A0A077YZP9_TRITR Loading...

Glutamate-rich WD repeat-containing protein 1

AlphaFold DB , UniProt , Accession A0A077YZP9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 465 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.3	Very low	39.7	Very low	233 Å²	233	158.1 Å²	158.1	100%	1.148	88%	0.878	S	S	*	*				0	84.3	0	-72.9	177.6	-178	0	0	105.5
2	E	39.8	Very low	39.5	Very low	197 Å²	197	154.1 Å²	154.1	92%	0.921	87%	0.869	S	S	*	*				85	97.8	116	-73.3	-175.9	164.3	0	0	109
3	G	38.5	Very low	39.6	Very low	77 Å²	77	156.2 Å²	156.2	79%	0.794	87%	0.867	S	S	*	*				125.3	145.3	63.3	0	0	0	0	0	104.9
4	K	43.8	Very low	39.5	Very low	206 Å²	206	158 Å²	158	90%	0.896	87%	0.866	S	S	*	*			cis	-160.4	141.8	22.7	-103	173.2	168	177.3	0	107.4
5	E	34	Very low	39.2	Very low	177 Å²	177	160.2 Å²	160.2	83%	0.827	87%	0.867	S	S	*	*			trans	-73.1	147.7	157.8	-68.1	164.2	153.1	0	0	110.4
6	V	47.1	Very low	39.1	Very low	144 Å²	144	161 Å²	161	87%	0.873	86%	0.864	S	S	*	*			trans	-141	112.6	147.9	-178.5	0	0	0	0	107.5
7	E	36.6	Very low	38.9	Very low	173 Å²	173	160.8 Å²	160.8	81%	0.808	86%	0.862	S	S	*	*			trans	-84.2	167.3	171.1	-73.4	-175.3	142.7	0	0	112.7
8	A	40.2	Very low	38.7	Very low	93 Å²	93	159.6 Å²	159.6	77%	0.769	86%	0.856	S	S	*	*			trans	91.6	112.2	148.3	0	0	0	0	0	118.3
9	S	40.5	Very low	38.5	Very low	124 Å²	124	156.6 Å²	156.6	87%	0.867	85%	0.849	S	S	*	*				-173.6	145.9	86.5	37.6	0	0	0	0	111.6
10	E	38.5	Very low	38.4	Very low	194 Å²	194	153.8 Å²	153.8	91%	0.907	84%	0.842	S	S	*	*			trans	-80.5	148.4	-169	-60.6	163.4	140.1	0	0	112.9
11	S	38.8	Very low	38.1	Very low	121 Å²	121	154.3 Å²	154.3	85%	0.846	84%	0.838	S	S	*	*			trans	-146.7	107	143.1	60.1	0	0	0	0	108.5
12	S	37.1	Very low	37.8	Very low	110 Å²	110	152.4 Å²	152.4	77%	0.769	83%	0.826	S	S	*	*			trans	-65	134.5	171.2	49.4	0	0	0	0	111.6
13	E	40.1	Very low	37.5	Very low	182 Å²	182	150.8 Å²	150.8	85%	0.85	82%	0.819	S	S	*	*			trans	-162.5	114	147	-106.8	159.7	-146.9	0	0	109.7
14	E	39.3	Very low	37	Very low	181 Å²	181	152.1 Å²	152.1	85%	0.846	82%	0.816	S	S	*	*			trans	73.5	111	145	-56.9	-175.3	170.3	0	0	120.3
15	Q	33.7	Very low	36.4	Very low	191 Å²	191	148 Å²	148	89%	0.893	81%	0.813	S	S	*	*			trans	-67.3	120.5	164.3	-70.3	171.2	-59	0	0	110
16	E	38.5	Very low	36.5	Very low	173 Å²	173	147.4 Å²	147.4	81%	0.808	82%	0.815	S	S	*	*			trans	-119.1	106.2	151.2	-77.8	-171.9	162.8	0	0	107.9	N18	E16-N18 VanDerWaalsContact C-N 3.34Å; E16-N18 PolarHBondContact O-N 2.69Å
17	D	34.7	Very low	36.4	Very low	157 Å²	157	146 Å²	146	84%	0.84	81%	0.811	S	S	*	*			trans	-61.5	94.5	163.2	-91.1	-34.8	0	0	0	108.2
18	N	36.9	Very low	37.4	Very low	139 Å²	139	141.9 Å²	141.9	74%	0.743	81%	0.807	S	S	*	*			trans	-95.3	83.9	164	-101	-27.1	0	0	0	108.9	E16 S20	E16-N18 VanDerWaalsContact C-N 3.34Å; E16-N18 PolarHBondContact O-N 2.69Å; N18-S20 PolarHBondContact O-N 2.97Å
19	S	33.5	Very low	38.4	Very low	104 Å²	104	147.9 Å²	147.9	73%	0.727	81%	0.809	S	S	*	*			trans	-64.4	88.3	152.5	53	0	0	0	0	108.3	E21	S19-E21 PolarHBondContact O-N 2.9Å
20	S	37.1	Very low	39.9	Very low	100 Å²	100	153.2 Å²	153.2	70%	0.699	81%	0.811	S	S	*	*			trans	-78	101.1	166.2	57	0	0	0	0	108.3	N18 E22	N18-S20 PolarHBondContact O-N 2.97Å; S20-E22 PolarHBondContact O-N 3Å
21	E	33.2	Very low	41.8	Very low	164 Å²	164	149.5 Å²	149.5	77%	0.766	80%	0.797	S	S	*	*			trans	-49.3	99	158.3	-67.2	166.9	161.4	0	0	108.9	S19 E23	S19-E21 PolarHBondContact O-N 2.9Å; E21-E23 PolarHBondContact O-N 2.93Å
22	E	32.7	Very low	44	Very low	193 Å²	193	148.9 Å²	148.9	90%	0.902	79%	0.788	S	S	*	*			trans	-77.6	71.1	157.2	-75.2	-168.9	168.8	0	0	107.8	S20 S24	S20-E22 PolarHBondContact O-N 3Å; E22-S24 PolarHBondContact O-N 3.12Å; E22-S24 VanDerWaalsContact O-N 3.11Å
23	E	32.3	Very low	46.3	Very low	164 Å²	164	147.3 Å²	147.3	77%	0.766	77%	0.766	S	S	*	*			trans	-69.9	99.7	162.7	-83.8	-165.3	156.2	0	0	109.1	E21 S25	E21-E23 PolarHBondContact O-N 2.93Å; E23-S25 PolarHBondContact O-N 2.93Å
24	S	28.4	Very low	48.5	Very low	105 Å²	105	139.9 Å²	139.9	73%	0.734	73%	0.732	S	S	*	*			trans	5.3	99.1	146.7	59.7	0	0	0	0	118	E22	E22-S24 PolarHBondContact O-N 3.12Å; E22-S24 VanDerWaalsContact O-N 3.11Å
25	S	31.1	Very low	50.6	Low	118 Å²	118	132.1 Å²	132.1	83%	0.825	70%	0.697	S	S	*	*			trans	-113.8	65.2	150.7	71.6	0	0	0	0	109.7	E23 S27	E23-S25 PolarHBondContact O-N 2.93Å; S25-S27 VanDerWaalsContact C-N 3.31Å; S25-S27 PolarHBondContact O-N 2.75Å
26	L	37.2	Very low	52.9	Low	166 Å²	166	125.7 Å²	125.7	87%	0.869	68%	0.682	S	S	*	*			trans	-72.4	92.2	162.3	-80.6	162	0	0	0	106.8	A28	L26-A28 PolarHBondContact O-N 3.44Å
27	S	44.9	Very low	55.1	Low	114 Å²	114	121.8 Å²	121.8	80%	0.797	67%	0.666	S	S	*	*			trans	-55	106.5	165.7	63.1	0	0	0	0	107.3	S25 R29	S25-S27 VanDerWaalsContact C-N 3.31Å; S25-S27 PolarHBondContact O-N 2.75Å; S27-R29 PolarHBondContact O-N 3.14Å
28	A	57.5	Low	57.5	Low	87 Å²	87	116.1 Å²	116.1	72%	0.719	64%	0.639	S	S	*	*			trans	-56.2	114.2	-176.5	0	0	0	0	0	108.9	L26 R30	L26-A28 PolarHBondContact O-N 3.44Å; A28-R30 PolarHBondContact O-N 3.01Å; A28-R30 VanDerWaalsContact O-N 3.11Å
29	R	60.4	Low	59.9	Low	218 Å²	218	115.2 Å²	115.2	82%	0.823	63%	0.625	S	S	*	*			trans	-58.9	116.4	176.8	-171.1	177.9	178.6	158.6	2.7	107.8	S27 D31	S27-R29 PolarHBondContact O-N 3.14Å; R29-D31 IonicContact NE-OD1 3.61Å; R29-D31 PolarHBondContact O-N 3.43Å
30	R	72.2	Confident	62.3	Low	236 Å²	236	115.3 Å²	115.3	89%	0.891	62%	0.623	S	S	*	*			trans	-84.7	108.7	175.9	-66.6	-178.7	-178.9	163.3	1.4	107.8	A28	A28-R30 PolarHBondContact O-N 3.01Å; A28-R30 VanDerWaalsContact O-N 3.11Å
31	D	79.1	Confident	64.7	Low	116 Å²	116	114.3 Å²	114.3	62%	0.62	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-94.8	142.6	173.1	-65.4	-32.1	0	0	0	109.7	R29	R29-D31 IonicContact NE-OD1 3.61Å; R29-D31 PolarHBondContact O-N 3.43Å
32	V	84.2	Confident	67.2	Low	108 Å²	108	111.9 Å²	111.9	66%	0.655	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-75.6	130.6	177.3	-178.7	0	0	0	0	109.2	L34 S38	V32-L34 HydrophobicContact CG1-CD2 4.17Å; V32-L34 HydrophobicContact CG1-CG 4.36Å; V32-S38 PolarHBondContact O-OG 3.06Å
33	Y	86	Confident	69.7	Low	77 Å²	77	111.1 Å²	111.1	30%	0.302	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-95.9	120.1	173.5	-177.7	-96.7	0	0	0	110.5	P35 L41 L47 L431	Y33-P35 HydrophobicContact CD1-CG 4.47Å; Y33-P35 HydrophobicContact CE1-CB 4.48Å; Y33-P35 HydrophobicContact CE1-CG 4.16Å; Y33-L41 HydrophobicContact CD2-CD2 4.41Å; Y33-L41 HydrophobicContact CE2-CG 4.4Å; Y33-L47 HydrophobicContact CD1-CD1 3.92Å; Y33-L47 HydrophobicContact CD1-CD2 3.71Å; Y33-L47 HydrophobicContact CD1-CG 4.49Å; Y33-L47 HydrophobicContact CD2-CD2 4.04Å; Y33-L47 HydrophobicContact CE1-CD1 4.05Å; Y33-L47 HydrophobicContact CE1-CD2 4.48Å; Y33-L47 HydrophobicContact CG-CD1 4.45Å; Y33-L47 HydrophobicContact CG-CD2 3.44Å; Y33-L47 VanDerWaalsContact CG-CD2 3.44Å; Y33-L431 HydrophobicContact CD1-CD1 4.18Å; Y33-L431 HydrophobicContact CE1-CD1 4.46Å
34	L	86.3	Confident	72.2	Confident	27 Å²	27	107.1 Å²	107.1	14%	0.141	60%	0.604	C	S	.	*			trans	-110.4	112	174.5	-64.4	178.2	0	0	0	108.4	V32 G36 L37 S38 L422 I429	V32-L34 HydrophobicContact CG1-CD2 4.17Å; V32-L34 HydrophobicContact CG1-CG 4.36Å; L34-G36 PolarHBondContact O-N 3.21Å; L34-L37 HydrophobicContact CB-CB 3.95Å; L34-L37 HydrophobicContact CB-CD1 4.32Å; L34-L37 HydrophobicContact CD1-CD1 4.22Å; L34-L37 PolarHBondContact O-N 3.01Å; L34-L37 VanDerWaalsContact O-N 3.07Å; L34-S38 PolarHBondContact N-OG 3.43Å; L34-S38 WeakPolarHBondContact O-CB 3.46Å; L34-S38 PolarHBondContact O-N 2.87Å; L34-S38 PolarHBondContact O-OG 2.94Å; L34-L422 HydrophobicContact CD1-CD1 4.07Å; L34-L422 HydrophobicContact CD1-CD2 4.5Å; L34-L422 HydrophobicContact CD1-CG 4.34Å; L34-L422 HydrophobicContact CD2-CD1 3.82Å; L34-I429 HydrophobicContact CD2-CD1 3.98Å
35	P	83.7	Confident	75	Confident	17 Å²	17	105.7 Å²	105.7	11%	0.11	59%	0.586	C	S	.	*	T	Hydrogen-bonded Turn	trans	-51.4	134.4	176.5	-23.3	29.9	0	0	0	111.9	Y33 L37 V400 I429 L431	Y33-P35 HydrophobicContact CD1-CG 4.47Å; Y33-P35 HydrophobicContact CE1-CB 4.48Å; Y33-P35 HydrophobicContact CE1-CG 4.16Å; P35-L37 PolarHBondContact O-N 3.14Å; P35-L37 VanDerWaalsContact O-N 3.12Å; P35-V400 HydrophobicContact CB-CG2 3.77Å; P35-V400 HydrophobicContact CG-CG2 3.93Å; P35-I429 HydrophobicContact CG-CG2 4.02Å; P35-L431 HydrophobicContact CG-CD1 3.78Å; P35-L431 HydrophobicContact CG-CD2 3.59Å; P35-L431 HydrophobicContact CG-CG 4.2Å
36	G	81.6	Confident	77.5	Confident	56 Å²	56	107.3 Å²	107.3	58%	0.577	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.9	-16.4	-179	0	0	0	0	0	115.8	L34	L34-G36 PolarHBondContact O-N 3.21Å
37	L	83.3	Confident	79.9	Confident	91 Å²	91	103.6 Å²	103.6	48%	0.476	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.5	-39.9	-179.1	-66.1	174.2	0	0	0	112.8	L34 P35 N421 L422	L34-L37 HydrophobicContact CB-CB 3.95Å; L34-L37 HydrophobicContact CB-CD1 4.32Å; L34-L37 HydrophobicContact CD1-CD1 4.22Å; L34-L37 PolarHBondContact O-N 3.01Å; L34-L37 VanDerWaalsContact O-N 3.07Å; P35-L37 PolarHBondContact O-N 3.14Å; P35-L37 VanDerWaalsContact O-N 3.12Å; L37-N421 HydrophobicContact CD1-CB 4.46Å; L37-L422 HydrophobicContact CD1-CD2 3.5Å; L37-L422 VanDerWaalsContact CD1-CD2 3.5Å; L37-L422 HydrophobicContact CD1-CG 4.39Å
38	S	85.1	Confident	81.8	Confident	39 Å²	39	105.2 Å²	105.2	27%	0.273	56%	0.557	S	S	.	*	S	Bend	trans	-74.2	152.5	174.6	-65.7	0	0	0	0	111.1	V32 L34	V32-S38 PolarHBondContact O-OG 3.06Å; L34-S38 PolarHBondContact N-OG 3.43Å; L34-S38 WeakPolarHBondContact O-CB 3.46Å; L34-S38 PolarHBondContact O-N 2.87Å; L34-S38 PolarHBondContact O-OG 2.94Å
39	R	88	Confident	83.1	Confident	119 Å²	119	104.5 Å²	104.5	45%	0.449	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-58.8	151.6	171	62.3	171	178.6	75.9	-2.6	110.7	M42 E45	R39-M42 VanDerWaalsContact CZ-CE 3.45Å; R39-E45 IonicContact CZ-OE1 3.4Å; R39-E45 IonicContact CZ-OE2 3.58Å; R39-E45 IonicContact NH1-OE1 3.25Å; R39-E45 PolarHBondContact NH1-OE1 2.82Å; R39-E45 IonicContact NH1-OE2 2.71Å; R39-E45 PolarHBondContact NH1-OE2 3.16Å; R39-E45 IonicContact NH2-OE1 2.68Å; R39-E45 PolarHBondContact NH2-OE1 2.9Å; R39-E45 IonicContact NH2-OE2 3.55Å
40	P	85.2	Confident	84.4	Confident	106 Å²	106	99 Å²	99	69%	0.688	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-53.6	148.2	170.4	-25.2	34.4	0	0	0	112	M42	P40-M42 PolarHBondContact O-N 3.32Å
41	L	85.6	Confident	85	Confident	79 Å²	79	92.4 Å²	92.4	41%	0.414	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-61.7	130.4	173.6	-65.2	166.7	0	0	0	109.8	Y33 E45 L47	Y33-L41 HydrophobicContact CD2-CD2 4.41Å; Y33-L41 HydrophobicContact CE2-CG 4.4Å; L41-E45 WeakPolarHBondContact CA-OE2 3.39Å; L41-E45 HydrophobicContact CB-CB 4.43Å; L41-E45 HydrophobicContact CD2-CB 4.08Å; L41-L47 HydrophobicContact CD1-CD1 3.95Å; L41-L47 HydrophobicContact CD1-CD2 4.41Å; L41-L47 HydrophobicContact CD1-CG 3.74Å; L41-L47 HydrophobicContact CD2-CD2 3.91Å; L41-L47 HydrophobicContact CD2-CG 4.08Å; L41-L47 HydrophobicContact CG-CG 4.46Å
42	M	86.7	Confident	85.3	Confident	113 Å²	113	90.7 Å²	90.7	56%	0.557	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-81.7	162.8	172.7	-61.6	-168.2	-146.4	0	0	110.8	R39 P40 G44 E45	R39-M42 VanDerWaalsContact CZ-CE 3.45Å; P40-M42 PolarHBondContact O-N 3.32Å; M42-G44 PolarHBondContact O-N 2.92Å; M42-E45 HydrophobicContact CB-CG 4.24Å; M42-E45 PolarHBondContact N-OE2 3.25Å; M42-E45 WeakPolarHBondContact O-CB 2.87Å; M42-E45 PolarHBondContact O-N 3.22Å
43	N	84.1	Confident	85.6	Confident	177 Å²	177	86.4 Å²	86.4	95%	0.947	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	124	175.4	-74.2	-16.2	0	0	0	110.8
44	G	86.1	Confident	85.9	Confident	80 Å²	80	83.6 Å²	83.6	83%	0.825	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.3	-14.8	-178.9	0	0	0	0	0	114.4	M42	M42-G44 PolarHBondContact O-N 2.92Å
45	E	87	Confident	86.1	Confident	75 Å²	75	85 Å²	85	35%	0.35	47%	0.471	S	S	.	.			trans	-77	139.6	172.6	-62.8	-178.3	157.7	0	0	110.6	R39 L41 M42	R39-E45 IonicContact CZ-OE1 3.4Å; R39-E45 IonicContact CZ-OE2 3.58Å; R39-E45 IonicContact NH1-OE1 3.25Å; R39-E45 PolarHBondContact NH1-OE1 2.82Å; R39-E45 IonicContact NH1-OE2 2.71Å; R39-E45 PolarHBondContact NH1-OE2 3.16Å; R39-E45 IonicContact NH2-OE1 2.68Å; R39-E45 PolarHBondContact NH2-OE1 2.9Å; R39-E45 IonicContact NH2-OE2 3.55Å; L41-E45 WeakPolarHBondContact CA-OE2 3.39Å; L41-E45 HydrophobicContact CB-CB 4.43Å; L41-E45 HydrophobicContact CD2-CB 4.08Å; M42-E45 HydrophobicContact CB-CG 4.24Å; M42-E45 PolarHBondContact N-OE2 3.25Å; M42-E45 WeakPolarHBondContact O-CB 2.87Å; M42-E45 PolarHBondContact O-N 3.22Å
46	K	84.2	Confident	86.5	Confident	153 Å²	153	84.2 Å²	84.2	67%	0.665	47%	0.465	S	S	*	.			trans	-126.9	139.7	176.6	-65.6	-175.9	-179.7	-179.2	0	109
47	L	85.7	Confident	87	Confident	87 Å²	87	82 Å²	82	46%	0.455	44%	0.44	S	S	.	.			trans	-76.1	128.7	165.5	-67.2	174.6	0	0	0	108.8	Y33 L41	Y33-L47 HydrophobicContact CD1-CD1 3.92Å; Y33-L47 HydrophobicContact CD1-CD2 3.71Å; Y33-L47 HydrophobicContact CD1-CG 4.49Å; Y33-L47 HydrophobicContact CD2-CD2 4.04Å; Y33-L47 HydrophobicContact CE1-CD1 4.05Å; Y33-L47 HydrophobicContact CE1-CD2 4.48Å; Y33-L47 HydrophobicContact CG-CD1 4.45Å; Y33-L47 HydrophobicContact CG-CD2 3.44Å; Y33-L47 VanDerWaalsContact CG-CD2 3.44Å; L41-L47 HydrophobicContact CD1-CD1 3.95Å; L41-L47 HydrophobicContact CD1-CD2 4.41Å; L41-L47 HydrophobicContact CD1-CG 3.74Å; L41-L47 HydrophobicContact CD2-CD2 3.91Å; L41-L47 HydrophobicContact CD2-CG 4.08Å; L41-L47 HydrophobicContact CG-CG 4.46Å
48	I	85.2	Confident	87.4	Confident	148 Å²	148	78.9 Å²	78.9	76%	0.759	42%	0.422	S	S	*	.			trans	-117	118.2	170.5	-57.4	173.1	0	0	0	104.8
49	F	86.1	Confident	87.7	Confident	73 Å²	73	79 Å²	79	32%	0.32	42%	0.418	S	S	.	.			trans	-71.7	147.7	176.5	74	-85.3	0	0	0	110	K51 Y54 Y57 F123	F49-K51 HydrophobicContact CD2-CG 4.38Å; F49-K51 HydrophobicContact CE2-CB 4.35Å; F49-K51 HydrophobicContact CE2-CG 3.76Å; F49-K51 HydrophobicContact CZ-CG 4Å; F49-K51 PolarHBondContact O-N 2.92Å; F49-Y54 AromaticContact CD2-CD2 3.95Å; F49-Y54 HydrophobicContact CD2-CD2 3.95Å; F49-Y54 AromaticContact CD2-CE2 3.82Å; F49-Y54 HydrophobicContact CD2-CE2 3.82Å; F49-Y54 HydrophobicContact CE2-CD2 4.18Å; F49-Y54 HydrophobicContact CE2-CE2 4.41Å; F49-Y57 HydrophobicContact CE2-CD1 4.16Å; F49-Y57 HydrophobicContact CZ-CD1 4.04Å; F49-Y57 HydrophobicContact CZ-CE1 4.34Å; F49-F123 HydrophobicContact CE2-CE1 4.47Å; F49-F123 HydrophobicContact CE2-CE2 4.26Å; F49-F123 AromaticContact CE2-CZ 4Å; F49-F123 HydrophobicContact CE2-CZ 4Å; F49-F123 HydrophobicContact CZ-CE1 4.39Å; F49-F123 AromaticContact CZ-CE2 3.87Å; F49-F123 HydrophobicContact CZ-CE2 3.87Å; F49-F123 AromaticContact CZ-CZ 3.57Å; F49-F123 HydrophobicContact CZ-CZ 3.57Å
50	D	86.1	Confident	87.9	Confident	101 Å²	101	73.6 Å²	73.6	54%	0.54	40%	0.398	S	S	.	.			trans	-75	107.6	173.3	-171.7	-13.5	0	0	0	109.6	S52 A53	D50-S52 PolarHBondContact O-N 2.92Å; D50-S52 WeakPolarHBondContact OD1-CB 3.44Å; D50-S52 PolarHBondContact OD1-N 3.09Å; D50-S52 PolarHBondContact OD1-OG 3.46Å; D50-S52 PolarHBondContact OD2-OG 2.83Å; D50-A53 HydrophobicContact CB-CB 4.3Å; D50-A53 VanDerWaalsContact O-CB 3.26Å; D50-A53 WeakPolarHBondContact O-CB 3.45Å; D50-A53 PolarHBondContact O-N 3.47Å; D50-A53 VanDerWaalsContact O-N 3.12Å
51	K	84.7	Confident	88	Confident	98 Å²	98	69.6 Å²	69.6	43%	0.426	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-59.5	-29	178.3	-66.3	174.2	160.3	-170.2	0	112.5	F49 A53 Y54 F123	F49-K51 HydrophobicContact CD2-CG 4.38Å; F49-K51 HydrophobicContact CE2-CB 4.35Å; F49-K51 HydrophobicContact CE2-CG 3.76Å; F49-K51 HydrophobicContact CZ-CG 4Å; F49-K51 PolarHBondContact O-N 2.92Å; K51-A53 PolarHBondContact O-N 3.03Å; K51-Y54 PolarHBondContact O-N 3.11Å; K51-F123 HydrophobicContact CB-CD1 4.06Å; K51-F123 HydrophobicContact CB-CE1 3.65Å; K51-F123 HydrophobicContact CD-CE1 3.57Å; K51-F123 HydrophobicContact CD-CZ 4.15Å; K51-F123 HydrophobicContact CG-CD1 4.29Å; K51-F123 HydrophobicContact CG-CE1 3.39Å; K51-F123 HydrophobicContact CG-CZ 3.91Å
52	S	86.6	Confident	87.9	Confident	80 Å²	80	65.8 Å²	65.8	56%	0.559	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-72	-15.7	179.9	74.1	0	0	0	0	113.3	D50 Y54 I463	D50-S52 PolarHBondContact O-N 2.92Å; D50-S52 WeakPolarHBondContact OD1-CB 3.44Å; D50-S52 PolarHBondContact OD1-N 3.09Å; D50-S52 PolarHBondContact OD1-OG 3.46Å; D50-S52 PolarHBondContact OD2-OG 2.83Å; S52-Y54 PolarHBondContact O-N 3.4Å; S52-I463 WeakPolarHBondContact O-CG2 3.39Å
53	A	90.4	Very high	87.5	Confident	19 Å²	19	60.5 Å²	60.5	16%	0.157	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-76.6	-9.8	177.7	0	0	0	0	0	113.3	D50 K51 F428 T462 I463	D50-A53 HydrophobicContact CB-CB 4.3Å; D50-A53 VanDerWaalsContact O-CB 3.26Å; D50-A53 WeakPolarHBondContact O-CB 3.45Å; D50-A53 PolarHBondContact O-N 3.47Å; D50-A53 VanDerWaalsContact O-N 3.12Å; K51-A53 PolarHBondContact O-N 3.03Å; A53-F428 HydrophobicContact CB-CE2 3.85Å; A53-F428 HydrophobicContact CB-CZ 4.14Å; A53-T462 WeakPolarHBondContact O-CA 3.38Å; A53-I463 PolarHBondContact O-N 2.87Å; A53-I463 VanDerWaalsContact O-N 3.14Å
54	Y	91.6	Very high	86.8	Confident	18 Å²	18	52.8 Å²	52.8	7%	0.071	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	136.9	-178.8	-63.2	-91.1	0	0	0	111.5	F49 K51 S52 Y57 F428 H430 A460	F49-Y54 AromaticContact CD2-CD2 3.95Å; F49-Y54 HydrophobicContact CD2-CD2 3.95Å; F49-Y54 AromaticContact CD2-CE2 3.82Å; F49-Y54 HydrophobicContact CD2-CE2 3.82Å; F49-Y54 HydrophobicContact CE2-CD2 4.18Å; F49-Y54 HydrophobicContact CE2-CE2 4.41Å; K51-Y54 PolarHBondContact O-N 3.11Å; S52-Y54 PolarHBondContact O-N 3.4Å; Y54-Y57 HydrophobicContact CD1-CG 4.46Å; Y54-F428 HydrophobicContact CD1-CZ 4.43Å; Y54-F428 AromaticContact CE1-CE1 3.97Å; Y54-F428 HydrophobicContact CE1-CE1 3.97Å; Y54-F428 AromaticContact CE1-CZ 3.8Å; Y54-F428 HydrophobicContact CE1-CZ 3.8Å; Y54-F428 AromaticContact CE2-CZ 3.9Å; Y54-F428 HydrophobicContact CE2-CZ 3.9Å; Y54-F428 AromaticContact CZ-CE1 3.75Å; Y54-F428 AromaticContact CZ-CZ 3.51Å; Y54-F428 WeakPolarHBondContact OH-CE1 3.43Å; Y54-H430 AromaticContact CE1-ND1 3.88Å; Y54-H430 AromaticContact CZ-ND1 3.77Å; Y54-H430 PolarHBondContact OH-ND1 3.06Å; Y54-A460 HydrophobicContact CD1-CB 4.05Å; Y54-A460 HydrophobicContact CE1-CB 4.02Å
55	E	91.1	Very high	85.8	Confident	57 Å²	57	51.1 Å²	51.1	27%	0.266	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	-38.1	163.3	-173.7	174.9	-178.9	0	0	110.8	L90 F92 R122 F123 K461	E55-L90 HydrophobicContact CG-CD2 4.35Å; E55-F92 HydrophobicContact CG-CE2 4.34Å; E55-F92 HydrophobicContact CG-CZ 4.23Å; E55-R122 HydrophobicContact CG-CG 4.41Å; E55-R122 WeakPolarHBondContact O-CG 3.19Å; E55-F123 PolarHBondContact O-N 2.89Å; E55-K461 HydrophobicContact CB-CB 4.32Å; E55-K461 HydrophobicContact CB-CG 3.89Å; E55-K461 PolarHBondContact N-O 3.4Å
56	M	92.2	Very high	84.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	139.4	177.5	-179.4	-173.2	66.9	0	0	109.2	F92 F94 L120 V448 V459 A460 K461	M56-F92 HydrophobicContact CB-CE1 4.1Å; M56-F92 HydrophobicContact CB-CZ 4.14Å; M56-F92 HydrophobicContact CG-CE1 4.16Å; M56-F92 HydrophobicContact SD-CE1 4Å; M56-F94 HydrophobicContact CE-CD1 3.72Å; M56-F94 HydrophobicContact CE-CE1 4.01Å; M56-F94 HydrophobicContact SD-CB 4.13Å; M56-F94 HydrophobicContact SD-CD1 3.67Å; M56-F94 HydrophobicContact SD-CG 4.25Å; M56-L120 HydrophobicContact SD-CB 3.87Å; M56-V448 HydrophobicContact CE-CG1 4.08Å; M56-V448 HydrophobicContact CE-CG2 4.29Å; M56-V459 HydrophobicContact CE-CG1 3.88Å; M56-A460 CarbonylContact O-C 3.57Å; M56-A460 VanDerWaalsContact O-CA 3.24Å; M56-A460 WeakPolarHBondContact O-CA 3.27Å; M56-K461 HydrophobicContact CB-CB 4.18Å; M56-K461 PolarHBondContact N-O 3.19Å; M56-K461 PolarHBondContact O-N 3.13Å
57	Y	92.7	Very high	83.8	Confident	10 Å²	10	50.5 Å²	50.5	4%	0.039	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	122.9	172.6	177.9	-136.6	0	0	0	111.2	F49 Y54 K59 F123 H430 D458 V459 A460	F49-Y57 HydrophobicContact CE2-CD1 4.16Å; F49-Y57 HydrophobicContact CZ-CD1 4.04Å; F49-Y57 HydrophobicContact CZ-CE1 4.34Å; Y54-Y57 HydrophobicContact CD1-CG 4.46Å; Y57-K59 HydrophobicContact CE1-CG 4.35Å; Y57-K59 HydrophobicContact CE2-CG 4.14Å; Y57-K59 VanDerWaalsContact CZ-CE 3.47Å; Y57-K59 WeakPolarHBondContact OH-CE 3.48Å; Y57-F123 HydrophobicContact CD1-CE2 4.46Å; Y57-H430 AromaticContact CE2-CE1 3.66Å; Y57-H430 AromaticContact CZ-CE1 3.99Å; Y57-D458 HydrophobicContact CE2-CB 3.89Å; Y57-D458 WeakPolarHBondContact CE2-OD2 3.25Å; Y57-D458 VanDerWaalsContact CZ-OD2 3.31Å; Y57-D458 PolarHBondContact OH-OD2 3.1Å; Y57-V459 CarbonylContact C-O 3.53Å; Y57-V459 WeakPolarHBondContact CA-O 3.39Å; Y57-A460 HydrophobicContact CD2-CB 4.05Å
58	H	92	Very high	83.2	Confident	24 Å²	24	53.5 Å²	53.5	11%	0.111	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	146.1	178	-69.2	-88.8	0	0	0	110.4	L120 N121 D458 V459	H58-L120 HydrophobicContact CB-CD2 4.27Å; H58-N121 PolarHBondContact NE2-N 3.38Å; H58-N121 PolarHBondContact NE2-O 2.54Å; H58-D458 WeakPolarHBondContact O-CA 3.48Å; H58-V459 PolarHBondContact N-O 3.01Å; H58-V459 PolarHBondContact O-N 3.32Å
59	K	91.4	Very high	82.8	Confident	43 Å²	43	49.8 Å²	49.8	19%	0.187	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	144.1	176.4	-59.8	-173.4	177.4	166.1	0	110.7	Y57 L131 E145 F457 D458	Y57-K59 HydrophobicContact CE1-CG 4.35Å; Y57-K59 HydrophobicContact CE2-CG 4.14Å; Y57-K59 VanDerWaalsContact CZ-CE 3.47Å; Y57-K59 WeakPolarHBondContact OH-CE 3.48Å; K59-L131 PolarHBondContact O-N 2.72Å; K59-E145 IonicContact NZ-OE1 3.97Å; K59-E145 IonicContact NZ-OE2 2.98Å; K59-E145 PolarHBondContact NZ-OE2 3.28Å; K59-F457 CarbonylContact C-O 3.49Å; K59-F457 WeakPolarHBondContact CA-O 3.38Å; K59-D458 WeakPolarHBondContact CG-OD1 3.43Å
60	F	90.4	Very high	82.5	Confident	4 Å²	4	49.3 Å²	49.3	2%	0.018	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	168.5	172.5	68.8	-85.7	0	0	0	112.2	L98 M115 L117 L131 F167 G456 F457 V459	F60-L98 HydrophobicContact CZ-CD1 4.07Å; F60-L98 HydrophobicContact CZ-CD2 4.24Å; F60-M115 HydrophobicContact CE2-CE 4.1Å; F60-M115 HydrophobicContact CE2-SD 3.85Å; F60-L117 HydrophobicContact CD1-CD2 3.97Å; F60-L117 HydrophobicContact CE1-CD2 3.75Å; F60-L117 HydrophobicContact CZ-CD1 4.38Å; F60-L117 HydrophobicContact CZ-CD2 4.4Å; F60-L131 VanDerWaalsContact CA-O 3.28Å; F60-L131 WeakPolarHBondContact CA-O 3.26Å; F60-L131 HydrophobicContact CB-CB 4.35Å; F60-F167 HydrophobicContact CB-CE2 3.66Å; F60-F167 HydrophobicContact CB-CZ 3.39Å; F60-F167 AromaticContact CD1-CZ 3.98Å; F60-F167 HydrophobicContact CD1-CZ 3.98Å; F60-F167 AromaticContact CD2-CE1 3.96Å; F60-F167 HydrophobicContact CD2-CE1 3.96Å; F60-F167 HydrophobicContact CD2-CE2 4.28Å; F60-F167 AromaticContact CD2-CZ 3.44Å; F60-F167 HydrophobicContact CD2-CZ 3.44Å; F60-F167 VanDerWaalsContact CD2-CZ 3.44Å; F60-F167 HydrophobicContact CE2-CE1 4.21Å; F60-F167 HydrophobicContact CE2-CZ 4.13Å; F60-F167 HydrophobicContact CG-CE1 4.2Å; F60-F167 HydrophobicContact CG-CE2 4.14Å; F60-F167 AromaticContact CG-CZ 3.35Å; F60-F167 HydrophobicContact CG-CZ 3.35Å; F60-G456 CarbonylContact O-C 3.58Å; F60-G456 WeakPolarHBondContact O-CA 3.49Å; F60-F457 HydrophobicContact CD1-CB 3.64Å; F60-F457 HydrophobicContact CD2-CB 3.97Å; F60-F457 HydrophobicContact CD2-CD2 4.02Å; F60-F457 HydrophobicContact CD2-CG 4.22Å; F60-F457 HydrophobicContact CE1-CB 3.24Å; F60-F457 HydrophobicContact CE1-CD1 4.44Å; F60-F457 AromaticContact CE1-CG 3.96Å; F60-F457 HydrophobicContact CE1-CG 3.96Å; F60-F457 HydrophobicContact CE2-CB 3.61Å; F60-F457 HydrophobicContact CE2-CD1 4.18Å; F60-F457 AromaticContact CE2-CD2 3.51Å; F60-F457 HydrophobicContact CE2-CD2 3.51Å; F60-F457 HydrophobicContact CE2-CE2 4.16Å; F60-F457 AromaticContact CE2-CG 3.53Å; F60-F457 HydrophobicContact CE2-CG 3.53Å; F60-F457 HydrophobicContact CG-CB 3.99Å; F60-F457 HydrophobicContact CZ-CB 3.23Å; F60-F457 AromaticContact CZ-CD1 3.75Å; F60-F457 HydrophobicContact CZ-CD1 3.75Å; F60-F457 AromaticContact CZ-CD2 3.9Å; F60-F457 HydrophobicContact CZ-CD2 3.9Å; F60-F457 AromaticContact CZ-CG 3.38Å; F60-F457 HydrophobicContact CZ-CG 3.38Å; F60-F457 PolarHBondContact N-O 2.97Å; F60-F457 PolarHBondContact O-N 3.46Å; F60-V459 HydrophobicContact CD1-CG2 4.34Å; F60-V459 HydrophobicContact CE1-CG2 3.71Å
61	H	87.1	Confident	82.6	Confident	22 Å²	22	45 Å²	45	10%	0.102	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	152.5	175.1	54.1	60	0	0	0	112.2	I70 L131 F132 I133	H61-I70 HydrophobicContact CB-CD1 4.46Å; H61-I70 HydrophobicContact CB-CG1 4.46Å; H61-I70 HydrophobicContact CB-CG2 4.32Å; H61-L131 PolarHBondContact N-O 2.75Å; H61-F132 VanDerWaalsContact CE1-CA 3.42Å; H61-F132 WeakPolarHBondContact CE1-CA 3.14Å; H61-F132 AromaticContact CE1-CD1 2.92Å; H61-F132 WeakPolarHBondContact CE1-CD1 3.14Å; H61-F132 AromaticContact CE1-CE1 3.48Å; H61-F132 VanDerWaalsContact CE1-CE1 3.48Å; H61-F132 WeakPolarHBondContact CE1-CE1 3.44Å; H61-F132 AromaticContact CE1-CG 3.28Å; H61-F132 WeakPolarHBondContact CE1-CG 3.11Å; H61-F132 AromaticContact NE2-CD1 3.03Å; H61-F132 WeakPolarHBondContact NE2-CD1 3.13Å; H61-F132 AromaticContact NE2-CD2 3.97Å; H61-F132 AromaticContact NE2-CE1 3.07Å; H61-F132 WeakPolarHBondContact NE2-CE1 3.35Å; H61-F132 AromaticContact NE2-CG 3.42Å; H61-F132 WeakPolarHBondContact NE2-CG 3.44Å; H61-F132 AromaticContact NE2-CZ 3.61Å; H61-I133 PolarHBondContact O-N 3.41Å
62	T	84.9	Confident	83.1	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	137.3	172.8	40.7	0	0	0	0	109.8	I70 Y71 I113 M115 F457	T62-I70 CarbonylContact O-C 3.52Å; T62-I70 WeakPolarHBondContact O-CA 3.39Å; T62-I70 WeakPolarHBondContact O-CG2 3.33Å; T62-Y71 PolarHBondContact O-N 2.78Å; T62-Y71 PolarHBondContact OG1-O 2.75Å; T62-I113 HydrophobicContact CG2-CD1 3.83Å; T62-M115 HydrophobicContact CG2-CE 4.24Å; T62-M115 HydrophobicContact CG2-SD 3.8Å; T62-F457 HydrophobicContact CG2-CE2 4.3Å
63	G	78.1	Confident	83.5	Confident	2 Å²	2	37.6 Å²	37.6	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.6	-160.2	179.9	0	0	0	0	0	115.1	Q69 I133 S134 L135	G63-Q69 CarbonylContact C-O 3.55Å; G63-Q69 WeakPolarHBondContact CA-O 3.37Å; G63-I133 CarbonylContact C-O 3.58Å; G63-I133 PolarHBondContact N-O 3.21Å; G63-S134 CarbonylContact O-C 3.53Å; G63-S134 VanDerWaalsContact O-CA 3.3Å; G63-S134 WeakPolarHBondContact O-CA 3.44Å; G63-L135 WeakPolarHBondContact O-CG 3.08Å; G63-L135 PolarHBondContact O-N 2.84Å
64	I	69.1	Low	83.8	Confident	14 Å²	14	38.4 Å²	38.4	7%	0.072	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	112.9	166.5	-62.7	179.6	0	0	0	106.9	E66 L67 L68 Q69 Y71 S136	I64-E66 VanDerWaalsContact C-N 3.34Å; I64-E66 HydrophobicContact CG2-CB 4.33Å; I64-E66 WeakPolarHBondContact CG2-OE2 3.28Å; I64-E66 PolarHBondContact O-N 3.24Å; I64-L67 HydrophobicContact CB-CB 4.33Å; I64-L67 HydrophobicContact CD1-CD1 4.23Å; I64-L67 HydrophobicContact CG2-CB 3.95Å; I64-L67 HydrophobicContact CG2-CD1 3.99Å; I64-L67 HydrophobicContact CG2-CG 3.8Å; I64-L67 PolarHBondContact O-N 2.76Å; I64-L68 PolarHBondContact O-N 2.72Å; I64-L68 VanDerWaalsContact O-N 3.16Å; I64-Q69 PolarHBondContact N-O 3.05Å; I64-Q69 PolarHBondContact O-N 3.44Å; I64-Y71 WeakPolarHBondContact CD1-OH 3.34Å; I64-Y71 HydrophobicContact CG1-CE2 4.4Å; I64-S136 WeakPolarHBondContact CG2-OG 3.4Å
65	I	65.5	Low	84.1	Confident	46 Å²	46	37.5 Å²	37.5	24%	0.236	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-61.3	-45.9	-177.2	-62.3	179.1	0	0	0	110.4	L67 L68 F132 I139	I65-L67 PolarHBondContact O-N 3.25Å; I65-L68 PolarHBondContact O-N 3.09Å; I65-F132 HydrophobicContact CD1-CB 3.48Å; I65-F132 VanDerWaalsContact CD1-CB 3.48Å; I65-F132 HydrophobicContact CG1-CB 3.77Å; I65-I139 WeakPolarHBondContact CD1-O 3.27Å
66	E	62.6	Low	84.5	Confident	95 Å²	95	34.8 Å²	34.8	44%	0.444	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-63.6	-19.9	-174.4	-59.7	83.2	177.7	0	0	113.1	I64 S134 T137	I64-E66 VanDerWaalsContact C-N 3.34Å; I64-E66 HydrophobicContact CG2-CB 4.33Å; I64-E66 WeakPolarHBondContact CG2-OE2 3.28Å; I64-E66 PolarHBondContact O-N 3.24Å; E66-S134 PolarHBondContact OE2-OG 3.02Å; E66-T137 VanDerWaalsContact OE1-CB 3.31Å; E66-T137 WeakPolarHBondContact OE1-CB 3.35Å; E66-T137 WeakPolarHBondContact OE1-CG2 3.24Å; E66-T137 PolarHBondContact OE1-OG1 2.89Å
67	L	67.4	Low	84.7	Confident	119 Å²	119	36.2 Å²	36.2	62%	0.623	18%	0.181	S	C	*	.	G	3₁₀ helix	trans	-111.5	2.6	-179.8	-60.7	179.4	0	0	0	112.8	I64 I65 Q69	I64-L67 HydrophobicContact CB-CB 4.33Å; I64-L67 HydrophobicContact CD1-CD1 4.23Å; I64-L67 HydrophobicContact CG2-CB 3.95Å; I64-L67 HydrophobicContact CG2-CD1 3.99Å; I64-L67 HydrophobicContact CG2-CG 3.8Å; I64-L67 PolarHBondContact O-N 2.76Å; I65-L67 PolarHBondContact O-N 3.25Å; L67-Q69 HydrophobicContact CB-CB 4.1Å; L67-Q69 PolarHBondContact O-N 2.86Å; L67-Q69 VanDerWaalsContact O-N 3.1Å
68	L	71.2	Confident	84.9	Confident	150 Å²	150	36.5 Å²	36.5	79%	0.785	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.9	35.4	-171.1	-62.7	171.9	0	0	0	112	I64 I65	I64-L68 PolarHBondContact O-N 2.72Å; I64-L68 VanDerWaalsContact O-N 3.16Å; I65-L68 PolarHBondContact O-N 3.09Å
69	Q	77.4	Confident	84.9	Confident	70 Å²	70	35.7 Å²	35.7	33%	0.327	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	104.8	-173.3	-167.6	179.4	4.3	0	0	109.8	G63 I64 L67 Y71	G63-Q69 CarbonylContact C-O 3.55Å; G63-Q69 WeakPolarHBondContact CA-O 3.37Å; I64-Q69 PolarHBondContact N-O 3.05Å; I64-Q69 PolarHBondContact O-N 3.44Å; L67-Q69 HydrophobicContact CB-CB 4.1Å; L67-Q69 PolarHBondContact O-N 2.86Å; L67-Q69 VanDerWaalsContact O-N 3.1Å; Q69-Y71 HydrophobicContact CB-CE1 4.43Å; Q69-Y71 HydrophobicContact CG-CD1 4.2Å; Q69-Y71 HydrophobicContact CG-CE1 3.75Å
70	I	80.3	Confident	84.6	Confident	63 Å²	63	34.9 Å²	34.9	32%	0.323	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	134.2	173.7	-60.5	173.5	0	0	0	109.1	H61 T62 P72	H61-I70 HydrophobicContact CB-CD1 4.46Å; H61-I70 HydrophobicContact CB-CG1 4.46Å; H61-I70 HydrophobicContact CB-CG2 4.32Å; T62-I70 CarbonylContact O-C 3.52Å; T62-I70 WeakPolarHBondContact O-CA 3.39Å; T62-I70 WeakPolarHBondContact O-CG2 3.33Å; I70-P72 WeakPolarHBondContact O-CD 3.19Å
71	Y	88.9	Confident	83.9	Confident	11 Å²	11	38.1 Å²	38.1	4%	0.043	19%	0.193	C	C	.	.			trans	-103.7	98.5	168.6	-67.3	-4.4	0	0	0	107	T62 I64 Q69 A104 K109 L135	T62-Y71 PolarHBondContact O-N 2.78Å; T62-Y71 PolarHBondContact OG1-O 2.75Å; I64-Y71 WeakPolarHBondContact CD1-OH 3.34Å; I64-Y71 HydrophobicContact CG1-CE2 4.4Å; Q69-Y71 HydrophobicContact CB-CE1 4.43Å; Q69-Y71 HydrophobicContact CG-CD1 4.2Å; Q69-Y71 HydrophobicContact CG-CE1 3.75Å; Y71-A104 HydrophobicContact CD1-CB 4.16Å; Y71-A104 HydrophobicContact CD2-CB 3.93Å; Y71-A104 HydrophobicContact CE1-CB 4.26Å; Y71-A104 HydrophobicContact CE2-CB 4.04Å; Y71-A104 HydrophobicContact CG-CB 4.03Å; Y71-K109 HydrophobicContact CE2-CB 4.31Å; Y71-L135 HydrophobicContact CD2-CD1 3.49Å; Y71-L135 VanDerWaalsContact CD2-CD1 3.49Å; Y71-L135 HydrophobicContact CE2-CD1 4.18Å; Y71-L135 HydrophobicContact CG-CD1 4.28Å
72	P	93.4	Very high	83.1	Confident	23 Å²	23	40.9 Å²	40.9	15%	0.149	21%	0.209	C	C	.	.			trans	-64	155	-178.1	29.6	-37.3	0	0	0	110.7	I70 T102 Q103 L454	I70-P72 WeakPolarHBondContact O-CD 3.19Å; P72-T102 CarbonylContact O-C 3.52Å; P72-Q103 WeakPolarHBondContact CD-O 3.48Å; P72-Q103 PolarHBondContact O-N 2.62Å; P72-L454 HydrophobicContact CB-CD1 4.15Å; P72-L454 HydrophobicContact CG-CD1 4Å
73	C	96.2	Very high	81.7	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	113	174.6	-65.7	0	0	0	0	108.2	S75 A100 G101 T452 F457	C73-S75 PolarHBondContact O-N 3.01Å; C73-A100 HydrophobicContact CB-CB 3.98Å; C73-G101 VanDerWaalsContact CA-O 3.32Å; C73-G101 WeakPolarHBondContact CA-O 3.31Å; C73-G101 WeakPolarHBondContact CB-O 3.48Å; C73-T452 WeakPolarHBondContact O-CG2 3.39Å; C73-T452 PolarHBondContact O-OG1 3.48Å; C73-F457 HydrophobicContact CB-CE2 3.96Å; C73-F457 HydrophobicContact CB-CZ 3.49Å; C73-F457 VanDerWaalsContact CB-CZ 3.49Å
74	L	96.5	Very high	80.8	Confident	35 Å²	35	49.2 Å²	49.2	18%	0.183	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	-30.8	176.3	-175.1	63.4	0	0	0	111	Q103 N179 F241 K437 E438	L74-Q103 HydrophobicContact CB-CG 4.24Å; L74-N179 HydrophobicContact CD2-CB 4.43Å; L74-N179 WeakPolarHBondContact CD2-O 3.3Å; L74-F241 HydrophobicContact CD2-CD1 3.92Å; L74-F241 HydrophobicContact CD2-CE1 3.67Å; L74-K437 HydrophobicContact CD1-CB 3.99Å; L74-K437 HydrophobicContact CD1-CD 3.83Å; L74-K437 HydrophobicContact CD1-CG 4.01Å; L74-E438 WeakPolarHBondContact O-CG 3.29Å
75	S	98.2	Very high	80.7	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	144	-177.3	-168.4	0	0	0	0	111.9	C73 G101 I181 E438	C73-S75 PolarHBondContact O-N 3.01Å; S75-G101 PolarHBondContact O-N 3.03Å; S75-G101 VanDerWaalsContact O-N 3.16Å; S75-I181 WeakPolarHBondContact O-CG2 3.31Å; S75-I181 PolarHBondContact OG-N 3.41Å; S75-I181 VanDerWaalsContact OG-N 3.16Å; S75-E438 WeakPolarHBondContact CA-OE2 2.92Å; S75-E438 WeakPolarHBondContact CB-OE1 3.19Å; S75-E438 PolarHBondContact OG-OE1 2.56Å; S75-E438 PolarHBondContact OG-OE2 2.76Å
76	F	98.3	Very high	81.3	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	166.5	175.6	78.1	-76	0	0	0	110.6	P78 L98 V99 A100 E438 H440 L450 T452 F457	F76-P78 HydrophobicContact CD2-CG 4.49Å; F76-P78 HydrophobicContact CE2-CG 3.96Å; F76-L98 HydrophobicContact CB-CD1 4.49Å; F76-L98 HydrophobicContact CD2-CB 4.42Å; F76-L98 HydrophobicContact CD2-CD1 3.68Å; F76-L98 HydrophobicContact CE2-CD1 4.32Å; F76-L98 HydrophobicContact CG-CD1 4.39Å; F76-V99 CarbonylContact C-O 3.58Å; F76-V99 WeakPolarHBondContact CA-O 3.35Å; F76-V99 VanDerWaalsContact CB-O 3.3Å; F76-V99 WeakPolarHBondContact CB-O 3.36Å; F76-A100 HydrophobicContact CB-CB 3.79Å; F76-E438 HydrophobicContact CD1-CB 4.18Å; F76-E438 HydrophobicContact CE1-CB 3.98Å; F76-E438 PolarHBondContact N-OE2 2.77Å; F76-E438 VanDerWaalsContact N-OE2 3.15Å; F76-H440 AromaticContact CD1-CD2 3.96Å; F76-H440 AromaticContact CE1-CD2 3.49Å; F76-H440 VanDerWaalsContact CE1-CD2 3.49Å; F76-H440 WeakPolarHBondContact CE1-CD2 3.28Å; F76-H440 HydrophobicContact CE2-CB 4.3Å; F76-H440 HydrophobicContact CZ-CB 4.08Å; F76-H440 AromaticContact CZ-CD2 3.52Å; F76-H440 PolarHBondContact O-CE1 2.95Å; F76-H440 PolarHBondContact O-NE2 3.09Å; F76-L450 HydrophobicContact CE2-CB 3.53Å; F76-L450 HydrophobicContact CE2-CD2 4.23Å; F76-L450 HydrophobicContact CE2-CG 4.47Å; F76-L450 HydrophobicContact CZ-CB 3.64Å; F76-T452 HydrophobicContact CD1-CG2 3.4Å; F76-T452 HydrophobicContact CE1-CG2 3.61Å; F76-F457 HydrophobicContact CB-CE1 3.98Å; F76-F457 HydrophobicContact CB-CZ 4.49Å; F76-F457 HydrophobicContact CD1-CE1 4.01Å; F76-F457 HydrophobicContact CD2-CE1 4.19Å; F76-F457 AromaticContact CG-CE1 3.8Å; F76-F457 HydrophobicContact CG-CE1 3.8Å
77	E	97.5	Very high	82.5	Confident	29 Å²	29	51 Å²	51	14%	0.136	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	128.2	167.3	-80.7	-160.4	160.2	0	0	110.8	L98 V99 R182 T183	E77-L98 CarbonylContact O-C 3.57Å; E77-L98 WeakPolarHBondContact O-CA 3.41Å; E77-L98 WeakPolarHBondContact O-CB 3.2Å; E77-V99 HydrophobicContact CB-CG1 4.34Å; E77-V99 PolarHBondContact N-O 3.01Å; E77-V99 PolarHBondContact O-N 2.83Å; E77-R182 WeakPolarHBondContact OE1-CD 3.33Å; E77-R182 IonicContact OE1-NE 3.19Å; E77-T183 WeakPolarHBondContact OE2-CA 3.43Å; E77-T183 VanDerWaalsContact OE2-CB 3.27Å; E77-T183 WeakPolarHBondContact OE2-CB 3.42Å; E77-T183 PolarHBondContact OE2-N 2.71Å; E77-T183 PolarHBondContact OE2-OG1 3.11Å
78	P	96.6	Very high	83.4	Confident	16 Å²	16	48.5 Å²	48.5	10%	0.104	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	143.4	163.4	-20	32.8	0	0	0	111	F76 S97 H440 P443 L450	F76-P78 HydrophobicContact CD2-CG 4.49Å; F76-P78 HydrophobicContact CE2-CG 3.96Å; P78-S97 CarbonylContact C-O 3.6Å; P78-S97 WeakPolarHBondContact CA-O 3.44Å; P78-H440 HydrophobicContact CG-CB 3.73Å; P78-P443 HydrophobicContact CB-CG 4.31Å; P78-L450 HydrophobicContact CB-CD1 4.37Å; P78-L450 HydrophobicContact CG-CD1 3.99Å
79	L	92.9	Very high	84.2	Confident	7 Å²	7	45.4 Å²	45.4	4%	0.037	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	144.2	-175.5	-63.2	178.4	0	0	0	111.4	F81 S97 V99 L114 T183 L190	L79-F81 HydrophobicContact CB-CE1 4.48Å; L79-F81 HydrophobicContact CD1-CE1 4.24Å; L79-S97 PolarHBondContact N-O 3.1Å; L79-V99 HydrophobicContact CD1-CB 4.11Å; L79-V99 HydrophobicContact CD1-CG1 4.36Å; L79-V99 HydrophobicContact CD2-CG1 4.32Å; L79-V99 HydrophobicContact CG-CG1 4.49Å; L79-L114 HydrophobicContact CD1-CD1 4.1Å; L79-L114 HydrophobicContact CD1-CG 4.16Å; L79-T183 HydrophobicContact CD2-CG2 3.88Å; L79-T183 WeakPolarHBondContact CD2-OG1 3.44Å; L79-L190 HydrophobicContact CD1-CD2 4.15Å; L79-L190 HydrophobicContact CD2-CD1 4.43Å
80	T	84	Confident	84.8	Confident	27 Å²	27	43.5 Å²	43.5	17%	0.166	26%	0.261	C	S	.	.			trans	-118	133.4	153.9	45.7	0	0	0	0	110.3	D82 Y185 P443 N444	T80-D82 PolarHBondContact O-N 2.84Å; T80-Y185 WeakPolarHBondContact O-CE2 3.42Å; T80-Y185 PolarHBondContact O-OH 3.38Å; T80-P443 HydrophobicContact CG2-CG 4.18Å; T80-N444 WeakPolarHBondContact CB-OD1 3.17Å; T80-N444 HydrophobicContact CG2-CB 3.79Å; T80-N444 WeakPolarHBondContact CG2-OD1 3.27Å; T80-N444 PolarHBondContact OG1-OD1 2.9Å
81	F	76.6	Confident	85.3	Confident	71 Å²	71	47 Å²	47	31%	0.311	28%	0.276	S	S	.	.	S	Bend	trans	-78.6	-10.4	178.8	-58.2	-53.1	0	0	0	113.1	L79 S97 L114 Y185 V210	L79-F81 HydrophobicContact CB-CE1 4.48Å; L79-F81 HydrophobicContact CD1-CE1 4.24Å; F81-S97 WeakPolarHBondContact CE2-OG 3.5Å; F81-L114 HydrophobicContact CE1-CD2 4.49Å; F81-L114 HydrophobicContact CZ-CD2 4.04Å; F81-Y185 WeakPolarHBondContact CA-OH 3.36Å; F81-V210 HydrophobicContact CD1-CG1 3.84Å; F81-V210 HydrophobicContact CD1-CG2 3.94Å; F81-V210 HydrophobicContact CE1-CB 4.35Å; F81-V210 HydrophobicContact CE1-CG1 3.9Å; F81-V210 HydrophobicContact CE1-CG2 3.55Å; F81-V210 HydrophobicContact CG-CG1 4.26Å; F81-V210 HydrophobicContact CZ-CG1 4.33Å; F81-V210 HydrophobicContact CZ-CG2 4.37Å
82	D	68.5	Low	85.3	Confident	80 Å²	80	49.7 Å²	49.7	43%	0.428	29%	0.288	S	S	.	.			trans	-116.3	96.8	169.8	179.8	5	0	0	0	109.1	T80 S84 S85	T80-D82 PolarHBondContact O-N 2.84Å; D82-S84 PolarHBondContact O-N 2.9Å; D82-S84 VanDerWaalsContact O-N 3.16Å; D82-S84 WeakPolarHBondContact OD1-CA 3.24Å; D82-S84 WeakPolarHBondContact OD1-CB 3.32Å; D82-S84 PolarHBondContact OD1-N 3.11Å; D82-S84 PolarHBondContact OD1-OG 3.04Å; D82-S85 WeakPolarHBondContact O-CB 3.31Å; D82-S85 PolarHBondContact O-N 2.96Å; D82-S85 PolarHBondContact OD1-N 3.03Å
83	A	56.1	Low	85.2	Confident	73 Å²	73	52.2 Å²	52.2	60%	0.603	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-16.5	177.2	0	0	0	0	0	113.2	Y185	A83-Y185 HydrophobicContact CB-CD2 3.87Å; A83-Y185 HydrophobicContact CB-CE2 4.21Å; A83-Y185 HydrophobicContact CB-CG 4.2Å
84	S	60	Low	85	Confident	105 Å²	105	52.4 Å²	52.4	73%	0.734	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-3.3	175.6	75.2	0	0	0	0	113.3	D82 S86	D82-S84 PolarHBondContact O-N 2.9Å; D82-S84 VanDerWaalsContact O-N 3.16Å; D82-S84 WeakPolarHBondContact OD1-CA 3.24Å; D82-S84 WeakPolarHBondContact OD1-CB 3.32Å; D82-S84 PolarHBondContact OD1-N 3.11Å; D82-S84 PolarHBondContact OD1-OG 3.04Å; S84-S86 PolarHBondContact O-N 3.06Å
85	S	66.2	Low	84.8	Confident	37 Å²	37	55.3 Å²	55.3	26%	0.259	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-59.6	129.6	-177.1	-167	0	0	0	0	110.1	D82 N444	D82-S85 WeakPolarHBondContact O-CB 3.31Å; D82-S85 PolarHBondContact O-N 2.96Å; D82-S85 PolarHBondContact OD1-N 3.03Å; S85-N444 PolarHBondContact O-ND2 3.45Å
86	S	79	Confident	84.5	Confident	91 Å²	91	55.4 Å²	55.4	64%	0.636	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-65.9	165.7	167	53.2	0	0	0	0	110.4	S84 Y88 N444	S84-S86 PolarHBondContact O-N 3.06Å; S86-Y88 PolarHBondContact O-N 2.96Å; S86-N444 PolarHBondContact O-ND2 2.85Å
87	T	86.3	Confident	84.4	Confident	64 Å²	64	55.7 Å²	55.7	39%	0.393	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-59.3	140.4	166	57.4	0	0	0	0	110.2	Y387 N444	T87-Y387 HydrophobicContact CG2-CD1 3.67Å; T87-Y387 HydrophobicContact CG2-CE1 3.2Å; T87-N444 CarbonylContact C-O 3.5Å; T87-N444 VanDerWaalsContact CA-O 3.27Å; T87-N444 WeakPolarHBondContact CA-O 3.41Å
88	Y	87.2	Confident	84.3	Confident	67 Å²	67	54.3 Å²	54.3	26%	0.263	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-124.7	151.9	175.7	55.7	-98.4	0	0	0	110.8	S86 F94 H442 N444 C445	S86-Y88 PolarHBondContact O-N 2.96Å; Y88-F94 HydrophobicContact CE2-CE2 4.08Å; Y88-H442 PolarHBondContact OH-CE1 2.96Å; Y88-N444 HydrophobicContact CD1-CB 3.89Å; Y88-N444 HydrophobicContact CE1-CB 3.41Å; Y88-N444 VanDerWaalsContact CE1-CB 3.41Å; Y88-N444 PolarHBondContact N-O 2.89Å; Y88-C445 HydrophobicContact CD2-CB 4.36Å; Y88-C445 HydrophobicContact CE2-CB 3.76Å
89	P	87.3	Confident	84.4	Confident	85 Å²	85	53.5 Å²	53.5	55%	0.552	31%	0.308	S	S	*	.			trans	-66.8	156.3	176.8	29.9	-35.1	0	0	0	110.9	E91	P89-E91 HydrophobicContact CG-CG 4.27Å; P89-E91 PolarHBondContact O-N 2.88Å
90	L	90.1	Very high	84.6	Confident	29 Å²	29	53.2 Å²	53.2	15%	0.152	31%	0.307	C	S	.	.			trans	-68.7	118.6	168.9	-179.2	61.2	0	0	0	108.8	E55 F92 F94 V448 K461	E55-L90 HydrophobicContact CG-CD2 4.35Å; L90-F92 HydrophobicContact CD1-CE1 4.34Å; L90-F92 HydrophobicContact CD1-CZ 4.39Å; L90-F92 HydrophobicContact CD2-CE1 4.36Å; L90-F92 HydrophobicContact CD2-CE2 4.31Å; L90-F92 HydrophobicContact CD2-CZ 3.7Å; L90-F92 HydrophobicContact CG-CE1 4.31Å; L90-F92 HydrophobicContact CG-CE2 4.26Å; L90-F92 HydrophobicContact CG-CZ 3.88Å; L90-F94 HydrophobicContact CD1-CB 3.77Å; L90-F94 HydrophobicContact CD1-CD1 4.09Å; L90-F94 HydrophobicContact CD1-CD2 3.47Å; L90-F94 VanDerWaalsContact CD1-CD2 3.47Å; L90-F94 HydrophobicContact CD1-CE2 4.05Å; L90-F94 HydrophobicContact CD1-CG 3.49Å; L90-F94 VanDerWaalsContact CD1-CG 3.49Å; L90-V448 HydrophobicContact CD1-CG2 4.14Å; L90-V448 HydrophobicContact CD2-CG2 4.49Å; L90-K461 HydrophobicContact CD2-CB 3.87Å; L90-K461 HydrophobicContact CD2-CD 4.46Å; L90-K461 HydrophobicContact CD2-CG 3.68Å
91	E	91.3	Very high	85.2	Confident	137 Å²	137	51.9 Å²	51.9	64%	0.64	30%	0.299	S	S	*	.			trans	-124.7	147.6	175.7	-68.8	-176.9	178	0	0	109.4	P89 P93 F94	P89-E91 HydrophobicContact CG-CG 4.27Å; P89-E91 PolarHBondContact O-N 2.88Å; E91-P93 CarbonylContact O-C 3.37Å; E91-F94 VanDerWaalsContact O-CA 3.27Å; E91-F94 WeakPolarHBondContact O-CA 3.43Å; E91-F94 WeakPolarHBondContact O-CB 3.47Å; E91-F94 PolarHBondContact O-N 2.56Å
92	F	89.6	Confident	86.2	Confident	68 Å²	68	48.5 Å²	48.5	30%	0.298	28%	0.284	S	S	.	.	S	Bend	trans	-109.7	138.1	-178.2	-63.2	-69.2	0	0	0	111	E55 M56 L90 F94 L120 R122	E55-F92 HydrophobicContact CG-CE2 4.34Å; E55-F92 HydrophobicContact CG-CZ 4.23Å; M56-F92 HydrophobicContact CB-CE1 4.1Å; M56-F92 HydrophobicContact CB-CZ 4.14Å; M56-F92 HydrophobicContact CG-CE1 4.16Å; M56-F92 HydrophobicContact SD-CE1 4Å; L90-F92 HydrophobicContact CD1-CE1 4.34Å; L90-F92 HydrophobicContact CD1-CZ 4.39Å; L90-F92 HydrophobicContact CD2-CE1 4.36Å; L90-F92 HydrophobicContact CD2-CE2 4.31Å; L90-F92 HydrophobicContact CD2-CZ 3.7Å; L90-F92 HydrophobicContact CG-CE1 4.31Å; L90-F92 HydrophobicContact CG-CE2 4.26Å; L90-F92 HydrophobicContact CG-CZ 3.88Å; F92-F94 HydrophobicContact CD1-CB 4.22Å; F92-F94 HydrophobicContact CE1-CB 4.36Å; F92-L120 VanDerWaalsContact CD1-O 3.25Å; F92-L120 WeakPolarHBondContact CD1-O 3.41Å; F92-R122 HydrophobicContact CD1-CB 4.26Å; F92-R122 HydrophobicContact CD2-CB 3.82Å; F92-R122 HydrophobicContact CD2-CG 4.45Å; F92-R122 HydrophobicContact CE1-CB 4.07Å; F92-R122 HydrophobicContact CE2-CB 3.63Å; F92-R122 HydrophobicContact CE2-CG 3.86Å; F92-R122 HydrophobicContact CG-CB 4.12Å; F92-R122 HydrophobicContact CZ-CB 3.74Å; F92-R122 HydrophobicContact CZ-CG 4.03Å
93	P	90.8	Very high	87.4	Confident	76 Å²	76	47.3 Å²	47.3	49%	0.494	28%	0.276	S	S	.	.	S	Bend	cis	-65.9	133.5	-4	24.9	-32.5	0	0	0	112.9	E91 N119	E91-P93 CarbonylContact O-C 3.37Å; P93-N119 WeakPolarHBondContact CB-OD1 3.31Å
94	F	92.1	Very high	89	Confident	4 Å²	4	44 Å²	44	2%	0.018	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	149.9	176.1	178.2	-114.6	0	0	0	109.9	M56 Y88 L90 E91 F92 C96 N119 L120 C445 V448	M56-F94 HydrophobicContact CE-CD1 3.72Å; M56-F94 HydrophobicContact CE-CE1 4.01Å; M56-F94 HydrophobicContact SD-CB 4.13Å; M56-F94 HydrophobicContact SD-CD1 3.67Å; M56-F94 HydrophobicContact SD-CG 4.25Å; Y88-F94 HydrophobicContact CE2-CE2 4.08Å; L90-F94 HydrophobicContact CD1-CB 3.77Å; L90-F94 HydrophobicContact CD1-CD1 4.09Å; L90-F94 HydrophobicContact CD1-CD2 3.47Å; L90-F94 VanDerWaalsContact CD1-CD2 3.47Å; L90-F94 HydrophobicContact CD1-CE2 4.05Å; L90-F94 HydrophobicContact CD1-CG 3.49Å; L90-F94 VanDerWaalsContact CD1-CG 3.49Å; E91-F94 VanDerWaalsContact O-CA 3.27Å; E91-F94 WeakPolarHBondContact O-CA 3.43Å; E91-F94 WeakPolarHBondContact O-CB 3.47Å; E91-F94 PolarHBondContact O-N 2.56Å; F92-F94 HydrophobicContact CD1-CB 4.22Å; F92-F94 HydrophobicContact CE1-CB 4.36Å; F94-C96 HydrophobicContact CE1-CB 3.73Å; F94-C96 HydrophobicContact CZ-CB 3.86Å; F94-N119 PolarHBondContact O-N 3.46Å; F94-L120 HydrophobicContact CB-CB 4.12Å; F94-L120 WeakPolarHBondContact CB-O 3.47Å; F94-L120 HydrophobicContact CD1-CB 4.2Å; F94-L120 HydrophobicContact CD1-CD1 3.83Å; F94-L120 HydrophobicContact CE1-CD1 4.3Å; F94-L120 PolarHBondContact N-O 2.91Å; F94-L120 VanDerWaalsContact O-CB 3.32Å; F94-L120 WeakPolarHBondContact O-CB 3.38Å; F94-L120 PolarHBondContact O-N 3.44Å; F94-C445 HydrophobicContact CE2-CB 4.03Å; F94-C445 HydrophobicContact CZ-CB 4.19Å; F94-V448 HydrophobicContact CE1-CG1 4.06Å; F94-V448 HydrophobicContact CE1-CG2 4.44Å; F94-V448 HydrophobicContact CZ-CG1 4.3Å; F94-V448 HydrophobicContact CZ-CG2 4.31Å
95	H	91.5	Very high	90.4	Very high	95 Å²	95	43.5 Å²	43.5	44%	0.44	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	143.2	174.1	56	-96.1	0	0	0	109.2	L117 Q118	H95-L117 VanDerWaalsContact CA-O 3.23Å; H95-L117 WeakPolarHBondContact CA-O 3.44Å; H95-L117 WeakPolarHBondContact CB-O 3.3Å; H95-Q118 VanDerWaalsContact CB-OE1 3.32Å
96	C	93.3	Very high	91.5	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.014	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	160.6	173.4	67.6	0	0	0	0	110.3	F94 Q116 L117	F94-C96 HydrophobicContact CE1-CB 3.73Å; F94-C96 HydrophobicContact CZ-CB 3.86Å; C96-Q116 CarbonylContact O-C 3.56Å; C96-Q116 WeakPolarHBondContact O-CA 3.48Å; C96-L117 PolarHBondContact N-O 2.83Å; C96-L117 VanDerWaalsContact N-O 3.09Å; C96-L117 PolarHBondContact O-N 3.26Å
97	S	94.8	Very high	92.1	Very high	6 Å²	6	47.4 Å²	47.4	4%	0.042	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	150.1	176.2	-61.4	0	0	0	0	109.4	P78 L79 F81 M115 Q116	P78-S97 CarbonylContact C-O 3.6Å; P78-S97 WeakPolarHBondContact CA-O 3.44Å; L79-S97 PolarHBondContact N-O 3.1Å; F81-S97 WeakPolarHBondContact CE2-OG 3.5Å; S97-M115 CarbonylContact C-O 3.53Å; S97-M115 VanDerWaalsContact CA-O 3.25Å; S97-M115 WeakPolarHBondContact CA-O 3.15Å; S97-Q116 WeakPolarHBondContact OG-CG 3.16Å
98	L	96.8	Very high	92.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	160.5	175.6	68.8	156.8	0	0	0	110.4	F60 F76 E77 M115 L117 L450 F457	F60-L98 HydrophobicContact CZ-CD1 4.07Å; F60-L98 HydrophobicContact CZ-CD2 4.24Å; F76-L98 HydrophobicContact CB-CD1 4.49Å; F76-L98 HydrophobicContact CD2-CB 4.42Å; F76-L98 HydrophobicContact CD2-CD1 3.68Å; F76-L98 HydrophobicContact CE2-CD1 4.32Å; F76-L98 HydrophobicContact CG-CD1 4.39Å; E77-L98 CarbonylContact O-C 3.57Å; E77-L98 WeakPolarHBondContact O-CA 3.41Å; E77-L98 WeakPolarHBondContact O-CB 3.2Å; L98-M115 HydrophobicContact CD1-CE 3.74Å; L98-M115 HydrophobicContact CD2-CB 3.87Å; L98-M115 HydrophobicContact CD2-CE 4.32Å; L98-M115 HydrophobicContact CG-CB 4.3Å; L98-M115 HydrophobicContact CG-CE 3.86Å; L98-M115 PolarHBondContact N-O 2.85Å; L98-M115 PolarHBondContact O-N 3.47Å; L98-L117 HydrophobicContact CD2-CD1 3.24Å; L98-L450 HydrophobicContact CD1-CD2 4.42Å; L98-F457 HydrophobicContact CD1-CD1 4.18Å; L98-F457 HydrophobicContact CD1-CE1 3.88Å
99	V	97.4	Very high	92.6	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	140.5	165.8	67.4	0	0	0	0	109.6	F76 E77 L79 I112 I113 I181 T183 L206	F76-V99 CarbonylContact C-O 3.58Å; F76-V99 WeakPolarHBondContact CA-O 3.35Å; F76-V99 VanDerWaalsContact CB-O 3.3Å; F76-V99 WeakPolarHBondContact CB-O 3.36Å; E77-V99 HydrophobicContact CB-CG1 4.34Å; E77-V99 PolarHBondContact N-O 3.01Å; E77-V99 PolarHBondContact O-N 2.83Å; L79-V99 HydrophobicContact CD1-CB 4.11Å; L79-V99 HydrophobicContact CD1-CG1 4.36Å; L79-V99 HydrophobicContact CD2-CG1 4.32Å; L79-V99 HydrophobicContact CG-CG1 4.49Å; V99-I112 HydrophobicContact CG2-CG2 3.52Å; V99-I113 CarbonylContact C-O 3.58Å; V99-I113 VanDerWaalsContact CA-O 3.26Å; V99-I113 WeakPolarHBondContact CA-O 3.08Å; V99-I113 WeakPolarHBondContact CG2-O 3.47Å; V99-I181 HydrophobicContact CB-CD1 4.5Å; V99-I181 HydrophobicContact CG1-CD1 4.11Å; V99-I181 HydrophobicContact CG2-CD1 3.71Å; V99-T183 HydrophobicContact CG1-CG2 3.4Å; V99-T183 VanDerWaalsContact CG1-CG2 3.4Å; V99-L206 HydrophobicContact CB-CD1 4.34Å; V99-L206 HydrophobicContact CG1-CD1 4.5Å; V99-L206 HydrophobicContact CG2-CD1 3.89Å
100	A	97.9	Very high	92.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	152	177.5	0	0	0	0	0	111.4	C73 F76 I113 M115 F457	C73-A100 HydrophobicContact CB-CB 3.98Å; F76-A100 HydrophobicContact CB-CB 3.79Å; A100-I113 PolarHBondContact N-O 2.92Å; A100-I113 PolarHBondContact O-N 3.09Å; A100-M115 HydrophobicContact CB-CE 3.79Å; A100-F457 HydrophobicContact CB-CE1 4.49Å; A100-F457 HydrophobicContact CB-CZ 3.86Å
101	G	97.2	Very high	93.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	126.7	171	0	0	0	0	0	110.9	C73 S75 I178	C73-G101 VanDerWaalsContact CA-O 3.32Å; C73-G101 WeakPolarHBondContact CA-O 3.31Å; C73-G101 WeakPolarHBondContact CB-O 3.48Å; S75-G101 PolarHBondContact O-N 3.03Å; S75-G101 VanDerWaalsContact O-N 3.16Å; G101-I178 VanDerWaalsContact CA-CD1 3.47Å
102	T	95.8	Very high	93.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	159	-178.9	63.2	0	0	0	0	113	P72 N110 A111 I113 L135 I178	P72-T102 CarbonylContact O-C 3.52Å; T102-N110 PolarHBondContact O-OD1 2.76Å; T102-N110 WeakPolarHBondContact OG1-CA 3.34Å; T102-N110 PolarHBondContact OG1-OD1 3.43Å; T102-A111 PolarHBondContact N-O 3.26Å; T102-A111 VanDerWaalsContact N-O 3.16Å; T102-A111 PolarHBondContact OG1-N 2.85Å; T102-A111 PolarHBondContact OG1-O 3.11Å; T102-I113 HydrophobicContact CG2-CD1 3.3Å; T102-I113 HydrophobicContact CG2-CG1 4.14Å; T102-L135 HydrophobicContact CG2-CD1 4.24Å; T102-I178 PolarHBondContact O-N 2.59Å
103	Q	93.6	Very high	93.8	Very high	54 Å²	54	36.2 Å²	36.2	25%	0.252	20%	0.203	S	C	.	.			trans	-124.8	87.2	163	-59.5	-163.2	-36.3	0	0	110.2	P72 L74 N110 D177 N179	P72-Q103 WeakPolarHBondContact CD-O 3.48Å; P72-Q103 PolarHBondContact O-N 2.62Å; L74-Q103 HydrophobicContact CB-CG 4.24Å; Q103-N110 VanDerWaalsContact CA-OD1 3.31Å; Q103-N110 WeakPolarHBondContact CA-OD1 3.37Å; Q103-N110 PolarHBondContact N-OD1 2.75Å; Q103-D177 HydrophobicContact CB-CB 4.31Å; Q103-D177 HydrophobicContact CG-CB 3.97Å; Q103-N179 PolarHBondContact NE2-OD1 3.04Å
104	A	91.2	Very high	94	Very high	5 Å²	5	32.7 Å²	32.7	4%	0.041	18%	0.18	C	C	.	.			trans	-90	147	179.4	0	0	0	0	0	110.6	Y71 K106 K109 N110	Y71-A104 HydrophobicContact CD1-CB 4.16Å; Y71-A104 HydrophobicContact CD2-CB 3.93Å; Y71-A104 HydrophobicContact CE1-CB 4.26Å; Y71-A104 HydrophobicContact CE2-CB 4.04Å; Y71-A104 HydrophobicContact CG-CB 4.03Å; A104-K106 PolarHBondContact O-N 3.13Å; A104-K109 HydrophobicContact CB-CB 3.75Å; A104-N110 PolarHBondContact N-OD1 3.06Å
105	A	88.3	Confident	94.1	Very high	93 Å²	93	32.5 Å²	32.5	77%	0.769	18%	0.18	S	C	*	.	S	Bend	trans	-57	-17.1	-179.8	0	0	0	0	0	115.3
106	K	90.8	Very high	94.1	Very high	139 Å²	139	29.3 Å²	29.3	60%	0.604	17%	0.165	S	C	*	.	S	Bend	trans	-117.7	129.8	174.3	-68.8	-177.2	-178.7	177.4	0	109.3	A104 T108 K109	A104-K106 PolarHBondContact O-N 3.13Å; K106-T108 PolarHBondContact O-N 3.01Å; K106-K109 HydrophobicContact CB-CB 4.33Å; K106-K109 HydrophobicContact CB-CG 3.95Å; K106-K109 WeakPolarHBondContact O-CB 3.27Å; K106-K109 PolarHBondContact O-N 3.32Å
107	P	91.5	Very high	94.1	Very high	71 Å²	71	29.4 Å²	29.4	46%	0.461	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-54.9	-28.5	-179.3	-29.7	35.3	0	0	0	114.9	K109 H175 G176	P107-K109 VanDerWaalsContact C-N 3.29Å; P107-K109 PolarHBondContact O-N 3.21Å; P107-H175 WeakPolarHBondContact O-CA 3.37Å; P107-G176 PolarHBondContact O-N 3.39Å
108	T	92	Very high	93.9	Very high	100 Å²	100	30.6 Å²	30.6	61%	0.613	17%	0.17	S	C	*	.	G	3₁₀ helix	trans	-84.2	0.8	-179.9	63.4	0	0	0	0	114.1	K106	K106-T108 PolarHBondContact O-N 3.01Å
109	K	91.6	Very high	93.5	Very high	107 Å²	107	31.4 Å²	31.4	47%	0.465	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-106.7	1.7	-179.1	-68.7	-64	-171.8	175.8	0	112.7	Y71 A104 K106 P107	Y71-K109 HydrophobicContact CE2-CB 4.31Å; A104-K109 HydrophobicContact CB-CB 3.75Å; K106-K109 HydrophobicContact CB-CB 4.33Å; K106-K109 HydrophobicContact CB-CG 3.95Å; K106-K109 WeakPolarHBondContact O-CB 3.27Å; K106-K109 PolarHBondContact O-N 3.32Å; P107-K109 VanDerWaalsContact C-N 3.29Å; P107-K109 PolarHBondContact O-N 3.21Å
110	N	93.9	Very high	93.2	Very high	3 Å²	3	31.6 Å²	31.6	2%	0.016	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	153.4	175.7	-73.9	-56.8	0	0	0	111.9	T102 Q103 A104 H174 G176 D177	T102-N110 PolarHBondContact O-OD1 2.76Å; T102-N110 WeakPolarHBondContact OG1-CA 3.34Å; T102-N110 PolarHBondContact OG1-OD1 3.43Å; Q103-N110 VanDerWaalsContact CA-OD1 3.31Å; Q103-N110 WeakPolarHBondContact CA-OD1 3.37Å; Q103-N110 PolarHBondContact N-OD1 2.75Å; A104-N110 PolarHBondContact N-OD1 3.06Å; N110-H174 CarbonylContact C-O 3.51Å; N110-H174 HydrophobicContact CB-CB 4.37Å; N110-H174 WeakPolarHBondContact CB-O 3.49Å; N110-H174 PolarHBondContact O-N 3.22Å; N110-G176 VanDerWaalsContact CB-O 3.22Å; N110-G176 WeakPolarHBondContact CB-O 3.48Å; N110-G176 PolarHBondContact ND2-O 2.81Å; N110-D177 PolarHBondContact ND2-N 2.93Å; N110-D177 PolarHBondContact ND2-OD1 3.23Å
111	A	95.6	Very high	92.8	Very high	4 Å²	4	33.5 Å²	33.5	3%	0.033	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	154.2	176.3	0	0	0	0	0	111	T102 I113 Q171 I172 I178	T102-A111 PolarHBondContact N-O 3.26Å; T102-A111 VanDerWaalsContact N-O 3.16Å; T102-A111 PolarHBondContact OG1-N 2.85Å; T102-A111 PolarHBondContact OG1-O 3.11Å; A111-I113 HydrophobicContact CB-CG1 4.09Å; A111-Q171 HydrophobicContact CB-CB 4.19Å; A111-I172 CarbonylContact C-O 3.54Å; A111-I172 VanDerWaalsContact CA-O 3.27Å; A111-I172 WeakPolarHBondContact CA-O 3.43Å; A111-I178 WeakPolarHBondContact O-CD1 3.23Å
112	I	97.5	Very high	92.3	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	125	156.8	-57.7	165	0	0	0	106	V99 Q171 I172 I178 I181 T194 W204 L206	V99-I112 HydrophobicContact CG2-CG2 3.52Å; I112-Q171 CarbonylContact O-C 3.6Å; I112-Q171 VanDerWaalsContact O-CA 3.23Å; I112-Q171 WeakPolarHBondContact O-CA 3.39Å; I112-I172 HydrophobicContact CB-CB 4.41Å; I112-I172 PolarHBondContact N-O 2.94Å; I112-I172 PolarHBondContact O-N 3.19Å; I112-I178 HydrophobicContact CG1-CD1 3.78Å; I112-I181 HydrophobicContact CG2-CD1 3.93Å; I112-T194 HydrophobicContact CD1-CG2 3.61Å; I112-T194 HydrophobicContact CG1-CG2 3.81Å; I112-W204 HydrophobicContact CD1-CB 4.24Å; I112-W204 VanDerWaalsContact CD1-CD1 3.43Å; I112-W204 HydrophobicContact CD1-CD2 3.53Å; I112-W204 HydrophobicContact CD1-CE3 4.23Å; I112-W204 HydrophobicContact CD1-CG 3.49Å; I112-W204 VanDerWaalsContact CD1-CG 3.49Å; I112-W204 HydrophobicContact CD1-CZ2 4.29Å; I112-L206 HydrophobicContact CG2-CD2 4.17Å
113	I	95.4	Very high	91	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	119.3	-177.1	-50.4	164.3	0	0	0	108.3	T62 V99 A100 T102 A111 M115 L135 Q171	T62-I113 HydrophobicContact CG2-CD1 3.83Å; V99-I113 CarbonylContact C-O 3.58Å; V99-I113 VanDerWaalsContact CA-O 3.26Å; V99-I113 WeakPolarHBondContact CA-O 3.08Å; V99-I113 WeakPolarHBondContact CG2-O 3.47Å; A100-I113 PolarHBondContact N-O 2.92Å; A100-I113 PolarHBondContact O-N 3.09Å; T102-I113 HydrophobicContact CG2-CD1 3.3Å; T102-I113 HydrophobicContact CG2-CG1 4.14Å; A111-I113 HydrophobicContact CB-CG1 4.09Å; I113-M115 HydrophobicContact CG2-CG 3.6Å; I113-M115 HydrophobicContact CG2-SD 4.17Å; I113-L135 HydrophobicContact CD1-CD1 3.72Å; I113-L135 HydrophobicContact CD1-CD2 3.47Å; I113-L135 VanDerWaalsContact CD1-CD2 3.47Å; I113-L135 HydrophobicContact CD1-CG 4.23Å; I113-L135 HydrophobicContact CG1-CD2 4.06Å; I113-L135 HydrophobicContact CG2-CD2 4.44Å; I113-Q171 HydrophobicContact CG1-CB 4.31Å
114	L	95.6	Very high	89.3	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	125.7	166.4	-158.8	154.9	0	0	0	107.9	L79 F81 C169 A170 L206 A209 V210 I213	L79-L114 HydrophobicContact CD1-CD1 4.1Å; L79-L114 HydrophobicContact CD1-CG 4.16Å; F81-L114 HydrophobicContact CE1-CD2 4.49Å; F81-L114 HydrophobicContact CZ-CD2 4.04Å; L114-C169 WeakPolarHBondContact O-CA 3.44Å; L114-A170 PolarHBondContact N-O 3.1Å; L114-A170 PolarHBondContact O-N 2.96Å; L114-L206 HydrophobicContact CD1-CB 4.43Å; L114-A209 HydrophobicContact CB-CB 4.37Å; L114-A209 HydrophobicContact CD1-CB 4.15Å; L114-V210 HydrophobicContact CD1-CG2 3.76Å; L114-I213 HydrophobicContact CB-CD1 4.08Å; L114-I213 HydrophobicContact CD2-CD1 3.25Å; L114-I213 HydrophobicContact CG-CD1 4.2Å; L114-I213 WeakPolarHBondContact O-CD1 3.42Å
115	M	93.9	Very high	87.3	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	133.3	-177.1	-61.2	177	-80.1	0	0	109.2	F60 T62 S97 L98 A100 I113 L117 I133 F167 F457	F60-M115 HydrophobicContact CE2-CE 4.1Å; F60-M115 HydrophobicContact CE2-SD 3.85Å; T62-M115 HydrophobicContact CG2-CE 4.24Å; T62-M115 HydrophobicContact CG2-SD 3.8Å; S97-M115 CarbonylContact C-O 3.53Å; S97-M115 VanDerWaalsContact CA-O 3.25Å; S97-M115 WeakPolarHBondContact CA-O 3.15Å; L98-M115 HydrophobicContact CD1-CE 3.74Å; L98-M115 HydrophobicContact CD2-CB 3.87Å; L98-M115 HydrophobicContact CD2-CE 4.32Å; L98-M115 HydrophobicContact CG-CB 4.3Å; L98-M115 HydrophobicContact CG-CE 3.86Å; L98-M115 PolarHBondContact N-O 2.85Å; L98-M115 PolarHBondContact O-N 3.47Å; A100-M115 HydrophobicContact CB-CE 3.79Å; I113-M115 HydrophobicContact CG2-CG 3.6Å; I113-M115 HydrophobicContact CG2-SD 4.17Å; M115-L117 HydrophobicContact CB-CD1 4.41Å; M115-I133 HydrophobicContact CG-CD1 4.44Å; M115-I133 HydrophobicContact SD-CD1 3.86Å; M115-F167 HydrophobicContact CB-CD1 4.43Å; M115-F457 HydrophobicContact CE-CZ 4.31Å
116	Q	92.8	Very high	85.2	Confident	28 Å²	28	55 Å²	55	13%	0.131	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	114.1	167.8	-174.9	177.3	47.6	0	0	108.2	C96 S97 Q118 F167 K168 I213	C96-Q116 CarbonylContact O-C 3.56Å; C96-Q116 WeakPolarHBondContact O-CA 3.48Å; S97-Q116 WeakPolarHBondContact OG-CG 3.16Å; Q116-Q118 HydrophobicContact CG-CG 4.28Å; Q116-Q118 VanDerWaalsContact OE1-NE2 3.17Å; Q116-F167 WeakPolarHBondContact O-CA 3.47Å; Q116-K168 HydrophobicContact CB-CB 4.38Å; Q116-K168 PolarHBondContact N-O 3.31Å; Q116-K168 PolarHBondContact O-N 3.05Å; Q116-I213 HydrophobicContact CB-CG2 3.98Å; Q116-I213 VanDerWaalsContact OE1-CG2 3.29Å
117	L	91.8	Very high	83.2	Confident	3 Å²	3	56 Å²	56	2%	0.016	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	130.1	174.1	-72.6	74	0	0	0	108.2	F60 H95 C96 L98 M115 L120 F167 V459	F60-L117 HydrophobicContact CD1-CD2 3.97Å; F60-L117 HydrophobicContact CE1-CD2 3.75Å; F60-L117 HydrophobicContact CZ-CD1 4.38Å; F60-L117 HydrophobicContact CZ-CD2 4.4Å; H95-L117 VanDerWaalsContact CA-O 3.23Å; H95-L117 WeakPolarHBondContact CA-O 3.44Å; H95-L117 WeakPolarHBondContact CB-O 3.3Å; C96-L117 PolarHBondContact N-O 2.83Å; C96-L117 VanDerWaalsContact N-O 3.09Å; C96-L117 PolarHBondContact O-N 3.26Å; L98-L117 HydrophobicContact CD2-CD1 3.24Å; M115-L117 HydrophobicContact CB-CD1 4.41Å; L117-L120 HydrophobicContact CB-CD1 3.82Å; L117-L120 HydrophobicContact CB-CD2 4.12Å; L117-L120 HydrophobicContact CB-CG 4.1Å; L117-L120 HydrophobicContact CD2-CD1 3.93Å; L117-L120 HydrophobicContact CD2-CD2 4.17Å; L117-F167 HydrophobicContact CB-CE1 4.45Å; L117-F167 HydrophobicContact CD1-CD1 4.09Å; L117-F167 HydrophobicContact CD1-CE1 3.41Å; L117-F167 VanDerWaalsContact CD1-CE1 3.41Å; L117-F167 HydrophobicContact CD1-CZ 4.31Å; L117-F167 HydrophobicContact CD2-CE1 4.08Å; L117-F167 HydrophobicContact CD2-CZ 4.21Å; L117-F167 HydrophobicContact CG-CD1 4Å; L117-F167 HydrophobicContact CG-CE1 3.31Å; L117-F167 HydrophobicContact CG-CZ 3.87Å; L117-V459 HydrophobicContact CD2-CG2 3.81Å
118	Q	90.4	Very high	81.2	Confident	31 Å²	31	53.8 Å²	53.8	15%	0.145	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	155.3	-178.7	-64.4	-72.8	1.2	0	0	109.6	H95 Q116 L120 P165 Y166	H95-Q118 VanDerWaalsContact CB-OE1 3.32Å; Q116-Q118 HydrophobicContact CG-CG 4.28Å; Q116-Q118 VanDerWaalsContact OE1-NE2 3.17Å; Q118-L120 VanDerWaalsContact C-N 3.27Å; Q118-L120 PolarHBondContact O-N 3.22Å; Q118-P165 WeakPolarHBondContact O-CA 3.22Å; Q118-Y166 HydrophobicContact CB-CD1 3.94Å; Q118-Y166 HydrophobicContact CB-CD2 3.95Å; Q118-Y166 HydrophobicContact CB-CE1 3.49Å; Q118-Y166 VanDerWaalsContact CB-CE1 3.49Å; Q118-Y166 HydrophobicContact CB-CE2 3.5Å; Q118-Y166 VanDerWaalsContact CB-CE2 3.5Å; Q118-Y166 HydrophobicContact CB-CG 4.14Å; Q118-Y166 HydrophobicContact CG-CD2 4.31Å; Q118-Y166 HydrophobicContact CG-CE1 4.43Å; Q118-Y166 HydrophobicContact CG-CE2 3.62Å; Q118-Y166 PolarHBondContact N-O 3.16Å; Q118-Y166 PolarHBondContact O-N 3.06Å; Q118-Y166 VanDerWaalsContact O-N 3.1Å
119	N	90	Very high	79.4	Confident	17 Å²	17	50.4 Å²	50.4	9%	0.091	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	60.7	34.8	173.8	-153	19.4	0	0	0	113.9	P93 F94 N121 N162 N163 E164 Y166	P93-N119 WeakPolarHBondContact CB-OD1 3.31Å; F94-N119 PolarHBondContact O-N 3.46Å; N119-N121 PolarHBondContact O-N 2.84Å; N119-N121 VanDerWaalsContact O-N 3.08Å; N119-N121 PolarHBondContact O-ND2 3.38Å; N119-N121 VanDerWaalsContact O-ND2 3.15Å; N119-N121 PolarHBondContact OD1-ND2 3.28Å; N119-N162 PolarHBondContact ND2-O 2.85Å; N119-N163 WeakPolarHBondContact ND2-CA 3.02Å; N119-N163 PolarHBondContact ND2-O 3.31Å; N119-E164 WeakPolarHBondContact CB-O 3.4Å; N119-E164 PolarHBondContact ND2-N 2.76Å; N119-E164 PolarHBondContact ND2-O 3.44Å; N119-Y166 HydrophobicContact CB-CD1 4.11Å; N119-Y166 HydrophobicContact CB-CE1 4.04Å
120	L	90.7	Very high	77.8	Confident	4 Å²	4	46.5 Å²	46.5	2%	0.021	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	99.4	174.6	-56.3	-175.1	0	0	0	108.2	M56 H58 F92 F94 L117 Q118 P165 V459	M56-L120 HydrophobicContact SD-CB 3.87Å; H58-L120 HydrophobicContact CB-CD2 4.27Å; F92-L120 VanDerWaalsContact CD1-O 3.25Å; F92-L120 WeakPolarHBondContact CD1-O 3.41Å; F94-L120 HydrophobicContact CB-CB 4.12Å; F94-L120 WeakPolarHBondContact CB-O 3.47Å; F94-L120 HydrophobicContact CD1-CB 4.2Å; F94-L120 HydrophobicContact CD1-CD1 3.83Å; F94-L120 HydrophobicContact CE1-CD1 4.3Å; F94-L120 PolarHBondContact N-O 2.91Å; F94-L120 VanDerWaalsContact O-CB 3.32Å; F94-L120 WeakPolarHBondContact O-CB 3.38Å; F94-L120 PolarHBondContact O-N 3.44Å; L117-L120 HydrophobicContact CB-CD1 3.82Å; L117-L120 HydrophobicContact CB-CD2 4.12Å; L117-L120 HydrophobicContact CB-CG 4.1Å; L117-L120 HydrophobicContact CD2-CD1 3.93Å; L117-L120 HydrophobicContact CD2-CD2 4.17Å; Q118-L120 VanDerWaalsContact C-N 3.27Å; Q118-L120 PolarHBondContact O-N 3.22Å; L120-P165 HydrophobicContact CD2-CB 3.99Å; L120-V459 HydrophobicContact CD1-CG1 4.31Å
121	N	88.8	Confident	76.2	Confident	41 Å²	41	46.9 Å²	46.9	22%	0.219	21%	0.214	C	C	.	.			trans	-88.1	161.6	-176.6	-75.6	-59.6	0	0	0	112.4	H58 N119 N163	H58-N121 PolarHBondContact NE2-N 3.38Å; H58-N121 PolarHBondContact NE2-O 2.54Å; N119-N121 PolarHBondContact O-N 2.84Å; N119-N121 VanDerWaalsContact O-N 3.08Å; N119-N121 PolarHBondContact O-ND2 3.38Å; N119-N121 VanDerWaalsContact O-ND2 3.15Å; N119-N121 PolarHBondContact OD1-ND2 3.28Å; N121-N163 PolarHBondContact ND2-O 3.03Å; N121-N163 VanDerWaalsContact ND2-O 3.09Å
122	R	86.1	Confident	74.3	Confident	161 Å²	161	49.2 Å²	49.2	61%	0.608	22%	0.223	S	C	*	.			trans	-52.9	144.2	171.8	-166.3	-179.5	-179.5	172.6	2.6	108.4	E55 F92 S124	E55-R122 HydrophobicContact CG-CG 4.41Å; E55-R122 WeakPolarHBondContact O-CG 3.19Å; F92-R122 HydrophobicContact CD1-CB 4.26Å; F92-R122 HydrophobicContact CD2-CB 3.82Å; F92-R122 HydrophobicContact CD2-CG 4.45Å; F92-R122 HydrophobicContact CE1-CB 4.07Å; F92-R122 HydrophobicContact CE2-CB 3.63Å; F92-R122 HydrophobicContact CE2-CG 3.86Å; F92-R122 HydrophobicContact CG-CB 4.12Å; F92-R122 HydrophobicContact CZ-CB 3.74Å; F92-R122 HydrophobicContact CZ-CG 4.03Å; R122-S124 VanDerWaalsContact C-N 3.28Å; R122-S124 PolarHBondContact O-N 2.98Å
123	F	70.1	Confident	72.6	Confident	28 Å²	28	49.1 Å²	49.1	12%	0.123	22%	0.223	C	C	.	.			trans	-63.6	93.8	172.2	-159.7	-84.7	0	0	0	109.1	F49 K51 E55 Y57	F49-F123 HydrophobicContact CE2-CE1 4.47Å; F49-F123 HydrophobicContact CE2-CE2 4.26Å; F49-F123 AromaticContact CE2-CZ 4Å; F49-F123 HydrophobicContact CE2-CZ 4Å; F49-F123 HydrophobicContact CZ-CE1 4.39Å; F49-F123 AromaticContact CZ-CE2 3.87Å; F49-F123 HydrophobicContact CZ-CE2 3.87Å; F49-F123 AromaticContact CZ-CZ 3.57Å; F49-F123 HydrophobicContact CZ-CZ 3.57Å; K51-F123 HydrophobicContact CB-CD1 4.06Å; K51-F123 HydrophobicContact CB-CE1 3.65Å; K51-F123 HydrophobicContact CD-CE1 3.57Å; K51-F123 HydrophobicContact CD-CZ 4.15Å; K51-F123 HydrophobicContact CG-CD1 4.29Å; K51-F123 HydrophobicContact CG-CE1 3.39Å; K51-F123 HydrophobicContact CG-CZ 3.91Å; E55-F123 PolarHBondContact O-N 2.89Å; Y57-F123 HydrophobicContact CD1-CE2 4.46Å
124	S	56.7	Low	71.2	Confident	73 Å²	73	49.1 Å²	49.1	51%	0.51	22%	0.223	S	C	.	.			trans	-80.4	163.2	173.5	-177.8	0	0	0	0	108.5	R122 R126	R122-S124 VanDerWaalsContact C-N 3.28Å; R122-S124 PolarHBondContact O-N 2.98Å; S124-R126 PolarHBondContact O-N 2.87Å; S124-R126 VanDerWaalsContact O-O 3.09Å
125	K	50.1	Low	69.7	Low	202 Å²	202	49.7 Å²	49.7	88%	0.878	23%	0.226	S	C	*	.	S	Bend	trans	-55.1	-14.3	175.2	-73.4	-177.3	176.8	-177.9	0	112.9
126	R	43	Very low	68.1	Low	140 Å²	140	53 Å²	53	53%	0.528	25%	0.248	S	C	.	.	S	Bend	trans	-83.1	132.3	175.7	-64.8	-176.8	173.4	-171.6	-5.1	112.5	S124 F156	S124-R126 PolarHBondContact O-N 2.87Å; S124-R126 VanDerWaalsContact O-O 3.09Å; R126-F156 PolarHBondContact NH2-O 3.3Å; R126-F156 VanDerWaalsContact NH2-O 3.13Å
127	R	49.6	Very low	66.5	Low	159 Å²	159	55 Å²	55	60%	0.6	26%	0.263	S	S	*	.			trans	12.4	131.3	167.1	-59.7	-174.7	179.9	165.1	5.2	119.7	V129 D144	R127-V129 PolarHBondContact O-N 3.48Å; R127-D144 VanDerWaalsContact CD-CG 3.5Å; R127-D144 WeakPolarHBondContact CD-OD2 3.49Å; R127-D144 IonicContact CZ-OD2 3.46Å; R127-D144 IonicContact NE-OD2 3.61Å; R127-D144 IonicContact NH1-OD2 2.74Å; R127-D144 PolarHBondContact NH1-OD2 2.86Å
128	A	49.3	Very low	64.8	Low	24 Å²	24	55.2 Å²	55.2	20%	0.198	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-73.5	120.5	161.3	0	0	0	0	0	108.8
129	V	55	Low	63.4	Low	29 Å²	29	58.3 Å²	58.3	18%	0.176	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	125.3	177.1	-177.9	0	0	0	0	108.3	R127 L131 P165	R127-V129 PolarHBondContact O-N 3.48Å; V129-L131 HydrophobicContact CG1-CD1 4.39Å; V129-P165 HydrophobicContact CB-CG 4.07Å; V129-P165 HydrophobicContact CG1-CG 4.03Å
130	I	57.3	Low	62	Low	26 Å²	26	59.3 Å²	59.3	13%	0.133	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	128.1	166.3	-61.6	169.9	0	0	0	107.6	F132 S142 G143 E145	I130-F132 HydrophobicContact CB-CD2 4.5Å; I130-F132 HydrophobicContact CB-CE2 3.77Å; I130-F132 HydrophobicContact CB-CZ 4.31Å; I130-F132 HydrophobicContact CG2-CD2 3.89Å; I130-F132 HydrophobicContact CG2-CE2 3.37Å; I130-F132 HydrophobicContact CG2-CZ 3.69Å; I130-S142 CarbonylContact O-C 3.36Å; I130-S142 WeakPolarHBondContact O-CA 3.21Å; I130-G143 PolarHBondContact N-O 2.92Å; I130-G143 PolarHBondContact O-N 2.85Å; I130-E145 HydrophobicContact CD1-CG 3.17Å; I130-E145 WeakPolarHBondContact CD1-OE1 3.31Å; I130-E145 HydrophobicContact CG1-CG 3.65Å
131	L	61.2	Low	60.4	Low	11 Å²	11	60.4 Å²	60.4	6%	0.058	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	141.5	163.9	-86	112	0	0	0	113.8	K59 F60 H61 V129 G141 P165 F167	K59-L131 PolarHBondContact O-N 2.72Å; F60-L131 VanDerWaalsContact CA-O 3.28Å; F60-L131 WeakPolarHBondContact CA-O 3.26Å; F60-L131 HydrophobicContact CB-CB 4.35Å; H61-L131 PolarHBondContact N-O 2.75Å; V129-L131 HydrophobicContact CG1-CD1 4.39Å; L131-G141 CarbonylContact C-O 3.48Å; L131-G141 WeakPolarHBondContact CA-O 3.28Å; L131-P165 HydrophobicContact CD1-CB 3.51Å; L131-P165 HydrophobicContact CD1-CG 3.54Å; L131-P165 WeakPolarHBondContact CD1-O 3.31Å; L131-P165 WeakPolarHBondContact CD2-O 3.46Å; L131-F167 HydrophobicContact CB-CD2 3.82Å; L131-F167 HydrophobicContact CB-CE2 3.31Å; L131-F167 HydrophobicContact CB-CZ 4.4Å; L131-F167 HydrophobicContact CD1-CE2 4.44Å; L131-F167 HydrophobicContact CD2-CD2 3.49Å; L131-F167 VanDerWaalsContact CD2-CD2 3.49Å; L131-F167 HydrophobicContact CD2-CE2 3.84Å; L131-F167 HydrophobicContact CG-CD2 4.23Å; L131-F167 HydrophobicContact CG-CE2 4.07Å
132	F	53.9	Low	59.2	Low	53 Å²	53	61.3 Å²	61.3	23%	0.232	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	135.3	179.4	-61.3	-110.3	0	0	0	109.3	H61 I65 I130 T140 G141	H61-F132 VanDerWaalsContact CE1-CA 3.42Å; H61-F132 WeakPolarHBondContact CE1-CA 3.14Å; H61-F132 AromaticContact CE1-CD1 2.92Å; H61-F132 WeakPolarHBondContact CE1-CD1 3.14Å; H61-F132 AromaticContact CE1-CE1 3.48Å; H61-F132 VanDerWaalsContact CE1-CE1 3.48Å; H61-F132 WeakPolarHBondContact CE1-CE1 3.44Å; H61-F132 AromaticContact CE1-CG 3.28Å; H61-F132 WeakPolarHBondContact CE1-CG 3.11Å; H61-F132 AromaticContact NE2-CD1 3.03Å; H61-F132 WeakPolarHBondContact NE2-CD1 3.13Å; H61-F132 AromaticContact NE2-CD2 3.97Å; H61-F132 AromaticContact NE2-CE1 3.07Å; H61-F132 WeakPolarHBondContact NE2-CE1 3.35Å; H61-F132 AromaticContact NE2-CG 3.42Å; H61-F132 WeakPolarHBondContact NE2-CG 3.44Å; H61-F132 AromaticContact NE2-CZ 3.61Å; I65-F132 HydrophobicContact CD1-CB 3.48Å; I65-F132 VanDerWaalsContact CD1-CB 3.48Å; I65-F132 HydrophobicContact CG1-CB 3.77Å; I130-F132 HydrophobicContact CB-CD2 4.5Å; I130-F132 HydrophobicContact CB-CE2 3.77Å; I130-F132 HydrophobicContact CB-CZ 4.31Å; I130-F132 HydrophobicContact CG2-CD2 3.89Å; I130-F132 HydrophobicContact CG2-CE2 3.37Å; I130-F132 HydrophobicContact CG2-CZ 3.69Å; F132-T140 CarbonylContact O-C 3.56Å; F132-T140 VanDerWaalsContact O-CA 3.29Å; F132-T140 WeakPolarHBondContact O-CA 3.37Å; F132-G141 PolarHBondContact N-O 2.99Å; F132-G141 PolarHBondContact O-N 2.89Å
133	I	61.8	Low	57.7	Low	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	121.9	169.8	-59.3	160.5	0	0	0	109	H61 G63 M115 L135 F167 V222	H61-I133 PolarHBondContact O-N 3.41Å; G63-I133 CarbonylContact C-O 3.58Å; G63-I133 PolarHBondContact N-O 3.21Å; M115-I133 HydrophobicContact CG-CD1 4.44Å; M115-I133 HydrophobicContact SD-CD1 3.86Å; I133-L135 HydrophobicContact CG2-CD2 4.25Å; I133-F167 HydrophobicContact CD1-CB 4.32Å; I133-F167 HydrophobicContact CD1-CD1 3.75Å; I133-F167 HydrophobicContact CD1-CD2 3.69Å; I133-F167 HydrophobicContact CD1-CE1 3.87Å; I133-F167 HydrophobicContact CD1-CE2 3.85Å; I133-F167 HydrophobicContact CD1-CG 3.67Å; I133-F167 HydrophobicContact CD1-CZ 4.02Å; I133-F167 HydrophobicContact CG1-CB 4.26Å; I133-F167 HydrophobicContact CG1-CD1 4.44Å; I133-F167 HydrophobicContact CG1-CD2 3.54Å; I133-F167 HydrophobicContact CG1-CE2 3.97Å; I133-F167 HydrophobicContact CG1-CG 3.85Å; I133-V222 HydrophobicContact CG2-CG2 3.43Å; I133-V222 VanDerWaalsContact CG2-CG2 3.43Å
134	S	67.2	Low	57.1	Low	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	109.3	169.7	-170.1	0	0	0	0	111.3	G63 E66 S136 T137 G138 I139	G63-S134 CarbonylContact O-C 3.53Å; G63-S134 VanDerWaalsContact O-CA 3.3Å; G63-S134 WeakPolarHBondContact O-CA 3.44Å; E66-S134 PolarHBondContact OE2-OG 3.02Å; S134-S136 PolarHBondContact O-N 2.86Å; S134-S136 PolarHBondContact OG-OG 3.42Å; S134-T137 WeakPolarHBondContact CB-OG1 3.44Å; S134-T137 PolarHBondContact OG-N 3.41Å; S134-T137 PolarHBondContact OG-OG1 3.48Å; S134-G138 CarbonylContact O-C 3.57Å; S134-G138 WeakPolarHBondContact O-CA 3.5Å; S134-G138 PolarHBondContact O-N 2.82Å; S134-I139 WeakPolarHBondContact CB-O 3.47Å; S134-I139 PolarHBondContact N-O 3.45Å
135	L	64.5	Low	56.9	Low	14 Å²	14	58.9 Å²	58.9	7%	0.073	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-18.6	177.4	-61	173	0	0	0	113.2	G63 Y71 T102 I113 I133 Q171	G63-L135 WeakPolarHBondContact O-CG 3.08Å; G63-L135 PolarHBondContact O-N 2.84Å; Y71-L135 HydrophobicContact CD2-CD1 3.49Å; Y71-L135 VanDerWaalsContact CD2-CD1 3.49Å; Y71-L135 HydrophobicContact CE2-CD1 4.18Å; Y71-L135 HydrophobicContact CG-CD1 4.28Å; T102-L135 HydrophobicContact CG2-CD1 4.24Å; I113-L135 HydrophobicContact CD1-CD1 3.72Å; I113-L135 HydrophobicContact CD1-CD2 3.47Å; I113-L135 VanDerWaalsContact CD1-CD2 3.47Å; I113-L135 HydrophobicContact CD1-CG 4.23Å; I113-L135 HydrophobicContact CG1-CD2 4.06Å; I113-L135 HydrophobicContact CG2-CD2 4.44Å; I133-L135 HydrophobicContact CG2-CD2 4.25Å; L135-Q171 PolarHBondContact O-NE2 2.91Å
136	S	59.8	Low	56.4	Low	68 Å²	68	52.9 Å²	52.9	48%	0.476	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-36.6	177.7	55	0	0	0	0	114.1	I64 S134	I64-S136 WeakPolarHBondContact CG2-OG 3.4Å; S134-S136 PolarHBondContact O-N 2.86Å; S134-S136 PolarHBondContact OG-OG 3.42Å
137	T	58.2	Low	56.1	Low	71 Å²	71	50 Å²	50	44%	0.436	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-12.9	-175.4	59.5	0	0	0	0	112.7	E66 S134 I139	E66-T137 VanDerWaalsContact OE1-CB 3.31Å; E66-T137 WeakPolarHBondContact OE1-CB 3.35Å; E66-T137 WeakPolarHBondContact OE1-CG2 3.24Å; E66-T137 PolarHBondContact OE1-OG1 2.89Å; S134-T137 WeakPolarHBondContact CB-OG1 3.44Å; S134-T137 PolarHBondContact OG-N 3.41Å; S134-T137 PolarHBondContact OG-OG1 3.48Å; T137-I139 PolarHBondContact O-N 3.24Å; T137-I139 PolarHBondContact OG1-N 3.26Å
138	G	58	Low	55.1	Low	7 Å²	7	47.9 Å²	47.9	7%	0.072	30%	0.303	C	S	.	.			trans	80.7	-17.2	-172.3	0	0	0	0	0	113.5	S134 T140 G221 V222	S134-G138 CarbonylContact O-C 3.57Å; S134-G138 WeakPolarHBondContact O-CA 3.5Å; S134-G138 PolarHBondContact O-N 2.82Å; G138-T140 PolarHBondContact O-N 3.44Å; G138-G221 CarbonylContact O-C 3.59Å; G138-G221 WeakPolarHBondContact O-CA 3.49Å; G138-V222 VanDerWaalsContact CA-N 3.25Å; G138-V222 PolarHBondContact O-N 2.79Å
139	I	59.2	Low	54.5	Low	97 Å²	97	52.4 Å²	52.4	50%	0.497	33%	0.333	S	S	.	.			trans	-62	128.5	-169.5	-61.2	171.7	0	0	0	110.5	I65 S134 T137	I65-I139 WeakPolarHBondContact CD1-O 3.27Å; S134-I139 WeakPolarHBondContact CB-O 3.47Å; S134-I139 PolarHBondContact N-O 3.45Å; T137-I139 PolarHBondContact O-N 3.24Å; T137-I139 PolarHBondContact OG1-N 3.26Å
140	T	61	Low	53.4	Low	38 Å²	38	60 Å²	60	23%	0.233	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	145.5	165.9	50.8	0	0	0	0	108.7	F132 G138 F167	F132-T140 CarbonylContact O-C 3.56Å; F132-T140 VanDerWaalsContact O-CA 3.29Å; F132-T140 WeakPolarHBondContact O-CA 3.37Å; G138-T140 PolarHBondContact O-N 3.44Å; T140-F167 HydrophobicContact CG2-CB 3.91Å
141	G	58.7	Low	52.4	Low	26 Å²	26	67.2 Å²	67.2	27%	0.268	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	152.3	174.3	0	0	0	0	0	111.1	L131 F132	L131-G141 CarbonylContact C-O 3.48Å; L131-G141 WeakPolarHBondContact CA-O 3.28Å; F132-G141 PolarHBondContact N-O 2.99Å; F132-G141 PolarHBondContact O-N 2.89Å
142	S	62.4	Low	51.3	Low	60 Å²	60	74.4 Å²	74.4	42%	0.42	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	150.2	171.5	54.4	0	0	0	0	110	I130 E164	I130-S142 CarbonylContact O-C 3.36Å; I130-S142 WeakPolarHBondContact O-CA 3.21Å; S142-E164 PolarHBondContact OG-OE2 2.86Å
143	G	55.3	Low	50.2	Low	26 Å²	26	81.6 Å²	81.6	27%	0.268	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	151.5	175	0	0	0	0	0	112	I130	I130-G143 PolarHBondContact N-O 2.92Å; I130-G143 PolarHBondContact O-N 2.85Å
144	D	56	Low	49	Very low	81 Å²	81	88.7 Å²	88.7	43%	0.433	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	132.3	-178.3	-73.3	-27.2	0	0	0	111.8	R127 S146	R127-D144 VanDerWaalsContact CD-CG 3.5Å; R127-D144 WeakPolarHBondContact CD-OD2 3.49Å; R127-D144 IonicContact CZ-OD2 3.46Å; R127-D144 IonicContact NE-OD2 3.61Å; R127-D144 IonicContact NH1-OD2 2.74Å; R127-D144 PolarHBondContact NH1-OD2 2.86Å; D144-S146 VanDerWaalsContact C-N 3.3Å; D144-S146 PolarHBondContact O-N 2.87Å
145	E	52.9	Low	47.2	Very low	104 Å²	104	94.1 Å²	94.1	49%	0.486	54%	0.544	S	S	.	.			trans	-79.1	-3.1	172.7	-77.1	-146.8	132.9	0	0	114.2	K59 I130 S147	K59-E145 IonicContact NZ-OE1 3.97Å; K59-E145 IonicContact NZ-OE2 2.98Å; K59-E145 PolarHBondContact NZ-OE2 3.28Å; I130-E145 HydrophobicContact CD1-CG 3.17Å; I130-E145 WeakPolarHBondContact CD1-OE1 3.31Å; I130-E145 HydrophobicContact CG1-CG 3.65Å; E145-S147 PolarHBondContact O-N 3.4Å
146	S	40.7	Very low	45.8	Very low	76 Å²	76	99.8 Å²	99.8	53%	0.531	57%	0.568	S	S	.	*			trans	-78.2	95.5	-171.9	59.5	0	0	0	0	113	D144	D144-S146 VanDerWaalsContact C-N 3.3Å; D144-S146 PolarHBondContact O-N 2.87Å
147	S	35.5	Very low	44.6	Very low	80 Å²	80	105.5 Å²	105.5	56%	0.559	59%	0.587	S	S	*	*			trans	-83.1	108.1	159.1	77.1	0	0	0	0	110.6	E145	E145-S147 PolarHBondContact O-N 3.4Å
148	S	29.8	Very low	43.9	Very low	115 Å²	115	108.2 Å²	108.2	80%	0.804	60%	0.599	S	S	*	*			trans	30.6	102.5	155.3	67.8	0	0	0	0	119.5
149	S	36.2	Very low	43.1	Very low	119 Å²	119	115.9 Å²	115.9	83%	0.832	64%	0.638	S	S	*	*			trans	-156.1	126.8	134.3	56.6	0	0	0	0	108
150	E	32.4	Very low	42.7	Very low	187 Å²	187	115.5 Å²	115.5	87%	0.874	64%	0.637	S	S	*	*			trans	-69.4	173.2	-175.5	-59.8	-177.4	169.2	0	0	112.1
151	E	35.1	Very low	42.3	Very low	178 Å²	178	122.3 Å²	122.3	83%	0.832	67%	0.666	S	S	*	*			trans	93.7	79	176.3	-52.4	178.4	-161.5	0	0	116
152	D	38.7	Very low	42.4	Very low	163 Å²	163	127.1 Å²	127.1	87%	0.872	69%	0.686	S	S	*	*				173.5	88.2	122.5	-85.2	-21.1	0	0	0	109.1	E154	D152-E154 PolarHBondContact O-N 3.38Å
153	E	31.3	Very low	42.9	Very low	203 Å²	203	128.6 Å²	128.6	95%	0.949	69%	0.689	S	S	*	*			trans	-78.8	87.3	170.2	-70.2	-170.6	175.4	0	0	110.1
154	E	36.7	Very low	44.1	Very low	149 Å²	149	132.3 Å²	132.3	70%	0.696	70%	0.699	S	S	*	*			trans	-98.8	108.1	151.3	-72.4	-148.3	169.9	0	0	109.4	D152 F156	D152-E154 PolarHBondContact O-N 3.38Å; E154-F156 HydrophobicContact CB-CD2 4.12Å; E154-F156 HydrophobicContact CB-CE2 3.65Å; E154-F156 PolarHBondContact O-N 3.12Å; E154-F156 WeakPolarHBondContact OE2-CE2 3.45Å; E154-F156 WeakPolarHBondContact OE2-CZ 3.43Å
155	S	29.6	Very low	45.6	Very low	115 Å²	115	128.9 Å²	128.9	80%	0.804	68%	0.681	S	S	*	*			trans	-62.2	99.3	171.8	55.6	0	0	0	0	110.2
156	F	35.3	Very low	47.1	Very low	132 Å²	132	126.6 Å²	126.6	58%	0.579	67%	0.669	S	S	*	*			trans	-108	102.3	160	-65.3	-83.2	0	0	0	107.8	R126 E154 D158	R126-F156 PolarHBondContact NH2-O 3.3Å; R126-F156 VanDerWaalsContact NH2-O 3.13Å; E154-F156 HydrophobicContact CB-CD2 4.12Å; E154-F156 HydrophobicContact CB-CE2 3.65Å; E154-F156 PolarHBondContact O-N 3.12Å; E154-F156 WeakPolarHBondContact OE2-CE2 3.45Å; E154-F156 WeakPolarHBondContact OE2-CZ 3.43Å; F156-D158 PolarHBondContact O-N 3.15Å; F156-D158 VanDerWaalsContact O-N 3.09Å
157	E	34.4	Very low	49.2	Very low	188 Å²	188	123.1 Å²	123.1	88%	0.879	64%	0.644	S	S	*	*			trans	-59.8	96.4	162.6	-65.9	178.6	171.7	0	0	108.2
158	D	42.2	Very low	51.8	Low	128 Å²	128	120.8 Å²	120.8	68%	0.684	62%	0.624	S	S	*	*			trans	-152.7	78.5	157.4	-89	-33	0	0	0	106	F156 D160	F156-D158 PolarHBondContact O-N 3.15Å; F156-D158 VanDerWaalsContact O-N 3.09Å; D158-D160 PolarHBondContact O-N 3.04Å
159	D	41.3	Very low	54.8	Low	168 Å²	168	115.3 Å²	115.3	90%	0.898	59%	0.586	S	S	*	*			trans	-72.6	67.7	167.4	-79.5	-33.1	0	0	0	109.5	E161	D159-E161 PolarHBondContact O-N 3.29Å
160	D	52.1	Low	57.5	Low	89 Å²	89	109.7 Å²	109.7	48%	0.476	55%	0.547	S	S	.	.			trans	-92.6	88.3	165.5	-106.2	-32.9	0	0	0	108.7	D158 N162 N163	D158-D160 PolarHBondContact O-N 3.04Å; D160-N162 PolarHBondContact O-N 3.35Å; D160-N163 PolarHBondContact O-N 2.87Å; D160-N163 VanDerWaalsContact O-N 3.1Å
161	E	52	Low	60.5	Low	182 Å²	182	101.7 Å²	101.7	85%	0.85	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-48.1	-19.1	163.1	-73.2	-179.4	161.1	0	0	111.7	D159 N163	D159-E161 PolarHBondContact O-N 3.29Å; E161-N163 VanDerWaalsContact C-N 3.29Å; E161-N163 PolarHBondContact O-N 2.71Å
162	N	60.3	Low	63.4	Low	126 Å²	126	93.3 Å²	93.3	67%	0.674	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-72.1	-5.7	177.8	-72.9	-41.5	0	0	0	116	N119 D160	N119-N162 PolarHBondContact ND2-O 2.85Å; D160-N162 PolarHBondContact O-N 3.35Å
163	N	73.5	Confident	66.1	Low	91 Å²	91	89.1 Å²	89.1	49%	0.487	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-100.6	1.8	-175.9	-74.1	-29.8	0	0	0	114.9	N119 N121 D160 E161	N119-N163 WeakPolarHBondContact ND2-CA 3.02Å; N119-N163 PolarHBondContact ND2-O 3.31Å; N121-N163 PolarHBondContact ND2-O 3.03Å; N121-N163 VanDerWaalsContact ND2-O 3.09Å; D160-N163 PolarHBondContact O-N 2.87Å; D160-N163 VanDerWaalsContact O-N 3.1Å; E161-N163 VanDerWaalsContact C-N 3.29Å; E161-N163 PolarHBondContact O-N 2.71Å
164	E	79.9	Confident	69.2	Low	104 Å²	104	79.8 Å²	79.8	49%	0.486	41%	0.408	S	S	.	.	S	Bend	trans	-71.9	134.7	177.2	-68.6	-164.1	-177.6	0	0	112	N119 S142	N119-E164 WeakPolarHBondContact CB-O 3.4Å; N119-E164 PolarHBondContact ND2-N 2.76Å; N119-E164 PolarHBondContact ND2-O 3.44Å; S142-E164 PolarHBondContact OG-OE2 2.86Å
165	P	86.8	Confident	72	Confident	9 Å²	9	78.3 Å²	78.3	6%	0.058	40%	0.401	C	S	.	.			trans	-61.3	145.8	171.4	21	-24.8	0	0	0	110.4	Q118 L120 V129 L131	Q118-P165 WeakPolarHBondContact O-CA 3.22Å; L120-P165 HydrophobicContact CD2-CB 3.99Å; V129-P165 HydrophobicContact CB-CG 4.07Å; V129-P165 HydrophobicContact CG1-CG 4.03Å; L131-P165 HydrophobicContact CD1-CB 3.51Å; L131-P165 HydrophobicContact CD1-CG 3.54Å; L131-P165 WeakPolarHBondContact CD1-O 3.31Å; L131-P165 WeakPolarHBondContact CD2-O 3.46Å
166	Y	85.7	Confident	75.1	Confident	57 Å²	57	73 Å²	73	22%	0.224	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	167.7	178.8	69.1	-89.5	0	0	0	112.7	Q118 N119 K168 I218	Q118-Y166 HydrophobicContact CB-CD1 3.94Å; Q118-Y166 HydrophobicContact CB-CD2 3.95Å; Q118-Y166 HydrophobicContact CB-CE1 3.49Å; Q118-Y166 VanDerWaalsContact CB-CE1 3.49Å; Q118-Y166 HydrophobicContact CB-CE2 3.5Å; Q118-Y166 VanDerWaalsContact CB-CE2 3.5Å; Q118-Y166 HydrophobicContact CB-CG 4.14Å; Q118-Y166 HydrophobicContact CG-CD2 4.31Å; Q118-Y166 HydrophobicContact CG-CE1 4.43Å; Q118-Y166 HydrophobicContact CG-CE2 3.62Å; Q118-Y166 PolarHBondContact N-O 3.16Å; Q118-Y166 PolarHBondContact O-N 3.06Å; Q118-Y166 VanDerWaalsContact O-N 3.1Å; N119-Y166 HydrophobicContact CB-CD1 4.11Å; N119-Y166 HydrophobicContact CB-CE1 4.04Å; Y166-K168 HydrophobicContact CE2-CG 4.35Å; Y166-I218 HydrophobicContact CD2-CG1 4.45Å; Y166-I218 HydrophobicContact CD2-CG2 3.89Å; Y166-I218 HydrophobicContact CE1-CD1 4.42Å; Y166-I218 HydrophobicContact CE2-CB 4.46Å; Y166-I218 HydrophobicContact CE2-CD1 4.46Å; Y166-I218 HydrophobicContact CE2-CG1 3.88Å; Y166-I218 HydrophobicContact CE2-CG2 4.17Å; Y166-I218 HydrophobicContact CG-CG2 4.08Å
167	F	84.6	Confident	78	Confident	3 Å²	3	69.1 Å²	69.1	1%	0.013	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	145.2	-179.7	-77.5	-74.5	0	0	0	112.6	F60 M115 Q116 L117 L131 I133 T140	F60-F167 HydrophobicContact CB-CE2 3.66Å; F60-F167 HydrophobicContact CB-CZ 3.39Å; F60-F167 AromaticContact CD1-CZ 3.98Å; F60-F167 HydrophobicContact CD1-CZ 3.98Å; F60-F167 AromaticContact CD2-CE1 3.96Å; F60-F167 HydrophobicContact CD2-CE1 3.96Å; F60-F167 HydrophobicContact CD2-CE2 4.28Å; F60-F167 AromaticContact CD2-CZ 3.44Å; F60-F167 HydrophobicContact CD2-CZ 3.44Å; F60-F167 VanDerWaalsContact CD2-CZ 3.44Å; F60-F167 HydrophobicContact CE2-CE1 4.21Å; F60-F167 HydrophobicContact CE2-CZ 4.13Å; F60-F167 HydrophobicContact CG-CE1 4.2Å; F60-F167 HydrophobicContact CG-CE2 4.14Å; F60-F167 AromaticContact CG-CZ 3.35Å; F60-F167 HydrophobicContact CG-CZ 3.35Å; M115-F167 HydrophobicContact CB-CD1 4.43Å; Q116-F167 WeakPolarHBondContact O-CA 3.47Å; L117-F167 HydrophobicContact CB-CE1 4.45Å; L117-F167 HydrophobicContact CD1-CD1 4.09Å; L117-F167 HydrophobicContact CD1-CE1 3.41Å; L117-F167 VanDerWaalsContact CD1-CE1 3.41Å; L117-F167 HydrophobicContact CD1-CZ 4.31Å; L117-F167 HydrophobicContact CD2-CE1 4.08Å; L117-F167 HydrophobicContact CD2-CZ 4.21Å; L117-F167 HydrophobicContact CG-CD1 4Å; L117-F167 HydrophobicContact CG-CE1 3.31Å; L117-F167 HydrophobicContact CG-CZ 3.87Å; L131-F167 HydrophobicContact CB-CD2 3.82Å; L131-F167 HydrophobicContact CB-CE2 3.31Å; L131-F167 HydrophobicContact CB-CZ 4.4Å; L131-F167 HydrophobicContact CD1-CE2 4.44Å; L131-F167 HydrophobicContact CD2-CD2 3.49Å; L131-F167 VanDerWaalsContact CD2-CD2 3.49Å; L131-F167 HydrophobicContact CD2-CE2 3.84Å; L131-F167 HydrophobicContact CG-CD2 4.23Å; L131-F167 HydrophobicContact CG-CE2 4.07Å; I133-F167 HydrophobicContact CD1-CB 4.32Å; I133-F167 HydrophobicContact CD1-CD1 3.75Å; I133-F167 HydrophobicContact CD1-CD2 3.69Å; I133-F167 HydrophobicContact CD1-CE1 3.87Å; I133-F167 HydrophobicContact CD1-CE2 3.85Å; I133-F167 HydrophobicContact CD1-CG 3.67Å; I133-F167 HydrophobicContact CD1-CZ 4.02Å; I133-F167 HydrophobicContact CG1-CB 4.26Å; I133-F167 HydrophobicContact CG1-CD1 4.44Å; I133-F167 HydrophobicContact CG1-CD2 3.54Å; I133-F167 HydrophobicContact CG1-CE2 3.97Å; I133-F167 HydrophobicContact CG1-CG 3.85Å; T140-F167 HydrophobicContact CG2-CB 3.91Å
168	K	90	Very high	81	Confident	31 Å²	31	60.1 Å²	60.1	14%	0.135	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	132.1	152.8	-60.5	-176.9	-179.7	-165.2	0	108.5	Q116 Y166 I213 M216	Q116-K168 HydrophobicContact CB-CB 4.38Å; Q116-K168 PolarHBondContact N-O 3.31Å; Q116-K168 PolarHBondContact O-N 3.05Å; Y166-K168 HydrophobicContact CE2-CG 4.35Å; K168-I213 HydrophobicContact CB-CG1 4.31Å; K168-I213 HydrophobicContact CB-CG2 3.81Å; K168-I213 HydrophobicContact CD-CG2 4.28Å; K168-M216 HydrophobicContact CB-SD 3.89Å; K168-M216 HydrophobicContact CD-CB 4.26Å; K168-M216 VanDerWaalsContact CE-O 3.3Å; K168-M216 WeakPolarHBondContact CE-O 3.39Å; K168-M216 HydrophobicContact CG-SD 4.33Å; K168-M216 PolarHBondContact NZ-O 3.26Å
169	C	91.9	Very high	83.7	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	134.8	-171.3	-69.2	0	0	0	0	112.3	L114 M216 V222 V223	L114-C169 WeakPolarHBondContact O-CA 3.44Å; C169-M216 WeakPolarHBondContact O-CE 3.48Å; C169-V222 HydrophobicContact CB-CB 4.19Å; C169-V222 HydrophobicContact CB-CG1 4.04Å; C169-V222 HydrophobicContact CB-CG2 3.77Å; C169-V222 WeakPolarHBondContact O-CA 3.27Å; C169-V223 PolarHBondContact O-N 3.17Å
170	A	93.7	Very high	86.4	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.008	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	136	169.3	0	0	0	0	0	108.6	L114 A209 I213 V223 L225	L114-A170 PolarHBondContact N-O 3.1Å; L114-A170 PolarHBondContact O-N 2.96Å; A170-A209 HydrophobicContact CB-CB 3.85Å; A170-I213 HydrophobicContact CB-CD1 3.74Å; A170-I213 HydrophobicContact CB-CG1 3.91Å; A170-V223 CarbonylContact C-O 3.54Å; A170-V223 WeakPolarHBondContact CA-O 3.41Å; A170-V223 HydrophobicContact CB-CG1 3.59Å; A170-L225 HydrophobicContact CB-CD1 4.29Å
171	Q	95	Very high	88.6	Confident	19 Å²	19	42.9 Å²	42.9	9%	0.089	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	146.1	178.6	73.3	178.1	-10.9	0	0	112.3	A111 I112 I113 L135 V222 V223 T224 L225	A111-Q171 HydrophobicContact CB-CB 4.19Å; I112-Q171 CarbonylContact O-C 3.6Å; I112-Q171 VanDerWaalsContact O-CA 3.23Å; I112-Q171 WeakPolarHBondContact O-CA 3.39Å; I113-Q171 HydrophobicContact CG1-CB 4.31Å; L135-Q171 PolarHBondContact O-NE2 2.91Å; Q171-V222 HydrophobicContact CB-CG1 4.12Å; Q171-V222 HydrophobicContact CG-CG1 3.81Å; Q171-V223 PolarHBondContact N-O 2.96Å; Q171-T224 HydrophobicContact CG-CG2 4.14Å; Q171-T224 PolarHBondContact NE2-OG1 3.34Å; Q171-L225 PolarHBondContact O-N 3.45Å
172	I	96.6	Very high	90.8	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	117.6	172	-60	167.5	0	0	0	107	A111 I112 H174 W204 L206 L225 E227	A111-I172 CarbonylContact C-O 3.54Å; A111-I172 VanDerWaalsContact CA-O 3.27Å; A111-I172 WeakPolarHBondContact CA-O 3.43Å; I112-I172 HydrophobicContact CB-CB 4.41Å; I112-I172 PolarHBondContact N-O 2.94Å; I112-I172 PolarHBondContact O-N 3.19Å; I172-H174 PolarHBondContact O-N 2.85Å; I172-W204 HydrophobicContact CG2-CE3 3.88Å; I172-W204 HydrophobicContact CG2-CZ3 3.72Å; I172-L206 HydrophobicContact CD1-CD2 3.76Å; I172-L225 HydrophobicContact CG1-CB 4.24Å; I172-E227 HydrophobicContact CD1-CB 3.95Å; I172-E227 HydrophobicContact CD1-CG 4.09Å; I172-E227 HydrophobicContact CG1-CB 4.13Å; I172-E227 HydrophobicContact CG1-CG 4.3Å; I172-E227 HydrophobicContact CG2-CB 4.03Å
173	P	95.6	Very high	92.6	Very high	74 Å²	74	29.4 Å²	29.4	48%	0.481	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	134.7	178.3	-25.7	35	0	0	0	112.1	T224 L225	P173-T224 HydrophobicContact CG-CG2 3.84Å; P173-L225 WeakPolarHBondContact CD-O 3.22Å
174	H	96.1	Very high	93.6	Very high	7 Å²	7	26.1 Å²	26.1	3%	0.032	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	140.2	-179.2	-172.9	-89.6	0	0	0	109.8	N110 I172 G176 I178 T194 N196 H202 W204	N110-H174 CarbonylContact C-O 3.51Å; N110-H174 HydrophobicContact CB-CB 4.37Å; N110-H174 WeakPolarHBondContact CB-O 3.49Å; N110-H174 PolarHBondContact O-N 3.22Å; I172-H174 PolarHBondContact O-N 2.85Å; H174-G176 PolarHBondContact CE1-O 2.81Å; H174-G176 PolarHBondContact ND1-O 3.28Å; H174-I178 HydrophobicContact CB-CD1 4.02Å; H174-I178 VanDerWaalsContact CE1-CG1 3.47Å; H174-I178 WeakPolarHBondContact CE1-CG1 3.45Å; H174-I178 WeakPolarHBondContact ND1-CG1 3.26Å; H174-T194 PolarHBondContact NE2-OG1 2.88Å; H174-N196 PolarHBondContact CE1-ND2 2.78Å; H174-H202 AromaticContact NE2-CD2 3.64Å; H174-W204 AromaticContact CD2-CZ2 3.52Å
175	H	94.7	Very high	94.3	Very high	118 Å²	118	24.1 Å²	24.1	55%	0.546	12%	0.12	S	C	.	.	S	Bend	trans	-100.3	111.6	179.1	-173.2	83.6	0	0	0	110.9	P107 N196	P107-H175 WeakPolarHBondContact O-CA 3.37Å; H175-N196 PolarHBondContact O-ND2 3.38Å
176	G	94.5	Very high	94.5	Very high	5 Å²	5	24.2 Å²	24.2	5%	0.052	12%	0.12	C	C	.	.	S	Bend	trans	96.8	160.9	-173.9	0	0	0	0	0	112.2	P107 N110 H174	P107-G176 PolarHBondContact O-N 3.39Å; N110-G176 VanDerWaalsContact CB-O 3.22Å; N110-G176 WeakPolarHBondContact CB-O 3.48Å; N110-G176 PolarHBondContact ND2-O 2.81Å; H174-G176 PolarHBondContact CE1-O 2.81Å; H174-G176 PolarHBondContact ND1-O 3.28Å
177	D	96.4	Very high	94.6	Very high	49 Å²	49	29.5 Å²	29.5	26%	0.262	15%	0.146	S	C	.	.			trans	-69.1	142	-177.1	-61	-30.4	0	0	0	110.5	Q103 N110 N196 A197	Q103-D177 HydrophobicContact CB-CB 4.31Å; Q103-D177 HydrophobicContact CG-CB 3.97Å; N110-D177 PolarHBondContact ND2-N 2.93Å; N110-D177 PolarHBondContact ND2-OD1 3.23Å; D177-N196 WeakPolarHBondContact O-CA 3.28Å; D177-A197 HydrophobicContact CB-CB 4.04Å; D177-A197 PolarHBondContact O-N 3.16Å; D177-A197 VanDerWaalsContact O-N 3.09Å
178	I	98.2	Very high	94.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	104.6	177.3	-60.6	163.6	0	0	0	107.7	G101 T102 A111 I112 H174 I181 T194	G101-I178 VanDerWaalsContact CA-CD1 3.47Å; T102-I178 PolarHBondContact O-N 2.59Å; A111-I178 WeakPolarHBondContact O-CD1 3.23Å; I112-I178 HydrophobicContact CG1-CD1 3.78Å; H174-I178 HydrophobicContact CB-CD1 4.02Å; H174-I178 VanDerWaalsContact CE1-CG1 3.47Å; H174-I178 WeakPolarHBondContact CE1-CG1 3.45Å; H174-I178 WeakPolarHBondContact ND1-CG1 3.26Å; I178-I181 HydrophobicContact CG2-CB 4.27Å; I178-T194 HydrophobicContact CD1-CG2 4.41Å; I178-T194 HydrophobicContact CG2-CG2 4.15Å
179	N	98	Very high	94.9	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-36.3	-177.6	-71.4	0.5	0	0	0	112	L74 Q103 W195 E239 G240 F241	L74-N179 HydrophobicContact CD2-CB 4.43Å; L74-N179 WeakPolarHBondContact CD2-O 3.3Å; Q103-N179 PolarHBondContact NE2-OD1 3.04Å; N179-W195 PolarHBondContact N-O 2.73Å; N179-E239 PolarHBondContact ND2-OE2 2.82Å; N179-G240 WeakPolarHBondContact CB-O 3.2Å; N179-G240 PolarHBondContact ND2-O 2.78Å; N179-F241 HydrophobicContact CB-CD1 3.64Å; N179-F241 HydrophobicContact CB-CE1 3.69Å; N179-F241 WeakPolarHBondContact ND2-CE1 3.46Å
180	R	98.6	Very high	95.1	Very high	19 Å²	19	38 Å²	38	7%	0.072	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	142.6	173.8	-170.2	144.6	-61.4	-164.5	-3.8	111.3	R182 T194 W195 F241 M243 D289 E438	R180-R182 HydrophobicContact CG-CG 4.25Å; R180-T194 WeakPolarHBondContact O-CA 3.29Å; R180-W195 HydrophobicContact CB-CB 4.14Å; R180-W195 PolarHBondContact N-O 3.49Å; R180-W195 PolarHBondContact O-N 2.91Å; R180-F241 VanDerWaalsContact CB-O 3.28Å; R180-F241 WeakPolarHBondContact CB-O 3.28Å; R180-F241 WeakPolarHBondContact CD-O 3.29Å; R180-F241 PolarHBondContact NE-O 2.76Å; R180-F241 VanDerWaalsContact NE-O 3.12Å; R180-M243 HydrophobicContact CB-CB 4.47Å; R180-M243 HydrophobicContact CB-CE 4.05Å; R180-M243 HydrophobicContact CG-CB 4.2Å; R180-M243 HydrophobicContact CG-CE 4.02Å; R180-M243 WeakPolarHBondContact O-CE 3.39Å; R180-D289 VanDerWaalsContact NH1-CG 3.28Å; R180-D289 IonicContact NH1-OD1 3.79Å; R180-D289 PolarHBondContact NH1-OD1 2.71Å; R180-D289 IonicContact NH1-OD2 3.53Å; R180-E438 IonicContact CZ-OE1 2.87Å; R180-E438 IonicContact NE-OE1 3.87Å; R180-E438 IonicContact NH2-OE1 3.98Å
181	I	98.5	Very high	95.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	134.1	173.1	-162.2	167.2	0	0	0	109.5	S75 V99 I112 I178 C192 A193 T194	S75-I181 WeakPolarHBondContact O-CG2 3.31Å; S75-I181 PolarHBondContact OG-N 3.41Å; S75-I181 VanDerWaalsContact OG-N 3.16Å; V99-I181 HydrophobicContact CB-CD1 4.5Å; V99-I181 HydrophobicContact CG1-CD1 4.11Å; V99-I181 HydrophobicContact CG2-CD1 3.71Å; I112-I181 HydrophobicContact CG2-CD1 3.93Å; I178-I181 HydrophobicContact CG2-CB 4.27Å; I181-C192 WeakPolarHBondContact CD1-SG 3.04Å; I181-C192 WeakPolarHBondContact CG1-SG 3.41Å; I181-A193 WeakPolarHBondContact CA-O 3.25Å; I181-T194 HydrophobicContact CD1-CG2 4.26Å; I181-T194 HydrophobicContact CG1-CG2 4.17Å
182	R	98.3	Very high	95.4	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.008	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	134.6	177	-65.7	-67.1	-177.1	-114.6	5.1	110.2	E77 R180 C192 A193 M243 W245 E438	E77-R182 WeakPolarHBondContact OE1-CD 3.33Å; E77-R182 IonicContact OE1-NE 3.19Å; R180-R182 HydrophobicContact CG-CG 4.25Å; R182-C192 CarbonylContact O-C 3.56Å; R182-C192 WeakPolarHBondContact O-CA 3.49Å; R182-A193 PolarHBondContact N-O 3.41Å; R182-A193 PolarHBondContact O-N 2.85Å; R182-M243 HydrophobicContact CB-CE 4.25Å; R182-M243 HydrophobicContact CG-CE 4.2Å; R182-M243 HydrophobicContact CG-CG 4.4Å; R182-M243 WeakPolarHBondContact CG-O 3.21Å; R182-W245 PolarHBondContact O-NE1 2.69Å; R182-E438 IonicContact NH1-OE1 3.78Å; R182-E438 IonicContact NH1-OE2 2.87Å; R182-E438 IonicContact NH2-OE1 3.86Å
183	T	97.3	Very high	95.5	Very high	23 Å²	23	37.4 Å²	37.4	14%	0.141	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	157.9	-177.6	68	0	0	0	0	111.8	E77 L79 V99 L191 C192 L206	E77-T183 WeakPolarHBondContact OE2-CA 3.43Å; E77-T183 VanDerWaalsContact OE2-CB 3.27Å; E77-T183 WeakPolarHBondContact OE2-CB 3.42Å; E77-T183 PolarHBondContact OE2-N 2.71Å; E77-T183 PolarHBondContact OE2-OG1 3.11Å; L79-T183 HydrophobicContact CD2-CG2 3.88Å; L79-T183 WeakPolarHBondContact CD2-OG1 3.44Å; V99-T183 HydrophobicContact CG1-CG2 3.4Å; V99-T183 VanDerWaalsContact CG1-CG2 3.4Å; T183-L191 CarbonylContact C-O 3.58Å; T183-L191 VanDerWaalsContact CA-O 3.23Å; T183-L191 WeakPolarHBondContact CA-O 3.28Å; T183-L191 WeakPolarHBondContact CB-O 3.21Å; T183-C192 HydrophobicContact CG2-CB 4.15Å; T183-L206 HydrophobicContact CG2-CD1 4.49Å
184	T	95.8	Very high	95.6	Very high	21 Å²	21	33.9 Å²	33.9	13%	0.129	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	150.1	175	-169.8	0	0	0	0	109.4	I186 L191 W245	T184-I186 HydrophobicContact CG2-CD1 4.41Å; T184-I186 HydrophobicContact CG2-CG1 4.15Å; T184-L191 HydrophobicContact CG2-CB 4.09Å; T184-L191 PolarHBondContact N-O 3.1Å; T184-L191 PolarHBondContact O-N 3.03Å; T184-W245 HydrophobicContact CG2-CD2 3.61Å; T184-W245 HydrophobicContact CG2-CE3 3.92Å; T184-W245 HydrophobicContact CG2-CG 4.05Å; T184-W245 HydrophobicContact CG2-CH2 4.19Å; T184-W245 HydrophobicContact CG2-CZ2 3.84Å; T184-W245 HydrophobicContact CG2-CZ3 4.22Å
185	Y	93.2	Very high	95.7	Very high	63 Å²	63	33.6 Å²	33.6	25%	0.247	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	128.9	166.8	-76.8	-84.4	0	0	0	109.7	T80 F81 A83 L190	T80-Y185 WeakPolarHBondContact O-CE2 3.42Å; T80-Y185 PolarHBondContact O-OH 3.38Å; F81-Y185 WeakPolarHBondContact CA-OH 3.36Å; A83-Y185 HydrophobicContact CB-CD2 3.87Å; A83-Y185 HydrophobicContact CB-CE2 4.21Å; A83-Y185 HydrophobicContact CB-CG 4.2Å; Y185-L190 HydrophobicContact CD1-CB 4.31Å; Y185-L190 HydrophobicContact CD2-CD1 4.32Å; Y185-L190 HydrophobicContact CE1-CB 3.76Å; Y185-L190 HydrophobicContact CE1-CD1 4.06Å; Y185-L190 HydrophobicContact CE1-CG 4.42Å; Y185-L190 HydrophobicContact CE2-CD1 3.87Å
186	I	92.4	Very high	95.7	Very high	11 Å²	11	28 Å²	28	6%	0.056	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	105.4	167.7	-55.9	-171.8	0	0	0	107.1	T184 D188 T189 L191 G251 L267 W273	T184-I186 HydrophobicContact CG2-CD1 4.41Å; T184-I186 HydrophobicContact CG2-CG1 4.15Å; I186-D188 PolarHBondContact O-N 2.98Å; I186-T189 PolarHBondContact N-O 2.94Å; I186-T189 VanDerWaalsContact N-O 3.07Å; I186-T189 PolarHBondContact O-N 3.21Å; I186-L191 HydrophobicContact CB-CD1 4.2Å; I186-L191 HydrophobicContact CD1-CD1 3.51Å; I186-L191 HydrophobicContact CG1-CD1 3.85Å; I186-G251 VanDerWaalsContact CD1-CA 3.4Å; I186-L267 HydrophobicContact CD1-CD2 4.03Å; I186-L267 HydrophobicContact CG2-CD2 3.84Å; I186-W273 HydrophobicContact CD1-CH2 4.39Å; I186-W273 HydrophobicContact CD1-CZ2 3.79Å
187	H	86.8	Confident	95.7	Very high	167 Å²	167	29.3 Å²	29.3	77%	0.773	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	-125.8	-162.4	-47	94.1	0	0	0	109.2
188	D	88.7	Confident	95.7	Very high	155 Å²	155	30.4 Å²	30.4	83%	0.829	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.2	9.2	-179.4	-52.1	-40.6	0	0	0	113.4	I186	I186-D188 PolarHBondContact O-N 2.98Å
189	T	93.4	Very high	95.6	Very high	54 Å²	54	30.4 Å²	30.4	33%	0.331	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	120.1	-179.7	-54.4	0	0	0	0	110.1	I186 L191 N205	I186-T189 PolarHBondContact N-O 2.94Å; I186-T189 VanDerWaalsContact N-O 3.07Å; I186-T189 PolarHBondContact O-N 3.21Å; T189-L191 HydrophobicContact CG2-CD2 3.67Å; T189-L191 HydrophobicContact CG2-CG 4.08Å; T189-L191 PolarHBondContact O-N 3.32Å; T189-N205 WeakPolarHBondContact CG2-OD1 3.27Å
190	L	95.5	Very high	95.6	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.016	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	112.7	170.5	178.3	60.7	0	0	0	108.5	L79 Y185 L206 S207 V210	L79-L190 HydrophobicContact CD1-CD2 4.15Å; L79-L190 HydrophobicContact CD2-CD1 4.43Å; Y185-L190 HydrophobicContact CD1-CB 4.31Å; Y185-L190 HydrophobicContact CD2-CD1 4.32Å; Y185-L190 HydrophobicContact CE1-CB 3.76Å; Y185-L190 HydrophobicContact CE1-CD1 4.06Å; Y185-L190 HydrophobicContact CE1-CG 4.42Å; Y185-L190 HydrophobicContact CE2-CD1 3.87Å; L190-L206 HydrophobicContact CB-CB 4.49Å; L190-L206 HydrophobicContact CD2-CB 3.96Å; L190-L206 HydrophobicContact CD2-CD1 4.4Å; L190-L206 HydrophobicContact CG-CB 4Å; L190-L206 HydrophobicContact CG-CD1 4.49Å; L190-L206 PolarHBondContact O-N 3.09Å; L190-S207 PolarHBondContact N-OG 3.38Å; L190-V210 HydrophobicContact CD2-CG2 3.86Å
191	L	96.7	Very high	95.6	Very high	11 Å²	11	33.5 Å²	33.5	6%	0.058	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	155.7	176.1	-62.5	178.1	0	0	0	110.8	T183 T184 I186 T189 I203 W204 N205 W273	T183-L191 CarbonylContact C-O 3.58Å; T183-L191 VanDerWaalsContact CA-O 3.23Å; T183-L191 WeakPolarHBondContact CA-O 3.28Å; T183-L191 WeakPolarHBondContact CB-O 3.21Å; T184-L191 HydrophobicContact CG2-CB 4.09Å; T184-L191 PolarHBondContact N-O 3.1Å; T184-L191 PolarHBondContact O-N 3.03Å; I186-L191 HydrophobicContact CB-CD1 4.2Å; I186-L191 HydrophobicContact CD1-CD1 3.51Å; I186-L191 HydrophobicContact CG1-CD1 3.85Å; T189-L191 HydrophobicContact CG2-CD2 3.67Å; T189-L191 HydrophobicContact CG2-CG 4.08Å; T189-L191 PolarHBondContact O-N 3.32Å; L191-I203 HydrophobicContact CD1-CG2 4.48Å; L191-W204 VanDerWaalsContact CA-O 3.29Å; L191-W204 WeakPolarHBondContact CA-O 3.41Å; L191-W204 WeakPolarHBondContact CD2-O 3.11Å; L191-N205 HydrophobicContact CD2-CB 4.24Å; L191-W273 HydrophobicContact CD1-CH2 3.54Å; L191-W273 HydrophobicContact CD1-CZ2 3.8Å
192	C	97.6	Very high	95.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	128.5	176	174	0	0	0	0	110.1	I181 R182 T183 I203 W204 L206	I181-C192 WeakPolarHBondContact CD1-SG 3.04Å; I181-C192 WeakPolarHBondContact CG1-SG 3.41Å; R182-C192 CarbonylContact O-C 3.56Å; R182-C192 WeakPolarHBondContact O-CA 3.49Å; T183-C192 HydrophobicContact CG2-CB 4.15Å; C192-I203 CarbonylContact O-C 3.57Å; C192-I203 WeakPolarHBondContact O-CA 3.46Å; C192-W204 PolarHBondContact N-O 3.16Å; C192-W204 PolarHBondContact O-N 3.47Å; C192-L206 HydrophobicContact CB-CD1 3.45Å; C192-L206 VanDerWaalsContact CB-CD1 3.45Å; C192-L206 HydrophobicContact CB-CD2 4.12Å; C192-L206 HydrophobicContact CB-CG 3.64Å
193	A	98.6	Very high	95.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	135.9	166.5	0	0	0	0	0	109.5	I181 R182 H202 I203 M243 W245 L253	I181-A193 WeakPolarHBondContact CA-O 3.25Å; R182-A193 PolarHBondContact N-O 3.41Å; R182-A193 PolarHBondContact O-N 2.85Å; A193-H202 CarbonylContact C-O 3.5Å; A193-H202 VanDerWaalsContact CA-O 3.26Å; A193-H202 WeakPolarHBondContact CA-O 3.13Å; A193-I203 HydrophobicContact CB-CD1 3.69Å; A193-M243 HydrophobicContact CB-CE 3.92Å; A193-M243 HydrophobicContact CB-SD 3.5Å; A193-M243 VanDerWaalsContact CB-SD 3.5Å; A193-M243 WeakPolarHBondContact O-CE 3.42Å; A193-W245 HydrophobicContact CB-CZ2 3.7Å; A193-L253 HydrophobicContact CB-CD1 4.45Å; A193-L253 HydrophobicContact CB-CD2 4.07Å
194	T	98.7	Very high	95.6	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	129.2	171.2	59.6	0	0	0	0	110.1	I112 H174 I178 R180 I181 V201 H202 W204	I112-T194 HydrophobicContact CD1-CG2 3.61Å; I112-T194 HydrophobicContact CG1-CG2 3.81Å; H174-T194 PolarHBondContact NE2-OG1 2.88Å; I178-T194 HydrophobicContact CD1-CG2 4.41Å; I178-T194 HydrophobicContact CG2-CG2 4.15Å; R180-T194 WeakPolarHBondContact O-CA 3.29Å; I181-T194 HydrophobicContact CD1-CG2 4.26Å; I181-T194 HydrophobicContact CG1-CG2 4.17Å; T194-V201 WeakPolarHBondContact O-CA 3.47Å; T194-H202 PolarHBondContact N-O 3.4Å; T194-H202 PolarHBondContact O-N 3.18Å; T194-H202 WeakPolarHBondContact OG1-CB 3.34Å; T194-W204 PolarHBondContact OG1-NE1 3.14Å
195	W	98.3	Very high	95.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	121.8	172.4	-170.1	-78.3	0	0	0	110.2	N179 R180 V201 H236 G240 M243 T255 G256 D257	N179-W195 PolarHBondContact N-O 2.73Å; R180-W195 HydrophobicContact CB-CB 4.14Å; R180-W195 PolarHBondContact N-O 3.49Å; R180-W195 PolarHBondContact O-N 2.91Å; W195-V201 HydrophobicContact CD2-CG2 4.06Å; W195-V201 HydrophobicContact CE3-CB 4.08Å; W195-V201 HydrophobicContact CE3-CG1 3.88Å; W195-V201 HydrophobicContact CE3-CG2 3.16Å; W195-V201 HydrophobicContact CH2-CG2 4.14Å; W195-V201 HydrophobicContact CZ3-CB 4.34Å; W195-V201 HydrophobicContact CZ3-CG1 4.43Å; W195-V201 HydrophobicContact CZ3-CG2 3.09Å; W195-H236 HydrophobicContact CH2-CB 4.41Å; W195-H236 AromaticContact CH2-CD2 3.16Å; W195-H236 WeakPolarHBondContact CH2-CD2 3.02Å; W195-H236 AromaticContact CH2-CE1 3.38Å; W195-H236 WeakPolarHBondContact CH2-CE1 3.41Å; W195-H236 AromaticContact CH2-CG 3.52Å; W195-H236 AromaticContact CH2-ND1 3.68Å; W195-H236 AromaticContact CH2-NE2 3.15Å; W195-H236 WeakPolarHBondContact CH2-NE2 3.31Å; W195-H236 AromaticContact CZ3-CD2 3.48Å; W195-H236 VanDerWaalsContact CZ3-CD2 3.48Å; W195-H236 WeakPolarHBondContact CZ3-CD2 3.15Å; W195-H236 AromaticContact CZ3-NE2 3.53Å; W195-G240 PolarHBondContact NE1-O 3.01Å; W195-M243 HydrophobicContact CB-CE 4.01Å; W195-M243 HydrophobicContact CB-SD 4.12Å; W195-T255 HydrophobicContact CE3-CG2 3.9Å; W195-T255 HydrophobicContact CZ3-CG2 3.69Å; W195-T255 VanDerWaalsContact CZ3-OG1 3.3Å; W195-T255 WeakPolarHBondContact CZ3-OG1 3.33Å; W195-G256 VanDerWaalsContact CH2-O 3.31Å; W195-G256 WeakPolarHBondContact CH2-O 3.3Å; W195-G256 WeakPolarHBondContact CZ2-O 3.3Å; W195-D257 HydrophobicContact CH2-CB 4.43Å; W195-D257 HydrophobicContact CZ2-CB 3.98Å
196	N	94.1	Very high	95.8	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	141.8	-165.5	-178.9	-38.9	0	0	0	111.9	H174 H175 D177 T198 G199 K200	H174-N196 PolarHBondContact CE1-ND2 2.78Å; H175-N196 PolarHBondContact O-ND2 3.38Å; D177-N196 WeakPolarHBondContact O-CA 3.28Å; N196-T198 PolarHBondContact ND2-OG1 2.74Å; N196-T198 PolarHBondContact O-N 2.9Å; N196-T198 WeakPolarHBondContact OD1-CB 3.45Å; N196-T198 WeakPolarHBondContact OD1-CG2 3.4Å; N196-T198 PolarHBondContact OD1-N 2.93Å; N196-T198 PolarHBondContact OD1-OG1 2.77Å; N196-G199 PolarHBondContact O-N 2.84Å; N196-K200 HydrophobicContact CB-CB 4.41Å; N196-K200 VanDerWaalsContact CB-O 3.27Å; N196-K200 WeakPolarHBondContact CB-O 3.43Å; N196-K200 PolarHBondContact N-O 3.04Å
197	A	95.1	Very high	95.9	Very high	32 Å²	32	32.8 Å²	32.8	26%	0.264	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-13.7	174.6	0	0	0	0	0	114.8	D177 G199 E239	D177-A197 HydrophobicContact CB-CB 4.04Å; D177-A197 PolarHBondContact O-N 3.16Å; D177-A197 VanDerWaalsContact O-N 3.09Å; A197-G199 VanDerWaalsContact C-N 3.29Å; A197-E239 WeakPolarHBondContact O-CB 3.29Å
198	T	94.7	Very high	96.4	Very high	72 Å²	72	26.5 Å²	26.5	44%	0.442	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	5.8	173.5	63.3	0	0	0	0	114.1	N196	N196-T198 PolarHBondContact ND2-OG1 2.74Å; N196-T198 PolarHBondContact O-N 2.9Å; N196-T198 WeakPolarHBondContact OD1-CB 3.45Å; N196-T198 WeakPolarHBondContact OD1-CG2 3.4Å; N196-T198 PolarHBondContact OD1-N 2.93Å; N196-T198 PolarHBondContact OD1-OG1 2.77Å
199	G	96.4	Very high	96.7	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.01	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	18.9	-177.8	0	0	0	0	0	114	N196 A197 H236 V238	N196-G199 PolarHBondContact O-N 2.84Å; A197-G199 VanDerWaalsContact C-N 3.29Å; G199-H236 WeakPolarHBondContact O-CB 3.32Å; G199-V238 WeakPolarHBondContact CA-O 3.43Å
200	K	97.8	Very high	96.7	Very high	87 Å²	87	17.4 Å²	17.4	38%	0.378	10%	0.099	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	149.7	-179.9	-60.9	-175.5	-175.8	169.9	0	111.2	N196 H202 T234	N196-K200 HydrophobicContact CB-CB 4.41Å; N196-K200 VanDerWaalsContact CB-O 3.27Å; N196-K200 WeakPolarHBondContact CB-O 3.43Å; N196-K200 PolarHBondContact N-O 3.04Å; K200-H202 WeakPolarHBondContact CB-NE2 3.18Å; K200-T234 HydrophobicContact CD-CG2 4.24Å; K200-T234 HydrophobicContact CG-CG2 4.16Å
201	V	98.5	Very high	96.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	126.3	171.5	-160.8	0	0	0	0	107.9	T194 W195 T232 F233 M243 T255 W265	T194-V201 WeakPolarHBondContact O-CA 3.47Å; W195-V201 HydrophobicContact CD2-CG2 4.06Å; W195-V201 HydrophobicContact CE3-CB 4.08Å; W195-V201 HydrophobicContact CE3-CG1 3.88Å; W195-V201 HydrophobicContact CE3-CG2 3.16Å; W195-V201 HydrophobicContact CH2-CG2 4.14Å; W195-V201 HydrophobicContact CZ3-CB 4.34Å; W195-V201 HydrophobicContact CZ3-CG1 4.43Å; W195-V201 HydrophobicContact CZ3-CG2 3.09Å; V201-T232 CarbonylContact O-C 3.58Å; V201-T232 WeakPolarHBondContact O-CA 3.28Å; V201-F233 HydrophobicContact CB-CB 4.49Å; V201-F233 HydrophobicContact CG2-CD1 4.31Å; V201-F233 PolarHBondContact N-O 2.78Å; V201-F233 VanDerWaalsContact N-O 3.1Å; V201-F233 PolarHBondContact O-N 2.83Å; V201-M243 HydrophobicContact CG1-SD 4.04Å; V201-T255 HydrophobicContact CG1-CG2 4.35Å; V201-W265 HydrophobicContact CB-CH2 3.72Å; V201-W265 HydrophobicContact CB-CZ2 3.58Å; V201-W265 HydrophobicContact CG1-CH2 4Å; V201-W265 HydrophobicContact CG1-CZ2 3.85Å; V201-W265 HydrophobicContact CG2-CH2 4.43Å; V201-W265 HydrophobicContact CG2-CZ2 3.83Å
202	H	98.4	Very high	96.5	Very high	19 Å²	19	24.3 Å²	24.3	9%	0.088	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	146	-178.1	-54.4	-80.5	0	0	0	109.6	H174 A193 T194 K200 W204 D229 F231 T232	H174-H202 AromaticContact NE2-CD2 3.64Å; A193-H202 CarbonylContact C-O 3.5Å; A193-H202 VanDerWaalsContact CA-O 3.26Å; A193-H202 WeakPolarHBondContact CA-O 3.13Å; T194-H202 PolarHBondContact N-O 3.4Å; T194-H202 PolarHBondContact O-N 3.18Å; T194-H202 WeakPolarHBondContact OG1-CB 3.34Å; K200-H202 WeakPolarHBondContact CB-NE2 3.18Å; H202-W204 HydrophobicContact CB-CZ2 3.89Å; H202-D229 HydrophobicContact CB-CB 4.22Å; H202-F231 CarbonylContact C-O 3.58Å; H202-F231 WeakPolarHBondContact CA-O 3.46Å; H202-T232 PolarHBondContact CE1-OG1 2.81Å; H202-T232 WeakPolarHBondContact ND1-CG2 3.46Å; H202-T232 PolarHBondContact ND1-OG1 3.17Å
203	I	98.3	Very high	96.2	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.7	169.3	-51.1	-58	0	0	0	107.8	L191 C192 A193 D229 V230 F231 W245 L253 W265 W273	L191-I203 HydrophobicContact CD1-CG2 4.48Å; C192-I203 CarbonylContact O-C 3.57Å; C192-I203 WeakPolarHBondContact O-CA 3.46Å; A193-I203 HydrophobicContact CB-CD1 3.69Å; I203-D229 CarbonylContact O-C 3.55Å; I203-D229 WeakPolarHBondContact O-CA 3.32Å; I203-V230 PolarHBondContact O-N 3.05Å; I203-F231 HydrophobicContact CB-CB 4.19Å; I203-F231 HydrophobicContact CG1-CB 4.18Å; I203-F231 PolarHBondContact N-O 2.87Å; I203-F231 PolarHBondContact O-N 3.02Å; I203-W245 HydrophobicContact CD1-CH2 3.8Å; I203-W245 HydrophobicContact CD1-CZ2 3.76Å; I203-L253 HydrophobicContact CD1-CD2 4.28Å; I203-W265 HydrophobicContact CD1-CZ3 4.43Å; I203-W265 HydrophobicContact CG1-CZ3 4.29Å; I203-W273 HydrophobicContact CG1-CD2 4.5Å; I203-W273 HydrophobicContact CG2-CH2 3.99Å; I203-W273 HydrophobicContact CG2-CZ2 4.2Å; I203-W273 HydrophobicContact CG2-CZ3 4.24Å
204	W	98.2	Very high	95.8	Very high	16 Å²	16	30.3 Å²	30.3	6%	0.061	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	147.9	-176.4	-54.7	85.8	0	0	0	110.3	I112 I172 H174 L191 C192 T194 H202 L206 D229	I112-W204 HydrophobicContact CD1-CB 4.24Å; I112-W204 VanDerWaalsContact CD1-CD1 3.43Å; I112-W204 HydrophobicContact CD1-CD2 3.53Å; I112-W204 HydrophobicContact CD1-CE3 4.23Å; I112-W204 HydrophobicContact CD1-CG 3.49Å; I112-W204 VanDerWaalsContact CD1-CG 3.49Å; I112-W204 HydrophobicContact CD1-CZ2 4.29Å; I172-W204 HydrophobicContact CG2-CE3 3.88Å; I172-W204 HydrophobicContact CG2-CZ3 3.72Å; H174-W204 AromaticContact CD2-CZ2 3.52Å; L191-W204 VanDerWaalsContact CA-O 3.29Å; L191-W204 WeakPolarHBondContact CA-O 3.41Å; L191-W204 WeakPolarHBondContact CD2-O 3.11Å; C192-W204 PolarHBondContact N-O 3.16Å; C192-W204 PolarHBondContact O-N 3.47Å; T194-W204 PolarHBondContact OG1-NE1 3.14Å; H202-W204 HydrophobicContact CB-CZ2 3.89Å; W204-L206 HydrophobicContact CB-CD2 4.31Å; W204-D229 HydrophobicContact CD2-CB 4.27Å; W204-D229 HydrophobicContact CE3-CB 4.27Å; W204-D229 HydrophobicContact CH2-CB 4.21Å; W204-D229 HydrophobicContact CZ2-CB 4.19Å; W204-D229 HydrophobicContact CZ3-CB 4.26Å
205	N	96.9	Very high	95.4	Very high	46 Å²	46	35.9 Å²	35.9	25%	0.246	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	114.6	168.6	-178.1	-1.6	0	0	0	109.1	T189 L191 S207 V230	T189-N205 WeakPolarHBondContact CG2-OD1 3.27Å; L191-N205 HydrophobicContact CD2-CB 4.24Å; N205-S207 VanDerWaalsContact OD1-CB 3.28Å; N205-S207 WeakPolarHBondContact OD1-CB 3.49Å; N205-S207 PolarHBondContact OD1-N 2.83Å; N205-S207 PolarHBondContact OD1-OG 3.04Å; N205-V230 HydrophobicContact CB-CG2 3.92Å
206	L	96.9	Very high	94.9	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	20%	0.198	C	C	.	.			trans	-93.7	-7	180	-58.8	-170.4	0	0	0	113.2	V99 I112 L114 I172 T183 L190 C192 W204 P208 A209 V210	V99-L206 HydrophobicContact CB-CD1 4.34Å; V99-L206 HydrophobicContact CG1-CD1 4.5Å; V99-L206 HydrophobicContact CG2-CD1 3.89Å; I112-L206 HydrophobicContact CG2-CD2 4.17Å; L114-L206 HydrophobicContact CD1-CB 4.43Å; I172-L206 HydrophobicContact CD1-CD2 3.76Å; T183-L206 HydrophobicContact CG2-CD1 4.49Å; L190-L206 HydrophobicContact CB-CB 4.49Å; L190-L206 HydrophobicContact CD2-CB 3.96Å; L190-L206 HydrophobicContact CD2-CD1 4.4Å; L190-L206 HydrophobicContact CG-CB 4Å; L190-L206 HydrophobicContact CG-CD1 4.49Å; L190-L206 PolarHBondContact O-N 3.09Å; C192-L206 HydrophobicContact CB-CD1 3.45Å; C192-L206 VanDerWaalsContact CB-CD1 3.45Å; C192-L206 HydrophobicContact CB-CD2 4.12Å; C192-L206 HydrophobicContact CB-CG 3.64Å; W204-L206 HydrophobicContact CB-CD2 4.31Å; L206-P208 VanDerWaalsContact C-CD 3.44Å; L206-P208 VanDerWaalsContact C-N 3.3Å; L206-A209 WeakPolarHBondContact O-CA 3.41Å; L206-A209 VanDerWaalsContact O-CB 3.31Å; L206-A209 WeakPolarHBondContact O-CB 3.16Å; L206-A209 PolarHBondContact O-N 2.8Å; L206-V210 PolarHBondContact O-N 3.39Å
207	S	95.2	Very high	94.5	Very high	24 Å²	24	42.6 Å²	42.6	17%	0.168	23%	0.23	C	C	.	.	H	α-helix	trans	-54.9	-36.9	177.9	-63.4	0	0	0	0	114	L190 N205 A209 V210 K211	L190-S207 PolarHBondContact N-OG 3.38Å; N205-S207 VanDerWaalsContact OD1-CB 3.28Å; N205-S207 WeakPolarHBondContact OD1-CB 3.49Å; N205-S207 PolarHBondContact OD1-N 2.83Å; N205-S207 PolarHBondContact OD1-OG 3.04Å; S207-A209 VanDerWaalsContact C-N 3.32Å; S207-A209 PolarHBondContact O-N 2.79Å; S207-V210 PolarHBondContact O-N 3.06Å; S207-K211 WeakPolarHBondContact O-CG 3.47Å; S207-K211 PolarHBondContact O-N 3.15Å; S207-K211 VanDerWaalsContact O-N 3.11Å
208	P	95.9	Very high	93.7	Very high	35 Å²	35	45.2 Å²	45.2	23%	0.227	24%	0.238	C	C	.	.	H	α-helix	trans	-61.5	-36.6	171.2	-24.7	36	0	0	0	113.6	L206 K211 A212 E227	L206-P208 VanDerWaalsContact C-CD 3.44Å; L206-P208 VanDerWaalsContact C-N 3.3Å; P208-K211 PolarHBondContact O-N 2.71Å; P208-A212 WeakPolarHBondContact O-CB 3.18Å; P208-A212 PolarHBondContact O-N 3.35Å; P208-E227 HydrophobicContact CB-CG 4.32Å; P208-E227 WeakPolarHBondContact CB-OE1 3.39Å; P208-E227 HydrophobicContact CG-CG 4.44Å
209	A	95.5	Very high	92.7	Very high	2 Å²	2	49.2 Å²	49.2	2%	0.017	26%	0.257	C	S	.	.	H	α-helix	trans	-67.5	-41.4	177.1	0	0	0	0	0	112.5	L114 A170 L206 S207 A212 I213 L225	L114-A209 HydrophobicContact CB-CB 4.37Å; L114-A209 HydrophobicContact CD1-CB 4.15Å; A170-A209 HydrophobicContact CB-CB 3.85Å; L206-A209 WeakPolarHBondContact O-CA 3.41Å; L206-A209 VanDerWaalsContact O-CB 3.31Å; L206-A209 WeakPolarHBondContact O-CB 3.16Å; L206-A209 PolarHBondContact O-N 2.8Å; S207-A209 VanDerWaalsContact C-N 3.32Å; S207-A209 PolarHBondContact O-N 2.79Å; A209-A212 PolarHBondContact O-N 2.78Å; A209-I213 PolarHBondContact O-N 2.83Å; A209-I213 VanDerWaalsContact O-N 3.08Å; A209-L225 VanDerWaalsContact CA-CD1 3.43Å; A209-L225 HydrophobicContact CB-CD1 3.68Å
210	V	94	Very high	91.6	Very high	15 Å²	15	52 Å²	52	9%	0.091	28%	0.277	C	S	.	.	H	α-helix	trans	-58.4	-51.7	173.2	-179.9	0	0	0	0	110.5	F81 L114 L190 L206 S207 A212 I213 E214	F81-V210 HydrophobicContact CD1-CG1 3.84Å; F81-V210 HydrophobicContact CD1-CG2 3.94Å; F81-V210 HydrophobicContact CE1-CB 4.35Å; F81-V210 HydrophobicContact CE1-CG1 3.9Å; F81-V210 HydrophobicContact CE1-CG2 3.55Å; F81-V210 HydrophobicContact CG-CG1 4.26Å; F81-V210 HydrophobicContact CZ-CG1 4.33Å; F81-V210 HydrophobicContact CZ-CG2 4.37Å; L114-V210 HydrophobicContact CD1-CG2 3.76Å; L190-V210 HydrophobicContact CD2-CG2 3.86Å; L206-V210 PolarHBondContact O-N 3.39Å; S207-V210 PolarHBondContact O-N 3.06Å; V210-A212 VanDerWaalsContact C-N 3.29Å; V210-A212 PolarHBondContact O-N 3.12Å; V210-I213 PolarHBondContact O-N 3.19Å; V210-E214 HydrophobicContact CG1-CG 4.49Å; V210-E214 WeakPolarHBondContact O-CG 3.32Å; V210-E214 PolarHBondContact O-N 2.97Å
211	K	93.9	Very high	90.6	Very high	140 Å²	140	48 Å²	48	61%	0.609	26%	0.26	S	S	*	.	H	α-helix	trans	-59.1	-39.8	178.4	-71	176.9	-177.3	-179.6	0	112.7	S207 P208 E214 T215	S207-K211 WeakPolarHBondContact O-CG 3.47Å; S207-K211 PolarHBondContact O-N 3.15Å; S207-K211 VanDerWaalsContact O-N 3.11Å; P208-K211 PolarHBondContact O-N 2.71Å; K211-E214 PolarHBondContact O-N 2.84Å; K211-T215 PolarHBondContact O-N 3.31Å; K211-T215 PolarHBondContact O-OG1 2.96Å
212	A	93.5	Very high	90	Very high	19 Å²	19	48.8 Å²	48.8	16%	0.157	27%	0.265	C	S	.	.	H	α-helix	trans	-63	-43.7	178.8	0	0	0	0	0	111.4	P208 A209 V210 T215 M216 V223 L225	P208-A212 WeakPolarHBondContact O-CB 3.18Å; P208-A212 PolarHBondContact O-N 3.35Å; A209-A212 PolarHBondContact O-N 2.78Å; V210-A212 VanDerWaalsContact C-N 3.29Å; V210-A212 PolarHBondContact O-N 3.12Å; A212-T215 PolarHBondContact O-N 3.22Å; A212-T215 PolarHBondContact O-OG1 3.18Å; A212-M216 WeakPolarHBondContact O-CB 3.2Å; A212-M216 PolarHBondContact O-N 2.86Å; A212-V223 HydrophobicContact CB-CG1 3.87Å; A212-L225 HydrophobicContact CB-CD1 4.47Å; A212-L225 HydrophobicContact CB-CD2 4.22Å
213	I	91.8	Very high	89.6	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-65.5	-40.6	175.8	-80.5	162.7	0	0	0	112.4	L114 Q116 K168 A170 A209 V210 T215 M216	L114-I213 HydrophobicContact CB-CD1 4.08Å; L114-I213 HydrophobicContact CD2-CD1 3.25Å; L114-I213 HydrophobicContact CG-CD1 4.2Å; L114-I213 WeakPolarHBondContact O-CD1 3.42Å; Q116-I213 HydrophobicContact CB-CG2 3.98Å; Q116-I213 VanDerWaalsContact OE1-CG2 3.29Å; K168-I213 HydrophobicContact CB-CG1 4.31Å; K168-I213 HydrophobicContact CB-CG2 3.81Å; K168-I213 HydrophobicContact CD-CG2 4.28Å; A170-I213 HydrophobicContact CB-CD1 3.74Å; A170-I213 HydrophobicContact CB-CG1 3.91Å; A209-I213 PolarHBondContact O-N 2.83Å; A209-I213 VanDerWaalsContact O-N 3.08Å; V210-I213 PolarHBondContact O-N 3.19Å; I213-T215 PolarHBondContact O-N 3.29Å; I213-M216 VanDerWaalsContact O-CB 3.26Å; I213-M216 WeakPolarHBondContact O-CB 3.4Å; I213-M216 PolarHBondContact O-N 3.34Å; I213-M216 VanDerWaalsContact O-N 3.11Å
214	E	89.7	Confident	89.4	Confident	125 Å²	125	54 Å²	54	58%	0.584	30%	0.298	S	S	*	.	H	α-helix	trans	-59.2	-35.4	177.6	-73.5	172.9	168.7	0	0	112.3	V210 K211	V210-E214 HydrophobicContact CG1-CG 4.49Å; V210-E214 WeakPolarHBondContact O-CG 3.32Å; V210-E214 PolarHBondContact O-N 2.97Å; K211-E214 PolarHBondContact O-N 2.84Å
215	T	89.9	Confident	89.2	Confident	116 Å²	116	54.6 Å²	54.6	71%	0.712	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	1	179.5	59.5	0	0	0	0	114.5	K211 A212 I213	K211-T215 PolarHBondContact O-N 3.31Å; K211-T215 PolarHBondContact O-OG1 2.96Å; A212-T215 PolarHBondContact O-N 3.22Å; A212-T215 PolarHBondContact O-OG1 3.18Å; I213-T215 PolarHBondContact O-N 3.29Å
216	M	88.7	Confident	89.1	Confident	16 Å²	16	56.2 Å²	56.2	8%	0.079	33%	0.329	C	S	.	.			trans	-83.7	131.7	-172.5	-174.3	175.2	-90	0	0	111.6	K168 C169 A212 I213 S220 G221 V223	K168-M216 HydrophobicContact CB-SD 3.89Å; K168-M216 HydrophobicContact CD-CB 4.26Å; K168-M216 VanDerWaalsContact CE-O 3.3Å; K168-M216 WeakPolarHBondContact CE-O 3.39Å; K168-M216 HydrophobicContact CG-SD 4.33Å; K168-M216 PolarHBondContact NZ-O 3.26Å; C169-M216 WeakPolarHBondContact O-CE 3.48Å; A212-M216 WeakPolarHBondContact O-CB 3.2Å; A212-M216 PolarHBondContact O-N 2.86Å; I213-M216 VanDerWaalsContact O-CB 3.26Å; I213-M216 WeakPolarHBondContact O-CB 3.4Å; I213-M216 PolarHBondContact O-N 3.34Å; I213-M216 VanDerWaalsContact O-N 3.11Å; M216-S220 WeakPolarHBondContact CG-OG 3.15Å; M216-G221 VanDerWaalsContact SD-O 3.38Å; M216-V223 HydrophobicContact CE-CB 3.55Å; M216-V223 HydrophobicContact CE-CG1 3.47Å; M216-V223 VanDerWaalsContact CE-CG1 3.47Å
217	D	85.3	Confident	89	Confident	126 Å²	126	59.6 Å²	59.6	67%	0.674	35%	0.345	S	S	*	.			trans	-75.5	155.1	168.5	-65.1	-40.3	0	0	0	110.5	D219 S220	D217-D219 PolarHBondContact O-N 3.3Å; D217-D219 VanDerWaalsContact O-N 3.14Å; D217-S220 PolarHBondContact N-OG 2.8Å; D217-S220 VanDerWaalsContact N-OG 3.09Å; D217-S220 VanDerWaalsContact O-CB 3.23Å; D217-S220 WeakPolarHBondContact O-CB 3.25Å; D217-S220 PolarHBondContact O-N 3.21Å; D217-S220 PolarHBondContact O-OG 3.45Å
218	I	77.7	Confident	89.1	Confident	88 Å²	88	66.7 Å²	66.7	45%	0.451	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-53.4	-38.7	-174.9	-61.7	174.7	0	0	0	112.2	Y166 S220	Y166-I218 HydrophobicContact CD2-CG1 4.45Å; Y166-I218 HydrophobicContact CD2-CG2 3.89Å; Y166-I218 HydrophobicContact CE1-CD1 4.42Å; Y166-I218 HydrophobicContact CE2-CB 4.46Å; Y166-I218 HydrophobicContact CE2-CD1 4.46Å; Y166-I218 HydrophobicContact CE2-CG1 3.88Å; Y166-I218 HydrophobicContact CE2-CG2 4.17Å; Y166-I218 HydrophobicContact CG-CG2 4.08Å; I218-S220 VanDerWaalsContact C-N 3.33Å; I218-S220 PolarHBondContact O-N 2.95Å
219	D	74.9	Confident	89.1	Confident	155 Å²	155	67.9 Å²	67.9	83%	0.829	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-87.5	4.3	-176.4	-55.8	-40.3	0	0	0	114.4	D217 G221	D217-D219 PolarHBondContact O-N 3.3Å; D217-D219 VanDerWaalsContact O-N 3.14Å; D219-G221 PolarHBondContact O-N 2.71Å
220	S	72.4	Confident	89.2	Confident	61 Å²	61	71.3 Å²	71.3	43%	0.427	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-72.4	-15.8	-173.5	-55.7	0	0	0	0	113.6	M216 D217 I218	M216-S220 WeakPolarHBondContact CG-OG 3.15Å; D217-S220 PolarHBondContact N-OG 2.8Å; D217-S220 VanDerWaalsContact N-OG 3.09Å; D217-S220 VanDerWaalsContact O-CB 3.23Å; D217-S220 WeakPolarHBondContact O-CB 3.25Å; D217-S220 PolarHBondContact O-N 3.21Å; D217-S220 PolarHBondContact O-OG 3.45Å; I218-S220 VanDerWaalsContact C-N 3.33Å; I218-S220 PolarHBondContact O-N 2.95Å
221	G	77.6	Confident	89.3	Confident	3 Å²	3	72.6 Å²	72.6	3%	0.031	40%	0.402	C	S	.	.			trans	69.4	-128.6	-179.1	0	0	0	0	0	114.3	G138 M216 D219	G138-G221 CarbonylContact O-C 3.59Å; G138-G221 WeakPolarHBondContact O-CA 3.49Å; M216-G221 VanDerWaalsContact SD-O 3.38Å; D219-G221 PolarHBondContact O-N 2.71Å
222	V	85.4	Confident	89.5	Confident	16 Å²	16	68.1 Å²	68.1	10%	0.097	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	122.8	179.2	-173.9	0	0	0	0	110.2	I133 G138 C169 Q171	I133-V222 HydrophobicContact CG2-CG2 3.43Å; I133-V222 VanDerWaalsContact CG2-CG2 3.43Å; G138-V222 VanDerWaalsContact CA-N 3.25Å; G138-V222 PolarHBondContact O-N 2.79Å; C169-V222 HydrophobicContact CB-CB 4.19Å; C169-V222 HydrophobicContact CB-CG1 4.04Å; C169-V222 HydrophobicContact CB-CG2 3.77Å; C169-V222 WeakPolarHBondContact O-CA 3.27Å; Q171-V222 HydrophobicContact CB-CG1 4.12Å; Q171-V222 HydrophobicContact CG-CG1 3.81Å
223	V	90.9	Very high	89.7	Confident	47 Å²	47	67.8 Å²	67.8	29%	0.285	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	131.3	170.2	65.4	0	0	0	0	110.4	C169 A170 Q171 A212 M216 L225	C169-V223 PolarHBondContact O-N 3.17Å; A170-V223 CarbonylContact C-O 3.54Å; A170-V223 WeakPolarHBondContact CA-O 3.41Å; A170-V223 HydrophobicContact CB-CG1 3.59Å; Q171-V223 PolarHBondContact N-O 2.96Å; A212-V223 HydrophobicContact CB-CG1 3.87Å; M216-V223 HydrophobicContact CE-CB 3.55Å; M216-V223 HydrophobicContact CE-CG1 3.47Å; M216-V223 VanDerWaalsContact CE-CG1 3.47Å; V223-L225 HydrophobicContact CG2-CD2 4.07Å
224	T	93.4	Very high	90	Very high	82 Å²	82	72.1 Å²	72.1	50%	0.503	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	123.4	175.5	-56.2	0	0	0	0	110.2	Q171 P173	Q171-T224 HydrophobicContact CG-CG2 4.14Å; Q171-T224 PolarHBondContact NE2-OG1 3.34Å; P173-T224 HydrophobicContact CG-CG2 3.84Å
225	L	94.7	Very high	90.2	Very high	28 Å²	28	67.4 Å²	67.4	15%	0.147	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-102.2	143.4	-177.7	-55.4	175.5	0	0	0	111	A170 Q171 I172 P173 A209 A212 V223 E227	A170-L225 HydrophobicContact CB-CD1 4.29Å; Q171-L225 PolarHBondContact O-N 3.45Å; I172-L225 HydrophobicContact CG1-CB 4.24Å; P173-L225 WeakPolarHBondContact CD-O 3.22Å; A209-L225 VanDerWaalsContact CA-CD1 3.43Å; A209-L225 HydrophobicContact CB-CD1 3.68Å; A212-L225 HydrophobicContact CB-CD1 4.47Å; A212-L225 HydrophobicContact CB-CD2 4.22Å; V223-L225 HydrophobicContact CG2-CD2 4.07Å; L225-E227 HydrophobicContact CB-CG 4.06Å; L225-E227 PolarHBondContact O-N 2.91Å
226	G	94.1	Very high	90.6	Very high	79 Å²	79	62.2 Å²	62.2	81%	0.814	36%	0.361	S	S	*	.			trans	-88.4	29.6	177.4	0	0	0	0	0	113.8
227	E	95.4	Very high	90.8	Very high	72 Å²	72	68.1 Å²	68.1	34%	0.336	39%	0.393	S	S	.	.			trans	-65.4	145.5	-177.9	-64.2	-56.3	144.9	0	0	111.3	I172 P208 L225	I172-E227 HydrophobicContact CD1-CB 3.95Å; I172-E227 HydrophobicContact CD1-CG 4.09Å; I172-E227 HydrophobicContact CG1-CB 4.13Å; I172-E227 HydrophobicContact CG1-CG 4.3Å; I172-E227 HydrophobicContact CG2-CB 4.03Å; P208-E227 HydrophobicContact CB-CG 4.32Å; P208-E227 WeakPolarHBondContact CB-OE1 3.39Å; P208-E227 HydrophobicContact CG-CG 4.44Å; L225-E227 HydrophobicContact CB-CG 4.06Å; L225-E227 PolarHBondContact O-N 2.91Å
228	K	96.2	Very high	91.4	Very high	173 Å²	173	63.8 Å²	63.8	75%	0.752	37%	0.371	S	S	*	.			trans	-107.2	157.4	172.2	-67	-174.1	177.7	-178.8	0	109.6	V230	K228-V230 PolarHBondContact O-N 3.48Å
229	D	96.4	Very high	92.3	Very high	61 Å²	61	63.3 Å²	63.3	33%	0.326	37%	0.367	S	S	.	.			trans	-59.2	139	168.7	62.2	-75.7	0	0	0	110.2	H202 I203 W204 F231 T232	H202-D229 HydrophobicContact CB-CB 4.22Å; I203-D229 CarbonylContact O-C 3.55Å; I203-D229 WeakPolarHBondContact O-CA 3.32Å; W204-D229 HydrophobicContact CD2-CB 4.27Å; W204-D229 HydrophobicContact CE3-CB 4.27Å; W204-D229 HydrophobicContact CH2-CB 4.21Å; W204-D229 HydrophobicContact CZ2-CB 4.19Å; W204-D229 HydrophobicContact CZ3-CB 4.26Å; D229-F231 VanDerWaalsContact C-N 3.33Å; D229-T232 VanDerWaalsContact CG-OG1 3.22Å; D229-T232 PolarHBondContact OD2-OG1 2.94Å
230	V	96.6	Very high	93.4	Very high	74 Å²	74	56 Å²	56	45%	0.448	33%	0.327	S	S	.	.	S	Bend	trans	-75.3	-31.4	173.3	-179.6	0	0	0	0	110	I203 N205 K228 W273	I203-V230 PolarHBondContact O-N 3.05Å; N205-V230 HydrophobicContact CB-CG2 3.92Å; K228-V230 PolarHBondContact O-N 3.48Å; V230-W273 HydrophobicContact CG1-CZ3 4.22Å
231	F	97.7	Very high	94.6	Very high	41 Å²	41	55.5 Å²	55.5	18%	0.18	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	144.5	179.2	-171.2	-85.9	0	0	0	110.8	H202 I203 D229 F233 W265 W273 V275	H202-F231 CarbonylContact C-O 3.58Å; H202-F231 WeakPolarHBondContact CA-O 3.46Å; I203-F231 HydrophobicContact CB-CB 4.19Å; I203-F231 HydrophobicContact CG1-CB 4.18Å; I203-F231 PolarHBondContact N-O 2.87Å; I203-F231 PolarHBondContact O-N 3.02Å; D229-F231 VanDerWaalsContact C-N 3.33Å; F231-F233 HydrophobicContact CE1-CB 4.24Å; F231-W265 HydrophobicContact CD1-CE3 4.43Å; F231-W265 HydrophobicContact CD1-CH2 4.18Å; F231-W265 AromaticContact CD1-CZ3 3.48Å; F231-W265 HydrophobicContact CD1-CZ3 3.48Å; F231-W265 VanDerWaalsContact CD1-CZ3 3.48Å; F231-W265 HydrophobicContact CE1-CE3 4.18Å; F231-W265 HydrophobicContact CE1-CH2 4.05Å; F231-W265 AromaticContact CE1-CZ3 3.42Å; F231-W265 HydrophobicContact CE1-CZ3 3.42Å; F231-W265 VanDerWaalsContact CE1-CZ3 3.42Å; F231-W273 HydrophobicContact CB-CE3 4.1Å; F231-W273 HydrophobicContact CD1-CB 4.14Å; F231-W273 HydrophobicContact CD2-CB 4.16Å; F231-W273 HydrophobicContact CE1-CB 4.08Å; F231-W273 HydrophobicContact CE2-CB 4.1Å; F231-W273 WeakPolarHBondContact CE2-O 3.21Å; F231-W273 HydrophobicContact CG-CB 4.16Å; F231-W273 HydrophobicContact CG-CE3 4.44Å; F231-W273 HydrophobicContact CZ-CB 4.05Å; F231-W273 VanDerWaalsContact CZ-O 3.23Å; F231-W273 WeakPolarHBondContact CZ-O 3.16Å; F231-V275 HydrophobicContact CE1-CG2 4.08Å; F231-V275 HydrophobicContact CZ-CG2 4.32Å
232	T	97.6	Very high	95.6	Very high	47 Å²	47	55.4 Å²	55.4	29%	0.288	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	133.2	172.5	-68.4	0	0	0	0	110.8	V201 H202 D229 T234	V201-T232 CarbonylContact O-C 3.58Å; V201-T232 WeakPolarHBondContact O-CA 3.28Å; H202-T232 PolarHBondContact CE1-OG1 2.81Å; H202-T232 WeakPolarHBondContact ND1-CG2 3.46Å; H202-T232 PolarHBondContact ND1-OG1 3.17Å; D229-T232 VanDerWaalsContact CG-OG1 3.22Å; D229-T232 PolarHBondContact OD2-OG1 2.94Å; T232-T234 HydrophobicContact CG2-CG2 3.86Å
233	F	97.8	Very high	96.3	Very high	11 Å²	11	54.6 Å²	54.6	5%	0.048	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	136.8	165.9	-179.5	-124.2	0	0	0	111.1	V201 F231 H236 H263 W265 V275	V201-F233 HydrophobicContact CB-CB 4.49Å; V201-F233 HydrophobicContact CG2-CD1 4.31Å; V201-F233 PolarHBondContact N-O 2.78Å; V201-F233 VanDerWaalsContact N-O 3.1Å; V201-F233 PolarHBondContact O-N 2.83Å; F231-F233 HydrophobicContact CE1-CB 4.24Å; F233-H236 AromaticContact CD1-CD2 3.74Å; F233-H236 AromaticContact CE1-CD2 3.44Å; F233-H236 VanDerWaalsContact CE1-CD2 3.44Å; F233-H236 WeakPolarHBondContact CE1-CD2 3.44Å; F233-H236 AromaticContact CE1-NE2 3.85Å; F233-H263 HydrophobicContact CE1-CB 4.13Å; F233-H263 AromaticContact CE1-CD2 3.98Å; F233-H263 AromaticContact CE1-CG 3.83Å; F233-H263 HydrophobicContact CZ-CB 4.49Å; F233-H263 AromaticContact CZ-CD2 3.62Å; F233-H263 AromaticContact CZ-CG 3.96Å; F233-H263 AromaticContact CZ-NE2 3.88Å; F233-W265 HydrophobicContact CB-CH2 3.03Å; F233-W265 HydrophobicContact CB-CZ2 3.26Å; F233-W265 HydrophobicContact CB-CZ3 3.97Å; F233-W265 HydrophobicContact CD1-CH2 4.25Å; F233-W265 AromaticContact CD1-CZ2 3.53Å; F233-W265 HydrophobicContact CD1-CZ2 3.53Å; F233-W265 AromaticContact CG-CH2 3.94Å; F233-W265 HydrophobicContact CG-CH2 3.94Å; F233-W265 AromaticContact CG-CZ2 3.67Å; F233-W265 HydrophobicContact CG-CZ2 3.67Å; F233-V275 HydrophobicContact CB-CG2 4.33Å; F233-V275 HydrophobicContact CD1-CG1 4.18Å; F233-V275 HydrophobicContact CD2-CB 4.01Å; F233-V275 HydrophobicContact CD2-CG1 4.06Å; F233-V275 HydrophobicContact CD2-CG2 3.97Å; F233-V275 HydrophobicContact CE1-CG1 3.89Å; F233-V275 HydrophobicContact CE2-CB 3.99Å; F233-V275 HydrophobicContact CE2-CG1 3.8Å; F233-V275 HydrophobicContact CE2-CG2 4.46Å; F233-V275 HydrophobicContact CG-CB 4.47Å; F233-V275 HydrophobicContact CG-CG1 4.25Å; F233-V275 HydrophobicContact CG-CG2 4.12Å; F233-V275 HydrophobicContact CZ-CB 4.4Å; F233-V275 HydrophobicContact CZ-CG1 3.69Å
234	T	96.9	Very high	96.6	Very high	93 Å²	93	52.8 Å²	52.8	57%	0.571	30%	0.3	S	S	*	.			trans	-126.5	18.4	-177.7	55.8	0	0	0	0	112.4	K200 T232	K200-T234 HydrophobicContact CD-CG2 4.24Å; K200-T234 HydrophobicContact CG-CG2 4.16Å; T232-T234 HydrophobicContact CG2-CG2 3.86Å
235	G	95.7	Very high	96.9	Very high	26 Å²	26	49.3 Å²	49.3	27%	0.268	28%	0.278	S	S	.	.			trans	-83.8	-17	-178.6	0	0	0	0	0	114.5
236	H	96.9	Very high	97	Very high	7 Å²	7	48.1 Å²	48.1	3%	0.032	27%	0.272	C	S	.	.			trans	-70.7	127.6	165.9	-73.8	-73.1	0	0	0	109.3	W195 G199 F233 T255 D257 N261 H263	W195-H236 HydrophobicContact CH2-CB 4.41Å; W195-H236 AromaticContact CH2-CD2 3.16Å; W195-H236 WeakPolarHBondContact CH2-CD2 3.02Å; W195-H236 AromaticContact CH2-CE1 3.38Å; W195-H236 WeakPolarHBondContact CH2-CE1 3.41Å; W195-H236 AromaticContact CH2-CG 3.52Å; W195-H236 AromaticContact CH2-ND1 3.68Å; W195-H236 AromaticContact CH2-NE2 3.15Å; W195-H236 WeakPolarHBondContact CH2-NE2 3.31Å; W195-H236 AromaticContact CZ3-CD2 3.48Å; W195-H236 VanDerWaalsContact CZ3-CD2 3.48Å; W195-H236 WeakPolarHBondContact CZ3-CD2 3.15Å; W195-H236 AromaticContact CZ3-NE2 3.53Å; G199-H236 WeakPolarHBondContact O-CB 3.32Å; F233-H236 AromaticContact CD1-CD2 3.74Å; F233-H236 AromaticContact CE1-CD2 3.44Å; F233-H236 VanDerWaalsContact CE1-CD2 3.44Å; F233-H236 WeakPolarHBondContact CE1-CD2 3.44Å; F233-H236 AromaticContact CE1-NE2 3.85Å; H236-T255 PolarHBondContact NE2-OG1 2.82Å; H236-T255 VanDerWaalsContact NE2-OG1 3.11Å; H236-D257 IonicContact CE1-OD2 2.93Å; H236-D257 IonicContact CG-OD2 3.72Å; H236-D257 VanDerWaalsContact ND1-CB 3.34Å; H236-D257 WeakPolarHBondContact ND1-CB 2.98Å; H236-D257 VanDerWaalsContact ND1-CG 3.32Å; H236-D257 IonicContact ND1-OD2 2.75Å; H236-D257 PolarHBondContact ND1-OD2 2.9Å; H236-N261 PolarHBondContact CE1-O 2.87Å; H236-H263 AromaticContact CD2-ND1 3.85Å; H236-H263 AromaticContact CE1-CE1 3.65Å; H236-H263 AromaticContact CE1-CG 3.97Å; H236-H263 AromaticContact CE1-ND1 2.92Å; H236-H263 PolarHBondContact CE1-ND1 3.4Å; H236-H263 AromaticContact ND1-CE1 3.8Å; H236-H263 AromaticContact ND1-ND1 3.52Å; H236-H263 AromaticContact NE2-CE1 3.94Å; H236-H263 AromaticContact NE2-CG 3.72Å; H236-H263 AromaticContact NE2-ND1 3.04Å; H236-H263 PolarHBondContact NE2-ND1 2.92Å
237	L	93.6	Very high	97.1	Very high	141 Å²	141	48.6 Å²	48.6	74%	0.738	26%	0.259	S	S	*	.	S	Bend	trans	-94.8	-5.7	-175.2	-60	-177.1	0	0	0	113.2
238	V	97.1	Very high	97.1	Very high	35 Å²	35	48.2 Å²	48.2	21%	0.212	26%	0.259	C	S	.	.	S	Bend	trans	-142.3	167.3	176.7	-66.6	0	0	0	0	107.8	G199 D257 C258 R259	G199-V238 WeakPolarHBondContact CA-O 3.43Å; V238-D257 HydrophobicContact CG2-CB 4.05Å; V238-C258 HydrophobicContact CG2-CB 4.22Å; V238-R259 HydrophobicContact CG1-CG 4.15Å; V238-R259 HydrophobicContact CG2-CB 3.85Å; V238-R259 HydrophobicContact CG2-CG 3.69Å
239	E	97.2	Very high	97.1	Very high	78 Å²	78	41.7 Å²	41.7	36%	0.364	23%	0.234	S	C	.	.			trans	-67.4	-177.4	171.3	72.8	-177.7	131.6	0	0	113.1	N179 A197 D257 C258	N179-E239 PolarHBondContact ND2-OE2 2.82Å; A197-E239 WeakPolarHBondContact O-CB 3.29Å; E239-D257 WeakPolarHBondContact O-CB 3.34Å; E239-C258 PolarHBondContact O-N 2.87Å; E239-C258 PolarHBondContact O-SG 2.8Å
240	G	98.2	Very high	97	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.245	C	C	.	.			trans	-176.4	-174.4	-176.8	0	0	0	0	0	110.3	N179 W195	N179-G240 WeakPolarHBondContact CB-O 3.2Å; N179-G240 PolarHBondContact ND2-O 2.78Å; W195-G240 PolarHBondContact NE1-O 3.01Å
241	F	98.1	Very high	97	Very high	52 Å²	52	39.4 Å²	39.4	23%	0.228	22%	0.224	C	C	.	.			trans	-139.4	-31.5	-177.2	-60.4	-88.1	0	0	0	111.4	L74 N179 R180 M243	L74-F241 HydrophobicContact CD2-CD1 3.92Å; L74-F241 HydrophobicContact CD2-CE1 3.67Å; N179-F241 HydrophobicContact CB-CD1 3.64Å; N179-F241 HydrophobicContact CB-CE1 3.69Å; N179-F241 WeakPolarHBondContact ND2-CE1 3.46Å; R180-F241 VanDerWaalsContact CB-O 3.28Å; R180-F241 WeakPolarHBondContact CB-O 3.28Å; R180-F241 WeakPolarHBondContact CD-O 3.29Å; R180-F241 PolarHBondContact NE-O 2.76Å; R180-F241 VanDerWaalsContact NE-O 3.12Å; F241-M243 PolarHBondContact O-N 3.48Å
242	A	98.7	Very high	97	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.223	C	C	.	.			trans	-68.4	118.7	-176.4	0	0	0	0	0	113.6	T255 G256 V287 E288 I290	A242-T255 CarbonylContact O-C 3.17Å; A242-T255 WeakPolarHBondContact O-CA 3.4Å; A242-G256 PolarHBondContact O-N 3.16Å; A242-V287 HydrophobicContact CB-CB 4.37Å; A242-V287 HydrophobicContact CB-CG1 3.74Å; A242-V287 WeakPolarHBondContact CB-O 3.19Å; A242-E288 PolarHBondContact N-O 2.88Å; A242-I290 HydrophobicContact CB-CB 4.24Å; A242-I290 HydrophobicContact CB-CD1 3.82Å; A242-I290 HydrophobicContact CB-CG1 3.85Å
243	M	98.7	Very high	97.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	131.8	177.1	179.7	167.4	69.1	0	0	110.8	R180 R182 A193 W195 V201 F241 L253 A254 T255	R180-M243 HydrophobicContact CB-CB 4.47Å; R180-M243 HydrophobicContact CB-CE 4.05Å; R180-M243 HydrophobicContact CG-CB 4.2Å; R180-M243 HydrophobicContact CG-CE 4.02Å; R180-M243 WeakPolarHBondContact O-CE 3.39Å; R182-M243 HydrophobicContact CB-CE 4.25Å; R182-M243 HydrophobicContact CG-CE 4.2Å; R182-M243 HydrophobicContact CG-CG 4.4Å; R182-M243 WeakPolarHBondContact CG-O 3.21Å; A193-M243 HydrophobicContact CB-CE 3.92Å; A193-M243 HydrophobicContact CB-SD 3.5Å; A193-M243 VanDerWaalsContact CB-SD 3.5Å; A193-M243 WeakPolarHBondContact O-CE 3.42Å; W195-M243 HydrophobicContact CB-CE 4.01Å; W195-M243 HydrophobicContact CB-SD 4.12Å; V201-M243 HydrophobicContact CG1-SD 4.04Å; F241-M243 PolarHBondContact O-N 3.48Å; M243-L253 HydrophobicContact CG-CD1 3.68Å; M243-L253 HydrophobicContact CG-CD2 4.36Å; M243-L253 HydrophobicContact CG-CG 4.33Å; M243-L253 HydrophobicContact SD-CD1 4.4Å; M243-L253 HydrophobicContact SD-CD2 4.27Å; M243-A254 WeakPolarHBondContact CA-O 3.19Å; M243-T255 HydrophobicContact CB-CG2 4.42Å; M243-T255 HydrophobicContact CG-CG2 4Å; M243-T255 HydrophobicContact SD-CG2 4.35Å
244	D	98.7	Very high	97.1	Very high	9 Å²	9	36.8 Å²	36.8	5%	0.048	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	144.9	173.3	-169.3	42.5	0	0	0	112.8	L253 A254 I290 R291 W292	D244-L253 WeakPolarHBondContact O-CD1 3.2Å; D244-A254 PolarHBondContact N-O 3.04Å; D244-A254 VanDerWaalsContact N-O 3.15Å; D244-A254 PolarHBondContact O-N 2.88Å; D244-I290 HydrophobicContact CB-CG2 4.35Å; D244-I290 WeakPolarHBondContact CB-O 3.37Å; D244-R291 IonicContact OD1-NH1 3.99Å; D244-R291 WeakPolarHBondContact OD2-CA 3.46Å; D244-W292 PolarHBondContact O-NE1 3.07Å; D244-W292 PolarHBondContact OD2-N 3Å
245	W	98.4	Very high	97.2	Very high	8 Å²	8	32.4 Å²	32.4	3%	0.03	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	142.3	173.4	-70.1	107.9	0	0	0	110.5	R182 T184 A193 I203 T247 L253 W273	R182-W245 PolarHBondContact O-NE1 2.69Å; T184-W245 HydrophobicContact CG2-CD2 3.61Å; T184-W245 HydrophobicContact CG2-CE3 3.92Å; T184-W245 HydrophobicContact CG2-CG 4.05Å; T184-W245 HydrophobicContact CG2-CH2 4.19Å; T184-W245 HydrophobicContact CG2-CZ2 3.84Å; T184-W245 HydrophobicContact CG2-CZ3 4.22Å; A193-W245 HydrophobicContact CB-CZ2 3.7Å; I203-W245 HydrophobicContact CD1-CH2 3.8Å; I203-W245 HydrophobicContact CD1-CZ2 3.76Å; W245-T247 PolarHBondContact O-N 3.16Å; W245-L253 HydrophobicContact CB-CD1 4.49Å; W245-L253 HydrophobicContact CD2-CB 4.12Å; W245-L253 HydrophobicContact CD2-CD1 3.55Å; W245-L253 HydrophobicContact CD2-CG 4.37Å; W245-L253 HydrophobicContact CE3-CB 3.63Å; W245-L253 HydrophobicContact CE3-CD1 3.99Å; W245-L253 HydrophobicContact CE3-CG 4.37Å; W245-L253 HydrophobicContact CG-CD1 3.78Å; W245-L253 HydrophobicContact CH2-CB 4.15Å; W245-L253 HydrophobicContact CH2-CD2 4.41Å; W245-L253 HydrophobicContact CZ2-CD1 4.31Å; W245-L253 HydrophobicContact CZ2-CD2 4.41Å; W245-L253 HydrophobicContact CZ3-CB 3.63Å; W245-L253 HydrophobicContact CZ3-CD1 4.49Å; W245-L253 HydrophobicContact CZ3-CG 4.48Å; W245-W273 HydrophobicContact CH2-CZ2 4.14Å; W245-W273 AromaticContact CH2-NE1 3.77Å; W245-W273 AromaticContact CZ3-NE1 3.76Å
246	S	98.1	Very high	97.3	Very high	3 Å²	3	31.1 Å²	31.1	2%	0.021	17%	0.167	C	C	.	.			trans	-70.9	125.2	167.3	-175.9	0	0	0	0	109.7	L248 T249 R252 W292	S246-L248 PolarHBondContact O-N 2.78Å; S246-L248 PolarHBondContact OG-N 3.46Å; S246-T249 PolarHBondContact OG-N 3.48Å; S246-T249 VanDerWaalsContact OG-N 3.17Å; S246-R252 PolarHBondContact N-O 2.88Å; S246-W292 VanDerWaalsContact N-CD1 3.34Å
247	T	94.5	Very high	97.4	Very high	90 Å²	90	30.8 Å²	30.8	55%	0.552	17%	0.166	S	C	*	.	S	Bend	trans	-76.6	-12.6	172.2	58.4	0	0	0	0	112.9	W245 K294	W245-T247 PolarHBondContact O-N 3.16Å; T247-K294 HydrophobicContact CG2-CD 4.34Å
248	L	95.8	Very high	97.6	Very high	63 Å²	63	26.4 Å²	26.4	33%	0.33	15%	0.146	S	C	.	.	S	Bend	trans	-104.6	-25.9	-175.7	-58	177.9	0	0	0	113.6	S246 S295 N297	S246-L248 PolarHBondContact O-N 2.78Å; S246-L248 PolarHBondContact OG-N 3.46Å; L248-S295 VanDerWaalsContact CD1-C 3.47Å; L248-N297 WeakPolarHBondContact CB-OD1 3.13Å; L248-N297 PolarHBondContact O-OD1 2.87Å
249	T	96.5	Very high	97.6	Very high	36 Å²	36	32.5 Å²	32.5	22%	0.221	17%	0.165	C	C	.	.	S	Bend	trans	-121.8	103	176.8	-59	0	0	0	0	109.7	S246 G251 R252 N297	S246-T249 PolarHBondContact OG-N 3.48Å; S246-T249 VanDerWaalsContact OG-N 3.17Å; T249-G251 PolarHBondContact O-N 3.33Å; T249-R252 HydrophobicContact CG2-CB 4.04Å; T249-R252 VanDerWaalsContact O-CB 3.31Å; T249-R252 WeakPolarHBondContact O-CB 3.34Å; T249-R252 PolarHBondContact O-N 2.96Å; T249-R252 VanDerWaalsContact O-N 3.15Å; T249-N297 PolarHBondContact OG1-OD1 3.34Å
250	P	94.8	Very high	97.7	Very high	87 Å²	87	29.3 Å²	29.3	57%	0.565	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.2	133.4	-178.3	-29.2	35.5	0	0	0	113.2	R252	P250-R252 PolarHBondContact O-N 2.95Å
251	G	96.1	Very high	97.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.7	9.1	177.7	0	0	0	0	0	115.8	I186 T249 L267 W273	I186-G251 VanDerWaalsContact CD1-CA 3.4Å; T249-G251 PolarHBondContact O-N 3.33Å; G251-L267 PolarHBondContact O-N 3.28Å; G251-W273 PolarHBondContact O-NE1 3.15Å; G251-W273 VanDerWaalsContact O-NE1 3.09Å
252	R	97.8	Very high	97.7	Very high	45 Å²	45	27.7 Å²	27.7	17%	0.17	15%	0.146	C	C	.	.			trans	-87.7	123.1	169.6	178.6	177.5	-66	-168.9	-5.6	110.1	S246 T249 P250 W265 W292 N297 N298	S246-R252 PolarHBondContact N-O 2.88Å; T249-R252 HydrophobicContact CG2-CB 4.04Å; T249-R252 VanDerWaalsContact O-CB 3.31Å; T249-R252 WeakPolarHBondContact O-CB 3.34Å; T249-R252 PolarHBondContact O-N 2.96Å; T249-R252 VanDerWaalsContact O-N 3.15Å; P250-R252 PolarHBondContact O-N 2.95Å; R252-W265 WeakPolarHBondContact CA-O 3.17Å; R252-W292 HydrophobicContact CG-CH2 3.78Å; R252-W292 HydrophobicContact CG-CZ2 3.54Å; R252-W292 HydrophobicContact CG-CZ3 4.46Å; R252-N297 PolarHBondContact NH1-O 2.83Å; R252-N298 PolarHBondContact NH1-OD1 2.9Å
253	L	98.7	Very high	97.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	148.2	177.9	-177.2	75.4	0	0	0	108.9	A193 I203 M243 D244 W245 T255 W265	A193-L253 HydrophobicContact CB-CD1 4.45Å; A193-L253 HydrophobicContact CB-CD2 4.07Å; I203-L253 HydrophobicContact CD1-CD2 4.28Å; M243-L253 HydrophobicContact CG-CD1 3.68Å; M243-L253 HydrophobicContact CG-CD2 4.36Å; M243-L253 HydrophobicContact CG-CG 4.33Å; M243-L253 HydrophobicContact SD-CD1 4.4Å; M243-L253 HydrophobicContact SD-CD2 4.27Å; D244-L253 WeakPolarHBondContact O-CD1 3.2Å; W245-L253 HydrophobicContact CB-CD1 4.49Å; W245-L253 HydrophobicContact CD2-CB 4.12Å; W245-L253 HydrophobicContact CD2-CD1 3.55Å; W245-L253 HydrophobicContact CD2-CG 4.37Å; W245-L253 HydrophobicContact CE3-CB 3.63Å; W245-L253 HydrophobicContact CE3-CD1 3.99Å; W245-L253 HydrophobicContact CE3-CG 4.37Å; W245-L253 HydrophobicContact CG-CD1 3.78Å; W245-L253 HydrophobicContact CH2-CB 4.15Å; W245-L253 HydrophobicContact CH2-CD2 4.41Å; W245-L253 HydrophobicContact CZ2-CD1 4.31Å; W245-L253 HydrophobicContact CZ2-CD2 4.41Å; W245-L253 HydrophobicContact CZ3-CB 3.63Å; W245-L253 HydrophobicContact CZ3-CD1 4.49Å; W245-L253 HydrophobicContact CZ3-CG 4.48Å; L253-T255 HydrophobicContact CD2-CG2 3.59Å; L253-T255 HydrophobicContact CG-CG2 3.79Å; L253-W265 HydrophobicContact CB-CB 3.79Å; L253-W265 HydrophobicContact CB-CG 4.05Å; L253-W265 HydrophobicContact CD2-CD2 4.17Å; L253-W265 HydrophobicContact CD2-CG 4.24Å; L253-W265 HydrophobicContact CG-CG 4.49Å; L253-W265 PolarHBondContact N-O 3.22Å; L253-W265 WeakPolarHBondContact O-CB 3.32Å; L253-W265 PolarHBondContact O-N 2.84Å
254	A	98.7	Very high	97.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	143.7	166.6	0	0	0	0	0	108.9	M243 D244 L264 I290 W292	M243-A254 WeakPolarHBondContact CA-O 3.19Å; D244-A254 PolarHBondContact N-O 3.04Å; D244-A254 VanDerWaalsContact N-O 3.15Å; D244-A254 PolarHBondContact O-N 2.88Å; A254-L264 HydrophobicContact CB-CD2 3.68Å; A254-I290 HydrophobicContact CB-CD1 4.46Å; A254-I290 HydrophobicContact CB-CG2 3.81Å; A254-W292 HydrophobicContact CB-CZ2 3.71Å
255	T	98.8	Very high	97.6	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	138.7	-175.6	67.3	0	0	0	0	113.6	W195 V201 H236 A242 M243 L253 I262 H263 W265	W195-T255 HydrophobicContact CE3-CG2 3.9Å; W195-T255 HydrophobicContact CZ3-CG2 3.69Å; W195-T255 VanDerWaalsContact CZ3-OG1 3.3Å; W195-T255 WeakPolarHBondContact CZ3-OG1 3.33Å; V201-T255 HydrophobicContact CG1-CG2 4.35Å; H236-T255 PolarHBondContact NE2-OG1 2.82Å; H236-T255 VanDerWaalsContact NE2-OG1 3.11Å; A242-T255 CarbonylContact O-C 3.17Å; A242-T255 WeakPolarHBondContact O-CA 3.4Å; M243-T255 HydrophobicContact CB-CG2 4.42Å; M243-T255 HydrophobicContact CG-CG2 4Å; M243-T255 HydrophobicContact SD-CG2 4.35Å; L253-T255 HydrophobicContact CD2-CG2 3.59Å; L253-T255 HydrophobicContact CG-CG2 3.79Å; T255-I262 CarbonylContact O-C 3.53Å; T255-I262 WeakPolarHBondContact O-CA 3.29Å; T255-H263 PolarHBondContact N-O 2.96Å; T255-H263 PolarHBondContact O-N 3.01Å; T255-W265 PolarHBondContact OG1-NE1 2.84Å
256	G	98.6	Very high	97.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	144.6	-173.1	0	0	0	0	0	113.5	W195 A242 N261	W195-G256 VanDerWaalsContact CH2-O 3.31Å; W195-G256 WeakPolarHBondContact CH2-O 3.3Å; W195-G256 WeakPolarHBondContact CZ2-O 3.3Å; A242-G256 PolarHBondContact O-N 3.16Å; G256-N261 VanDerWaalsContact CA-O 3.28Å; G256-N261 WeakPolarHBondContact CA-O 3.39Å
257	D	98.5	Very high	97.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.187	C	C	.	.			trans	-117.7	171	-179.8	71.4	23.3	0	0	0	114.8	W195 H236 V238 E239 R259 A260 N261 V287	W195-D257 HydrophobicContact CH2-CB 4.43Å; W195-D257 HydrophobicContact CZ2-CB 3.98Å; H236-D257 IonicContact CE1-OD2 2.93Å; H236-D257 IonicContact CG-OD2 3.72Å; H236-D257 VanDerWaalsContact ND1-CB 3.34Å; H236-D257 WeakPolarHBondContact ND1-CB 2.98Å; H236-D257 VanDerWaalsContact ND1-CG 3.32Å; H236-D257 IonicContact ND1-OD2 2.75Å; H236-D257 PolarHBondContact ND1-OD2 2.9Å; V238-D257 HydrophobicContact CG2-CB 4.05Å; E239-D257 WeakPolarHBondContact O-CB 3.34Å; D257-R259 PolarHBondContact O-N 2.86Å; D257-R259 VanDerWaalsContact OD1-CA 3.27Å; D257-R259 WeakPolarHBondContact OD1-CA 3.48Å; D257-R259 PolarHBondContact OD1-N 2.83Å; D257-A260 PolarHBondContact O-N 3.05Å; D257-A260 PolarHBondContact OD1-N 2.78Å; D257-N261 PolarHBondContact N-O 3.37Å; D257-N261 WeakPolarHBondContact OD1-CB 3.45Å; D257-N261 PolarHBondContact OD1-N 2.88Å; D257-N261 PolarHBondContact OD1-ND2 2.97Å; D257-N261 WeakPolarHBondContact OD2-CB 3.29Å; D257-N261 PolarHBondContact OD2-ND2 2.95Å; D257-V287 PolarHBondContact O-N 3.32Å; D257-V287 VanDerWaalsContact O-N 3.14Å
258	C	98.2	Very high	97.6	Very high	48 Å²	48	34.2 Å²	34.2	32%	0.324	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	3.9	178.3	-61.7	0	0	0	0	114.5	V238 E239 S286	V238-C258 HydrophobicContact CG2-CB 4.22Å; E239-C258 PolarHBondContact O-N 2.87Å; E239-C258 PolarHBondContact O-SG 2.8Å; C258-S286 WeakPolarHBondContact CA-OG 3.19Å; C258-S286 PolarHBondContact SG-OG 2.73Å
259	R	97.5	Very high	97.3	Very high	163 Å²	163	40.6 Å²	40.6	62%	0.615	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119	32.9	174.5	-81	-176.8	177.6	-175.8	2.9	111.7	V238 D257 N261	V238-R259 HydrophobicContact CG1-CG 4.15Å; V238-R259 HydrophobicContact CG2-CB 3.85Å; V238-R259 HydrophobicContact CG2-CG 3.69Å; D257-R259 PolarHBondContact O-N 2.86Å; D257-R259 VanDerWaalsContact OD1-CA 3.27Å; D257-R259 WeakPolarHBondContact OD1-CA 3.48Å; D257-R259 PolarHBondContact OD1-N 2.83Å; R259-N261 WeakPolarHBondContact CB-ND2 3.2Å; R259-N261 PolarHBondContact O-N 2.87Å; R259-N261 VanDerWaalsContact O-N 3.12Å; R259-N261 PolarHBondContact O-ND2 3.36Å
260	A	97.9	Very high	97	Very high	12 Å²	12	42.6 Å²	42.6	10%	0.099	23%	0.228	C	C	.	.	S	Bend	trans	64.3	10.3	174.1	0	0	0	0	0	115.5	D257 H283 G285	D257-A260 PolarHBondContact O-N 3.05Å; D257-A260 PolarHBondContact OD1-N 2.78Å; A260-H283 HydrophobicContact CB-CB 4.06Å; A260-H283 VanDerWaalsContact CB-O 3.28Å; A260-H283 WeakPolarHBondContact CB-O 3.15Å; A260-G285 VanDerWaalsContact CA-O 3.31Å; A260-G285 WeakPolarHBondContact CA-O 3.23Å; A260-G285 WeakPolarHBondContact CB-O 3.36Å; A260-G285 PolarHBondContact N-O 3.11Å
261	N	98	Very high	96.8	Very high	16 Å²	16	40.7 Å²	40.7	9%	0.086	23%	0.225	C	C	.	.			trans	-89.9	124.6	-175.4	-52.8	-74.8	0	0	0	110.1	H236 G256 D257 R259 A279 K281	H236-N261 PolarHBondContact CE1-O 2.87Å; G256-N261 VanDerWaalsContact CA-O 3.28Å; G256-N261 WeakPolarHBondContact CA-O 3.39Å; D257-N261 PolarHBondContact N-O 3.37Å; D257-N261 WeakPolarHBondContact OD1-CB 3.45Å; D257-N261 PolarHBondContact OD1-N 2.88Å; D257-N261 PolarHBondContact OD1-ND2 2.97Å; D257-N261 WeakPolarHBondContact OD2-CB 3.29Å; D257-N261 PolarHBondContact OD2-ND2 2.95Å; R259-N261 WeakPolarHBondContact CB-ND2 3.2Å; R259-N261 PolarHBondContact O-N 2.87Å; R259-N261 VanDerWaalsContact O-N 3.12Å; R259-N261 PolarHBondContact O-ND2 3.36Å; N261-A279 HydrophobicContact CB-CB 3.63Å; N261-K281 WeakPolarHBondContact OD1-CD 3.42Å; N261-K281 WeakPolarHBondContact OD1-CE 3.44Å; N261-K281 PolarHBondContact OD1-NZ 2.64Å
262	I	98.7	Very high	96.7	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	121.6	169.4	-55.8	175.1	0	0	0	109.8	T255 A279 F280 V287 I290 F300 W312	T255-I262 CarbonylContact O-C 3.53Å; T255-I262 WeakPolarHBondContact O-CA 3.29Å; I262-A279 CarbonylContact O-C 3.48Å; I262-A279 WeakPolarHBondContact O-CA 3.46Å; I262-F280 HydrophobicContact CB-CB 4.2Å; I262-F280 PolarHBondContact N-O 3.16Å; I262-F280 PolarHBondContact O-N 2.83Å; I262-V287 HydrophobicContact CD1-CG1 4.14Å; I262-V287 HydrophobicContact CD1-CG2 4.19Å; I262-V287 HydrophobicContact CG1-CG1 4.21Å; I262-V287 HydrophobicContact CG1-CG2 3.91Å; I262-I290 HydrophobicContact CD1-CD1 4.26Å; I262-I290 HydrophobicContact CG1-CD1 4.17Å; I262-I290 HydrophobicContact CG2-CD1 3.79Å; I262-F300 HydrophobicContact CD1-CE2 4.33Å; I262-F300 HydrophobicContact CG2-CE2 3.99Å; I262-F300 HydrophobicContact CG2-CZ 4.05Å; I262-W312 HydrophobicContact CD1-CH2 4.35Å; I262-W312 HydrophobicContact CD1-CZ2 3.69Å
263	H	98.5	Very high	96.7	Very high	10 Å²	10	42.3 Å²	42.3	5%	0.046	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	139.6	175	-66.3	85.3	0	0	0	110.9	F233 H236 T255 V275 D276	F233-H263 HydrophobicContact CE1-CB 4.13Å; F233-H263 AromaticContact CE1-CD2 3.98Å; F233-H263 AromaticContact CE1-CG 3.83Å; F233-H263 HydrophobicContact CZ-CB 4.49Å; F233-H263 AromaticContact CZ-CD2 3.62Å; F233-H263 AromaticContact CZ-CG 3.96Å; F233-H263 AromaticContact CZ-NE2 3.88Å; H236-H263 AromaticContact CD2-ND1 3.85Å; H236-H263 AromaticContact CE1-CE1 3.65Å; H236-H263 AromaticContact CE1-CG 3.97Å; H236-H263 AromaticContact CE1-ND1 2.92Å; H236-H263 PolarHBondContact CE1-ND1 3.4Å; H236-H263 AromaticContact ND1-CE1 3.8Å; H236-H263 AromaticContact ND1-ND1 3.52Å; H236-H263 AromaticContact NE2-CE1 3.94Å; H236-H263 AromaticContact NE2-CG 3.72Å; H236-H263 AromaticContact NE2-ND1 3.04Å; H236-H263 PolarHBondContact NE2-ND1 2.92Å; T255-H263 PolarHBondContact N-O 2.96Å; T255-H263 PolarHBondContact O-N 3.01Å; H263-V275 HydrophobicContact CB-CG1 3.82Å; H263-D276 PolarHBondContact CD2-O 2.87Å
264	L	98.3	Very high	96.6	Very high	25 Å²	25	48.1 Å²	48.1	13%	0.131	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	136.2	176.3	-66.9	-175.7	0	0	0	111	A254 V275 D276 F280 W292 F300 A314	A254-L264 HydrophobicContact CB-CD2 3.68Å; L264-V275 WeakPolarHBondContact O-CA 3.32Å; L264-D276 PolarHBondContact O-N 2.61Å; L264-F280 HydrophobicContact CD1-CE1 4.2Å; L264-F280 HydrophobicContact CD1-CE2 3.61Å; L264-F280 HydrophobicContact CD1-CZ 3.36Å; L264-F280 HydrophobicContact CG-CE2 4.16Å; L264-F280 HydrophobicContact CG-CZ 4.15Å; L264-W292 HydrophobicContact CD2-CH2 4.13Å; L264-W292 HydrophobicContact CD2-CZ2 3.94Å; L264-F300 HydrophobicContact CD1-CE1 4.38Å; L264-F300 HydrophobicContact CD2-CD1 4.44Å; L264-F300 HydrophobicContact CD2-CE1 3.73Å; L264-F300 HydrophobicContact CD2-CZ 4Å; L264-A314 HydrophobicContact CD1-CB 3.66Å
265	W	98	Very high	96.5	Very high	3 Å²	3	48.7 Å²	48.7	1%	0.011	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	139.3	-176.7	-61.4	65.5	0	0	0	109.6	V201 I203 F231 F233 R252 L253 T255 W273 Q274 V275	V201-W265 HydrophobicContact CB-CH2 3.72Å; V201-W265 HydrophobicContact CB-CZ2 3.58Å; V201-W265 HydrophobicContact CG1-CH2 4Å; V201-W265 HydrophobicContact CG1-CZ2 3.85Å; V201-W265 HydrophobicContact CG2-CH2 4.43Å; V201-W265 HydrophobicContact CG2-CZ2 3.83Å; I203-W265 HydrophobicContact CD1-CZ3 4.43Å; I203-W265 HydrophobicContact CG1-CZ3 4.29Å; F231-W265 HydrophobicContact CD1-CE3 4.43Å; F231-W265 HydrophobicContact CD1-CH2 4.18Å; F231-W265 AromaticContact CD1-CZ3 3.48Å; F231-W265 HydrophobicContact CD1-CZ3 3.48Å; F231-W265 VanDerWaalsContact CD1-CZ3 3.48Å; F231-W265 HydrophobicContact CE1-CE3 4.18Å; F231-W265 HydrophobicContact CE1-CH2 4.05Å; F231-W265 AromaticContact CE1-CZ3 3.42Å; F231-W265 HydrophobicContact CE1-CZ3 3.42Å; F231-W265 VanDerWaalsContact CE1-CZ3 3.42Å; F233-W265 HydrophobicContact CB-CH2 3.03Å; F233-W265 HydrophobicContact CB-CZ2 3.26Å; F233-W265 HydrophobicContact CB-CZ3 3.97Å; F233-W265 HydrophobicContact CD1-CH2 4.25Å; F233-W265 AromaticContact CD1-CZ2 3.53Å; F233-W265 HydrophobicContact CD1-CZ2 3.53Å; F233-W265 AromaticContact CG-CH2 3.94Å; F233-W265 HydrophobicContact CG-CH2 3.94Å; F233-W265 AromaticContact CG-CZ2 3.67Å; F233-W265 HydrophobicContact CG-CZ2 3.67Å; R252-W265 WeakPolarHBondContact CA-O 3.17Å; L253-W265 HydrophobicContact CB-CB 3.79Å; L253-W265 HydrophobicContact CB-CG 4.05Å; L253-W265 HydrophobicContact CD2-CD2 4.17Å; L253-W265 HydrophobicContact CD2-CG 4.24Å; L253-W265 HydrophobicContact CG-CG 4.49Å; L253-W265 PolarHBondContact N-O 3.22Å; L253-W265 WeakPolarHBondContact O-CB 3.32Å; L253-W265 PolarHBondContact O-N 2.84Å; T255-W265 PolarHBondContact OG1-NE1 2.84Å; W265-W273 HydrophobicContact CE3-CB 3.99Å; W265-W273 HydrophobicContact CE3-CG 4.18Å; W265-W273 HydrophobicContact CZ3-CB 4.42Å; W265-Q274 WeakPolarHBondContact CA-O 3.33Å; W265-V275 HydrophobicContact CD2-CB 4.39Å; W265-V275 HydrophobicContact CD2-CG1 4.19Å; W265-V275 HydrophobicContact CD2-CG2 3.41Å; W265-V275 VanDerWaalsContact CD2-CG2 3.41Å; W265-V275 HydrophobicContact CE3-CG2 3.38Å; W265-V275 HydrophobicContact CG-CG1 4.27Å; W265-V275 HydrophobicContact CG-CG2 4.04Å; W265-V275 HydrophobicContact CH2-CG2 4.11Å; W265-V275 HydrophobicContact CZ2-CG2 4.08Å; W265-V275 HydrophobicContact CZ3-CG2 3.76Å
266	K	97	Very high	96.4	Very high	124 Å²	124	51.2 Å²	51.2	54%	0.539	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	127.9	177.4	-179.4	-178.4	175.3	-172.5	0	109.8	V268 W273 Q274	K266-V268 HydrophobicContact CG-CG1 4.45Å; K266-V268 PolarHBondContact O-N 2.88Å; K266-W273 WeakPolarHBondContact O-CA 3.44Å; K266-Q274 PolarHBondContact N-O 3.44Å; K266-Q274 PolarHBondContact O-N 3.02Å
267	L	97	Very high	96.1	Very high	44 Å²	44	57.4 Å²	57.4	23%	0.23	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	123.6	164.5	-175	71.8	0	0	0	109.6	I186 G251 W273	I186-L267 HydrophobicContact CD1-CD2 4.03Å; I186-L267 HydrophobicContact CG2-CD2 3.84Å; G251-L267 PolarHBondContact O-N 3.28Å; L267-W273 HydrophobicContact CD1-CD2 4.09Å; L267-W273 HydrophobicContact CD1-CE3 4.18Å; L267-W273 HydrophobicContact CD1-CH2 3.85Å; L267-W273 HydrophobicContact CD1-CZ2 3.79Å; L267-W273 HydrophobicContact CD1-CZ3 4.05Å
268	V	95.7	Very high	96	Very high	42 Å²	42	63.9 Å²	63.9	26%	0.255	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	168.7	179.1	-63.4	0	0	0	0	111.3	K266 G270 G271 T272 Q274	K266-V268 HydrophobicContact CG-CG1 4.45Å; K266-V268 PolarHBondContact O-N 2.88Å; V268-G270 PolarHBondContact O-N 3.46Å; V268-G271 PolarHBondContact O-N 2.78Å; V268-T272 HydrophobicContact CG2-CG2 3.7Å; V268-T272 VanDerWaalsContact CG2-O 3.3Å; V268-T272 WeakPolarHBondContact CG2-O 3.41Å; V268-T272 PolarHBondContact N-O 2.93Å; V268-Q274 HydrophobicContact CG1-CB 3.75Å
269	E	90.9	Very high	95.9	Very high	196 Å²	196	62 Å²	62	92%	0.916	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	135.1	173.4	-169.1	175.4	-176.3	0	0	110.4
270	G	89	Confident	95.9	Very high	78 Å²	78	54.5 Å²	54.5	80%	0.804	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.5	-3.4	-172	0	0	0	0	0	115	V268	V268-G270 PolarHBondContact O-N 3.46Å
271	G	90.8	Very high	95.8	Very high	48 Å²	48	60.4 Å²	60.4	50%	0.495	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	24.9	172.8	0	0	0	0	0	114.2	V268	V268-G271 PolarHBondContact O-N 2.78Å
272	T	93.9	Very high	95.7	Very high	63 Å²	63	64.6 Å²	64.6	39%	0.387	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	167.3	176.5	-168.6	0	0	0	0	111.1	V268	V268-T272 HydrophobicContact CG2-CG2 3.7Å; V268-T272 VanDerWaalsContact CG2-O 3.3Å; V268-T272 WeakPolarHBondContact CG2-O 3.41Å; V268-T272 PolarHBondContact N-O 2.93Å
273	W	97	Very high	95.7	Very high	15 Å²	15	65 Å²	65	6%	0.057	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	137.4	-180	-77.4	-100.2	0	0	0	111.6	I186 L191 I203 V230 F231 W245 G251 W265 K266 L267	I186-W273 HydrophobicContact CD1-CH2 4.39Å; I186-W273 HydrophobicContact CD1-CZ2 3.79Å; L191-W273 HydrophobicContact CD1-CH2 3.54Å; L191-W273 HydrophobicContact CD1-CZ2 3.8Å; I203-W273 HydrophobicContact CG1-CD2 4.5Å; I203-W273 HydrophobicContact CG2-CH2 3.99Å; I203-W273 HydrophobicContact CG2-CZ2 4.2Å; I203-W273 HydrophobicContact CG2-CZ3 4.24Å; V230-W273 HydrophobicContact CG1-CZ3 4.22Å; F231-W273 HydrophobicContact CB-CE3 4.1Å; F231-W273 HydrophobicContact CD1-CB 4.14Å; F231-W273 HydrophobicContact CD2-CB 4.16Å; F231-W273 HydrophobicContact CE1-CB 4.08Å; F231-W273 HydrophobicContact CE2-CB 4.1Å; F231-W273 WeakPolarHBondContact CE2-O 3.21Å; F231-W273 HydrophobicContact CG-CB 4.16Å; F231-W273 HydrophobicContact CG-CE3 4.44Å; F231-W273 HydrophobicContact CZ-CB 4.05Å; F231-W273 VanDerWaalsContact CZ-O 3.23Å; F231-W273 WeakPolarHBondContact CZ-O 3.16Å; W245-W273 HydrophobicContact CH2-CZ2 4.14Å; W245-W273 AromaticContact CH2-NE1 3.77Å; W245-W273 AromaticContact CZ3-NE1 3.76Å; G251-W273 PolarHBondContact O-NE1 3.15Å; G251-W273 VanDerWaalsContact O-NE1 3.09Å; W265-W273 HydrophobicContact CE3-CB 3.99Å; W265-W273 HydrophobicContact CE3-CG 4.18Å; W265-W273 HydrophobicContact CZ3-CB 4.42Å; K266-W273 WeakPolarHBondContact O-CA 3.44Å; L267-W273 HydrophobicContact CD1-CD2 4.09Å; L267-W273 HydrophobicContact CD1-CE3 4.18Å; L267-W273 HydrophobicContact CD1-CH2 3.85Å; L267-W273 HydrophobicContact CD1-CZ2 3.79Å; L267-W273 HydrophobicContact CD1-CZ3 4.05Å
274	Q	97.2	Very high	95.7	Very high	123 Å²	123	73.3 Å²	73.3	58%	0.575	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105	127.9	163.5	-175.5	-179	10.4	0	0	108.5	W265 K266 V268	W265-Q274 WeakPolarHBondContact CA-O 3.33Å; K266-Q274 PolarHBondContact N-O 3.44Å; K266-Q274 PolarHBondContact O-N 3.02Å; V268-Q274 HydrophobicContact CG1-CB 3.75Å
275	V	97.8	Very high	95.7	Very high	11 Å²	11	72.8 Å²	72.8	7%	0.067	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	125	175.4	-168.3	0	0	0	0	108.9	F231 F233 H263 L264 W265 Q277	F231-V275 HydrophobicContact CE1-CG2 4.08Å; F231-V275 HydrophobicContact CZ-CG2 4.32Å; F233-V275 HydrophobicContact CB-CG2 4.33Å; F233-V275 HydrophobicContact CD1-CG1 4.18Å; F233-V275 HydrophobicContact CD2-CB 4.01Å; F233-V275 HydrophobicContact CD2-CG1 4.06Å; F233-V275 HydrophobicContact CD2-CG2 3.97Å; F233-V275 HydrophobicContact CE1-CG1 3.89Å; F233-V275 HydrophobicContact CE2-CB 3.99Å; F233-V275 HydrophobicContact CE2-CG1 3.8Å; F233-V275 HydrophobicContact CE2-CG2 4.46Å; F233-V275 HydrophobicContact CG-CB 4.47Å; F233-V275 HydrophobicContact CG-CG1 4.25Å; F233-V275 HydrophobicContact CG-CG2 4.12Å; F233-V275 HydrophobicContact CZ-CB 4.4Å; F233-V275 HydrophobicContact CZ-CG1 3.69Å; H263-V275 HydrophobicContact CB-CG1 3.82Å; L264-V275 WeakPolarHBondContact O-CA 3.32Å; W265-V275 HydrophobicContact CD2-CB 4.39Å; W265-V275 HydrophobicContact CD2-CG1 4.19Å; W265-V275 HydrophobicContact CD2-CG2 3.41Å; W265-V275 VanDerWaalsContact CD2-CG2 3.41Å; W265-V275 HydrophobicContact CE3-CG2 3.38Å; W265-V275 HydrophobicContact CG-CG1 4.27Å; W265-V275 HydrophobicContact CG-CG2 4.04Å; W265-V275 HydrophobicContact CH2-CG2 4.11Å; W265-V275 HydrophobicContact CZ2-CG2 4.08Å; W265-V275 HydrophobicContact CZ3-CG2 3.76Å; V275-Q277 PolarHBondContact O-N 3.29Å; V275-Q277 VanDerWaalsContact O-N 3.14Å; V275-Q277 PolarHBondContact O-NE2 2.87Å
276	D	95.7	Very high	95.7	Very high	53 Å²	53	73.4 Å²	73.4	28%	0.283	38%	0.383	S	S	.	.			trans	-65.5	115.1	174.6	-168.4	-24.4	0	0	0	108.5	H263 L264 R278	H263-D276 PolarHBondContact CD2-O 2.87Å; L264-D276 PolarHBondContact O-N 2.61Å; D276-R278 PolarHBondContact O-N 3.11Å; D276-R278 VanDerWaalsContact O-N 3.16Å; D276-R278 WeakPolarHBondContact OD1-CB 3.05Å; D276-R278 IonicContact OD1-CZ 3.23Å; D276-R278 PolarHBondContact OD1-N 3.47Å; D276-R278 IonicContact OD1-NE 3.82Å; D276-R278 PolarHBondContact OD1-NE 2.65Å; D276-R278 IonicContact OD1-NH2 3.75Å; D276-R278 IonicContact OD2-CZ 2.73Å; D276-R278 IonicContact OD2-NE 3.69Å; D276-R278 IonicContact OD2-NH2 3.41Å; D276-R278 PolarHBondContact OD2-NH2 3.46Å
277	Q	93	Very high	95.8	Very high	130 Å²	130	67.5 Å²	67.5	61%	0.607	36%	0.357	S	S	*	.	S	Bend	trans	-68.1	-11.1	-178.2	-58.3	-59.1	-58.1	0	0	113.2	V275	V275-Q277 PolarHBondContact O-N 3.29Å; V275-Q277 VanDerWaalsContact O-N 3.14Å; V275-Q277 PolarHBondContact O-NE2 2.87Å
278	R	95	Very high	95.9	Very high	136 Å²	136	67.1 Å²	67.1	51%	0.513	35%	0.354	S	S	.	.	S	Bend	trans	-98	97.9	175.9	-56.7	167.4	-62.4	160.4	9.1	108.3	D276 P318	D276-R278 PolarHBondContact O-N 3.11Å; D276-R278 VanDerWaalsContact O-N 3.16Å; D276-R278 WeakPolarHBondContact OD1-CB 3.05Å; D276-R278 IonicContact OD1-CZ 3.23Å; D276-R278 PolarHBondContact OD1-N 3.47Å; D276-R278 IonicContact OD1-NE 3.82Å; D276-R278 PolarHBondContact OD1-NE 2.65Å; D276-R278 IonicContact OD1-NH2 3.75Å; D276-R278 IonicContact OD2-CZ 2.73Å; D276-R278 IonicContact OD2-NE 3.69Å; D276-R278 IonicContact OD2-NH2 3.41Å; D276-R278 PolarHBondContact OD2-NH2 3.46Å; R278-P318 HydrophobicContact CB-CG 3.74Å; R278-P318 VanDerWaalsContact O-CG 3.31Å; R278-P318 WeakPolarHBondContact O-CG 3.21Å
279	A	96.8	Very high	96	Very high	10 Å²	10	65.2 Å²	65.2	8%	0.083	34%	0.342	C	S	.	.			trans	-61.1	148.3	176.1	0	0	0	0	0	112.5	N261 I262 K281	N261-A279 HydrophobicContact CB-CB 3.63Å; I262-A279 CarbonylContact O-C 3.48Å; I262-A279 WeakPolarHBondContact O-CA 3.46Å; A279-K281 HydrophobicContact CB-CG 4.09Å
280	F	97.8	Very high	96.4	Very high	5 Å²	5	55.9 Å²	55.9	2%	0.022	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-73.9	124.6	162.5	-58.9	-6.7	0	0	0	108	I262 L264 F300 W312 P318 A321	I262-F280 HydrophobicContact CB-CB 4.2Å; I262-F280 PolarHBondContact N-O 3.16Å; I262-F280 PolarHBondContact O-N 2.83Å; L264-F280 HydrophobicContact CD1-CE1 4.2Å; L264-F280 HydrophobicContact CD1-CE2 3.61Å; L264-F280 HydrophobicContact CD1-CZ 3.36Å; L264-F280 HydrophobicContact CG-CE2 4.16Å; L264-F280 HydrophobicContact CG-CZ 4.15Å; F280-F300 HydrophobicContact CD2-CE1 4.3Å; F280-F300 AromaticContact CD2-CZ 3.76Å; F280-F300 HydrophobicContact CD2-CZ 3.76Å; F280-F300 AromaticContact CE2-CE1 3.88Å; F280-F300 HydrophobicContact CE2-CE1 3.88Å; F280-F300 AromaticContact CE2-CZ 3.82Å; F280-F300 HydrophobicContact CE2-CZ 3.82Å; F280-W312 HydrophobicContact CB-CE3 4.02Å; F280-W312 HydrophobicContact CB-CH2 4.08Å; F280-W312 HydrophobicContact CB-CZ3 3.58Å; F280-W312 HydrophobicContact CD2-CD2 4.18Å; F280-W312 AromaticContact CD2-CE3 3.58Å; F280-W312 HydrophobicContact CD2-CE3 3.58Å; F280-W312 HydrophobicContact CD2-CZ3 4.06Å; F280-W312 HydrophobicContact CE2-CE3 4.4Å; F280-W312 HydrophobicContact CG-CE3 4.17Å; F280-W312 HydrophobicContact CG-CZ3 4.19Å; F280-P318 VanDerWaalsContact CD1-CA 3.5Å; F280-P318 HydrophobicContact CD1-CB 3.69Å; F280-P318 HydrophobicContact CD1-CG 3.8Å; F280-P318 HydrophobicContact CE1-CB 4.18Å; F280-P318 HydrophobicContact CE1-CG 3.91Å; F280-A321 HydrophobicContact CD1-CB 3.91Å; F280-A321 HydrophobicContact CD2-CB 3.58Å; F280-A321 HydrophobicContact CE1-CB 3.71Å; F280-A321 HydrophobicContact CE2-CB 3.38Å; F280-A321 HydrophobicContact CG-CB 3.83Å; F280-A321 HydrophobicContact CZ-CB 3.43Å; F280-A321 VanDerWaalsContact CZ-CB 3.43Å
281	K	95.2	Very high	96.8	Very high	136 Å²	136	52.9 Å²	52.9	59%	0.591	26%	0.263	S	S	*	.			trans	-132.5	74.6	-173.6	-61	-170.8	-166.2	-137.1	0	110.6	N261 A279	N261-K281 WeakPolarHBondContact OD1-CD 3.42Å; N261-K281 WeakPolarHBondContact OD1-CE 3.44Å; N261-K281 PolarHBondContact OD1-NZ 2.64Å; A279-K281 HydrophobicContact CB-CG 4.09Å
282	K	97.1	Very high	97.2	Very high	103 Å²	103	50.6 Å²	50.6	45%	0.448	24%	0.24	S	C	.	.			trans	-117.2	-20	173.4	-65.7	-68.1	-170.6	179	0	113.8	K310 W312 E319 C322	K282-K310 HydrophobicContact CB-CD 4.11Å; K282-K310 WeakPolarHBondContact O-CE 3.33Å; K282-W312 HydrophobicContact CB-CH2 3.61Å; K282-W312 HydrophobicContact CB-CZ3 4.08Å; K282-W312 HydrophobicContact CG-CH2 4.09Å; K282-W312 HydrophobicContact CG-CZ3 4.04Å; K282-E319 WeakPolarHBondContact CE-O 3.3Å; K282-C322 HydrophobicContact CB-CB 4.18Å; K282-C322 HydrophobicContact CG-CB 3.8Å
283	H	98.1	Very high	97.4	Very high	11 Å²	11	47.8 Å²	47.8	5%	0.051	22%	0.222	C	C	.	.			trans	-66.3	149.9	166.3	-80.2	-65.8	0	0	0	110.2	A260 V287 S302 S304 D306 S308 K310 W312	A260-H283 HydrophobicContact CB-CB 4.06Å; A260-H283 VanDerWaalsContact CB-O 3.28Å; A260-H283 WeakPolarHBondContact CB-O 3.15Å; H283-V287 HydrophobicContact CB-CG2 4.31Å; H283-S302 PolarHBondContact CD2-OG 2.92Å; H283-S302 PolarHBondContact NE2-OG 3.44Å; H283-S304 WeakPolarHBondContact CE1-CB 3.23Å; H283-S304 WeakPolarHBondContact ND1-CB 3.44Å; H283-D306 WeakPolarHBondContact CA-OD2 3.49Å; H283-D306 WeakPolarHBondContact CB-OD2 3.38Å; H283-D306 IonicContact CE1-OD1 3.96Å; H283-D306 IonicContact CG-OD2 3.67Å; H283-D306 IonicContact ND1-OD1 3.72Å; H283-D306 PolarHBondContact ND1-OD1 2.81Å; H283-D306 IonicContact ND1-OD2 2.69Å; H283-D306 PolarHBondContact ND1-OD2 2.96Å; H283-S308 PolarHBondContact CE1-OG 3.5Å; H283-S308 PolarHBondContact ND1-OG 3.43Å; H283-K310 VanDerWaalsContact ND1-CE 3.31Å; H283-K310 WeakPolarHBondContact ND1-CE 3.5Å; H283-W312 AromaticContact CD2-CZ2 3.92Å
284	E	97.9	Very high	97.3	Very high	184 Å²	184	49.9 Å²	49.9	86%	0.86	23%	0.232	S	C	*	.	S	Bend	trans	-103.3	-4.5	176.9	-62.1	-176.3	176.9	0	0	111.9	D306	E284-D306 HydrophobicContact CB-CB 4.16Å; E284-D306 PolarHBondContact N-OD2 3.08Å
285	G	98.1	Very high	97.2	Very high	14 Å²	14	47.2 Å²	47.2	14%	0.144	23%	0.227	C	C	.	.	S	Bend	trans	-132.7	-170.5	179.9	0	0	0	0	0	113	A260 S305	A260-G285 VanDerWaalsContact CA-O 3.31Å; A260-G285 WeakPolarHBondContact CA-O 3.23Å; A260-G285 WeakPolarHBondContact CB-O 3.36Å; A260-G285 PolarHBondContact N-O 3.11Å; G285-S305 WeakPolarHBondContact CA-OG 3.26Å
286	S	98.5	Very high	97.1	Very high	16 Å²	16	51.7 Å²	51.7	11%	0.112	25%	0.247	C	C	.	.			trans	-62.9	138.6	176.1	172.4	0	0	0	0	110.3	C258 E288 S304 S305	C258-S286 WeakPolarHBondContact CA-OG 3.19Å; C258-S286 PolarHBondContact SG-OG 2.73Å; S286-E288 WeakPolarHBondContact CB-OE1 3.39Å; S286-E288 PolarHBondContact OG-OE1 2.93Å; S286-S304 WeakPolarHBondContact O-CA 3.01Å; S286-S304 WeakPolarHBondContact O-CB 3.48Å; S286-S304 PolarHBondContact O-OG 3.04Å; S286-S305 PolarHBondContact N-OG 3.44Å; S286-S305 PolarHBondContact O-N 3.2Å
287	V	98.8	Very high	97.2	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	109.3	174.4	-175.6	0	0	0	0	107.8	A242 D257 I262 H283 I290	A242-V287 HydrophobicContact CB-CB 4.37Å; A242-V287 HydrophobicContact CB-CG1 3.74Å; A242-V287 WeakPolarHBondContact CB-O 3.19Å; D257-V287 PolarHBondContact O-N 3.32Å; D257-V287 VanDerWaalsContact O-N 3.14Å; I262-V287 HydrophobicContact CD1-CG1 4.14Å; I262-V287 HydrophobicContact CD1-CG2 4.19Å; I262-V287 HydrophobicContact CG1-CG1 4.21Å; I262-V287 HydrophobicContact CG1-CG2 3.91Å; H283-V287 HydrophobicContact CB-CG2 4.31Å; V287-I290 HydrophobicContact CG1-CD1 4.16Å; V287-I290 HydrophobicContact CG1-CG1 4.04Å
288	E	98.8	Very high	97.4	Very high	35 Å²	35	48.3 Å²	48.3	16%	0.164	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	-40.7	-171	-59.1	-52	139.5	0	0	112	A242 S286 C303 V334 N335	A242-E288 PolarHBondContact N-O 2.88Å; S286-E288 WeakPolarHBondContact CB-OE1 3.39Å; S286-E288 PolarHBondContact OG-OE1 2.93Å; E288-C303 PolarHBondContact N-O 2.71Å; E288-V334 WeakPolarHBondContact CB-O 3.26Å; E288-N335 VanDerWaalsContact CB-O 3.26Å; E288-N335 WeakPolarHBondContact CB-O 3.44Å
289	D	98.8	Very high	97.6	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.011	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	155.5	177.5	-157.4	8.9	0	0	0	113	R180 R291 S302 C303 I337	R180-D289 VanDerWaalsContact NH1-CG 3.28Å; R180-D289 IonicContact NH1-OD1 3.79Å; R180-D289 PolarHBondContact NH1-OD1 2.71Å; R180-D289 IonicContact NH1-OD2 3.53Å; D289-R291 IonicContact OD2-NE 2.86Å; D289-S302 WeakPolarHBondContact O-CA 3.28Å; D289-S302 WeakPolarHBondContact O-CB 3.45Å; D289-C303 VanDerWaalsContact CB-SG 3.56Å; D289-C303 PolarHBondContact O-N 2.84Å; D289-I337 HydrophobicContact CB-CG1 4.16Å; D289-I337 PolarHBondContact OD2-N 3.01Å
290	I	98.9	Very high	97.7	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	137.6	175.6	-76.5	163.3	0	0	0	108	A242 D244 A254 I262 V287 F300 F301	A242-I290 HydrophobicContact CB-CB 4.24Å; A242-I290 HydrophobicContact CB-CD1 3.82Å; A242-I290 HydrophobicContact CB-CG1 3.85Å; D244-I290 HydrophobicContact CB-CG2 4.35Å; D244-I290 WeakPolarHBondContact CB-O 3.37Å; A254-I290 HydrophobicContact CB-CD1 4.46Å; A254-I290 HydrophobicContact CB-CG2 3.81Å; I262-I290 HydrophobicContact CD1-CD1 4.26Å; I262-I290 HydrophobicContact CG1-CD1 4.17Å; I262-I290 HydrophobicContact CG2-CD1 3.79Å; V287-I290 HydrophobicContact CG1-CD1 4.16Å; V287-I290 HydrophobicContact CG1-CG1 4.04Å; I290-F300 HydrophobicContact CG2-CD2 3.91Å; I290-F301 CarbonylContact C-O 3.57Å; I290-F301 VanDerWaalsContact CA-O 3.25Å; I290-F301 WeakPolarHBondContact CA-O 3.29Å
291	R	98.7	Very high	97.7	Very high	15 Å²	15	42.1 Å²	42.1	6%	0.057	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	129.1	171.1	-66.5	-65.8	-172.8	172.5	11	111.5	D244 D289 F300 F301 I337 V339	D244-R291 IonicContact OD1-NH1 3.99Å; D244-R291 WeakPolarHBondContact OD2-CA 3.46Å; D289-R291 IonicContact OD2-NE 2.86Å; R291-F300 CarbonylContact O-C 3.51Å; R291-F300 WeakPolarHBondContact O-CA 3.46Å; R291-F300 WeakPolarHBondContact O-CB 3.16Å; R291-F301 PolarHBondContact N-O 3.46Å; R291-F301 WeakPolarHBondContact O-CD2 3.3Å; R291-F301 PolarHBondContact O-N 3.25Å; R291-I337 HydrophobicContact CG-CG1 4.05Å; R291-I337 WeakPolarHBondContact CG-O 3.4Å; R291-I337 PolarHBondContact NE-O 2.88Å; R291-V339 HydrophobicContact CB-CG2 4.17Å
292	W	98.5	Very high	97.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	143.6	171.1	-76.7	91.6	0	0	0	111.1	D244 S246 R252 A254 L264 K294 F300 A314	D244-W292 PolarHBondContact O-NE1 3.07Å; D244-W292 PolarHBondContact OD2-N 3Å; S246-W292 VanDerWaalsContact N-CD1 3.34Å; R252-W292 HydrophobicContact CG-CH2 3.78Å; R252-W292 HydrophobicContact CG-CZ2 3.54Å; R252-W292 HydrophobicContact CG-CZ3 4.46Å; A254-W292 HydrophobicContact CB-CZ2 3.71Å; L264-W292 HydrophobicContact CD2-CH2 4.13Å; L264-W292 HydrophobicContact CD2-CZ2 3.94Å; W292-K294 PolarHBondContact O-N 3.37Å; W292-F300 HydrophobicContact CD2-CB 3.82Å; W292-F300 HydrophobicContact CE3-CB 3.79Å; W292-F300 HydrophobicContact CE3-CD1 4.32Å; W292-F300 HydrophobicContact CE3-CG 4.49Å; W292-F300 HydrophobicContact CG-CB 4.2Å; W292-F300 AromaticContact CH2-CD1 3.72Å; W292-F300 HydrophobicContact CH2-CD1 3.72Å; W292-F300 HydrophobicContact CH2-CE1 4.33Å; W292-F300 HydrophobicContact CH2-CG 4.46Å; W292-F300 HydrophobicContact CZ2-CD1 4.17Å; W292-F300 HydrophobicContact CZ3-CB 4.17Å; W292-F300 AromaticContact CZ3-CD1 3.82Å; W292-F300 HydrophobicContact CZ3-CD1 3.82Å; W292-F300 HydrophobicContact CZ3-CG 4.43Å; W292-A314 HydrophobicContact CH2-CB 3.64Å; W292-A314 HydrophobicContact CZ3-CB 3.93Å
293	S	97.7	Very high	98	Very high	4 Å²	4	30.8 Å²	30.8	3%	0.028	16%	0.16	C	C	.	.			trans	-59.5	136.1	170.5	177.7	0	0	0	0	110.5	S295 E296 V299	S293-S295 VanDerWaalsContact C-N 3.3Å; S293-S295 PolarHBondContact OG-N 3.12Å; S293-E296 PolarHBondContact OG-N 2.85Å; S293-V299 WeakPolarHBondContact CB-O 3.36Å; S293-V299 PolarHBondContact N-O 3.45Å
294	K	95.7	Very high	98	Very high	59 Å²	59	30.2 Å²	30.2	26%	0.257	16%	0.158	S	C	.	.	S	Bend	trans	-81.8	-7.8	175.8	-52.1	-56.3	-176.3	-175.3	0	112.9	T247 W292	T247-K294 HydrophobicContact CG2-CD 4.34Å; W292-K294 PolarHBondContact O-N 3.37Å
295	S	95	Very high	98.1	Very high	68 Å²	68	23 Å²	23	48%	0.476	13%	0.127	S	C	.	.	S	Bend	trans	-123.2	-18.5	179.6	58.5	0	0	0	0	114.7	L248 S293 Q344	L248-S295 VanDerWaalsContact CD1-C 3.47Å; S293-S295 VanDerWaalsContact C-N 3.3Å; S293-S295 PolarHBondContact OG-N 3.12Å; S295-Q344 PolarHBondContact OG-NE2 3.25Å
296	E	96.3	Very high	98.1	Very high	104 Å²	104	23.9 Å²	23.9	49%	0.486	13%	0.129	S	C	.	.			trans	-121.4	112.8	-176.8	-65.9	-169.1	-148.5	0	0	112.3	S293 N298 V299	S293-E296 PolarHBondContact OG-N 2.85Å; E296-N298 PolarHBondContact O-N 3.4Å; E296-V299 HydrophobicContact CB-CB 3.92Å; E296-V299 HydrophobicContact CB-CG2 4Å; E296-V299 PolarHBondContact O-N 2.97Å; E296-V299 WeakPolarHBondContact OE2-CG2 3.5Å
297	N	97	Very high	98.1	Very high	75 Å²	75	26.5 Å²	26.5	40%	0.401	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-32.4	-174.4	-76.8	-57.5	0	0	0	115.8	L248 T249 R252	L248-N297 WeakPolarHBondContact CB-OD1 3.13Å; L248-N297 PolarHBondContact O-OD1 2.87Å; T249-N297 PolarHBondContact OG1-OD1 3.34Å; R252-N297 PolarHBondContact NH1-O 2.83Å
298	N	97.7	Very high	98.1	Very high	38 Å²	38	26.7 Å²	26.7	20%	0.203	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	3	-169.8	-53.5	-69.7	0	0	0	113.1	R252 E296 A314 R315	R252-N298 PolarHBondContact NH1-OD1 2.9Å; E296-N298 PolarHBondContact O-N 3.4Å; N298-A314 HydrophobicContact CB-CB 4.4Å; N298-A314 VanDerWaalsContact O-CB 3.29Å; N298-A314 WeakPolarHBondContact O-CB 3.37Å; N298-A314 PolarHBondContact O-N 2.88Å; N298-R315 HydrophobicContact CB-CG 3.83Å
299	V	98.1	Very high	98.1	Very high	12 Å²	12	25.1 Å²	25.1	7%	0.073	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	135.8	-179.7	176.7	0	0	0	0	109.9	S293 E296 F301 I311 W312	S293-V299 WeakPolarHBondContact CB-O 3.36Å; S293-V299 PolarHBondContact N-O 3.45Å; E296-V299 HydrophobicContact CB-CB 3.92Å; E296-V299 HydrophobicContact CB-CG2 4Å; E296-V299 PolarHBondContact O-N 2.97Å; E296-V299 WeakPolarHBondContact OE2-CG2 3.5Å; V299-F301 HydrophobicContact CG1-CE2 4.31Å; V299-F301 HydrophobicContact CG1-CZ 4.19Å; V299-I311 HydrophobicContact CG1-CG2 3.59Å; V299-W312 VanDerWaalsContact CA-O 3.28Å; V299-W312 WeakPolarHBondContact CA-O 3.25Å
300	F	98.7	Very high	98.1	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	163.2	167.9	68.6	-86.5	0	0	0	110	I262 L264 F280 I290 R291 W292 W312 A314	I262-F300 HydrophobicContact CD1-CE2 4.33Å; I262-F300 HydrophobicContact CG2-CE2 3.99Å; I262-F300 HydrophobicContact CG2-CZ 4.05Å; L264-F300 HydrophobicContact CD1-CE1 4.38Å; L264-F300 HydrophobicContact CD2-CD1 4.44Å; L264-F300 HydrophobicContact CD2-CE1 3.73Å; L264-F300 HydrophobicContact CD2-CZ 4Å; F280-F300 HydrophobicContact CD2-CE1 4.3Å; F280-F300 AromaticContact CD2-CZ 3.76Å; F280-F300 HydrophobicContact CD2-CZ 3.76Å; F280-F300 AromaticContact CE2-CE1 3.88Å; F280-F300 HydrophobicContact CE2-CE1 3.88Å; F280-F300 AromaticContact CE2-CZ 3.82Å; F280-F300 HydrophobicContact CE2-CZ 3.82Å; I290-F300 HydrophobicContact CG2-CD2 3.91Å; R291-F300 CarbonylContact O-C 3.51Å; R291-F300 WeakPolarHBondContact O-CA 3.46Å; R291-F300 WeakPolarHBondContact O-CB 3.16Å; W292-F300 HydrophobicContact CD2-CB 3.82Å; W292-F300 HydrophobicContact CE3-CB 3.79Å; W292-F300 HydrophobicContact CE3-CD1 4.32Å; W292-F300 HydrophobicContact CE3-CG 4.49Å; W292-F300 HydrophobicContact CG-CB 4.2Å; W292-F300 AromaticContact CH2-CD1 3.72Å; W292-F300 HydrophobicContact CH2-CD1 3.72Å; W292-F300 HydrophobicContact CH2-CE1 4.33Å; W292-F300 HydrophobicContact CH2-CG 4.46Å; W292-F300 HydrophobicContact CZ2-CD1 4.17Å; W292-F300 HydrophobicContact CZ3-CB 4.17Å; W292-F300 AromaticContact CZ3-CD1 3.82Å; W292-F300 HydrophobicContact CZ3-CD1 3.82Å; W292-F300 HydrophobicContact CZ3-CG 4.43Å; F300-W312 HydrophobicContact CD1-CB 3.78Å; F300-W312 HydrophobicContact CD2-CB 4.07Å; F300-W312 AromaticContact CD2-CD1 3.58Å; F300-W312 HydrophobicContact CD2-CG 4.03Å; F300-W312 HydrophobicContact CE1-CB 3.37Å; F300-W312 HydrophobicContact CE1-CG 4.05Å; F300-W312 HydrophobicContact CE2-CB 3.7Å; F300-W312 AromaticContact CE2-CD1 3.26Å; F300-W312 HydrophobicContact CE2-CD2 4.2Å; F300-W312 AromaticContact CE2-CG 3.45Å; F300-W312 HydrophobicContact CE2-CG 3.45Å; F300-W312 VanDerWaalsContact CE2-CG 3.45Å; F300-W312 AromaticContact CE2-NE1 3.89Å; F300-W312 HydrophobicContact CG-CB 4.12Å; F300-W312 HydrophobicContact CZ-CB 3.34Å; F300-W312 AromaticContact CZ-CD1 3.82Å; F300-W312 HydrophobicContact CZ-CD2 4.13Å; F300-W312 AromaticContact CZ-CG 3.48Å; F300-W312 HydrophobicContact CZ-CG 3.48Å; F300-W312 VanDerWaalsContact CZ-CG 3.48Å; F300-W312 PolarHBondContact N-O 3.02Å; F300-W312 PolarHBondContact O-N 3.05Å; F300-A314 HydrophobicContact CD1-CB 4.42Å; F300-A314 HydrophobicContact CE1-CB 4.3Å
301	F	98.8	Very high	98	Very high	9 Å²	9	26.1 Å²	26.1	4%	0.039	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	149.7	-178.4	-54.6	-92.7	0	0	0	108.4	I290 R291 V299 K310 I311 I337 V339 L346 L360	I290-F301 CarbonylContact C-O 3.57Å; I290-F301 VanDerWaalsContact CA-O 3.25Å; I290-F301 WeakPolarHBondContact CA-O 3.29Å; R291-F301 PolarHBondContact N-O 3.46Å; R291-F301 WeakPolarHBondContact O-CD2 3.3Å; R291-F301 PolarHBondContact O-N 3.25Å; V299-F301 HydrophobicContact CG1-CE2 4.31Å; V299-F301 HydrophobicContact CG1-CZ 4.19Å; F301-K310 CarbonylContact C-O 3.59Å; F301-K310 VanDerWaalsContact CA-O 3.3Å; F301-K310 WeakPolarHBondContact CA-O 3.22Å; F301-I311 HydrophobicContact CD1-CB 4.41Å; F301-I311 HydrophobicContact CD1-CD1 4.25Å; F301-I311 HydrophobicContact CD1-CG1 3.79Å; F301-I311 HydrophobicContact CD1-CG2 4.23Å; F301-I311 HydrophobicContact CE1-CB 4.45Å; F301-I311 HydrophobicContact CE1-CD1 3.81Å; F301-I311 HydrophobicContact CE1-CG1 3.83Å; F301-I311 HydrophobicContact CE1-CG2 3.94Å; F301-I337 HydrophobicContact CB-CD1 3.65Å; F301-V339 HydrophobicContact CD2-CG2 3.5Å; F301-V339 VanDerWaalsContact CD2-CG2 3.5Å; F301-V339 HydrophobicContact CE2-CG1 4.28Å; F301-V339 HydrophobicContact CE2-CG2 3.74Å; F301-V339 HydrophobicContact CG-CG2 4.2Å; F301-L346 HydrophobicContact CB-CD1 3.98Å; F301-L346 HydrophobicContact CD1-CD1 3.59Å; F301-L346 HydrophobicContact CE1-CD1 4.21Å; F301-L346 HydrophobicContact CG-CD1 3.78Å; F301-L360 HydrophobicContact CE1-CD1 4.25Å; F301-L360 HydrophobicContact CE1-CD2 3.69Å; F301-L360 HydrophobicContact CZ-CD1 3.81Å; F301-L360 HydrophobicContact CZ-CD2 4.12Å
302	S	98.9	Very high	98	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	153.4	168.7	65.6	0	0	0	0	111.2	H283 D289 I309 K310 W312	H283-S302 PolarHBondContact CD2-OG 2.92Å; H283-S302 PolarHBondContact NE2-OG 3.44Å; D289-S302 WeakPolarHBondContact O-CA 3.28Å; D289-S302 WeakPolarHBondContact O-CB 3.45Å; S302-I309 CarbonylContact O-C 3.49Å; S302-I309 VanDerWaalsContact O-CA 3.3Å; S302-I309 WeakPolarHBondContact O-CA 3.47Å; S302-K310 PolarHBondContact N-O 2.81Å; S302-K310 PolarHBondContact O-N 2.96Å; S302-W312 PolarHBondContact OG-NE1 2.93Å
303	C	98.9	Very high	98	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	164.5	171.1	68.7	0	0	0	0	111	E288 D289 S308 I309 V334 I337	E288-C303 PolarHBondContact N-O 2.71Å; D289-C303 VanDerWaalsContact CB-SG 3.56Å; D289-C303 PolarHBondContact O-N 2.84Å; C303-S308 WeakPolarHBondContact CA-O 3.38Å; C303-I309 HydrophobicContact CB-CG1 4.2Å; C303-V334 HydrophobicContact CB-CB 3.83Å; C303-V334 HydrophobicContact CB-CG1 3.46Å; C303-V334 VanDerWaalsContact CB-CG1 3.46Å; C303-V334 PolarHBondContact SG-O 3.01Å; C303-I337 HydrophobicContact CB-CD1 4.44Å; C303-I337 HydrophobicContact CB-CG2 3.72Å
304	S	98.9	Very high	98	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	158.8	-169.2	175.6	0	0	0	0	113.5	H283 S286 D306 K307 S308 V334	H283-S304 WeakPolarHBondContact CE1-CB 3.23Å; H283-S304 WeakPolarHBondContact ND1-CB 3.44Å; S286-S304 WeakPolarHBondContact O-CA 3.01Å; S286-S304 WeakPolarHBondContact O-CB 3.48Å; S286-S304 PolarHBondContact O-OG 3.04Å; S304-D306 VanDerWaalsContact CB-OD1 3.27Å; S304-D306 WeakPolarHBondContact CB-OD1 3.49Å; S304-D306 PolarHBondContact O-N 3.33Å; S304-D306 VanDerWaalsContact O-N 3.11Å; S304-D306 PolarHBondContact OG-N 3.28Å; S304-D306 VanDerWaalsContact OG-N 3.09Å; S304-D306 PolarHBondContact OG-OD1 2.92Å; S304-K307 PolarHBondContact O-N 3.47Å; S304-S308 PolarHBondContact N-O 3.47Å; S304-V334 PolarHBondContact N-O 3.36Å; S304-V334 PolarHBondContact O-N 3.07Å; S304-V334 VanDerWaalsContact O-N 3.13Å
305	S	98.7	Very high	98.1	Very high	32 Å²	32	33 Å²	33	22%	0.224	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-7	165	84.9	0	0	0	0	113.8	G285 S286 K307 D333	G285-S305 WeakPolarHBondContact CA-OG 3.26Å; S286-S305 PolarHBondContact N-OG 3.44Å; S286-S305 PolarHBondContact O-N 3.2Å; S305-K307 PolarHBondContact O-N 2.63Å; S305-D333 VanDerWaalsContact CB-OD2 3.29Å; S305-D333 WeakPolarHBondContact CB-OD2 3.41Å
306	D	98.5	Very high	98.1	Very high	32 Å²	32	31.3 Å²	31.3	17%	0.171	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	9.9	168.2	73.4	11.7	0	0	0	113.7	H283 E284 S304 S308	H283-D306 WeakPolarHBondContact CA-OD2 3.49Å; H283-D306 WeakPolarHBondContact CB-OD2 3.38Å; H283-D306 IonicContact CE1-OD1 3.96Å; H283-D306 IonicContact CG-OD2 3.67Å; H283-D306 IonicContact ND1-OD1 3.72Å; H283-D306 PolarHBondContact ND1-OD1 2.81Å; H283-D306 IonicContact ND1-OD2 2.69Å; H283-D306 PolarHBondContact ND1-OD2 2.96Å; E284-D306 HydrophobicContact CB-CB 4.16Å; E284-D306 PolarHBondContact N-OD2 3.08Å; S304-D306 VanDerWaalsContact CB-OD1 3.27Å; S304-D306 WeakPolarHBondContact CB-OD1 3.49Å; S304-D306 PolarHBondContact O-N 3.33Å; S304-D306 VanDerWaalsContact O-N 3.11Å; S304-D306 PolarHBondContact OG-N 3.28Å; S304-D306 VanDerWaalsContact OG-N 3.09Å; S304-D306 PolarHBondContact OG-OD1 2.92Å; D306-S308 VanDerWaalsContact CG-OG 3.31Å; D306-S308 PolarHBondContact O-N 3.01Å; D306-S308 VanDerWaalsContact OD1-CB 3.24Å; D306-S308 WeakPolarHBondContact OD1-CB 3.39Å; D306-S308 PolarHBondContact OD1-N 2.88Å; D306-S308 PolarHBondContact OD1-OG 3.21Å; D306-S308 PolarHBondContact OD2-OG 3.32Å
307	K	98.7	Very high	98.1	Very high	72 Å²	72	32.3 Å²	32.3	31%	0.313	16%	0.16	S	C	.	.	S	Bend	trans	67.7	11.9	177.9	-40	-175.4	178.3	-168	0	114.5	S304 S305 N328 A329 H330 D331 S332	S304-K307 PolarHBondContact O-N 3.47Å; S305-K307 PolarHBondContact O-N 2.63Å; K307-N328 CarbonylContact O-C 3.58Å; K307-N328 WeakPolarHBondContact O-CA 3.48Å; K307-A329 PolarHBondContact O-N 2.9Å; K307-H330 PolarHBondContact O-N 3.36Å; K307-D331 WeakPolarHBondContact CD-O 3.37Å; K307-D331 WeakPolarHBondContact CE-O 3.45Å; K307-D331 PolarHBondContact NZ-O 2.97Å; K307-S332 WeakPolarHBondContact CB-O 3.47Å; K307-S332 WeakPolarHBondContact CG-O 3.27Å
308	S	98.7	Very high	98	Very high	4 Å²	4	29.4 Å²	29.4	3%	0.028	15%	0.145	C	C	.	.			trans	-107.1	156	-178.6	76.1	0	0	0	0	113.3	H283 C303 S304 D306 K310 I326	H283-S308 PolarHBondContact CE1-OG 3.5Å; H283-S308 PolarHBondContact ND1-OG 3.43Å; C303-S308 WeakPolarHBondContact CA-O 3.38Å; S304-S308 PolarHBondContact N-O 3.47Å; D306-S308 VanDerWaalsContact CG-OG 3.31Å; D306-S308 PolarHBondContact O-N 3.01Å; D306-S308 VanDerWaalsContact OD1-CB 3.24Å; D306-S308 WeakPolarHBondContact OD1-CB 3.39Å; D306-S308 PolarHBondContact OD1-N 2.88Å; D306-S308 PolarHBondContact OD1-OG 3.21Å; D306-S308 PolarHBondContact OD2-OG 3.32Å; S308-K310 WeakPolarHBondContact OG-CE 3.33Å; S308-K310 PolarHBondContact OG-NZ 2.84Å; S308-K310 VanDerWaalsContact OG-NZ 3.09Å; S308-I326 VanDerWaalsContact CA-O 3.28Å; S308-I326 WeakPolarHBondContact CA-O 2.77Å; S308-I326 WeakPolarHBondContact CB-O 3.13Å
309	I	98.8	Very high	97.8	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128.1	165.5	-60.4	168.9	0	0	0	107.2	S302 C303 I326 A329 V334 I337 L346 W358	S302-I309 CarbonylContact O-C 3.49Å; S302-I309 VanDerWaalsContact O-CA 3.3Å; S302-I309 WeakPolarHBondContact O-CA 3.47Å; C303-I309 HydrophobicContact CB-CG1 4.2Å; I309-I326 HydrophobicContact CB-CB 4.36Å; I309-I326 HydrophobicContact CB-CD1 4.24Å; I309-I326 HydrophobicContact CG2-CD1 4.41Å; I309-I326 PolarHBondContact N-O 2.68Å; I309-I326 PolarHBondContact O-N 3.4Å; I309-A329 HydrophobicContact CB-CB 4.32Å; I309-A329 HydrophobicContact CD1-CB 3.78Å; I309-A329 HydrophobicContact CG1-CB 3.76Å; I309-V334 HydrophobicContact CD1-CG1 4.4Å; I309-V334 HydrophobicContact CG1-CG1 4.17Å; I309-I337 HydrophobicContact CD1-CG2 4.31Å; I309-I337 HydrophobicContact CG1-CG2 4.44Å; I309-L346 HydrophobicContact CD1-CD2 4.05Å; I309-L346 HydrophobicContact CG2-CD1 4.29Å; I309-W358 HydrophobicContact CD1-CZ2 4.17Å
310	K	98.6	Very high	97.7	Very high	8 Å²	8	37.1 Å²	37.1	4%	0.035	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	146.4	-178.6	-63.9	-171.3	-162.5	-52.1	0	111.5	K282 H283 F301 S302 S308 W312 F324 D325	K282-K310 HydrophobicContact CB-CD 4.11Å; K282-K310 WeakPolarHBondContact O-CE 3.33Å; H283-K310 VanDerWaalsContact ND1-CE 3.31Å; H283-K310 WeakPolarHBondContact ND1-CE 3.5Å; F301-K310 CarbonylContact C-O 3.59Å; F301-K310 VanDerWaalsContact CA-O 3.3Å; F301-K310 WeakPolarHBondContact CA-O 3.22Å; S302-K310 PolarHBondContact N-O 2.81Å; S302-K310 PolarHBondContact O-N 2.96Å; S308-K310 WeakPolarHBondContact OG-CE 3.33Å; S308-K310 PolarHBondContact OG-NZ 2.84Å; S308-K310 VanDerWaalsContact OG-NZ 3.09Å; K310-W312 HydrophobicContact CB-CZ2 3.88Å; K310-W312 HydrophobicContact CD-CH2 4.26Å; K310-W312 HydrophobicContact CD-CZ2 3.82Å; K310-W312 HydrophobicContact CG-CZ2 4.47Å; K310-F324 WeakPolarHBondContact CA-O 3.43Å; K310-D325 HydrophobicContact CG-CB 4.47Å; K310-D325 IonicContact NZ-OD1 3.96Å; K310-D325 PolarHBondContact NZ-OD1 3.44Å; K310-D325 IonicContact NZ-OD2 3.89Å; K310-D325 PolarHBondContact NZ-OD2 2.71Å
311	I	98.4	Very high	97.7	Very high	15 Å²	15	37.1 Å²	37.1	8%	0.077	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.6	175.1	-46.8	-175	0	0	0	108.2	V299 F301 C322 I323 F324 I363	V299-I311 HydrophobicContact CG1-CG2 3.59Å; F301-I311 HydrophobicContact CD1-CB 4.41Å; F301-I311 HydrophobicContact CD1-CD1 4.25Å; F301-I311 HydrophobicContact CD1-CG1 3.79Å; F301-I311 HydrophobicContact CD1-CG2 4.23Å; F301-I311 HydrophobicContact CE1-CB 4.45Å; F301-I311 HydrophobicContact CE1-CD1 3.81Å; F301-I311 HydrophobicContact CE1-CG1 3.83Å; F301-I311 HydrophobicContact CE1-CG2 3.94Å; I311-C322 CarbonylContact O-C 3.5Å; I311-I323 HydrophobicContact CB-CG1 4.06Å; I311-I323 HydrophobicContact CG2-CD1 3.88Å; I311-I323 HydrophobicContact CG2-CG1 3.88Å; I311-I323 VanDerWaalsContact O-CG1 3.31Å; I311-I323 WeakPolarHBondContact O-CG1 3.24Å; I311-I323 PolarHBondContact O-N 2.87Å; I311-F324 HydrophobicContact CB-CB 4.03Å; I311-F324 HydrophobicContact CD1-CB 3.94Å; I311-F324 HydrophobicContact CD1-CD1 4.21Å; I311-F324 HydrophobicContact CD1-CG 4.41Å; I311-F324 HydrophobicContact CG1-CB 4.03Å; I311-F324 PolarHBondContact N-O 2.95Å; I311-F324 PolarHBondContact O-N 2.84Å; I311-I363 HydrophobicContact CD1-CG1 4.07Å; I311-I363 HydrophobicContact CD1-CG2 4.47Å
312	W	98.6	Very high	97.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	144.4	-171.8	-53.9	89.1	0	0	0	112.1	I262 F280 K282 H283 V299 F300 S302 K310 A321 C322	I262-W312 HydrophobicContact CD1-CH2 4.35Å; I262-W312 HydrophobicContact CD1-CZ2 3.69Å; F280-W312 HydrophobicContact CB-CE3 4.02Å; F280-W312 HydrophobicContact CB-CH2 4.08Å; F280-W312 HydrophobicContact CB-CZ3 3.58Å; F280-W312 HydrophobicContact CD2-CD2 4.18Å; F280-W312 AromaticContact CD2-CE3 3.58Å; F280-W312 HydrophobicContact CD2-CE3 3.58Å; F280-W312 HydrophobicContact CD2-CZ3 4.06Å; F280-W312 HydrophobicContact CE2-CE3 4.4Å; F280-W312 HydrophobicContact CG-CE3 4.17Å; F280-W312 HydrophobicContact CG-CZ3 4.19Å; K282-W312 HydrophobicContact CB-CH2 3.61Å; K282-W312 HydrophobicContact CB-CZ3 4.08Å; K282-W312 HydrophobicContact CG-CH2 4.09Å; K282-W312 HydrophobicContact CG-CZ3 4.04Å; H283-W312 AromaticContact CD2-CZ2 3.92Å; V299-W312 VanDerWaalsContact CA-O 3.28Å; V299-W312 WeakPolarHBondContact CA-O 3.25Å; F300-W312 HydrophobicContact CD1-CB 3.78Å; F300-W312 HydrophobicContact CD2-CB 4.07Å; F300-W312 AromaticContact CD2-CD1 3.58Å; F300-W312 HydrophobicContact CD2-CG 4.03Å; F300-W312 HydrophobicContact CE1-CB 3.37Å; F300-W312 HydrophobicContact CE1-CG 4.05Å; F300-W312 HydrophobicContact CE2-CB 3.7Å; F300-W312 AromaticContact CE2-CD1 3.26Å; F300-W312 HydrophobicContact CE2-CD2 4.2Å; F300-W312 AromaticContact CE2-CG 3.45Å; F300-W312 HydrophobicContact CE2-CG 3.45Å; F300-W312 VanDerWaalsContact CE2-CG 3.45Å; F300-W312 AromaticContact CE2-NE1 3.89Å; F300-W312 HydrophobicContact CG-CB 4.12Å; F300-W312 HydrophobicContact CZ-CB 3.34Å; F300-W312 AromaticContact CZ-CD1 3.82Å; F300-W312 HydrophobicContact CZ-CD2 4.13Å; F300-W312 AromaticContact CZ-CG 3.48Å; F300-W312 HydrophobicContact CZ-CG 3.48Å; F300-W312 VanDerWaalsContact CZ-CG 3.48Å; F300-W312 PolarHBondContact N-O 3.02Å; F300-W312 PolarHBondContact O-N 3.05Å; S302-W312 PolarHBondContact OG-NE1 2.93Å; K310-W312 HydrophobicContact CB-CZ2 3.88Å; K310-W312 HydrophobicContact CD-CH2 4.26Å; K310-W312 HydrophobicContact CD-CZ2 3.82Å; K310-W312 HydrophobicContact CG-CZ2 4.47Å; W312-A321 CarbonylContact C-O 3.47Å; W312-A321 VanDerWaalsContact CA-O 3.24Å; W312-A321 WeakPolarHBondContact CA-O 3.23Å; W312-A321 HydrophobicContact CE3-CB 4.03Å; W312-C322 HydrophobicContact CD2-CB 4.45Å; W312-C322 HydrophobicContact CE3-CB 3.77Å; W312-C322 HydrophobicContact CH2-CB 4.21Å; W312-C322 HydrophobicContact CZ3-CB 3.62Å
313	D	98.1	Very high	97.6	Very high	24 Å²	24	42.7 Å²	42.7	13%	0.128	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	110.6	164.6	-174.1	-16.4	0	0	0	109.8	R315 A316 A321 I323	D313-R315 PolarHBondContact O-N 3.23Å; D313-R315 VanDerWaalsContact O-N 3.09Å; D313-R315 VanDerWaalsContact OD1-CB 3.29Å; D313-R315 WeakPolarHBondContact OD1-CB 3.4Å; D313-R315 WeakPolarHBondContact OD1-CG 3.48Å; D313-R315 IonicContact OD1-CZ 3.73Å; D313-R315 PolarHBondContact OD1-N 2.9Å; D313-R315 IonicContact OD1-NE 3.78Å; D313-R315 PolarHBondContact OD1-NE 3.07Å; D313-R315 IonicContact OD1-NH2 3.87Å; D313-R315 IonicContact OD2-CZ 3.25Å; D313-R315 IonicContact OD2-NE 3.78Å; D313-R315 PolarHBondContact OD2-NE 3.19Å; D313-R315 IonicContact OD2-NH2 2.92Å; D313-R315 PolarHBondContact OD2-NH2 3.37Å; D313-A316 HydrophobicContact CB-CB 4.45Å; D313-A316 PolarHBondContact O-N 2.72Å; D313-A316 VanDerWaalsContact O-N 3.11Å; D313-A321 PolarHBondContact N-O 3.21Å; D313-I323 HydrophobicContact CB-CG2 3.81Å
314	A	97.5	Very high	97.5	Very high	22 Å²	22	44.7 Å²	44.7	18%	0.182	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-11.4	-178.7	0	0	0	0	0	114.7	L264 W292 N298 F300	L264-A314 HydrophobicContact CD1-CB 3.66Å; W292-A314 HydrophobicContact CH2-CB 3.64Å; W292-A314 HydrophobicContact CZ3-CB 3.93Å; N298-A314 HydrophobicContact CB-CB 4.4Å; N298-A314 VanDerWaalsContact O-CB 3.29Å; N298-A314 WeakPolarHBondContact O-CB 3.37Å; N298-A314 PolarHBondContact O-N 2.88Å; F300-A314 HydrophobicContact CD1-CB 4.42Å; F300-A314 HydrophobicContact CE1-CB 4.3Å
315	R	96.5	Very high	97.4	Very high	178 Å²	178	47 Å²	47	67%	0.672	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-23.4	176.2	-58	169.7	-65.5	177.6	4.5	112.4	N298 D313	N298-R315 HydrophobicContact CB-CG 3.83Å; D313-R315 PolarHBondContact O-N 3.23Å; D313-R315 VanDerWaalsContact O-N 3.09Å; D313-R315 VanDerWaalsContact OD1-CB 3.29Å; D313-R315 WeakPolarHBondContact OD1-CB 3.4Å; D313-R315 WeakPolarHBondContact OD1-CG 3.48Å; D313-R315 IonicContact OD1-CZ 3.73Å; D313-R315 PolarHBondContact OD1-N 2.9Å; D313-R315 IonicContact OD1-NE 3.78Å; D313-R315 PolarHBondContact OD1-NE 3.07Å; D313-R315 IonicContact OD1-NH2 3.87Å; D313-R315 IonicContact OD2-CZ 3.25Å; D313-R315 IonicContact OD2-NE 3.78Å; D313-R315 PolarHBondContact OD2-NE 3.19Å; D313-R315 IonicContact OD2-NH2 2.92Å; D313-R315 PolarHBondContact OD2-NH2 3.37Å
316	A	96.6	Very high	97.3	Very high	32 Å²	32	45.7 Å²	45.7	26%	0.264	23%	0.226	S	C	.	.	S	Bend	trans	-76.8	156.8	-176	0	0	0	0	0	110.9	D313 A321	D313-A316 HydrophobicContact CB-CB 4.45Å; D313-A316 PolarHBondContact O-N 2.72Å; D313-A316 VanDerWaalsContact O-N 3.11Å; A316-A321 HydrophobicContact CB-CB 4.32Å
317	K	95.3	Very high	97.3	Very high	125 Å²	125	51.5 Å²	51.5	54%	0.543	25%	0.249	S	C	.	.			trans	-67.9	150.6	170.4	-62.3	-178.7	-178.8	176.9	0	109.6	E319 N320 A321	K317-E319 VanDerWaalsContact CB-CD 3.44Å; K317-E319 HydrophobicContact CB-CG 4.33Å; K317-E319 WeakPolarHBondContact CB-OE1 3.12Å; K317-E319 WeakPolarHBondContact CB-OE2 3.31Å; K317-E319 WeakPolarHBondContact CD-OE1 3.33Å; K317-E319 PolarHBondContact O-N 2.98Å; K317-N320 CarbonylContact O-C 3.5Å; K317-N320 PolarHBondContact O-N 2.78Å; K317-A321 PolarHBondContact O-N 3.17Å
318	P	94.8	Very high	97.2	Very high	13 Å²	13	53.7 Å²	53.7	8%	0.084	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-47.3	-39	-176.4	-31	35.1	0	0	0	115.5	R278 F280 N320 A321	R278-P318 HydrophobicContact CB-CG 3.74Å; R278-P318 VanDerWaalsContact O-CG 3.31Å; R278-P318 WeakPolarHBondContact O-CG 3.21Å; F280-P318 VanDerWaalsContact CD1-CA 3.5Å; F280-P318 HydrophobicContact CD1-CB 3.69Å; F280-P318 HydrophobicContact CD1-CG 3.8Å; F280-P318 HydrophobicContact CE1-CB 4.18Å; F280-P318 HydrophobicContact CE1-CG 3.91Å; P318-N320 PolarHBondContact O-N 2.99Å; P318-A321 PolarHBondContact O-N 3.02Å
319	E	94.3	Very high	97.2	Very high	99 Å²	99	53.5 Å²	53.5	46%	0.463	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-62.1	-26.2	179.8	58.2	-90.7	-155.9	0	0	114.4	K282 K317	K282-E319 WeakPolarHBondContact CE-O 3.3Å; K317-E319 VanDerWaalsContact CB-CD 3.44Å; K317-E319 HydrophobicContact CB-CG 4.33Å; K317-E319 WeakPolarHBondContact CB-OE1 3.12Å; K317-E319 WeakPolarHBondContact CB-OE2 3.31Å; K317-E319 WeakPolarHBondContact CD-OE1 3.33Å; K317-E319 PolarHBondContact O-N 2.98Å
320	N	96.4	Very high	97.1	Very high	114 Å²	114	53.5 Å²	53.5	61%	0.61	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-121.1	7.5	-175	-61.3	-31.2	0	0	0	112.8	K317 P318	K317-N320 CarbonylContact O-C 3.5Å; K317-N320 PolarHBondContact O-N 2.78Å; P318-N320 PolarHBondContact O-N 2.99Å
321	A	97.8	Very high	97.1	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.294	C	S	.	.			trans	-73.6	-29.7	-171.1	0	0	0	0	0	113.8	F280 W312 D313 A316 K317 P318 I323	F280-A321 HydrophobicContact CD1-CB 3.91Å; F280-A321 HydrophobicContact CD2-CB 3.58Å; F280-A321 HydrophobicContact CE1-CB 3.71Å; F280-A321 HydrophobicContact CE2-CB 3.38Å; F280-A321 HydrophobicContact CG-CB 3.83Å; F280-A321 HydrophobicContact CZ-CB 3.43Å; F280-A321 VanDerWaalsContact CZ-CB 3.43Å; W312-A321 CarbonylContact C-O 3.47Å; W312-A321 VanDerWaalsContact CA-O 3.24Å; W312-A321 WeakPolarHBondContact CA-O 3.23Å; W312-A321 HydrophobicContact CE3-CB 4.03Å; D313-A321 PolarHBondContact N-O 3.21Å; A316-A321 HydrophobicContact CB-CB 4.32Å; K317-A321 PolarHBondContact O-N 3.17Å; P318-A321 PolarHBondContact O-N 3.02Å; A321-I323 PolarHBondContact O-N 2.59Å
322	C	98	Very high	97.1	Very high	32 Å²	32	59.4 Å²	59.4	22%	0.216	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	109.7	174	-175.6	0	0	0	0	109.2	K282 I311 W312 F324	K282-C322 HydrophobicContact CB-CB 4.18Å; K282-C322 HydrophobicContact CG-CB 3.8Å; I311-C322 CarbonylContact O-C 3.5Å; W312-C322 HydrophobicContact CD2-CB 4.45Å; W312-C322 HydrophobicContact CE3-CB 3.77Å; W312-C322 HydrophobicContact CH2-CB 4.21Å; W312-C322 HydrophobicContact CZ3-CB 3.62Å; C322-F324 PolarHBondContact SG-O 2.81Å
323	I	97.1	Very high	97.1	Very high	93 Å²	93	61.7 Å²	61.7	48%	0.477	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-21.5	-177.7	58.9	169.8	0	0	0	112.8	I311 D313 A321	I311-I323 HydrophobicContact CB-CG1 4.06Å; I311-I323 HydrophobicContact CG2-CD1 3.88Å; I311-I323 HydrophobicContact CG2-CG1 3.88Å; I311-I323 VanDerWaalsContact O-CG1 3.31Å; I311-I323 WeakPolarHBondContact O-CG1 3.24Å; I311-I323 PolarHBondContact O-N 2.87Å; D313-I323 HydrophobicContact CB-CG2 3.81Å; A321-I323 PolarHBondContact O-N 2.59Å
324	F	97.3	Very high	97.1	Very high	42 Å²	42	60.6 Å²	60.6	18%	0.184	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	149	174.6	-161.2	-99.2	0	0	0	111.1	K310 I311 C322 I326 I363	K310-F324 WeakPolarHBondContact CA-O 3.43Å; I311-F324 HydrophobicContact CB-CB 4.03Å; I311-F324 HydrophobicContact CD1-CB 3.94Å; I311-F324 HydrophobicContact CD1-CD1 4.21Å; I311-F324 HydrophobicContact CD1-CG 4.41Å; I311-F324 HydrophobicContact CG1-CB 4.03Å; I311-F324 PolarHBondContact N-O 2.95Å; I311-F324 PolarHBondContact O-N 2.84Å; C322-F324 PolarHBondContact SG-O 2.81Å; F324-I326 HydrophobicContact CD1-CG1 4.03Å; F324-I326 HydrophobicContact CE1-CG1 3.83Å; F324-I363 HydrophobicContact CD1-CG1 4.03Å; F324-I363 HydrophobicContact CD1-CG2 4.24Å; F324-I363 HydrophobicContact CE1-CB 4.43Å; F324-I363 HydrophobicContact CE1-CG1 3.89Å; F324-I363 HydrophobicContact CE1-CG2 4.18Å; F324-I363 WeakPolarHBondContact CE1-O 3.23Å; F324-I363 HydrophobicContact CZ-CG2 4.41Å; F324-I363 WeakPolarHBondContact CZ-O 3.5Å
325	D	96.5	Very high	97.2	Very high	50 Å²	50	60.6 Å²	60.6	27%	0.267	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	110.1	-173.7	-178.5	9.7	0	0	0	110.5	K310 K327	K310-D325 HydrophobicContact CG-CB 4.47Å; K310-D325 IonicContact NZ-OD1 3.96Å; K310-D325 PolarHBondContact NZ-OD1 3.44Å; K310-D325 IonicContact NZ-OD2 3.89Å; K310-D325 PolarHBondContact NZ-OD2 2.71Å; D325-K327 PolarHBondContact O-N 3.03Å; D325-K327 WeakPolarHBondContact OD2-CE 3.31Å
326	I	97.8	Very high	97.3	Very high	4 Å²	4	52.3 Å²	52.3	2%	0.021	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	87	173.3	-49.1	173.3	0	0	0	107.4	S308 I309 F324 A329 W358 I363	S308-I326 VanDerWaalsContact CA-O 3.28Å; S308-I326 WeakPolarHBondContact CA-O 2.77Å; S308-I326 WeakPolarHBondContact CB-O 3.13Å; I309-I326 HydrophobicContact CB-CB 4.36Å; I309-I326 HydrophobicContact CB-CD1 4.24Å; I309-I326 HydrophobicContact CG2-CD1 4.41Å; I309-I326 PolarHBondContact N-O 2.68Å; I309-I326 PolarHBondContact O-N 3.4Å; F324-I326 HydrophobicContact CD1-CG1 4.03Å; F324-I326 HydrophobicContact CE1-CG1 3.83Å; I326-A329 HydrophobicContact CB-CB 4.28Å; I326-A329 HydrophobicContact CG2-CB 3.81Å; I326-A329 PolarHBondContact O-N 3.25Å; I326-W358 HydrophobicContact CD1-CD2 4.43Å; I326-W358 HydrophobicContact CD1-CE3 4.14Å; I326-W358 HydrophobicContact CD1-CZ3 4.48Å; I326-W358 HydrophobicContact CG2-CE3 4.43Å; I326-W358 HydrophobicContact CG2-CH2 3.97Å; I326-W358 HydrophobicContact CG2-CZ3 3.75Å; I326-I363 HydrophobicContact CD1-CD1 3.48Å; I326-I363 VanDerWaalsContact CD1-CD1 3.48Å; I326-I363 HydrophobicContact CD1-CG1 3.96Å; I326-I363 HydrophobicContact CG1-CD1 4.42Å; I326-I363 HydrophobicContact CG1-CG1 4.45Å
327	K	96.8	Very high	97.4	Very high	153 Å²	153	50.8 Å²	50.8	67%	0.665	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	138	177.1	-62.6	-173.5	178.1	-169.4	0	110.7	D325 A329	D325-K327 PolarHBondContact O-N 3.03Å; D325-K327 WeakPolarHBondContact OD2-CE 3.31Å; K327-A329 PolarHBondContact O-N 2.77Å
328	N	97.1	Very high	97.6	Very high	118 Å²	118	45.4 Å²	45.4	63%	0.631	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	47.2	-174.6	-48.9	-56.6	0	0	0	111	K307 H330	K307-N328 CarbonylContact O-C 3.58Å; K307-N328 WeakPolarHBondContact O-CA 3.48Å; N328-H330 CarbonylContact C-O 3.54Å; N328-H330 PolarHBondContact O-N 3.48Å
329	A	98.2	Very high	97.7	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.008	23%	0.232	C	C	.	.	S	Bend	trans	-54.5	-37.2	172.8	0	0	0	0	0	109.8	K307 I309 I326 K327 V334 K356 W358	K307-A329 PolarHBondContact O-N 2.9Å; I309-A329 HydrophobicContact CB-CB 4.32Å; I309-A329 HydrophobicContact CD1-CB 3.78Å; I309-A329 HydrophobicContact CG1-CB 3.76Å; I326-A329 HydrophobicContact CB-CB 4.28Å; I326-A329 HydrophobicContact CG2-CB 3.81Å; I326-A329 PolarHBondContact O-N 3.25Å; K327-A329 PolarHBondContact O-N 2.77Å; A329-V334 HydrophobicContact CB-CG2 4.48Å; A329-K356 WeakPolarHBondContact O-CD 3.4Å; A329-K356 PolarHBondContact O-NZ 2.86Å; A329-W358 HydrophobicContact CB-CH2 3.89Å; A329-W358 HydrophobicContact CB-CZ2 3.84Å; A329-W358 WeakPolarHBondContact O-CH2 3.14Å; A329-W358 WeakPolarHBondContact O-CZ2 3.21Å
330	H	98.4	Very high	97.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	-127.3	166.6	171.9	-74.4	-107.1	0	0	0	111.9	K307 N328 S332 V334 S348 D350 A354	K307-H330 PolarHBondContact O-N 3.36Å; N328-H330 CarbonylContact C-O 3.54Å; N328-H330 PolarHBondContact O-N 3.48Å; H330-S332 VanDerWaalsContact C-N 3.33Å; H330-S332 WeakPolarHBondContact CB-O 3.37Å; H330-V334 HydrophobicContact CB-CG2 3.82Å; H330-S348 PolarHBondContact NE2-OG 3.48Å; H330-D350 HydrophobicContact CB-CB 3.84Å; H330-D350 WeakPolarHBondContact CB-OD2 3.31Å; H330-D350 IonicContact CE1-OD2 3.66Å; H330-D350 IonicContact CG-OD2 3.7Å; H330-D350 WeakPolarHBondContact ND1-CB 3.42Å; H330-D350 VanDerWaalsContact ND1-CG 3.26Å; H330-D350 IonicContact ND1-OD2 2.78Å; H330-D350 PolarHBondContact ND1-OD2 2.94Å; H330-A354 PolarHBondContact CE1-O 2.83Å
331	D	97.5	Very high	97.5	Very high	129 Å²	129	39.1 Å²	39.1	69%	0.69	21%	0.21	S	C	*	.	S	Bend	trans	-84.1	-15	176.9	-65.9	-42.9	0	0	0	111.9	K307	K307-D331 WeakPolarHBondContact CD-O 3.37Å; K307-D331 WeakPolarHBondContact CE-O 3.45Å; K307-D331 PolarHBondContact NZ-O 2.97Å
332	S	98.2	Very high	97	Very high	19 Å²	19	41.1 Å²	41.1	13%	0.133	23%	0.226	C	C	.	.	S	Bend	trans	-126.8	-175.3	173.1	-159.5	0	0	0	0	111.1	K307 H330 D351 D352	K307-S332 WeakPolarHBondContact CB-O 3.47Å; K307-S332 WeakPolarHBondContact CG-O 3.27Å; H330-S332 VanDerWaalsContact C-N 3.33Å; H330-S332 WeakPolarHBondContact CB-O 3.37Å; S332-D351 WeakPolarHBondContact OG-CB 3.21Å; S332-D352 WeakPolarHBondContact CB-OD2 3.36Å
333	D	98.4	Very high	96.7	Very high	48 Å²	48	42.4 Å²	42.4	26%	0.257	23%	0.229	S	C	.	.			trans	-61.5	134.3	-177.6	-67.1	12.8	0	0	0	110.3	S305 D350 D351	S305-D333 VanDerWaalsContact CB-OD2 3.29Å; S305-D333 WeakPolarHBondContact CB-OD2 3.41Å; D333-D350 CarbonylContact O-C 3.58Å; D333-D350 WeakPolarHBondContact O-CA 3.35Å; D333-D350 WeakPolarHBondContact O-CB 3.38Å; D333-D351 HydrophobicContact CB-CB 4.43Å; D333-D351 PolarHBondContact O-N 2.82Å
334	V	98.9	Very high	96.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	107.2	-177.8	-171.4	0	0	0	0	108.1	E288 C303 S304 I309 A329 H330 I337	E288-V334 WeakPolarHBondContact CB-O 3.26Å; C303-V334 HydrophobicContact CB-CB 3.83Å; C303-V334 HydrophobicContact CB-CG1 3.46Å; C303-V334 VanDerWaalsContact CB-CG1 3.46Å; C303-V334 PolarHBondContact SG-O 3.01Å; S304-V334 PolarHBondContact N-O 3.36Å; S304-V334 PolarHBondContact O-N 3.07Å; S304-V334 VanDerWaalsContact O-N 3.13Å; I309-V334 HydrophobicContact CD1-CG1 4.4Å; I309-V334 HydrophobicContact CG1-CG1 4.17Å; A329-V334 HydrophobicContact CB-CG2 4.48Å; H330-V334 HydrophobicContact CB-CG2 3.82Å; V334-I337 HydrophobicContact CG1-CG2 4.49Å
335	N	98.8	Very high	96.5	Very high	22 Å²	22	40.3 Å²	40.3	12%	0.118	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-36.2	-168.5	-64.2	-20.1	0	0	0	113.4	E288 G349 D351 I379	E288-N335 VanDerWaalsContact CB-O 3.26Å; E288-N335 WeakPolarHBondContact CB-O 3.44Å; N335-G349 PolarHBondContact N-O 3.09Å; N335-D351 PolarHBondContact ND2-OD1 3.41Å; N335-D351 PolarHBondContact OD1-OD1 2.97Å; N335-I379 VanDerWaalsContact CB-O 3.28Å; N335-I379 WeakPolarHBondContact CB-O 3.35Å; N335-I379 PolarHBondContact ND2-O 2.75Å
336	V	98.8	Very high	96.6	Very high	5 Å²	5	38 Å²	38	3%	0.03	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	149.9	-171.2	-72	0	0	0	0	112.5	S348 G349 I379 N380 V382	V336-S348 VanDerWaalsContact O-CA 3.29Å; V336-S348 WeakPolarHBondContact O-CA 3.42Å; V336-G349 PolarHBondContact O-N 3.43Å; V336-I379 HydrophobicContact CG2-CB 4.47Å; V336-I379 HydrophobicContact CG2-CG2 3.8Å; V336-N380 WeakPolarHBondContact CG1-O 3.17Å; V336-V382 HydrophobicContact CB-CG2 4.08Å; V336-V382 HydrophobicContact CG2-CB 4.4Å; V336-V382 HydrophobicContact CG2-CG1 3.99Å; V336-V382 HydrophobicContact CG2-CG2 3.79Å
337	I	98.9	Very high	96.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	153.5	172.8	54.8	172.6	0	0	0	111.2	D289 R291 F301 C303 I309 V334 L346 I347	D289-I337 HydrophobicContact CB-CG1 4.16Å; D289-I337 PolarHBondContact OD2-N 3.01Å; R291-I337 HydrophobicContact CG-CG1 4.05Å; R291-I337 WeakPolarHBondContact CG-O 3.4Å; R291-I337 PolarHBondContact NE-O 2.88Å; F301-I337 HydrophobicContact CB-CD1 3.65Å; C303-I337 HydrophobicContact CB-CD1 4.44Å; C303-I337 HydrophobicContact CB-CG2 3.72Å; I309-I337 HydrophobicContact CD1-CG2 4.31Å; I309-I337 HydrophobicContact CG1-CG2 4.44Å; V334-I337 HydrophobicContact CG1-CG2 4.49Å; I337-L346 HydrophobicContact CB-CD2 4.45Å; I337-L346 HydrophobicContact CG2-CD2 4.11Å; I337-I347 CarbonylContact C-O 3.55Å; I337-I347 WeakPolarHBondContact CA-O 2.92Å
338	D	98.7	Very high	96.7	Very high	12 Å²	12	30.6 Å²	30.6	6%	0.064	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	154.6	166.1	-169.8	34.2	0	0	0	112	L346 I347 V382 W384	D338-L346 CarbonylContact O-C 3.6Å; D338-L346 WeakPolarHBondContact O-CA 3.42Å; D338-I347 HydrophobicContact CB-CG2 3.72Å; D338-I347 PolarHBondContact N-O 3.27Å; D338-I347 PolarHBondContact O-N 2.9Å; D338-V382 HydrophobicContact CB-CG2 4.28Å; D338-V382 WeakPolarHBondContact CB-O 3.3Å; D338-W384 PolarHBondContact O-NE1 2.88Å; D338-W384 PolarHBondContact OD2-N 3.04Å
339	V	97.9	Very high	96.8	Very high	8 Å²	8	25 Å²	25	5%	0.048	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	122.2	-175.3	-176.4	0	0	0	0	109.3	R291 F301 S341 L346 L360	R291-V339 HydrophobicContact CB-CG2 4.17Å; F301-V339 HydrophobicContact CD2-CG2 3.5Å; F301-V339 VanDerWaalsContact CD2-CG2 3.5Å; F301-V339 HydrophobicContact CE2-CG1 4.28Å; F301-V339 HydrophobicContact CE2-CG2 3.74Å; F301-V339 HydrophobicContact CG-CG2 4.2Å; V339-S341 PolarHBondContact O-N 2.88Å; V339-L346 HydrophobicContact CG2-CD1 4.27Å; V339-L360 HydrophobicContact CG1-CD1 4.25Å
340	S	96.4	Very high	96.8	Very high	8 Å²	8	25.1 Å²	25.1	6%	0.056	14%	0.144	C	C	.	.			trans	-64.2	134.4	-179.9	-178.4	0	0	0	0	111	A342 Q343 L345 W384	S340-A342 PolarHBondContact OG-N 2.97Å; S340-Q343 WeakPolarHBondContact CB-O 3.07Å; S340-Q343 PolarHBondContact OG-N 3.13Å; S340-Q343 VanDerWaalsContact OG-N 3.13Å; S340-L345 PolarHBondContact N-O 2.95Å; S340-W384 VanDerWaalsContact N-CD1 3.25Å
341	S	90.1	Very high	96.8	Very high	77 Å²	77	27.8 Å²	27.8	54%	0.538	16%	0.158	S	C	.	.	S	Bend	trans	-78.3	-23.6	170.3	58.7	0	0	0	0	112.4	V339	V339-S341 PolarHBondContact O-N 2.88Å
342	A	87.7	Confident	96.8	Very high	42 Å²	42	25.7 Å²	25.7	35%	0.347	15%	0.147	S	C	.	.	S	Bend	trans	-96.7	-21.5	-173.6	0	0	0	0	0	113.5	S340 K389	S340-A342 PolarHBondContact OG-N 2.97Å; A342-K389 HydrophobicContact CB-CG 3.99Å
343	Q	90.6	Very high	96.8	Very high	60 Å²	60	24.8 Å²	24.8	28%	0.28	14%	0.141	S	C	.	.	S	Bend	trans	-139.3	158.4	-177	-62.9	177.6	-51.6	0	0	110.5	S340 L345 K389	S340-Q343 WeakPolarHBondContact CB-O 3.07Å; S340-Q343 PolarHBondContact OG-N 3.13Å; S340-Q343 VanDerWaalsContact OG-N 3.13Å; Q343-L345 HydrophobicContact CB-CB 4.41Å; Q343-L345 HydrophobicContact CB-CD1 4.12Å; Q343-L345 HydrophobicContact CB-CG 3.9Å; Q343-L345 PolarHBondContact O-N 2.9Å; Q343-L345 VanDerWaalsContact OE1-CD1 3.29Å; Q343-K389 HydrophobicContact CG-CB 4.25Å; Q343-K389 HydrophobicContact CG-CD 4.11Å; Q343-K389 HydrophobicContact CG-CG 3.96Å
344	Q	94	Very high	96.8	Very high	74 Å²	74	22.8 Å²	22.8	35%	0.346	13%	0.131	S	C	.	.	S	Bend	trans	-81.1	55.8	173.8	-69.4	-67.2	-40.3	0	0	110.3	S295 L360 R361	S295-Q344 PolarHBondContact OG-NE2 3.25Å; Q344-L360 HydrophobicContact CB-CB 4.35Å; Q344-L360 WeakPolarHBondContact O-CB 3.34Å; Q344-L360 PolarHBondContact O-N 2.89Å; Q344-R361 HydrophobicContact CB-CG 3.82Å; Q344-R361 HydrophobicContact CG-CG 4.2Å
345	L	97	Very high	96.8	Very high	16 Å²	16	23 Å²	23	8%	0.084	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	144	-178	-63.1	-178.2	0	0	0	111.2	S340 Q343 I357 W358 D359 W384 L406	S340-L345 PolarHBondContact N-O 2.95Å; Q343-L345 HydrophobicContact CB-CB 4.41Å; Q343-L345 HydrophobicContact CB-CD1 4.12Å; Q343-L345 HydrophobicContact CB-CG 3.9Å; Q343-L345 PolarHBondContact O-N 2.9Å; Q343-L345 VanDerWaalsContact OE1-CD1 3.29Å; L345-I357 HydrophobicContact CB-CG2 4.45Å; L345-I357 HydrophobicContact CD1-CG2 4.14Å; L345-I357 HydrophobicContact CD2-CG2 4.22Å; L345-W358 VanDerWaalsContact CA-O 3.31Å; L345-W358 WeakPolarHBondContact CA-O 3.48Å; L345-D359 HydrophobicContact CD2-CB 4.15Å; L345-W384 HydrophobicContact CB-CH2 4.32Å; L345-W384 HydrophobicContact CB-CZ2 3.82Å; L345-W384 HydrophobicContact CD1-CH2 3.9Å; L345-W384 HydrophobicContact CD1-CZ2 4.26Å; L345-L406 HydrophobicContact CD1-CD1 4.24Å
346	L	98.3	Very high	96.8	Very high	3 Å²	3	23.1 Å²	23.1	2%	0.016	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	140.6	166.3	-179.2	151.9	0	0	0	108.5	F301 I309 I337 D338 V339 I357 W358 L360	F301-L346 HydrophobicContact CB-CD1 3.98Å; F301-L346 HydrophobicContact CD1-CD1 3.59Å; F301-L346 HydrophobicContact CE1-CD1 4.21Å; F301-L346 HydrophobicContact CG-CD1 3.78Å; I309-L346 HydrophobicContact CD1-CD2 4.05Å; I309-L346 HydrophobicContact CG2-CD1 4.29Å; I337-L346 HydrophobicContact CB-CD2 4.45Å; I337-L346 HydrophobicContact CG2-CD2 4.11Å; D338-L346 CarbonylContact O-C 3.6Å; D338-L346 WeakPolarHBondContact O-CA 3.42Å; V339-L346 HydrophobicContact CG2-CD1 4.27Å; L346-I357 CarbonylContact O-C 3.56Å; L346-I357 WeakPolarHBondContact O-CA 3.03Å; L346-W358 HydrophobicContact CB-CB 4.34Å; L346-W358 HydrophobicContact CD2-CG 4.17Å; L346-W358 PolarHBondContact N-O 2.88Å; L346-W358 PolarHBondContact O-N 3.1Å; L346-L360 HydrophobicContact CB-CD2 3.96Å; L346-L360 HydrophobicContact CB-CG 4.35Å; L346-L360 HydrophobicContact CD1-CD2 4.5Å
347	I	98.7	Very high	96.8	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	144.2	169.5	-177.8	164.9	0	0	0	108.7	I337 D338 V355 K356 I357 V382 W384 F392	I337-I347 CarbonylContact C-O 3.55Å; I337-I347 WeakPolarHBondContact CA-O 2.92Å; D338-I347 HydrophobicContact CB-CG2 3.72Å; D338-I347 PolarHBondContact N-O 3.27Å; D338-I347 PolarHBondContact O-N 2.9Å; I347-V355 HydrophobicContact CD1-CG1 3.61Å; I347-V355 HydrophobicContact CG1-CG1 3.69Å; I347-K356 CarbonylContact C-O 3.54Å; I347-K356 WeakPolarHBondContact CA-O 3.4Å; I347-I357 HydrophobicContact CB-CD1 3.85Å; I347-I357 HydrophobicContact CD1-CD1 3.75Å; I347-I357 HydrophobicContact CG1-CD1 3.65Å; I347-V382 HydrophobicContact CD1-CB 4.02Å; I347-V382 HydrophobicContact CD1-CG1 4.14Å; I347-V382 HydrophobicContact CG1-CB 4.07Å; I347-V382 HydrophobicContact CG1-CG1 4.18Å; I347-V382 HydrophobicContact CG1-CG2 4.3Å; I347-V382 HydrophobicContact CG2-CB 3.96Å; I347-V382 HydrophobicContact CG2-CG2 3.73Å; I347-W384 HydrophobicContact CB-CZ2 3.85Å; I347-W384 HydrophobicContact CG2-CZ2 4.37Å; I347-W384 VanDerWaalsContact CG2-NE1 3.28Å; I347-F392 HydrophobicContact CD1-CB 4.26Å; I347-F392 HydrophobicContact CD1-CD1 4.38Å; I347-F392 HydrophobicContact CD1-CD2 3.26Å; I347-F392 HydrophobicContact CD1-CE2 3.55Å; I347-F392 HydrophobicContact CD1-CG 3.72Å; I347-F392 HydrophobicContact CD1-CZ 4.23Å
348	S	98.8	Very high	96.7	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	148.3	174	60.3	0	0	0	0	111.7	H330 V336 V355 K356 W358	H330-S348 PolarHBondContact NE2-OG 3.48Å; V336-S348 VanDerWaalsContact O-CA 3.29Å; V336-S348 WeakPolarHBondContact O-CA 3.42Å; S348-V355 CarbonylContact O-C 3.58Å; S348-V355 VanDerWaalsContact O-CA 3.29Å; S348-V355 WeakPolarHBondContact O-CA 3.4Å; S348-K356 PolarHBondContact N-O 3.25Å; S348-K356 PolarHBondContact O-N 3.3Å; S348-W358 PolarHBondContact OG-NE1 3.02Å
349	G	98.8	Very high	96.6	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	145.3	176.1	0	0	0	0	0	111.9	N335 V336 A354	N335-G349 PolarHBondContact N-O 3.09Å; V336-G349 PolarHBondContact O-N 3.43Å; G349-A354 WeakPolarHBondContact CA-O 3.28Å
350	D	98.8	Very high	96.5	Very high	4 Å²	4	24.6 Å²	24.6	2%	0.021	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	172.7	179.9	71	16.8	0	0	0	114.7	H330 D333 D352 G353 A354 I379	H330-D350 HydrophobicContact CB-CB 3.84Å; H330-D350 WeakPolarHBondContact CB-OD2 3.31Å; H330-D350 IonicContact CE1-OD2 3.66Å; H330-D350 IonicContact CG-OD2 3.7Å; H330-D350 WeakPolarHBondContact ND1-CB 3.42Å; H330-D350 VanDerWaalsContact ND1-CG 3.26Å; H330-D350 IonicContact ND1-OD2 2.78Å; H330-D350 PolarHBondContact ND1-OD2 2.94Å; D333-D350 CarbonylContact O-C 3.58Å; D333-D350 WeakPolarHBondContact O-CA 3.35Å; D333-D350 WeakPolarHBondContact O-CB 3.38Å; D350-D352 PolarHBondContact O-N 3.17Å; D350-D352 PolarHBondContact OD1-N 3.4Å; D350-G353 PolarHBondContact O-N 3.31Å; D350-G353 VanDerWaalsContact O-N 3.16Å; D350-G353 PolarHBondContact OD1-N 3.25Å; D350-A354 PolarHBondContact N-O 2.79Å; D350-A354 VanDerWaalsContact N-O 3.1Å; D350-A354 WeakPolarHBondContact OD1-CB 3.47Å; D350-A354 PolarHBondContact OD1-N 3.18Å; D350-A354 WeakPolarHBondContact OD2-CB 3.38Å; D350-I379 PolarHBondContact O-N 3.01Å
351	D	98.3	Very high	96.4	Very high	56 Å²	56	33.1 Å²	33.1	30%	0.299	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-24	176.7	-97.6	-4.5	0	0	0	114.5	S332 D333 N335 G353 P378	S332-D351 WeakPolarHBondContact OG-CB 3.21Å; D333-D351 HydrophobicContact CB-CB 4.43Å; D333-D351 PolarHBondContact O-N 2.82Å; N335-D351 PolarHBondContact ND2-OD1 3.41Å; N335-D351 PolarHBondContact OD1-OD1 2.97Å; D351-G353 VanDerWaalsContact C-N 3.3Å; D351-P378 WeakPolarHBondContact O-CA 3.24Å; D351-P378 WeakPolarHBondContact O-CD 3.32Å; D351-P378 WeakPolarHBondContact O-CG 3.3Å
352	D	97.9	Very high	96.7	Very high	85 Å²	85	31.2 Å²	31.2	46%	0.455	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-3	178.9	-71.1	-26.4	0	0	0	111.8	S332 D350 K373	S332-D352 WeakPolarHBondContact CB-OD2 3.36Å; D350-D352 PolarHBondContact O-N 3.17Å; D350-D352 PolarHBondContact OD1-N 3.4Å; D352-K373 VanDerWaalsContact C-NZ 3.26Å; D352-K373 VanDerWaalsContact CB-NZ 3.28Å; D352-K373 PolarHBondContact O-NZ 3.19Å
353	G	97.6	Very high	96.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.148	C	C	.	.	S	Bend	trans	87.5	14.6	-178.2	0	0	0	0	0	114.5	D350 D351 G377	D350-G353 PolarHBondContact O-N 3.31Å; D350-G353 VanDerWaalsContact O-N 3.16Å; D350-G353 PolarHBondContact OD1-N 3.25Å; D351-G353 VanDerWaalsContact C-N 3.3Å; G353-G377 WeakPolarHBondContact CA-O 3.35Å; G353-G377 PolarHBondContact N-O 3.11Å
354	A	98.2	Very high	97.1	Very high	7 Å²	7	34.7 Å²	34.7	6%	0.058	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	135.9	174.1	0	0	0	0	0	111.3	H330 G349 D350 L371 K373	H330-A354 PolarHBondContact CE1-O 2.83Å; G349-A354 WeakPolarHBondContact CA-O 3.28Å; D350-A354 PolarHBondContact N-O 2.79Å; D350-A354 VanDerWaalsContact N-O 3.1Å; D350-A354 WeakPolarHBondContact OD1-CB 3.47Å; D350-A354 PolarHBondContact OD1-N 3.18Å; D350-A354 WeakPolarHBondContact OD2-CB 3.38Å; A354-L371 HydrophobicContact CB-CD1 3.99Å; A354-K373 HydrophobicContact CB-CD 3.95Å
355	V	98.7	Very high	97	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.018	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	127.7	173.3	178	0	0	0	0	109.1	I347 S348 L371 F372 I379 F392 V394	I347-V355 HydrophobicContact CD1-CG1 3.61Å; I347-V355 HydrophobicContact CG1-CG1 3.69Å; S348-V355 CarbonylContact O-C 3.58Å; S348-V355 VanDerWaalsContact O-CA 3.29Å; S348-V355 WeakPolarHBondContact O-CA 3.4Å; V355-L371 CarbonylContact O-C 3.56Å; V355-L371 WeakPolarHBondContact O-CA 3.14Å; V355-F372 HydrophobicContact CB-CB 4.36Å; V355-F372 HydrophobicContact CG1-CD2 4.47Å; V355-F372 PolarHBondContact N-O 2.82Å; V355-F372 PolarHBondContact O-N 2.77Å; V355-I379 HydrophobicContact CG2-CD1 4.07Å; V355-I379 HydrophobicContact CG2-CG1 4.01Å; V355-F392 HydrophobicContact CG1-CE2 4.22Å; V355-V394 HydrophobicContact CG2-CG1 3.96Å; V355-V394 HydrophobicContact CG2-CG2 4.21Å
356	K	98.5	Very high	96.8	Very high	25 Å²	25	38.3 Å²	38.3	11%	0.109	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	143.2	179.7	-75.6	176.9	176.1	162	0	111.3	A329 I347 S348 W358 P368 A370 L371	A329-K356 WeakPolarHBondContact O-CD 3.4Å; A329-K356 PolarHBondContact O-NZ 2.86Å; I347-K356 CarbonylContact C-O 3.54Å; I347-K356 WeakPolarHBondContact CA-O 3.4Å; S348-K356 PolarHBondContact N-O 3.25Å; S348-K356 PolarHBondContact O-N 3.3Å; K356-W358 HydrophobicContact CB-CZ2 3.84Å; K356-W358 HydrophobicContact CD-CH2 4.09Å; K356-W358 HydrophobicContact CD-CZ2 3.67Å; K356-W358 HydrophobicContact CG-CZ2 4.39Å; K356-P368 HydrophobicContact CB-CB 3.97Å; K356-P368 HydrophobicContact CD-CB 4.15Å; K356-P368 HydrophobicContact CD-CG 3.96Å; K356-P368 HydrophobicContact CG-CB 4.08Å; K356-P368 HydrophobicContact CG-CG 4.25Å; K356-A370 WeakPolarHBondContact CA-O 3.49Å; K356-L371 HydrophobicContact CD-CD1 4.49Å; K356-L371 HydrophobicContact CG-CD1 3.76Å
357	I	98.2	Very high	96.7	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	136.6	174.4	-49.6	-58.8	0	0	0	109.1	L345 L346 I347 P368 V369 A370 F372 W384 F392 L406	L345-I357 HydrophobicContact CB-CG2 4.45Å; L345-I357 HydrophobicContact CD1-CG2 4.14Å; L345-I357 HydrophobicContact CD2-CG2 4.22Å; L346-I357 CarbonylContact O-C 3.56Å; L346-I357 WeakPolarHBondContact O-CA 3.03Å; I347-I357 HydrophobicContact CB-CD1 3.85Å; I347-I357 HydrophobicContact CD1-CD1 3.75Å; I347-I357 HydrophobicContact CG1-CD1 3.65Å; I357-P368 CarbonylContact O-C 3.59Å; I357-P368 WeakPolarHBondContact O-CA 3.43Å; I357-P368 WeakPolarHBondContact O-CB 3.35Å; I357-V369 HydrophobicContact CB-CG2 4.03Å; I357-V369 HydrophobicContact CG2-CG2 3.79Å; I357-V369 WeakPolarHBondContact O-CG2 3.19Å; I357-V369 PolarHBondContact O-N 2.97Å; I357-A370 HydrophobicContact CB-CB 4.07Å; I357-A370 HydrophobicContact CG1-CB 3.98Å; I357-A370 PolarHBondContact N-O 2.85Å; I357-F372 HydrophobicContact CG1-CE2 3.94Å; I357-W384 HydrophobicContact CD1-CH2 3.85Å; I357-W384 HydrophobicContact CD1-CZ2 3.9Å; I357-W384 HydrophobicContact CG2-CH2 4.11Å; I357-W384 HydrophobicContact CG2-CZ2 4.14Å; I357-F392 HydrophobicContact CD1-CE1 4.31Å; I357-F392 HydrophobicContact CD1-CZ 4.38Å; I357-L406 HydrophobicContact CG1-CD1 4.36Å; I357-L406 HydrophobicContact CG1-CD2 4.33Å; I357-L406 HydrophobicContact CG2-CD1 4.23Å
358	W	98	Very high	96.7	Very high	4 Å²	4	47.8 Å²	47.8	2%	0.015	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128.5	-175.9	-48.1	83.1	0	0	0	110	I309 I326 A329 L345 L346 S348 K356 L360 I363 P368	I309-W358 HydrophobicContact CD1-CZ2 4.17Å; I326-W358 HydrophobicContact CD1-CD2 4.43Å; I326-W358 HydrophobicContact CD1-CE3 4.14Å; I326-W358 HydrophobicContact CD1-CZ3 4.48Å; I326-W358 HydrophobicContact CG2-CE3 4.43Å; I326-W358 HydrophobicContact CG2-CH2 3.97Å; I326-W358 HydrophobicContact CG2-CZ3 3.75Å; A329-W358 HydrophobicContact CB-CH2 3.89Å; A329-W358 HydrophobicContact CB-CZ2 3.84Å; A329-W358 WeakPolarHBondContact O-CH2 3.14Å; A329-W358 WeakPolarHBondContact O-CZ2 3.21Å; L345-W358 VanDerWaalsContact CA-O 3.31Å; L345-W358 WeakPolarHBondContact CA-O 3.48Å; L346-W358 HydrophobicContact CB-CB 4.34Å; L346-W358 HydrophobicContact CD2-CG 4.17Å; L346-W358 PolarHBondContact N-O 2.88Å; L346-W358 PolarHBondContact O-N 3.1Å; S348-W358 PolarHBondContact OG-NE1 3.02Å; K356-W358 HydrophobicContact CB-CZ2 3.84Å; K356-W358 HydrophobicContact CD-CH2 4.09Å; K356-W358 HydrophobicContact CD-CZ2 3.67Å; K356-W358 HydrophobicContact CG-CZ2 4.39Å; W358-L360 PolarHBondContact O-N 2.88Å; W358-I363 HydrophobicContact CB-CD1 4.14Å; W358-P368 HydrophobicContact CD2-CB 4.22Å; W358-P368 HydrophobicContact CE3-CB 4.07Å; W358-P368 HydrophobicContact CH2-CB 4.18Å; W358-P368 HydrophobicContact CH2-CG 4.34Å; W358-P368 HydrophobicContact CZ2-CB 4.33Å; W358-P368 HydrophobicContact CZ3-CB 4.06Å; W358-P368 HydrophobicContact CZ3-CG 4.35Å
359	D	96.5	Very high	96.5	Very high	27 Å²	27	52.1 Å²	52.1	14%	0.144	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	111.8	170.4	-171.2	-23.3	0	0	0	109.7	L345 R361 A362 I363 V369	L345-D359 HydrophobicContact CD2-CB 4.15Å; D359-R361 PolarHBondContact O-N 2.87Å; D359-R361 VanDerWaalsContact O-N 3.16Å; D359-R361 VanDerWaalsContact OD1-CB 3.23Å; D359-R361 WeakPolarHBondContact OD1-CB 3.09Å; D359-R361 WeakPolarHBondContact OD1-CG 3.43Å; D359-R361 IonicContact OD1-CZ 2.93Å; D359-R361 PolarHBondContact OD1-N 2.93Å; D359-R361 IonicContact OD1-NE 2.71Å; D359-R361 PolarHBondContact OD1-NE 2.82Å; D359-R361 IonicContact OD1-NH2 3.72Å; D359-R361 IonicContact OD2-CZ 3.36Å; D359-R361 IonicContact OD2-NE 3.02Å; D359-R361 PolarHBondContact OD2-NE 2.73Å; D359-R361 IonicContact OD2-NH2 3.44Å; D359-R361 PolarHBondContact OD2-NH2 2.98Å; D359-A362 HydrophobicContact CB-CB 4.33Å; D359-A362 CarbonylContact O-C 3.55Å; D359-A362 PolarHBondContact O-N 2.99Å; D359-I363 PolarHBondContact O-N 2.91Å; D359-I363 VanDerWaalsContact O-N 3.07Å; D359-V369 HydrophobicContact CB-CG1 3.81Å
360	L	95.9	Very high	96.4	Very high	26 Å²	26	53.4 Å²	53.4	14%	0.136	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-64	-20.7	-178	-63.8	177.5	0	0	0	112.6	F301 V339 Q344 L346 W358 I363	F301-L360 HydrophobicContact CE1-CD1 4.25Å; F301-L360 HydrophobicContact CE1-CD2 3.69Å; F301-L360 HydrophobicContact CZ-CD1 3.81Å; F301-L360 HydrophobicContact CZ-CD2 4.12Å; V339-L360 HydrophobicContact CG1-CD1 4.25Å; Q344-L360 HydrophobicContact CB-CB 4.35Å; Q344-L360 WeakPolarHBondContact O-CB 3.34Å; Q344-L360 PolarHBondContact O-N 2.89Å; L346-L360 HydrophobicContact CB-CD2 3.96Å; L346-L360 HydrophobicContact CB-CG 4.35Å; L346-L360 HydrophobicContact CD1-CD2 4.5Å; W358-L360 PolarHBondContact O-N 2.88Å; L360-I363 HydrophobicContact CD2-CD1 4.2Å
361	R	94.7	Very high	96.3	Very high	187 Å²	187	58 Å²	58	71%	0.706	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-77.5	-26.2	175.3	-56.4	166.7	-65	-179.4	3	112.2	Q344 D359	Q344-R361 HydrophobicContact CB-CG 3.82Å; Q344-R361 HydrophobicContact CG-CG 4.2Å; D359-R361 PolarHBondContact O-N 2.87Å; D359-R361 VanDerWaalsContact O-N 3.16Å; D359-R361 VanDerWaalsContact OD1-CB 3.23Å; D359-R361 WeakPolarHBondContact OD1-CB 3.09Å; D359-R361 WeakPolarHBondContact OD1-CG 3.43Å; D359-R361 IonicContact OD1-CZ 2.93Å; D359-R361 PolarHBondContact OD1-N 2.93Å; D359-R361 IonicContact OD1-NE 2.71Å; D359-R361 PolarHBondContact OD1-NE 2.82Å; D359-R361 IonicContact OD1-NH2 3.72Å; D359-R361 IonicContact OD2-CZ 3.36Å; D359-R361 IonicContact OD2-NE 3.02Å; D359-R361 PolarHBondContact OD2-NE 2.73Å; D359-R361 IonicContact OD2-NH2 3.44Å; D359-R361 PolarHBondContact OD2-NH2 2.98Å
362	A	95	Very high	96.2	Very high	37 Å²	37	56.1 Å²	56.1	31%	0.306	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-109.5	18.8	178.6	0	0	0	0	0	112	D359 Q364 D365	D359-A362 HydrophobicContact CB-CB 4.33Å; D359-A362 CarbonylContact O-C 3.55Å; D359-A362 PolarHBondContact O-N 2.99Å; A362-Q364 PolarHBondContact O-N 2.85Å; A362-D365 WeakPolarHBondContact O-CB 3.2Å; A362-D365 PolarHBondContact O-N 3.48Å
363	I	93.6	Very high	96	Very high	21 Å²	21	57.6 Å²	57.6	11%	0.108	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-60.2	-25.3	-171.7	-153.1	60.5	0	0	0	113.5	I311 F324 I326 W358 D359 L360 D365 A366	I311-I363 HydrophobicContact CD1-CG1 4.07Å; I311-I363 HydrophobicContact CD1-CG2 4.47Å; F324-I363 HydrophobicContact CD1-CG1 4.03Å; F324-I363 HydrophobicContact CD1-CG2 4.24Å; F324-I363 HydrophobicContact CE1-CB 4.43Å; F324-I363 HydrophobicContact CE1-CG1 3.89Å; F324-I363 HydrophobicContact CE1-CG2 4.18Å; F324-I363 WeakPolarHBondContact CE1-O 3.23Å; F324-I363 HydrophobicContact CZ-CG2 4.41Å; F324-I363 WeakPolarHBondContact CZ-O 3.5Å; I326-I363 HydrophobicContact CD1-CD1 3.48Å; I326-I363 VanDerWaalsContact CD1-CD1 3.48Å; I326-I363 HydrophobicContact CD1-CG1 3.96Å; I326-I363 HydrophobicContact CG1-CD1 4.42Å; I326-I363 HydrophobicContact CG1-CG1 4.45Å; W358-I363 HydrophobicContact CB-CD1 4.14Å; D359-I363 PolarHBondContact O-N 2.91Å; D359-I363 VanDerWaalsContact O-N 3.07Å; L360-I363 HydrophobicContact CD2-CD1 4.2Å; I363-D365 PolarHBondContact O-N 2.91Å; I363-A366 PolarHBondContact O-N 3.16Å
364	Q	92.9	Very high	95.8	Very high	153 Å²	153	58.4 Å²	58.4	72%	0.715	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-57.3	-27.4	174.4	-67.3	-83.2	-15.1	0	0	112.9	A362 A366	A362-Q364 PolarHBondContact O-N 2.85Å; Q364-A366 PolarHBondContact O-N 2.88Å
365	D	93.1	Very high	95.7	Very high	116 Å²	116	58.2 Å²	58.2	62%	0.62	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-73.9	-14.7	177.9	-65.8	-22.2	0	0	0	112.4	A362 I363 K367	A362-D365 WeakPolarHBondContact O-CB 3.2Å; A362-D365 PolarHBondContact O-N 3.48Å; I363-D365 PolarHBondContact O-N 2.91Å; D365-K367 WeakPolarHBondContact O-CG 3.5Å; D365-K367 PolarHBondContact O-N 2.94Å; D365-K367 VanDerWaalsContact O-N 3.11Å
366	A	93.3	Very high	95.5	Very high	50 Å²	50	64.5 Å²	64.5	41%	0.413	33%	0.326	S	S	.	.			trans	49.4	34.6	-178.5	0	0	0	0	0	113.3	I363 Q364	I363-A366 PolarHBondContact O-N 3.16Å; Q364-A366 PolarHBondContact O-N 2.88Å
367	K	96.2	Very high	95.4	Very high	157 Å²	157	63.8 Å²	63.8	68%	0.683	33%	0.326	S	S	*	.			trans	-124.9	136.4	179.4	-74.2	174.3	-175.2	-179.8	0	110.2	D365	D365-K367 WeakPolarHBondContact O-CG 3.5Å; D365-K367 PolarHBondContact O-N 2.94Å; D365-K367 VanDerWaalsContact O-N 3.11Å
368	P	97.1	Very high	95.4	Very high	46 Å²	46	65.1 Å²	65.1	30%	0.299	33%	0.334	S	S	.	.			trans	-69.2	146.6	171.9	32.2	-35.7	0	0	0	109.8	K356 I357 W358	K356-P368 HydrophobicContact CB-CB 3.97Å; K356-P368 HydrophobicContact CD-CB 4.15Å; K356-P368 HydrophobicContact CD-CG 3.96Å; K356-P368 HydrophobicContact CG-CB 4.08Å; K356-P368 HydrophobicContact CG-CG 4.25Å; I357-P368 CarbonylContact O-C 3.59Å; I357-P368 WeakPolarHBondContact O-CA 3.43Å; I357-P368 WeakPolarHBondContact O-CB 3.35Å; W358-P368 HydrophobicContact CD2-CB 4.22Å; W358-P368 HydrophobicContact CE3-CB 4.07Å; W358-P368 HydrophobicContact CH2-CB 4.18Å; W358-P368 HydrophobicContact CH2-CG 4.34Å; W358-P368 HydrophobicContact CZ2-CB 4.33Å; W358-P368 HydrophobicContact CZ3-CB 4.06Å; W358-P368 HydrophobicContact CZ3-CG 4.35Å
369	V	96.1	Very high	95.4	Very high	91 Å²	91	65 Å²	65	55%	0.552	33%	0.334	S	S	*	.	S	Bend	trans	-83.8	-19.1	173.7	-64.7	0	0	0	0	112.4	I357 D359	I357-V369 HydrophobicContact CB-CG2 4.03Å; I357-V369 HydrophobicContact CG2-CG2 3.79Å; I357-V369 WeakPolarHBondContact O-CG2 3.19Å; I357-V369 PolarHBondContact O-N 2.97Å; D359-V369 HydrophobicContact CB-CG1 3.81Å
370	A	95.8	Very high	95.5	Very high	27 Å²	27	64.9 Å²	64.9	22%	0.223	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	152.8	172	0	0	0	0	0	111.3	K356 I357 F372	K356-A370 WeakPolarHBondContact CA-O 3.49Å; I357-A370 HydrophobicContact CB-CB 4.07Å; I357-A370 HydrophobicContact CG1-CB 3.98Å; I357-A370 PolarHBondContact N-O 2.85Å; A370-F372 HydrophobicContact CB-CE2 3.96Å; A370-F372 HydrophobicContact CB-CZ 3.94Å
371	L	96.2	Very high	95.7	Very high	101 Å²	101	63.9 Å²	63.9	53%	0.529	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	124.3	175.7	167.1	63.2	0	0	0	108.5	A354 V355 K356	A354-L371 HydrophobicContact CB-CD1 3.99Å; V355-L371 CarbonylContact O-C 3.56Å; V355-L371 WeakPolarHBondContact O-CA 3.14Å; K356-L371 HydrophobicContact CD-CD1 4.49Å; K356-L371 HydrophobicContact CG-CD1 3.76Å
372	F	95.9	Very high	95.9	Very high	15 Å²	15	55 Å²	55	7%	0.066	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	122.3	174.2	-54.1	-70.6	0	0	0	109.4	V355 I357 A370 F392 W404 L406 Q425	V355-F372 HydrophobicContact CB-CB 4.36Å; V355-F372 HydrophobicContact CG1-CD2 4.47Å; V355-F372 PolarHBondContact N-O 2.82Å; V355-F372 PolarHBondContact O-N 2.77Å; I357-F372 HydrophobicContact CG1-CE2 3.94Å; A370-F372 HydrophobicContact CB-CE2 3.96Å; A370-F372 HydrophobicContact CB-CZ 3.94Å; F372-F392 AromaticContact CD2-CZ 3.96Å; F372-F392 HydrophobicContact CD2-CZ 3.96Å; F372-F392 HydrophobicContact CE2-CE1 4.27Å; F372-F392 AromaticContact CE2-CZ 3.79Å; F372-F392 HydrophobicContact CE2-CZ 3.79Å; F372-W404 HydrophobicContact CB-CH2 3.96Å; F372-W404 HydrophobicContact CB-CZ3 3.97Å; F372-W404 AromaticContact CD1-CE3 3.97Å; F372-W404 HydrophobicContact CD1-CE3 3.97Å; F372-W404 HydrophobicContact CD1-CH2 4.37Å; F372-W404 AromaticContact CD1-CZ3 3.57Å; F372-W404 HydrophobicContact CD1-CZ3 3.57Å; F372-W404 HydrophobicContact CE1-CE3 4.31Å; F372-W404 HydrophobicContact CE1-CZ3 4.26Å; F372-W404 HydrophobicContact CG-CE3 4.11Å; F372-W404 HydrophobicContact CG-CH2 4.32Å; F372-W404 AromaticContact CG-CZ3 3.82Å; F372-W404 HydrophobicContact CG-CZ3 3.82Å; F372-L406 HydrophobicContact CE2-CD2 3.62Å; F372-L406 HydrophobicContact CZ-CD2 3.39Å; F372-Q425 HydrophobicContact CE1-CB 3.95Å; F372-Q425 HydrophobicContact CE1-CG 3.99Å; F372-Q425 HydrophobicContact CZ-CB 4.35Å; F372-Q425 HydrophobicContact CZ-CG 4.28Å
373	K	93.8	Very high	96	Very high	116 Å²	116	54.6 Å²	54.6	50%	0.504	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	81.8	177.1	-170.2	67.4	171.1	-174.6	0	108.8	D352 A354	D352-K373 VanDerWaalsContact C-NZ 3.26Å; D352-K373 VanDerWaalsContact CB-NZ 3.28Å; D352-K373 PolarHBondContact O-NZ 3.19Å; A354-K373 HydrophobicContact CB-CD 3.95Å
374	Y	94.3	Very high	96.2	Very high	18 Å²	18	54.1 Å²	54.1	7%	0.071	28%	0.284	C	S	.	.			trans	-118.1	-50.4	-179.5	169.8	-98.5	0	0	0	111.2	Q376 T402 W404 L422 L426 I429	Y374-Q376 PolarHBondContact O-NE2 3.27Å; Y374-T402 HydrophobicContact CD1-CG2 4.01Å; Y374-T402 HydrophobicContact CE1-CG2 3.66Å; Y374-W404 HydrophobicContact CD1-CZ2 4.26Å; Y374-W404 HydrophobicContact CG-CH2 4.3Å; Y374-W404 HydrophobicContact CG-CZ2 4.32Å; Y374-L422 HydrophobicContact CD2-CD2 4.15Å; Y374-L422 HydrophobicContact CE2-CD2 3.62Å; Y374-L426 HydrophobicContact CD2-CD2 4.08Å; Y374-L426 HydrophobicContact CE1-CD2 4.34Å; Y374-L426 HydrophobicContact CE2-CD2 3.89Å; Y374-L426 HydrophobicContact CG-CD2 4.39Å; Y374-I429 WeakPolarHBondContact OH-CD1 3.46Å
375	H	96	Very high	96.4	Very high	3 Å²	3	47.1 Å²	47.1	1%	0.014	25%	0.251	C	S	.	.			trans	-61.9	147.6	178.9	-76.2	-74.9	0	0	0	112.1	I379 S396 D398 V400 T402	H375-I379 HydrophobicContact CB-CD1 3.66Å; H375-S396 VanDerWaalsContact ND1-CB 3.29Å; H375-S396 WeakPolarHBondContact ND1-CB 3.35Å; H375-D398 WeakPolarHBondContact CA-OD2 3.3Å; H375-D398 WeakPolarHBondContact CB-OD2 3.36Å; H375-D398 IonicContact CE1-OD1 3.2Å; H375-D398 IonicContact CG-OD2 3.63Å; H375-D398 IonicContact ND1-OD1 2.85Å; H375-D398 PolarHBondContact ND1-OD1 3.11Å; H375-D398 IonicContact ND1-OD2 3.46Å; H375-D398 PolarHBondContact ND1-OD2 3.29Å; H375-V400 PolarHBondContact CE1-O 3.28Å; H375-T402 PolarHBondContact NE2-OG1 3.12Å
376	Q	94.9	Very high	96.3	Very high	134 Å²	134	43.9 Å²	43.9	63%	0.626	24%	0.236	S	C	*	.	S	Bend	trans	-109.6	6.3	-173.8	-58.6	-59.2	-51.3	0	0	113.2	Y374 D398	Y374-Q376 PolarHBondContact O-NE2 3.27Å; Q376-D398 HydrophobicContact CB-CB 4.38Å; Q376-D398 PolarHBondContact N-OD2 2.96Å
377	G	96.2	Very high	96.1	Very high	11 Å²	11	44.3 Å²	44.3	11%	0.113	23%	0.228	C	C	.	.	S	Bend	trans	-147.9	178.9	176.2	0	0	0	0	0	111.7	G353 I379 S396	G353-G377 WeakPolarHBondContact CA-O 3.35Å; G353-G377 PolarHBondContact N-O 3.11Å; G377-I379 PolarHBondContact O-N 2.58Å; G377-S396 PolarHBondContact O-OG 3.15Å
378	P	98.2	Very high	95.9	Very high	28 Å²	28	41.4 Å²	41.4	18%	0.182	22%	0.216	C	C	.	.			trans	-49.4	137.2	-179.4	-31.3	34.3	0	0	0	113.7	D351 S396 E397	D351-P378 WeakPolarHBondContact O-CA 3.24Å; D351-P378 WeakPolarHBondContact O-CD 3.32Å; D351-P378 WeakPolarHBondContact O-CG 3.3Å; P378-S396 CarbonylContact O-C 3.6Å; P378-S396 WeakPolarHBondContact O-CA 3.42Å; P378-S396 WeakPolarHBondContact O-CB 3.28Å; P378-S396 PolarHBondContact O-OG 3.27Å; P378-E397 HydrophobicContact CB-CB 4.44Å; P378-E397 HydrophobicContact CB-CG 4.1Å; P378-E397 HydrophobicContact CG-CB 4.5Å; P378-E397 HydrophobicContact CG-CG 4.42Å; P378-E397 PolarHBondContact O-N 3.19Å
379	I	98.8	Very high	95.6	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	122.1	170.8	-53.8	-53.9	0	0	0	108.8	N335 V336 D350 V355 H375 G377 V382 V394	N335-I379 VanDerWaalsContact CB-O 3.28Å; N335-I379 WeakPolarHBondContact CB-O 3.35Å; N335-I379 PolarHBondContact ND2-O 2.75Å; V336-I379 HydrophobicContact CG2-CB 4.47Å; V336-I379 HydrophobicContact CG2-CG2 3.8Å; D350-I379 PolarHBondContact O-N 3.01Å; V355-I379 HydrophobicContact CG2-CD1 4.07Å; V355-I379 HydrophobicContact CG2-CG1 4.01Å; H375-I379 HydrophobicContact CB-CD1 3.66Å; G377-I379 PolarHBondContact O-N 2.58Å; I379-V382 HydrophobicContact CG2-CG1 3.72Å; I379-V394 HydrophobicContact CD1-CG1 3.9Å; I379-V394 HydrophobicContact CG2-CG1 3.72Å
380	N	98.4	Very high	95.5	Very high	26 Å²	26	40.8 Å²	40.8	14%	0.139	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-22.5	-174.9	-75.1	-10.9	0	0	0	114.2	V336 S395 E397 V436 K437	V336-N380 WeakPolarHBondContact CG1-O 3.17Å; N380-S395 PolarHBondContact N-O 2.97Å; N380-E397 WeakPolarHBondContact ND2-CG 3.37Å; N380-V436 PolarHBondContact ND2-O 3.2Å; N380-K437 WeakPolarHBondContact CB-O 3.21Å
381	S	98.7	Very high	95.5	Very high	5 Å²	5	39.6 Å²	39.6	4%	0.035	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	146.3	172.1	-171.1	0	0	0	0	110.7	V394 S395 V439	S381-V394 WeakPolarHBondContact O-CA 3.38Å; S381-S395 VanDerWaalsContact CB-OG 3.23Å; S381-S395 WeakPolarHBondContact CB-OG 3.42Å; S381-S395 PolarHBondContact N-O 2.99Å; S381-S395 PolarHBondContact N-OG 3.24Å; S381-S395 PolarHBondContact O-N 3.37Å; S381-V439 PolarHBondContact OG-O 2.99Å
382	V	98.8	Very high	95.6	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.006	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	137.4	170.3	-67.2	0	0	0	0	107.7	V336 D338 I347 I379 A393 V394	V336-V382 HydrophobicContact CB-CG2 4.08Å; V336-V382 HydrophobicContact CG2-CB 4.4Å; V336-V382 HydrophobicContact CG2-CG1 3.99Å; V336-V382 HydrophobicContact CG2-CG2 3.79Å; D338-V382 HydrophobicContact CB-CG2 4.28Å; D338-V382 WeakPolarHBondContact CB-O 3.3Å; I347-V382 HydrophobicContact CD1-CB 4.02Å; I347-V382 HydrophobicContact CD1-CG1 4.14Å; I347-V382 HydrophobicContact CG1-CB 4.07Å; I347-V382 HydrophobicContact CG1-CG1 4.18Å; I347-V382 HydrophobicContact CG1-CG2 4.3Å; I347-V382 HydrophobicContact CG2-CB 3.96Å; I347-V382 HydrophobicContact CG2-CG2 3.73Å; I379-V382 HydrophobicContact CG2-CG1 3.72Å; V382-A393 WeakPolarHBondContact CA-O 3.34Å; V382-V394 HydrophobicContact CG1-CG1 4.28Å; V382-V394 HydrophobicContact CG1-CG2 4.28Å
383	E	98.5	Very high	95.8	Very high	28 Å²	28	34.1 Å²	34.1	13%	0.131	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	127	176.6	-168	175.4	130.4	0	0	112	F392 A393 H440 W441	E383-F392 CarbonylContact O-C 3.55Å; E383-F392 VanDerWaalsContact O-CA 3.24Å; E383-F392 WeakPolarHBondContact O-CA 3.29Å; E383-F392 WeakPolarHBondContact O-CB 3.26Å; E383-A393 PolarHBondContact N-O 2.82Å; E383-A393 PolarHBondContact O-N 2.77Å; E383-H440 WeakPolarHBondContact OE2-CA 3.32Å; E383-H440 IonicContact OE2-CE1 2.87Å; E383-H440 IonicContact OE2-CG 3.36Å; E383-H440 IonicContact OE2-ND1 3.77Å; E383-H440 PolarHBondContact OE2-ND1 2.85Å; E383-H440 VanDerWaalsContact OE2-ND1 3.11Å; E383-W441 PolarHBondContact O-NE1 3.29Å; E383-W441 PolarHBondContact OE1-N 3.36Å
384	W	97.9	Very high	96	Very high	10 Å²	10	28.6 Å²	28.6	4%	0.038	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	133.5	170.2	-72.5	103.9	0	0	0	110.7	D338 S340 L345 I347 I357 P386 F392 L406	D338-W384 PolarHBondContact O-NE1 2.88Å; D338-W384 PolarHBondContact OD2-N 3.04Å; S340-W384 VanDerWaalsContact N-CD1 3.25Å; L345-W384 HydrophobicContact CB-CH2 4.32Å; L345-W384 HydrophobicContact CB-CZ2 3.82Å; L345-W384 HydrophobicContact CD1-CH2 3.9Å; L345-W384 HydrophobicContact CD1-CZ2 4.26Å; I347-W384 HydrophobicContact CB-CZ2 3.85Å; I347-W384 HydrophobicContact CG2-CZ2 4.37Å; I347-W384 VanDerWaalsContact CG2-NE1 3.28Å; I357-W384 HydrophobicContact CD1-CH2 3.85Å; I357-W384 HydrophobicContact CD1-CZ2 3.9Å; I357-W384 HydrophobicContact CG2-CH2 4.11Å; I357-W384 HydrophobicContact CG2-CZ2 4.14Å; W384-P386 WeakPolarHBondContact O-CD 3.45Å; W384-F392 HydrophobicContact CD2-CB 4.34Å; W384-F392 HydrophobicContact CE3-CB 3.86Å; W384-F392 HydrophobicContact CE3-CD1 4.25Å; W384-F392 HydrophobicContact CE3-CG 4.47Å; W384-F392 HydrophobicContact CH2-CD1 4.16Å; W384-F392 HydrophobicContact CZ3-CB 4.19Å; W384-F392 AromaticContact CZ3-CD1 3.7Å; W384-F392 HydrophobicContact CZ3-CD1 3.7Å; W384-F392 HydrophobicContact CZ3-CG 4.31Å; W384-L406 HydrophobicContact CH2-CD1 3.78Å; W384-L406 HydrophobicContact CZ3-CD1 4.12Å
385	Y	96.1	Very high	96.2	Very high	6 Å²	6	27.7 Å²	27.7	2%	0.024	14%	0.136	C	C	.	.			trans	-68.6	123.4	170.9	-175.6	-133	0	0	0	109.8	Y387 E388 V391 W441 K446 G447 V465	Y385-Y387 HydrophobicContact CD2-CD2 4.08Å; Y385-Y387 HydrophobicContact CE1-CD2 4.24Å; Y385-Y387 AromaticContact CE2-CD2 3.34Å; Y385-Y387 HydrophobicContact CE2-CD2 3.34Å; Y385-Y387 AromaticContact CE2-CE2 3.93Å; Y385-Y387 HydrophobicContact CE2-CE2 3.93Å; Y385-Y387 HydrophobicContact CE2-CG 4.37Å; Y385-Y387 AromaticContact CZ-CD2 3.46Å; Y385-Y387 VanDerWaalsContact CZ-CD2 3.46Å; Y385-Y387 PolarHBondContact O-N 3.21Å; Y385-E388 HydrophobicContact CD1-CB 3.66Å; Y385-E388 HydrophobicContact CE1-CB 3.82Å; Y385-V391 VanDerWaalsContact CB-O 3.3Å; Y385-V391 WeakPolarHBondContact CB-O 3.43Å; Y385-V391 HydrophobicContact CD1-CB 3.92Å; Y385-V391 HydrophobicContact CD1-CG1 3.89Å; Y385-V391 HydrophobicContact CG-CB 4.33Å; Y385-V391 HydrophobicContact CG-CG1 4.09Å; Y385-V391 PolarHBondContact N-O 2.93Å; Y385-W441 HydrophobicContact CD2-CB 4.3Å; Y385-W441 AromaticContact CD2-CD2 3.44Å; Y385-W441 HydrophobicContact CD2-CD2 3.44Å; Y385-W441 VanDerWaalsContact CD2-CD2 3.44Å; Y385-W441 AromaticContact CD2-CE2 3.75Å; Y385-W441 AromaticContact CD2-CE3 3.7Å; Y385-W441 HydrophobicContact CD2-CE3 3.7Å; Y385-W441 AromaticContact CD2-CG 3.72Å; Y385-W441 HydrophobicContact CD2-CG 3.72Å; Y385-W441 HydrophobicContact CD2-CH2 4.43Å; Y385-W441 HydrophobicContact CD2-CZ2 4.23Å; Y385-W441 HydrophobicContact CD2-CZ3 4.2Å; Y385-W441 HydrophobicContact CE2-CD2 4.09Å; Y385-W441 AromaticContact CE2-CE3 3.88Å; Y385-W441 HydrophobicContact CE2-CE3 3.88Å; Y385-W441 HydrophobicContact CE2-CZ3 4.28Å; Y385-W441 HydrophobicContact CG-CD2 4.29Å; Y385-W441 HydrophobicContact CG-CZ2 4.38Å; Y385-K446 VanDerWaalsContact OH-CA 3.3Å; Y385-K446 WeakPolarHBondContact OH-CA 3.38Å; Y385-K446 VanDerWaalsContact OH-CB 3.28Å; Y385-K446 WeakPolarHBondContact OH-CB 3.34Å; Y385-G447 PolarHBondContact OH-N 3.22Å; Y385-V465 HydrophobicContact CD1-CG1 4.22Å; Y385-V465 HydrophobicContact CE1-CG1 3.82Å; Y385-V465 HydrophobicContact CE2-CG1 4.38Å
386	P	91.3	Very high	96.3	Very high	48 Å²	48	27.6 Å²	27.6	31%	0.312	14%	0.136	S	C	.	.	S	Bend	trans	-75.5	-9.9	-169.3	27.8	-35.6	0	0	0	114.2	W384	W384-P386 WeakPolarHBondContact O-CD 3.45Å
387	Y	89.2	Confident	96.3	Very high	60 Å²	60	25.3 Å²	25.3	24%	0.235	13%	0.125	C	C	.	.	S	Bend	trans	-108.7	-20.2	-170.6	-48.4	-56.9	0	0	0	114.9	T87 Y385 H442 P443 N444 K446	T87-Y387 HydrophobicContact CG2-CD1 3.67Å; T87-Y387 HydrophobicContact CG2-CE1 3.2Å; Y385-Y387 HydrophobicContact CD2-CD2 4.08Å; Y385-Y387 HydrophobicContact CE1-CD2 4.24Å; Y385-Y387 AromaticContact CE2-CD2 3.34Å; Y385-Y387 HydrophobicContact CE2-CD2 3.34Å; Y385-Y387 AromaticContact CE2-CE2 3.93Å; Y385-Y387 HydrophobicContact CE2-CE2 3.93Å; Y385-Y387 HydrophobicContact CE2-CG 4.37Å; Y385-Y387 AromaticContact CZ-CD2 3.46Å; Y385-Y387 VanDerWaalsContact CZ-CD2 3.46Å; Y385-Y387 PolarHBondContact O-N 3.21Å; Y387-H442 PolarHBondContact OH-O 3.09Å; Y387-P443 PolarHBondContact OH-O 3.15Å; Y387-N444 VanDerWaalsContact OH-C 3.31Å; Y387-N444 WeakPolarHBondContact OH-CA 3.11Å; Y387-N444 PolarHBondContact OH-N 3.08Å; Y387-K446 HydrophobicContact CD2-CB 4.29Å; Y387-K446 HydrophobicContact CD2-CG 3.65Å; Y387-K446 HydrophobicContact CE2-CG 3.97Å; Y387-K446 HydrophobicContact CG-CG 4.02Å
388	E	90.9	Very high	96.3	Very high	95 Å²	95	26.4 Å²	26.4	44%	0.444	13%	0.128	S	C	.	.	S	Bend	trans	-131.7	140.7	-179.8	-165	169.6	145.7	0	0	110.4	Y385 V391	Y385-E388 HydrophobicContact CD1-CB 3.66Å; Y385-E388 HydrophobicContact CE1-CB 3.82Å; E388-V391 HydrophobicContact CB-CB 4.5Å; E388-V391 HydrophobicContact CB-CG2 4.05Å; E388-V391 HydrophobicContact CG-CG2 4.04Å
389	K	92.7	Very high	96.2	Very high	123 Å²	123	28 Å²	28	54%	0.535	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	134.1	-175.6	-71.8	-179.5	179.9	174.5	0	109.7	A342 Q343 V391	A342-K389 HydrophobicContact CB-CG 3.99Å; Q343-K389 HydrophobicContact CG-CB 4.25Å; Q343-K389 HydrophobicContact CG-CD 4.11Å; Q343-K389 HydrophobicContact CG-CG 3.96Å; K389-V391 VanDerWaalsContact C-N 3.26Å; K389-V391 PolarHBondContact O-N 2.87Å
390	G	93.4	Very high	96.1	Very high	2 Å²	2	28 Å²	28	2%	0.021	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	-6.3	175.5	0	0	0	0	0	114.9	L406	G390-L406 WeakPolarHBondContact O-CG 3.23Å; G390-L406 PolarHBondContact O-N 3.25Å
391	V	96.4	Very high	96.1	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.012	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	135.2	176.7	-179.8	0	0	0	0	110.4	Y385 E388 K389 W404 D405 W441 V465	Y385-V391 VanDerWaalsContact CB-O 3.3Å; Y385-V391 WeakPolarHBondContact CB-O 3.43Å; Y385-V391 HydrophobicContact CD1-CB 3.92Å; Y385-V391 HydrophobicContact CD1-CG1 3.89Å; Y385-V391 HydrophobicContact CG-CB 4.33Å; Y385-V391 HydrophobicContact CG-CG1 4.09Å; Y385-V391 PolarHBondContact N-O 2.93Å; E388-V391 HydrophobicContact CB-CB 4.5Å; E388-V391 HydrophobicContact CB-CG2 4.05Å; E388-V391 HydrophobicContact CG-CG2 4.04Å; K389-V391 VanDerWaalsContact C-N 3.26Å; K389-V391 PolarHBondContact O-N 2.87Å; V391-W404 CarbonylContact C-O 3.59Å; V391-W404 WeakPolarHBondContact CA-O 3.35Å; V391-D405 HydrophobicContact CG2-CB 4.14Å; V391-W441 HydrophobicContact CG1-CZ2 4.37Å; V391-V465 HydrophobicContact CG1-CG1 4.19Å; V391-V465 HydrophobicContact CG1-CG2 4.32Å
392	F	98	Very high	96.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	159.9	177.4	62	-87.1	0	0	0	112.5	I347 V355 I357 F372 E383 W384 V394 W404 L406	I347-F392 HydrophobicContact CD1-CB 4.26Å; I347-F392 HydrophobicContact CD1-CD1 4.38Å; I347-F392 HydrophobicContact CD1-CD2 3.26Å; I347-F392 HydrophobicContact CD1-CE2 3.55Å; I347-F392 HydrophobicContact CD1-CG 3.72Å; I347-F392 HydrophobicContact CD1-CZ 4.23Å; V355-F392 HydrophobicContact CG1-CE2 4.22Å; I357-F392 HydrophobicContact CD1-CE1 4.31Å; I357-F392 HydrophobicContact CD1-CZ 4.38Å; F372-F392 AromaticContact CD2-CZ 3.96Å; F372-F392 HydrophobicContact CD2-CZ 3.96Å; F372-F392 HydrophobicContact CE2-CE1 4.27Å; F372-F392 AromaticContact CE2-CZ 3.79Å; F372-F392 HydrophobicContact CE2-CZ 3.79Å; E383-F392 CarbonylContact O-C 3.55Å; E383-F392 VanDerWaalsContact O-CA 3.24Å; E383-F392 WeakPolarHBondContact O-CA 3.29Å; E383-F392 WeakPolarHBondContact O-CB 3.26Å; W384-F392 HydrophobicContact CD2-CB 4.34Å; W384-F392 HydrophobicContact CE3-CB 3.86Å; W384-F392 HydrophobicContact CE3-CD1 4.25Å; W384-F392 HydrophobicContact CE3-CG 4.47Å; W384-F392 HydrophobicContact CH2-CD1 4.16Å; W384-F392 HydrophobicContact CZ3-CB 4.19Å; W384-F392 AromaticContact CZ3-CD1 3.7Å; W384-F392 HydrophobicContact CZ3-CD1 3.7Å; W384-F392 HydrophobicContact CZ3-CG 4.31Å; F392-V394 HydrophobicContact CD2-CG2 3.67Å; F392-V394 HydrophobicContact CE2-CG2 3.63Å; F392-W404 HydrophobicContact CD1-CB 3.9Å; F392-W404 HydrophobicContact CD2-CB 3.94Å; F392-W404 AromaticContact CD2-CD1 3.86Å; F392-W404 HydrophobicContact CD2-CG 4.07Å; F392-W404 HydrophobicContact CE1-CB 3.44Å; F392-W404 VanDerWaalsContact CE1-CB 3.44Å; F392-W404 HydrophobicContact CE1-CG 4.18Å; F392-W404 HydrophobicContact CE2-CB 3.5Å; F392-W404 AromaticContact CE2-CD1 3.39Å; F392-W404 HydrophobicContact CE2-CD2 4.11Å; F392-W404 AromaticContact CE2-CG 3.38Å; F392-W404 HydrophobicContact CE2-CG 3.38Å; F392-W404 HydrophobicContact CG-CB 4.13Å; F392-W404 HydrophobicContact CZ-CB 3.24Å; F392-W404 AromaticContact CZ-CD1 3.97Å; F392-W404 HydrophobicContact CZ-CD2 4.01Å; F392-W404 HydrophobicContact CZ-CE3 4.49Å; F392-W404 AromaticContact CZ-CG 3.45Å; F392-W404 HydrophobicContact CZ-CG 3.45Å; F392-W404 VanDerWaalsContact CZ-CG 3.45Å; F392-W404 PolarHBondContact N-O 2.84Å; F392-W404 PolarHBondContact O-N 2.94Å; F392-L406 HydrophobicContact CD1-CG 4.5Å; F392-L406 HydrophobicContact CE1-CD2 3.78Å; F392-L406 HydrophobicContact CE1-CG 3.97Å
393	A	98.5	Very high	96.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	149.6	174.4	0	0	0	0	0	110.6	V382 E383 T402 L403 V439 W441	V382-A393 WeakPolarHBondContact CA-O 3.34Å; E383-A393 PolarHBondContact N-O 2.82Å; E383-A393 PolarHBondContact O-N 2.77Å; A393-T402 CarbonylContact C-O 3.47Å; A393-T402 WeakPolarHBondContact CA-O 3.35Å; A393-L403 HydrophobicContact CB-CD2 3.72Å; A393-V439 HydrophobicContact CB-CG1 3.98Å; A393-V439 HydrophobicContact CB-CG2 3.99Å; A393-W441 HydrophobicContact CB-CZ2 3.85Å
394	V	98.7	Very high	96	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	135.2	177.2	-175.5	0	0	0	0	108.9	V355 I379 S381 V382 F392 V401 T402	V355-V394 HydrophobicContact CG2-CG1 3.96Å; V355-V394 HydrophobicContact CG2-CG2 4.21Å; I379-V394 HydrophobicContact CD1-CG1 3.9Å; I379-V394 HydrophobicContact CG2-CG1 3.72Å; S381-V394 WeakPolarHBondContact O-CA 3.38Å; V382-V394 HydrophobicContact CG1-CG1 4.28Å; V382-V394 HydrophobicContact CG1-CG2 4.28Å; F392-V394 HydrophobicContact CD2-CG2 3.67Å; F392-V394 HydrophobicContact CE2-CG2 3.63Å; V394-V401 CarbonylContact O-C 3.6Å; V394-V401 VanDerWaalsContact O-CA 3.25Å; V394-V401 WeakPolarHBondContact O-CA 3.49Å; V394-T402 PolarHBondContact N-O 2.83Å; V394-T402 PolarHBondContact O-N 3.43Å
395	S	98.5	Very high	95.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	142.3	168.6	65.8	0	0	0	0	111.5	N380 S381	N380-S395 PolarHBondContact N-O 2.97Å; S381-S395 VanDerWaalsContact CB-OG 3.23Å; S381-S395 WeakPolarHBondContact CB-OG 3.42Å; S381-S395 PolarHBondContact N-O 2.99Å; S381-S395 PolarHBondContact N-OG 3.24Å; S381-S395 PolarHBondContact O-N 3.37Å
396	S	98.2	Very high	95.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	157.1	-178.2	173.3	0	0	0	0	113.1	H375 G377 P378 D398 N399 V400	H375-S396 VanDerWaalsContact ND1-CB 3.29Å; H375-S396 WeakPolarHBondContact ND1-CB 3.35Å; G377-S396 PolarHBondContact O-OG 3.15Å; P378-S396 CarbonylContact O-C 3.6Å; P378-S396 WeakPolarHBondContact O-CA 3.42Å; P378-S396 WeakPolarHBondContact O-CB 3.28Å; P378-S396 PolarHBondContact O-OG 3.27Å; S396-D398 WeakPolarHBondContact CB-OD1 3.32Å; S396-D398 PolarHBondContact O-N 3.05Å; S396-D398 VanDerWaalsContact OG-CG 3.28Å; S396-D398 PolarHBondContact OG-N 3.14Å; S396-D398 PolarHBondContact OG-OD1 3.27Å; S396-N399 PolarHBondContact O-N 3.31Å; S396-V400 PolarHBondContact N-O 3.46Å; S396-V400 VanDerWaalsContact N-O 3.11Å
397	E	96	Very high	95.7	Very high	87 Å²	87	29.6 Å²	29.6	41%	0.407	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-11.5	170	-66.8	-159.6	152.9	0	0	113.7	P378 N380 N399	P378-E397 HydrophobicContact CB-CB 4.44Å; P378-E397 HydrophobicContact CB-CG 4.1Å; P378-E397 HydrophobicContact CG-CB 4.5Å; P378-E397 HydrophobicContact CG-CG 4.42Å; P378-E397 PolarHBondContact O-N 3.19Å; N380-E397 WeakPolarHBondContact ND2-CG 3.37Å; E397-N399 PolarHBondContact O-N 3.23Å; E397-N399 VanDerWaalsContact O-N 3.12Å
398	D	95.5	Very high	95.5	Very high	33 Å²	33	27.8 Å²	27.8	18%	0.176	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	3.8	170.1	70.1	7.7	0	0	0	114.1	H375 Q376 S396 V400	H375-D398 WeakPolarHBondContact CA-OD2 3.3Å; H375-D398 WeakPolarHBondContact CB-OD2 3.36Å; H375-D398 IonicContact CE1-OD1 3.2Å; H375-D398 IonicContact CG-OD2 3.63Å; H375-D398 IonicContact ND1-OD1 2.85Å; H375-D398 PolarHBondContact ND1-OD1 3.11Å; H375-D398 IonicContact ND1-OD2 3.46Å; H375-D398 PolarHBondContact ND1-OD2 3.29Å; Q376-D398 HydrophobicContact CB-CB 4.38Å; Q376-D398 PolarHBondContact N-OD2 2.96Å; S396-D398 WeakPolarHBondContact CB-OD1 3.32Å; S396-D398 PolarHBondContact O-N 3.05Å; S396-D398 VanDerWaalsContact OG-CG 3.28Å; S396-D398 PolarHBondContact OG-N 3.14Å; S396-D398 PolarHBondContact OG-OD1 3.27Å; D398-V400 VanDerWaalsContact OD1-CB 3.24Å; D398-V400 WeakPolarHBondContact OD1-CB 3.47Å; D398-V400 WeakPolarHBondContact OD1-CG2 3.48Å; D398-V400 PolarHBondContact OD1-N 2.76Å
399	N	96.5	Very high	94.5	Very high	62 Å²	62	29 Å²	29	33%	0.332	15%	0.153	S	C	.	.	S	Bend	trans	75.8	18.4	179	-47.5	-70.3	0	0	0	114.4	S396 E397 L433 R434 E435	S396-N399 PolarHBondContact O-N 3.31Å; E397-N399 PolarHBondContact O-N 3.23Å; E397-N399 VanDerWaalsContact O-N 3.12Å; N399-L433 WeakPolarHBondContact CB-O 3.37Å; N399-R434 VanDerWaalsContact OD1-CA 3.28Å; N399-R434 WeakPolarHBondContact OD1-CA 3.35Å; N399-E435 PolarHBondContact OD1-N 2.93Å
400	V	96.8	Very high	93.1	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	136	-177.4	-168.2	0	0	0	0	110.6	P35 H375 S396 D398 T402 I429 L431	P35-V400 HydrophobicContact CB-CG2 3.77Å; P35-V400 HydrophobicContact CG-CG2 3.93Å; H375-V400 PolarHBondContact CE1-O 3.28Å; S396-V400 PolarHBondContact N-O 3.46Å; S396-V400 VanDerWaalsContact N-O 3.11Å; D398-V400 VanDerWaalsContact OD1-CB 3.24Å; D398-V400 WeakPolarHBondContact OD1-CB 3.47Å; D398-V400 WeakPolarHBondContact OD1-CG2 3.48Å; D398-V400 PolarHBondContact OD1-N 2.76Å; V400-T402 HydrophobicContact CG1-CG2 3.68Å; V400-I429 HydrophobicContact CG1-CG2 3.64Å; V400-L431 HydrophobicContact CB-CD2 4.21Å; V400-L431 HydrophobicContact CG1-CD2 4.04Å; V400-L431 HydrophobicContact CG2-CD2 3.67Å
401	V	98.3	Very high	91.2	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	130.1	159.5	177.1	0	0	0	0	108	V394 H430 V436 V439 F449	V394-V401 CarbonylContact O-C 3.6Å; V394-V401 VanDerWaalsContact O-CA 3.25Å; V394-V401 WeakPolarHBondContact O-CA 3.49Å; V401-H430 HydrophobicContact CB-CB 4.08Å; V401-H430 PolarHBondContact N-O 3.33Å; V401-H430 WeakPolarHBondContact O-CB 3.46Å; V401-H430 PolarHBondContact O-N 3.14Å; V401-V436 HydrophobicContact CG2-CG1 3.76Å; V401-V436 HydrophobicContact CG2-CG2 4.29Å; V401-V439 HydrophobicContact CG1-CB 4.34Å; V401-V439 HydrophobicContact CG1-CG2 3.88Å; V401-F449 HydrophobicContact CG1-CE2 4.33Å
402	T	97.8	Very high	89.1	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	145.6	178.1	53.3	0	0	0	0	111.5	Y374 H375 A393 V394 V400 W404 L426 F428 I429	Y374-T402 HydrophobicContact CD1-CG2 4.01Å; Y374-T402 HydrophobicContact CE1-CG2 3.66Å; H375-T402 PolarHBondContact NE2-OG1 3.12Å; A393-T402 CarbonylContact C-O 3.47Å; A393-T402 WeakPolarHBondContact CA-O 3.35Å; V394-T402 PolarHBondContact N-O 2.83Å; V394-T402 PolarHBondContact O-N 3.43Å; V400-T402 HydrophobicContact CG1-CG2 3.68Å; T402-W404 PolarHBondContact OG1-NE1 3.33Å; T402-L426 HydrophobicContact CG2-CD1 3.74Å; T402-F428 VanDerWaalsContact CA-O 3.3Å; T402-F428 WeakPolarHBondContact CA-O 3.41Å; T402-I429 HydrophobicContact CG2-CG1 4.43Å
403	L	97.8	Very high	86.8	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	139	172	-51.7	-178.4	0	0	0	108.7	A393 L427 F428 W441 F449 T462 V465	A393-L403 HydrophobicContact CB-CD2 3.72Å; L403-L427 HydrophobicContact CB-CB 4.44Å; L403-L427 WeakPolarHBondContact O-CB 3.25Å; L403-L427 PolarHBondContact O-N 3.1Å; L403-F428 HydrophobicContact CB-CB 3.87Å; L403-F428 HydrophobicContact CD1-CB 3.91Å; L403-F428 HydrophobicContact CD1-CG 4.36Å; L403-F428 HydrophobicContact CG-CB 3.95Å; L403-F428 PolarHBondContact N-O 3.41Å; L403-F428 PolarHBondContact O-N 3.12Å; L403-W441 HydrophobicContact CD1-CH2 3.99Å; L403-W441 HydrophobicContact CD2-CH2 3.59Å; L403-W441 HydrophobicContact CD2-CZ2 3.77Å; L403-W441 HydrophobicContact CG-CH2 4.33Å; L403-F449 HydrophobicContact CD1-CD1 4.48Å; L403-F449 HydrophobicContact CD1-CE1 4.39Å; L403-T462 HydrophobicContact CD1-CG2 3.8Å; L403-V465 HydrophobicContact CD1-CG2 3.97Å
404	W	97.1	Very high	84.5	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.008	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	152.7	-173.6	-60.6	78.5	0	0	0	111.3	F372 Y374 V391 F392 T402 P423 Q425 L426	F372-W404 HydrophobicContact CB-CH2 3.96Å; F372-W404 HydrophobicContact CB-CZ3 3.97Å; F372-W404 AromaticContact CD1-CE3 3.97Å; F372-W404 HydrophobicContact CD1-CE3 3.97Å; F372-W404 HydrophobicContact CD1-CH2 4.37Å; F372-W404 AromaticContact CD1-CZ3 3.57Å; F372-W404 HydrophobicContact CD1-CZ3 3.57Å; F372-W404 HydrophobicContact CE1-CE3 4.31Å; F372-W404 HydrophobicContact CE1-CZ3 4.26Å; F372-W404 HydrophobicContact CG-CE3 4.11Å; F372-W404 HydrophobicContact CG-CH2 4.32Å; F372-W404 AromaticContact CG-CZ3 3.82Å; F372-W404 HydrophobicContact CG-CZ3 3.82Å; Y374-W404 HydrophobicContact CD1-CZ2 4.26Å; Y374-W404 HydrophobicContact CG-CH2 4.3Å; Y374-W404 HydrophobicContact CG-CZ2 4.32Å; V391-W404 CarbonylContact C-O 3.59Å; V391-W404 WeakPolarHBondContact CA-O 3.35Å; F392-W404 HydrophobicContact CD1-CB 3.9Å; F392-W404 HydrophobicContact CD2-CB 3.94Å; F392-W404 AromaticContact CD2-CD1 3.86Å; F392-W404 HydrophobicContact CD2-CG 4.07Å; F392-W404 HydrophobicContact CE1-CB 3.44Å; F392-W404 VanDerWaalsContact CE1-CB 3.44Å; F392-W404 HydrophobicContact CE1-CG 4.18Å; F392-W404 HydrophobicContact CE2-CB 3.5Å; F392-W404 AromaticContact CE2-CD1 3.39Å; F392-W404 HydrophobicContact CE2-CD2 4.11Å; F392-W404 AromaticContact CE2-CG 3.38Å; F392-W404 HydrophobicContact CE2-CG 3.38Å; F392-W404 HydrophobicContact CG-CB 4.13Å; F392-W404 HydrophobicContact CZ-CB 3.24Å; F392-W404 AromaticContact CZ-CD1 3.97Å; F392-W404 HydrophobicContact CZ-CD2 4.01Å; F392-W404 HydrophobicContact CZ-CE3 4.49Å; F392-W404 AromaticContact CZ-CG 3.45Å; F392-W404 HydrophobicContact CZ-CG 3.45Å; F392-W404 VanDerWaalsContact CZ-CG 3.45Å; F392-W404 PolarHBondContact N-O 2.84Å; F392-W404 PolarHBondContact O-N 2.94Å; T402-W404 PolarHBondContact OG1-NE1 3.33Å; W404-P423 HydrophobicContact CH2-CB 4.37Å; W404-P423 HydrophobicContact CH2-CG 4.01Å; W404-P423 HydrophobicContact CZ3-CB 3.78Å; W404-P423 HydrophobicContact CZ3-CG 3.93Å; W404-Q425 CarbonylContact C-O 3.59Å; W404-Q425 WeakPolarHBondContact CA-O 3.18Å; W404-Q425 HydrophobicContact CE3-CB 3.97Å; W404-Q425 HydrophobicContact CZ3-CB 4.49Å; W404-L426 HydrophobicContact CD2-CD1 4.19Å; W404-L426 HydrophobicContact CE3-CB 4.17Å; W404-L426 HydrophobicContact CH2-CB 4.17Å; W404-L426 HydrophobicContact CH2-CD1 4.19Å; W404-L426 HydrophobicContact CZ2-CD1 3.8Å; W404-L426 HydrophobicContact CZ3-CB 3.96Å
405	D	95	Very high	82.4	Confident	18 Å²	18	56.8 Å²	56.8	10%	0.096	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	116.5	170.5	174.7	15.4	0	0	0	110.7	V391 T407 A408 Q425 L427	V391-D405 HydrophobicContact CG2-CB 4.14Å; D405-T407 VanDerWaalsContact CG-OG1 3.26Å; D405-T407 PolarHBondContact O-N 3.12Å; D405-T407 WeakPolarHBondContact OD1-CA 2.77Å; D405-T407 WeakPolarHBondContact OD1-CB 3.37Å; D405-T407 PolarHBondContact OD1-N 3.46Å; D405-T407 PolarHBondContact OD1-OG1 3.09Å; D405-T407 PolarHBondContact OD2-OG1 2.99Å; D405-A408 HydrophobicContact CB-CB 4.47Å; D405-A408 WeakPolarHBondContact O-CB 3.28Å; D405-A408 PolarHBondContact O-N 2.62Å; D405-Q425 PolarHBondContact N-O 3.31Å; D405-Q425 WeakPolarHBondContact O-CA 2.92Å; D405-Q425 VanDerWaalsContact O-CB 3.3Å; D405-Q425 WeakPolarHBondContact O-CB 3.34Å; D405-Q425 WeakPolarHBondContact O-CG 3.46Å; D405-L427 HydrophobicContact CB-CD1 3.43Å; D405-L427 VanDerWaalsContact CB-CD1 3.43Å; D405-L427 HydrophobicContact CB-CD2 4Å; D405-L427 HydrophobicContact CB-CG 3.69Å
406	L	93.6	Very high	80.4	Confident	52 Å²	52	61.5 Å²	61.5	27%	0.272	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-17.1	176.9	-64.1	-174.5	0	0	0	113.9	L345 I357 F372 W384 G390 F392	L345-L406 HydrophobicContact CD1-CD1 4.24Å; I357-L406 HydrophobicContact CG1-CD1 4.36Å; I357-L406 HydrophobicContact CG1-CD2 4.33Å; I357-L406 HydrophobicContact CG2-CD1 4.23Å; F372-L406 HydrophobicContact CE2-CD2 3.62Å; F372-L406 HydrophobicContact CZ-CD2 3.39Å; W384-L406 HydrophobicContact CH2-CD1 3.78Å; W384-L406 HydrophobicContact CZ3-CD1 4.12Å; G390-L406 WeakPolarHBondContact O-CG 3.23Å; G390-L406 PolarHBondContact O-N 3.25Å; F392-L406 HydrophobicContact CD1-CG 4.5Å; F392-L406 HydrophobicContact CE1-CD2 3.78Å; F392-L406 HydrophobicContact CE1-CG 3.97Å
407	T	89.8	Confident	78.3	Confident	83 Å²	83	70.2 Å²	70.2	51%	0.509	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-8.3	-179.8	78.1	0	0	0	0	113.2	D405 D409	D405-T407 VanDerWaalsContact CG-OG1 3.26Å; D405-T407 PolarHBondContact O-N 3.12Å; D405-T407 WeakPolarHBondContact OD1-CA 2.77Å; D405-T407 WeakPolarHBondContact OD1-CB 3.37Å; D405-T407 PolarHBondContact OD1-N 3.46Å; D405-T407 PolarHBondContact OD1-OG1 3.09Å; D405-T407 PolarHBondContact OD2-OG1 2.99Å; T407-D409 PolarHBondContact O-N 2.99Å; T407-D409 VanDerWaalsContact O-N 3.15Å
408	A	86.2	Confident	76.5	Confident	22 Å²	22	71.9 Å²	71.9	18%	0.182	39%	0.385	C	S	.	.			trans	-64.2	115.6	175.8	0	0	0	0	0	110.5	D405 P424	D405-A408 HydrophobicContact CB-CB 4.47Å; D405-A408 WeakPolarHBondContact O-CB 3.28Å; D405-A408 PolarHBondContact O-N 2.62Å; A408-P424 WeakPolarHBondContact CB-O 3.45Å
409	D	69.8	Low	75.1	Confident	121 Å²	121	72.9 Å²	72.9	65%	0.647	39%	0.392	S	S	*	.			trans	-75.5	142.2	178.3	-78.3	-31.2	0	0	0	111.2	T407 V411	T407-D409 PolarHBondContact O-N 2.99Å; T407-D409 VanDerWaalsContact O-N 3.15Å; D409-V411 HydrophobicContact CB-CG2 4.33Å; D409-V411 PolarHBondContact O-N 2.89Å
410	T	63.2	Low	73.6	Confident	88 Å²	88	77.7 Å²	77.7	54%	0.54	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-61.2	-15.8	176.9	53.9	0	0	0	0	113.6	N412 A413 P424	T410-N412 PolarHBondContact O-N 3.3Å; T410-A413 PolarHBondContact O-N 3.19Å; T410-P424 HydrophobicContact CG2-CB 4.47Å; T410-P424 HydrophobicContact CG2-CG 3.59Å
411	V	53.5	Low	72.7	Confident	103 Å²	103	84 Å²	84	62%	0.624	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-65.1	-26.4	-170.3	-171.4	0	0	0	0	112.4	D409	D409-V411 HydrophobicContact CB-CG2 4.33Å; D409-V411 PolarHBondContact O-N 2.89Å
412	N	51.1	Low	72	Confident	133 Å²	133	85.2 Å²	85.2	71%	0.711	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-88.6	-10.5	-179.6	-65.3	-19.5	0	0	0	113.9	T410	T410-N412 PolarHBondContact O-N 3.3Å
413	A	51.1	Low	71.5	Confident	36 Å²	36	86.8 Å²	86.8	30%	0.298	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-76.7	-23.7	-176.1	0	0	0	0	0	113.2	T410 E415 P424	T410-A413 PolarHBondContact O-N 3.19Å; A413-E415 PolarHBondContact O-N 3.45Å; A413-P424 HydrophobicContact CB-CB 4.19Å
414	E	49	Very low	71.1	Confident	176 Å²	176	88.7 Å²	88.7	82%	0.822	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-73.2	-12	-174.1	-63.1	-173.3	176.7	0	0	114
415	E	55.1	Low	70.9	Confident	174 Å²	174	90.5 Å²	90.5	81%	0.813	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-88.5	-3.4	-174.2	-63.6	-168.7	163.2	0	0	114.5	A413	A413-E415 PolarHBondContact O-N 3.45Å
416	N	56.2	Low	70.8	Confident	99 Å²	99	90.8 Å²	90.8	53%	0.529	49%	0.485	S	S	.	.			trans	-131.8	100.6	-173.6	-124.6	-24.1	0	0	0	112.3	N418 V419	N416-N418 PolarHBondContact O-N 3.41Å; N416-V419 HydrophobicContact CB-CB 4.39Å; N416-V419 HydrophobicContact CB-CG2 4.02Å; N416-V419 PolarHBondContact O-N 3.04Å
417	E	54.7	Low	70.8	Confident	184 Å²	184	91 Å²	91	86%	0.86	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-54.7	-24.9	-179.2	-66.2	-176.3	169.5	0	0	113.4	V419	E417-V419 VanDerWaalsContact C-N 3.27Å; E417-V419 PolarHBondContact O-N 3.31Å
418	N	58.6	Low	71.1	Confident	122 Å²	122	88 Å²	88	65%	0.652	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-78.8	-4.1	179.7	-67.9	-34.5	0	0	0	114.4	N416	N416-N418 PolarHBondContact O-N 3.41Å
419	V	66.5	Low	71.5	Confident	53 Å²	53	88.8 Å²	88.8	32%	0.321	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-124.8	4	-170.1	-166.7	0	0	0	0	111.9	N416 E417 N421 L422	N416-V419 HydrophobicContact CB-CB 4.39Å; N416-V419 HydrophobicContact CB-CG2 4.02Å; N416-V419 PolarHBondContact O-N 3.04Å; E417-V419 VanDerWaalsContact C-N 3.27Å; E417-V419 PolarHBondContact O-N 3.31Å; V419-N421 PolarHBondContact O-N 2.77Å; V419-L422 HydrophobicContact CG1-CB 3.79Å; V419-L422 HydrophobicContact CG1-CD1 3.77Å; V419-L422 HydrophobicContact CG1-CG 4.08Å; V419-L422 PolarHBondContact O-N 2.93Å
420	E	65	Low	72.7	Confident	164 Å²	164	83.1 Å²	83.1	77%	0.766	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-24.7	-170.3	-162.3	178.8	-176.7	0	0	114.5
421	N	76.7	Confident	74.2	Confident	134 Å²	134	81.5 Å²	81.5	72%	0.717	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	0.8	-179.5	-64.4	-51.9	0	0	0	114.9	L37 V419	L37-N421 HydrophobicContact CD1-CB 4.46Å; V419-N421 PolarHBondContact O-N 2.77Å
422	L	84.4	Confident	75.9	Confident	25 Å²	25	78.5 Å²	78.5	13%	0.131	41%	0.414	C	S	.	.	S	Bend	trans	-88.5	139.5	176.2	-63.8	-177.2	0	0	0	110.3	L34 L37 Y374 V419 L426 I429	L34-L422 HydrophobicContact CD1-CD1 4.07Å; L34-L422 HydrophobicContact CD1-CD2 4.5Å; L34-L422 HydrophobicContact CD1-CG 4.34Å; L34-L422 HydrophobicContact CD2-CD1 3.82Å; L37-L422 HydrophobicContact CD1-CD2 3.5Å; L37-L422 VanDerWaalsContact CD1-CD2 3.5Å; L37-L422 HydrophobicContact CD1-CG 4.39Å; Y374-L422 HydrophobicContact CD2-CD2 4.15Å; Y374-L422 HydrophobicContact CE2-CD2 3.62Å; V419-L422 HydrophobicContact CG1-CB 3.79Å; V419-L422 HydrophobicContact CG1-CD1 3.77Å; V419-L422 HydrophobicContact CG1-CG 4.08Å; V419-L422 PolarHBondContact O-N 2.93Å; L422-L426 HydrophobicContact CD1-CD2 4.41Å; L422-L426 HydrophobicContact CD2-CD2 4.07Å; L422-I429 HydrophobicContact CD1-CD1 4.47Å
423	P	87.6	Confident	78	Confident	33 Å²	33	72.5 Å²	72.5	21%	0.214	38%	0.382	C	S	.	.			trans	-58.6	135.2	171.1	-22.4	33.9	0	0	0	110.1	W404 Q425 L426	W404-P423 HydrophobicContact CH2-CB 4.37Å; W404-P423 HydrophobicContact CH2-CG 4.01Å; W404-P423 HydrophobicContact CZ3-CB 3.78Å; W404-P423 HydrophobicContact CZ3-CG 3.93Å; P423-Q425 PolarHBondContact O-N 3.49Å; P423-Q425 VanDerWaalsContact O-N 3.1Å; P423-L426 VanDerWaalsContact O-CB 3.32Å; P423-L426 WeakPolarHBondContact O-CB 3.49Å; P423-L426 PolarHBondContact O-N 3.11Å
424	P	89	Confident	80	Confident	41 Å²	41	79.1 Å²	79.1	27%	0.266	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-20.4	178.8	20.4	-28.3	0	0	0	113	A408 T410 A413 L426	A408-P424 WeakPolarHBondContact CB-O 3.45Å; T410-P424 HydrophobicContact CG2-CB 4.47Å; T410-P424 HydrophobicContact CG2-CG 3.59Å; A413-P424 HydrophobicContact CB-CB 4.19Å; P424-L426 VanDerWaalsContact C-N 3.29Å
425	Q	93.1	Very high	82.1	Confident	40 Å²	40	74.8 Å²	74.8	19%	0.187	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-13.6	175	-62.4	79.2	18.5	0	0	113.6	F372 W404 D405 P423 L427	F372-Q425 HydrophobicContact CE1-CB 3.95Å; F372-Q425 HydrophobicContact CE1-CG 3.99Å; F372-Q425 HydrophobicContact CZ-CB 4.35Å; F372-Q425 HydrophobicContact CZ-CG 4.28Å; W404-Q425 CarbonylContact C-O 3.59Å; W404-Q425 WeakPolarHBondContact CA-O 3.18Å; W404-Q425 HydrophobicContact CE3-CB 3.97Å; W404-Q425 HydrophobicContact CZ3-CB 4.49Å; D405-Q425 PolarHBondContact N-O 3.31Å; D405-Q425 WeakPolarHBondContact O-CA 2.92Å; D405-Q425 VanDerWaalsContact O-CB 3.3Å; D405-Q425 WeakPolarHBondContact O-CB 3.34Å; D405-Q425 WeakPolarHBondContact O-CG 3.46Å; P423-Q425 PolarHBondContact O-N 3.49Å; P423-Q425 VanDerWaalsContact O-N 3.1Å; Q425-L427 PolarHBondContact O-N 3.24Å
426	L	93.4	Very high	84.1	Confident	24 Å²	24	66.5 Å²	66.5	13%	0.126	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	104.9	178.9	179.1	61.7	0	0	0	109.6	Y374 T402 W404 L422 P423 P424 I429	Y374-L426 HydrophobicContact CD2-CD2 4.08Å; Y374-L426 HydrophobicContact CE1-CD2 4.34Å; Y374-L426 HydrophobicContact CE2-CD2 3.89Å; Y374-L426 HydrophobicContact CG-CD2 4.39Å; T402-L426 HydrophobicContact CG2-CD1 3.74Å; W404-L426 HydrophobicContact CD2-CD1 4.19Å; W404-L426 HydrophobicContact CE3-CB 4.17Å; W404-L426 HydrophobicContact CH2-CB 4.17Å; W404-L426 HydrophobicContact CH2-CD1 4.19Å; W404-L426 HydrophobicContact CZ2-CD1 3.8Å; W404-L426 HydrophobicContact CZ3-CB 3.96Å; L422-L426 HydrophobicContact CD1-CD2 4.41Å; L422-L426 HydrophobicContact CD2-CD2 4.07Å; P423-L426 VanDerWaalsContact O-CB 3.32Å; P423-L426 WeakPolarHBondContact O-CB 3.49Å; P423-L426 PolarHBondContact O-N 3.11Å; P424-L426 VanDerWaalsContact C-N 3.29Å; L426-I429 HydrophobicContact CD1-CG1 4.34Å; L426-I429 HydrophobicContact CD2-CD1 3.98Å; L426-I429 HydrophobicContact CD2-CG1 3.97Å; L426-I429 HydrophobicContact CG-CG1 4.33Å
427	L	93.2	Very high	86.1	Confident	55 Å²	55	63.3 Å²	63.3	29%	0.288	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-35.9	-177.3	-70.6	-175.5	0	0	0	113.7	L403 D405 Q425 V465	L403-L427 HydrophobicContact CB-CB 4.44Å; L403-L427 WeakPolarHBondContact O-CB 3.25Å; L403-L427 PolarHBondContact O-N 3.1Å; D405-L427 HydrophobicContact CB-CD1 3.43Å; D405-L427 VanDerWaalsContact CB-CD1 3.43Å; D405-L427 HydrophobicContact CB-CD2 4Å; D405-L427 HydrophobicContact CB-CG 3.69Å; Q425-L427 PolarHBondContact O-N 3.24Å; L427-V465 HydrophobicContact CD1-CG2 3.98Å
428	F	94.6	Very high	88.2	Confident	20 Å²	20	54.7 Å²	54.7	9%	0.088	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	146.1	-171.5	-160.3	-93.2	0	0	0	112.3	A53 Y54 T402 L403 H430 T462	A53-F428 HydrophobicContact CB-CE2 3.85Å; A53-F428 HydrophobicContact CB-CZ 4.14Å; Y54-F428 HydrophobicContact CD1-CZ 4.43Å; Y54-F428 AromaticContact CE1-CE1 3.97Å; Y54-F428 HydrophobicContact CE1-CE1 3.97Å; Y54-F428 AromaticContact CE1-CZ 3.8Å; Y54-F428 HydrophobicContact CE1-CZ 3.8Å; Y54-F428 AromaticContact CE2-CZ 3.9Å; Y54-F428 HydrophobicContact CE2-CZ 3.9Å; Y54-F428 AromaticContact CZ-CE1 3.75Å; Y54-F428 AromaticContact CZ-CZ 3.51Å; Y54-F428 WeakPolarHBondContact OH-CE1 3.43Å; T402-F428 VanDerWaalsContact CA-O 3.3Å; T402-F428 WeakPolarHBondContact CA-O 3.41Å; L403-F428 HydrophobicContact CB-CB 3.87Å; L403-F428 HydrophobicContact CD1-CB 3.91Å; L403-F428 HydrophobicContact CD1-CG 4.36Å; L403-F428 HydrophobicContact CG-CB 3.95Å; L403-F428 PolarHBondContact N-O 3.41Å; L403-F428 PolarHBondContact O-N 3.12Å; F428-H430 HydrophobicContact CD1-CB 4.09Å; F428-H430 HydrophobicContact CE1-CB 3.91Å; F428-T462 HydrophobicContact CD1-CG2 3.8Å; F428-T462 HydrophobicContact CD2-CG2 3.87Å; F428-T462 HydrophobicContact CE1-CG2 3.75Å; F428-T462 HydrophobicContact CE2-CG2 3.79Å; F428-T462 HydrophobicContact CG-CG2 3.87Å; F428-T462 HydrophobicContact CZ-CG2 3.74Å
429	I	94.9	Very high	90.1	Very high	39 Å²	39	48.9 Å²	48.9	20%	0.2	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	115.2	173.9	-58.7	167.7	0	0	0	107.6	L34 P35 Y374 V400 T402 L422 L426 L431	L34-I429 HydrophobicContact CD2-CD1 3.98Å; P35-I429 HydrophobicContact CG-CG2 4.02Å; Y374-I429 WeakPolarHBondContact OH-CD1 3.46Å; V400-I429 HydrophobicContact CG1-CG2 3.64Å; T402-I429 HydrophobicContact CG2-CG1 4.43Å; L422-I429 HydrophobicContact CD1-CD1 4.47Å; L426-I429 HydrophobicContact CD1-CG1 4.34Å; L426-I429 HydrophobicContact CD2-CD1 3.98Å; L426-I429 HydrophobicContact CD2-CG1 3.97Å; L426-I429 HydrophobicContact CG-CG1 4.33Å; I429-L431 HydrophobicContact CG2-CD2 4.24Å; I429-L431 HydrophobicContact CG2-CG 4.14Å
430	H	95.5	Very high	91.6	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.009	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128.1	176.7	175.2	70	0	0	0	110.3	Y54 Y57 V401 F428 F449 D458	Y54-H430 AromaticContact CE1-ND1 3.88Å; Y54-H430 AromaticContact CZ-ND1 3.77Å; Y54-H430 PolarHBondContact OH-ND1 3.06Å; Y57-H430 AromaticContact CE2-CE1 3.66Å; Y57-H430 AromaticContact CZ-CE1 3.99Å; V401-H430 HydrophobicContact CB-CB 4.08Å; V401-H430 PolarHBondContact N-O 3.33Å; V401-H430 WeakPolarHBondContact O-CB 3.46Å; V401-H430 PolarHBondContact O-N 3.14Å; F428-H430 HydrophobicContact CD1-CB 4.09Å; F428-H430 HydrophobicContact CE1-CB 3.91Å; H430-F449 HydrophobicContact CB-CZ 4.22Å; H430-F449 AromaticContact CG-CZ 3.96Å; H430-D458 IonicContact CE1-OD2 3.39Å; H430-D458 PolarHBondContact CE1-OD2 3.22Å; H430-D458 IonicContact NE2-OD2 3.21Å; H430-D458 PolarHBondContact NE2-OD2 3.06Å
431	L	94.1	Very high	93.1	Very high	54 Å²	54	39.3 Å²	39.3	28%	0.283	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	156.2	-176.4	-60.8	175.3	0	0	0	110.2	Y33 P35 V400 I429	Y33-L431 HydrophobicContact CD1-CD1 4.18Å; Y33-L431 HydrophobicContact CE1-CD1 4.46Å; P35-L431 HydrophobicContact CG-CD1 3.78Å; P35-L431 HydrophobicContact CG-CD2 3.59Å; P35-L431 HydrophobicContact CG-CG 4.2Å; V400-L431 HydrophobicContact CB-CD2 4.21Å; V400-L431 HydrophobicContact CG1-CD2 4.04Å; V400-L431 HydrophobicContact CG2-CD2 3.67Å; I429-L431 HydrophobicContact CG2-CD2 4.24Å; I429-L431 HydrophobicContact CG2-CG 4.14Å
432	G	90.3	Very high	94	Very high	40 Å²	40	33 Å²	33	41%	0.412	17%	0.168	S	C	.	.			trans	133.5	-23.4	174.6	0	0	0	0	0	113.2	N455	G432-N455 PolarHBondContact O-ND2 3.2Å
433	L	94.2	Very high	94.4	Very high	8 Å²	8	34.1 Å²	34.1	4%	0.042	18%	0.177	C	C	.	.			trans	-82.8	157.4	172.8	-69.1	177.6	0	0	0	111.9	N399 V436 S451 A453 N455 D458	N399-L433 WeakPolarHBondContact CB-O 3.37Å; L433-V436 HydrophobicContact CB-CG2 3.8Å; L433-V436 HydrophobicContact CD1-CG1 4.36Å; L433-V436 HydrophobicContact CD1-CG2 4.43Å; L433-S451 WeakPolarHBondContact CD1-OG 3.47Å; L433-A453 HydrophobicContact CB-CB 3.66Å; L433-A453 HydrophobicContact CD1-CB 4.11Å; L433-A453 HydrophobicContact CD2-CB 3.83Å; L433-A453 HydrophobicContact CG-CB 4.08Å; L433-N455 WeakPolarHBondContact CA-OD1 3.28Å; L433-D458 HydrophobicContact CD1-CB 4.14Å; L433-D458 HydrophobicContact CD2-CB 4.46Å; L433-D458 WeakPolarHBondContact CD2-OD1 3.39Å; L433-D458 HydrophobicContact CG-CB 4.4Å
434	R	93.9	Very high	94.6	Very high	175 Å²	175	33.3 Å²	33.3	66%	0.66	17%	0.171	S	C	*	.	S	Bend	trans	-123.3	129.2	175.9	-67.3	-173.9	-178.4	-177	1.3	110.7	N399 A453 L454 N455	N399-R434 VanDerWaalsContact OD1-CA 3.28Å; N399-R434 WeakPolarHBondContact OD1-CA 3.35Å; R434-A453 VanDerWaalsContact O-CB 3.26Å; R434-A453 WeakPolarHBondContact O-CB 3.5Å; R434-L454 VanDerWaalsContact O-CB 3.25Å; R434-L454 WeakPolarHBondContact O-CB 3.15Å; R434-L454 PolarHBondContact O-N 3.07Å; R434-N455 PolarHBondContact N-OD1 2.62Å
435	E	93.7	Very high	94.8	Very high	85 Å²	85	31.4 Å²	31.4	40%	0.397	16%	0.158	S	C	.	.	S	Bend	trans	48.4	69	-171	-56.4	179.3	-158.2	0	0	111	N399 K437 A453 L454	N399-E435 PolarHBondContact OD1-N 2.93Å; E435-K437 VanDerWaalsContact O-CD 3.27Å; E435-K437 WeakPolarHBondContact O-CD 3.45Å; E435-K437 WeakPolarHBondContact O-CE 3.3Å; E435-K437 WeakPolarHBondContact O-CG 3.36Å; E435-K437 PolarHBondContact O-N 2.8Å; E435-K437 IonicContact OE2-NZ 3.85Å; E435-K437 PolarHBondContact OE2-NZ 3.03Å; E435-A453 WeakPolarHBondContact O-CA 3.26Å; E435-L454 HydrophobicContact CB-CB 4.17Å; E435-L454 PolarHBondContact O-N 2.88Å
436	V	97.5	Very high	94.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	131.5	-177.8	-167	0	0	0	0	109.5	N380 V401 L433 T452	N380-V436 PolarHBondContact ND2-O 3.2Å; V401-V436 HydrophobicContact CG2-CG1 3.76Å; V401-V436 HydrophobicContact CG2-CG2 4.29Å; L433-V436 HydrophobicContact CB-CG2 3.8Å; L433-V436 HydrophobicContact CD1-CG1 4.36Å; L433-V436 HydrophobicContact CD1-CG2 4.43Å; V436-T452 WeakPolarHBondContact CG1-O 3.04Å
437	K	97.2	Very high	94.8	Very high	31 Å²	31	33.2 Å²	33.2	14%	0.135	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-46.4	-172.3	-60	-49.9	176.4	-174.4	0	112.6	L74 N380 E435 T452	L74-K437 HydrophobicContact CD1-CB 3.99Å; L74-K437 HydrophobicContact CD1-CD 3.83Å; L74-K437 HydrophobicContact CD1-CG 4.01Å; N380-K437 WeakPolarHBondContact CB-O 3.21Å; E435-K437 VanDerWaalsContact O-CD 3.27Å; E435-K437 WeakPolarHBondContact O-CD 3.45Å; E435-K437 WeakPolarHBondContact O-CE 3.3Å; E435-K437 WeakPolarHBondContact O-CG 3.36Å; E435-K437 PolarHBondContact O-N 2.8Å; E435-K437 IonicContact OE2-NZ 3.85Å; E435-K437 PolarHBondContact OE2-NZ 3.03Å; K437-T452 HydrophobicContact CB-CG2 4.07Å; K437-T452 PolarHBondContact N-O 2.82Å
438	E	98.1	Very high	95	Very high	3 Å²	3	30.6 Å²	30.6	1%	0.014	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	154.5	174.3	-77.7	-173.6	175.7	0	0	111.1	L74 S75 F76 R180 R182 H440 S451 T452	L74-E438 WeakPolarHBondContact O-CG 3.29Å; S75-E438 WeakPolarHBondContact CA-OE2 2.92Å; S75-E438 WeakPolarHBondContact CB-OE1 3.19Å; S75-E438 PolarHBondContact OG-OE1 2.56Å; S75-E438 PolarHBondContact OG-OE2 2.76Å; F76-E438 HydrophobicContact CD1-CB 4.18Å; F76-E438 HydrophobicContact CE1-CB 3.98Å; F76-E438 PolarHBondContact N-OE2 2.77Å; F76-E438 VanDerWaalsContact N-OE2 3.15Å; R180-E438 IonicContact CZ-OE1 2.87Å; R180-E438 IonicContact NE-OE1 3.87Å; R180-E438 IonicContact NH2-OE1 3.98Å; R182-E438 IonicContact NH1-OE1 3.78Å; R182-E438 IonicContact NH1-OE2 2.87Å; R182-E438 IonicContact NH2-OE1 3.86Å; E438-H440 IonicContact OE2-CD2 2.72Å; E438-H440 IonicContact OE2-CE1 3.86Å; E438-H440 IonicContact OE2-NE2 3.11Å; E438-H440 PolarHBondContact OE2-NE2 3.47Å; E438-S451 CarbonylContact O-C 3.59Å; E438-S451 WeakPolarHBondContact O-CA 3.35Å; E438-S451 WeakPolarHBondContact O-CB 3.39Å; E438-T452 HydrophobicContact CB-CG2 3.91Å; E438-T452 PolarHBondContact N-O 3.11Å; E438-T452 PolarHBondContact O-N 3.28Å
439	V	98.6	Very high	95.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	140.3	167.1	62	0	0	0	0	108.5	S381 A393 V401 F449 L450	S381-V439 PolarHBondContact OG-O 2.99Å; A393-V439 HydrophobicContact CB-CG1 3.98Å; A393-V439 HydrophobicContact CB-CG2 3.99Å; V401-V439 HydrophobicContact CG1-CB 4.34Å; V401-V439 HydrophobicContact CG1-CG2 3.88Å; V439-F449 HydrophobicContact CG2-CD2 4.14Å; V439-L450 CarbonylContact C-O 3.4Å; V439-L450 WeakPolarHBondContact CA-O 3.49Å; V439-L450 WeakPolarHBondContact CG2-O 3.27Å
440	H	98.5	Very high	95.2	Very high	11 Å²	11	27.8 Å²	27.8	5%	0.051	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	148	175.8	-67.8	-104.7	0	0	0	112	F76 P78 E383 E438 F449 L450	F76-H440 AromaticContact CD1-CD2 3.96Å; F76-H440 AromaticContact CE1-CD2 3.49Å; F76-H440 VanDerWaalsContact CE1-CD2 3.49Å; F76-H440 WeakPolarHBondContact CE1-CD2 3.28Å; F76-H440 HydrophobicContact CE2-CB 4.3Å; F76-H440 HydrophobicContact CZ-CB 4.08Å; F76-H440 AromaticContact CZ-CD2 3.52Å; F76-H440 PolarHBondContact O-CE1 2.95Å; F76-H440 PolarHBondContact O-NE2 3.09Å; P78-H440 HydrophobicContact CG-CB 3.73Å; E383-H440 WeakPolarHBondContact OE2-CA 3.32Å; E383-H440 IonicContact OE2-CE1 2.87Å; E383-H440 IonicContact OE2-CG 3.36Å; E383-H440 IonicContact OE2-ND1 3.77Å; E383-H440 PolarHBondContact OE2-ND1 2.85Å; E383-H440 VanDerWaalsContact OE2-ND1 3.11Å; E438-H440 IonicContact OE2-CD2 2.72Å; E438-H440 IonicContact OE2-CE1 3.86Å; E438-H440 IonicContact OE2-NE2 3.11Å; E438-H440 PolarHBondContact OE2-NE2 3.47Å; H440-F449 CarbonylContact O-C 3.38Å; H440-F449 WeakPolarHBondContact O-CA 3.36Å; H440-L450 PolarHBondContact N-O 2.82Å; H440-L450 PolarHBondContact O-N 2.74Å
441	W	97.3	Very high	95.4	Very high	5 Å²	5	27.7 Å²	27.7	2%	0.019	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	148.7	167.8	-64.6	103.9	0	0	0	111	E383 Y385 V391 A393 L403 P443 F449 V465	E383-W441 PolarHBondContact O-NE1 3.29Å; E383-W441 PolarHBondContact OE1-N 3.36Å; Y385-W441 HydrophobicContact CD2-CB 4.3Å; Y385-W441 AromaticContact CD2-CD2 3.44Å; Y385-W441 HydrophobicContact CD2-CD2 3.44Å; Y385-W441 VanDerWaalsContact CD2-CD2 3.44Å; Y385-W441 AromaticContact CD2-CE2 3.75Å; Y385-W441 AromaticContact CD2-CE3 3.7Å; Y385-W441 HydrophobicContact CD2-CE3 3.7Å; Y385-W441 AromaticContact CD2-CG 3.72Å; Y385-W441 HydrophobicContact CD2-CG 3.72Å; Y385-W441 HydrophobicContact CD2-CH2 4.43Å; Y385-W441 HydrophobicContact CD2-CZ2 4.23Å; Y385-W441 HydrophobicContact CD2-CZ3 4.2Å; Y385-W441 HydrophobicContact CE2-CD2 4.09Å; Y385-W441 AromaticContact CE2-CE3 3.88Å; Y385-W441 HydrophobicContact CE2-CE3 3.88Å; Y385-W441 HydrophobicContact CE2-CZ3 4.28Å; Y385-W441 HydrophobicContact CG-CD2 4.29Å; Y385-W441 HydrophobicContact CG-CZ2 4.38Å; V391-W441 HydrophobicContact CG1-CZ2 4.37Å; A393-W441 HydrophobicContact CB-CZ2 3.85Å; L403-W441 HydrophobicContact CD1-CH2 3.99Å; L403-W441 HydrophobicContact CD2-CH2 3.59Å; L403-W441 HydrophobicContact CD2-CZ2 3.77Å; L403-W441 HydrophobicContact CG-CH2 4.33Å; W441-P443 WeakPolarHBondContact O-CD 3.23Å; W441-F449 HydrophobicContact CD2-CB 4.38Å; W441-F449 HydrophobicContact CE3-CB 3.74Å; W441-F449 HydrophobicContact CZ3-CB 3.89Å; W441-F449 HydrophobicContact CZ3-CD1 4.42Å; W441-V465 HydrophobicContact CH2-CB 4.27Å; W441-V465 HydrophobicContact CH2-CG1 3.81Å; W441-V465 HydrophobicContact CH2-CG2 4.36Å; W441-V465 HydrophobicContact CZ3-CG1 4Å
442	H	95.9	Very high	95.6	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	12%	0.124	C	C	.	.			trans	-68.1	126.8	171.5	-170.4	-82	0	0	0	110	Y88 Y387 N444 C445 V448 L450	Y88-H442 PolarHBondContact OH-CE1 2.96Å; Y387-H442 PolarHBondContact OH-O 3.09Å; H442-N444 PolarHBondContact ND1-N 3.42Å; H442-N444 PolarHBondContact O-N 2.77Å; H442-N444 VanDerWaalsContact O-N 3.12Å; H442-C445 HydrophobicContact CB-CB 4.25Å; H442-C445 VanDerWaalsContact ND1-CB 3.31Å; H442-C445 WeakPolarHBondContact ND1-CB 3.42Å; H442-C445 PolarHBondContact ND1-N 2.76Å; H442-V448 HydrophobicContact CB-CB 3.78Å; H442-V448 HydrophobicContact CB-CG1 3.96Å; H442-V448 WeakPolarHBondContact CB-O 3.31Å; H442-V448 PolarHBondContact N-O 3.38Å; H442-L450 HydrophobicContact CB-CD1 4.3Å
443	P	92	Very high	95.9	Very high	50 Å²	50	23.2 Å²	23.2	33%	0.325	10%	0.104	S	C	.	.	S	Bend	trans	-69.9	-14	-168.1	22.4	-34	0	0	0	114.9	P78 T80 Y387 W441	P78-P443 HydrophobicContact CB-CG 4.31Å; T80-P443 HydrophobicContact CG2-CG 4.18Å; Y387-P443 PolarHBondContact OH-O 3.15Å; W441-P443 WeakPolarHBondContact O-CD 3.23Å
444	N	91.2	Very high	95.8	Very high	16 Å²	16	26.4 Å²	26.4	9%	0.086	12%	0.121	C	C	.	.	S	Bend	trans	-132.1	-2.9	177.7	-71.2	93	0	0	0	116.1	T80 S85 S86 T87 Y88 Y387 H442	T80-N444 WeakPolarHBondContact CB-OD1 3.17Å; T80-N444 HydrophobicContact CG2-CB 3.79Å; T80-N444 WeakPolarHBondContact CG2-OD1 3.27Å; T80-N444 PolarHBondContact OG1-OD1 2.9Å; S85-N444 PolarHBondContact O-ND2 3.45Å; S86-N444 PolarHBondContact O-ND2 2.85Å; T87-N444 CarbonylContact C-O 3.5Å; T87-N444 VanDerWaalsContact CA-O 3.27Å; T87-N444 WeakPolarHBondContact CA-O 3.41Å; Y88-N444 HydrophobicContact CD1-CB 3.89Å; Y88-N444 HydrophobicContact CE1-CB 3.41Å; Y88-N444 VanDerWaalsContact CE1-CB 3.41Å; Y88-N444 PolarHBondContact N-O 2.89Å; Y387-N444 VanDerWaalsContact OH-C 3.31Å; Y387-N444 WeakPolarHBondContact OH-CA 3.11Å; Y387-N444 PolarHBondContact OH-N 3.08Å; H442-N444 PolarHBondContact ND1-N 3.42Å; H442-N444 PolarHBondContact O-N 2.77Å; H442-N444 VanDerWaalsContact O-N 3.12Å
445	C	93	Very high	95.7	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.103	C	C	.	.	B	Isolated β-bridge	trans	-124.5	113.1	-174.5	-167.6	0	0	0	0	109.2	Y88 F94 H442 G447 V448	Y88-C445 HydrophobicContact CD2-CB 4.36Å; Y88-C445 HydrophobicContact CE2-CB 3.76Å; F94-C445 HydrophobicContact CE2-CB 4.03Å; F94-C445 HydrophobicContact CZ-CB 4.19Å; H442-C445 HydrophobicContact CB-CB 4.25Å; H442-C445 VanDerWaalsContact ND1-CB 3.31Å; H442-C445 WeakPolarHBondContact ND1-CB 3.42Å; H442-C445 PolarHBondContact ND1-N 2.76Å; C445-G447 PolarHBondContact O-N 2.91Å; C445-V448 HydrophobicContact CB-CB 4.49Å; C445-V448 HydrophobicContact CB-CG2 4.17Å; C445-V448 PolarHBondContact O-N 2.86Å
446	K	93	Very high	95.6	Very high	101 Å²	101	16.7 Å²	16.7	44%	0.439	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	130	-168.9	-69.6	-171.9	177.3	-174.3	0	112.1	Y385 Y387 V448 K461	Y385-K446 VanDerWaalsContact OH-CA 3.3Å; Y385-K446 WeakPolarHBondContact OH-CA 3.38Å; Y385-K446 VanDerWaalsContact OH-CB 3.28Å; Y385-K446 WeakPolarHBondContact OH-CB 3.34Å; Y387-K446 HydrophobicContact CD2-CB 4.29Å; Y387-K446 HydrophobicContact CD2-CG 3.65Å; Y387-K446 HydrophobicContact CE2-CG 3.97Å; Y387-K446 HydrophobicContact CG-CG 4.02Å; K446-V448 PolarHBondContact O-N 3.35Å; K446-K461 WeakPolarHBondContact O-CE 3.24Å; K446-K461 PolarHBondContact O-NZ 3.05Å
447	G	94.2	Very high	95.6	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.01	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	0.9	175	0	0	0	0	0	115.8	Y385 C445 K461	Y385-G447 PolarHBondContact OH-N 3.22Å; C445-G447 PolarHBondContact O-N 2.91Å; G447-K461 VanDerWaalsContact O-CD 3.28Å; G447-K461 WeakPolarHBondContact O-CD 3.42Å
448	V	96.4	Very high	95.5	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	125.7	166.2	178.4	0	0	0	0	107.5	M56 L90 F94 H442 C445 K446 L450 V459 A460 K461	M56-V448 HydrophobicContact CE-CG1 4.08Å; M56-V448 HydrophobicContact CE-CG2 4.29Å; L90-V448 HydrophobicContact CD1-CG2 4.14Å; L90-V448 HydrophobicContact CD2-CG2 4.49Å; F94-V448 HydrophobicContact CE1-CG1 4.06Å; F94-V448 HydrophobicContact CE1-CG2 4.44Å; F94-V448 HydrophobicContact CZ-CG1 4.3Å; F94-V448 HydrophobicContact CZ-CG2 4.31Å; H442-V448 HydrophobicContact CB-CB 3.78Å; H442-V448 HydrophobicContact CB-CG1 3.96Å; H442-V448 WeakPolarHBondContact CB-O 3.31Å; H442-V448 PolarHBondContact N-O 3.38Å; C445-V448 HydrophobicContact CB-CB 4.49Å; C445-V448 HydrophobicContact CB-CG2 4.17Å; C445-V448 PolarHBondContact O-N 2.86Å; K446-V448 PolarHBondContact O-N 3.35Å; V448-L450 HydrophobicContact CG1-CD1 4.34Å; V448-V459 HydrophobicContact CG1-CG1 4.11Å; V448-A460 CarbonylContact C-O 3.56Å; V448-A460 WeakPolarHBondContact CA-O 3.11Å; V448-K461 HydrophobicContact CG2-CB 4.24Å; V448-K461 HydrophobicContact CG2-CD 4.46Å
449	F	97.4	Very high	95.3	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	155.2	171.6	73.2	-85.5	0	0	0	110.4	V401 L403 H430 V439 H440 W441 A460 T462	V401-F449 HydrophobicContact CG1-CE2 4.33Å; L403-F449 HydrophobicContact CD1-CD1 4.48Å; L403-F449 HydrophobicContact CD1-CE1 4.39Å; H430-F449 HydrophobicContact CB-CZ 4.22Å; H430-F449 AromaticContact CG-CZ 3.96Å; V439-F449 HydrophobicContact CG2-CD2 4.14Å; H440-F449 CarbonylContact O-C 3.38Å; H440-F449 WeakPolarHBondContact O-CA 3.36Å; W441-F449 HydrophobicContact CD2-CB 4.38Å; W441-F449 HydrophobicContact CE3-CB 3.74Å; W441-F449 HydrophobicContact CZ3-CB 3.89Å; W441-F449 HydrophobicContact CZ3-CD1 4.42Å; F449-A460 HydrophobicContact CD1-CB 4.19Å; F449-A460 WeakPolarHBondContact CD1-O 3.34Å; F449-A460 HydrophobicContact CE1-CB 3.49Å; F449-A460 VanDerWaalsContact CE1-CB 3.49Å; F449-A460 HydrophobicContact CE2-CB 4.17Å; F449-A460 HydrophobicContact CZ-CB 3.5Å; F449-A460 PolarHBondContact N-O 3.31Å; F449-A460 PolarHBondContact O-N 3.09Å; F449-T462 HydrophobicContact CD1-CG2 4.49Å; F449-T462 HydrophobicContact CE1-CG2 3.66Å
450	L	98	Very high	95.2	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.005	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	147.5	176.3	-66.5	88.3	0	0	0	107.9	F76 P78 L98 V439 H440 H442 V448 D458 V459	F76-L450 HydrophobicContact CE2-CB 3.53Å; F76-L450 HydrophobicContact CE2-CD2 4.23Å; F76-L450 HydrophobicContact CE2-CG 4.47Å; F76-L450 HydrophobicContact CZ-CB 3.64Å; P78-L450 HydrophobicContact CB-CD1 4.37Å; P78-L450 HydrophobicContact CG-CD1 3.99Å; L98-L450 HydrophobicContact CD1-CD2 4.42Å; V439-L450 CarbonylContact C-O 3.4Å; V439-L450 WeakPolarHBondContact CA-O 3.49Å; V439-L450 WeakPolarHBondContact CG2-O 3.27Å; H440-L450 PolarHBondContact N-O 2.82Å; H440-L450 PolarHBondContact O-N 2.74Å; H442-L450 HydrophobicContact CB-CD1 4.3Å; V448-L450 HydrophobicContact CG1-CD1 4.34Å; L450-D458 CarbonylContact C-O 3.46Å; L450-D458 VanDerWaalsContact CA-O 3.28Å; L450-D458 WeakPolarHBondContact CA-O 3.22Å; L450-V459 HydrophobicContact CD2-CG2 3.88Å; L450-V459 HydrophobicContact CG-CB 4.47Å; L450-V459 HydrophobicContact CG-CG1 4.15Å; L450-V459 HydrophobicContact CG-CG2 4Å
451	S	98.3	Very high	95	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	154.3	171.7	51.8	0	0	0	0	110.9	L433 E438 F457 D458	L433-S451 WeakPolarHBondContact CD1-OG 3.47Å; E438-S451 CarbonylContact O-C 3.59Å; E438-S451 WeakPolarHBondContact O-CA 3.35Å; E438-S451 WeakPolarHBondContact O-CB 3.39Å; S451-F457 CarbonylContact O-C 3.49Å; S451-F457 WeakPolarHBondContact O-CA 3.3Å; S451-D458 PolarHBondContact N-O 3.32Å; S451-D458 PolarHBondContact O-N 2.92Å
452	T	97.8	Very high	94.8	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	151	177.2	-177	0	0	0	0	109.8	C73 F76 V436 K437 E438 G456 F457	C73-T452 WeakPolarHBondContact O-CG2 3.39Å; C73-T452 PolarHBondContact O-OG1 3.48Å; F76-T452 HydrophobicContact CD1-CG2 3.4Å; F76-T452 HydrophobicContact CE1-CG2 3.61Å; V436-T452 WeakPolarHBondContact CG1-O 3.04Å; K437-T452 HydrophobicContact CB-CG2 4.07Å; K437-T452 PolarHBondContact N-O 2.82Å; E438-T452 HydrophobicContact CB-CG2 3.91Å; E438-T452 PolarHBondContact N-O 3.11Å; E438-T452 PolarHBondContact O-N 3.28Å; T452-G456 CarbonylContact C-O 3.58Å; T452-G456 WeakPolarHBondContact CA-O 3.28Å; T452-F457 VanDerWaalsContact CB-CE1 3.46Å; T452-F457 HydrophobicContact CG2-CE1 4.45Å; T452-F457 WeakPolarHBondContact OG1-CZ 3.2Å
453	A	96.8	Very high	94.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	-177.5	-177.5	0	0	0	0	0	110.8	L433 R434 E435 N455 G456	L433-A453 HydrophobicContact CB-CB 3.66Å; L433-A453 HydrophobicContact CD1-CB 4.11Å; L433-A453 HydrophobicContact CD2-CB 3.83Å; L433-A453 HydrophobicContact CG-CB 4.08Å; R434-A453 VanDerWaalsContact O-CB 3.26Å; R434-A453 WeakPolarHBondContact O-CB 3.5Å; E435-A453 WeakPolarHBondContact O-CA 3.26Å; A453-N455 PolarHBondContact O-N 2.67Å; A453-G456 PolarHBondContact N-O 3.46Å; A453-G456 PolarHBondContact O-N 2.87Å
454	L	93.3	Very high	94.1	Very high	75 Å²	75	21.6 Å²	21.6	39%	0.393	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-34.7	176.1	-178.3	62.6	0	0	0	112.4	P72 R434 E435	P72-L454 HydrophobicContact CB-CD1 4.15Å; P72-L454 HydrophobicContact CG-CD1 4Å; R434-L454 VanDerWaalsContact O-CB 3.25Å; R434-L454 WeakPolarHBondContact O-CB 3.15Å; R434-L454 PolarHBondContact O-N 3.07Å; E435-L454 HydrophobicContact CB-CB 4.17Å; E435-L454 PolarHBondContact O-N 2.88Å
455	N	91.3	Very high	93.7	Very high	54 Å²	54	22.4 Å²	22.4	29%	0.289	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	8.1	-175.5	67.1	-34.3	0	0	0	114.8	G432 L433 R434 A453	G432-N455 PolarHBondContact O-ND2 3.2Å; L433-N455 WeakPolarHBondContact CA-OD1 3.28Å; R434-N455 PolarHBondContact N-OD1 2.62Å; A453-N455 PolarHBondContact O-N 2.67Å
456	G	92.8	Very high	93.7	Very high	2 Å²	2	23.5 Å²	23.5	2%	0.021	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	129.7	-146.3	176.2	0	0	0	0	0	113.5	F60 T452 A453	F60-G456 CarbonylContact O-C 3.58Å; F60-G456 WeakPolarHBondContact O-CA 3.49Å; T452-G456 CarbonylContact C-O 3.58Å; T452-G456 WeakPolarHBondContact CA-O 3.28Å; A453-G456 PolarHBondContact N-O 3.46Å; A453-G456 PolarHBondContact O-N 2.87Å
457	F	95.7	Very high	93.8	Very high	2 Å²	2	19.4 Å²	19.4	1%	0.009	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	145.9	-173.4	-69.9	-103.5	0	0	0	110.9	K59 F60 T62 C73 F76 L98 A100 M115 S451 T452	K59-F457 CarbonylContact C-O 3.49Å; K59-F457 WeakPolarHBondContact CA-O 3.38Å; F60-F457 HydrophobicContact CD1-CB 3.64Å; F60-F457 HydrophobicContact CD2-CB 3.97Å; F60-F457 HydrophobicContact CD2-CD2 4.02Å; F60-F457 HydrophobicContact CD2-CG 4.22Å; F60-F457 HydrophobicContact CE1-CB 3.24Å; F60-F457 HydrophobicContact CE1-CD1 4.44Å; F60-F457 AromaticContact CE1-CG 3.96Å; F60-F457 HydrophobicContact CE1-CG 3.96Å; F60-F457 HydrophobicContact CE2-CB 3.61Å; F60-F457 HydrophobicContact CE2-CD1 4.18Å; F60-F457 AromaticContact CE2-CD2 3.51Å; F60-F457 HydrophobicContact CE2-CD2 3.51Å; F60-F457 HydrophobicContact CE2-CE2 4.16Å; F60-F457 AromaticContact CE2-CG 3.53Å; F60-F457 HydrophobicContact CE2-CG 3.53Å; F60-F457 HydrophobicContact CG-CB 3.99Å; F60-F457 HydrophobicContact CZ-CB 3.23Å; F60-F457 AromaticContact CZ-CD1 3.75Å; F60-F457 HydrophobicContact CZ-CD1 3.75Å; F60-F457 AromaticContact CZ-CD2 3.9Å; F60-F457 HydrophobicContact CZ-CD2 3.9Å; F60-F457 AromaticContact CZ-CG 3.38Å; F60-F457 HydrophobicContact CZ-CG 3.38Å; F60-F457 PolarHBondContact N-O 2.97Å; F60-F457 PolarHBondContact O-N 3.46Å; T62-F457 HydrophobicContact CG2-CE2 4.3Å; C73-F457 HydrophobicContact CB-CE2 3.96Å; C73-F457 HydrophobicContact CB-CZ 3.49Å; C73-F457 VanDerWaalsContact CB-CZ 3.49Å; F76-F457 HydrophobicContact CB-CE1 3.98Å; F76-F457 HydrophobicContact CB-CZ 4.49Å; F76-F457 HydrophobicContact CD1-CE1 4.01Å; F76-F457 HydrophobicContact CD2-CE1 4.19Å; F76-F457 AromaticContact CG-CE1 3.8Å; F76-F457 HydrophobicContact CG-CE1 3.8Å; L98-F457 HydrophobicContact CD1-CD1 4.18Å; L98-F457 HydrophobicContact CD1-CE1 3.88Å; A100-F457 HydrophobicContact CB-CE1 4.49Å; A100-F457 HydrophobicContact CB-CZ 3.86Å; M115-F457 HydrophobicContact CE-CZ 4.31Å; S451-F457 CarbonylContact O-C 3.49Å; S451-F457 WeakPolarHBondContact O-CA 3.3Å; T452-F457 VanDerWaalsContact CB-CE1 3.46Å; T452-F457 HydrophobicContact CG2-CE1 4.45Å; T452-F457 WeakPolarHBondContact OG1-CZ 3.2Å
458	D	95.4	Very high	93.7	Very high	3 Å²	3	20.4 Å²	20.4	2%	0.016	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	138.7	171.3	-76.6	15.2	0	0	0	109.2	Y57 H58 K59 H430 L433 L450 S451	Y57-D458 HydrophobicContact CE2-CB 3.89Å; Y57-D458 WeakPolarHBondContact CE2-OD2 3.25Å; Y57-D458 VanDerWaalsContact CZ-OD2 3.31Å; Y57-D458 PolarHBondContact OH-OD2 3.1Å; H58-D458 WeakPolarHBondContact O-CA 3.48Å; K59-D458 WeakPolarHBondContact CG-OD1 3.43Å; H430-D458 IonicContact CE1-OD2 3.39Å; H430-D458 PolarHBondContact CE1-OD2 3.22Å; H430-D458 IonicContact NE2-OD2 3.21Å; H430-D458 PolarHBondContact NE2-OD2 3.06Å; L433-D458 HydrophobicContact CD1-CB 4.14Å; L433-D458 HydrophobicContact CD2-CB 4.46Å; L433-D458 WeakPolarHBondContact CD2-OD1 3.39Å; L433-D458 HydrophobicContact CG-CB 4.4Å; L450-D458 CarbonylContact C-O 3.46Å; L450-D458 VanDerWaalsContact CA-O 3.28Å; L450-D458 WeakPolarHBondContact CA-O 3.22Å; S451-D458 PolarHBondContact N-O 3.32Å; S451-D458 PolarHBondContact O-N 2.92Å
459	V	95.5	Very high	93.6	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	121.7	169.9	-174.2	0	0	0	0	108.1	M56 Y57 H58 F60 L117 L120 V448 L450	M56-V459 HydrophobicContact CE-CG1 3.88Å; Y57-V459 CarbonylContact C-O 3.53Å; Y57-V459 WeakPolarHBondContact CA-O 3.39Å; H58-V459 PolarHBondContact N-O 3.01Å; H58-V459 PolarHBondContact O-N 3.32Å; F60-V459 HydrophobicContact CD1-CG2 4.34Å; F60-V459 HydrophobicContact CE1-CG2 3.71Å; L117-V459 HydrophobicContact CD2-CG2 3.81Å; L120-V459 HydrophobicContact CD1-CG1 4.31Å; V448-V459 HydrophobicContact CG1-CG1 4.11Å; L450-V459 HydrophobicContact CD2-CG2 3.88Å; L450-V459 HydrophobicContact CG-CB 4.47Å; L450-V459 HydrophobicContact CG-CG1 4.15Å; L450-V459 HydrophobicContact CG-CG2 4Å
460	A	95.2	Very high	93.3	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	150	-172.3	0	0	0	0	0	113	Y54 M56 Y57 V448 F449	Y54-A460 HydrophobicContact CD1-CB 4.05Å; Y54-A460 HydrophobicContact CE1-CB 4.02Å; M56-A460 CarbonylContact O-C 3.57Å; M56-A460 VanDerWaalsContact O-CA 3.24Å; M56-A460 WeakPolarHBondContact O-CA 3.27Å; Y57-A460 HydrophobicContact CD2-CB 4.05Å; V448-A460 CarbonylContact C-O 3.56Å; V448-A460 WeakPolarHBondContact CA-O 3.11Å; F449-A460 HydrophobicContact CD1-CB 4.19Å; F449-A460 WeakPolarHBondContact CD1-O 3.34Å; F449-A460 HydrophobicContact CE1-CB 3.49Å; F449-A460 VanDerWaalsContact CE1-CB 3.49Å; F449-A460 HydrophobicContact CE2-CB 4.17Å; F449-A460 HydrophobicContact CZ-CB 3.5Å; F449-A460 PolarHBondContact N-O 3.31Å; F449-A460 PolarHBondContact O-N 3.09Å
461	K	94.6	Very high	93	Very high	23 Å²	23	24.5 Å²	24.5	10%	0.1	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	118.2	163.3	172.3	68.5	175.1	179.2	0	106.9	E55 M56 L90 K446 G447 V448 V465	E55-K461 HydrophobicContact CB-CB 4.32Å; E55-K461 HydrophobicContact CB-CG 3.89Å; E55-K461 PolarHBondContact N-O 3.4Å; M56-K461 HydrophobicContact CB-CB 4.18Å; M56-K461 PolarHBondContact N-O 3.19Å; M56-K461 PolarHBondContact O-N 3.13Å; L90-K461 HydrophobicContact CD2-CB 3.87Å; L90-K461 HydrophobicContact CD2-CD 4.46Å; L90-K461 HydrophobicContact CD2-CG 3.68Å; K446-K461 WeakPolarHBondContact O-CE 3.24Å; K446-K461 PolarHBondContact O-NZ 3.05Å; G447-K461 VanDerWaalsContact O-CD 3.28Å; G447-K461 WeakPolarHBondContact O-CD 3.42Å; V448-K461 HydrophobicContact CG2-CB 4.24Å; V448-K461 HydrophobicContact CG2-CD 4.46Å; K461-V465 WeakPolarHBondContact CE-O 3.38Å; K461-V465 PolarHBondContact NZ-O 3.03Å; K461-V465 PolarHBondContact NZ-OXT 3.19Å
462	T	93.3	Very high	92.6	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.006	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	168.2	175.7	78.1	0	0	0	0	110.7	A53 L403 F428 F449 S464 V465	A53-T462 WeakPolarHBondContact O-CA 3.38Å; L403-T462 HydrophobicContact CD1-CG2 3.8Å; F428-T462 HydrophobicContact CD1-CG2 3.8Å; F428-T462 HydrophobicContact CD2-CG2 3.87Å; F428-T462 HydrophobicContact CE1-CG2 3.75Å; F428-T462 HydrophobicContact CE2-CG2 3.79Å; F428-T462 HydrophobicContact CG-CG2 3.87Å; F428-T462 HydrophobicContact CZ-CG2 3.74Å; F449-T462 HydrophobicContact CD1-CG2 4.49Å; F449-T462 HydrophobicContact CE1-CG2 3.66Å; T462-S464 VanDerWaalsContact C-N 3.27Å; T462-S464 PolarHBondContact OG1-N 3.05Å; T462-V465 PolarHBondContact OG1-N 3Å
463	I	89.6	Confident	92.2	Very high	118 Å²	118	28.2 Å²	28.2	61%	0.605	16%	0.156	S	C	*	.	S	Bend	trans	-77.5	-13	168.1	63.3	170.1	0	0	0	113.3	S52 A53	S52-I463 WeakPolarHBondContact O-CG2 3.39Å; A53-I463 PolarHBondContact O-N 2.87Å; A53-I463 VanDerWaalsContact O-N 3.14Å
464	S	84.2	Confident	91.9	Very high	57 Å²	57	30.6 Å²	30.6	40%	0.399	17%	0.169	S	C	.	.			trans	-89.6	-22.8	-171.1	-55.8	0	0	0	0	114.4	T462	T462-S464 VanDerWaalsContact C-N 3.27Å; T462-S464 PolarHBondContact OG1-N 3.05Å
465	V	81.7	Confident	91.7	Very high	32 Å²	32	26.5 Å²	26.5	19%	0.194	15%	0.149	C	C	.	.			trans	-136.3	0	-176.4	-176.1	0	0	0	0	109.6	Y385 V391 L403 L427 W441 K461 T462	Y385-V465 HydrophobicContact CD1-CG1 4.22Å; Y385-V465 HydrophobicContact CE1-CG1 3.82Å; Y385-V465 HydrophobicContact CE2-CG1 4.38Å; V391-V465 HydrophobicContact CG1-CG1 4.19Å; V391-V465 HydrophobicContact CG1-CG2 4.32Å; L403-V465 HydrophobicContact CD1-CG2 3.97Å; L427-V465 HydrophobicContact CD1-CG2 3.98Å; W441-V465 HydrophobicContact CH2-CB 4.27Å; W441-V465 HydrophobicContact CH2-CG1 3.81Å; W441-V465 HydrophobicContact CH2-CG2 4.36Å; W441-V465 HydrophobicContact CZ3-CG1 4Å; K461-V465 WeakPolarHBondContact CE-O 3.38Å; K461-V465 PolarHBondContact NZ-O 3.03Å; K461-V465 PolarHBondContact NZ-OXT 3.19Å; T462-V465 PolarHBondContact OG1-N 3Å

Retrieved 465 of 465 residues in 212.2 ms (Link to these results)

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