%	0.8	S	S	*	*			trans	67.3	157	166.1	-54.7	-178.6	-177.4	-151.9	-0.2	116.2
315	G	27.8	Very low	30.5	Very low	65 Å²	65	147.3 Å²	147.3	67%	0.67	80%	0.803	S	S	*	*			cis	151	136.1	-11	0	0	0	0	0	113.2
316	E	31	Very low	30.1	Very low	191 Å²	191	143.4 Å²	143.4	89%	0.893	80%	0.804	S	S	*	*			trans	63.8	169.2	163.3	-65.8	-166.3	129.3	0	0	119.1
317	H	31.6	Very low	30	Very low	158 Å²	158	145 Å²	145	73%	0.731	81%	0.81	S	S	*	*				-172.2	107.7	-50.6	-145	-68.1	0	0	0	109.5
318	L	29.1	Very low	29.9	Very low	167 Å²	167	143.6 Å²	143.6	87%	0.874	81%	0.812	S	S	*	*			trans	178.5	140.3	159.9	-123.2	63.1	0	0	0	109.3
319	R	27.5	Very low	29.5	Very low	187 Å²	187	145 Å²	145	71%	0.706	81%	0.812	S	S	*	*			cis	97.7	106.2	9.6	-126.8	-151	-178.7	179.1	3.7	117.6
320	R	29.1	Very low	29.6	Very low	171 Å²	171	144.6 Å²	144.6	65%	0.645	81%	0.811	S	S	*	*			trans	100.7	121.4	143	-71.5	-176.9	153.7	168.6	-4.5	123.2
321	H	28.8	Very low	29.6	Very low	160 Å²	160	143.3 Å²	143.3	74%	0.741	81%	0.814	S	S	*	*				65.2	154.6	130	-60.2	-37.5	0	0	0	120.9
322	S	28.8	Very low	29.5	Very low	95 Å²	95	142.2 Å²	142.2	66%	0.664	81%	0.814	S	S	*	*			cis	-171.6	177.1	-25.5	-165.6	0	0	0	0	109.7
323	T	29.2	Very low	30.1	Very low	143 Å²	143	142.9 Å²	142.9	88%	0.877	80%	0.803	S	S	*	*			trans	65.6	142.6	175.8	71.5	0	0	0	0	115.7
324	G	27.9	Very low	29.9	Very low	83 Å²	83	142.2 Å²	142.2	86%	0.856	81%	0.805	S	S	*	*			cis	165.7	157.2	-6.9	0	0	0	0	0	107.9
325	G	27.9	Very low	29.8	Very low	84 Å²	84	137.7 Å²	137.7	87%	0.866	80%	0.797	S	S	*	*			cis	-175.2	162.4	-4.9	0	0	0	0	0	107.9
326	G	28.4	Very low	29.5	Very low	85 Å²	85	144 Å²	144	88%	0.876	81%	0.807	S	S	*	*			trans	-176.2	145.7	-176.9	0	0	0	0	0	112.1
327	M	33.3	Very low	29.2	Very low	200 Å²	200	140.7 Å²	140.7	99%	0.985	80%	0.8	S	S	*	*			trans	-100.1	138.3	-169.2	-157.4	98	76.3	0	0	111.9
328	G	29.8	Very low	29	Very low	73 Å²	73	138.9 Å²	138.9	75%	0.753	80%	0.804	S	S	*	*			trans	167.7	125.7	170.3	0	0	0	0	0	112.5
329	D	30.6	Very low	29.1	Very low	158 Å²	158	136.7 Å²	136.7	85%	0.845	80%	0.799	S	S	*	*			trans	-72.8	126.6	-177.5	-78.8	-63.6	0	0	0	113.4
330	M	29.6	Very low	29.3	Very low	189 Å²	189	136.2 Å²	136.2	93%	0.931	81%	0.805	S	S	*	*				-157	140.7	109.1	-119.5	-167.8	170.3	0	0	111.4
331	T	31.4	Very low	29.6	Very low	132 Å²	132	133.6 Å²	133.6	81%	0.81	81%	0.81	S	S	*	*			trans	-96.4	132.2	-178.5	44.1	0	0	0	0	111.9
332	D	27.4	Very low	29.4	Very low	150 Å²	150	128.8 Å²	128.8	80%	0.802	80%	0.804	S	S	*	*			trans	-150.1	173.7	169.5	-158.3	23.4	0	0	0	108.4
333	P	42	Very low	29.6	Very low	97 Å²	97	128.7 Å²	128.7	63%	0.63	81%	0.809	S	S	*	*				-96.7	168	-94.1	34.2	-22.6	0	0	0	112.7
334	L	24.8	Very low	29.7	Very low	160 Å²	160	128.4 Å²	128.4	84%	0.838	81%	0.807	S	S	*	*			trans	176.1	161.3	131.7	-95.9	167.5	0	0	0	113.6
335	L	28.9	Very low	29.9	Very low	144 Å²	144	133.1 Å²	133.1	75%	0.754	81%	0.806	S	S	*	*			trans	-27.5	143.2	167.7	-57.4	161.5	0	0	0	117
336	F	22.5	Very low	30	Very low	197 Å²	197	140 Å²	140	86%	0.864	81%	0.807	S	S	*	*				-169.8	144.5	119.2	-108.1	-67	0	0	0	115.1
337	T	24.3	Very low	29.8	Very low	121 Å²	121	141 Å²	141	74%	0.742	80%	0.799	S	S	*	*			trans	28.4	121.3	158.3	26.7	0	0	0	0	122
338	C	27.4	Very low	29.7	Very low	121 Å²	121	139.6 Å²	139.6	82%	0.818	79%	0.79	S	S	*	*			trans	-72.9	142.1	147	-55.6	0	0	0	0	110.5
339	P	31.4	Very low	29.6	Very low	121 Å²	121	143.8 Å²	143.8	79%	0.786	79%	0.79	S	S	*	*			trans	-77.1	152.4	174.8	32.3	-35	0	0	0	112
340	H	31.5	Very low	29.5	Very low	177 Å²	177	142 Å²	142	82%	0.819	79%	0.785	S	S	*	*			trans	-118	111	178.9	-167	75.3	0	0	0	111.6
341	P	34.9	Very low	29.4	Very low	116 Å²	116	141.1 Å²	141.1	75%	0.753	78%	0.783	S	S	*	*			trans	-92.1	132.9	157	-0.2	20.4	0	0	0	109.4
342	G	26.2	Very low	29.1	Very low	59 Å²	59	145.6 Å²	145.6	61%	0.608	79%	0.785	S	S	*	*			trans	-83.8	155.5	-171.9	0	0	0	0	0	115.6
343	A	31.4	Very low	29	Very low	93 Å²	93	143.5 Å²	143.5	77%	0.769	78%	0.782	S	S	*	*			trans	33.6	108.1	151	0	0	0	0	0	119.8
344	T	32.2	Very low	28.4	Very low	137 Å²	137	144.9 Å²	144.9	84%	0.84	79%	0.791	S	S	*	*				-175.4	171.5	109.1	25.2	0	0	0	0	111.7
345	Q	31.2	Very low	28.5	Very low	181 Å²	181	145 Å²	145	85%	0.846	79%	0.792	S	S	*	*			trans	69.8	129.6	175.9	-58.3	-62.2	-13.1	0	0	117.2
346	R	31.5	Very low	28.5	Very low	230 Å²	230	144.3 Å²	144.3	87%	0.868	80%	0.798	S	S	*	*			trans	-87.3	138.5	168.8	-69.4	176.2	175	164.5	-2.9	109
347	S	24.6	Very low	28.8	Very low	104 Å²	104	143.2 Å²	143.2	73%	0.727	79%	0.793	S	S	*	*			trans	-132.8	139.5	158.7	-171.4	0	0	0	0	109.3
348	H	30.9	Very low	29.1	Very low	171 Å²	171	144.7 Å²	144.7	79%	0.792	80%	0.796	S	S	*	*			trans	-95.3	124	-176.8	-78.5	-104.6	0	0	0	110.5
349	H	27.8	Very low	29.1	Very low	161 Å²	161	146.3 Å²	146.3	75%	0.745	80%	0.797	S	S	*	*			trans	-133.6	122.4	169.2	-94.3	-89	0	0	0	112.6
350	T	27.8	Very low	29.1	Very low	122 Å²	122	148.5 Å²	148.5	75%	0.748	80%	0.801	S	S	*	*			trans	33.4	107.9	145.2	51.7	0	0	0	0	119.3
351	L	26.9	Very low	29.1	Very low	169 Å²	169	150 Å²	150	89%	0.885	81%	0.805	S	S	*	*			trans	-96	107.9	163.1	-129.7	84.3	0	0	0	110.7
352	W	24.8	Very low	28.6	Very low	226 Å²	226	150.8 Å²	150.8	86%	0.856	81%	0.811	S	S	*	*			trans	-149.5	96.9	163.3	-87.4	105	0	0	0	110.7
353	S	27	Very low	28.6	Very low	106 Å²	106	151.1 Å²	151.1	74%	0.741	82%	0.815	S	S	*	*			trans	-164.7	133.3	161.8	-83.4	0	0	0	0	109.9	L355	S353-L355 PolarHBondContact O-N 2.84Å; S353-L355 VanDerWaalsContact O-N 3.16Å
354	P	27.5	Very low	28.4	Very low	126 Å²	126	152.1 Å²	152.1	82%	0.818	82%	0.816	S	S	*	*			trans	-84.1	90.9	-173.3	32.6	-34.7	0	0	0	112.6	C356	P354-C356 VanDerWaalsContact C-N 3.29Å; P354-C356 PolarHBondContact O-N 3.15Å
355	L	27.8	Very low	28.1	Very low	164 Å²	164	153.3 Å²	153.3	86%	0.859	82%	0.818	S	S	*	*			trans	-76.8	72.8	173	-88.5	162.9	0	0	0	112.3	S353 K357	S353-L355 PolarHBondContact O-N 2.84Å; S353-L355 VanDerWaalsContact O-N 3.16Å; L355-K357 VanDerWaalsContact C-N 3.35Å; L355-K357 PolarHBondContact O-N 2.98Å
356	C	29.7	Very low	27.9	Very low	129 Å²	129	147.6 Å²	147.6	87%	0.872	81%	0.808	S	S	*	*			trans	-85.6	75	165.8	-86.5	0	0	0	0	111.1	P354	P354-C356 VanDerWaalsContact C-N 3.29Å; P354-C356 PolarHBondContact O-N 3.15Å
357	K	29.1	Very low	27.7	Very low	173 Å²	173	146 Å²	146	75%	0.752	81%	0.807	S	S	*	*			trans	-159.9	105.8	165.4	-118.4	-176.8	179.6	-173.7	0	110.6	L355	L355-K357 VanDerWaalsContact C-N 3.35Å; L355-K357 PolarHBondContact O-N 2.98Å
358	D	29.7	Very low	27.8	Very low	153 Å²	153	152 Å²	152	82%	0.818	82%	0.815	S	S	*	*				-164	154.3	121.5	-100.9	-27.9	0	0	0	111.3
359	N	27.2	Very low	27.6	Very low	154 Å²	154	147.3 Å²	147.3	82%	0.824	81%	0.813	S	S	*	*			trans	-103.3	95.3	-174.8	-71.6	-95.8	0	0	0	110.6
360	L	30.6	Very low	27.7	Very low	167 Å²	167	149 Å²	149	87%	0.874	82%	0.822	S	S	*	*			trans	-84	123.7	158.6	-90.5	72.4	0	0	0	109.2	C362	L360-C362 PolarHBondContact O-N 3.47Å
361	K	31.5	Very low	27.8	Very low	210 Å²	210	152.5 Å²	152.5	91%	0.913	83%	0.83	S	S	*	*			trans	-66	116	166.7	-73.8	178.9	175.6	178.3	0	108.7
362	C	25.2	Very low	27.9	Very low	131 Å²	131	151.8 Å²	151.8	89%	0.885	82%	0.822	S	S	*	*			trans	-90.9	113.8	157	-168.6	0	0	0	0	107.8	L360	L360-C362 PolarHBondContact O-N 3.47Å
363	G	26.1	Very low	28.4	Very low	67 Å²	67	146.5 Å²	146.5	69%	0.691	82%	0.817	S	S	*	*			trans	-85.9	138	168.1	0	0	0	0	0	109.5
364	S	27.8	Very low	28.6	Very low	113 Å²	113	148.5 Å²	148.5	79%	0.79	82%	0.818	S	S	*	*			trans	-81.1	123.9	171.9	167.1	0	0	0	0	109.8
365	D	26.1	Very low	28.7	Very low	163 Å²	163	149.6 Å²	149.6	87%	0.872	82%	0.817	S	S	*	*			trans	-166.6	140.7	141.2	-101.2	-28	0	0	0	112.6
366	G	26.2	Very low	28.7	Very low	61 Å²	61	150.7 Å²	150.7	63%	0.629	82%	0.815	S	S	*	*			trans	85.5	94.9	138.5	0	0	0	0	0	121.9
367	F	27.4	Very low	28.6	Very low	196 Å²	196	150.7 Å²	150.7	86%	0.86	82%	0.815	S	S	*	*			trans	68.8	116.2	137.3	-77.3	-90.5	0	0	0	123.4
368	Y	27.3	Very low	28.6	Very low	229 Å²	229	152.6 Å²	152.6	90%	0.898	82%	0.823	S	S	*	*			trans	66.7	117.6	137.9	-105.6	-99.8	0	0	0	121.9
369	G	26.3	Very low	28.5	Very low	73 Å²	73	151.3 Å²	151.3	75%	0.753	83%	0.826	S	S	*	*			trans	179.4	118.2	160.9	0	0	0	0	0	110.1
370	Q	30.4	Very low	28.5	Very low	198 Å²	198	149.3 Å²	149.3	93%	0.925	83%	0.825	S	S	*	*			trans	-81.8	135.2	164	-78.3	-176.4	-47.1	0	0	108.3
371	E	29.1	Very low	28.5	Very low	195 Å²	195	147.9 Å²	147.9	91%	0.911	82%	0.823	S	S	*	*			trans	-145.8	143.4	152.1	-152.9	165.1	-149.7	0	0	110.5
372	E	28.6	Very low	28.2	Very low	153 Å²	153	144.3 Å²	144.3	72%	0.715	82%	0.819	S	S	*	*			trans	-109.9	135.1	-167.4	-175.4	-178.5	161.6	0	0	110	L374	E372-L374 PolarHBondContact O-N 2.73Å
373	P	35.5	Very low	28.4	Very low	116 Å²	116	144.9 Å²	144.9	75%	0.753	81%	0.813	S	S	*	*			trans	-62.3	108	177.4	-23.9	35	0	0	0	111.9	N375	P373-N375 PolarHBondContact O-N 3.04Å; P373-N375 VanDerWaalsContact O-N 3.15Å; P373-N375 PolarHBondContact O-ND2 3.15Å
374	L	30.8	Very low	28.6	Very low	148 Å²	148	151.1 Å²	151.1	78%	0.775	82%	0.823	S	S	*	*			trans	-57.9	113	-171.4	-73.8	167.2	0	0	0	113.6	E372 F376	E372-L374 PolarHBondContact O-N 2.73Å; L374-F376 HydrophobicContact CB-CD2 4.32Å; L374-F376 PolarHBondContact O-N 3.35Å
375	N	29.6	Very low	28.7	Very low	148 Å²	148	155.5 Å²	155.5	79%	0.791	83%	0.829	S	S	*	*			trans	-79.6	99.1	170.9	-79.1	-83.7	0	0	0	111	P373	P373-N375 PolarHBondContact O-N 3.04Å; P373-N375 VanDerWaalsContact O-N 3.15Å; P373-N375 PolarHBondContact O-ND2 3.15Å
376	F	29.2	Very low	28.8	Very low	188 Å²	188	151.2 Å²	151.2	83%	0.825	82%	0.822	S	S	*	*			trans	-110.1	82.4	174.2	-101	-80.6	0	0	0	112.7	L374	L374-F376 HydrophobicContact CB-CD2 4.32Å; L374-F376 PolarHBondContact O-N 3.35Å
377	C	26.1	Very low	28.9	Very low	128 Å²	128	153.1 Å²	153.1	87%	0.865	83%	0.833	S	S	*	*			trans	-157.9	74.7	167.5	-129.1	0	0	0	0	112.2
378	K	29.3	Very low	29	Very low	213 Å²	213	148.7 Å²	148.7	93%	0.926	83%	0.832	S	S	*	*			trans	-170.2	115	164.1	-108.8	159.9	-171.3	176.3	0	111.6
379	S	27.3	Very low	29.2	Very low	126 Å²	126	142.8 Å²	142.8	88%	0.881	83%	0.83	S	S	*	*			trans	-139.9	104.9	155.4	50.3	0	0	0	0	109.2
380	S	29.1	Very low	29.3	Very low	112 Å²	112	142.8 Å²	142.8	78%	0.783	83%	0.83	S	S	*	*			trans	-89.5	140.7	170.2	48.7	0	0	0	0	109.9
381	V	29.4	Very low	29.6	Very low	138 Å²	138	142.1 Å²	142.1	84%	0.836	83%	0.832	S	S	*	*			trans	-72.9	132.9	-178.8	-176.9	0	0	0	0	111.3
382	T	25.8	Very low	29.5	Very low	135 Å²	135	136.4 Å²	136.4	83%	0.828	83%	0.826	S	S	*	*			trans	-161.3	146.8	149.4	15.3	0	0	0	0	110.8
383	D	29	Very low	29.4	Very low	143 Å²	143	133.4 Å²	133.4	77%	0.765	84%	0.835	S	S	*	*			trans	-77.8	166.5	-176.4	-61.7	-96	0	0	0	115.3
384	H	29.8	Very low	28.9	Very low	197 Å²	197	131.5 Å²	131.5	91%	0.912	84%	0.837	S	S	*	*				-167.6	170	118.4	-99.1	-58	0	0	0	113.6
385	K	30.9	Very low	28.7	Very low	206 Å²	206	136.3 Å²	136.3	90%	0.896	85%	0.845	S	S	*	*			trans	-103.5	139.5	-169.3	-70	175	174.3	174	0	114.2
386	G	28.2	Very low	29.2	Very low	72 Å²	72	134.7 Å²	134.7	74%	0.742	84%	0.843	S	S	*	*				95.6	148.7	110.6	0	0	0	0	0	121.2
387	A	28.8	Very low	29.3	Very low	102 Å²	102	134 Å²	134	84%	0.843	84%	0.844	S	S	*	*			trans	67.1	128.4	174	0	0	0	0	0	116.7
388	A	28.8	Very low	29.5	Very low	102 Å²	102	139.4 Å²	139.4	84%	0.843	85%	0.846	S	S	*	*			cis	101.4	137.9	28.5	0	0	0	0	0	113
389	A	31.3	Very low	29.6	Very low	105 Å²	105	137.5 Å²	137.5	87%	0.868	84%	0.841	S	S	*	*			cis	-166.6	164.7	-10.4	0	0	0	0	0	112.7
390	G	29.2	Very low	29.6	Very low	73 Å²	73	142.5 Å²	142.5	75%	0.753	84%	0.84	S	S	*	*			trans	105.3	149.8	162.3	0	0	0	0	0	115.9
391	L	35.4	Very low	29.8	Very low	185 Å²	185	146 Å²	146	97%	0.969	85%	0.847	S	S	*	*			cis	-163.7	142.4	-4.8	-118.2	172.8	0	0	0	110.4
392	G	27	Very low	29.7	Very low	75 Å²	75	142.2 Å²	142.2	77%	0.773	84%	0.835	S	S	*	*			trans	139.4	104.2	156.5	0	0	0	0	0	120.2
393	G	26.7	Very low	30.7	Very low	89 Å²	89	141.4 Å²	141.4	92%	0.918	83%	0.832	S	S	*	*			trans	93.2	135.3	145.4	0	0	0	0	0	120.6
394	G	26.1	Very low	30.8	Very low	77 Å²	77	141.8 Å²	141.8	79%	0.794	83%	0.833	S	S	*	*			trans	117.8	84.7	153.1	0	0	0	0	0	119.4
395	W	26.5	Very low	30.9	Very low	248 Å²	248	143.8 Å²	143.8	94%	0.939	83%	0.832	S	S	*	*			trans	-42	164.6	168.1	-59.7	84.1	0	0	0	118.3
396	P	40.3	Very low	30.7	Very low	114 Å²	114	138.8 Å²	138.8	74%	0.74	83%	0.829	S	S	*	*			cis	-140.4	167.5	-32.9	37.1	-19.2	0	0	0	116.5
397	M	31	Very low	30.6	Very low	174 Å²	174	140.2 Å²	140.2	86%	0.857	83%	0.834	S	S	*	*			trans	-96.1	160.9	-179.8	-144.2	81.9	145.8	0	0	113.7
398	R	28.8	Very low	30.7	Very low	241 Å²	241	144.9 Å²	144.9	91%	0.909	84%	0.838	S	S	*	*			trans	-147.1	117.2	145.4	-119	-173.9	-158.3	-102.5	4.3	113.5
399	Q	32.4	Very low	30.6	Very low	174 Å²	174	143.2 Å²	143.2	81%	0.813	83%	0.831	S	S	*	*			trans	-113	160.3	152.8	-79.8	-173	-17.4	0	0	108.6
400	R	28	Very low	30.6	Very low	230 Å²	230	145 Å²	145	87%	0.868	83%	0.831	S	S	*	*			trans	-168	134.5	135	-110.3	178.5	-164.8	-110.5	5	112
401	M	31.7	Very low	30.6	Very low	187 Å²	187	145.1 Å²	145.1	92%	0.921	83%	0.832	S	S	*	*			trans	-98	163.9	140.7	-102.8	-72.7	177.9	0	0	108.1
402	G	27.5	Very low	30.4	Very low	57 Å²	57	146.3 Å²	146.3	59%	0.588	83%	0.825	S	S	*	*			trans	-164.8	142	179.7	0	0	0	0	0	113.3
403	P	46.9	Very low	30.9	Very low	118 Å²	118	148.3 Å²	148.3	77%	0.766	82%	0.822	S	S	*	*			trans	-104.4	151.2	-173.9	37.9	-34.2	0	0	0	115.8
404	I	30.7	Very low	32.1	Very low	151 Å²	151	149.4 Å²	149.4	77%	0.774	81%	0.813	S	S	*	*			trans	67.5	106.3	143.5	-63.6	171.1	0	0	0	120.4
405	R	32.4	Very low	32.4	Very low	240 Å²	240	149.9 Å²	149.9	91%	0.906	80%	0.804	S	S	*	*			trans	62.8	133.9	137.6	-69.1	-173.3	177.4	-159.5	-0.1	124.3
406	A	27.5	Very low	32.5	Very low	100 Å²	100	144.2 Å²	144.2	83%	0.826	79%	0.793	S	S	*	*			trans	84.7	106	138.6	0	0	0	0	0	121.5
407	A	25.3	Very low	32.3	Very low	102 Å²	102	149.3 Å²	149.3	84%	0.843	80%	0.797	S	S	*	*				-171.7	168.1	116	0	0	0	0	0	112.8
408	Q	30.3	Very low	32.4	Very low	200 Å²	200	147.7 Å²	147.7	94%	0.935	79%	0.791	S	S	*	*			trans	-66.8	167.1	-167	-62.1	144.6	-48.9	0	0	117.8
409	G	27.9	Very low	32.5	Very low	68 Å²	68	142.9 Å²	142.9	70%	0.701	78%	0.783	S	S	*	*			trans	133.5	78.1	167.2	0	0	0	0	0	114
410	V	30.2	Very low	32.5	Very low	142 Å²	142	144.7 Å²	144.7	86%	0.861	78%	0.783	S	S	*	*				64.1	107.7	87.2	-178.2	0	0	0	0	113.6
411	G	29.3	Very low	32.6	Very low	75 Å²	75	140.2 Å²	140.2	77%	0.773	78%	0.781	S	S	*	*			trans	175	73.5	-177.6	0	0	0	0	0	115.6
412	Y	31.1	Very low	32.5	Very low	211 Å²	211	135 Å²	135	83%	0.827	78%	0.776	S	S	*	*			trans	-36.7	163.7	164.3	-77.7	-106.2	0	0	0	116.1
413	V	37.8	Very low	32.7	Very low	117 Å²	117	140.8 Å²	140.8	71%	0.709	79%	0.787	S	S	*	*			cis	166	-179.8	-11.9	85.8	0	0	0	0	105.1
414	P	51.6	Low	32	Very low	112 Å²	112	146 Å²	146	73%	0.727	79%	0.793	S	S	*	*			cis	-114.8	-139.8	-26.6	38.2	-17.6	0	0	0	108.4
415	S	32.6	Very low	32	Very low	87 Å²	87	142.3 Å²	142.3	61%	0.608	79%	0.793	S	S	*	*			cis	-160.5	144.8	-15.6	-163.7	0	0	0	0	109.1
416	N	28.6	Very low	32.3	Very low	129 Å²	129	140.6 Å²	140.6	69%	0.69	79%	0.792	S	S	*	*				168.8	128.6	106.5	-99.8	-53.9	0	0	0	115.1
417	R	36.1	Very low	33.4	Very low	221 Å²	221	140.9 Å²	140.9	83%	0.834	79%	0.785	S	S	*	*			trans	65.6	147.9	147.2	-57.9	-175.8	-178.9	-147.5	-0.9	120.1
418	L	34.5	Very low	33.6	Very low	140 Å²	140	145.1 Å²	145.1	73%	0.733	78%	0.781	S	S	*	*			cis	-167	127.3	-38.9	-124.5	163.4	0	0	0	111.7
419	N	30.4	Very low	33.6	Very low	140 Å²	140	145.2 Å²	145.2	75%	0.749	77%	0.772	S	S	*	*			trans	80.9	153.6	144.1	-121.3	-22	0	0	0	125
420	R	31.8	Very low	33.9	Very low	211 Å²	211	149.7 Å²	149.7	80%	0.796	78%	0.779	S	S	*	*			trans	73.8	93.2	159.7	-67.9	-168.4	179.9	-149	0.5	123
421	T	30.2	Very low	33.8	Very low	136 Å²	136	147.7 Å²	147.7	83%	0.834	77%	0.772	S	S	*	*				32.2	136.2	113.8	59.2	0	0	0	0	122.1
422	G	29.8	Very low	34.5	Very low	79 Å²	79	149.8 Å²	149.8	81%	0.814	77%	0.772	S	S	*	*			trans	145.7	75.4	140.1	0	0	0	0	0	120.9
423	Q	32.7	Very low	34.3	Very low	177 Å²	177	144.9 Å²	144.9	83%	0.827	77%	0.769	S	S	*	*			trans	14.2	142.1	147.4	-90.9	177.6	-12.7	0	0	125.1
424	Y	31.1	Very low	34	Very low	228 Å²	228	145 Å²	145	89%	0.894	77%	0.773	S	S	*	*			trans	74.7	128	150	-85.9	-74.3	0	0	0	122.1
425	G	30.1	Very low	33	Very low	74 Å²	74	149.4 Å²	149.4	76%	0.763	78%	0.783	S	S	*	*			trans	158.2	109	168.2	0	0	0	0	0	114.3
426	K	38.6	Very low	32.7	Very low	204 Å²	204	149.2 Å²	149.2	89%	0.887	80%	0.796	S	S	*	*			trans	-117.8	174.8	166.9	-70.5	-176.3	-179.9	178.9	0	107.8
427	P	52.5	Low	32.6	Very low	105 Å²	105	146.8 Å²	146.8	68%	0.682	80%	0.801	S	S	*	*			cis	-120.9	-162.2	-4.6	14.8	14	0	0	0	110.9
428	Y	29.2	Very low	32.5	Very low	192 Å²	192	148.4 Å²	148.4	75%	0.753	81%	0.807	S	S	*	*			cis	-160.4	153.5	30.8	-123.4	-59.3	0	0	0	114.8
429	R	30.6	Very low	32.1	Very low	201 Å²	201	145.5 Å²	145.5	76%	0.758	81%	0.811	S	S	*	*			trans	52.1	112.2	153.5	-94.7	168.6	-157.8	-88	6.4	121.1
430	L	32.7	Very low	32.1	Very low	162 Å²	162	142.6 Å²	142.6	85%	0.848	81%	0.806	S	S	*	*				-78.1	162	129.8	-60.2	104.4	0	0	0	110.1
431	S	27.9	Very low	32.1	Very low	101 Å²	101	140 Å²	140	71%	0.706	81%	0.808	S	S	*	*			trans	-164.4	128.2	145	-83.5	0	0	0	0	111.3
432	P	44.6	Very low	32.1	Very low	118 Å²	118	138.8 Å²	138.8	77%	0.766	80%	0.8	S	S	*	*			trans	-122.5	162.7	171	40.2	-30	0	0	0	114.7
433	S	27.5	Very low	32	Very low	109 Å²	109	144.9 Å²	144.9	76%	0.762	80%	0.8	S	S	*	*			trans	74.1	153.1	147	-156	0	0	0	0	122
434	C	31	Very low	31.9	Very low	118 Å²	118	141.3 Å²	141.3	80%	0.797	79%	0.791	S	S	*	*			trans	60.2	136.6	158.9	50.7	0	0	0	0	121.6
435	H	30.9	Very low	31.8	Very low	205 Å²	205	134.9 Å²	134.9	95%	0.949	78%	0.779	S	S	*	*			trans	-114.8	153.7	175.2	-78.6	-64	0	0	0	112.1
436	G	26.4	Very low	31.9	Very low	84 Å²	84	139.6 Å²	139.6	87%	0.866	78%	0.778	S	S	*	*			trans	175.5	142.7	158.6	0	0	0	0	0	113
437	G	27.2	Very low	31.5	Very low	77 Å²	77	136.4 Å²	136.4	79%	0.794	77%	0.77	S	S	*	*			trans	108.8	90.4	158.2	0	0	0	0	0	119.3
438	R	32.3	Very low	30.4	Very low	255 Å²	255	141.7 Å²	141.7	96%	0.962	78%	0.778	S	S	*	*			trans	36.3	126	136.2	-60.6	177.7	-180	-102.7	1.6	122.1
439	G	27.8	Very low	30.4	Very low	79 Å²	79	136 Å²	136	81%	0.814	78%	0.778	S	S	*	*			trans	81.9	165.2	138.7	0	0	0	0	0	117.5
440	A	29.3	Very low	30.3	Very low	80 Å²	80	131.6 Å²	131.6	66%	0.661	78%	0.778	S	S	*	*			cis	-164.9	158.2	-16.7	0	0	0	0	0	109.1
441	D	30.9	Very low	30.3	Very low	155 Å²	155	128.3 Å²	128.3	83%	0.829	77%	0.768	S	S	*	*			trans	64.9	159.2	157.3	-57.9	-28.2	0	0	0	117.2
442	V	31.8	Very low	30.4	Very low	111 Å²	111	130.5 Å²	130.5	67%	0.673	77%	0.772	S	S	*	*			cis	-163.9	147.5	-12.5	120.8	0	0	0	0	110.4
443	Y	27.4	Very low	29.9	Very low	207 Å²	207	128.7 Å²	128.7	81%	0.812	77%	0.767	S	S	*	*			trans	67.2	155.7	156.3	-88.3	-140	0	0	0	120.7
444	V	31.1	Very low	30	Very low	103 Å²	103	131.2 Å²	131.2	62%	0.624	77%	0.772	S	S	*	*			cis	-171.8	164.5	-19.6	67.9	0	0	0	0	112.2
445	S	29.1	Very low	30	Very low	93 Å²	93	129 Å²	129	65%	0.65	76%	0.762	S	S	*	*			trans	74.2	153.8	152.6	-69.9	0	0	0	0	119
446	K	30.6	Very low	30	Very low	172 Å²	172	129.5 Å²	129.5	75%	0.748	76%	0.757	S	S	*	*			cis	-167.4	149.8	-6	-118.8	-174.4	173.4	-175.3	0	111.8
447	L	31.7	Very low	30	Very low	137 Å²	137	130.7 Å²	130.7	72%	0.717	75%	0.751	S	S	*	*			trans	57.1	155.1	144.7	-95.3	79.4	0	0	0	120.4
448	Y	28.6	Very low	30.1	Very low	217 Å²	217	132.5 Å²	132.5	85%	0.851	75%	0.747	S	S	*	*			cis	-169.6	147.3	-14.3	-151.5	-131.2	0	0	0	112.1
449	G	29.3	Very low	30	Very low	72 Å²	72	126.9 Å²	126.9	74%	0.742	74%	0.735	S	S	*	*			trans	64.1	173.5	156.6	0	0	0	0	0	119.3
450	S	29.3	Very low	30.1	Very low	108 Å²	108	131.2 Å²	131.2	76%	0.755	74%	0.739	S	S	*	*			cis	-170.3	151	-23.9	-169.3	0	0	0	0	109.8
451	S	31.1	Very low	30.1	Very low	94 Å²	94	132.8 Å²	132.8	66%	0.657	74%	0.74	S	S	*	*			trans	66.3	158.7	156.4	-65.1	0	0	0	0	118.6
452	D	30.8	Very low	30	Very low	146 Å²	146	134.8 Å²	134.8	78%	0.781	74%	0.741	S	S	*	*			cis	-164.6	170	-24.5	-105.5	-54.6	0	0	0	110
453	A	33.9	Very low	29.8	Very low	80 Å²	80	133.9 Å²	133.9	66%	0.661	74%	0.74	S	S	*	*			trans	69.7	129.7	156.2	0	0	0	0	0	123
454	D	29.5	Very low	29.7	Very low	162 Å²	162	131.7 Å²	131.7	87%	0.866	74%	0.737	S	S	*	*				40	155.1	124.6	-54.1	-22.7	0	0	0	123.5
455	A	31.1	Very low	29.6	Very low	71 Å²	71	132.7 Å²	132.7	59%	0.587	74%	0.739	S	S	*	*			cis	-176	165.7	-25.6	0	0	0	0	0	109.4
456	Y	30.2	Very low	29.4	Very low	216 Å²	216	135 Å²	135	85%	0.847	75%	0.745	S	S	*	*			trans	66.5	124.9	173.5	-73.6	-90.1	0	0	0	116.3
457	C	28.1	Very low	29.3	Very low	109 Å²	109	136.6 Å²	136.6	74%	0.736	75%	0.752	S	S	*	*				69.1	140.1	81.2	-62.1	0	0	0	0	114.2
458	V	29.5	Very low	29.1	Very low	116 Å²	116	133.8 Å²	133.8	70%	0.703	76%	0.756	S	S	*	*			cis	-160.6	167.6	6	107.6	0	0	0	0	111
459	D	29.1	Very low	29.1	Very low	136 Å²	136	132.2 Å²	132.2	73%	0.727	76%	0.757	S	S	*	*			trans	63.3	142	175.6	-65.7	-26	0	0	0	116.3
460	L	30.8	Very low	29	Very low	171 Å²	171	134 Å²	134	90%	0.895	76%	0.756	S	S	*	*				-143.9	-168.3	55	-125.4	93.9	0	0	0	114.9
461	V	29.4	Very low	29	Very low	112 Å²	112	140.1 Å²	140.1	68%	0.679	77%	0.765	S	S	*	*			trans	-122.8	151.2	-161.5	164.4	0	0	0	0	112.9
462	K	28.2	Very low	28.8	Very low	197 Å²	197	144.4 Å²	144.4	86%	0.857	77%	0.774	S	S	*	*			trans	72.8	154.5	173.9	-77.2	162.5	-177.1	178.7	0	115.6
463	S	26.2	Very low	28.6	Very low	93 Å²	93	140.3 Å²	140.3	65%	0.65	77%	0.767	S	S	*	*			cis	-166.4	165.2	-9.2	41.2	0	0	0	0	111.9
464	E	27.1	Very low	28.4	Very low	160 Å²	160	145.5 Å²	145.5	75%	0.748	78%	0.777	S	S	*	*			trans	72.2	128	155.4	-80.8	-172.4	95.4	0	0	121.7
465	N	27.5	Very low	28.4	Very low	124 Å²	124	145.7 Å²	145.7	66%	0.663	77%	0.774	S	S	*	*			trans	72.3	155.8	136.2	-54.8	-16.4	0	0	0	123.3
466	D	26.5	Very low	28.3	Very low	143 Å²	143	151.3 Å²	151.3	77%	0.765	79%	0.791	S	S	*	*			trans	80.6	141.3	156.6	-70.1	-35.2	0	0	0	124.3
467	F	27.1	Very low	28.3	Very low	204 Å²	204	146.8 Å²	146.8	90%	0.895	79%	0.79	S	S	*	*			trans	-19	151.9	161.4	-70.2	-104.5	0	0	0	119.2
468	G	28.7	Very low	28.4	Very low	79 Å²	79	150.4 Å²	150.4	81%	0.814	80%	0.797	S	S	*	*			trans	178	102.5	158.7	0	0	0	0	0	113.4
469	E	28.2	Very low	28.8	Very low	184 Å²	184	153.1 Å²	153.1	86%	0.86	80%	0.804	S	S	*	*			trans	-74.6	159.5	174.3	-58.2	-178.4	128.5	0	0	112.5
470	C	26.7	Very low	29.4	Very low	109 Å²	109	151.7 Å²	151.7	74%	0.736	80%	0.802	S	S	*	*			trans	55.5	122.9	151.9	-65.1	0	0	0	0	119.9
471	Y	28.7	Very low	30	Very low	237 Å²	237	149.6 Å²	149.6	93%	0.929	80%	0.798	S	S	*	*				-159.3	162	101.3	-117.6	-82.2	0	0	0	112.1
472	E	27.2	Very low	30.4	Very low	184 Å²	184	151.9 Å²	151.9	86%	0.86	81%	0.805	S	S	*	*			trans	-99.5	124.8	-171.4	-175.6	178.4	167.2	0	0	112.7
473	G	27.3	Very low	30.7	Very low	60 Å²	60	151.8 Å²	151.8	62%	0.619	81%	0.805	S	S	*	*			trans	62.7	124.7	148	0	0	0	0	0	120.4
474	H	29	Very low	31.3	Very low	189 Å²	189	154.4 Å²	154.4	88%	0.875	81%	0.81	S	S	*	*				-153.3	171.9	115.6	-112.6	68.3	0	0	0	113.3
475	M	28.7	Very low	31.8	Very low	166 Å²	166	155.6 Å²	155.6	82%	0.818	82%	0.815	S	S	*	*			trans	-73.7	156	-156.3	-52.3	177.7	75.2	0	0	115.3
476	M	30.1	Very low	32.1	Very low	189 Å²	189	157.5 Å²	157.5	93%	0.931	82%	0.82	S	S	*	*			trans	-108.5	155.9	157.6	-87.8	-69.7	176.6	0	0	110.4
477	S	30.6	Very low	32.5	Very low	120 Å²	120	158.7 Å²	158.7	84%	0.839	83%	0.826	S	S	*	*			trans	-88.2	174.8	-161.9	-154.8	0	0	0	0	115.5
478	E	30	Very low	33.2	Very low	186 Å²	186	153.8 Å²	153.8	87%	0.869	82%	0.817	S	S	*	*			trans	-69.9	148.3	-171.4	-167.9	172.2	-170	0	0	114.2
479	M	37.4	Very low	33.7	Very low	173 Å²	173	158 Å²	158	85%	0.852	82%	0.822	S	S	*	*			trans	-124.8	128.4	179.2	-171	72.9	161.1	0	0	109.2
480	P	41.8	Very low	34.4	Very low	105 Å²	105	155.4 Å²	155.4	68%	0.682	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-71.4	152.9	-168.8	27.3	-35.1	0	0	0	113.9
481	P	42.6	Very low	35.2	Very low	127 Å²	127	158.2 Å²	158.2	83%	0.825	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-73.7	141.9	-170	28.9	-35.8	0	0	0	114.1
482	I	38.8	Very low	35.4	Very low	161 Å²	161	153.8 Å²	153.8	83%	0.826	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-78.1	136.2	175.1	-64.8	170.8	0	0	0	109.8
483	K	34.8	Very low	35.7	Very low	194 Å²	194	148.1 Å²	148.1	84%	0.843	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-68.1	135.2	173.4	-65.8	-178.9	179	-179.4	0	110.6
484	I	38.6	Very low	35.8	Very low	148 Å²	148	151 Å²	151	76%	0.759	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-100.9	122.4	168	-63.9	168.8	0	0	0	107.2
485	E	37.3	Very low	36.1	Very low	185 Å²	185	150.1 Å²	150.1	86%	0.864	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-84.7	136.8	171	-66.8	179.9	144.9	0	0	109.2
486	H	34.8	Very low	36.1	Very low	165 Å²	165	146.4 Å²	146.4	76%	0.764	80%	0.802	S	S	*	*			trans	-106.3	102.6	180	-97.5	-93.8	0	0	0	109.3
487	D	34.5	Very low	36.3	Very low	167 Å²	167	148.6 Å²	148.6	89%	0.893	80%	0.801	S	S	*	*			trans	-84.8	128.1	160.9	-74.2	-32.1	0	0	0	109.2
488	S	40.4	Very low	36.4	Very low	101 Å²	101	146.1 Å²	146.1	71%	0.706	79%	0.794	S	S	*	*			trans	-144.8	105.8	179.7	-71	0	0	0	0	110.4
489	D	39.8	Very low	36.3	Very low	169 Å²	169	145.2 Å²	145.2	90%	0.904	79%	0.79	S	S	*	*			trans	-116.6	98.3	173.3	-92.6	-35.3	0	0	0	110.4
490	S	43.9	Very low	36	Very low	129 Å²	129	142.5 Å²	142.5	90%	0.902	78%	0.784	S	S	*	*			trans	-171.1	106.4	151.3	3.7	0	0	0	0	110.1
491	E	42.1	Very low	35.4	Very low	168 Å²	168	148.3 Å²	148.3	79%	0.785	79%	0.792	S	S	*	*			trans	-101.5	157.4	174.9	-160.7	-169.6	79.1	0	0	110.7
492	N	33.8	Very low	34.8	Very low	143 Å²	143	147 Å²	147	77%	0.765	79%	0.792	S	S	*	*			trans	76.4	125.8	172.8	-56.4	-67.9	0	0	0	117.1
493	G	32.8	Very low	34.2	Very low	65 Å²	65	145.5 Å²	145.5	67%	0.67	79%	0.794	S	S	*	*			cis	170.4	169.8	-6.4	0	0	0	0	0	114
494	C	30.6	Very low	33.8	Very low	120 Å²	120	148 Å²	148	81%	0.811	80%	0.799	S	S	*	*			trans	64.7	115.1	176.8	-71.2	0	0	0	0	116.5
495	E	34.2	Very low	33.3	Very low	171 Å²	171	147.9 Å²	147.9	80%	0.799	80%	0.799	S	S	*	*				85.3	141.6	69.5	-82.3	-151.3	-127.2	0	0	113.3
496	T	29	Very low	32.8	Very low	89 Å²	89	147.1 Å²	147.1	55%	0.546	80%	0.796	S	S	.	*			cis	-160.9	159.8	0.6	-118.8	0	0	0	0	112.8
497	Y	34.4	Very low	32.5	Very low	234 Å²	234	142.8 Å²	142.8	92%	0.918	79%	0.788	S	S	*	*			trans	61.3	141.1	-179.7	-64	-58.5	0	0	0	117.9
498	G	32.1	Very low	32.3	Very low	68 Å²	68	140.8 Å²	140.8	70%	0.701	78%	0.783	S	S	*	*			cis	-173	154.7	-5.1	0	0	0	0	0	112.8
499	Q	29.5	Very low	31.8	Very low	167 Å²	167	143.5 Å²	143.5	78%	0.78	79%	0.787	S	S	*	*			trans	-79.2	169.7	173.7	-66.2	-172.1	-10.3	0	0	110.2
500	T	29.4	Very low	31.2	Very low	116 Å²	116	140.7 Å²	140.7	71%	0.712	77%	0.772	S	S	*	*				-167.4	134.5	58.5	48.1	0	0	0	0	118.3
501	W	30.1	Very low	30.5	Very low	228 Å²	228	144.7 Å²	144.7	86%	0.864	77%	0.768	S	S	*	*				73.3	150.1	128.7	-71.1	51	0	0	0	124.1
502	A	29	Very low	29.8	Very low	99 Å²	99	144.2 Å²	144.2	82%	0.818	77%	0.765	S	S	*	*			trans	93.9	128	149.8	0	0	0	0	0	120.9
503	C	27.2	Very low	29.7	Very low	130 Å²	130	148.6 Å²	148.6	88%	0.878	77%	0.773	S	S	*	*			trans	-90.7	153.6	172.6	-43.2	0	0	0	0	112
504	R	26.4	Very low	29.5	Very low	247 Å²	247	148.8 Å²	148.8	93%	0.932	78%	0.775	S	S	*	*				-161.9	156.7	129.4	-146.5	163.5	-179.5	159.7	0.2	114
505	N	27.2	Very low	29.3	Very low	145 Å²	145	151.3 Å²	151.3	78%	0.775	78%	0.78	S	S	*	*			trans	-77.4	179.9	170.4	-66.7	-31.7	0	0	0	113.1
506	Q	27.7	Very low	29	Very low	168 Å²	168	146.5 Å²	146.5	79%	0.785	78%	0.777	S	S	*	*			trans	84.5	104.1	168.4	-132.4	67.2	17.9	0	0	114.1
507	A	27.9	Very low	29	Very low	74 Å²	74	146.8 Å²	146.8	61%	0.612	79%	0.788	S	S	*	*			cis	91.3	130.8	38.6	0	0	0	0	0	114.9
508	T	30	Very low	28.7	Very low	126 Å²	126	146.6 Å²	146.6	77%	0.773	79%	0.787	S	S	*	*			trans	51.1	124	160.3	55.6	0	0	0	0	120.1
509	I	30.6	Very low	28.7	Very low	157 Å²	157	150.2 Å²	150.2	81%	0.805	79%	0.79	S	S	*	*				-173	133.6	127	-100	155.5	0	0	0	110.3
510	D	28.3	Very low	29	Very low	110 Å²	110	147.6 Å²	147.6	59%	0.588	79%	0.788	S	S	*	*			trans	54.1	157.2	160.7	-80	6	0	0	0	120.4
511	R	29.2	Very low	29	Very low	213 Å²	213	146.8 Å²	146.8	80%	0.804	79%	0.787	S	S	*	*			cis	-146.6	156.5	8.6	-145.5	156.6	-120.5	-171.2	-1.4	113.6
512	H	27.1	Very low	29.1	Very low	158 Å²	158	142.9 Å²	142.9	73%	0.731	79%	0.789	S	S	*	*			trans	-66.4	143.1	166	-52.7	-98.3	0	0	0	112.1
513	Y	30.4	Very low	29	Very low	236 Å²	236	141.3 Å²	141.3	93%	0.925	78%	0.782	S	S	*	*				172.7	172.7	103.1	-113.2	-85.7	0	0	0	112
514	G	28.3	Very low	29.1	Very low	69 Å²	69	142.8 Å²	142.8	71%	0.711	78%	0.78	S	S	*	*			trans	109.2	72.3	149	0	0	0	0	0	116.8
515	N	26.6	Very low	29.1	Very low	172 Å²	172	138.4 Å²	138.4	92%	0.92	77%	0.77	S	S	*	*			trans	-73.2	130.1	159.7	-166	1.1	0	0	0	108.7
516	G	28.1	Very low	29.1	Very low	71 Å²	71	137.9 Å²	137.9	73%	0.732	77%	0.767	S	S	*	*			trans	-154.2	74.1	-166.1	0	0	0	0	0	113.8	Y518	G516-Y518 PolarHBondContact O-N 3.4Å
517	A	29.8	Very low	28.9	Very low	95 Å²	95	137.9 Å²	137.9	79%	0.785	76%	0.764	S	S	*	*			trans	-76.8	119.9	175.1	0	0	0	0	0	111.4
518	Y	28.5	Very low	29.2	Very low	229 Å²	229	138.9 Å²	138.9	90%	0.898	77%	0.767	S	S	*	*			trans	-140.3	132.7	161.6	-107.4	-85.4	0	0	0	109.9	G516	G516-Y518 PolarHBondContact O-N 3.4Å
519	N	31.4	Very low	29.2	Very low	144 Å²	144	139.7 Å²	139.7	77%	0.77	76%	0.762	S	S	*	*			trans	-142.9	112.2	174.8	-179.5	10.8	0	0	0	108.8
520	P	35.6	Very low	29.1	Very low	113 Å²	113	137.1 Å²	137.1	73%	0.734	75%	0.753	S	S	*	*			trans	-121.1	100.7	166.8	33.7	-18.7	0	0	0	110.9
521	S	30.3	Very low	29.3	Very low	98 Å²	98	138.3 Å²	138.3	69%	0.685	76%	0.76	S	S	*	*			trans	-87.4	102.6	171.3	56.9	0	0	0	0	111.7
522	T	31.4	Very low	29.4	Very low	147 Å²	147	136.9 Å²	136.9	90%	0.902	76%	0.756	S	S	*	*			trans	-172	137.6	150.8	19.4	0	0	0	0	113.3
523	G	27.3	Very low	29.6	Very low	65 Å²	65	140 Å²	140	67%	0.67	76%	0.763	S	S	*	*				110.3	113.4	127	0	0	0	0	0	120.4
524	L	29.6	Very low	29.8	Very low	161 Å²	161	132.6 Å²	132.6	84%	0.843	74%	0.739	S	S	*	*			trans	72.1	163.2	140.6	-54.2	172.7	0	0	0	119.1
525	Q	26.1	Very low	30.6	Very low	155 Å²	155	135.3 Å²	135.3	72%	0.724	74%	0.744	S	S	*	*			cis	-174.2	169.8	-37.3	-169.6	173.2	52.8	0	0	108.6
526	L	26.7	Very low	31.1	Very low	134 Å²	134	132.8 Å²	132.8	70%	0.702	73%	0.727	S	S	*	*			trans	75.1	123.9	173.9	-70	108.2	0	0	0	115.1
527	K	25	Very low	31.1	Very low	168 Å²	168	139.7 Å²	139.7	73%	0.73	73%	0.732	S	S	*	*				77.2	142.6	68.9	-80.9	-172.1	155.2	-128.9	0	111.9	E529	K527-E529 IonicContact NZ-OE1 2.69Å; K527-E529 PolarHBondContact NZ-OE1 3.18Å
528	S	33.4	Very low	31.2	Very low	96 Å²	96	139.9 Å²	139.9	67%	0.671	73%	0.728	S	S	*	*			cis	-156.3	147.2	34.7	62.3	0	0	0	0	111.4
529	E	29.2	Very low	32.3	Very low	143 Å²	143	134.9 Å²	134.9	67%	0.668	72%	0.724	S	S	*	*				79	141	96.7	-73.2	174.9	-158.6	0	0	115.5	K527	K527-E529 IonicContact NZ-OE1 2.69Å; K527-E529 PolarHBondContact NZ-OE1 3.18Å
530	T	29.4	Very low	32.2	Very low	102 Å²	102	134.6 Å²	134.6	63%	0.626	73%	0.731	S	S	*	*			cis	-154.4	162.5	-17	-41.3	0	0	0	0	107.9
531	D	31.1	Very low	32.2	Very low	135 Å²	135	137.8 Å²	137.8	72%	0.722	74%	0.736	S	S	*	*				137.3	155.7	105.3	-90.6	-38.2	0	0	0	108.4
532	Y	31.5	Very low	32.1	Very low	184 Å²	184	145 Å²	145	72%	0.722	75%	0.749	S	S	*	*			cis	-167.2	130.2	-28.2	-159.6	-91.9	0	0	0	108.7
533	Y	32.9	Very low	32.1	Very low	224 Å²	224	141.1 Å²	141.1	88%	0.878	74%	0.738	S	S	*	*			trans	-175.9	155.7	140.9	-121.9	-85.7	0	0	0	112
534	D	34.7	Very low	32.5	Very low	79 Å²	79	148.3 Å²	148.3	42%	0.422	75%	0.75	S	S	.	*			trans	-149.9	152.2	-166	-169.8	22.7	0	0	0	109.3	Q536	D534-Q536 PolarHBondContact OD1-N 3.48Å; D534-Q536 WeakPolarHBondContact OD2-CG 3.43Å; D534-Q536 PolarHBondContact OD2-NE2 2.82Å
535	P	45	Very low	32.6	Very low	127 Å²	127	145.8 Å²	145.8	83%	0.825	75%	0.753	S	S	*	*				-148	113.9	95	34.3	-14.3	0	0	0	116.7
536	Q	35.8	Very low	32.7	Very low	119 Å²	119	141.6 Å²	141.6	56%	0.556	75%	0.751	S	S	*	*			trans	4.2	139.5	140.2	-71.4	164	55.1	0	0	119.9	D534	D534-Q536 PolarHBondContact OD1-N 3.48Å; D534-Q536 WeakPolarHBondContact OD2-CG 3.43Å; D534-Q536 PolarHBondContact OD2-NE2 2.82Å
537	Y	28.3	Very low	33	Very low	215 Å²	215	143.8 Å²	143.8	84%	0.843	76%	0.762	S	S	*	*				-162.8	162.2	89.4	-120.7	-88.7	0	0	0	115.1
538	S	32.6	Very low	33.3	Very low	100 Å²	100	140.3 Å²	140.3	70%	0.699	76%	0.759	S	S	*	*			trans	-112.4	163.1	-162.5	-58	0	0	0	0	114.9
539	P	50.8	Low	33.5	Very low	124 Å²	124	141.3 Å²	141.3	81%	0.805	76%	0.763	S	S	*	*			trans	-94.7	152.3	-174.8	36.4	-35.6	0	0	0	115.2
540	C	29.1	Very low	33.5	Very low	137 Å²	137	140 Å²	140	93%	0.926	77%	0.765	S	S	*	*			trans	-164.1	175.5	159	-126.6	0	0	0	0	114.4
541	Q	36.2	Very low	33.5	Very low	180 Å²	180	145.7 Å²	145.7	84%	0.841	78%	0.776	S	S	*	*			trans	-98.7	152.5	-154.1	-58.1	172.5	-18.4	0	0	118.9
542	R	28.2	Very low	33.3	Very low	251 Å²	251	146 Å²	146	95%	0.947	78%	0.778	S	S	*	*			trans	-169.3	151.3	146.6	-140.1	155.3	-66.8	-169.7	0.1	111.9
543	G	30.8	Very low	33.2	Very low	65 Å²	65	144.4 Å²	144.4	67%	0.67	78%	0.782	S	S	*	*			cis	159.9	111	-21.8	0	0	0	0	0	116.8
544	K	35.8	Very low	33	Very low	215 Å²	215	137.3 Å²	137.3	94%	0.935	78%	0.777	S	S	*	*			trans	92.8	138.3	161.3	-60.8	-175	174.5	-177.6	0	121.7
545	A	32	Very low	32.7	Very low	108 Å²	108	138.4 Å²	138.4	89%	0.893	80%	0.797	S	S	*	*			trans	67.2	139.7	156.6	0	0	0	0	0	120.5
546	G	29.1	Very low	32	Very low	67 Å²	67	143.2 Å²	143.2	69%	0.691	80%	0.8	S	S	*	*			cis	167.2	169.1	-12.3	0	0	0	0	0	116.7
547	I	31.6	Very low	32.2	Very low	181 Å²	181	143.5 Å²	143.5	93%	0.928	81%	0.813	S	S	*	*			trans	68.6	133.6	161.9	-16.8	-178.4	0	0	0	120.2
548	S	31.1	Very low	32.2	Very low	95 Å²	95	136 Å²	136	66%	0.664	80%	0.8	S	S	*	*			trans	-86.2	172.1	168.1	-41.6	0	0	0	0	112.7
549	P	38.5	Very low	32	Very low	116 Å²	116	142.4 Å²	142.4	75%	0.753	81%	0.811	S	S	*	*				-136	162.4	101.1	38.4	-28.5	0	0	0	112.4
550	T	29.1	Very low	30.9	Very low	116 Å²	116	140.8 Å²	140.8	71%	0.712	81%	0.808	S	S	*	*			cis	81.2	110.2	20.8	69.1	0	0	0	0	118.3
551	Y	29.2	Very low	30.8	Very low	221 Å²	221	140.2 Å²	140.2	87%	0.867	80%	0.8	S	S	*	*			trans	18.7	134.1	147.9	-78.2	-96	0	0	0	120.6
552	N	27.8	Very low	30.4	Very low	143 Å²	143	138.6 Å²	138.6	77%	0.765	80%	0.797	S	S	*	*				-169	172	91.2	-154.6	1.5	0	0	0	113.4
553	N	28.8	Very low	30.3	Very low	149 Å²	149	131.6 Å²	131.6	80%	0.797	79%	0.786	S	S	*	*			trans	-69.6	162	170.6	-68.3	-70.6	0	0	0	113.8
554	G	27.7	Very low	30.3	Very low	75 Å²	75	133.1 Å²	133.1	77%	0.773	79%	0.793	S	S	*	*			trans	177.8	119.5	159	0	0	0	0	0	117.8
555	A	28.3	Very low	30.1	Very low	103 Å²	103	126.9 Å²	126.9	85%	0.851	78%	0.782	S	S	*	*			trans	62.6	119.7	150.3	0	0	0	0	0	122.6
556	Y	31.3	Very low	30.2	Very low	227 Å²	227	132.6 Å²	132.6	89%	0.89	78%	0.78	S	S	*	*			trans	-69	151.2	145	-96.7	-96.1	0	0	0	110.3
557	P	40.9	Very low	30.3	Very low	126 Å²	126	136.1 Å²	136.1	82%	0.818	78%	0.782	S	S	*	*				-131.4	171.9	89.6	38.6	-29.8	0	0	0	112.3
558	G	26.8	Very low	30.3	Very low	56 Å²	56	134.8 Å²	134.8	58%	0.577	78%	0.776	S	S	*	*			cis	147.7	154.5	0.3	0	0	0	0	0	111.3
559	Y	28.1	Very low	30.5	Very low	236 Å²	236	138.7 Å²	138.7	93%	0.925	78%	0.781	S	S	*	*			trans	80.4	149	176	-68.2	-84.5	0	0	0	120.8
560	A	27.6	Very low	30.2	Very low	90 Å²	90	137.5 Å²	137.5	74%	0.744	78%	0.775	S	S	*	*			trans	58.5	126.7	173	0	0	0	0	0	117.2
561	V	27.9	Very low	30.5	Very low	125 Å²	125	137.2 Å²	137.2	76%	0.758	77%	0.769	S	S	*	*			cis	71.8	76	17.3	-162.5	0	0	0	0	115.9
562	N	27.1	Very low	30.8	Very low	145 Å²	145	133.9 Å²	133.9	78%	0.775	76%	0.759	S	S	*	*				-177.9	133.7	129	-90.9	-36.1	0	0	0	107.8
563	S	26.3	Very low	30.8	Very low	104 Å²	104	132.5 Å²	132.5	73%	0.727	75%	0.752	S	S	*	*				79.5	125.7	53.4	-62.4	0	0	0	0	114.1
564	A	31.5	Very low	31	Very low	98 Å²	98	132.9 Å²	132.9	81%	0.81	75%	0.753	S	S	*	*			trans	77.3	107.2	159.2	0	0	0	0	0	121
565	A	32.3	Very low	31.3	Very low	84 Å²	84	134.6 Å²	134.6	69%	0.694	75%	0.748	S	S	*	*				89.1	131.3	111.8	0	0	0	0	0	123
566	R	33	Very low	31.6	Very low	227 Å²	227	134.2 Å²	134.2	86%	0.857	74%	0.739	S	S	*	*			trans	70.5	110.6	131.8	-73.3	174	-175.1	167.3	1	121.7
567	L	31.2	Very low	31.7	Very low	141 Å²	141	130.9 Å²	130.9	74%	0.738	74%	0.736	S	S	*	*				58.9	113.9	101.7	-164.9	173.2	0	0	0	119
568	L	31.4	Very low	31.3	Very low	154 Å²	154	128.1 Å²	128.1	81%	0.806	73%	0.731	S	S	*	*			trans	178.1	132.4	144.4	-90.7	153.9	0	0	0	105.8
569	K	35	Very low	31.4	Very low	176 Å²	176	133 Å²	133	77%	0.765	74%	0.744	S	S	*	*			cis	90.9	144.8	22.2	-164	179.7	178	-172.8	0	114.8
570	C	33.6	Very low	31.5	Very low	92 Å²	92	128 Å²	128	62%	0.622	74%	0.743	S	S	*	*			trans	91.7	150.8	179.2	-53.3	0	0	0	0	113.9
571	D	34.3	Very low	31.5	Very low	110 Å²	110	131.1 Å²	131.1	59%	0.588	75%	0.748	S	S	*	*			cis	-71	-140	-19.8	-111.9	-158.9	0	0	0	115.5
572	K	35.2	Very low	31.7	Very low	150 Å²	150	133.9 Å²	133.9	65%	0.652	75%	0.752	S	S	*	*				-165.2	157.2	-62.9	-132.5	173.1	-179.9	72.5	0	113.6
573	D	28.7	Very low	31.8	Very low	115 Å²	115	135.8 Å²	135.8	62%	0.615	75%	0.754	S	S	*	*			trans	54.5	157.3	152.8	-61.1	-28.8	0	0	0	120.2
574	L	33.3	Very low	31.9	Very low	156 Å²	156	135.7 Å²	135.7	82%	0.817	75%	0.753	S	S	*	*			cis	-104.9	156.2	-10.4	-125.6	57.2	0	0	0	107.6
575	V	33.6	Very low	32.9	Very low	111 Å²	111	136.4 Å²	136.4	67%	0.673	75%	0.75	S	S	*	*			cis	78.9	117.6	24.8	-179.2	0	0	0	0	113.8
576	S	34.2	Very low	32.7	Very low	95 Å²	95	139.8 Å²	139.8	66%	0.664	75%	0.751	S	S	*	*			cis	-168.2	176.1	-11.8	-171.4	0	0	0	0	112
577	N	33.8	Very low	32.5	Very low	157 Å²	157	138.3 Å²	138.3	84%	0.84	75%	0.746	S	S	*	*			trans	91	133.9	159.3	-52.1	-10.3	0	0	0	117.6
578	G	31.7	Very low	32.4	Very low	68 Å²	68	138.8 Å²	138.8	70%	0.701	75%	0.748	S	S	*	*			cis	-174.9	150.6	-6.1	0	0	0	0	0	116
579	D	30.4	Very low	32.3	Very low	160 Å²	160	136 Å²	136	86%	0.856	74%	0.741	S	S	*	*			trans	28.3	122.4	154	-51.8	-35.4	0	0	0	122.8
580	S	28.6	Very low	32.1	Very low	130 Å²	130	135.6 Å²	135.6	91%	0.909	74%	0.742	S	S	*	*				-168.4	150.6	113.2	-83.9	0	0	0	0	112.7
581	N	29	Very low	32	Very low	156 Å²	156	135.7 Å²	135.7	83%	0.834	74%	0.744	S	S	*	*			trans	-135.6	127.2	-172.2	-151.1	-1.5	0	0	0	109.6
582	Q	31	Very low	31.6	Very low	182 Å²	182	137.6 Å²	137.6	85%	0.85	75%	0.754	S	S	*	*			trans	-160.1	114.4	167.8	-126.6	165.2	93	0	0	115.7
583	F	28.8	Very low	31.3	Very low	185 Å²	185	135.8 Å²	135.8	81%	0.811	76%	0.76	S	S	*	*			trans	36.1	113.7	141.5	-73.4	-99.7	0	0	0	122.3
584	S	29.7	Very low	31.3	Very low	103 Å²	103	137.8 Å²	137.8	72%	0.72	77%	0.77	S	S	*	*				59.5	163.5	112.3	-53.2	0	0	0	0	122.1
585	P	52.6	Low	31	Very low	113 Å²	113	136.1 Å²	136.1	73%	0.734	77%	0.77	S	S	*	*				-140.2	169.9	-52.6	40.6	-25.7	0	0	0	113.8
586	Q	27.8	Very low	30.6	Very low	155 Å²	155	135.5 Å²	135.5	72%	0.724	77%	0.771	S	S	*	*			trans	-166	127.5	131.4	-113.8	-176	101	0	0	114.6
587	R	28.7	Very low	30.3	Very low	196 Å²	196	138.5 Å²	138.5	74%	0.74	78%	0.779	S	S	*	*			trans	40.3	117.4	154.9	-67	-172.6	-101.8	-143.5	-1.5	119.5
588	L	29.8	Very low	30.1	Very low	151 Å²	151	139.8 Å²	139.8	79%	0.791	78%	0.78	S	S	*	*				67.8	134.5	72.4	-69.4	169.3	0	0	0	113
589	S	28.4	Very low	30.8	Very low	94 Å²	94	141.6 Å²	141.6	66%	0.657	78%	0.779	S	S	*	*			cis	-166	158.2	13.1	36.4	0	0	0	0	113.7
590	H	31.7	Very low	30.8	Very low	168 Å²	168	139.3 Å²	139.3	78%	0.778	77%	0.771	S	S	*	*			trans	27.4	149.1	144.1	-52	-58.8	0	0	0	122
591	S	30.3	Very low	30.9	Very low	95 Å²	95	139.8 Å²	139.8	66%	0.664	76%	0.764	S	S	*	*			cis	-174.6	150	-6.4	45	0	0	0	0	111.6
592	D	26.7	Very low	30.9	Very low	149 Å²	149	138.9 Å²	138.9	80%	0.797	76%	0.758	S	S	*	*			trans	45.4	141.1	150.3	-63.9	-53	0	0	0	125.5
593	S	28.6	Very low	30.9	Very low	112 Å²	112	138 Å²	138	78%	0.783	76%	0.756	S	S	*	*			trans	92.3	131.1	140.1	75.3	0	0	0	0	123.8
594	L	29.3	Very low	30.9	Very low	158 Å²	158	136.1 Å²	136.1	83%	0.827	75%	0.75	S	S	*	*			trans	22	128.3	146.3	-61.3	172.3	0	0	0	123.8
595	C	27.2	Very low	31.6	Very low	120 Å²	120	136.3 Å²	136.3	81%	0.811	75%	0.748	S	S	*	*			trans	68.2	135.8	134.1	-65	0	0	0	0	123.2
596	S	24.8	Very low	30.5	Very low	99 Å²	99	137 Å²	137	69%	0.692	75%	0.746	S	S	*	*			trans	118	119.4	131.7	-153.9	0	0	0	0	119.6
597	N	27.3	Very low	30.5	Very low	157 Å²	157	136.4 Å²	136.4	84%	0.84	75%	0.753	S	S	*	*			trans	67.2	161.7	146.7	-66.9	-12.5	0	0	0	123.5
598	Q	30.1	Very low	30.5	Very low	184 Å²	184	137.3 Å²	137.3	86%	0.86	76%	0.757	S	S	*	*			trans	-91.4	-160.3	179.7	-45.5	179.6	-43.5	0	0	110.6
599	P	46.3	Very low	31.6	Very low	106 Å²	106	135 Å²	135	69%	0.688	75%	0.752	S	S	*	*			cis	-142.1	-161.9	-4.9	25.2	3.5	0	0	0	116
600	V	29.8	Very low	31.5	Very low	113 Å²	113	139.9 Å²	139.9	69%	0.685	76%	0.764	S	S	*	*			trans	98.5	106.3	149.5	-173.3	0	0	0	0	120.8
601	N	30.1	Very low	31.5	Very low	140 Å²	140	141.9 Å²	141.9	75%	0.749	77%	0.77	S	S	*	*			trans	55.2	175.3	139	-54.7	-5.1	0	0	0	120.2
602	L	30.3	Very low	31.4	Very low	136 Å²	136	142.5 Å²	142.5	71%	0.712	78%	0.781	S	S	*	*			cis	-158.6	163.7	16	-163.4	71.1	0	0	0	113.1
603	M	30.1	Very low	31.6	Very low	163 Å²	163	145.7 Å²	145.7	80%	0.803	78%	0.784	S	S	*	*			trans	78	123.9	161.8	-70.3	-45.5	174.3	0	0	123
604	E	29.6	Very low	31.7	Very low	147 Å²	147	149.3 Å²	149.3	69%	0.687	79%	0.79	S	S	*	*			trans	-94.3	175.9	149.8	-158.7	-159.3	-113.8	0	0	108.7	N606	E604-N606 PolarHBondContact OE2-N 2.79Å
605	P	43.8	Very low	31.7	Very low	107 Å²	107	148.6 Å²	148.6	70%	0.695	78%	0.783	S	S	*	*				-153.6	145.1	97.4	37.4	-18.9	0	0	0	117.9
606	N	29	Very low	31.9	Very low	128 Å²	128	150.5 Å²	150.5	68%	0.684	78%	0.784	S	S	*	*			trans	36.7	135.1	135.9	-64.2	-72.3	0	0	0	122.3	E604	E604-N606 PolarHBondContact OE2-N 2.79Å
607	V	28.8	Very low	32.2	Very low	142 Å²	142	151.5 Å²	151.5	86%	0.861	78%	0.782	S	S	*	*				-179.9	138	98.9	154.1	0	0	0	0	111.8
608	Y	29.1	Very low	32.3	Very low	215 Å²	215	154.7 Å²	154.7	84%	0.843	78%	0.783	S	S	*	*			trans	-99.7	-170.2	176	-101.8	-73.4	0	0	0	110.6
609	P	51.9	Low	32.3	Very low	103 Å²	103	151.1 Å²	151.1	67%	0.669	78%	0.779	S	S	*	*			cis	-131.8	179.5	-31.4	37.5	-22.3	0	0	0	113.1
610	Q	26.6	Very low	31.7	Very low	195 Å²	195	155.2 Å²	155.2	91%	0.911	79%	0.786	S	S	*	*				-162.8	161	122.9	-114.5	173.1	-2.9	0	0	114.1
611	K	32.6	Very low	31.8	Very low	210 Å²	210	159.2 Å²	159.2	91%	0.913	80%	0.797	S	S	*	*			trans	-109.8	148	178.7	-63	177	179.3	177.7	0	110.4
612	A	28	Very low	31.8	Very low	109 Å²	109	156 Å²	156	90%	0.901	80%	0.796	S	S	*	*			trans	-142.9	154.4	155.7	0	0	0	0	0	109.6
613	Y	29.9	Very low	31.9	Very low	216 Å²	216	154.2 Å²	154.2	85%	0.847	80%	0.801	S	S	*	*			trans	-135.7	121.2	-170.1	-173.6	-78.7	0	0	0	108.8
614	M	31.1	Very low	31.8	Very low	187 Å²	187	157.5 Å²	157.5	92%	0.921	81%	0.806	S	S	*	*			trans	-153.7	147.4	162	-89.7	-52.4	163.6	0	0	110.8
615	H	29.9	Very low	31.9	Very low	144 Å²	144	159 Å²	159	67%	0.667	81%	0.814	S	S	*	*			trans	-114.5	135.7	174.3	-168.7	-75.8	0	0	0	107.9	D617	H615-D617 IonicContact CE1-OD1 3.4Å; H615-D617 IonicContact CE1-OD2 3.59Å; H615-D617 PolarHBondContact CE1-OD2 2.82Å; H615-D617 IonicContact ND1-OD2 3.42Å; H615-D617 PolarHBondContact ND1-OD2 3.23Å
616	L	31.2	Very low	31.1	Very low	159 Å²	159	164 Å²	164	83%	0.832	83%	0.825	S	S	*	*			trans	-153	118.6	168	-155.9	76.4	0	0	0	111
617	D	30.9	Very low	31.3	Very low	121 Å²	121	165.7 Å²	165.7	65%	0.647	83%	0.826	S	S	*	*			trans	-74.2	137.1	174.8	-55.4	-93.8	0	0	0	111.1	H615	H615-D617 IonicContact CE1-OD1 3.4Å; H615-D617 IonicContact CE1-OD2 3.59Å; H615-D617 PolarHBondContact CE1-OD2 2.82Å; H615-D617 IonicContact ND1-OD2 3.42Å; H615-D617 PolarHBondContact ND1-OD2 3.23Å
618	Y	30.3	Very low	31.4	Very low	224 Å²	224	162.4 Å²	162.4	88%	0.878	82%	0.821	S	S	*	*			trans	-151	130.6	150.1	-109.6	-72.4	0	0	0	111.8
619	S	30.1	Very low	31.5	Very low	109 Å²	109	160.1 Å²	160.1	76%	0.762	82%	0.818	S	S	*	*			trans	-96.3	116.3	177.4	178.4	0	0	0	0	111.2
620	K	33.1	Very low	30.5	Very low	191 Å²	191	158.5 Å²	158.5	83%	0.83	82%	0.819	S	S	*	*			trans	169.5	120.8	148.1	-98.3	162.6	-177.9	177.7	0	110.6
621	H	32.6	Very low	30.8	Very low	198 Å²	198	156.6 Å²	156.6	92%	0.917	82%	0.815	S	S	*	*			trans	-124.8	111.6	158.1	-82.3	-67.5	0	0	0	110.4
622	G	29.4	Very low	30.9	Very low	72 Å²	72	154.1 Å²	154.1	74%	0.742	81%	0.81	S	S	*	*			trans	-81.7	168.6	156.4	0	0	0	0	0	110.3
623	A	32.6	Very low	31.2	Very low	99 Å²	99	156.8 Å²	156.8	82%	0.818	80%	0.803	S	S	*	*			trans	-68.1	148.4	-173.3	0	0	0	0	0	114
624	Y	27.7	Very low	31.3	Very low	232 Å²	232	152 Å²	152	91%	0.91	80%	0.802	S	S	*	*			trans	-145.5	143.2	146.2	-139.3	-93	0	0	0	109.6
625	E	32	Very low	31.6	Very low	179 Å²	179	150.8 Å²	150.8	84%	0.836	80%	0.797	S	S	*	*			trans	-86.3	157.1	-175.8	-58.9	178.9	124.2	0	0	112
626	F	27.2	Very low	31.6	Very low	211 Å²	211	151.6 Å²	151.6	93%	0.925	80%	0.799	S	S	*	*			trans	-129.8	148.2	153.7	-156.3	-94.2	0	0	0	110.9
627	K	33.4	Very low	31.8	Very low	163 Å²	163	155.6 Å²	155.6	71%	0.709	80%	0.803	S	S	*	*			trans	-118.9	124.5	-157.5	-177.2	177.3	179.9	175.9	0	111.2
628	G	28.9	Very low	32.2	Very low	74 Å²	74	156.4 Å²	156.4	76%	0.763	80%	0.802	S	S	*	*			trans	-133.1	112.3	179.7	0	0	0	0	0	111.8
629	H	33	Very low	32.7	Very low	167 Å²	167	151.2 Å²	151.2	77%	0.773	80%	0.796	S	S	*	*			trans	-69.3	149.9	179.4	-54.7	-110.5	0	0	0	110.7
630	G	29.6	Very low	33.1	Very low	68 Å²	68	154.2 Å²	154.2	70%	0.701	80%	0.8	S	S	*	*			cis	123.4	99.4	0.5	0	0	0	0	0	112.3
631	L	33.4	Very low	33.2	Very low	156 Å²	156	152.4 Å²	152.4	82%	0.817	80%	0.8	S	S	*	*			trans	-144.1	114.4	165.8	-152.7	79.8	0	0	0	109.9
632	I	35.3	Very low	33.4	Very low	157 Å²	157	148.3 Å²	148.3	81%	0.805	79%	0.794	S	S	*	*			trans	-114.3	122.9	179.8	-64.5	170.6	0	0	0	107.9
633	H	32.8	Very low	34.1	Very low	166 Å²	166	149.4 Å²	149.4	77%	0.769	79%	0.787	S	S	*	*			trans	-88.7	110.1	167	-83.4	-79.9	0	0	0	110.2	I635	H633-I635 PolarHBondContact O-N 3.41Å
634	S	33	Very low	34.3	Very low	116 Å²	116	151 Å²	151	81%	0.811	79%	0.789	S	S	*	*			trans	-70.8	114.5	174.4	-55.2	0	0	0	0	110.9
635	I	37.7	Very low	34.6	Very low	160 Å²	160	151.3 Å²	151.3	82%	0.821	79%	0.789	S	S	*	*			trans	-98.6	113.8	165.7	-62.8	-178.4	0	0	0	108.9	H633 R637	H633-I635 PolarHBondContact O-N 3.41Å; I635-R637 PolarHBondContact O-N 3.28Å
636	K	28.4	Very low	34.7	Very low	162 Å²	162	148.3 Å²	148.3	70%	0.704	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-63	116.9	175.8	-175.2	-167.9	-171.8	-167.5	0	109.7	E638	K636-E638 HydrophobicContact CD-CG 4.12Å; K636-E638 WeakPolarHBondContact CE-OE1 3.46Å; K636-E638 HydrophobicContact CG-CG 4.28Å; K636-E638 IonicContact NZ-OE1 3.21Å; K636-E638 PolarHBondContact NZ-OE1 3.04Å
637	R	36.7	Very low	34.9	Very low	243 Å²	243	148 Å²	148	92%	0.917	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-82.9	121.8	160.8	-81.6	-172.2	175.4	-180	-0.9	108.7	I635	I635-R637 PolarHBondContact O-N 3.28Å
638	E	38.2	Very low	34.8	Very low	137 Å²	137	147.8 Å²	147.8	64%	0.64	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-94.6	146.5	162.2	-65.2	-177.4	163.3	0	0	108.8	K636	K636-E638 HydrophobicContact CD-CG 4.12Å; K636-E638 WeakPolarHBondContact CE-OE1 3.46Å; K636-E638 HydrophobicContact CG-CG 4.28Å; K636-E638 IonicContact NZ-OE1 3.21Å; K636-E638 PolarHBondContact NZ-OE1 3.04Å
639	P	40.6	Very low	34.8	Very low	116 Å²	116	147.9 Å²	147.9	75%	0.753	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-76.5	132	174.5	31.6	-32.3	0	0	0	110.1
640	M	40.4	Very low	34.8	Very low	171 Å²	171	148.5 Å²	148.5	84%	0.842	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-102.2	118	164.6	-76.7	-63.2	-59.8	0	0	108.5
641	D	34.6	Very low	34.8	Very low	154 Å²	154	153 Å²	153	82%	0.824	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-71.7	127.8	172.3	-72.6	-56.9	0	0	0	110.7
642	S	37.3	Very low	34.8	Very low	112 Å²	112	153.6 Å²	153.6	78%	0.783	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-88.1	127.8	174.1	-64.1	0	0	0	0	110.6
643	P	44	Very low	34.3	Very low	94 Å²	94	153.7 Å²	153.7	61%	0.61	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-70.4	144.1	172.6	29.9	-34.2	0	0	0	110.9	W645	P643-W645 PolarHBondContact O-N 3.4Å
644	P	36.9	Very low	34.3	Very low	132 Å²	132	153.7 Å²	153.7	86%	0.857	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-74.6	124	179.2	30	-33.7	0	0	0	111
645	W	33.3	Very low	34.2	Very low	240 Å²	240	153.2 Å²	153.2	91%	0.909	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-96.7	121.9	166.8	-75.6	75.8	0	0	0	109.3	P643	P643-W645 PolarHBondContact O-N 3.4Å
646	S	33.5	Very low	33.9	Very low	115 Å²	115	154.6 Å²	154.6	80%	0.804	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-80.4	116.7	-178.9	53.7	0	0	0	0	111.2	N648	S646-N648 PolarHBondContact O-N 3.42Å
647	E	31.9	Very low	34.1	Very low	204 Å²	204	156.2 Å²	156.2	95%	0.953	83%	0.825	S	S	*	*			trans	-75.1	114.9	172.2	-173.5	171.5	-149.5	0	0	110.1
648	N	30.7	Very low	33.8	Very low	159 Å²	159	148.4 Å²	148.4	85%	0.85	82%	0.821	S	S	*	*			trans	-158.8	118.9	173.9	-151.5	17.3	0	0	0	109.7	S646	S646-N648 PolarHBondContact O-N 3.42Å
649	G	28.5	Very low	33.4	Very low	77 Å²	77	145.8 Å²	145.8	79%	0.794	83%	0.83	S	S	*	*			trans	166.2	63.8	-173.6	0	0	0	0	0	114.8
650	H	34.9	Very low	33	Very low	180 Å²	180	146.3 Å²	146.3	83%	0.833	84%	0.837	S	S	*	*			trans	-93.5	124.5	166.8	-79.1	-66	0	0	0	110.9
651	D	28.7	Very low	32.7	Very low	163 Å²	163	148.9 Å²	148.9	87%	0.872	84%	0.837	S	S	*	*			trans	-144.5	108.6	151.9	-82.8	-52.5	0	0	0	104.6
652	M	32.9	Very low	32.6	Very low	168 Å²	168	148.8 Å²	148.8	83%	0.828	84%	0.836	S	S	*	*			cis	66.6	117.5	48.5	-158.6	176.2	-171.7	0	0	113.6
653	N	26.2	Very low	32.4	Very low	159 Å²	159	149.7 Å²	149.7	85%	0.85	84%	0.837	S	S	*	*			trans	-153.5	96.4	170.1	-164.7	-5.6	0	0	0	109.8
654	Q	32.1	Very low	31.7	Very low	166 Å²	166	153 Å²	153	78%	0.776	85%	0.846	S	S	*	*			trans	-154	123.1	169.6	-145.5	168.1	93.6	0	0	112.2
655	S	31.4	Very low	32.4	Very low	106 Å²	106	151.9 Å²	151.9	74%	0.741	84%	0.839	S	S	*	*			trans	13.2	129.6	162.9	55.8	0	0	0	0	121.6
656	M	30.1	Very low	32.3	Very low	188 Å²	188	145.2 Å²	145.2	93%	0.926	83%	0.828	S	S	*	*			trans	-66.6	145.5	164	-63.1	179	174.7	0	0	113.9
657	M	32.6	Very low	32.3	Very low	196 Å²	196	146 Å²	146	97%	0.966	83%	0.827	S	S	*	*			trans	-149.1	155.4	134	-96.9	-60.7	179.2	0	0	107.7
658	G	31.4	Very low	32.2	Very low	80 Å²	80	144.9 Å²	144.9	83%	0.825	82%	0.824	S	S	*	*			trans	-138.1	172.6	-160.7	0	0	0	0	0	118
659	G	29.1	Very low	32.3	Very low	81 Å²	81	142.5 Å²	142.5	84%	0.835	82%	0.82	S	S	*	*			trans	107.8	139.4	-178.6	0	0	0	0	0	112.7
660	S	32	Very low	32.6	Very low	128 Å²	128	146 Å²	146	90%	0.895	83%	0.826	S	S	*	*			cis	-150.4	-171.6	-6.2	68.5	0	0	0	0	111.2
661	R	34.2	Very low	32.4	Very low	225 Å²	225	140.3 Å²	140.3	85%	0.849	82%	0.817	S	S	*	*			trans	-86.5	161.2	-163.3	-65.8	175.2	171.5	162.2	-4.3	115.6
662	N	32.5	Very low	32.8	Very low	151 Å²	151	140.7 Å²	140.7	81%	0.807	81%	0.813	S	S	*	*			trans	131.1	146.9	141.8	-65.1	-21.4	0	0	0	113
663	V	32.4	Very low	32.8	Very low	132 Å²	132	138.9 Å²	138.9	80%	0.8	80%	0.802	S	S	*	*			cis	-156.6	152.6	-17.3	132.8	0	0	0	0	107.1
664	M	30.6	Very low	33.2	Very low	163 Å²	163	139.3 Å²	139.3	80%	0.803	80%	0.797	S	S	*	*			trans	-94.9	163.5	177.4	-104.1	-68.9	-178.7	0	0	111.2
665	P	52	Low	33.1	Very low	108 Å²	108	137 Å²	137	70%	0.701	80%	0.799	S	S	*	*				-157.2	158.3	58.5	43.8	-21.8	0	0	0	121.1
666	C	30.8	Very low	33.2	Very low	101 Å²	101	137.4 Å²	137.4	68%	0.682	80%	0.802	S	S	*	*			trans	55.6	131	131.5	-65.9	0	0	0	0	125.7
667	V	32.8	Very low	34.5	Very low	130 Å²	130	133 Å²	133	79%	0.788	79%	0.787	S	S	*	*				79.2	143.9	124.3	169.2	0	0	0	0	117.8
668	M	30.5	Very low	34.4	Very low	181 Å²	181	133.6 Å²	133.6	89%	0.892	78%	0.78	S	S	*	*			cis	-144	178.7	12.7	-150.7	148.9	171.6	0	0	114.1
669	S	32.3	Very low	34.9	Very low	109 Å²	109	136.6 Å²	136.6	76%	0.762	78%	0.775	S	S	*	*			trans	-105.5	148.2	-178.3	-49.6	0	0	0	0	115.7
670	T	35.3	Very low	35.8	Very low	150 Å²	150	143.2 Å²	143.2	92%	0.92	78%	0.777	S	S	*	*			trans	-157.4	141.8	152.9	52.5	0	0	0	0	109.8
671	G	30.4	Very low	36.2	Very low	62 Å²	62	145.2 Å²	145.2	64%	0.639	77%	0.774	S	S	*	*			cis	153.4	107.9	-13	0	0	0	0	0	114.9
672	H	36	Very low	36.3	Very low	171 Å²	171	147.3 Å²	147.3	79%	0.792	79%	0.793	S	S	*	*			trans	63.5	162.9	156.6	-61.2	-75.4	0	0	0	119
673	H	34.2	Very low	36.5	Very low	130 Å²	130	147.1 Å²	147.1	60%	0.602	79%	0.793	S	S	*	*			cis	-161.8	154.1	-13.7	-116.8	-20	0	0	0	113
674	K	33.5	Very low	36.7	Very low	167 Å²	167	147.9 Å²	147.9	73%	0.726	79%	0.792	S	S	*	*			trans	38.3	129.1	142	-62.6	160.9	174.5	156.7	0	122.9
675	S	31.2	Very low	37	Very low	118 Å²	118	147.1 Å²	147.1	83%	0.825	79%	0.792	S	S	*	*				172.7	129.2	106.4	58.8	0	0	0	0	117.9
676	S	32.3	Very low	36.2	Very low	114 Å²	114	149.4 Å²	149.4	80%	0.797	80%	0.797	S	S	*	*			trans	6	174.7	136.7	-67.1	0	0	0	0	124.8
677	P	57.2	Low	36.5	Very low	95 Å²	95	152.4 Å²	152.4	62%	0.617	80%	0.804	S	S	*	*			cis	-144.7	-158	-32.4	39.1	-17.4	0	0	0	115
678	Y	31.3	Very low	36.7	Very low	210 Å²	210	153.9 Å²	153.9	82%	0.824	81%	0.805	S	S	*	*			trans	76.6	154.9	160.1	-67.2	-38.6	0	0	0	119
679	I	43.1	Very low	37.2	Very low	142 Å²	142	151.9 Å²	151.9	73%	0.728	80%	0.799	S	S	*	*			cis	-148.4	169.4	-7.5	-125.7	161	0	0	0	110.8
680	Y	47	Very low	37.6	Very low	220 Å²	220	155.2 Å²	155.2	86%	0.863	80%	0.802	S	S	*	*			trans	-120.4	123.5	174.6	-165.7	-72.8	0	0	0	110.7
681	M	39.6	Very low	37.7	Very low	171 Å²	171	155.7 Å²	155.7	84%	0.842	79%	0.792	S	S	*	*			trans	-171.1	149.6	158	-118.6	-166.3	-61.1	0	0	113.3
682	Q	37.1	Very low	38.4	Very low	268 Å²	268	164.2 Å²	164.2	100%	1.252	81%	0.806	S	S	*	*			trans	70.8	0	172.5	-161.5	155	66.5	0	0	117.1

Retrieved 682 of 682 residues in 1485.3 ms (Link to these results)

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