A0A077ZBK2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZBK2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 420 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	47.7	Very low	51.4	Low	225 Å²	225	111.5 Å²	111.5	100%	1.108	65%	0.646	S	S	*	*				0	-16.3	0	-70.8	-178.2	-177.2	0	0	114.9
2	K	47	Very low	51.8	Low	194 Å²	194	107.2 Å²	107.2	84%	0.843	63%	0.632	S	S	*	*			trans	-77.6	-18.3	178.8	-74.2	-176.2	174.8	-179.5	0	115.7
3	T	48.6	Very low	52	Low	124 Å²	124	104.7 Å²	104.7	76%	0.761	62%	0.619	S	S	*	*	H	α-helix	trans	-79.3	-25.6	-176.4	39.5	0	0	0	0	114.2
4	A	50	Low	52.4	Low	63 Å²	63	107.9 Å²	107.9	52%	0.521	62%	0.622	S	S	.	*	H	α-helix	trans	-73.3	-30.5	179.8	0	0	0	0	0	113.2
5	A	52.2	Low	52.6	Low	60 Å²	60	102.9 Å²	102.9	50%	0.496	60%	0.603	S	S	.	*	H	α-helix	trans	-70.3	-32.3	-178.7	0	0	0	0	0	112.8
6	V	51.7	Low	53.3	Low	105 Å²	105	102.9 Å²	102.9	64%	0.636	60%	0.599	S	S	*	*	H	α-helix	trans	-73	-35.5	-179.3	-177.1	0	0	0	0	111.3	L8 I9 S10	V6-L8 PolarHBondContact O-N 3.09Å; V6-I9 PolarHBondContact O-N 3.13Å; V6-S10 PolarHBondContact O-N 3.35Å
7	A	52	Low	53.7	Low	56 Å²	56	104 Å²	104	46%	0.463	60%	0.601	S	S	.	*	H	α-helix	trans	-65	-39.4	177.6	0	0	0	0	0	112.2	I9 S10 T11	A7-I9 PolarHBondContact O-N 3.43Å; A7-S10 PolarHBondContact O-N 3.41Å; A7-S10 PolarHBondContact O-OG 2.91Å; A7-T11 PolarHBondContact O-N 3.06Å
8	L	52.3	Low	54.3	Low	127 Å²	127	104.5 Å²	104.5	67%	0.665	60%	0.6	S	S	*	*	H	α-helix	trans	-68.7	-30.1	-179.3	-106.6	134	0	0	0	113.9	V6 T11 A12	V6-L8 PolarHBondContact O-N 3.09Å; L8-T11 PolarHBondContact O-OG1 2.69Å; L8-A12 PolarHBondContact O-N 3.29Å
9	I	54.4	Low	54.6	Low	119 Å²	119	106 Å²	106	61%	0.61	61%	0.605	S	S	*	*	H	α-helix	trans	-74.8	-33.1	176.8	-61.8	169.6	0	0	0	110.6	V6 A7 T13	V6-I9 PolarHBondContact O-N 3.13Å; A7-I9 PolarHBondContact O-N 3.43Å; I9-T13 PolarHBondContact O-N 2.76Å; I9-T13 PolarHBondContact O-OG1 3.34Å
10	S	53.7	Low	54.8	Low	63 Å²	63	106.3 Å²	106.3	44%	0.441	60%	0.604	S	S	.	*	H	α-helix	trans	-70.1	-33.7	178.5	74.6	0	0	0	0	113.4	V6 A7 T13 F14	V6-S10 PolarHBondContact O-N 3.35Å; A7-S10 PolarHBondContact O-N 3.41Å; A7-S10 PolarHBondContact O-OG 2.91Å; S10-T13 PolarHBondContact O-OG1 3.28Å; S10-T13 VanDerWaalsContact O-OG1 3.06Å; S10-F14 PolarHBondContact O-N 3.46Å
11	T	55.9	Low	54.7	Low	91 Å²	91	103.4 Å²	103.4	56%	0.558	60%	0.598	S	S	*	*	H	α-helix	trans	-77.2	-35.6	179.6	52.1	0	0	0	0	112.3	A7 L8 G15	A7-T11 PolarHBondContact O-N 3.06Å; L8-T11 PolarHBondContact O-OG1 2.69Å; T11-G15 PolarHBondContact O-N 3.03Å
12	A	55.9	Low	55.2	Low	59 Å²	59	96.4 Å²	96.4	49%	0.488	57%	0.568	S	S	.	*	H	α-helix	trans	-66.9	-37.5	177.1	0	0	0	0	0	112.7	L8 G15 I16	L8-A12 PolarHBondContact O-N 3.29Å; A12-G15 PolarHBondContact O-N 3.38Å; A12-I16 WeakPolarHBondContact O-CG1 3.47Å; A12-I16 PolarHBondContact O-N 3.47Å
13	T	55.2	Low	55.4	Low	75 Å²	75	89.4 Å²	89.4	46%	0.46	55%	0.551	S	S	.	*	H	α-helix	trans	-69.8	-37.3	178.4	41.2	0	0	0	0	112.4	I9 S10 I16 L17	I9-T13 PolarHBondContact O-N 2.76Å; I9-T13 PolarHBondContact O-OG1 3.34Å; S10-T13 PolarHBondContact O-OG1 3.28Å; S10-T13 VanDerWaalsContact O-OG1 3.06Å; T13-I16 PolarHBondContact O-N 3.46Å; T13-L17 PolarHBondContact O-N 2.97Å
14	F	57.1	Low	55.6	Low	149 Å²	149	89.2 Å²	89.2	65%	0.654	54%	0.544	S	S	*	.	H	α-helix	trans	-64.9	-37.8	173.3	-110.3	-87	0	0	0	112.8	S10 I16 L17 L18	S10-F14 PolarHBondContact O-N 3.46Å; F14-I16 PolarHBondContact O-N 3.35Å; F14-L17 PolarHBondContact O-N 3.5Å; F14-L18 PolarHBondContact O-N 3.19Å
15	G	55.5	Low	55.8	Low	33 Å²	33	93.3 Å²	93.3	34%	0.34	55%	0.55	S	S	.	*	H	α-helix	trans	-63.2	-39.1	177.1	0	0	0	0	0	113.4	T11 A12 L19	T11-G15 PolarHBondContact O-N 3.03Å; A12-G15 PolarHBondContact O-N 3.38Å; G15-L19 WeakPolarHBondContact O-CG 3.2Å; G15-L19 PolarHBondContact O-N 2.93Å; G15-L19 VanDerWaalsContact O-N 3.1Å
16	I	63.6	Low	55.8	Low	104 Å²	104	97.1 Å²	97.1	53%	0.533	56%	0.556	S	S	.	*	H	α-helix	trans	-71.2	-39.3	179.2	-64.2	168.7	0	0	0	111.2	A12 T13 F14 L19 L20	A12-I16 WeakPolarHBondContact O-CG1 3.47Å; A12-I16 PolarHBondContact O-N 3.47Å; T13-I16 PolarHBondContact O-N 3.46Å; F14-I16 PolarHBondContact O-N 3.35Å; I16-L19 PolarHBondContact O-N 3.28Å; I16-L20 HydrophobicContact CG2-CD1 4.05Å; I16-L20 PolarHBondContact O-N 3.06Å
17	L	60.6	Low	55.9	Low	121 Å²	121	96.1 Å²	96.1	63%	0.634	56%	0.559	S	S	*	*	H	α-helix	trans	-64.1	-39.3	175.4	-89.4	154.6	0	0	0	112.3	T13 F14 G21	T13-L17 PolarHBondContact O-N 2.97Å; F14-L17 PolarHBondContact O-N 3.5Å; L17-G21 PolarHBondContact O-N 3.48Å
18	L	63.7	Low	55.7	Low	113 Å²	113	100 Å²	100	59%	0.592	57%	0.571	S	S	*	*	H	α-helix	trans	-65.1	-41.5	174.6	-89.7	154.6	0	0	0	112.2	F14 G21 V22	F14-L18 PolarHBondContact O-N 3.19Å; L18-G21 PolarHBondContact O-N 3.4Å; L18-V22 WeakPolarHBondContact O-CG2 3.45Å; L18-V22 PolarHBondContact O-N 3.27Å
19	L	60.1	Low	55.2	Low	133 Å²	133	98.4 Å²	98.4	70%	0.696	56%	0.562	S	S	*	*	H	α-helix	trans	-67.4	-38.4	178	-76.7	164.4	0	0	0	112.6	G15 I16 G23	G15-L19 WeakPolarHBondContact O-CG 3.2Å; G15-L19 PolarHBondContact O-N 2.93Å; G15-L19 VanDerWaalsContact O-N 3.1Å; I16-L19 PolarHBondContact O-N 3.28Å; L19-G23 PolarHBondContact O-N 3.09Å
20	L	59.1	Low	54.6	Low	112 Å²	112	98.2 Å²	98.2	59%	0.586	57%	0.569	S	S	*	*	H	α-helix	trans	-67.3	-38.5	174.5	-77	165.6	0	0	0	112	I16 G23 L24	I16-L20 HydrophobicContact CG2-CD1 4.05Å; I16-L20 PolarHBondContact O-N 3.06Å; L20-G23 PolarHBondContact O-N 3.49Å; L20-L24 PolarHBondContact O-N 3.48Å; L20-L24 VanDerWaalsContact O-N 3.15Å
21	G	53.4	Low	54.1	Low	46 Å²	46	106.1 Å²	106.1	47%	0.474	59%	0.589	S	S	.	*	H	α-helix	trans	-65	-41.5	176.6	0	0	0	0	0	113.2	L17 L18 F25	L17-G21 PolarHBondContact O-N 3.48Å; L18-G21 PolarHBondContact O-N 3.4Å; G21-F25 PolarHBondContact O-N 3.49Å
22	V	57.1	Low	53.4	Low	78 Å²	78	107.9 Å²	107.9	47%	0.473	60%	0.602	S	S	.	*	H	α-helix	trans	-72	-37.4	178.2	177.4	0	0	0	0	111.3	L18 L24 F25 F26	L18-V22 WeakPolarHBondContact O-CG2 3.45Å; L18-V22 PolarHBondContact O-N 3.27Å; V22-L24 VanDerWaalsContact C-N 3.35Å; V22-L24 PolarHBondContact O-N 2.8Å; V22-F25 PolarHBondContact O-N 3.41Å; V22-F26 HydrophobicContact CG1-CD2 3.99Å; V22-F26 HydrophobicContact CG1-CE2 3.67Å; V22-F26 WeakPolarHBondContact O-CD2 3.46Å; V22-F26 PolarHBondContact O-N 2.67Å
23	G	50.9	Low	52.6	Low	47 Å²	47	114.1 Å²	114.1	49%	0.485	62%	0.621	S	S	.	*	H	α-helix	trans	-61.3	-40	175.7	0	0	0	0	0	113.3	L19 L20 F25 A27	L19-G23 PolarHBondContact O-N 3.09Å; L20-G23 PolarHBondContact O-N 3.49Å; G23-F25 VanDerWaalsContact C-N 3.32Å; G23-F25 PolarHBondContact O-N 2.75Å; G23-A27 PolarHBondContact O-N 2.8Å
24	L	52.9	Low	51.7	Low	119 Å²	119	120.2 Å²	120.2	62%	0.623	64%	0.641	S	S	*	*	H	α-helix	trans	-67.9	-32.2	175.7	-115.6	100.4	0	0	0	112.5	L20 V22 F26 A27	L20-L24 PolarHBondContact O-N 3.48Å; L20-L24 VanDerWaalsContact O-N 3.15Å; V22-L24 VanDerWaalsContact C-N 3.35Å; V22-L24 PolarHBondContact O-N 2.8Å; L24-F26 PolarHBondContact O-N 2.7Å; L24-A27 PolarHBondContact O-N 2.79Å
25	F	55.5	Low	50.6	Low	149 Å²	149	122.2 Å²	122.2	65%	0.654	65%	0.65	S	S	*	*	H	α-helix	trans	-67.2	-36.9	-179.6	-157	-94.6	0	0	0	112.2	G21 V22 G23 L28	G21-F25 PolarHBondContact O-N 3.49Å; V22-F25 PolarHBondContact O-N 3.41Å; G23-F25 VanDerWaalsContact C-N 3.32Å; G23-F25 PolarHBondContact O-N 2.75Å; F25-L28 PolarHBondContact O-N 2.96Å
26	F	51.2	Low	49.7	Very low	140 Å²	140	126.8 Å²	126.8	61%	0.614	67%	0.673	S	S	*	*	H	α-helix	trans	-76.2	-21.8	176.4	-74.7	-73.2	0	0	0	114	V22 L24 L28 I29	V22-F26 HydrophobicContact CG1-CD2 3.99Å; V22-F26 HydrophobicContact CG1-CE2 3.67Å; V22-F26 WeakPolarHBondContact O-CD2 3.46Å; V22-F26 PolarHBondContact O-N 2.67Å; L24-F26 PolarHBondContact O-N 2.7Å; F26-L28 PolarHBondContact O-N 2.94Å; F26-I29 HydrophobicContact CD1-CD1 3.87Å; F26-I29 HydrophobicContact CE1-CD1 4.25Å
27	A	54.1	Low	48.2	Very low	85 Å²	85	130.2 Å²	130.2	70%	0.702	69%	0.687	S	S	*	*	H	α-helix	trans	-72.6	-19.6	173.7	0	0	0	0	0	112.9	G23 L24	G23-A27 PolarHBondContact O-N 2.8Å; L24-A27 PolarHBondContact O-N 2.79Å
28	L	47.2	Very low	47.2	Very low	136 Å²	136	131.2 Å²	131.2	71%	0.712	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-0.9	-177.4	-72.6	165.8	0	0	0	114.1	F25 F26 P30	F25-L28 PolarHBondContact O-N 2.96Å; F26-L28 PolarHBondContact O-N 2.94Å; L28-P30 VanDerWaalsContact O-CD 3.27Å; L28-P30 WeakPolarHBondContact O-CD 3.4Å
29	I	42.8	Very low	46.2	Very low	94 Å²	94	130.7 Å²	130.7	48%	0.482	70%	0.702	S	S	.	*	S	Bend	trans	-81.6	113.6	175.1	-56.4	178.9	0	0	0	108.1	F26 R31	F26-I29 HydrophobicContact CD1-CD1 3.87Å; F26-I29 HydrophobicContact CE1-CD1 4.25Å; I29-R31 PolarHBondContact O-N 2.8Å
30	P	40.8	Very low	45	Very low	115 Å²	115	132 Å²	132	75%	0.747	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-61.7	122.9	-178.4	19.1	-24	0	0	0	109.7	L28	L28-P30 VanDerWaalsContact O-CD 3.27Å; L28-P30 WeakPolarHBondContact O-CD 3.4Å
31	R	44.6	Very low	43.7	Very low	229 Å²	229	134.5 Å²	134.5	86%	0.864	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-64.9	131.8	176.2	-70.2	-177.7	-179.8	-178	0.4	108.4	I29 E33	I29-R31 PolarHBondContact O-N 2.8Å; R31-E33 PolarHBondContact O-N 3.45Å; R31-E33 VanDerWaalsContact O-N 3.09Å
32	P	39.7	Very low	42.6	Very low	129 Å²	129	140.9 Å²	140.9	84%	0.838	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-61.1	117	176.4	22.9	-30.5	0	0	0	109.2	K34	P32-K34 PolarHBondContact O-N 2.91Å
33	E	40.3	Very low	41.3	Very low	190 Å²	190	144 Å²	144	89%	0.888	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-56	130.4	174.3	-80.2	179.3	147.4	0	0	109.7	R31 K35	R31-E33 PolarHBondContact O-N 3.45Å; R31-E33 VanDerWaalsContact O-N 3.09Å; E33-K35 PolarHBondContact O-N 3.37Å
34	K	35.7	Very low	40.4	Very low	202 Å²	202	146.4 Å²	146.4	88%	0.878	76%	0.762	S	S	*	*			trans	-59	111.6	171.5	-101.2	-178.5	171.9	-177.3	0	107.9	P32 P36	P32-K34 PolarHBondContact O-N 2.91Å; K34-P36 WeakPolarHBondContact O-CD 3.21Å
35	K	33.2	Very low	39.1	Very low	191 Å²	191	146.3 Å²	146.3	83%	0.83	77%	0.767	S	S	*	*			trans	-53.3	120.6	166.4	-104	-178.3	175.1	-177.7	0	108.6	E33 E37	E33-K35 PolarHBondContact O-N 3.37Å; K35-E37 PolarHBondContact O-N 3.43Å; K35-E37 VanDerWaalsContact O-N 3.15Å
36	P	36.5	Very low	37.9	Very low	129 Å²	129	146.3 Å²	146.3	84%	0.838	77%	0.774	S	S	*	*			trans	-69.9	109.9	170.4	25.5	-28.1	0	0	0	108.7	K34	K34-P36 WeakPolarHBondContact O-CD 3.21Å
37	E	32.8	Very low	36.9	Very low	177 Å²	177	148.4 Å²	148.4	83%	0.827	79%	0.785	S	S	*	*			trans	-75.2	113.3	159.6	-72.4	179.1	159	0	0	107.7	K35	K35-E37 PolarHBondContact O-N 3.43Å; K35-E37 VanDerWaalsContact O-N 3.15Å
38	T	39.2	Very low	36.1	Very low	142 Å²	142	149.6 Å²	149.6	87%	0.871	79%	0.786	S	S	*	*			trans	171.7	156.6	131.3	24.1	0	0	0	0	112
39	P	44.2	Very low	35.2	Very low	101 Å²	101	149.8 Å²	149.8	66%	0.656	79%	0.793	S	S	*	*			trans	-101.4	157.9	-142.2	38.9	-36.7	0	0	0	115.3	Q41	P39-Q41 PolarHBondContact O-N 3.1Å
40	D	33.4	Very low	34.5	Very low	160 Å²	160	149.8 Å²	149.8	86%	0.856	80%	0.801	S	S	*	*			trans	17.3	83.6	147.3	-63.4	-21.5	0	0	0	115.8
41	Q	32.1	Very low	33.9	Very low	166 Å²	166	153.4 Å²	153.4	78%	0.776	81%	0.808	S	S	*	*			trans	-114.2	103.9	152.8	-75.9	-169	-14.3	0	0	108.6	P39 I43	P39-Q41 PolarHBondContact O-N 3.1Å; Q41-I43 VanDerWaalsContact C-N 3.33Å; Q41-I43 HydrophobicContact CB-CG1 4.37Å; Q41-I43 PolarHBondContact O-N 3.14Å
42	L	29.4	Very low	33.3	Very low	180 Å²	180	150.2 Å²	150.2	94%	0.942	80%	0.803	S	S	*	*			trans	-57.9	99.2	158.5	-89.7	100.1	0	0	0	107.9
43	I	30.8	Very low	32.9	Very low	143 Å²	143	150.2 Å²	150.2	73%	0.733	80%	0.8	S	S	*	*			trans	-95.8	95.5	165.3	-59.6	176.9	0	0	0	106.6	Q41	Q41-I43 VanDerWaalsContact C-N 3.33Å; Q41-I43 HydrophobicContact CB-CG1 4.37Å; Q41-I43 PolarHBondContact O-N 3.14Å
44	S	31	Very low	32.5	Very low	97 Å²	97	148.4 Å²	148.4	68%	0.678	80%	0.795	S	S	*	*			trans	-67	130.1	154.5	177.6	0	0	0	0	108.1
45	T	27.2	Very low	32.4	Very low	118 Å²	118	143.7 Å²	143.7	72%	0.724	78%	0.784	S	S	*	*				168.5	139.4	120.1	29.8	0	0	0	0	110.9	H47	T45-H47 PolarHBondContact O-N 3.47Å
46	D	30.5	Very low	32.6	Very low	148 Å²	148	137.7 Å²	137.7	79%	0.791	77%	0.766	S	S	*	*			trans	-38.4	126.1	168.8	-56.9	-65.8	0	0	0	112.9
47	H	29.2	Very low	32.9	Very low	184 Å²	184	135.6 Å²	135.6	85%	0.852	76%	0.76	S	S	*	*			trans	-149.5	149.4	154.2	-102.1	8.7	0	0	0	112	T45	T45-H47 PolarHBondContact O-N 3.47Å
48	P	37.4	Very low	33	Very low	110 Å²	110	131.8 Å²	131.8	71%	0.714	74%	0.74	S	S	*	*			trans	-77.4	142.3	-150.2	30.5	-33.3	0	0	0	111.1	S50	P48-S50 VanDerWaalsContact C-N 3.32Å; P48-S50 PolarHBondContact O-N 2.81Å
49	T	28.2	Very low	33	Very low	141 Å²	141	127.4 Å²	127.4	87%	0.865	72%	0.715	S	S	*	*			trans	-58.1	93.3	176	-26	0	0	0	0	108.6	E51	T49-E51 PolarHBondContact O-N 2.92Å
50	S	28.1	Very low	32.9	Very low	93 Å²	93	127.3 Å²	127.3	65%	0.65	71%	0.709	S	S	*	*			trans	-57	123.9	156.9	48.7	0	0	0	0	106.2	P48 E52	P48-S50 VanDerWaalsContact C-N 3.32Å; P48-S50 PolarHBondContact O-N 2.81Å; S50-E52 PolarHBondContact O-N 3.3Å
51	E	28.9	Very low	33.3	Very low	192 Å²	192	121.2 Å²	121.2	90%	0.897	68%	0.676	S	S	*	*			trans	-60.5	71.7	172.5	-66.8	174	148.8	0	0	109.5	T49 T53	T49-E51 PolarHBondContact O-N 2.92Å; E51-T53 VanDerWaalsContact C-N 3.34Å; E51-T53 PolarHBondContact O-N 3.02Å; E51-T53 VanDerWaalsContact O-N 3.09Å
52	E	31.3	Very low	33.8	Very low	162 Å²	162	115.9 Å²	115.9	76%	0.757	66%	0.655	S	S	*	*			trans	-62.6	110.4	150.6	-80.9	-169.9	160.3	0	0	104.6	S50 I54	S50-E52 PolarHBondContact O-N 3.3Å; E52-I54 WeakPolarHBondContact O-CG1 2.86Å; E52-I54 PolarHBondContact O-N 3.45Å
53	T	31.1	Very low	34.6	Very low	128 Å²	128	112.4 Å²	112.4	79%	0.785	63%	0.634	S	S	*	*			trans	-47.5	91.3	170.8	-27.8	0	0	0	0	107.7	E51 T55	E51-T53 VanDerWaalsContact C-N 3.34Å; E51-T53 PolarHBondContact O-N 3.02Å; E51-T53 VanDerWaalsContact O-N 3.09Å; T53-T55 PolarHBondContact O-N 3.35Å; T53-T55 PolarHBondContact O-OG1 3.44Å
54	I	32.9	Very low	35.3	Very low	152 Å²	152	109.1 Å²	109.1	78%	0.779	62%	0.615	S	S	*	*			trans	-66.8	90.3	170.9	-61.4	172.6	0	0	0	103	E52 S56	E52-I54 WeakPolarHBondContact O-CG1 2.86Å; E52-I54 PolarHBondContact O-N 3.45Å; I54-S56 PolarHBondContact O-N 2.86Å
55	T	33.6	Very low	35.9	Very low	104 Å²	104	106 Å²	106	64%	0.638	59%	0.59	S	S	*	*			trans	-58.3	87.1	160	2.2	0	0	0	0	104.9	T53 A57	T53-T55 PolarHBondContact O-N 3.35Å; T53-T55 PolarHBondContact O-OG1 3.44Å; T55-A57 PolarHBondContact O-N 2.91Å
56	S	37.8	Very low	36.8	Very low	65 Å²	65	105.6 Å²	105.6	46%	0.455	58%	0.58	S	S	.	*			trans	-47.1	137.8	179.7	170.8	0	0	0	0	107.7	I54 K58 S59	I54-S56 PolarHBondContact O-N 2.86Å; S56-K58 PolarHBondContact O-N 2.83Å; S56-K58 PolarHBondContact OG-N 3.1Å; S56-S59 PolarHBondContact O-N 3.03Å; S56-S59 PolarHBondContact O-OG 2.92Å
57	A	42.9	Very low	37.6	Very low	85 Å²	85	106.1 Å²	106.1	70%	0.702	58%	0.575	S	S	*	*	H	α-helix	trans	-46.1	-24.3	175.5	0	0	0	0	0	112.9	T55 S59 L60 L61	T55-A57 PolarHBondContact O-N 2.91Å; A57-S59 PolarHBondContact O-N 3.02Å; A57-L60 PolarHBondContact O-N 3.39Å; A57-L61 VanDerWaalsContact O-CB 3.3Å; A57-L61 WeakPolarHBondContact O-CB 3.49Å; A57-L61 PolarHBondContact O-N 3.26Å
58	K	33.5	Very low	38.1	Very low	97 Å²	97	99 Å²	99	42%	0.422	55%	0.549	S	S	.	.	H	α-helix	trans	-60.3	-35.6	172.4	-151.6	175.6	-175	-178	0	114.4	S56 V62	S56-K58 PolarHBondContact O-N 2.83Å; S56-K58 PolarHBondContact OG-N 3.1Å; K58-V62 WeakPolarHBondContact O-CG2 3.13Å; K58-V62 PolarHBondContact O-N 2.85Å
59	S	40.6	Very low	37.7	Very low	50 Å²	50	97 Å²	97	35%	0.35	55%	0.547	S	S	.	.	H	α-helix	trans	-71.6	-43.2	178.1	63.6	0	0	0	0	112.3	S56 A57 L61 V62 E63	S56-S59 PolarHBondContact O-N 3.03Å; S56-S59 PolarHBondContact O-OG 2.92Å; A57-S59 PolarHBondContact O-N 3.02Å; S59-L61 VanDerWaalsContact C-N 3.31Å; S59-L61 PolarHBondContact O-N 3.4Å; S59-V62 PolarHBondContact O-N 3.48Å; S59-E63 PolarHBondContact O-N 2.9Å; S59-E63 VanDerWaalsContact O-N 3.09Å
60	L	41.8	Very low	38	Very low	98 Å²	98	91.3 Å²	91.3	51%	0.513	51%	0.511	S	S	.	.	H	α-helix	trans	-63.5	-40.8	174.6	-127.3	102	0	0	0	110.9	A57 E63 Q64	A57-L60 PolarHBondContact O-N 3.39Å; L60-E63 PolarHBondContact O-N 3.28Å; L60-Q64 PolarHBondContact O-N 2.81Å
61	L	40.8	Very low	38.1	Very low	33 Å²	33	95.7 Å²	95.7	17%	0.173	52%	0.521	C	S	.	.	H	α-helix	trans	-58.6	-49.9	175.7	-172.5	73.7	0	0	0	111.8	A57 S59 E63 Q64 M65 L218	A57-L61 VanDerWaalsContact O-CB 3.3Å; A57-L61 WeakPolarHBondContact O-CB 3.49Å; A57-L61 PolarHBondContact O-N 3.26Å; S59-L61 VanDerWaalsContact C-N 3.31Å; S59-L61 PolarHBondContact O-N 3.4Å; L61-E63 VanDerWaalsContact C-N 3.29Å; L61-E63 PolarHBondContact O-N 2.81Å; L61-Q64 PolarHBondContact O-N 2.82Å; L61-M65 HydrophobicContact CD1-CE 3.9Å; L61-M65 HydrophobicContact CD1-SD 4.23Å; L61-M65 HydrophobicContact CD2-CE 4.34Å; L61-M65 HydrophobicContact CD2-SD 4.3Å; L61-M65 HydrophobicContact CG-CE 4.02Å; L61-M65 HydrophobicContact CG-CG 4.49Å; L61-M65 HydrophobicContact CG-SD 3.78Å; L61-M65 WeakPolarHBondContact O-CB 3.11Å; L61-M65 WeakPolarHBondContact O-CG 3.21Å; L61-M65 PolarHBondContact O-N 3.25Å; L61-L218 HydrophobicContact CD1-CD1 4.39Å; L61-L218 HydrophobicContact CD1-CD2 3.38Å; L61-L218 HydrophobicContact CD1-CG 4.34Å
62	V	43.3	Very low	38.5	Very low	54 Å²	54	89.4 Å²	89.4	33%	0.327	49%	0.489	S	S	.	.	H	α-helix	trans	-60.3	-40.4	177.6	171.3	0	0	0	0	111	K58 S59 M65 H66 F74	K58-V62 WeakPolarHBondContact O-CG2 3.13Å; K58-V62 PolarHBondContact O-N 2.85Å; S59-V62 PolarHBondContact O-N 3.48Å; V62-M65 PolarHBondContact O-N 3.05Å; V62-H66 WeakPolarHBondContact O-CB 3.27Å; V62-H66 PolarHBondContact O-N 2.92Å; V62-F74 HydrophobicContact CG2-CD2 4.12Å; V62-F74 HydrophobicContact CG2-CE2 3.64Å; V62-F74 HydrophobicContact CG2-CZ 4.48Å
63	E	45.6	Very low	38.4	Very low	107 Å²	107	89.3 Å²	89.3	50%	0.5	49%	0.493	S	S	.	.	H	α-helix	trans	-70.6	-43.1	-178.4	-158.2	-165.6	139.9	0	0	112.7	S59 L60 L61 M65 H66 K67	S59-E63 PolarHBondContact O-N 2.9Å; S59-E63 VanDerWaalsContact O-N 3.09Å; L60-E63 PolarHBondContact O-N 3.28Å; L61-E63 VanDerWaalsContact C-N 3.29Å; L61-E63 PolarHBondContact O-N 2.81Å; E63-M65 VanDerWaalsContact C-N 3.34Å; E63-H66 PolarHBondContact O-N 3.02Å; E63-K67 WeakPolarHBondContact O-CG 3.17Å; E63-K67 PolarHBondContact O-N 3.01Å; E63-K67 IonicContact OE1-NZ 2.79Å; E63-K67 PolarHBondContact OE1-NZ 2.76Å
64	Q	46.4	Very low	38.4	Very low	74 Å²	74	87.8 Å²	87.8	35%	0.346	48%	0.476	S	S	.	.	H	α-helix	trans	-65.7	-37.4	173.7	-74.9	172	-59.7	0	0	111.5	L60 L61 K67 A68 E211	L60-Q64 PolarHBondContact O-N 2.81Å; L61-Q64 PolarHBondContact O-N 2.82Å; Q64-K67 WeakPolarHBondContact O-CB 3.1Å; Q64-K67 PolarHBondContact O-N 3.25Å; Q64-A68 PolarHBondContact O-N 3.46Å; Q64-E211 PolarHBondContact NE2-OE1 3Å; Q64-E211 PolarHBondContact OE1-OE1 3.1Å
65	M	42.3	Very low	38.1	Very low	30 Å²	30	83.8 Å²	83.8	15%	0.148	47%	0.472	C	S	.	.	H	α-helix	trans	-68.7	-38.1	177.2	-75	178.6	157.8	0	0	113	L61 V62 E63 K67 A68 G69 F70 L218	L61-M65 HydrophobicContact CD1-CE 3.9Å; L61-M65 HydrophobicContact CD1-SD 4.23Å; L61-M65 HydrophobicContact CD2-CE 4.34Å; L61-M65 HydrophobicContact CD2-SD 4.3Å; L61-M65 HydrophobicContact CG-CE 4.02Å; L61-M65 HydrophobicContact CG-CG 4.49Å; L61-M65 HydrophobicContact CG-SD 3.78Å; L61-M65 WeakPolarHBondContact O-CB 3.11Å; L61-M65 WeakPolarHBondContact O-CG 3.21Å; L61-M65 PolarHBondContact O-N 3.25Å; V62-M65 PolarHBondContact O-N 3.05Å; E63-M65 VanDerWaalsContact C-N 3.34Å; M65-K67 VanDerWaalsContact C-N 3.35Å; M65-A68 CarbonylContact O-C 3.58Å; M65-A68 PolarHBondContact O-N 2.88Å; M65-G69 PolarHBondContact O-N 2.91Å; M65-F70 PolarHBondContact O-N 2.53Å; M65-L218 HydrophobicContact CE-CD1 4.19Å
66	H	47.9	Very low	37.9	Very low	111 Å²	111	85 Å²	85	51%	0.514	48%	0.479	S	S	.	.	H	α-helix	trans	-64.7	-38.6	170.6	-100.6	-74.8	0	0	0	111.8	V62 E63 A68 G69	V62-H66 WeakPolarHBondContact O-CB 3.27Å; V62-H66 PolarHBondContact O-N 2.92Å; E63-H66 PolarHBondContact O-N 3.02Å; H66-A68 PolarHBondContact O-N 3.24Å; H66-G69 PolarHBondContact O-N 3.16Å
67	K	45.7	Very low	37.4	Very low	158 Å²	158	87.2 Å²	87.2	69%	0.687	49%	0.493	S	S	*	.	H	α-helix	trans	-62.7	-29.6	173	-76.7	172.5	-173.6	157.5	0	112.4	E63 Q64 M65 G69	E63-K67 WeakPolarHBondContact O-CG 3.17Å; E63-K67 PolarHBondContact O-N 3.01Å; E63-K67 IonicContact OE1-NZ 2.79Å; E63-K67 PolarHBondContact OE1-NZ 2.76Å; Q64-K67 WeakPolarHBondContact O-CB 3.1Å; Q64-K67 PolarHBondContact O-N 3.25Å; M65-K67 VanDerWaalsContact C-N 3.35Å; K67-G69 PolarHBondContact O-N 3.17Å
68	A	40.5	Very low	36.9	Very low	36 Å²	36	91.7 Å²	91.7	30%	0.298	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	1.8	172.7	0	0	0	0	0	114	Q64 M65 H66 F70	Q64-A68 PolarHBondContact O-N 3.46Å; M65-A68 CarbonylContact O-C 3.58Å; M65-A68 PolarHBondContact O-N 2.88Å; H66-A68 PolarHBondContact O-N 3.24Å; A68-F70 HydrophobicContact CB-CD2 3.83Å; A68-F70 HydrophobicContact CB-CE2 3.91Å
69	G	29.5	Very low	36.7	Very low	66 Å²	66	93.5 Å²	93.5	68%	0.68	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	18.7	172	0	0	0	0	0	115.5	M65 H66 K67	M65-G69 PolarHBondContact O-N 2.91Å; H66-G69 PolarHBondContact O-N 3.16Å; K67-G69 PolarHBondContact O-N 3.17Å
70	F	33.7	Very low	36.1	Very low	23 Å²	23	97.5 Å²	97.5	10%	0.101	54%	0.54	C	S	.	.			trans	-103.2	132.7	179.6	-58.5	-77.6	0	0	0	112.5	M65 A68 W72 N194	M65-F70 PolarHBondContact O-N 2.53Å; A68-F70 HydrophobicContact CB-CD2 3.83Å; A68-F70 HydrophobicContact CB-CE2 3.91Å; F70-W72 VanDerWaalsContact CB-NE1 3.32Å; F70-W72 AromaticContact CG-NE1 3.97Å; F70-N194 HydrophobicContact CE2-CB 3.65Å; F70-N194 HydrophobicContact CZ-CB 3.67Å; F70-N194 WeakPolarHBondContact CZ-ND2 3.46Å
71	E	30.1	Very low	35.4	Very low	184 Å²	184	97.5 Å²	97.5	86%	0.86	55%	0.549	S	S	*	.			trans	-94	117.5	169.4	-71.2	-173.8	163	0	0	110.1
72	W	37.2	Very low	34.9	Very low	61 Å²	61	101.3 Å²	101.3	23%	0.231	58%	0.575	C	S	.	*			trans	-124.6	133.6	-178.2	-76.2	91.4	0	0	0	112.1	F70 F74 T254	F70-W72 VanDerWaalsContact CB-NE1 3.32Å; F70-W72 AromaticContact CG-NE1 3.97Å; W72-F74 HydrophobicContact CB-CE2 4.21Å; W72-T254 HydrophobicContact CH2-CG2 3.27Å; W72-T254 HydrophobicContact CZ2-CG2 3.27Å; W72-T254 HydrophobicContact CZ3-CG2 4.17Å
73	N	29.4	Very low	34.4	Very low	159 Å²	159	104.4 Å²	104.4	85%	0.85	60%	0.597	S	S	*	*			trans	-102.9	106.6	166.1	-87.8	-28.4	0	0	0	109.6	G75	N73-G75 PolarHBondContact O-N 3.02Å
74	F	30.6	Very low	33.8	Very low	97 Å²	97	106.9 Å²	106.9	43%	0.425	61%	0.612	S	S	.	*			trans	-76.4	111.3	167.3	-69.2	-85.1	0	0	0	108.5	V62 W72 T76	V62-F74 HydrophobicContact CG2-CD2 4.12Å; V62-F74 HydrophobicContact CG2-CE2 3.64Å; V62-F74 HydrophobicContact CG2-CZ 4.48Å; W72-F74 HydrophobicContact CB-CE2 4.21Å; F74-T76 PolarHBondContact O-N 3.44Å
75	G	27.6	Very low	32.9	Very low	67 Å²	67	115.3 Å²	115.3	69%	0.691	64%	0.641	S	S	*	*			trans	-54.5	134.8	168.9	0	0	0	0	0	110.3	N73	N73-G75 PolarHBondContact O-N 3.02Å
76	T	28.3	Very low	32.4	Very low	129 Å²	129	119.6 Å²	119.6	79%	0.791	67%	0.669	S	S	*	*			trans	-57.9	133.7	176.9	36.1	0	0	0	0	110.4	F74 E78	F74-T76 PolarHBondContact O-N 3.44Å; T76-E78 PolarHBondContact O-N 2.89Å; T76-E78 VanDerWaalsContact O-N 3.13Å
77	P	28.6	Very low	31.5	Very low	113 Å²	113	121.4 Å²	121.4	73%	0.734	68%	0.682	S	S	*	*			trans	-69.2	111	-175.1	26.3	-31	0	0	0	110.5	T79	P77-T79 PolarHBondContact O-N 3.23Å
78	E	31	Very low	30.9	Very low	178 Å²	178	119.3 Å²	119.3	83%	0.832	69%	0.685	S	S	*	*			trans	-64.7	128.3	165.5	-73	-174.2	165.8	0	0	109.1	T76 V80	T76-E78 PolarHBondContact O-N 2.89Å; T76-E78 VanDerWaalsContact O-N 3.13Å; E78-V80 PolarHBondContact O-N 2.93Å
79	T	29.2	Very low	30.4	Very low	136 Å²	136	123.6 Å²	123.6	83%	0.834	71%	0.707	S	S	*	*			trans	-68.6	95.8	-179.4	-25.5	0	0	0	0	108.5	P77 S81	P77-T79 PolarHBondContact O-N 3.23Å; T79-S81 PolarHBondContact O-N 2.84Å
80	V	28.2	Very low	30.5	Very low	133 Å²	133	127.6 Å²	127.6	81%	0.806	71%	0.712	S	S	*	*			trans	-66.3	100.4	177.1	-175.9	0	0	0	0	108.5	E78	E78-V80 PolarHBondContact O-N 2.93Å
81	S	28.4	Very low	30.2	Very low	99 Å²	99	131.5 Å²	131.5	69%	0.692	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-66.5	136.3	169.2	-63.9	0	0	0	0	109.3	T79	T79-S81 PolarHBondContact O-N 2.84Å
82	P	29.3	Very low	30.2	Very low	113 Å²	113	128.7 Å²	128.7	73%	0.734	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-66.1	139.8	-171.4	25.6	-32.4	0	0	0	111.1	L84	P82-L84 PolarHBondContact O-N 2.97Å
83	P	33	Very low	30	Very low	119 Å²	119	136.7 Å²	136.7	77%	0.773	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-70	125.5	-170.4	26.8	-32.3	0	0	0	111	R85	P83-R85 PolarHBondContact O-N 2.95Å; P83-R85 VanDerWaalsContact O-N 3.11Å
84	L	32.4	Very low	29.9	Very low	158 Å²	158	134.5 Å²	134.5	83%	0.827	76%	0.761	S	S	*	*			trans	-56.8	115.3	168.3	-100.8	93	0	0	0	109.2	P82 T86	P82-L84 PolarHBondContact O-N 2.97Å; L84-T86 PolarHBondContact O-N 3.16Å
85	R	28.5	Very low	29.8	Very low	252 Å²	252	140 Å²	140	95%	0.951	79%	0.786	S	S	*	*			trans	-53.7	103.1	168.4	-82.7	-179.8	170.5	-178.8	-2.7	109.4	P83	P83-R85 PolarHBondContact O-N 2.95Å; P83-R85 VanDerWaalsContact O-N 3.11Å
86	T	32.2	Very low	29.8	Very low	119 Å²	119	145.7 Å²	145.7	73%	0.73	79%	0.791	S	S	*	*			trans	-114.8	121.9	162.4	44.9	0	0	0	0	107.7	L84	L84-T86 PolarHBondContact O-N 3.16Å
87	N	28.4	Very low	29.9	Very low	149 Å²	149	144.7 Å²	144.7	80%	0.797	79%	0.787	S	S	*	*			trans	-57.4	130.3	-176.4	-83.3	-28.7	0	0	0	110.2	T89	N87-T89 PolarHBondContact O-N 2.93Å
88	P	32.5	Very low	30	Very low	114 Å²	114	147.1 Å²	147.1	74%	0.74	79%	0.793	S	S	*	*			trans	-75.2	95.4	-175.4	30.6	-32	0	0	0	108.9	I90	P88-I90 PolarHBondContact O-N 2.77Å
89	T	31.2	Very low	29.8	Very low	126 Å²	126	145 Å²	145	77%	0.773	79%	0.786	S	S	*	*			trans	-82.7	92.3	163.3	-43.7	0	0	0	0	105.9	N87 P91	N87-T89 PolarHBondContact O-N 2.93Å; T89-P91 WeakPolarHBondContact O-CD 3.3Å; T89-P91 VanDerWaalsContact O-N 3.15Å
90	I	30.7	Very low	29.8	Very low	150 Å²	150	143 Å²	143	77%	0.769	78%	0.778	S	S	*	*			trans	-62.8	109.5	179.8	-61.4	170.6	0	0	0	107.9	P88	P88-I90 PolarHBondContact O-N 2.77Å
91	P	27.4	Very low	30.2	Very low	105 Å²	105	143.6 Å²	143.6	68%	0.682	78%	0.777	S	S	*	*			trans	-78.6	136.1	175	1.2	17.5	0	0	0	108.4	T89 R93	T89-P91 WeakPolarHBondContact O-CD 3.3Å; T89-P91 VanDerWaalsContact O-N 3.15Å; P91-R93 PolarHBondContact O-N 3.11Å
92	P	29.8	Very low	30.2	Very low	125 Å²	125	144.9 Å²	144.9	81%	0.812	78%	0.78	S	S	*	*			trans	-66.5	109.2	176.5	26.9	-31	0	0	0	108.8	P94	P92-P94 WeakPolarHBondContact O-CD 3.46Å
93	R	32.5	Very low	30.2	Very low	229 Å²	229	148.3 Å²	148.3	86%	0.864	79%	0.786	S	S	*	*			trans	-77.9	120	179.2	-160.5	-175.8	-77.8	-151.2	-0.1	108.4	P91 F95	P91-R93 PolarHBondContact O-N 3.11Å; R93-F95 PolarHBondContact O-N 2.92Å
94	P	29	Very low	30.1	Very low	113 Å²	113	148.2 Å²	148.2	73%	0.734	79%	0.786	S	S	*	*			trans	-72.5	125.4	177.7	28.4	-31.3	0	0	0	109.3	P92 K96	P92-P94 WeakPolarHBondContact O-CD 3.46Å; P94-K96 PolarHBondContact O-N 2.85Å
95	F	28.3	Very low	29.9	Very low	212 Å²	212	145.8 Å²	145.8	93%	0.93	78%	0.782	S	S	*	*			trans	-60.2	104	168	-88.1	-94.8	0	0	0	108.5	R93	R93-F95 PolarHBondContact O-N 2.92Å
96	K	27.2	Very low	30.1	Very low	187 Å²	187	141.7 Å²	141.7	81%	0.813	77%	0.774	S	S	*	*			trans	-114.1	110.4	162.4	-141.9	178.1	-174	-175.6	0	106.7	P94 L98	P94-K96 PolarHBondContact O-N 2.85Å; K96-L98 PolarHBondContact O-N 3.01Å; K96-L98 VanDerWaalsContact O-N 3.13Å
97	P	29.7	Very low	30.1	Very low	109 Å²	109	141.6 Å²	141.6	71%	0.708	78%	0.775	S	S	*	*			trans	-68	114.7	179.3	27	-28.7	0	0	0	107.3	I99	P97-I99 PolarHBondContact O-N 2.74Å
98	L	30.8	Very low	30.3	Very low	164 Å²	164	142.1 Å²	142.1	86%	0.859	78%	0.776	S	S	*	*			trans	-69.5	92.2	165.5	-90.7	123.9	0	0	0	107.1	K96 S100	K96-L98 PolarHBondContact O-N 3.01Å; K96-L98 VanDerWaalsContact O-N 3.13Å; L98-S100 VanDerWaalsContact C-N 3.35Å; L98-S100 PolarHBondContact O-N 3.37Å
99	I	27.3	Very low	30.5	Very low	134 Å²	134	142.5 Å²	142.5	69%	0.687	77%	0.772	S	S	*	*			trans	-68.2	101.1	152.7	-60	166.7	0	0	0	104.5	P97	P97-I99 PolarHBondContact O-N 2.74Å
100	S	29.9	Very low	30.9	Very low	94 Å²	94	140.7 Å²	140.7	66%	0.657	77%	0.765	S	S	*	*			trans	-115.6	100	156.9	68.1	0	0	0	0	106.7	L98 T102	L98-S100 VanDerWaalsContact C-N 3.35Å; L98-S100 PolarHBondContact O-N 3.37Å; S100-T102 VanDerWaalsContact C-N 3.29Å; S100-T102 PolarHBondContact O-N 3.19Å
101	D	35.5	Very low	31.3	Very low	145 Å²	145	142.7 Å²	142.7	78%	0.775	77%	0.771	S	S	*	*			trans	-61	88.1	173.2	-65.9	-47.4	0	0	0	109.8
102	T	28.8	Very low	32.3	Very low	125 Å²	125	140.4 Å²	140.4	77%	0.767	75%	0.753	S	S	*	*			trans	-176.6	83.5	147.1	7.8	0	0	0	0	106.5	S100 P104	S100-T102 VanDerWaalsContact C-N 3.29Å; S100-T102 PolarHBondContact O-N 3.19Å; T102-P104 WeakPolarHBondContact O-CD 3.48Å
103	E	28.4	Very low	33.6	Very low	185 Å²	185	139.1 Å²	139.1	86%	0.864	74%	0.743	S	S	*	*			trans	-52.4	124.4	149.8	-84.2	180	154.6	0	0	106	S105	E103-S105 PolarHBondContact O-N 2.9Å
104	P	32.7	Very low	35	Very low	117 Å²	117	133.1 Å²	133.1	76%	0.76	73%	0.725	S	S	*	*			trans	-58.3	113.5	165.8	-1	12.6	0	0	0	104.5	T102 E106	T102-P104 WeakPolarHBondContact O-CD 3.48Å; P104-E106 PolarHBondContact O-N 3.48Å
105	S	28.1	Very low	36.8	Very low	108 Å²	108	129.7 Å²	129.7	76%	0.755	70%	0.702	S	S	*	*			trans	-41.6	116.3	172.5	50.8	0	0	0	0	107.6	E103	E103-S105 PolarHBondContact O-N 2.9Å
106	E	30.8	Very low	38.4	Very low	165 Å²	165	125.1 Å²	125.1	77%	0.771	69%	0.686	S	S	*	*			trans	-44.6	128.8	173.3	-68.1	-179.2	152.1	0	0	107.1	P104 I108	P104-E106 PolarHBondContact O-N 3.48Å; E106-I108 PolarHBondContact O-N 2.97Å
107	P	32.9	Very low	40.2	Very low	118 Å²	118	116.3 Å²	116.3	77%	0.766	65%	0.648	S	S	*	*			trans	-58	111.6	170.6	24.1	-28.8	0	0	0	105.3	D109	P107-D109 PolarHBondContact O-N 2.86Å
108	I	31.9	Very low	41.8	Very low	159 Å²	159	116.1 Å²	116.1	82%	0.815	65%	0.645	S	S	*	*			trans	-40.9	112.8	171.7	-66.6	165.9	0	0	0	105.4	E106 S110	E106-I108 PolarHBondContact O-N 2.97Å; I108-S110 PolarHBondContact O-N 2.83Å
109	D	37.9	Very low	43	Very low	122 Å²	122	109.5 Å²	109.5	65%	0.652	61%	0.612	S	S	*	*			trans	-42.9	103.8	-177.7	-80.7	-36.9	0	0	0	107.4	P107 E111	P107-D109 PolarHBondContact O-N 2.86Å; D109-E111 PolarHBondContact O-N 2.88Å; D109-E111 VanDerWaalsContact O-N 3.16Å
110	S	38.4	Very low	44.3	Very low	89 Å²	89	109.9 Å²	109.9	62%	0.622	61%	0.608	S	S	*	*			trans	-59.8	123.4	-175.7	59.3	0	0	0	0	106.5	I108 D112	I108-S110 PolarHBondContact O-N 2.83Å; S110-D112 WeakPolarHBondContact O-CA 3.29Å; S110-D112 PolarHBondContact O-N 2.78Å
111	E	40.1	Very low	45.2	Very low	191 Å²	191	109.6 Å²	109.6	89%	0.893	61%	0.607	S	S	*	*			trans	-12	91.4	-179.5	-67.9	-170.3	160.5	0	0	112.2	D109 T113	D109-E111 PolarHBondContact O-N 2.88Å; D109-E111 VanDerWaalsContact O-N 3.16Å; E111-T113 PolarHBondContact O-N 3.11Å
112	D	49	Very low	45.7	Very low	58 Å²	58	108.6 Å²	108.6	31%	0.31	59%	0.593	S	S	.	*			trans	-53.1	110.9	-173.6	-89.5	-6.8	0	0	0	107.9	S110 E114 R290 H298	S110-D112 WeakPolarHBondContact O-CA 3.29Å; S110-D112 PolarHBondContact O-N 2.78Å; D112-E114 PolarHBondContact O-N 2.77Å; D112-R290 IonicContact OD1-NH1 2.77Å; D112-R290 IonicContact OD2-CZ 3.2Å; D112-R290 IonicContact OD2-NH1 2.67Å; D112-R290 PolarHBondContact OD2-NH1 2.85Å; D112-H298 IonicContact OD1-CE1 2.92Å; D112-H298 PolarHBondContact OD1-CE1 2.91Å; D112-H298 IonicContact OD1-ND1 3.42Å; D112-H298 PolarHBondContact OD1-ND1 2.86Å
113	T	56.3	Low	46.1	Very low	97 Å²	97	106.7 Å²	106.7	60%	0.595	58%	0.578	S	S	*	*			trans	-65.3	92	164.9	28.5	0	0	0	0	107.3	E111 V299 G300 K301	E111-T113 PolarHBondContact O-N 3.11Å; T113-V299 PolarHBondContact OG1-O 2.85Å; T113-G300 WeakPolarHBondContact O-CA 3.13Å; T113-K301 PolarHBondContact O-N 2.83Å; T113-K301 VanDerWaalsContact O-N 3.11Å
114	E	62.7	Low	46.6	Very low	103 Å²	103	102 Å²	102	48%	0.481	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.8	121	176.5	-176.8	163.2	-137.1	0	0	109.3	D112 K301 T303	D112-E114 PolarHBondContact O-N 2.77Å; E114-K301 WeakPolarHBondContact CA-O 3.34Å; E114-K301 IonicContact OE1-NZ 3.59Å; E114-K301 PolarHBondContact OE1-NZ 3.04Å; E114-T303 PolarHBondContact OE1-OG1 2.97Å
115	V	66.5	Low	46.7	Very low	42 Å²	42	102.8 Å²	102.8	26%	0.255	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	112.9	171.5	-172	0	0	0	0	107.6	I117 K301 T303 E338	V115-I117 HydrophobicContact CG1-CD1 3.93Å; V115-I117 HydrophobicContact CG1-CG1 3.78Å; V115-K301 PolarHBondContact N-O 2.75Å; V115-T303 PolarHBondContact O-N 2.97Å; V115-E338 HydrophobicContact CG1-CG 4.31Å
116	L	62	Low	46.9	Very low	116 Å²	116	101.3 Å²	101.3	61%	0.607	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	116.7	177.8	-172.5	70.4	0	0	0	109.8	T303 P305	L116-T303 HydrophobicContact CD1-CG2 4.2Å; L116-P305 HydrophobicContact CD1-CG 3.8Å; L116-P305 HydrophobicContact CG-CG 4.3Å
117	I	64.6	Low	47	Very low	1 Å²	1	97.6 Å²	97.6	1%	0.005	52%	0.522	C	S	.	.			trans	-121.4	118.8	-174.6	-54.7	177.4	0	0	0	110.4	V115 I302 T303 P305 V333 Q339 A340	V115-I117 HydrophobicContact CG1-CD1 3.93Å; V115-I117 HydrophobicContact CG1-CG1 3.78Å; I117-I302 HydrophobicContact CD1-CG2 3.97Å; I117-T303 PolarHBondContact N-O 2.89Å; I117-P305 WeakPolarHBondContact O-CD 3.35Å; I117-V333 HydrophobicContact CD1-CG1 3.31Å; I117-V333 HydrophobicContact CG2-CG1 4.44Å; I117-Q339 VanDerWaalsContact CG2-C 3.44Å; I117-A340 HydrophobicContact CG2-CB 3.44Å; I117-A340 VanDerWaalsContact CG2-CB 3.44Å
118	T	63.8	Low	46.9	Very low	106 Å²	106	102 Å²	102	65%	0.65	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-93.2	120.5	-180	-54.7	0	0	0	0	110.7
119	P	55.8	Low	46.7	Very low	24 Å²	24	102 Å²	102	16%	0.156	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	147.5	-175.8	28.2	-28.2	0	0	0	113.6	V304 S306 F331 A340 T342	P119-V304 HydrophobicContact CG-CG1 3.87Å; P119-S306 WeakPolarHBondContact CG-OG 3.44Å; P119-F331 HydrophobicContact CB-CD1 4.44Å; P119-F331 HydrophobicContact CG-CD1 4.31Å; P119-F331 HydrophobicContact CG-CE1 4.26Å; P119-A340 CarbonylContact C-O 3.23Å; P119-A340 VanDerWaalsContact CA-O 3.26Å; P119-A340 WeakPolarHBondContact CA-O 3.35Å; P119-A340 HydrophobicContact CB-CB 3.87Å; P119-T342 WeakPolarHBondContact CB-OG1 3.25Å
120	K	53.6	Low	46.5	Very low	142 Å²	142	101.1 Å²	101.1	62%	0.617	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	127.6	166.1	-65.5	177.5	-178.7	172.1	0	110	A340 F341 T342	K120-A340 PolarHBondContact N-O 3.11Å; K120-F341 HydrophobicContact CB-CB 4.41Å; K120-F341 CarbonylContact O-C 3.53Å; K120-F341 WeakPolarHBondContact O-CA 3.47Å; K120-F341 WeakPolarHBondContact O-CB 3.21Å; K120-T342 PolarHBondContact O-N 2.71Å
121	S	49.2	Very low	46.4	Very low	89 Å²	89	105.6 Å²	105.6	62%	0.622	53%	0.532	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	136.1	-179.8	56.9	0	0	0	0	112.3
122	Y	46.4	Very low	45.9	Very low	124 Å²	124	100 Å²	100	49%	0.486	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	122.4	165.4	-68.8	-88.4	0	0	0	109.3	F341 T342	Y122-F341 HydrophobicContact CD2-CB 4.2Å; Y122-F341 HydrophobicContact CD2-CD2 4.04Å; Y122-F341 HydrophobicContact CD2-CG 4.42Å; Y122-F341 HydrophobicContact CE2-CB 3.87Å; Y122-F341 HydrophobicContact CE2-CD2 4.14Å; Y122-F341 HydrophobicContact CE2-CG 4.13Å; Y122-T342 PolarHBondContact N-O 3.14Å; Y122-T342 VanDerWaalsContact N-O 3.12Å
123	D	38	Very low	45.1	Very low	85 Å²	85	105.5 Å²	105.5	46%	0.455	54%	0.542	S	S	.	.			trans	-93	124.4	179.4	-135.9	3.5	0	0	0	110	E125 T126 N344	D123-E125 PolarHBondContact O-N 2.81Å; D123-E125 VanDerWaalsContact O-N 3.11Å; D123-T126 HydrophobicContact CB-CG2 4.19Å; D123-T126 PolarHBondContact O-N 2.85Å; D123-T126 PolarHBondContact O-OG1 3.45Å; D123-N344 PolarHBondContact OD1-ND2 2.93Å; D123-N344 VanDerWaalsContact OD1-ND2 3.14Å
124	Y	37	Very low	44.3	Very low	86 Å²	86	108 Å²	108	34%	0.337	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-53.6	-36.5	-174.4	-170.7	-87.7	0	0	0	112	T126 Y382	Y124-T126 VanDerWaalsContact C-N 3.35Å; Y124-T126 PolarHBondContact O-N 3.47Å; Y124-Y382 AromaticContact CE2-CD1 3.92Å; Y124-Y382 HydrophobicContact CE2-CD1 3.92Å; Y124-Y382 HydrophobicContact CE2-CD2 4.01Å; Y124-Y382 AromaticContact CE2-CG 3.57Å; Y124-Y382 HydrophobicContact CE2-CG 3.57Å; Y124-Y382 WeakPolarHBondContact OH-CD1 3.34Å; Y124-Y382 WeakPolarHBondContact OH-CE1 3.37Å
125	E	35.7	Very low	43.1	Very low	134 Å²	134	112.2 Å²	112.2	63%	0.626	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-71.2	-24.5	180	-67	-166.9	165	0	0	114.1	D123 T127 W128	D123-E125 PolarHBondContact O-N 2.81Å; D123-E125 VanDerWaalsContact O-N 3.11Å; E125-T127 PolarHBondContact O-N 3Å; E125-W128 PolarHBondContact O-N 2.98Å
126	T	31.8	Very low	41.6	Very low	76 Å²	76	117.1 Å²	117.1	47%	0.466	59%	0.591	S	S	.	*	G	3₁₀ helix	trans	-75.2	-24.1	-175	52.3	0	0	0	0	113.4	D123 Y124 W128 K129	D123-T126 HydrophobicContact CB-CG2 4.19Å; D123-T126 PolarHBondContact O-N 2.85Å; D123-T126 PolarHBondContact O-OG1 3.45Å; Y124-T126 VanDerWaalsContact C-N 3.35Å; Y124-T126 PolarHBondContact O-N 3.47Å; T126-W128 PolarHBondContact O-N 3.5Å; T126-K129 PolarHBondContact O-N 2.86Å
127	T	33	Very low	40.2	Very low	87 Å²	87	120 Å²	120	53%	0.534	59%	0.594	S	S	.	*	G	3₁₀ helix	trans	-72	-19	177.1	-19.5	0	0	0	0	113	E125	E125-T127 PolarHBondContact O-N 3Å
128	W	30.5	Very low	38.9	Very low	212 Å²	212	121.6 Å²	121.6	80%	0.803	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-86	-13.8	173.5	-94.4	86.4	0	0	0	113.5	E125 T126 S130	E125-W128 PolarHBondContact O-N 2.98Å; T126-W128 PolarHBondContact O-N 3.5Å; W128-S130 VanDerWaalsContact C-N 3.28Å; W128-S130 PolarHBondContact O-N 3.25Å
129	K	28.9	Very low	37.6	Very low	157 Å²	157	122.1 Å²	122.1	68%	0.683	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-4	-175.3	-77.7	-174	178	174	0	114.9	T126	T126-K129 PolarHBondContact O-N 2.86Å
130	S	34	Very low	36.6	Very low	104 Å²	104	123.6 Å²	123.6	73%	0.727	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-3.1	-172.9	66	0	0	0	0	116.5	W128	W128-S130 VanDerWaalsContact C-N 3.28Å; W128-S130 PolarHBondContact O-N 3.25Å
131	E	35.6	Very low	35.7	Very low	183 Å²	183	122.9 Å²	122.9	86%	0.855	63%	0.625	S	S	*	*	S	Bend	trans	-127.1	0.1	-177.3	-68.7	-169.5	168.9	0	0	116.3
132	A	28.8	Very low	35.1	Very low	73 Å²	73	124.5 Å²	124.5	60%	0.603	63%	0.626	S	S	*	*			trans	-93.2	114.2	177.5	0	0	0	0	0	111.6
133	Q	33.5	Very low	34.5	Very low	174 Å²	174	121 Å²	121	81%	0.813	62%	0.622	S	S	*	*			trans	-61.1	142	167.4	-71.8	-176.8	-16.7	0	0	109.8	E135 D136	Q133-E135 PolarHBondContact O-N 3.43Å; Q133-D136 PolarHBondContact O-N 2.93Å
134	E	39.4	Very low	34.5	Very low	150 Å²	150	124.8 Å²	124.8	70%	0.701	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	-16.2	-159.9	-72.6	-168	119.3	0	0	117.2	R137	E134-R137 IonicContact OE1-NH2 3.63Å; E134-R137 PolarHBondContact OE1-NH2 2.84Å
135	E	37.6	Very low	34.3	Very low	192 Å²	192	125.2 Å²	125.2	90%	0.897	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-14.1	-175.7	-66.4	-171.3	163.9	0	0	114.3	Q133 R137	Q133-E135 PolarHBondContact O-N 3.43Å; E135-R137 PolarHBondContact O-N 2.72Å
136	D	33.9	Very low	34.2	Very low	144 Å²	144	121.8 Å²	121.8	77%	0.77	65%	0.65	S	S	*	*			trans	-98.1	38.3	178.9	-76.1	-32.8	0	0	0	113.2	Q133 G138	Q133-D136 PolarHBondContact O-N 2.93Å; D136-G138 PolarHBondContact O-N 1.99Å
137	R	33.9	Very low	34.2	Very low	177 Å²	177	123.6 Å²	123.6	67%	0.668	65%	0.649	S	S	*	*			trans	-72.3	78.4	173.5	-69.4	-176.9	-173.7	-177.3	6.9	110.9	E134 E135	E134-R137 IonicContact OE1-NH2 3.63Å; E134-R137 PolarHBondContact OE1-NH2 2.84Å; E135-R137 PolarHBondContact O-N 2.72Å
138	G	36.7	Very low	34.4	Very low	35 Å²	35	124.3 Å²	124.3	36%	0.361	66%	0.657	S	S	.	*			trans	-78.2	136.8	163.7	0	0	0	0	0	111	D136 G140 V151	D136-G138 PolarHBondContact O-N 1.99Å; G138-G140 PolarHBondContact O-N 2.55Å; G138-V151 WeakPolarHBondContact CA-O 3.32Å
139	I	36.5	Very low	34.7	Very low	116 Å²	116	116.3 Å²	116.3	60%	0.595	63%	0.633	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.8	105.9	169	-58.6	174.4	0	0	0	106.7	F141 V151	I139-F141 HydrophobicContact CB-CE2 4.35Å; I139-F141 HydrophobicContact CG2-CD2 4.34Å; I139-F141 HydrophobicContact CG2-CE1 4.37Å; I139-F141 HydrophobicContact CG2-CE2 3.66Å; I139-F141 HydrophobicContact CG2-CZ 3.67Å; I139-V151 WeakPolarHBondContact O-CG2 3.48Å
140	G	33.5	Very low	35	Very low	55 Å²	55	116.1 Å²	116.1	57%	0.567	64%	0.638	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.8	132.2	175.4	0	0	0	0	0	110.9	G138 S149	G138-G140 PolarHBondContact O-N 2.55Å; G140-S149 WeakPolarHBondContact CA-O 3.46Å
141	F	35.7	Very low	35.2	Very low	128 Å²	128	113.3 Å²	113.3	56%	0.561	62%	0.616	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.2	130.4	167.6	-63.1	-87.9	0	0	0	108.7	I139 S149 V151	I139-F141 HydrophobicContact CB-CE2 4.35Å; I139-F141 HydrophobicContact CG2-CD2 4.34Å; I139-F141 HydrophobicContact CG2-CE1 4.37Å; I139-F141 HydrophobicContact CG2-CE2 3.66Å; I139-F141 HydrophobicContact CG2-CZ 3.67Å; F141-S149 PolarHBondContact N-O 3.43Å; F141-S149 PolarHBondContact O-N 2.99Å; F141-S149 VanDerWaalsContact O-N 3.13Å; F141-V151 HydrophobicContact CD2-CG2 4.16Å; F141-V151 HydrophobicContact CE2-CG2 4.17Å
142	I	36.9	Very low	35.3	Very low	123 Å²	123	109.1 Å²	109.1	63%	0.631	60%	0.6	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99	113.6	169.7	-58.1	174.5	0	0	0	107	R147	I142-R147 WeakPolarHBondContact CA-O 3.45Å
143	A	33.3	Very low	35.9	Very low	49 Å²	49	110.7 Å²	110.7	41%	0.405	60%	0.604	S	S	.	*			trans	-69.1	147.1	169	0	0	0	0	0	109.5	D145 G146 R147	A143-D145 PolarHBondContact O-N 2.78Å; A143-G146 PolarHBondContact O-N 3.04Å; A143-R147 HydrophobicContact CB-CB 4.42Å; A143-R147 PolarHBondContact N-O 2.74Å
144	L	37.5	Very low	36.5	Very low	165 Å²	165	107.3 Å²	107.3	86%	0.864	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	-9.1	-172.9	-71.5	165.9	0	0	0	115.6	T347	L144-T347 HydrophobicContact CD2-CG2 4.35Å
145	D	34.4	Very low	36.4	Very low	95 Å²	95	103 Å²	103	51%	0.508	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.1	14.1	174.3	68	-7.1	0	0	0	114	A143 R147	A143-D145 PolarHBondContact O-N 2.78Å; D145-R147 WeakPolarHBondContact OD1-CG 3.41Å; D145-R147 IonicContact OD1-NE 3.09Å; D145-R147 PolarHBondContact OD1-NE 2.75Å; D145-R147 IonicContact OD2-CZ 2.75Å; D145-R147 IonicContact OD2-NE 3.29Å; D145-R147 PolarHBondContact OD2-NE 2.92Å; D145-R147 IonicContact OD2-NH2 3.64Å; D145-R147 PolarHBondContact OD2-NH2 3.34Å
146	G	31.9	Very low	36.5	Very low	62 Å²	62	100.3 Å²	100.3	64%	0.639	59%	0.589	S	S	*	*	S	Bend	trans	87.4	11.2	173.4	0	0	0	0	0	115.2	A143	A143-G146 PolarHBondContact O-N 3.04Å
147	R	32.9	Very low	36.4	Very low	115 Å²	115	103.3 Å²	103.3	43%	0.434	59%	0.589	S	S	.	*			trans	-86.2	127.1	175.5	-60.1	-177.6	-135.8	-165.5	6.1	110.9	I142 A143 D145 N163	I142-R147 WeakPolarHBondContact CA-O 3.45Å; A143-R147 HydrophobicContact CB-CB 4.42Å; A143-R147 PolarHBondContact N-O 2.74Å; D145-R147 WeakPolarHBondContact OD1-CG 3.41Å; D145-R147 IonicContact OD1-NE 3.09Å; D145-R147 PolarHBondContact OD1-NE 2.75Å; D145-R147 IonicContact OD2-CZ 2.75Å; D145-R147 IonicContact OD2-NE 3.29Å; D145-R147 PolarHBondContact OD2-NE 2.92Å; D145-R147 IonicContact OD2-NH2 3.64Å; D145-R147 PolarHBondContact OD2-NH2 3.34Å; R147-N163 PolarHBondContact NH1-O 2.72Å
148	S	36.9	Very low	36.5	Very low	102 Å²	102	100.1 Å²	100.1	71%	0.713	59%	0.589	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100.6	138.8	175	57.5	0	0	0	0	111.5
149	S	36.4	Very low	36.2	Very low	43 Å²	43	103 Å²	103	30%	0.301	60%	0.599	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-123.2	146.5	168.9	61.4	0	0	0	0	111.2	G140 F141	G140-S149 WeakPolarHBondContact CA-O 3.46Å; F141-S149 PolarHBondContact N-O 3.43Å; F141-S149 PolarHBondContact O-N 2.99Å; F141-S149 VanDerWaalsContact O-N 3.13Å
150	I	36.4	Very low	35.8	Very low	154 Å²	154	103.5 Å²	103.5	79%	0.79	60%	0.603	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-106.3	123.5	175.5	-60.8	172.8	0	0	0	107.6
151	V	36.8	Very low	35.7	Very low	44 Å²	44	108.4 Å²	108.4	27%	0.267	61%	0.611	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.4	117	173.9	-178.9	0	0	0	0	108.2	G138 I139 F141 P153	G138-V151 WeakPolarHBondContact CA-O 3.32Å; I139-V151 WeakPolarHBondContact O-CG2 3.48Å; F141-V151 HydrophobicContact CD2-CG2 4.16Å; F141-V151 HydrophobicContact CE2-CG2 4.17Å; V151-P153 WeakPolarHBondContact O-CD 3.44Å
152	N	38.8	Very low	35.4	Very low	95 Å²	95	106.4 Å²	106.4	51%	0.508	61%	0.609	S	S	.	*			trans	-81.2	113.7	168.7	-176.3	-22	0	0	0	108.6	S154 S155	N152-S154 PolarHBondContact O-N 3.13Å; N152-S154 VanDerWaalsContact O-N 3.13Å; N152-S154 PolarHBondContact OD1-N 3.49Å; N152-S154 PolarHBondContact OD1-OG 2.91Å; N152-S155 PolarHBondContact O-N 2.81Å
153	P	41.6	Very low	34.9	Very low	107 Å²	107	107 Å²	107	70%	0.695	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-15.9	-175.1	24.8	-32.3	0	0	0	114	V151	V151-P153 WeakPolarHBondContact O-CD 3.44Å
154	S	44.6	Very low	34.5	Very low	102 Å²	102	111.6 Å²	111.6	71%	0.713	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-8.1	-178.7	65.7	0	0	0	0	114.8	N152	N152-S154 PolarHBondContact O-N 3.13Å; N152-S154 VanDerWaalsContact O-N 3.13Å; N152-S154 PolarHBondContact OD1-N 3.49Å; N152-S154 PolarHBondContact OD1-OG 2.91Å
155	S	39.2	Very low	34.2	Very low	59 Å²	59	108 Å²	108	41%	0.413	62%	0.62	S	S	.	*			trans	-117.2	121.4	-179.6	107.1	0	0	0	0	110.9	N152 R157	N152-S155 PolarHBondContact O-N 2.81Å; S155-R157 PolarHBondContact O-N 3.3Å; S155-R157 PolarHBondContact OG-O 3.32Å; S155-R157 VanDerWaalsContact OG-O 3.11Å
156	S	38.5	Very low	33.9	Very low	137 Å²	137	109.4 Å²	109.4	96%	0.958	63%	0.628	S	S	*	*	S	Bend	trans	-67.4	12.8	174.7	52.4	0	0	0	0	114
157	R	31.8	Very low	34	Very low	207 Å²	207	110 Å²	110	78%	0.781	63%	0.634	S	S	*	*			trans	-116.5	112.9	176.1	-79.7	-175.7	154.3	-172.4	-6	110.2	S155 T159	S155-R157 PolarHBondContact O-N 3.3Å; S155-R157 PolarHBondContact OG-O 3.32Å; S155-R157 VanDerWaalsContact OG-O 3.11Å; R157-T159 PolarHBondContact O-N 3.48Å
158	V	35.8	Very low	34.2	Very low	110 Å²	110	110.4 Å²	110.4	67%	0.667	65%	0.649	S	S	*	*			trans	-79.3	99.7	168.6	-179.3	0	0	0	0	108	L160	V158-L160 HydrophobicContact CG1-CG 4.28Å; V158-L160 PolarHBondContact O-N 2.99Å
159	T	30.7	Very low	34.3	Very low	94 Å²	94	108.7 Å²	108.7	58%	0.577	65%	0.648	S	S	*	*			trans	-84.1	97	170.2	-50.2	0	0	0	0	109.1	R157 H161	R157-T159 PolarHBondContact O-N 3.48Å; T159-H161 WeakPolarHBondContact CG2-NE2 3.5Å; T159-H161 PolarHBondContact O-N 2.79Å; T159-H161 VanDerWaalsContact O-N 3.07Å
160	L	29.3	Very low	35	Very low	128 Å²	128	108.2 Å²	108.2	67%	0.67	65%	0.647	S	S	*	*			trans	-70.4	98.7	170.8	-87.3	147.1	0	0	0	109.4	V158 V162	V158-L160 HydrophobicContact CG1-CG 4.28Å; V158-L160 PolarHBondContact O-N 2.99Å; L160-V162 HydrophobicContact CB-CG2 4.33Å; L160-V162 PolarHBondContact O-N 2.96Å
161	H	30.6	Very low	36.3	Very low	158 Å²	158	109.1 Å²	109.1	73%	0.731	65%	0.645	S	S	*	*			trans	-75.5	79.4	163.8	-71.5	-81.1	0	0	0	108.8	T159 N163	T159-H161 WeakPolarHBondContact CG2-NE2 3.5Å; T159-H161 PolarHBondContact O-N 2.79Å; T159-H161 VanDerWaalsContact O-N 3.07Å; H161-N163 VanDerWaalsContact C-N 3.27Å; H161-N163 PolarHBondContact O-N 3.05Å
162	V	28.9	Very low	38.6	Very low	85 Å²	85	107.4 Å²	107.4	52%	0.515	64%	0.636	S	S	.	*			trans	-69.3	95.7	162.6	-171.6	0	0	0	0	105.3	L160 Q164	L160-V162 HydrophobicContact CB-CG2 4.33Å; L160-V162 PolarHBondContact O-N 2.96Å; V162-Q164 HydrophobicContact CG1-CG 4.37Å; V162-Q164 PolarHBondContact O-N 2.88Å
163	N	26.4	Very low	41.1	Very low	137 Å²	137	103 Å²	103	73%	0.733	61%	0.612	S	S	*	*			trans	-60.2	94.9	155.5	-88.4	-21.4	0	0	0	105.1	R147 H161 A165	R147-N163 PolarHBondContact NH1-O 2.72Å; H161-N163 VanDerWaalsContact C-N 3.27Å; H161-N163 PolarHBondContact O-N 3.05Å; N163-A165 VanDerWaalsContact C-N 3.26Å; N163-A165 PolarHBondContact O-N 2.97Å
164	Q	25.5	Very low	43.5	Very low	145 Å²	145	103 Å²	103	68%	0.678	60%	0.599	S	S	*	*			trans	-57.4	104.1	159.5	-74	-176	-8.9	0	0	103.8	V162 N166	V162-Q164 HydrophobicContact CG1-CG 4.37Å; V162-Q164 PolarHBondContact O-N 2.88Å; Q164-N166 PolarHBondContact O-N 3.29Å
165	A	31.5	Very low	45.8	Very low	89 Å²	89	101.1 Å²	101.1	74%	0.736	58%	0.578	S	S	*	*			trans	-66.7	69.5	164.8	0	0	0	0	0	107.2	N163 G167	N163-A165 VanDerWaalsContact C-N 3.26Å; N163-A165 PolarHBondContact O-N 2.97Å; A165-G167 PolarHBondContact O-N 2.94Å; A165-G167 VanDerWaalsContact O-N 3.11Å
166	N	26.8	Very low	48.3	Very low	124 Å²	124	101 Å²	101	66%	0.663	57%	0.574	S	S	*	*			trans	-51.9	115.3	153.5	-85.5	-18.1	0	0	0	104.8	Q164 T168	Q164-N166 PolarHBondContact O-N 3.29Å; N166-T168 PolarHBondContact O-N 3.25Å; N166-T168 PolarHBondContact O-OG1 3.18Å
167	G	33.9	Very low	51	Low	75 Å²	75	100 Å²	100	77%	0.773	55%	0.549	S	S	*	.			trans	-46.2	126.3	-160	0	0	0	0	0	113.3	A165	A165-G167 PolarHBondContact O-N 2.94Å; A165-G167 VanDerWaalsContact O-N 3.11Å
168	T	37.6	Very low	54	Low	123 Å²	123	93.7 Å²	93.7	76%	0.755	53%	0.529	S	S	*	.			trans	-150.1	82.8	172.3	40.6	0	0	0	0	110.1	N166	N166-T168 PolarHBondContact O-N 3.25Å; N166-T168 PolarHBondContact O-OG1 3.18Å
169	G	40	Very low	56.8	Low	66 Å²	66	90.2 Å²	90.2	68%	0.68	51%	0.506	S	S	*	.			trans	73.2	126.4	156.2	0	0	0	0	0	116.4	K171	G169-K171 PolarHBondContact O-N 3.31Å; G169-K171 VanDerWaalsContact O-N 3.13Å
170	A	49.7	Very low	59.9	Low	34 Å²	34	89.1 Å²	89.1	28%	0.281	50%	0.497	S	S	.	.			trans	-50.7	121.3	154.7	0	0	0	0	0	109	S387 S389	A170-S387 WeakPolarHBondContact CB-O 3.34Å; A170-S389 VanDerWaalsContact CB-CA 3.5Å; A170-S389 VanDerWaalsContact CB-N 3.27Å
171	K	63.7	Low	63	Low	172 Å²	172	83.1 Å²	83.1	75%	0.748	47%	0.465	S	S	*	.	S	Bend	trans	-96.1	108.3	173.5	-69.8	-171.4	179.3	-178.2	0	107.3	G169 S387	G169-K171 PolarHBondContact O-N 3.31Å; G169-K171 VanDerWaalsContact O-N 3.13Å; K171-S387 PolarHBondContact O-N 3.34Å
172	G	85.5	Confident	65.9	Low	8 Å²	8	83 Å²	83	8%	0.082	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	111.2	-7.2	160	0	0	0	0	0	116.7	R419 E420	G172-R419 CarbonylContact O-C 3.52Å; G172-R419 VanDerWaalsContact O-CA 3.23Å; G172-R419 WeakPolarHBondContact O-CA 3.32Å; G172-E420 PolarHBondContact O-N 2.9Å
173	L	92.8	Very high	68.9	Low	2 Å²	2	87.2 Å²	87.2	1%	0.01	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	119.7	172.1	-64.3	173.7	0	0	0	112.7	M373 L386 A388 W394 V404 Y417 I418 R419	L173-M373 HydrophobicContact CD1-CE 4.4Å; L173-M373 HydrophobicContact CD2-CE 4.06Å; L173-L386 HydrophobicContact CD1-CB 4.15Å; L173-L386 HydrophobicContact CD2-CB 4.42Å; L173-L386 HydrophobicContact CG-CB 4.01Å; L173-A388 HydrophobicContact CB-CB 4.44Å; L173-W394 HydrophobicContact CD1-CH2 3.53Å; L173-W394 HydrophobicContact CD1-CZ2 4.25Å; L173-W394 HydrophobicContact CD1-CZ3 4.5Å; L173-V404 HydrophobicContact CD2-CB 4.35Å; L173-V404 HydrophobicContact CD2-CG2 3.76Å; L173-Y417 HydrophobicContact CB-CD1 4.26Å; L173-Y417 HydrophobicContact CB-CG 4.46Å; L173-I418 WeakPolarHBondContact CA-O 3.47Å; L173-R419 HydrophobicContact CD2-CB 4.45Å; L173-R419 HydrophobicContact CD2-CG 3.82Å
174	R	91.3	Very high	72	Confident	108 Å²	108	81.5 Å²	81.5	41%	0.408	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	124	174.5	178.9	177.9	57.1	74.6	2	110.7	Y417 I418 E420	R174-Y417 CarbonylContact O-C 3.51Å; R174-Y417 WeakPolarHBondContact O-CA 3.28Å; R174-I418 PolarHBondContact N-O 2.77Å; R174-I418 PolarHBondContact O-N 3.07Å; R174-E420 HydrophobicContact CB-CG 4.2Å; R174-E420 VanDerWaalsContact CB-OE1 3.25Å; R174-E420 WeakPolarHBondContact CB-OE1 3.34Å; R174-E420 VanDerWaalsContact CD-OE1 3.25Å; R174-E420 WeakPolarHBondContact CD-OE1 3.5Å; R174-E420 IonicContact NE-OE1 3.7Å; R174-E420 PolarHBondContact NE-OE1 3.11Å
175	K	92.1	Very high	75.1	Confident	63 Å²	63	75.4 Å²	75.4	27%	0.274	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	134.7	175	-171.3	173.6	76	170.7	0	110.1	E178 V415 Y417	K175-E178 IonicContact NZ-OE2 3.94Å; K175-E178 PolarHBondContact NZ-OE2 3.19Å; K175-V415 HydrophobicContact CD-CG1 3.62Å; K175-V415 HydrophobicContact CG-CG1 3.71Å; K175-Y417 HydrophobicContact CB-CD1 3.93Å; K175-Y417 HydrophobicContact CB-CE1 3.89Å; K175-Y417 HydrophobicContact CG-CD1 4.49Å; K175-Y417 HydrophobicContact CG-CE1 4.27Å
176	V	93	Very high	77.9	Confident	55 Å²	55	74.2 Å²	74.2	33%	0.333	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	-53.3	177.5	-171	0	0	0	0	110.1	H416 I418	V176-H416 PolarHBondContact N-O 3.13Å; V176-I418 HydrophobicContact CG2-CB 4.14Å; V176-I418 HydrophobicContact CG2-CD1 3.5Å; V176-I418 HydrophobicContact CG2-CG1 3.6Å
177	R	94.4	Very high	81.1	Confident	117 Å²	117	68.5 Å²	68.5	44%	0.442	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	162.7	-176.4	-72.2	179.7	-167.8	-176	14.5	111.2	D213 S214 M215 H416	R177-D213 PolarHBondContact NH1-O 2.93Å; R177-S214 VanDerWaalsContact NH1-C 3.31Å; R177-S214 VanDerWaalsContact NH1-CA 3.27Å; R177-S214 PolarHBondContact NH1-O 3.08Å; R177-M215 HydrophobicContact CB-CB 4.47Å; R177-M215 HydrophobicContact CB-CG 3.99Å; R177-H416 HydrophobicContact CB-CB 4.43Å; R177-H416 PolarHBondContact N-O 3.4Å; R177-H416 PolarHBondContact O-N 3.44Å
178	E	94.6	Very high	83.8	Confident	75 Å²	75	65.1 Å²	65.1	35%	0.35	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	148	168.9	63.5	-175.5	-123.5	0	0	109.7	K175 K413 V414 V415	K175-E178 IonicContact NZ-OE2 3.94Å; K175-E178 PolarHBondContact NZ-OE2 3.19Å; E178-K413 IonicContact OE1-NZ 3.31Å; E178-K413 PolarHBondContact OE1-NZ 2.83Å; E178-V414 CarbonylContact C-O 3.59Å; E178-V414 VanDerWaalsContact CA-O 3.26Å; E178-V414 WeakPolarHBondContact CA-O 3.37Å; E178-V415 HydrophobicContact CB-CG2 4.39Å
179	L	95.6	Very high	86.6	Confident	36 Å²	36	59.3 Å²	59.3	19%	0.188	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	122.9	172	179.4	64.4	0	0	0	108.7	L181 I210 M215 M217 K413 V414	L179-L181 HydrophobicContact CD2-CD2 3.84Å; L179-L181 HydrophobicContact CD2-CG 4.47Å; L179-L181 HydrophobicContact CG-CD2 3.92Å; L179-L181 HydrophobicContact CG-CG 4.32Å; L179-I210 HydrophobicContact CD2-CD1 3.65Å; L179-I210 HydrophobicContact CD2-CG1 3.87Å; L179-I210 HydrophobicContact CD2-CG2 4.27Å; L179-M215 HydrophobicContact CB-CE 3.96Å; L179-M217 HydrophobicContact CD2-CE 4.42Å; L179-K413 VanDerWaalsContact O-CA 3.31Å; L179-K413 WeakPolarHBondContact O-CA 3.4Å; L179-K413 WeakPolarHBondContact O-CB 3.41Å; L179-V414 PolarHBondContact N-O 3.25Å; L179-V414 PolarHBondContact O-N 2.7Å; L179-V414 VanDerWaalsContact O-N 3.09Å
180	D	95.4	Very high	89.4	Confident	71 Å²	71	56.6 Å²	56.6	38%	0.38	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	119.6	177.4	-169.7	-12.2	0	0	0	110.6	R182	D180-R182 VanDerWaalsContact OD1-CB 3.28Å; D180-R182 WeakPolarHBondContact OD1-CB 3.4Å; D180-R182 WeakPolarHBondContact OD1-CG 3.29Å; D180-R182 PolarHBondContact OD1-N 3.32Å; D180-R182 IonicContact OD1-NE 3.21Å; D180-R182 PolarHBondContact OD1-NE 3.49Å; D180-R182 VanDerWaalsContact OD1-NE 3.11Å; D180-R182 IonicContact OD2-CZ 3.25Å; D180-R182 IonicContact OD2-NE 2.73Å; D180-R182 PolarHBondContact OD2-NE 3.41Å; D180-R182 IonicContact OD2-NH2 3.06Å; D180-R182 PolarHBondContact OD2-NH2 3.46Å
181	L	94.7	Very high	91.6	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.01	25%	0.245	C	C	.	.			trans	-118.4	16.2	-179.7	-61.4	-177.8	0	0	0	112	L179 R183 Y184 M187 V199 M217 S412 V414	L179-L181 HydrophobicContact CD2-CD2 3.84Å; L179-L181 HydrophobicContact CD2-CG 4.47Å; L179-L181 HydrophobicContact CG-CD2 3.92Å; L179-L181 HydrophobicContact CG-CG 4.32Å; L181-R183 PolarHBondContact O-N 3.5Å; L181-Y184 HydrophobicContact CB-CD2 3.9Å; L181-Y184 HydrophobicContact CD2-CD2 3.88Å; L181-Y184 HydrophobicContact CD2-CE2 3.75Å; L181-Y184 HydrophobicContact CG-CD2 4.45Å; L181-Y184 WeakPolarHBondContact O-CB 3.35Å; L181-Y184 WeakPolarHBondContact O-CD2 3.13Å; L181-Y184 PolarHBondContact O-N 3.01Å; L181-M187 HydrophobicContact CB-CG 4.02Å; L181-M187 HydrophobicContact CB-SD 4.33Å; L181-M187 HydrophobicContact CD1-CE 3.99Å; L181-M187 HydrophobicContact CD1-CG 4.22Å; L181-M187 HydrophobicContact CD1-SD 4.44Å; L181-V199 HydrophobicContact CD1-CB 4.48Å; L181-V199 HydrophobicContact CD1-CG2 3.85Å; L181-M217 HydrophobicContact CD2-CE 3.56Å; L181-S412 CarbonylContact C-O 3.58Å; L181-S412 VanDerWaalsContact C-O 3.24Å; L181-S412 VanDerWaalsContact CA-O 3.24Å; L181-S412 WeakPolarHBondContact CA-O 3.15Å; L181-S412 VanDerWaalsContact CB-O 3.28Å; L181-S412 WeakPolarHBondContact CB-O 3.49Å; L181-S412 PolarHBondContact N-O 2.93Å; L181-V414 HydrophobicContact CD1-CG2 3.62Å
182	R	91.4	Very high	93.1	Very high	157 Å²	157	48.7 Å²	48.7	59%	0.592	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-53.5	-31.4	-178.8	-76.3	-178.4	-73.1	180	-1.9	114	D180 Y184 G185 G411 S412	D180-R182 VanDerWaalsContact OD1-CB 3.28Å; D180-R182 WeakPolarHBondContact OD1-CB 3.4Å; D180-R182 WeakPolarHBondContact OD1-CG 3.29Å; D180-R182 PolarHBondContact OD1-N 3.32Å; D180-R182 IonicContact OD1-NE 3.21Å; D180-R182 PolarHBondContact OD1-NE 3.49Å; D180-R182 VanDerWaalsContact OD1-NE 3.11Å; D180-R182 IonicContact OD2-CZ 3.25Å; D180-R182 IonicContact OD2-NE 2.73Å; D180-R182 PolarHBondContact OD2-NE 3.41Å; D180-R182 IonicContact OD2-NH2 3.06Å; D180-R182 PolarHBondContact OD2-NH2 3.46Å; R182-Y184 PolarHBondContact O-N 3.15Å; R182-G185 PolarHBondContact O-N 3.45Å; R182-G411 WeakPolarHBondContact CG-O 3.25Å; R182-S412 PolarHBondContact N-O 3.44Å
183	R	92.3	Very high	93.6	Very high	173 Å²	173	50.5 Å²	50.5	65%	0.653	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-60.7	-23.7	176.1	71.3	179.8	-178.4	-176	2.7	113.3	L181 E220	L181-R183 PolarHBondContact O-N 3.5Å; R183-E220 IonicContact CZ-OE1 2.83Å; R183-E220 IonicContact NH2-OE1 3.11Å; R183-E220 PolarHBondContact NH2-OE1 3.31Å
184	Y	90.3	Very high	93.4	Very high	17 Å²	17	53.7 Å²	53.7	7%	0.067	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-93.9	6	176.3	-51.8	-72.5	0	0	0	113.1	L181 R182 S201 Y204 T206 M217 E220	L181-Y184 HydrophobicContact CB-CD2 3.9Å; L181-Y184 HydrophobicContact CD2-CD2 3.88Å; L181-Y184 HydrophobicContact CD2-CE2 3.75Å; L181-Y184 HydrophobicContact CG-CD2 4.45Å; L181-Y184 WeakPolarHBondContact O-CB 3.35Å; L181-Y184 WeakPolarHBondContact O-CD2 3.13Å; L181-Y184 PolarHBondContact O-N 3.01Å; R182-Y184 PolarHBondContact O-N 3.15Å; Y184-S201 WeakPolarHBondContact O-CB 3.39Å; Y184-S201 PolarHBondContact O-OG 3.47Å; Y184-Y204 WeakPolarHBondContact O-CD2 3.33Å; Y184-T206 HydrophobicContact CD1-CG2 3.78Å; Y184-T206 HydrophobicContact CE1-CG2 3.91Å; Y184-M217 HydrophobicContact CE2-CE 4.15Å; Y184-E220 WeakPolarHBondContact CE1-OE2 3.46Å; Y184-E220 PolarHBondContact OH-OE1 3.26Å; Y184-E220 PolarHBondContact OH-OE2 2.84Å
185	G	90.3	Very high	93.4	Very high	16 Å²	16	53.5 Å²	53.5	17%	0.165	24%	0.242	C	C	.	.			trans	63.1	-142.2	-178.3	0	0	0	0	0	111.7	R182 M187 S412	R182-G185 PolarHBondContact O-N 3.45Å; G185-M187 PolarHBondContact O-N 3.03Å; G185-S412 WeakPolarHBondContact O-CB 3.43Å; G185-S412 PolarHBondContact O-OG 3.11Å
186	K	91.5	Very high	93.5	Very high	65 Å²	65	51.7 Å²	51.7	28%	0.283	24%	0.236	S	C	.	.			trans	-74.1	112.1	-167.6	-178	180	140.7	167.3	0	112	V188 S201 Y202 S203 Y409	K186-V188 HydrophobicContact CD-CG2 4.27Å; K186-V188 HydrophobicContact CG-CG2 3.86Å; K186-S201 WeakPolarHBondContact O-CA 3.5Å; K186-Y202 PolarHBondContact O-N 3.45Å; K186-S203 WeakPolarHBondContact CB-OG 3.17Å; K186-S203 PolarHBondContact N-OG 3.17Å; K186-Y409 HydrophobicContact CD-CE2 3.82Å; K186-Y409 VanDerWaalsContact CE-OH 3.24Å; K186-Y409 WeakPolarHBondContact CE-OH 3.48Å; K186-Y409 HydrophobicContact CG-CD2 4.41Å; K186-Y409 HydrophobicContact CG-CE2 3.99Å; K186-Y409 PolarHBondContact NZ-OH 3.48Å
187	M	92.5	Very high	93.8	Very high	3 Å²	3	49.1 Å²	49.1	2%	0.015	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	137.4	173.5	-55.4	-52	-64	0	0	110.4	L181 G185 V199 A200 I407	L181-M187 HydrophobicContact CB-CG 4.02Å; L181-M187 HydrophobicContact CB-SD 4.33Å; L181-M187 HydrophobicContact CD1-CE 3.99Å; L181-M187 HydrophobicContact CD1-CG 4.22Å; L181-M187 HydrophobicContact CD1-SD 4.44Å; G185-M187 PolarHBondContact O-N 3.03Å; M187-V199 HydrophobicContact CE-CB 3.59Å; M187-V199 HydrophobicContact CE-CG2 3.7Å; M187-A200 WeakPolarHBondContact CA-O 3.44Å; M187-A200 WeakPolarHBondContact CE-O 3.38Å; M187-I407 HydrophobicContact CB-CD1 4.33Å; M187-I407 HydrophobicContact CB-CG2 3.63Å
188	V	92.3	Very high	93.9	Very high	5 Å²	5	43.5 Å²	43.5	3%	0.03	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	-37.9	-172.9	-171	0	0	0	0	114.5	K186 A200 Y202 F229 Y314 D396 Y409	K186-V188 HydrophobicContact CD-CG2 4.27Å; K186-V188 HydrophobicContact CG-CG2 3.86Å; V188-A200 PolarHBondContact N-O 3.31Å; V188-Y202 HydrophobicContact CG2-CG 4.38Å; V188-F229 HydrophobicContact CG1-CD2 4.35Å; V188-F229 HydrophobicContact CG1-CE2 4.27Å; V188-F229 WeakPolarHBondContact CG1-O 3.17Å; V188-Y314 WeakPolarHBondContact CG1-OH 3.47Å; V188-Y314 PolarHBondContact O-OH 3.37Å; V188-D396 WeakPolarHBondContact O-CB 3.45Å; V188-Y409 HydrophobicContact CG2-CE2 4.38Å
189	G	95.5	Very high	94.1	Very high	0 Å²	0	40 Å²	40	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	138.8	-178.8	0	0	0	0	0	112.3	V199 A200 F229 D230 I407	G189-V199 CarbonylContact O-C 3.59Å; G189-V199 WeakPolarHBondContact O-CA 3.26Å; G189-A200 PolarHBondContact O-N 3.41Å; G189-F229 PolarHBondContact N-O 2.68Å; G189-D230 WeakPolarHBondContact CA-OD1 3.34Å; G189-I407 VanDerWaalsContact O-CD1 3.28Å; G189-I407 WeakPolarHBondContact O-CD1 3.18Å
190	L	97.8	Very high	94.2	Very high	9 Å²	9	38.3 Å²	38.3	5%	0.047	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	129.9	-179.2	-170.7	69.8	0	0	0	110.4	L197 A198 V199 D396 A398 Y405 I407	L190-L197 HydrophobicContact CD1-CD1 3.67Å; L190-L197 HydrophobicContact CD1-CD2 3.97Å; L190-L197 HydrophobicContact CD1-CG 3.75Å; L190-L197 HydrophobicContact CD2-CD1 4.48Å; L190-L197 HydrophobicContact CG-CD1 4.04Å; L190-A198 WeakPolarHBondContact CA-O 3.37Å; L190-V199 HydrophobicContact CD1-CG1 3.38Å; L190-D396 HydrophobicContact CB-CB 3.83Å; L190-D396 PolarHBondContact N-OD2 3.43Å; L190-A398 HydrophobicContact CD2-CB 3.87Å; L190-A398 HydrophobicContact CG-CB 4.11Å; L190-Y405 WeakPolarHBondContact CD2-O 3.17Å; L190-I407 HydrophobicContact CB-CD1 3.75Å; L190-I407 HydrophobicContact CB-CG1 4.11Å; L190-I407 HydrophobicContact CD1-CD1 4.23Å; L190-I407 HydrophobicContact CD1-CG1 4.08Å; L190-I407 HydrophobicContact CD2-CG1 4.34Å; L190-I407 HydrophobicContact CG-CG1 4.43Å
191	S	97.2	Very high	94.2	Very high	10 Å²	10	34.9 Å²	34.9	7%	0.07	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	149.8	168.5	171.5	0	0	0	0	111.5	L197 A198 L231 D232	S191-L197 CarbonylContact O-C 3.57Å; S191-L197 WeakPolarHBondContact O-CA 3.42Å; S191-A198 PolarHBondContact N-O 3.21Å; S191-A198 PolarHBondContact O-N 3.39Å; S191-L231 WeakPolarHBondContact CB-O 3.36Å; S191-D232 WeakPolarHBondContact CB-OD1 3.38Å; S191-D232 PolarHBondContact OG-OD1 2.86Å
192	L	95.6	Very high	94.1	Very high	31 Å²	31	37.4 Å²	37.4	16%	0.162	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	121.2	177.4	178.3	57.3	0	0	0	109.8	V196 L197 I212 A398 Q400 Y405	L192-V196 WeakPolarHBondContact CA-O 3.41Å; L192-V196 WeakPolarHBondContact CD1-O 3.49Å; L192-L197 HydrophobicContact CB-CD1 3.93Å; L192-L197 HydrophobicContact CD1-CB 4.38Å; L192-L197 HydrophobicContact CD1-CD1 4.21Å; L192-I212 HydrophobicContact CD1-CG2 3.63Å; L192-A398 HydrophobicContact CB-CB 3.73Å; L192-A398 HydrophobicContact CD2-CB 4.47Å; L192-Q400 HydrophobicContact CD2-CB 3.49Å; L192-Q400 VanDerWaalsContact CD2-CB 3.49Å; L192-Y405 HydrophobicContact CD2-CD2 3.78Å; L192-Y405 HydrophobicContact CD2-CE2 3.74Å
193	R	94.1	Very high	94	Very high	45 Å²	45	32.7 Å²	32.7	17%	0.17	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	138.6	172.8	-173.7	169.9	-64.8	-139.1	4.7	110.2	H195 V196 I233 V273	R193-H195 PolarHBondContact O-N 3.44Å; R193-H195 VanDerWaalsContact O-N 3.16Å; R193-V196 PolarHBondContact N-O 3.06Å; R193-V196 PolarHBondContact O-N 3.33Å; R193-I233 HydrophobicContact CB-CB 3.88Å; R193-I233 HydrophobicContact CB-CD1 4.07Å; R193-I233 HydrophobicContact CB-CG2 4.15Å; R193-I233 WeakPolarHBondContact CD-O 3.27Å; R193-I233 PolarHBondContact NE-O 2.91Å; R193-I233 PolarHBondContact NH2-O 2.92Å; R193-V273 PolarHBondContact NH2-O 2.68Å
194	N	89.5	Confident	94	Very high	70 Å²	70	31.2 Å²	31.2	37%	0.374	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	45.9	175.2	-59.7	-7.2	0	0	0	113.2	F70 V196	F70-N194 HydrophobicContact CE2-CB 3.65Å; F70-N194 HydrophobicContact CZ-CB 3.67Å; F70-N194 WeakPolarHBondContact CZ-ND2 3.46Å; N194-V196 PolarHBondContact O-N 3.39Å
195	H	91.2	Very high	94.1	Very high	103 Å²	103	30.4 Å²	30.4	48%	0.477	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	64	12.5	-179.2	-53.8	-79.8	0	0	0	115.9	R193 I212 Q400	R193-H195 PolarHBondContact O-N 3.44Å; R193-H195 VanDerWaalsContact O-N 3.16Å; H195-I212 HydrophobicContact CB-CD1 3.96Å; H195-I212 HydrophobicContact CB-CG1 4.14Å; H195-I212 WeakPolarHBondContact O-CG1 3.49Å; H195-I212 WeakPolarHBondContact O-CG2 3.38Å; H195-Q400 PolarHBondContact ND1-OE1 3Å
196	V	95.3	Very high	94.4	Very high	26 Å²	26	30.3 Å²	30.3	16%	0.158	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	126.3	171.4	-179.9	0	0	0	0	109	L192 R193 N194 L209 I233	L192-V196 WeakPolarHBondContact CA-O 3.41Å; L192-V196 WeakPolarHBondContact CD1-O 3.49Å; R193-V196 PolarHBondContact N-O 3.06Å; R193-V196 PolarHBondContact O-N 3.33Å; N194-V196 PolarHBondContact O-N 3.39Å; V196-L209 HydrophobicContact CG1-CB 4.05Å; V196-L209 HydrophobicContact CG1-CD2 4.28Å; V196-I233 HydrophobicContact CB-CD1 4.42Å; V196-I233 HydrophobicContact CG1-CD1 4.33Å; V196-I233 WeakPolarHBondContact O-CD1 3.46Å
197	L	97.7	Very high	94.7	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	123.3	172.1	-169.6	75.6	0	0	0	108.8	L190 S191 L192 L209 I210 I212 A398 Y405 V414	L190-L197 HydrophobicContact CD1-CD1 3.67Å; L190-L197 HydrophobicContact CD1-CD2 3.97Å; L190-L197 HydrophobicContact CD1-CG 3.75Å; L190-L197 HydrophobicContact CD2-CD1 4.48Å; L190-L197 HydrophobicContact CG-CD1 4.04Å; S191-L197 CarbonylContact O-C 3.57Å; S191-L197 WeakPolarHBondContact O-CA 3.42Å; L192-L197 HydrophobicContact CB-CD1 3.93Å; L192-L197 HydrophobicContact CD1-CB 4.38Å; L192-L197 HydrophobicContact CD1-CD1 4.21Å; L197-L209 CarbonylContact O-C 3.49Å; L197-L209 WeakPolarHBondContact O-CA 3.16Å; L197-I210 HydrophobicContact CB-CB 4.24Å; L197-I210 PolarHBondContact N-O 2.93Å; L197-I210 PolarHBondContact O-N 3.33Å; L197-I212 HydrophobicContact CB-CG2 3.73Å; L197-A398 HydrophobicContact CD1-CB 4.25Å; L197-Y405 HydrophobicContact CD1-CD2 4.31Å; L197-Y405 HydrophobicContact CD1-CG 4.02Å; L197-Y405 HydrophobicContact CD2-CD1 3.91Å; L197-Y405 HydrophobicContact CD2-CG 4.07Å; L197-V414 HydrophobicContact CD2-CG1 3.6Å
198	A	98	Very high	94.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	138.2	176.6	0	0	0	0	0	110.3	L190 S191 G208 L209 L231 I233	L190-A198 WeakPolarHBondContact CA-O 3.37Å; S191-A198 PolarHBondContact N-O 3.21Å; S191-A198 PolarHBondContact O-N 3.39Å; A198-G208 CarbonylContact C-O 3.59Å; A198-G208 WeakPolarHBondContact CA-O 3.42Å; A198-L209 HydrophobicContact CB-CD2 3.49Å; A198-L209 VanDerWaalsContact CB-CD2 3.49Å; A198-L231 HydrophobicContact CB-CD1 3.33Å; A198-L231 HydrophobicContact CB-CD2 4.46Å; A198-I233 HydrophobicContact CB-CD1 3.68Å; A198-I233 HydrophobicContact CB-CG1 3.77Å
199	V	97.8	Very high	95.1	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.006	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	137	-177	-70	0	0	0	0	112.1	L181 M187 G189 L190 V207 G208 I210 V414	L181-V199 HydrophobicContact CD1-CB 4.48Å; L181-V199 HydrophobicContact CD1-CG2 3.85Å; M187-V199 HydrophobicContact CE-CB 3.59Å; M187-V199 HydrophobicContact CE-CG2 3.7Å; G189-V199 CarbonylContact O-C 3.59Å; G189-V199 WeakPolarHBondContact O-CA 3.26Å; L190-V199 HydrophobicContact CD1-CG1 3.38Å; V199-V207 CarbonylContact O-C 3.6Å; V199-V207 VanDerWaalsContact O-CA 3.24Å; V199-V207 WeakPolarHBondContact O-CA 2.99Å; V199-G208 WeakPolarHBondContact CG2-O 3.33Å; V199-G208 PolarHBondContact N-O 2.96Å; V199-G208 PolarHBondContact O-N 3.28Å; V199-I210 HydrophobicContact CG1-CD1 4.09Å; V199-I210 HydrophobicContact CG2-CD1 3.78Å; V199-V414 HydrophobicContact CG1-CG2 3.58Å
200	A	97.2	Very high	95.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	132.2	179	0	0	0	0	0	112.3	M187 V188 G189 L228 L231	M187-A200 WeakPolarHBondContact CA-O 3.44Å; M187-A200 WeakPolarHBondContact CE-O 3.38Å; V188-A200 PolarHBondContact N-O 3.31Å; G189-A200 PolarHBondContact O-N 3.41Å; A200-L228 HydrophobicContact CB-CB 3.89Å; A200-L231 HydrophobicContact CB-CD2 3.34Å; A200-L231 HydrophobicContact CB-CG 4.39Å
201	S	95.6	Very high	95.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	121	164.4	169.6	0	0	0	0	110.5	Y184 K186 S203 Y204 G205 T206	Y184-S201 WeakPolarHBondContact O-CB 3.39Å; Y184-S201 PolarHBondContact O-OG 3.47Å; K186-S201 WeakPolarHBondContact O-CA 3.5Å; S201-S203 VanDerWaalsContact C-N 3.34Å; S201-S203 PolarHBondContact OG-N 3.44Å; S201-Y204 PolarHBondContact OG-N 2.97Å; S201-Y204 VanDerWaalsContact OG-N 3.1Å; S201-G205 WeakPolarHBondContact O-CA 3.39Å; S201-G205 PolarHBondContact O-N 2.93Å; S201-T206 PolarHBondContact N-O 2.7Å
202	Y	93.4	Very high	94.9	Very high	55 Å²	55	28.4 Å²	28.4	22%	0.216	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-33.2	171.6	-173.7	-89.9	0	0	0	112.4	K186 V188 N227 L228 F229 S244	K186-Y202 PolarHBondContact O-N 3.45Å; V188-Y202 HydrophobicContact CG2-CG 4.38Å; Y202-N227 HydrophobicContact CE1-CB 4.48Å; Y202-N227 HydrophobicContact CE2-CB 4.22Å; Y202-N227 PolarHBondContact O-ND2 3.48Å; Y202-L228 VanDerWaalsContact CA-O 3.23Å; Y202-L228 WeakPolarHBondContact CA-O 3.44Å; Y202-F229 HydrophobicContact CD2-CB 4.43Å; Y202-F229 HydrophobicContact CE2-CB 4.46Å; Y202-F229 HydrophobicContact CE2-CD2 4.37Å; Y202-S244 WeakPolarHBondContact CE2-OG 3.13Å
203	S	88.9	Confident	94.6	Very high	57 Å²	57	32.1 Å²	32.1	40%	0.399	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-42.4	-172.2	-66.8	0	0	0	0	113.1	K186 S201	K186-S203 WeakPolarHBondContact CB-OG 3.17Å; K186-S203 PolarHBondContact N-OG 3.17Å; S201-S203 VanDerWaalsContact C-N 3.34Å; S201-S203 PolarHBondContact OG-N 3.44Å
204	Y	91.5	Very high	94.5	Very high	143 Å²	143	31 Å²	31	56%	0.561	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.6	-0.2	-171.6	-59.8	-57.5	0	0	0	114	Y184 S201 T206	Y184-Y204 WeakPolarHBondContact O-CD2 3.33Å; S201-Y204 PolarHBondContact OG-N 2.97Å; S201-Y204 VanDerWaalsContact OG-N 3.1Å; Y204-T206 VanDerWaalsContact C-N 3.29Å; Y204-T206 PolarHBondContact O-N 3.13Å
205	G	93.7	Very high	94.7	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.14	C	C	.	.			trans	65.4	33.7	-179.1	0	0	0	0	0	112.6	S201 C223 C226	S201-G205 WeakPolarHBondContact O-CA 3.39Å; S201-G205 PolarHBondContact O-N 2.93Å; G205-C223 WeakPolarHBondContact O-CA 3.5Å; G205-C223 WeakPolarHBondContact O-CB 3.39Å; G205-C223 PolarHBondContact O-N 2.76Å; G205-C226 WeakPolarHBondContact CA-O 3.35Å; G205-C226 PolarHBondContact N-O 2.79Å
206	T	95.7	Very high	94.9	Very high	13 Å²	13	29 Å²	29	8%	0.08	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	137.9	178.9	-49.3	0	0	0	0	110.3	Y184 S201 Y204 M221	Y184-T206 HydrophobicContact CD1-CG2 3.78Å; Y184-T206 HydrophobicContact CE1-CG2 3.91Å; S201-T206 PolarHBondContact N-O 2.7Å; Y204-T206 VanDerWaalsContact C-N 3.29Å; Y204-T206 PolarHBondContact O-N 3.13Å; T206-M221 CarbonylContact C-O 3.54Å; T206-M221 WeakPolarHBondContact CA-O 3.4Å
207	V	97.7	Very high	94.9	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	124.3	164.3	-180	0	0	0	0	109.1	V199 L209 M221 L228 L231 V239 M252	V199-V207 CarbonylContact O-C 3.6Å; V199-V207 VanDerWaalsContact O-CA 3.24Å; V199-V207 WeakPolarHBondContact O-CA 2.99Å; V207-L209 HydrophobicContact CG1-CD2 4.25Å; V207-M221 HydrophobicContact CB-CB 4.35Å; V207-M221 HydrophobicContact CB-CE 3.71Å; V207-M221 HydrophobicContact CG1-CE 3.42Å; V207-M221 VanDerWaalsContact CG1-CE 3.42Å; V207-M221 PolarHBondContact N-O 3.19Å; V207-M221 PolarHBondContact O-N 2.04Å; V207-L228 HydrophobicContact CG2-CD1 3.59Å; V207-L231 HydrophobicContact CG1-CD2 4.18Å; V207-L231 HydrophobicContact CG2-CD2 4.49Å; V207-V239 HydrophobicContact CG1-CG1 4.24Å; V207-M252 HydrophobicContact CG2-CE 3.72Å
208	G	96.9	Very high	94.7	Very high	3 Å²	3	32.1 Å²	32.1	3%	0.031	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	135.9	170.6	0	0	0	0	0	110.4	A198 V199 M217	A198-G208 CarbonylContact C-O 3.59Å; A198-G208 WeakPolarHBondContact CA-O 3.42Å; V199-G208 WeakPolarHBondContact CG2-O 3.33Å; V199-G208 PolarHBondContact N-O 2.96Å; V199-G208 PolarHBondContact O-N 3.28Å; G208-M217 WeakPolarHBondContact CA-SD 3.36Å
209	L	97.4	Very high	94.5	Very high	7 Å²	7	34.2 Å²	34.2	4%	0.037	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	131.7	167.7	-56.5	-172.9	0	0	0	109	V196 L197 A198 V207 M217 L218 T219 M221 V239 T254	V196-L209 HydrophobicContact CG1-CB 4.05Å; V196-L209 HydrophobicContact CG1-CD2 4.28Å; L197-L209 CarbonylContact O-C 3.49Å; L197-L209 WeakPolarHBondContact O-CA 3.16Å; A198-L209 HydrophobicContact CB-CD2 3.49Å; A198-L209 VanDerWaalsContact CB-CD2 3.49Å; V207-L209 HydrophobicContact CG1-CD2 4.25Å; L209-M217 VanDerWaalsContact O-SD 3.36Å; L209-L218 HydrophobicContact CB-CB 4.44Å; L209-L218 WeakPolarHBondContact O-CB 3.04Å; L209-L218 PolarHBondContact O-N 3.04Å; L209-T219 HydrophobicContact CB-CG2 3.77Å; L209-T219 HydrophobicContact CD1-CG2 3.53Å; L209-T219 HydrophobicContact CG-CG2 3.72Å; L209-T219 PolarHBondContact N-O 2.97Å; L209-M221 HydrophobicContact CD1-CE 4.13Å; L209-M221 HydrophobicContact CD2-CE 3.95Å; L209-M221 HydrophobicContact CG-CE 3.92Å; L209-V239 HydrophobicContact CD2-CG2 4.08Å; L209-T254 HydrophobicContact CD1-CG2 3.77Å
210	I	97.4	Very high	94.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	133.9	-170.6	-60.9	159.9	0	0	0	108.7	L179 L197 V199 M215 H216 M217 V414	L179-I210 HydrophobicContact CD2-CD1 3.65Å; L179-I210 HydrophobicContact CD2-CG1 3.87Å; L179-I210 HydrophobicContact CD2-CG2 4.27Å; L197-I210 HydrophobicContact CB-CB 4.24Å; L197-I210 PolarHBondContact N-O 2.93Å; L197-I210 PolarHBondContact O-N 3.33Å; V199-I210 HydrophobicContact CG1-CD1 4.09Å; V199-I210 HydrophobicContact CG2-CD1 3.78Å; I210-M215 HydrophobicContact CG2-SD 4.33Å; I210-H216 VanDerWaalsContact CA-O 3.31Å; I210-H216 WeakPolarHBondContact CA-O 3.49Å; I210-M217 HydrophobicContact CG1-CE 4.2Å; I210-M217 HydrophobicContact CG1-SD 4.03Å; I210-V414 HydrophobicContact CD1-CG2 4.12Å
211	E	95.2	Very high	94.3	Very high	38 Å²	38	38.3 Å²	38.3	18%	0.178	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	125.6	168.3	179	-173.5	-145.5	0	0	109.1	Q64 D213 S214 M215 H216 L218	Q64-E211 PolarHBondContact NE2-OE1 3Å; Q64-E211 PolarHBondContact OE1-OE1 3.1Å; E211-D213 PolarHBondContact O-N 3.4Å; E211-S214 WeakPolarHBondContact OE2-CB 3.38Å; E211-S214 PolarHBondContact OE2-OG 3.27Å; E211-M215 WeakPolarHBondContact O-CA 3.28Å; E211-M215 PolarHBondContact O-N 2.92Å; E211-H216 PolarHBondContact N-O 3.23Å; E211-L218 HydrophobicContact CB-CD1 4.08Å; E211-L218 HydrophobicContact CB-CD2 3.71Å; E211-L218 HydrophobicContact CB-CG 4.03Å
212	I	92.9	Very high	94.2	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.021	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-27.3	-169.3	63.9	166.5	0	0	0	114.1	L192 H195 L197 Y405	L192-I212 HydrophobicContact CD1-CG2 3.63Å; H195-I212 HydrophobicContact CB-CD1 3.96Å; H195-I212 HydrophobicContact CB-CG1 4.14Å; H195-I212 WeakPolarHBondContact O-CG1 3.49Å; H195-I212 WeakPolarHBondContact O-CG2 3.38Å; L197-I212 HydrophobicContact CB-CG2 3.73Å; I212-Y405 HydrophobicContact CB-CE1 4.2Å; I212-Y405 HydrophobicContact CG2-CE1 4.36Å
213	D	89	Confident	94.2	Very high	110 Å²	110	41.2 Å²	41.2	59%	0.588	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-37.8	-176.5	-69.6	-28.7	0	0	0	111.5	R177 E211	R177-D213 PolarHBondContact NH1-O 2.93Å; E211-D213 PolarHBondContact O-N 3.4Å
214	S	91.9	Very high	94.3	Very high	22 Å²	22	46.2 Å²	46.2	15%	0.154	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-27.3	176.8	66.7	0	0	0	0	112.4	R177 E211 H216	R177-S214 VanDerWaalsContact NH1-C 3.31Å; R177-S214 VanDerWaalsContact NH1-CA 3.27Å; R177-S214 PolarHBondContact NH1-O 3.08Å; E211-S214 WeakPolarHBondContact OE2-CB 3.38Å; E211-S214 PolarHBondContact OE2-OG 3.27Å; S214-H216 PolarHBondContact O-CD2 2.79Å; S214-H216 WeakPolarHBondContact OG-CB 3.09Å; S214-H216 PolarHBondContact OG-N 3.28Å; S214-H216 VanDerWaalsContact OG-N 3.13Å
215	M	94.2	Very high	94.3	Very high	6 Å²	6	41.8 Å²	41.8	3%	0.03	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	60	32.1	-164.2	-70.1	-73.5	-65.7	0	0	112.6	R177 L179 I210 E211 Y405 V414 H416	R177-M215 HydrophobicContact CB-CB 4.47Å; R177-M215 HydrophobicContact CB-CG 3.99Å; L179-M215 HydrophobicContact CB-CE 3.96Å; I210-M215 HydrophobicContact CG2-SD 4.33Å; E211-M215 WeakPolarHBondContact O-CA 3.28Å; E211-M215 PolarHBondContact O-N 2.92Å; M215-Y405 HydrophobicContact SD-CD1 4.2Å; M215-Y405 HydrophobicContact SD-CE1 4.08Å; M215-V414 HydrophobicContact CE-CB 4Å; M215-V414 HydrophobicContact CE-CG1 3.71Å; M215-H416 HydrophobicContact CE-CB 4.4Å; M215-H416 HydrophobicContact SD-CB 4.18Å
216	H	94.6	Very high	94.3	Very high	123 Å²	123	42 Å²	42	57%	0.569	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	142.9	176.5	-67	178.5	0	0	0	112.1	I210 E211 S214 L218	I210-H216 VanDerWaalsContact CA-O 3.31Å; I210-H216 WeakPolarHBondContact CA-O 3.49Å; E211-H216 PolarHBondContact N-O 3.23Å; S214-H216 PolarHBondContact O-CD2 2.79Å; S214-H216 WeakPolarHBondContact OG-CB 3.09Å; S214-H216 PolarHBondContact OG-N 3.28Å; S214-H216 VanDerWaalsContact OG-N 3.13Å; H216-L218 PolarHBondContact O-N 3.12Å
217	M	95.2	Very high	94.4	Very high	47 Å²	47	42.4 Å²	42.4	23%	0.232	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	120.1	171.9	-169.3	67.3	69.8	0	0	109.7	L179 L181 Y184 G208 L209 I210 E220	L179-M217 HydrophobicContact CD2-CE 4.42Å; L181-M217 HydrophobicContact CD2-CE 3.56Å; Y184-M217 HydrophobicContact CE2-CE 4.15Å; G208-M217 WeakPolarHBondContact CA-SD 3.36Å; L209-M217 VanDerWaalsContact O-SD 3.36Å; I210-M217 HydrophobicContact CG1-CE 4.2Å; I210-M217 HydrophobicContact CG1-SD 4.03Å; M217-E220 HydrophobicContact CG-CG 3.83Å; M217-E220 HydrophobicContact SD-CG 4.22Å
218	L	93.9	Very high	94.3	Very high	46 Å²	46	42.4 Å²	42.4	24%	0.241	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	-45.5	176.9	-60	178.5	0	0	0	111.6	L61 M65 L209 E211 H216	L61-L218 HydrophobicContact CD1-CD1 4.39Å; L61-L218 HydrophobicContact CD1-CD2 3.38Å; L61-L218 HydrophobicContact CD1-CG 4.34Å; M65-L218 HydrophobicContact CE-CD1 4.19Å; L209-L218 HydrophobicContact CB-CB 4.44Å; L209-L218 WeakPolarHBondContact O-CB 3.04Å; L209-L218 PolarHBondContact O-N 3.04Å; E211-L218 HydrophobicContact CB-CD1 4.08Å; E211-L218 HydrophobicContact CB-CD2 3.71Å; E211-L218 HydrophobicContact CB-CG 4.03Å; H216-L218 PolarHBondContact O-N 3.12Å
219	T	94.4	Very high	94.3	Very high	43 Å²	43	43.5 Å²	43.5	26%	0.264	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	158.2	-178.4	-175.2	0	0	0	0	110.7	L209	L209-T219 HydrophobicContact CB-CG2 3.77Å; L209-T219 HydrophobicContact CD1-CG2 3.53Å; L209-T219 HydrophobicContact CG-CG2 3.72Å; L209-T219 PolarHBondContact N-O 2.97Å
220	E	94.8	Very high	94.3	Very high	86 Å²	86	43.4 Å²	43.4	40%	0.402	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	124.4	-179.8	-59	176.5	-154.8	0	0	108.2	R183 Y184 M217	R183-E220 IonicContact CZ-OE1 2.83Å; R183-E220 IonicContact NH2-OE1 3.11Å; R183-E220 PolarHBondContact NH2-OE1 3.31Å; Y184-E220 WeakPolarHBondContact CE1-OE2 3.46Å; Y184-E220 PolarHBondContact OH-OE1 3.26Å; Y184-E220 PolarHBondContact OH-OE2 2.84Å; M217-E220 HydrophobicContact CG-CG 3.83Å; M217-E220 HydrophobicContact SD-CG 4.22Å
221	M	95.3	Very high	94.3	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.7	179.7	-58.3	177.3	-71.4	0	0	109.1	T206 V207 L209 V239 T254	T206-M221 CarbonylContact C-O 3.54Å; T206-M221 WeakPolarHBondContact CA-O 3.4Å; V207-M221 HydrophobicContact CB-CB 4.35Å; V207-M221 HydrophobicContact CB-CE 3.71Å; V207-M221 HydrophobicContact CG1-CE 3.42Å; V207-M221 VanDerWaalsContact CG1-CE 3.42Å; V207-M221 PolarHBondContact N-O 3.19Å; V207-M221 PolarHBondContact O-N 2.04Å; L209-M221 HydrophobicContact CD1-CE 4.13Å; L209-M221 HydrophobicContact CD2-CE 3.95Å; L209-M221 HydrophobicContact CG-CE 3.92Å; M221-V239 HydrophobicContact CE-CB 4.21Å; M221-V239 HydrophobicContact CE-CG2 3.76Å; M221-T254 VanDerWaalsContact SD-CA 3.56Å
222	I	94.5	Very high	94.5	Very high	116 Å²	116	42.1 Å²	42.1	60%	0.595	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	118.5	-177	-58.1	175.9	0	0	0	109.3	E224	I222-E224 HydrophobicContact CG2-CG 3.98Å
223	C	93.7	Very high	94.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.225	C	C	.	.			trans	-97.4	89.1	168.1	-166.3	0	0	0	0	108.3	G205 G225 C226 L228 I250 M252 R258	G205-C223 WeakPolarHBondContact O-CA 3.5Å; G205-C223 WeakPolarHBondContact O-CB 3.39Å; G205-C223 PolarHBondContact O-N 2.76Å; C223-G225 PolarHBondContact O-N 3.04Å; C223-C226 HydrophobicContact CB-CB 3.61Å; C223-C226 WeakPolarHBondContact CB-SG 3.31Å; C223-C226 WeakPolarHBondContact O-CB 3.41Å; C223-C226 PolarHBondContact O-N 2.93Å; C223-C226 VanDerWaalsContact O-N 3.08Å; C223-C226 PolarHBondContact O-SG 2.85Å; C223-C226 WeakPolarHBondContact SG-CB 3.47Å; C223-C226 CovalentContact SG-SG 2.04Å; C223-C226 PolarHBondContact SG-SG 2.93Å; C223-L228 HydrophobicContact CB-CD1 4.21Å; C223-L228 HydrophobicContact CB-CD2 4.47Å; C223-I250 WeakPolarHBondContact SG-CD1 3.48Å; C223-M252 HydrophobicContact CB-SD 4.14Å; C223-R258 PolarHBondContact SG-NH2 3.38Å; C223-R258 VanDerWaalsContact SG-NH2 3.37Å
224	E	91	Very high	95	Very high	162 Å²	162	37.2 Å²	37.2	76%	0.757	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	126.6	-176.2	-68.1	-172.5	172.6	0	0	112.1	I222 C226	I222-E224 HydrophobicContact CG2-CG 3.98Å; E224-C226 PolarHBondContact O-N 2.82Å
225	G	90.5	Very high	95	Very high	50 Å²	50	38.8 Å²	38.8	52%	0.515	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.3	-1	178.9	0	0	0	0	0	115.4	C223 R246	C223-G225 PolarHBondContact O-N 3.04Å; G225-R246 VanDerWaalsContact O-CZ 3.22Å; G225-R246 PolarHBondContact O-NH1 2.77Å; G225-R246 PolarHBondContact O-NH2 2.57Å
226	C	94.8	Very high	94.9	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.02	23%	0.227	C	C	.	.			trans	-80.7	149	-175	-49	0	0	0	0	112.9	G205 C223 E224 L228 I250	G205-C226 WeakPolarHBondContact CA-O 3.35Å; G205-C226 PolarHBondContact N-O 2.79Å; C223-C226 HydrophobicContact CB-CB 3.61Å; C223-C226 WeakPolarHBondContact CB-SG 3.31Å; C223-C226 WeakPolarHBondContact O-CB 3.41Å; C223-C226 PolarHBondContact O-N 2.93Å; C223-C226 VanDerWaalsContact O-N 3.08Å; C223-C226 PolarHBondContact O-SG 2.85Å; C223-C226 WeakPolarHBondContact SG-CB 3.47Å; C223-C226 CovalentContact SG-SG 2.04Å; C223-C226 PolarHBondContact SG-SG 2.93Å; E224-C226 PolarHBondContact O-N 2.82Å; C226-L228 HydrophobicContact CB-CD2 3.75Å; C226-L228 HydrophobicContact CB-CG 4.16Å; C226-I250 HydrophobicContact CB-CD1 4.41Å
227	N	96.1	Very high	94.8	Very high	22 Å²	22	36.8 Å²	36.8	12%	0.118	20%	0.203	C	C	.	.			trans	-114	81.9	169.9	-74.4	112.3	0	0	0	110.4	Y202 F229 D243 S244 K245	Y202-N227 HydrophobicContact CE1-CB 4.48Å; Y202-N227 HydrophobicContact CE2-CB 4.22Å; Y202-N227 PolarHBondContact O-ND2 3.48Å; N227-F229 PolarHBondContact O-N 2.97Å; N227-D243 PolarHBondContact N-OD1 3.27Å; N227-S244 PolarHBondContact O-N 2.86Å; N227-S244 PolarHBondContact O-OG 2.81Å; N227-K245 HydrophobicContact CB-CB 4.32Å; N227-K245 HydrophobicContact CB-CD 4.25Å; N227-K245 HydrophobicContact CB-CG 3.89Å; N227-K245 WeakPolarHBondContact OD1-CD 3.04Å; N227-K245 VanDerWaalsContact OD1-CE 3.27Å; N227-K245 WeakPolarHBondContact OD1-CE 3.33Å; N227-K245 PolarHBondContact OD1-NZ 2.88Å
228	L	96.8	Very high	94.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	110.3	-172.5	-55.2	-178.4	0	0	0	110.7	A200 Y202 V207 C223 C226 A241 V242	A200-L228 HydrophobicContact CB-CB 3.89Å; Y202-L228 VanDerWaalsContact CA-O 3.23Å; Y202-L228 WeakPolarHBondContact CA-O 3.44Å; V207-L228 HydrophobicContact CG2-CD1 3.59Å; C223-L228 HydrophobicContact CB-CD1 4.21Å; C223-L228 HydrophobicContact CB-CD2 4.47Å; C226-L228 HydrophobicContact CB-CD2 3.75Å; C226-L228 HydrophobicContact CB-CG 4.16Å; L228-A241 HydrophobicContact CD1-CB 4.45Å; L228-A241 HydrophobicContact CD2-CB 3.92Å; L228-V242 VanDerWaalsContact CA-O 3.3Å; L228-V242 WeakPolarHBondContact CA-O 3.4Å
229	F	96	Very high	95	Very high	27 Å²	27	33.1 Å²	33.1	12%	0.118	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-45.1	178.3	-178.4	-87.9	0	0	0	111.6	V188 G189 Y202 N227 V242 K269 K313 Y314	V188-F229 HydrophobicContact CG1-CD2 4.35Å; V188-F229 HydrophobicContact CG1-CE2 4.27Å; V188-F229 WeakPolarHBondContact CG1-O 3.17Å; G189-F229 PolarHBondContact N-O 2.68Å; Y202-F229 HydrophobicContact CD2-CB 4.43Å; Y202-F229 HydrophobicContact CE2-CB 4.46Å; Y202-F229 HydrophobicContact CE2-CD2 4.37Å; N227-F229 PolarHBondContact O-N 2.97Å; F229-V242 PolarHBondContact N-O 3.11Å; F229-K269 VanDerWaalsContact CD1-C 3.46Å; F229-K269 VanDerWaalsContact CD1-CA 3.49Å; F229-K269 HydrophobicContact CD1-CB 4.45Å; F229-K269 HydrophobicContact CD1-CD 4.32Å; F229-K269 HydrophobicContact CD2-CD 4.41Å; F229-K269 HydrophobicContact CE1-CB 4.2Å; F229-K269 HydrophobicContact CE1-CD 3.82Å; F229-K269 HydrophobicContact CE2-CD 3.9Å; F229-K269 HydrophobicContact CZ-CD 3.6Å; F229-K313 WeakPolarHBondContact CE1-O 3.46Å; F229-K313 HydrophobicContact CZ-CB 4.21Å; F229-Y314 HydrophobicContact CE1-CE2 4.25Å; F229-Y314 HydrophobicContact CZ-CE2 4.13Å
230	D	97.6	Very high	95.2	Very high	5 Å²	5	31 Å²	31	3%	0.027	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	164.3	-178.2	-164.4	17.3	0	0	0	110.9	G189 A241 V242 G270 I271	G189-D230 WeakPolarHBondContact CA-OD1 3.34Å; D230-A241 WeakPolarHBondContact O-CA 3.46Å; D230-V242 PolarHBondContact O-N 2.88Å; D230-G270 WeakPolarHBondContact OD2-CA 3.43Å; D230-I271 HydrophobicContact CB-CG2 4.08Å; D230-I271 PolarHBondContact OD2-N 2.73Å
231	L	98.3	Very high	95.3	Very high	1 Å²	1	27 Å²	27	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	158.6	-179.4	76.6	97.4	0	0	0	111.6	S191 A198 A200 V207 V239 V240 A241 I271	S191-L231 WeakPolarHBondContact CB-O 3.36Å; A198-L231 HydrophobicContact CB-CD1 3.33Å; A198-L231 HydrophobicContact CB-CD2 4.46Å; A200-L231 HydrophobicContact CB-CD2 3.34Å; A200-L231 HydrophobicContact CB-CG 4.39Å; V207-L231 HydrophobicContact CG1-CD2 4.18Å; V207-L231 HydrophobicContact CG2-CD2 4.49Å; L231-V239 HydrophobicContact CB-CG1 4.19Å; L231-V239 HydrophobicContact CD1-CG1 4Å; L231-V240 CarbonylContact C-O 3.51Å; L231-V240 WeakPolarHBondContact CA-O 3.2Å; L231-V240 WeakPolarHBondContact CB-O 3.47Å; L231-A241 HydrophobicContact CB-CB 3.91Å; L231-I271 VanDerWaalsContact CA-CG2 3.5Å
232	D	97.9	Very high	95.5	Very high	10 Å²	10	26.9 Å²	26.9	5%	0.053	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	161.8	164.9	-155	-14.5	0	0	0	110.9	S191 V240 S272 V273	S191-D232 WeakPolarHBondContact CB-OD1 3.38Å; S191-D232 PolarHBondContact OG-OD1 2.86Å; D232-V240 HydrophobicContact CB-CG2 4.45Å; D232-V240 PolarHBondContact N-O 2.94Å; D232-V240 WeakPolarHBondContact O-CG2 3.19Å; D232-V240 PolarHBondContact O-N 2.84Å; D232-S272 WeakPolarHBondContact OD2-CA 3.42Å; D232-S272 WeakPolarHBondContact OD2-CB 3.48Å; D232-S272 PolarHBondContact OD2-OG 2.98Å; D232-V273 HydrophobicContact CB-CB 4.38Å; D232-V273 HydrophobicContact CB-CG2 3.94Å; D232-V273 PolarHBondContact OD2-N 2.88Å
233	I	96.9	Very high	95.6	Very high	7 Å²	7	21.3 Å²	21.3	4%	0.036	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	126	-179.9	-52.2	172.3	0	0	0	107.9	R193 V196 A198	R193-I233 HydrophobicContact CB-CB 3.88Å; R193-I233 HydrophobicContact CB-CD1 4.07Å; R193-I233 HydrophobicContact CB-CG2 4.15Å; R193-I233 WeakPolarHBondContact CD-O 3.27Å; R193-I233 PolarHBondContact NE-O 2.91Å; R193-I233 PolarHBondContact NH2-O 2.92Å; V196-I233 HydrophobicContact CB-CD1 4.42Å; V196-I233 HydrophobicContact CG1-CD1 4.33Å; V196-I233 WeakPolarHBondContact O-CD1 3.46Å; A198-I233 HydrophobicContact CB-CD1 3.68Å; A198-I233 HydrophobicContact CB-CG1 3.77Å
234	M	95.8	Very high	95.6	Very high	3 Å²	3	22.2 Å²	22.2	2%	0.015	13%	0.13	C	C	.	.			trans	-72.7	159	174.4	-65.6	-164.6	74.7	0	0	111.6	N236 G237 D238 V240 K251 V273 I279 Q294	M234-N236 WeakPolarHBondContact CB-OD1 3.46Å; M234-N236 PolarHBondContact O-N 3.29Å; M234-N236 VanDerWaalsContact O-N 3.14Å; M234-G237 PolarHBondContact O-N 3.03Å; M234-D238 HydrophobicContact CB-CB 4.35Å; M234-D238 WeakPolarHBondContact CB-O 3.46Å; M234-D238 HydrophobicContact CG-CB 4.48Å; M234-D238 PolarHBondContact N-O 2.84Å; M234-D238 HydrophobicContact SD-CB 4.31Å; M234-V240 HydrophobicContact CG-CG1 3.92Å; M234-V240 HydrophobicContact CG-CG2 4.39Å; M234-V240 HydrophobicContact SD-CG1 3.75Å; M234-K251 HydrophobicContact SD-CD 3.86Å; M234-K251 WeakPolarHBondContact SD-CE 3.09Å; M234-K251 HydrophobicContact SD-CG 4.43Å; M234-K251 PolarHBondContact SD-NZ 3Å; M234-V273 HydrophobicContact CG-CG1 4.43Å; M234-V273 HydrophobicContact CG-CG2 4.19Å; M234-I279 HydrophobicContact CE-CD1 4.44Å; M234-Q294 HydrophobicContact CE-CB 3.77Å
235	P	92.7	Very high	95.7	Very high	56 Å²	56	21 Å²	21	36%	0.364	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-32.1	175.7	-26	32.7	0	0	0	114.6	G237	P235-G237 VanDerWaalsContact C-N 3.25Å; P235-G237 PolarHBondContact O-N 2.79Å
236	N	91.8	Very high	95.9	Very high	81 Å²	81	23.6 Å²	23.6	43%	0.433	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-0.3	177.8	72.4	-20	0	0	0	113.8	M234 D238	M234-N236 WeakPolarHBondContact CB-OD1 3.46Å; M234-N236 PolarHBondContact O-N 3.29Å; M234-N236 VanDerWaalsContact O-N 3.14Å; N236-D238 PolarHBondContact ND2-OD2 2.79Å; N236-D238 WeakPolarHBondContact OD1-CB 3.22Å; N236-D238 PolarHBondContact OD1-N 3.18Å; N236-D238 VanDerWaalsContact OD1-N 3.1Å
237	G	92.7	Very high	95.9	Very high	6 Å²	6	25.4 Å²	25.4	6%	0.062	13%	0.125	C	C	.	.	S	Bend	trans	90.5	-8.2	-179.5	0	0	0	0	0	115	M234 P235 T254	M234-G237 PolarHBondContact O-N 3.03Å; P235-G237 VanDerWaalsContact C-N 3.25Å; P235-G237 PolarHBondContact O-N 2.79Å; G237-T254 WeakPolarHBondContact O-CG2 3.34Å
238	D	95.8	Very high	95.9	Very high	14 Å²	14	28.9 Å²	28.9	8%	0.075	14%	0.136	C	C	.	.			trans	-63.7	147.8	172.4	-69.2	-24.5	0	0	0	110.4	M234 N236 K251 M252 R253	M234-D238 HydrophobicContact CB-CB 4.35Å; M234-D238 WeakPolarHBondContact CB-O 3.46Å; M234-D238 HydrophobicContact CG-CB 4.48Å; M234-D238 PolarHBondContact N-O 2.84Å; M234-D238 HydrophobicContact SD-CB 4.31Å; N236-D238 PolarHBondContact ND2-OD2 2.79Å; N236-D238 WeakPolarHBondContact OD1-CB 3.22Å; N236-D238 PolarHBondContact OD1-N 3.18Å; N236-D238 VanDerWaalsContact OD1-N 3.1Å; D238-K251 HydrophobicContact CB-CG 4.23Å; D238-K251 WeakPolarHBondContact OD2-CE 3.39Å; D238-K251 IonicContact OD2-NZ 3.6Å; D238-K251 PolarHBondContact OD2-NZ 2.81Å; D238-M252 CarbonylContact C-O 3.57Å; D238-M252 WeakPolarHBondContact CA-O 3.24Å; D238-R253 WeakPolarHBondContact OD1-CA 3.5Å; D238-R253 VanDerWaalsContact OD1-CG 3.27Å; D238-R253 WeakPolarHBondContact OD1-CG 2.89Å
239	V	97.9	Very high	95.9	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	133.9	173.9	176.3	0	0	0	0	109.6	V207 L209 M221 L231 K251 M252	V207-V239 HydrophobicContact CG1-CG1 4.24Å; L209-V239 HydrophobicContact CD2-CG2 4.08Å; M221-V239 HydrophobicContact CE-CB 4.21Å; M221-V239 HydrophobicContact CE-CG2 3.76Å; L231-V239 HydrophobicContact CB-CG1 4.19Å; L231-V239 HydrophobicContact CD1-CG1 4Å; V239-K251 CarbonylContact O-C 3.52Å; V239-K251 WeakPolarHBondContact O-CA 3.35Å; V239-M252 PolarHBondContact N-O 2.89Å; V239-M252 PolarHBondContact O-N 2.91Å
240	V	98	Very high	96	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	138.6	166.7	-66.6	0	0	0	0	109.4	L231 D232 M234 I250 K251 I271 V273 I279 L296	L231-V240 CarbonylContact C-O 3.51Å; L231-V240 WeakPolarHBondContact CA-O 3.2Å; L231-V240 WeakPolarHBondContact CB-O 3.47Å; D232-V240 HydrophobicContact CB-CG2 4.45Å; D232-V240 PolarHBondContact N-O 2.94Å; D232-V240 WeakPolarHBondContact O-CG2 3.19Å; D232-V240 PolarHBondContact O-N 2.84Å; M234-V240 HydrophobicContact CG-CG1 3.92Å; M234-V240 HydrophobicContact CG-CG2 4.39Å; M234-V240 HydrophobicContact SD-CG1 3.75Å; V240-I250 CarbonylContact C-O 3.56Å; V240-I250 VanDerWaalsContact CA-O 3.26Å; V240-I250 WeakPolarHBondContact CA-O 3.42Å; V240-K251 HydrophobicContact CG1-CB 4.01Å; V240-K251 HydrophobicContact CG1-CD 4.33Å; V240-K251 HydrophobicContact CG1-CG 3.88Å; V240-I271 HydrophobicContact CB-CD1 4.07Å; V240-I271 HydrophobicContact CG2-CD1 3.86Å; V240-I271 HydrophobicContact CG2-CG1 4.39Å; V240-V273 HydrophobicContact CG2-CG2 3.47Å; V240-V273 VanDerWaalsContact CG2-CG2 3.47Å; V240-I279 HydrophobicContact CG1-CD1 3.96Å; V240-I279 HydrophobicContact CG2-CG2 4.32Å; V240-L296 HydrophobicContact CG1-CD2 4.26Å
241	A	98.1	Very high	96	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	153.8	-178.1	0	0	0	0	0	111.6	L228 D230 L231 V249 I250	L228-A241 HydrophobicContact CD1-CB 4.45Å; L228-A241 HydrophobicContact CD2-CB 3.92Å; D230-A241 WeakPolarHBondContact O-CA 3.46Å; L231-A241 HydrophobicContact CB-CB 3.91Å; A241-V249 WeakPolarHBondContact O-CA 3.34Å; A241-I250 PolarHBondContact N-O 2.82Å; A241-I250 PolarHBondContact O-N 2.93Å
242	V	97.8	Very high	96	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	115.9	178	169.9	0	0	0	0	110.4	L228 F229 D230 S244 R248 V249 A267 I271	L228-V242 VanDerWaalsContact CA-O 3.3Å; L228-V242 WeakPolarHBondContact CA-O 3.4Å; F229-V242 PolarHBondContact N-O 3.11Å; D230-V242 PolarHBondContact O-N 2.88Å; V242-S244 PolarHBondContact O-N 3.3Å; V242-R248 WeakPolarHBondContact CA-O 3.5Å; V242-V249 HydrophobicContact CG2-CG2 4.33Å; V242-A267 VanDerWaalsContact CG1-O 3.28Å; V242-A267 WeakPolarHBondContact CG1-O 3.41Å; V242-I271 HydrophobicContact CG2-CB 3.67Å; V242-I271 HydrophobicContact CG2-CD1 3.91Å; V242-I271 HydrophobicContact CG2-CG1 4.31Å; V242-I271 HydrophobicContact CG2-CG2 3.98Å
243	D	96.8	Very high	95.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	94.7	163.5	-177.2	3.9	0	0	0	109.6	N227 K245 R246 E247 R248 I250	N227-D243 PolarHBondContact N-OD1 3.27Å; D243-K245 VanDerWaalsContact C-N 3.26Å; D243-K245 PolarHBondContact O-N 3.34Å; D243-K245 PolarHBondContact OD1-N 3.05Å; D243-R246 PolarHBondContact O-N 2.87Å; D243-R246 WeakPolarHBondContact OD2-CD 3.36Å; D243-R246 WeakPolarHBondContact OD2-CG 3.17Å; D243-R246 IonicContact OD2-CZ 3.66Å; D243-R246 IonicContact OD2-NH1 3.9Å; D243-R246 PolarHBondContact OD2-NH1 3.36Å; D243-E247 PolarHBondContact O-N 3.19Å; D243-R248 HydrophobicContact CB-CB 4.35Å; D243-R248 PolarHBondContact N-O 2.85Å; D243-R248 PolarHBondContact O-N 3.36Å; D243-I250 HydrophobicContact CB-CD1 3.88Å
244	S	94.5	Very high	95.5	Very high	18 Å²	18	33.3 Å²	33.3	13%	0.126	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-25.7	-172	58	0	0	0	0	115.4	Y202 N227 V242 N268	Y202-S244 WeakPolarHBondContact CE2-OG 3.13Å; N227-S244 PolarHBondContact O-N 2.86Å; N227-S244 PolarHBondContact O-OG 2.81Å; V242-S244 PolarHBondContact O-N 3.3Å; S244-N268 WeakPolarHBondContact CB-O 3.48Å
245	K	93.1	Very high	95.2	Very high	136 Å²	136	37.7 Å²	37.7	59%	0.591	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-25.4	-179.2	-72.2	-161.4	-165.6	150.5	0	113.1	N227 D243	N227-K245 HydrophobicContact CB-CB 4.32Å; N227-K245 HydrophobicContact CB-CD 4.25Å; N227-K245 HydrophobicContact CB-CG 3.89Å; N227-K245 WeakPolarHBondContact OD1-CD 3.04Å; N227-K245 VanDerWaalsContact OD1-CE 3.27Å; N227-K245 WeakPolarHBondContact OD1-CE 3.33Å; N227-K245 PolarHBondContact OD1-NZ 2.88Å; D243-K245 VanDerWaalsContact C-N 3.26Å; D243-K245 PolarHBondContact O-N 3.34Å; D243-K245 PolarHBondContact OD1-N 3.05Å
246	R	94.3	Very high	95	Very high	105 Å²	105	36.3 Å²	36.3	40%	0.396	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-2.2	-179.5	-60	-167.6	-176.2	88.8	1.5	113.2	G225 D243 R248 H263	G225-R246 VanDerWaalsContact O-CZ 3.22Å; G225-R246 PolarHBondContact O-NH1 2.77Å; G225-R246 PolarHBondContact O-NH2 2.57Å; D243-R246 PolarHBondContact O-N 2.87Å; D243-R246 WeakPolarHBondContact OD2-CD 3.36Å; D243-R246 WeakPolarHBondContact OD2-CG 3.17Å; D243-R246 IonicContact OD2-CZ 3.66Å; D243-R246 IonicContact OD2-NH1 3.9Å; D243-R246 PolarHBondContact OD2-NH1 3.36Å; R246-R248 VanDerWaalsContact C-N 3.32Å; R246-R248 HydrophobicContact CB-CG 3.88Å; R246-R248 WeakPolarHBondContact O-CG 3.41Å; R246-R248 PolarHBondContact O-N 2.8Å; R246-H263 PolarHBondContact O-ND1 2.76Å
247	E	94.3	Very high	95.1	Very high	41 Å²	41	37 Å²	37	19%	0.192	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	53.5	-174.6	-51.3	-169.5	144	0	0	111	D243 H263 V264 H265 G266 A267 N268	D243-E247 PolarHBondContact O-N 3.19Å; E247-H263 WeakPolarHBondContact O-CA 3.3Å; E247-H263 PolarHBondContact O-ND1 3.18Å; E247-H263 IonicContact OE2-CE1 2.92Å; E247-V264 PolarHBondContact O-N 3.01Å; E247-H265 IonicContact OE2-ND1 3.4Å; E247-G266 VanDerWaalsContact CD-N 3.34Å; E247-G266 WeakPolarHBondContact OE1-CA 3.48Å; E247-G266 PolarHBondContact OE2-N 3.39Å; E247-A267 WeakPolarHBondContact CA-O 3.35Å; E247-N268 HydrophobicContact CG-CB 4.49Å
248	R	96	Very high	95.1	Very high	95 Å²	95	41.2 Å²	41.2	36%	0.358	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	141.1	-179.8	-59.2	-173.3	-179.9	173	-4.9	110.8	V242 D243 R246 I250 E261 R262	V242-R248 WeakPolarHBondContact CA-O 3.5Å; D243-R248 HydrophobicContact CB-CB 4.35Å; D243-R248 PolarHBondContact N-O 2.85Å; D243-R248 PolarHBondContact O-N 3.36Å; R246-R248 VanDerWaalsContact C-N 3.32Å; R246-R248 HydrophobicContact CB-CG 3.88Å; R246-R248 WeakPolarHBondContact O-CG 3.41Å; R246-R248 PolarHBondContact O-N 2.8Å; R248-I250 HydrophobicContact CB-CG1 4.36Å; R248-E261 HydrophobicContact CB-CG 4.39Å; R248-E261 WeakPolarHBondContact CD-OE1 3.28Å; R248-E261 IonicContact CZ-OE1 3.45Å; R248-E261 IonicContact NE-OE1 3.29Å; R248-E261 IonicContact NH1-OE1 3.64Å; R248-E261 PolarHBondContact NH1-OE1 3.41Å; R248-R262 CarbonylContact C-O 3.58Å; R248-R262 WeakPolarHBondContact CA-O 3.45Å; R248-R262 WeakPolarHBondContact CB-O 3.44Å
249	V	97.8	Very high	95	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	130.2	163.2	-176.8	0	0	0	0	107.7	A241 V242 E261 R262 V264 A267 I271 T281 L292 L296	A241-V249 WeakPolarHBondContact O-CA 3.34Å; V242-V249 HydrophobicContact CG2-CG2 4.33Å; V249-E261 WeakPolarHBondContact O-CA 3.34Å; V249-R262 PolarHBondContact N-O 3.32Å; V249-R262 PolarHBondContact O-N 3.1Å; V249-V264 HydrophobicContact CB-CG2 4.4Å; V249-V264 HydrophobicContact CG2-CB 4.35Å; V249-V264 HydrophobicContact CG2-CG2 3.99Å; V249-A267 HydrophobicContact CG2-CB 4.23Å; V249-I271 HydrophobicContact CG1-CD1 3.71Å; V249-I271 HydrophobicContact CG2-CD1 4.44Å; V249-T281 HydrophobicContact CG2-CG2 4.25Å; V249-L292 HydrophobicContact CB-CD1 4.04Å; V249-L292 HydrophobicContact CG1-CD1 4.14Å; V249-L292 HydrophobicContact CG2-CD1 3.8Å; V249-L296 HydrophobicContact CG1-CD1 4.29Å; V249-L296 HydrophobicContact CG1-CD2 3.81Å; V249-L296 WeakPolarHBondContact O-CD1 3.3Å
250	I	97.6	Very high	94.8	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	130.8	-174.4	-52.8	176.1	0	0	0	107.6	C223 C226 V240 A241 D243 R248 M252 R258 E261	C223-I250 WeakPolarHBondContact SG-CD1 3.48Å; C226-I250 HydrophobicContact CB-CD1 4.41Å; V240-I250 CarbonylContact C-O 3.56Å; V240-I250 VanDerWaalsContact CA-O 3.26Å; V240-I250 WeakPolarHBondContact CA-O 3.42Å; A241-I250 PolarHBondContact N-O 2.82Å; A241-I250 PolarHBondContact O-N 2.93Å; D243-I250 HydrophobicContact CB-CD1 3.88Å; R248-I250 HydrophobicContact CB-CG1 4.36Å; I250-M252 HydrophobicContact CG2-CG 4.16Å; I250-R258 HydrophobicContact CG2-CG 3.9Å; I250-E261 HydrophobicContact CG1-CG 4.08Å
251	K	97.8	Very high	94.8	Very high	16 Å²	16	46.1 Å²	46.1	7%	0.07	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	129.6	174.6	-173	176.5	168.9	162.8	0	109.8	M234 D238 V239 V240 V259 A260 Q294 L296	M234-K251 HydrophobicContact SD-CD 3.86Å; M234-K251 WeakPolarHBondContact SD-CE 3.09Å; M234-K251 HydrophobicContact SD-CG 4.43Å; M234-K251 PolarHBondContact SD-NZ 3Å; D238-K251 HydrophobicContact CB-CG 4.23Å; D238-K251 WeakPolarHBondContact OD2-CE 3.39Å; D238-K251 IonicContact OD2-NZ 3.6Å; D238-K251 PolarHBondContact OD2-NZ 2.81Å; V239-K251 CarbonylContact O-C 3.52Å; V239-K251 WeakPolarHBondContact O-CA 3.35Å; V240-K251 HydrophobicContact CG1-CB 4.01Å; V240-K251 HydrophobicContact CG1-CD 4.33Å; V240-K251 HydrophobicContact CG1-CG 3.88Å; K251-V259 HydrophobicContact CB-CG2 3.85Å; K251-V259 HydrophobicContact CD-CG2 3.84Å; K251-V259 HydrophobicContact CG-CG2 3.5Å; K251-V259 WeakPolarHBondContact O-CG2 3.49Å; K251-V259 PolarHBondContact O-N 3.41Å; K251-A260 HydrophobicContact CB-CB 4.19Å; K251-A260 PolarHBondContact N-O 3.48Å; K251-A260 PolarHBondContact O-N 3.04Å; K251-Q294 PolarHBondContact NZ-O 3.44Å; K251-L296 HydrophobicContact CB-CD1 3.99Å; K251-L296 HydrophobicContact CB-CD2 4.37Å; K251-L296 HydrophobicContact CB-CG 4.39Å
252	M	97.3	Very high	94.6	Very high	1 Å²	1	52 Å²	52	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	139	-179.1	-63.5	175.8	-68.6	0	0	109.6	V207 C223 D238 V239 I250 Q257	V207-M252 HydrophobicContact CG2-CE 3.72Å; C223-M252 HydrophobicContact CB-SD 4.14Å; D238-M252 CarbonylContact C-O 3.57Å; D238-M252 WeakPolarHBondContact CA-O 3.24Å; V239-M252 PolarHBondContact N-O 2.89Å; V239-M252 PolarHBondContact O-N 2.91Å; I250-M252 HydrophobicContact CG2-CG 4.16Å; M252-Q257 CarbonylContact C-O 3.56Å; M252-Q257 WeakPolarHBondContact CA-O 3.16Å
253	R	95.6	Very high	94.5	Very high	107 Å²	107	57.2 Å²	57.2	40%	0.404	26%	0.263	S	S	.	.			trans	-73.4	153.6	163.8	-75.7	170.3	179.4	164.5	1.2	109.2	D238 N255 G256 Q257 V259	D238-R253 WeakPolarHBondContact OD1-CA 3.5Å; D238-R253 VanDerWaalsContact OD1-CG 3.27Å; D238-R253 WeakPolarHBondContact OD1-CG 2.89Å; R253-N255 WeakPolarHBondContact CB-OD1 3.32Å; R253-N255 PolarHBondContact O-N 3.44Å; R253-N255 VanDerWaalsContact O-N 3.1Å; R253-G256 WeakPolarHBondContact O-CA 3.28Å; R253-G256 PolarHBondContact O-N 3.49Å; R253-Q257 HydrophobicContact CB-CB 4.33Å; R253-Q257 PolarHBondContact N-O 3.19Å; R253-V259 HydrophobicContact CG-CG1 3.67Å
254	T	89.9	Confident	94.3	Very high	19 Å²	19	57.7 Å²	57.7	12%	0.117	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-23.5	176.7	166.4	0	0	0	0	114.1	W72 L209 M221 G237 G256	W72-T254 HydrophobicContact CH2-CG2 3.27Å; W72-T254 HydrophobicContact CZ2-CG2 3.27Å; W72-T254 HydrophobicContact CZ3-CG2 4.17Å; L209-T254 HydrophobicContact CD1-CG2 3.77Å; M221-T254 VanDerWaalsContact SD-CA 3.56Å; G237-T254 WeakPolarHBondContact O-CG2 3.34Å; T254-G256 PolarHBondContact O-N 2.89Å
255	N	89.5	Confident	93.9	Very high	96 Å²	96	61.9 Å²	61.9	51%	0.513	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	6.7	171.6	71.1	-4.8	0	0	0	113.8	R253 Q257	R253-N255 WeakPolarHBondContact CB-OD1 3.32Å; R253-N255 PolarHBondContact O-N 3.44Å; R253-N255 VanDerWaalsContact O-N 3.1Å; N255-Q257 VanDerWaalsContact C-N 3.33Å; N255-Q257 PolarHBondContact O-N 3.04Å; N255-Q257 WeakPolarHBondContact OD1-CB 3.49Å; N255-Q257 PolarHBondContact OD1-N 3.15Å
256	G	89.2	Confident	93.6	Very high	27 Å²	27	55.4 Å²	55.4	28%	0.278	26%	0.255	S	S	.	.	S	Bend	trans	84.5	-4.6	-179.2	0	0	0	0	0	115.1	R253 T254 R258	R253-G256 WeakPolarHBondContact O-CA 3.28Å; R253-G256 PolarHBondContact O-N 3.49Å; T254-G256 PolarHBondContact O-N 2.89Å; G256-R258 PolarHBondContact O-N 3.09Å
257	Q	93	Very high	93.4	Very high	94 Å²	94	50.4 Å²	50.4	44%	0.439	24%	0.237	S	C	.	.			trans	-68.8	120.3	178.9	-175.8	-178.5	11	0	0	110.8	M252 R253 N255 V259	M252-Q257 CarbonylContact C-O 3.56Å; M252-Q257 WeakPolarHBondContact CA-O 3.16Å; R253-Q257 HydrophobicContact CB-CB 4.33Å; R253-Q257 PolarHBondContact N-O 3.19Å; N255-Q257 VanDerWaalsContact C-N 3.33Å; N255-Q257 PolarHBondContact O-N 3.04Å; N255-Q257 WeakPolarHBondContact OD1-CB 3.49Å; N255-Q257 PolarHBondContact OD1-N 3.15Å; Q257-V259 HydrophobicContact CG-CG1 4.34Å; Q257-V259 PolarHBondContact O-N 3.34Å
258	R	92.1	Very high	93.4	Very high	96 Å²	96	49.3 Å²	49.3	36%	0.362	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	120	168.3	-167	179.4	-62.3	-176.1	6.1	109.4	C223 I250 G256 E261	C223-R258 PolarHBondContact SG-NH2 3.38Å; C223-R258 VanDerWaalsContact SG-NH2 3.37Å; I250-R258 HydrophobicContact CG2-CG 3.9Å; G256-R258 PolarHBondContact O-N 3.09Å; R258-E261 WeakPolarHBondContact CD-OE2 3.43Å; R258-E261 IonicContact CZ-OE2 3.74Å; R258-E261 IonicContact NE-OE2 2.73Å; R258-E261 IonicContact NH1-OE2 3.76Å; R258-E261 PolarHBondContact NH1-OE2 3.07Å
259	V	94.2	Very high	93.4	Very high	55 Å²	55	46.2 Å²	46.2	33%	0.333	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	-30.6	-175	-68	0	0	0	0	113.5	K251 R253 Q257	K251-V259 HydrophobicContact CB-CG2 3.85Å; K251-V259 HydrophobicContact CD-CG2 3.84Å; K251-V259 HydrophobicContact CG-CG2 3.5Å; K251-V259 WeakPolarHBondContact O-CG2 3.49Å; K251-V259 PolarHBondContact O-N 3.41Å; R253-V259 HydrophobicContact CG-CG1 3.67Å; Q257-V259 HydrophobicContact CG-CG1 4.34Å; Q257-V259 PolarHBondContact O-N 3.34Å
260	A	95	Very high	93.3	Very high	21 Å²	21	46.2 Å²	46.2	17%	0.174	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	150.7	176.3	0	0	0	0	0	110.3	K251 L296	K251-A260 HydrophobicContact CB-CB 4.19Å; K251-A260 PolarHBondContact N-O 3.48Å; K251-A260 PolarHBondContact O-N 3.04Å; A260-L296 HydrophobicContact CB-CD1 3.74Å; A260-L296 HydrophobicContact CB-CG 4.14Å
261	E	96	Very high	93.3	Very high	42 Å²	42	46.3 Å²	46.3	20%	0.196	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	133.6	174.1	176.9	170.3	169.3	0	0	107.6	R248 V249 I250 R258	R248-E261 HydrophobicContact CB-CG 4.39Å; R248-E261 WeakPolarHBondContact CD-OE1 3.28Å; R248-E261 IonicContact CZ-OE1 3.45Å; R248-E261 IonicContact NE-OE1 3.29Å; R248-E261 IonicContact NH1-OE1 3.64Å; R248-E261 PolarHBondContact NH1-OE1 3.41Å; V249-E261 WeakPolarHBondContact O-CA 3.34Å; I250-E261 HydrophobicContact CG1-CG 4.08Å; R258-E261 WeakPolarHBondContact CD-OE2 3.43Å; R258-E261 IonicContact CZ-OE2 3.74Å; R258-E261 IonicContact NE-OE2 2.73Å; R258-E261 IonicContact NH1-OE2 3.76Å; R258-E261 PolarHBondContact NH1-OE2 3.07Å
262	R	95.9	Very high	93.3	Very high	122 Å²	122	45.6 Å²	45.6	46%	0.46	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	136.2	179.3	-68.8	-66	-178.4	-100.9	4.8	109.6	R248 V249 V264 L296	R248-R262 CarbonylContact C-O 3.58Å; R248-R262 WeakPolarHBondContact CA-O 3.45Å; R248-R262 WeakPolarHBondContact CB-O 3.44Å; V249-R262 PolarHBondContact N-O 3.32Å; V249-R262 PolarHBondContact O-N 3.1Å; R262-V264 HydrophobicContact CB-CG2 4.38Å; R262-L296 HydrophobicContact CB-CB 4.08Å; R262-L296 HydrophobicContact CG-CB 3.67Å; R262-L296 HydrophobicContact CG-CD1 4.5Å
263	H	95.3	Very high	93.3	Very high	110 Å²	110	45.5 Å²	45.5	51%	0.509	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	131.3	163.3	-179.1	66	0	0	0	108.1	R246 E247	R246-H263 PolarHBondContact O-ND1 2.76Å; E247-H263 WeakPolarHBondContact O-CA 3.3Å; E247-H263 PolarHBondContact O-ND1 3.18Å; E247-H263 IonicContact OE2-CE1 2.92Å
264	V	91.8	Very high	93.1	Very high	10 Å²	10	40.5 Å²	40.5	6%	0.061	20%	0.199	C	C	.	.			trans	-133	106.4	177.9	-179.4	0	0	0	0	105.6	E247 V249 R262 G266 A267 T281 R290 L292	E247-V264 PolarHBondContact O-N 3.01Å; V249-V264 HydrophobicContact CB-CG2 4.4Å; V249-V264 HydrophobicContact CG2-CB 4.35Å; V249-V264 HydrophobicContact CG2-CG2 3.99Å; R262-V264 HydrophobicContact CB-CG2 4.38Å; V264-G266 PolarHBondContact O-N 3.03Å; V264-A267 HydrophobicContact CB-CB 3.69Å; V264-A267 HydrophobicContact CG1-CB 3.81Å; V264-A267 WeakPolarHBondContact O-CB 3.48Å; V264-A267 PolarHBondContact O-N 3.17Å; V264-T281 HydrophobicContact CG1-CG2 4.09Å; V264-R290 HydrophobicContact CG1-CB 4.14Å; V264-R290 HydrophobicContact CG1-CG 4.16Å; V264-L292 HydrophobicContact CG1-CD2 4.17Å; V264-L292 HydrophobicContact CG2-CD1 3.98Å; V264-L292 HydrophobicContact CG2-CD2 4.06Å
265	H	87.1	Confident	93	Very high	107 Å²	107	45.3 Å²	45.3	50%	0.495	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	124.8	-171.3	-178.1	61.1	0	0	0	111.7	E247 A267	E247-H265 IonicContact OE2-ND1 3.4Å; H265-A267 VanDerWaalsContact C-N 3.26Å; H265-A267 PolarHBondContact O-N 2.96Å
266	G	86.1	Confident	92.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	76	-1.9	-179.7	0	0	0	0	0	115.7	E247 V264 N268 S283	E247-G266 VanDerWaalsContact CD-N 3.34Å; E247-G266 WeakPolarHBondContact OE1-CA 3.48Å; E247-G266 PolarHBondContact OE2-N 3.39Å; V264-G266 PolarHBondContact O-N 3.03Å; G266-N268 VanDerWaalsContact C-N 3.34Å; G266-N268 PolarHBondContact O-N 3.24Å; G266-N268 PolarHBondContact O-OD1 3.01Å; G266-N268 VanDerWaalsContact O-OD1 3.1Å; G266-S283 WeakPolarHBondContact CA-OG 3.32Å; G266-S283 WeakPolarHBondContact O-CA 3.49Å; G266-S283 WeakPolarHBondContact O-CB 3.32Å; G266-S283 PolarHBondContact O-OG 2.89Å; G266-S283 VanDerWaalsContact O-OG 3.04Å
267	A	90.8	Very high	92.9	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	87.5	175.7	0	0	0	0	0	110.5	V242 E247 V249 V264 H265 T281	V242-A267 VanDerWaalsContact CG1-O 3.28Å; V242-A267 WeakPolarHBondContact CG1-O 3.41Å; E247-A267 WeakPolarHBondContact CA-O 3.35Å; V249-A267 HydrophobicContact CG2-CB 4.23Å; V264-A267 HydrophobicContact CB-CB 3.69Å; V264-A267 HydrophobicContact CG1-CB 3.81Å; V264-A267 WeakPolarHBondContact O-CB 3.48Å; V264-A267 PolarHBondContact O-N 3.17Å; H265-A267 VanDerWaalsContact C-N 3.26Å; H265-A267 PolarHBondContact O-N 2.96Å; A267-T281 HydrophobicContact CB-CG2 3.69Å; A267-T281 WeakPolarHBondContact CB-OG1 3.42Å
268	N	93.5	Very high	93	Very high	17 Å²	17	45.1 Å²	45.1	9%	0.091	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	8.2	-169.3	69.7	-4.5	0	0	0	114.4	S244 E247 G266 D284	S244-N268 WeakPolarHBondContact CB-O 3.48Å; E247-N268 HydrophobicContact CG-CB 4.49Å; G266-N268 VanDerWaalsContact C-N 3.34Å; G266-N268 PolarHBondContact O-N 3.24Å; G266-N268 PolarHBondContact O-OD1 3.01Å; G266-N268 VanDerWaalsContact O-OD1 3.1Å; N268-D284 VanDerWaalsContact OD1-CB 3.22Å; N268-D284 WeakPolarHBondContact OD1-CB 3.42Å; N268-D284 PolarHBondContact OD1-N 3.44Å
269	K	95.1	Very high	93.3	Very high	30 Å²	30	40.6 Å²	40.6	13%	0.13	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	-144.9	179.5	-69	-60	178.2	-63.1	0	110	F229 L282 D284 K313	F229-K269 VanDerWaalsContact CD1-C 3.46Å; F229-K269 VanDerWaalsContact CD1-CA 3.49Å; F229-K269 HydrophobicContact CD1-CB 4.45Å; F229-K269 HydrophobicContact CD1-CD 4.32Å; F229-K269 HydrophobicContact CD2-CD 4.41Å; F229-K269 HydrophobicContact CE1-CB 4.2Å; F229-K269 HydrophobicContact CE1-CD 3.82Å; F229-K269 HydrophobicContact CE2-CD 3.9Å; F229-K269 HydrophobicContact CZ-CD 3.6Å; K269-L282 HydrophobicContact CB-CB 4.26Å; K269-L282 HydrophobicContact CB-CD2 4.23Å; K269-L282 HydrophobicContact CB-CG 4.36Å; K269-L282 PolarHBondContact N-O 3.1Å; K269-D284 HydrophobicContact CD-CB 4.46Å; K269-D284 VanDerWaalsContact CE-OD2 3.26Å; K269-D284 WeakPolarHBondContact CE-OD2 3.15Å; K269-D284 HydrophobicContact CG-CB 3.63Å; K269-D284 IonicContact NZ-OD2 3.52Å; K269-D284 PolarHBondContact NZ-OD2 3.26Å; K269-K313 WeakPolarHBondContact CB-O 2.84Å; K269-K313 HydrophobicContact CD-CB 4.26Å; K269-K313 HydrophobicContact CD-CG 4.15Å
270	G	96.2	Very high	93.4	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	154.9	-173	0	0	0	0	0	113.7	D230 T281 L282 K313 V315	D230-G270 WeakPolarHBondContact OD2-CA 3.43Å; G270-T281 WeakPolarHBondContact O-CA 3.39Å; G270-L282 PolarHBondContact O-N 2.91Å; G270-K313 WeakPolarHBondContact CA-O 3.38Å; G270-K313 PolarHBondContact N-O 2.87Å; G270-V315 VanDerWaalsContact C-CG1 3.46Å; G270-V315 WeakPolarHBondContact O-CG1 3.41Å
271	I	98.2	Very high	93.5	Very high	2 Å²	2	37 Å²	37	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	139	174	-174.2	169.4	0	0	0	109	D230 L231 V240 V242 V249 I279 Y280	D230-I271 HydrophobicContact CB-CG2 4.08Å; D230-I271 PolarHBondContact OD2-N 2.73Å; L231-I271 VanDerWaalsContact CA-CG2 3.5Å; V240-I271 HydrophobicContact CB-CD1 4.07Å; V240-I271 HydrophobicContact CG2-CD1 3.86Å; V240-I271 HydrophobicContact CG2-CG1 4.39Å; V242-I271 HydrophobicContact CG2-CB 3.67Å; V242-I271 HydrophobicContact CG2-CD1 3.91Å; V242-I271 HydrophobicContact CG2-CG1 4.31Å; V242-I271 HydrophobicContact CG2-CG2 3.98Å; V249-I271 HydrophobicContact CG1-CD1 3.71Å; V249-I271 HydrophobicContact CG2-CD1 4.44Å; I271-I279 HydrophobicContact CD1-CG2 3.62Å; I271-I279 HydrophobicContact CG1-CG2 3.7Å; I271-Y280 CarbonylContact C-O 3.58Å; I271-Y280 VanDerWaalsContact CA-O 3.28Å; I271-Y280 WeakPolarHBondContact CA-O 3.21Å
272	S	97.8	Very high	93.5	Very high	1 Å²	1	35 Å²	35	1%	0.007	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	151.5	171.9	-171.8	0	0	0	0	112.6	D232 I279 Y280 V315 C317	D232-S272 WeakPolarHBondContact OD2-CA 3.42Å; D232-S272 WeakPolarHBondContact OD2-CB 3.48Å; D232-S272 PolarHBondContact OD2-OG 2.98Å; S272-I279 CarbonylContact O-C 3.6Å; S272-Y280 PolarHBondContact N-O 3.32Å; S272-Y280 PolarHBondContact O-N 3.25Å; S272-V315 WeakPolarHBondContact CB-O 3.47Å; S272-C317 PolarHBondContact OG-N 2.94Å
273	V	97	Very high	93.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	120.5	-179.2	-179.6	0	0	0	0	109.1	R193 D232 M234 V240 R278 I279	R193-V273 PolarHBondContact NH2-O 2.68Å; D232-V273 HydrophobicContact CB-CB 4.38Å; D232-V273 HydrophobicContact CB-CG2 3.94Å; D232-V273 PolarHBondContact OD2-N 2.88Å; M234-V273 HydrophobicContact CG-CG1 4.43Å; M234-V273 HydrophobicContact CG-CG2 4.19Å; V240-V273 HydrophobicContact CG2-CG2 3.47Å; V240-V273 VanDerWaalsContact CG2-CG2 3.47Å; V273-R278 WeakPolarHBondContact CA-O 3.45Å; V273-I279 HydrophobicContact CG2-CG1 4.18Å; V273-I279 HydrophobicContact CG2-CG2 4.48Å
274	C	92.2	Very high	92.7	Very high	1 Å²	1	25 Å²	25	1%	0.007	12%	0.119	C	C	.	.			trans	-73.6	170.9	173.7	-58.3	0	0	0	0	111.8	N276 G277 R278 Y280 C317	C274-N276 WeakPolarHBondContact CB-OD1 3.43Å; C274-N276 PolarHBondContact O-N 2.83Å; C274-G277 PolarHBondContact O-N 2.67Å; C274-R278 PolarHBondContact N-O 3.04Å; C274-Y280 HydrophobicContact CB-CE2 4.09Å; C274-Y280 VanDerWaalsContact SG-CD2 3.51Å; C274-Y280 WeakPolarHBondContact SG-CE2 3.48Å; C274-C317 HydrophobicContact CB-CB 4.05Å; C274-C317 WeakPolarHBondContact CB-SG 3.31Å; C274-C317 WeakPolarHBondContact SG-CB 3.42Å; C274-C317 CovalentContact SG-SG 1.99Å; C274-C317 PolarHBondContact SG-SG 2.87Å
275	E	86.9	Confident	92.3	Very high	120 Å²	120	27.1 Å²	27.1	56%	0.561	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-31.3	176.6	-67.8	177.3	-172.4	0	0	112.7	G277	E275-G277 PolarHBondContact O-N 2.73Å
276	N	86.8	Confident	92.1	Very high	86 Å²	86	23.9 Å²	23.9	46%	0.46	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	2.8	176.3	66.9	10.9	0	0	0	114.4	C274 R278	C274-N276 WeakPolarHBondContact CB-OD1 3.43Å; C274-N276 PolarHBondContact O-N 2.83Å; N276-R278 VanDerWaalsContact C-N 3.28Å; N276-R278 PolarHBondContact O-N 3.29Å; N276-R278 VanDerWaalsContact OD1-CB 3.29Å; N276-R278 WeakPolarHBondContact OD1-CB 3.21Å; N276-R278 WeakPolarHBondContact OD1-CG 3.43Å; N276-R278 PolarHBondContact OD1-N 2.84Å
277	G	91	Very high	92	Very high	11 Å²	11	24.1 Å²	24.1	11%	0.113	12%	0.122	C	C	.	.	S	Bend	trans	79.2	0.5	178.7	0	0	0	0	0	115.4	C274 E275	C274-G277 PolarHBondContact O-N 2.67Å; E275-G277 PolarHBondContact O-N 2.73Å
278	R	95.1	Very high	92	Very high	117 Å²	117	24.1 Å²	24.1	44%	0.442	12%	0.122	S	C	.	.			trans	-68.5	142.8	169.9	-70.7	-177.6	176.9	171.1	-1.4	110.4	V273 C274 N276 Y280 I291	V273-R278 WeakPolarHBondContact CA-O 3.45Å; C274-R278 PolarHBondContact N-O 3.04Å; N276-R278 VanDerWaalsContact C-N 3.28Å; N276-R278 PolarHBondContact O-N 3.29Å; N276-R278 VanDerWaalsContact OD1-CB 3.29Å; N276-R278 WeakPolarHBondContact OD1-CB 3.21Å; N276-R278 WeakPolarHBondContact OD1-CG 3.43Å; N276-R278 PolarHBondContact OD1-N 2.84Å; R278-Y280 HydrophobicContact CB-CD2 4.46Å; R278-Y280 HydrophobicContact CB-CE2 3.5Å; R278-Y280 VanDerWaalsContact CB-CE2 3.5Å; R278-Y280 WeakPolarHBondContact CD-OH 3.33Å; R278-I291 HydrophobicContact CB-CG2 4.39Å
279	I	97.5	Very high	92	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	131.9	-177.1	-50	170.2	0	0	0	107.9	M234 V240 I271 S272 V273 I291 L292 D293 L296	M234-I279 HydrophobicContact CE-CD1 4.44Å; V240-I279 HydrophobicContact CG1-CD1 3.96Å; V240-I279 HydrophobicContact CG2-CG2 4.32Å; I271-I279 HydrophobicContact CD1-CG2 3.62Å; I271-I279 HydrophobicContact CG1-CG2 3.7Å; S272-I279 CarbonylContact O-C 3.6Å; V273-I279 HydrophobicContact CG2-CG1 4.18Å; V273-I279 HydrophobicContact CG2-CG2 4.48Å; I279-I291 CarbonylContact O-C 3.54Å; I279-I291 WeakPolarHBondContact O-CA 3.13Å; I279-L292 HydrophobicContact CB-CB 4.12Å; I279-L292 HydrophobicContact CG2-CD1 4.48Å; I279-L292 PolarHBondContact N-O 2.89Å; I279-L292 PolarHBondContact O-N 3.43Å; I279-D293 WeakPolarHBondContact CD1-O 3.39Å; I279-L296 HydrophobicContact CD1-CD2 3.41Å; I279-L296 VanDerWaalsContact CD1-CD2 3.41Å
280	Y	96.6	Very high	91.9	Very high	1 Å²	1	23.2 Å²	23.2	0%	0.004	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	117.8	-178.6	-64.2	-94.6	0	0	0	107.7	I271 S272 C274 R278 V289 R290 I291 I302 C317 I322 I335	I271-Y280 CarbonylContact C-O 3.58Å; I271-Y280 VanDerWaalsContact CA-O 3.28Å; I271-Y280 WeakPolarHBondContact CA-O 3.21Å; S272-Y280 PolarHBondContact N-O 3.32Å; S272-Y280 PolarHBondContact O-N 3.25Å; C274-Y280 HydrophobicContact CB-CE2 4.09Å; C274-Y280 VanDerWaalsContact SG-CD2 3.51Å; C274-Y280 WeakPolarHBondContact SG-CE2 3.48Å; R278-Y280 HydrophobicContact CB-CD2 4.46Å; R278-Y280 HydrophobicContact CB-CE2 3.5Å; R278-Y280 VanDerWaalsContact CB-CE2 3.5Å; R278-Y280 WeakPolarHBondContact CD-OH 3.33Å; Y280-V289 HydrophobicContact CD1-CG1 3.93Å; Y280-V289 HydrophobicContact CG-CG1 4.31Å; Y280-R290 WeakPolarHBondContact CA-O 3.2Å; Y280-I291 HydrophobicContact CD1-CG1 3.93Å; Y280-I291 HydrophobicContact CD1-CG2 4.41Å; Y280-I291 HydrophobicContact CE1-CB 4.36Å; Y280-I291 HydrophobicContact CE1-CD1 3.95Å; Y280-I291 HydrophobicContact CE1-CG1 3.73Å; Y280-I291 HydrophobicContact CE1-CG2 3.91Å; Y280-I302 HydrophobicContact CD1-CD1 4.45Å; Y280-I302 HydrophobicContact CE1-CD1 4.18Å; Y280-C317 HydrophobicContact CD2-CB 4.46Å; Y280-I322 HydrophobicContact CD1-CD1 3.32Å; Y280-I322 HydrophobicContact CD1-CG1 4.29Å; Y280-I322 HydrophobicContact CE1-CD1 3.51Å; Y280-I322 HydrophobicContact CE1-CG1 4.42Å; Y280-I322 HydrophobicContact CG-CD1 4.02Å; Y280-I335 HydrophobicContact CE1-CD1 3.83Å; Y280-I335 WeakPolarHBondContact OH-CD1 3.3Å
281	T	96.8	Very high	91.9	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	131.6	178.2	-176.3	0	0	0	0	110.6	V249 V264 A267 G270 V289 R290 L292	V249-T281 HydrophobicContact CG2-CG2 4.25Å; V264-T281 HydrophobicContact CG1-CG2 4.09Å; A267-T281 HydrophobicContact CB-CG2 3.69Å; A267-T281 WeakPolarHBondContact CB-OG1 3.42Å; G270-T281 WeakPolarHBondContact O-CA 3.39Å; T281-V289 CarbonylContact O-C 3.59Å; T281-V289 WeakPolarHBondContact O-CA 3.49Å; T281-R290 HydrophobicContact CG2-CB 3.78Å; T281-R290 PolarHBondContact N-O 3.22Å; T281-R290 PolarHBondContact O-N 2.86Å; T281-L292 HydrophobicContact CG2-CD1 4.46Å
282	L	95.5	Very high	91.7	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	132.7	-176.8	-176.7	66.1	0	0	0	110.6	K269 G270 V289 M307 C312 V315 I324	K269-L282 HydrophobicContact CB-CB 4.26Å; K269-L282 HydrophobicContact CB-CD2 4.23Å; K269-L282 HydrophobicContact CB-CG 4.36Å; K269-L282 PolarHBondContact N-O 3.1Å; G270-L282 PolarHBondContact O-N 2.91Å; L282-V289 HydrophobicContact CD1-CG2 3.84Å; L282-M307 HydrophobicContact CD1-CE 4.05Å; L282-M307 HydrophobicContact CD1-SD 4.29Å; L282-C312 HydrophobicContact CD1-CB 4.35Å; L282-C312 VanDerWaalsContact CD2-C 3.42Å; L282-C312 HydrophobicContact CD2-CB 3.81Å; L282-C312 WeakPolarHBondContact CD2-O 3.32Å; L282-V315 HydrophobicContact CB-CB 4.29Å; L282-V315 HydrophobicContact CB-CG1 4.1Å; L282-I324 HydrophobicContact CD1-CG2 3.97Å; L282-I324 HydrophobicContact CD2-CG2 4.09Å
283	S	90.9	Very high	91.6	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.007	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	112.8	172	177	0	0	0	0	111.9	G266 V285 T286 G287 S288	G266-S283 WeakPolarHBondContact CA-OG 3.32Å; G266-S283 WeakPolarHBondContact O-CA 3.49Å; G266-S283 WeakPolarHBondContact O-CB 3.32Å; G266-S283 PolarHBondContact O-OG 2.89Å; G266-S283 VanDerWaalsContact O-OG 3.04Å; S283-V285 VanDerWaalsContact C-N 3.26Å; S283-V285 PolarHBondContact O-N 3.24Å; S283-T286 WeakPolarHBondContact CB-OG1 3.19Å; S283-T286 PolarHBondContact OG-N 3.42Å; S283-T286 PolarHBondContact OG-OG1 2.94Å; S283-G287 WeakPolarHBondContact O-CA 3.07Å; S283-G287 PolarHBondContact O-N 3.23Å; S283-S288 PolarHBondContact N-O 3.46Å
284	D	83.6	Confident	91.5	Very high	19 Å²	19	30.1 Å²	30.1	10%	0.102	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-30.2	177.1	-159.3	32.7	0	0	0	112.6	N268 K269 K309 H310	N268-D284 VanDerWaalsContact OD1-CB 3.22Å; N268-D284 WeakPolarHBondContact OD1-CB 3.42Å; N268-D284 PolarHBondContact OD1-N 3.44Å; K269-D284 HydrophobicContact CD-CB 4.46Å; K269-D284 VanDerWaalsContact CE-OD2 3.26Å; K269-D284 WeakPolarHBondContact CE-OD2 3.15Å; K269-D284 HydrophobicContact CG-CB 3.63Å; K269-D284 IonicContact NZ-OD2 3.52Å; K269-D284 PolarHBondContact NZ-OD2 3.26Å; D284-K309 WeakPolarHBondContact O-CA 3.45Å; D284-H310 PolarHBondContact O-N 3.22Å; D284-H310 VanDerWaalsContact OD1-C 3.3Å; D284-H310 WeakPolarHBondContact OD1-CA 3.37Å; D284-H310 PolarHBondContact OD1-N 2.99Å; D284-H310 IonicContact OD2-ND1 2.91Å
285	V	84.3	Confident	91.6	Very high	56 Å²	56	37 Å²	37	34%	0.339	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-37.7	-174.7	-177.5	0	0	0	0	111.3	S283 K309	S283-V285 VanDerWaalsContact C-N 3.26Å; S283-V285 PolarHBondContact O-N 3.24Å; V285-K309 WeakPolarHBondContact O-CD 3.41Å; V285-K309 VanDerWaalsContact O-CE 3.25Å; V285-K309 WeakPolarHBondContact O-CE 3.22Å; V285-K309 WeakPolarHBondContact O-CG 3.45Å
286	T	83.1	Confident	92	Very high	39 Å²	39	31.4 Å²	31.4	24%	0.239	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-19.4	-176.9	62.4	0	0	0	0	112.6	S283 S288	S283-T286 WeakPolarHBondContact CB-OG1 3.19Å; S283-T286 PolarHBondContact OG-N 3.42Å; S283-T286 PolarHBondContact OG-OG1 2.94Å; T286-S288 VanDerWaalsContact C-N 3.35Å; T286-S288 PolarHBondContact OG1-OG 2.92Å
287	G	84.4	Confident	92.4	Very high	5 Å²	5	30.6 Å²	30.6	5%	0.052	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	44.1	-171.4	0	0	0	0	0	110.3	S283 M307	S283-G287 WeakPolarHBondContact O-CA 3.07Å; S283-G287 PolarHBondContact O-N 3.23Å; G287-M307 WeakPolarHBondContact O-CE 3.42Å
288	S	89.9	Confident	92.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	162.6	179	71.3	0	0	0	0	112	S283 T286 K301 I302	S283-S288 PolarHBondContact N-O 3.46Å; T286-S288 VanDerWaalsContact C-N 3.35Å; T286-S288 PolarHBondContact OG1-OG 2.92Å; S288-K301 WeakPolarHBondContact OG-CE 3.32Å; S288-I302 WeakPolarHBondContact CA-O 3.39Å; S288-I302 WeakPolarHBondContact CB-O 3.38Å
289	V	93	Very high	92.4	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.006	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	118.8	173.3	-179	0	0	0	0	108.4	Y280 T281 L282 K301 I302 I324	Y280-V289 HydrophobicContact CD1-CG1 3.93Å; Y280-V289 HydrophobicContact CG-CG1 4.31Å; T281-V289 CarbonylContact O-C 3.59Å; T281-V289 WeakPolarHBondContact O-CA 3.49Å; L282-V289 HydrophobicContact CD1-CG2 3.84Å; V289-K301 CarbonylContact O-C 3.54Å; V289-K301 WeakPolarHBondContact O-CA 2.94Å; V289-I302 HydrophobicContact CB-CB 4.35Å; V289-I302 PolarHBondContact N-O 2.82Å; V289-I302 PolarHBondContact O-N 2.94Å; V289-I324 HydrophobicContact CG2-CD1 3.66Å; V289-I324 HydrophobicContact CG2-CG1 4.39Å
290	R	93.9	Very high	92.1	Very high	27 Å²	27	30 Å²	30	10%	0.102	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	138.5	174.8	-65.1	-75.1	-175.2	-179.9	3.1	109.3	D112 V264 Y280 T281 H298	D112-R290 IonicContact OD1-NH1 2.77Å; D112-R290 IonicContact OD2-CZ 3.2Å; D112-R290 IonicContact OD2-NH1 2.67Å; D112-R290 PolarHBondContact OD2-NH1 2.85Å; V264-R290 HydrophobicContact CG1-CB 4.14Å; V264-R290 HydrophobicContact CG1-CG 4.16Å; Y280-R290 WeakPolarHBondContact CA-O 3.2Å; T281-R290 HydrophobicContact CG2-CB 3.78Å; T281-R290 PolarHBondContact N-O 3.22Å; T281-R290 PolarHBondContact O-N 2.86Å; R290-H298 WeakPolarHBondContact CD-NE2 3.48Å; R290-H298 PolarHBondContact NH1-CE1 2.84Å; R290-H298 VanDerWaalsContact NH1-CE1 3.31Å; R290-H298 PolarHBondContact NH1-NE2 3.45Å; R290-H298 VanDerWaalsContact NH1-NE2 3.12Å
291	I	94.6	Very high	91.9	Very high	15 Å²	15	31.5 Å²	31.5	8%	0.077	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	126.8	178.4	-46	178.2	0	0	0	108	R278 I279 Y280 V299 G300 I302	R278-I291 HydrophobicContact CB-CG2 4.39Å; I279-I291 CarbonylContact O-C 3.54Å; I279-I291 WeakPolarHBondContact O-CA 3.13Å; Y280-I291 HydrophobicContact CD1-CG1 3.93Å; Y280-I291 HydrophobicContact CD1-CG2 4.41Å; Y280-I291 HydrophobicContact CE1-CB 4.36Å; Y280-I291 HydrophobicContact CE1-CD1 3.95Å; Y280-I291 HydrophobicContact CE1-CG1 3.73Å; Y280-I291 HydrophobicContact CE1-CG2 3.91Å; I291-V299 HydrophobicContact CB-CG2 3.99Å; I291-V299 HydrophobicContact CG2-CG2 3.63Å; I291-V299 WeakPolarHBondContact O-CG2 3.44Å; I291-V299 PolarHBondContact O-N 3.03Å; I291-G300 WeakPolarHBondContact CB-O 3.28Å; I291-G300 PolarHBondContact N-O 3.18Å; I291-I302 HydrophobicContact CD1-CD1 4.04Å; I291-I302 HydrophobicContact CD1-CG1 4.03Å; I291-I302 HydrophobicContact CG1-CD1 4.46Å; I291-I302 HydrophobicContact CG1-CG1 4.5Å
292	L	96	Very high	91.5	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	151.4	174.7	-39	171.5	0	0	0	110.8	V249 V264 I279 T281 N297 H298	V249-L292 HydrophobicContact CB-CD1 4.04Å; V249-L292 HydrophobicContact CG1-CD1 4.14Å; V249-L292 HydrophobicContact CG2-CD1 3.8Å; V264-L292 HydrophobicContact CG1-CD2 4.17Å; V264-L292 HydrophobicContact CG2-CD1 3.98Å; V264-L292 HydrophobicContact CG2-CD2 4.06Å; I279-L292 HydrophobicContact CB-CB 4.12Å; I279-L292 HydrophobicContact CG2-CD1 4.48Å; I279-L292 PolarHBondContact N-O 2.89Å; I279-L292 PolarHBondContact O-N 3.43Å; T281-L292 HydrophobicContact CG2-CD1 4.46Å; L292-N297 CarbonylContact C-O 3.58Å; L292-N297 WeakPolarHBondContact CA-O 3.34Å; L292-H298 HydrophobicContact CD2-CB 4.19Å
293	D	95	Very high	91.1	Very high	40 Å²	40	32.8 Å²	32.8	21%	0.214	17%	0.165	C	C	.	.			trans	-79.2	179.5	167.8	73.4	11.8	0	0	0	112.1	I279 Y295 L296 N297 V299	I279-D293 WeakPolarHBondContact CD1-O 3.39Å; D293-Y295 PolarHBondContact O-N 2.89Å; D293-Y295 VanDerWaalsContact O-N 3.1Å; D293-Y295 VanDerWaalsContact OD1-C 3.29Å; D293-Y295 VanDerWaalsContact OD1-CA 3.29Å; D293-Y295 WeakPolarHBondContact OD1-CA 3.4Å; D293-Y295 WeakPolarHBondContact OD1-CB 3.45Å; D293-Y295 PolarHBondContact OD1-N 2.98Å; D293-L296 PolarHBondContact O-N 2.85Å; D293-L296 PolarHBondContact OD1-N 2.87Å; D293-N297 PolarHBondContact N-O 3.3Å; D293-N297 PolarHBondContact OD1-N 3.1Å; D293-N297 PolarHBondContact OD1-ND2 2.57Å; D293-N297 WeakPolarHBondContact OD2-CB 3.23Å; D293-N297 PolarHBondContact OD2-ND2 3.06Å; D293-V299 HydrophobicContact CB-CG1 4.04Å
294	Q	93.8	Very high	90.8	Very high	92 Å²	92	32.9 Å²	32.9	43%	0.43	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-11.6	179.3	65.1	179	-12.2	0	0	115.3	M234 K251	M234-Q294 HydrophobicContact CE-CB 3.77Å; K251-Q294 PolarHBondContact NZ-O 3.44Å
295	Y	94	Very high	90.3	Very high	145 Å²	145	35.6 Å²	35.6	57%	0.569	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.7	6.6	177.2	-53.5	-69.6	0	0	0	112	D293 N297	D293-Y295 PolarHBondContact O-N 2.89Å; D293-Y295 VanDerWaalsContact O-N 3.1Å; D293-Y295 VanDerWaalsContact OD1-C 3.29Å; D293-Y295 VanDerWaalsContact OD1-CA 3.29Å; D293-Y295 WeakPolarHBondContact OD1-CA 3.4Å; D293-Y295 WeakPolarHBondContact OD1-CB 3.45Å; D293-Y295 PolarHBondContact OD1-N 2.98Å; Y295-N297 VanDerWaalsContact C-N 3.29Å
296	L	96.3	Very high	90	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.016	19%	0.186	C	C	.	.			trans	68.9	18.3	-177.4	-46.1	-176.6	0	0	0	114.4	V240 V249 K251 A260 R262 I279 D293	V240-L296 HydrophobicContact CG1-CD2 4.26Å; V249-L296 HydrophobicContact CG1-CD1 4.29Å; V249-L296 HydrophobicContact CG1-CD2 3.81Å; V249-L296 WeakPolarHBondContact O-CD1 3.3Å; K251-L296 HydrophobicContact CB-CD1 3.99Å; K251-L296 HydrophobicContact CB-CD2 4.37Å; K251-L296 HydrophobicContact CB-CG 4.39Å; A260-L296 HydrophobicContact CB-CD1 3.74Å; A260-L296 HydrophobicContact CB-CG 4.14Å; R262-L296 HydrophobicContact CB-CB 4.08Å; R262-L296 HydrophobicContact CG-CB 3.67Å; R262-L296 HydrophobicContact CG-CD1 4.5Å; I279-L296 HydrophobicContact CD1-CD2 3.41Å; I279-L296 VanDerWaalsContact CD1-CD2 3.41Å; D293-L296 PolarHBondContact O-N 2.85Å; D293-L296 PolarHBondContact OD1-N 2.87Å
297	N	94.7	Very high	89.9	Confident	69 Å²	69	34.2 Å²	34.2	37%	0.369	18%	0.178	S	C	.	.			trans	-77.2	138.8	172.6	-53.2	-53.3	0	0	0	109.7	L292 D293 Y295 V299	L292-N297 CarbonylContact C-O 3.58Å; L292-N297 WeakPolarHBondContact CA-O 3.34Å; D293-N297 PolarHBondContact N-O 3.3Å; D293-N297 PolarHBondContact OD1-N 3.1Å; D293-N297 PolarHBondContact OD1-ND2 2.57Å; D293-N297 WeakPolarHBondContact OD2-CB 3.23Å; D293-N297 PolarHBondContact OD2-ND2 3.06Å; Y295-N297 VanDerWaalsContact C-N 3.29Å; N297-V299 PolarHBondContact O-N 2.96Å
298	H	93.1	Very high	89.5	Confident	48 Å²	48	38.2 Å²	38.2	22%	0.222	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	129.5	173.3	-176.1	-105.6	0	0	0	110.3	D112 R290 L292 G300	D112-H298 IonicContact OD1-CE1 2.92Å; D112-H298 PolarHBondContact OD1-CE1 2.91Å; D112-H298 IonicContact OD1-ND1 3.42Å; D112-H298 PolarHBondContact OD1-ND1 2.86Å; R290-H298 WeakPolarHBondContact CD-NE2 3.48Å; R290-H298 PolarHBondContact NH1-CE1 2.84Å; R290-H298 VanDerWaalsContact NH1-CE1 3.31Å; R290-H298 PolarHBondContact NH1-NE2 3.45Å; R290-H298 VanDerWaalsContact NH1-NE2 3.12Å; L292-H298 HydrophobicContact CD2-CB 4.19Å; H298-G300 PolarHBondContact NE2-O 3.01Å
299	V	92.9	Very high	89.1	Confident	65 Å²	65	44.1 Å²	44.1	39%	0.394	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	-0.6	-178.7	-62	0	0	0	0	113.3	T113 I291 D293 N297	T113-V299 PolarHBondContact OG1-O 2.85Å; I291-V299 HydrophobicContact CB-CG2 3.99Å; I291-V299 HydrophobicContact CG2-CG2 3.63Å; I291-V299 WeakPolarHBondContact O-CG2 3.44Å; I291-V299 PolarHBondContact O-N 3.03Å; D293-V299 HydrophobicContact CB-CG1 4.04Å; N297-V299 PolarHBondContact O-N 2.96Å
300	G	91.5	Very high	88.5	Confident	2 Å²	2	49.7 Å²	49.7	2%	0.021	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159.2	177.9	177.3	0	0	0	0	0	113.4	T113 I291 H298	T113-G300 WeakPolarHBondContact O-CA 3.13Å; I291-G300 WeakPolarHBondContact CB-O 3.28Å; I291-G300 PolarHBondContact N-O 3.18Å; H298-G300 PolarHBondContact NE2-O 3.01Å
301	K	92	Very high	88.2	Confident	34 Å²	34	50.5 Å²	50.5	15%	0.148	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	140.6	-174.3	-179.8	-167	170.5	-150.2	0	110.2	T113 E114 V115 S288 V289 T303	T113-K301 PolarHBondContact O-N 2.83Å; T113-K301 VanDerWaalsContact O-N 3.11Å; E114-K301 WeakPolarHBondContact CA-O 3.34Å; E114-K301 IonicContact OE1-NZ 3.59Å; E114-K301 PolarHBondContact OE1-NZ 3.04Å; V115-K301 PolarHBondContact N-O 2.75Å; S288-K301 WeakPolarHBondContact OG-CE 3.32Å; V289-K301 CarbonylContact O-C 3.54Å; V289-K301 WeakPolarHBondContact O-CA 2.94Å; K301-T303 WeakPolarHBondContact CE-OG1 3.38Å; K301-T303 PolarHBondContact NZ-OG1 3.29Å
302	I	89.4	Confident	88.1	Confident	3 Å²	3	50 Å²	50	2%	0.015	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	125.4	171.7	-62.4	166.3	0	0	0	108.2	I117 Y280 S288 V289 I291 V304 I322 V333 I335	I117-I302 HydrophobicContact CD1-CG2 3.97Å; Y280-I302 HydrophobicContact CD1-CD1 4.45Å; Y280-I302 HydrophobicContact CE1-CD1 4.18Å; S288-I302 WeakPolarHBondContact CA-O 3.39Å; S288-I302 WeakPolarHBondContact CB-O 3.38Å; V289-I302 HydrophobicContact CB-CB 4.35Å; V289-I302 PolarHBondContact N-O 2.82Å; V289-I302 PolarHBondContact O-N 2.94Å; I291-I302 HydrophobicContact CD1-CD1 4.04Å; I291-I302 HydrophobicContact CD1-CG1 4.03Å; I291-I302 HydrophobicContact CG1-CD1 4.46Å; I291-I302 HydrophobicContact CG1-CG1 4.5Å; I302-V304 HydrophobicContact CG2-CG2 4.41Å; I302-I322 HydrophobicContact CD1-CD1 3.47Å; I302-I322 VanDerWaalsContact CD1-CD1 3.47Å; I302-V333 HydrophobicContact CG2-CG1 4.33Å; I302-I335 HydrophobicContact CD1-CG1 4.26Å
303	T	87.4	Confident	88	Confident	24 Å²	24	51.9 Å²	51.9	15%	0.147	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126.8	175.3	-58.8	0	0	0	0	109.1	E114 V115 L116 I117 K301	E114-T303 PolarHBondContact OE1-OG1 2.97Å; V115-T303 PolarHBondContact O-N 2.97Å; L116-T303 HydrophobicContact CD1-CG2 4.2Å; I117-T303 PolarHBondContact N-O 2.89Å; K301-T303 WeakPolarHBondContact CE-OG1 3.38Å; K301-T303 PolarHBondContact NZ-OG1 3.29Å
304	V	83.1	Confident	88	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.018	25%	0.252	C	S	.	.			trans	-108.7	111.6	175	179.1	0	0	0	0	107.2	P119 I302 S306 M307 F331 V333	P119-V304 HydrophobicContact CG-CG1 3.87Å; I302-V304 HydrophobicContact CG2-CG2 4.41Å; V304-S306 PolarHBondContact O-N 2.88Å; V304-S306 VanDerWaalsContact O-N 3.11Å; V304-M307 HydrophobicContact CB-CB 3.84Å; V304-M307 HydrophobicContact CG1-CB 4.16Å; V304-M307 VanDerWaalsContact O-CB 3.24Å; V304-M307 WeakPolarHBondContact O-CB 3.13Å; V304-M307 PolarHBondContact O-N 2.91Å; V304-F331 HydrophobicContact CG1-CD1 3.91Å; V304-F331 HydrophobicContact CG1-CE1 4.22Å; V304-F331 HydrophobicContact CG1-CG 4.32Å; V304-V333 HydrophobicContact CG2-CG2 3.99Å
305	P	74.2	Confident	88.1	Confident	77 Å²	77	46.3 Å²	46.3	50%	0.5	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-30.7	-170.6	-29.1	35.8	0	0	0	115.5	L116 I117 M307	L116-P305 HydrophobicContact CD1-CG 3.8Å; L116-P305 HydrophobicContact CG-CG 4.3Å; I117-P305 WeakPolarHBondContact O-CD 3.35Å; P305-M307 VanDerWaalsContact C-N 3.34Å
306	S	77.3	Confident	88.3	Confident	54 Å²	54	41.2 Å²	41.2	38%	0.378	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	3.5	178.7	62.4	0	0	0	0	113.5	P119 V304 D308 F331	P119-S306 WeakPolarHBondContact CG-OG 3.44Å; V304-S306 PolarHBondContact O-N 2.88Å; V304-S306 VanDerWaalsContact O-N 3.11Å; S306-D308 PolarHBondContact O-N 2.85Å; S306-F331 WeakPolarHBondContact O-CZ 3.42Å; S306-F331 WeakPolarHBondContact OG-CE1 3.48Å
307	M	81.6	Confident	88.2	Confident	11 Å²	11	41.4 Å²	41.4	5%	0.054	22%	0.216	C	C	.	.			trans	-83.6	100.7	179.3	-171.8	165.2	71.9	0	0	109.6	L282 G287 V304 P305 C312 I324 F331	L282-M307 HydrophobicContact CD1-CE 4.05Å; L282-M307 HydrophobicContact CD1-SD 4.29Å; G287-M307 WeakPolarHBondContact O-CE 3.42Å; V304-M307 HydrophobicContact CB-CB 3.84Å; V304-M307 HydrophobicContact CG1-CB 4.16Å; V304-M307 VanDerWaalsContact O-CB 3.24Å; V304-M307 WeakPolarHBondContact O-CB 3.13Å; V304-M307 PolarHBondContact O-N 2.91Å; P305-M307 VanDerWaalsContact C-N 3.34Å; M307-C312 HydrophobicContact CG-CB 4.4Å; M307-C312 WeakPolarHBondContact CG-SG 3.37Å; M307-C312 HydrophobicContact SD-CB 4.29Å; M307-I324 HydrophobicContact CE-CD1 4.32Å; M307-I324 HydrophobicContact SD-CB 4.44Å; M307-I324 HydrophobicContact SD-CD1 3.71Å; M307-I324 HydrophobicContact SD-CG2 3.79Å; M307-F331 HydrophobicContact CB-CD2 4.32Å; M307-F331 HydrophobicContact CB-CE2 3.95Å; M307-F331 HydrophobicContact CB-CZ 4.29Å; M307-F331 HydrophobicContact CG-CD2 4.1Å; M307-F331 HydrophobicContact CG-CE2 3.87Å; M307-F331 HydrophobicContact SD-CD2 4.2Å
308	D	76.6	Confident	88.1	Confident	90 Å²	90	40.9 Å²	40.9	48%	0.481	21%	0.209	S	C	.	.			trans	-66.2	135.7	-179.9	-75.6	-23.1	0	0	0	112	S306 Q311	S306-D308 PolarHBondContact O-N 2.85Å; D308-Q311 HydrophobicContact CB-CB 4.24Å; D308-Q311 HydrophobicContact CB-CG 3.8Å; D308-Q311 VanDerWaalsContact CB-NE2 3.32Å; D308-Q311 PolarHBondContact OD2-NE2 2.92Å
309	K	81.4	Confident	87.9	Confident	124 Å²	124	44.3 Å²	44.3	54%	0.539	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	149.1	168.6	-62.3	174.1	173.3	-166.9	0	110.2	D284 V285 Q311	D284-K309 WeakPolarHBondContact O-CA 3.45Å; V285-K309 WeakPolarHBondContact O-CD 3.41Å; V285-K309 VanDerWaalsContact O-CE 3.25Å; V285-K309 WeakPolarHBondContact O-CE 3.22Å; V285-K309 WeakPolarHBondContact O-CG 3.45Å; K309-Q311 PolarHBondContact O-N 3.11Å; K309-Q311 VanDerWaalsContact O-N 3.14Å
310	H	80.4	Confident	87.8	Confident	118 Å²	118	44.3 Å²	44.3	55%	0.546	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	8	176.7	-53.2	-55.3	0	0	0	115.9	D284	D284-H310 PolarHBondContact O-N 3.22Å; D284-H310 VanDerWaalsContact OD1-C 3.3Å; D284-H310 WeakPolarHBondContact OD1-CA 3.37Å; D284-H310 PolarHBondContact OD1-N 2.99Å; D284-H310 IonicContact OD2-ND1 2.91Å
311	Q	87.2	Confident	87.9	Confident	44 Å²	44	45.6 Å²	45.6	21%	0.206	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-26.6	-179.3	-62.4	-167.5	21.9	0	0	113.9	D308 K309 C326 N327 N328	D308-Q311 HydrophobicContact CB-CB 4.24Å; D308-Q311 HydrophobicContact CB-CG 3.8Å; D308-Q311 VanDerWaalsContact CB-NE2 3.32Å; D308-Q311 PolarHBondContact OD2-NE2 2.92Å; K309-Q311 PolarHBondContact O-N 3.11Å; K309-Q311 VanDerWaalsContact O-N 3.14Å; Q311-C326 HydrophobicContact CB-CB 4.43Å; Q311-C326 CarbonylContact O-C 3.24Å; Q311-C326 VanDerWaalsContact O-CA 3.28Å; Q311-C326 WeakPolarHBondContact O-CA 3.4Å; Q311-N327 HydrophobicContact CB-CB 4.44Å; Q311-N327 PolarHBondContact O-N 2.67Å; Q311-N328 PolarHBondContact OE1-ND2 2.97Å; Q311-N328 VanDerWaalsContact OE1-ND2 3.13Å
312	C	92.5	Very high	88.1	Confident	4 Å²	4	44 Å²	44	3%	0.027	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	129.2	-171.1	-53.7	0	0	0	0	110.9	L282 M307 I324 C326	L282-C312 HydrophobicContact CD1-CB 4.35Å; L282-C312 VanDerWaalsContact CD2-C 3.42Å; L282-C312 HydrophobicContact CD2-CB 3.81Å; L282-C312 WeakPolarHBondContact CD2-O 3.32Å; M307-C312 HydrophobicContact CG-CB 4.4Å; M307-C312 WeakPolarHBondContact CG-SG 3.37Å; M307-C312 HydrophobicContact SD-CB 4.29Å; C312-I324 HydrophobicContact CB-CG2 3.99Å; C312-C326 HydrophobicContact CB-CB 3.97Å; C312-C326 WeakPolarHBondContact CB-SG 3.46Å; C312-C326 WeakPolarHBondContact SG-CB 3.4Å; C312-C326 CovalentContact SG-SG 2.02Å; C312-C326 PolarHBondContact SG-SG 2.9Å
313	K	93	Very high	88.4	Confident	39 Å²	39	44.6 Å²	44.6	17%	0.17	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	-27	-171.2	-61.1	-170.4	-159.4	144.1	0	114.9	F229 K269 G270 S325 G352	F229-K313 WeakPolarHBondContact CE1-O 3.46Å; F229-K313 HydrophobicContact CZ-CB 4.21Å; K269-K313 WeakPolarHBondContact CB-O 2.84Å; K269-K313 HydrophobicContact CD-CB 4.26Å; K269-K313 HydrophobicContact CD-CG 4.15Å; G270-K313 WeakPolarHBondContact CA-O 3.38Å; G270-K313 PolarHBondContact N-O 2.87Å; K313-S325 PolarHBondContact N-O 2.92Å; K313-G352 WeakPolarHBondContact CD-O 3.11Å
314	Y	95.6	Very high	88.8	Confident	10 Å²	10	43.5 Å²	43.5	4%	0.039	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	142.8	-178.3	-71.2	-97.8	0	0	0	109.6	V188 F229 I324 S325 I353 S395 D396	V188-Y314 WeakPolarHBondContact CG1-OH 3.47Å; V188-Y314 PolarHBondContact O-OH 3.37Å; F229-Y314 HydrophobicContact CE1-CE2 4.25Å; F229-Y314 HydrophobicContact CZ-CE2 4.13Å; Y314-I324 WeakPolarHBondContact O-CA 3.2Å; Y314-S325 PolarHBondContact O-N 2.79Å; Y314-I353 HydrophobicContact CE2-CB 4.34Å; Y314-S395 PolarHBondContact OH-O 3.04Å; Y314-D396 HydrophobicContact CE1-CB 4Å; Y314-D396 WeakPolarHBondContact CE1-OD2 3.39Å
315	V	96.3	Very high	89.4	Confident	6 Å²	6	43.3 Å²	43.3	4%	0.036	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	135.8	175	62.8	0	0	0	0	107.1	G270 S272 L282 I322 Y323 I324	G270-V315 VanDerWaalsContact C-CG1 3.46Å; G270-V315 WeakPolarHBondContact O-CG1 3.41Å; S272-V315 WeakPolarHBondContact CB-O 3.47Å; L282-V315 HydrophobicContact CB-CB 4.29Å; L282-V315 HydrophobicContact CB-CG1 4.1Å; V315-I322 HydrophobicContact CG2-CG2 3.28Å; V315-Y323 CarbonylContact C-O 3.53Å; V315-Y323 VanDerWaalsContact CA-O 3.32Å; V315-Y323 WeakPolarHBondContact CA-O 3.01Å; V315-I324 HydrophobicContact CG2-CG1 4.25Å
316	H	97	Very high	90.3	Very high	37 Å²	37	39.8 Å²	39.8	17%	0.171	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134.2	176.2	176.2	63.2	0	0	0	108.3	Y323 I355 N357	H316-Y323 PolarHBondContact N-O 2.85Å; H316-Y323 WeakPolarHBondContact O-CD2 3.4Å; H316-Y323 PolarHBondContact O-N 2.83Å; H316-I355 HydrophobicContact CB-CG2 3.92Å; H316-I355 WeakPolarHBondContact CB-O 3.21Å; H316-N357 VanDerWaalsContact CD2-CG 3.46Å; H316-N357 PolarHBondContact CD2-ND2 2.86Å; H316-N357 PolarHBondContact NE2-ND2 2.88Å
317	C	95.4	Very high	91	Very high	7 Å²	7	38.5 Å²	38.5	5%	0.047	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	138.5	174.4	-176.2	0	0	0	0	111.8	S272 C274 Y280 K319	S272-C317 PolarHBondContact OG-N 2.94Å; C274-C317 HydrophobicContact CB-CB 4.05Å; C274-C317 WeakPolarHBondContact CB-SG 3.31Å; C274-C317 WeakPolarHBondContact SG-CB 3.42Å; C274-C317 CovalentContact SG-SG 1.99Å; C274-C317 PolarHBondContact SG-SG 2.87Å; Y280-C317 HydrophobicContact CD2-CB 4.46Å; C317-K319 PolarHBondContact SG-O 3.18Å
318	R	91.8	Very high	91.3	Very high	59 Å²	59	41 Å²	41	22%	0.223	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	122.6	165.9	-178.2	178.9	-178.8	107	17.5	110	D320 V321 Y323 N357 D358	R318-D320 PolarHBondContact O-N 2.87Å; R318-V321 PolarHBondContact N-O 3.09Å; R318-V321 PolarHBondContact O-N 2.88Å; R318-Y323 HydrophobicContact CB-CE2 4.15Å; R318-N357 WeakPolarHBondContact CB-ND2 3.28Å; R318-N357 PolarHBondContact NH1-O 2.94Å; R318-D358 PolarHBondContact NE-O 2.88Å; R318-D358 PolarHBondContact NH1-O 2.73Å; R318-D358 PolarHBondContact NH2-O 3.01Å
319	K	89.8	Confident	92	Very high	120 Å²	120	37.2 Å²	37.2	52%	0.522	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	-119.7	-174	-59.2	177.9	176	-178.5	0	110.6	C317	C317-K319 PolarHBondContact SG-O 3.18Å
320	D	90.5	Very high	92.6	Very high	65 Å²	65	31.3 Å²	31.3	35%	0.348	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101	14.9	178.8	-59.7	-47.6	0	0	0	112.5	R318 I335 R336	R318-D320 PolarHBondContact O-N 2.87Å; D320-I335 WeakPolarHBondContact O-CB 3.39Å; D320-I335 VanDerWaalsContact O-CG1 3.28Å; D320-I335 WeakPolarHBondContact O-CG1 3.45Å; D320-I335 PolarHBondContact O-N 3.25Å; D320-R336 HydrophobicContact CB-CB 4.15Å
321	V	93.8	Very high	93.2	Very high	28 Å²	28	26.1 Å²	26.1	17%	0.17	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	130.7	-178.3	-170.7	0	0	0	0	110.8	R318 Y323 V332 V333	R318-V321 PolarHBondContact N-O 3.09Å; R318-V321 PolarHBondContact O-N 2.88Å; V321-Y323 HydrophobicContact CB-CE2 3.76Å; V321-Y323 HydrophobicContact CG1-CD2 4.27Å; V321-Y323 HydrophobicContact CG1-CE1 3.99Å; V321-Y323 HydrophobicContact CG1-CE2 3.55Å; V321-Y323 VanDerWaalsContact CG1-CZ 3.44Å; V321-Y323 WeakPolarHBondContact O-CE2 3.24Å; V321-V332 HydrophobicContact CG1-CG1 3.59Å; V321-V333 CarbonylContact C-O 3.55Å; V321-V333 VanDerWaalsContact CA-O 3.3Å; V321-V333 WeakPolarHBondContact CA-O 3.47Å
322	I	95	Very high	93.5	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	135.5	174.7	-55.2	174.6	0	0	0	109	Y280 I302 V315 I324 V332 V333 I335	Y280-I322 HydrophobicContact CD1-CD1 3.32Å; Y280-I322 HydrophobicContact CD1-CG1 4.29Å; Y280-I322 HydrophobicContact CE1-CD1 3.51Å; Y280-I322 HydrophobicContact CE1-CG1 4.42Å; Y280-I322 HydrophobicContact CG-CD1 4.02Å; I302-I322 HydrophobicContact CD1-CD1 3.47Å; I302-I322 VanDerWaalsContact CD1-CD1 3.47Å; V315-I322 HydrophobicContact CG2-CG2 3.28Å; I322-I324 HydrophobicContact CG2-CD1 4.41Å; I322-I324 HydrophobicContact CG2-CG1 3.87Å; I322-V332 WeakPolarHBondContact O-CA 3.18Å; I322-V333 HydrophobicContact CB-CB 4.31Å; I322-V333 PolarHBondContact N-O 2.97Å; I322-V333 PolarHBondContact O-N 2.79Å; I322-I335 HydrophobicContact CD1-CD1 3.68Å; I322-I335 HydrophobicContact CD1-CG1 3.86Å; I322-I335 HydrophobicContact CG1-CD1 3.72Å; I322-I335 HydrophobicContact CG1-CG1 3.95Å
323	Y	96.1	Very high	93.4	Very high	15 Å²	15	24.1 Å²	24.1	6%	0.059	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	120.1	178.5	-54.5	-97.9	0	0	0	107.7	V315 H316 R318 V321 F331 V332 N357 I363	V315-Y323 CarbonylContact C-O 3.53Å; V315-Y323 VanDerWaalsContact CA-O 3.32Å; V315-Y323 WeakPolarHBondContact CA-O 3.01Å; H316-Y323 PolarHBondContact N-O 2.85Å; H316-Y323 WeakPolarHBondContact O-CD2 3.4Å; H316-Y323 PolarHBondContact O-N 2.83Å; R318-Y323 HydrophobicContact CB-CE2 4.15Å; V321-Y323 HydrophobicContact CB-CE2 3.76Å; V321-Y323 HydrophobicContact CG1-CD2 4.27Å; V321-Y323 HydrophobicContact CG1-CE1 3.99Å; V321-Y323 HydrophobicContact CG1-CE2 3.55Å; V321-Y323 VanDerWaalsContact CG1-CZ 3.44Å; V321-Y323 WeakPolarHBondContact O-CE2 3.24Å; Y323-F331 CarbonylContact C-O 3.56Å; Y323-F331 WeakPolarHBondContact CA-O 3.38Å; Y323-V332 HydrophobicContact CD1-CB 4.46Å; Y323-V332 HydrophobicContact CD1-CG1 3.96Å; Y323-V332 HydrophobicContact CD1-CG2 3.96Å; Y323-V332 HydrophobicContact CE1-CG1 3.7Å; Y323-V332 HydrophobicContact CE1-CG2 4.31Å; Y323-N357 WeakPolarHBondContact CD2-ND2 3.49Å; Y323-N357 WeakPolarHBondContact CE2-ND2 3.01Å; Y323-N357 VanDerWaalsContact CZ-ND2 3.29Å; Y323-I363 HydrophobicContact CD1-CD1 3.93Å; Y323-I363 HydrophobicContact CD1-CG1 4.01Å; Y323-I363 HydrophobicContact CD1-CG2 4.1Å; Y323-I363 HydrophobicContact CE1-CD1 3.66Å; Y323-I363 HydrophobicContact CE1-CG1 3.64Å
324	I	95.7	Very high	93.3	Very high	1 Å²	1	25 Å²	25	1%	0.005	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	117.9	-175.8	-47.9	172.1	0	0	0	108.3	L282 V289 M307 C312 Y314 V315 I322 I330 F331 V333	L282-I324 HydrophobicContact CD1-CG2 3.97Å; L282-I324 HydrophobicContact CD2-CG2 4.09Å; V289-I324 HydrophobicContact CG2-CD1 3.66Å; V289-I324 HydrophobicContact CG2-CG1 4.39Å; M307-I324 HydrophobicContact CE-CD1 4.32Å; M307-I324 HydrophobicContact SD-CB 4.44Å; M307-I324 HydrophobicContact SD-CD1 3.71Å; M307-I324 HydrophobicContact SD-CG2 3.79Å; C312-I324 HydrophobicContact CB-CG2 3.99Å; Y314-I324 WeakPolarHBondContact O-CA 3.2Å; V315-I324 HydrophobicContact CG2-CG1 4.25Å; I322-I324 HydrophobicContact CG2-CD1 4.41Å; I322-I324 HydrophobicContact CG2-CG1 3.87Å; I324-I330 CarbonylContact O-C 3.56Å; I324-I330 VanDerWaalsContact O-CA 3.27Å; I324-I330 WeakPolarHBondContact O-CA 3.1Å; I324-F331 HydrophobicContact CB-CB 4.21Å; I324-F331 HydrophobicContact CD1-CB 4.44Å; I324-F331 PolarHBondContact N-O 3.21Å; I324-F331 PolarHBondContact O-N 2.9Å; I324-V333 HydrophobicContact CD1-CG2 4.38Å
325	S	95.7	Very high	92.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	117.1	179.1	176.6	0	0	0	0	110.5	K313 Y314 G352 I353	K313-S325 PolarHBondContact N-O 2.92Å; Y314-S325 PolarHBondContact O-N 2.79Å; S325-G352 PolarHBondContact OG-N 3.43Å; S325-I353 WeakPolarHBondContact CB-O 3.31Å; S325-I353 PolarHBondContact OG-N 3.26Å; S325-I353 PolarHBondContact OG-O 2.84Å
326	C	94.1	Very high	92.5	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.014	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	159	178	-47.6	0	0	0	0	110.5	Q311 C312 N328 A329 F331 Y351 G352	Q311-C326 HydrophobicContact CB-CB 4.43Å; Q311-C326 CarbonylContact O-C 3.24Å; Q311-C326 VanDerWaalsContact O-CA 3.28Å; Q311-C326 WeakPolarHBondContact O-CA 3.4Å; C312-C326 HydrophobicContact CB-CB 3.97Å; C312-C326 WeakPolarHBondContact CB-SG 3.46Å; C312-C326 WeakPolarHBondContact SG-CB 3.4Å; C312-C326 CovalentContact SG-SG 2.02Å; C312-C326 PolarHBondContact SG-SG 2.9Å; C326-N328 PolarHBondContact O-N 3.41Å; C326-A329 CarbonylContact C-O 3.58Å; C326-A329 WeakPolarHBondContact CA-O 3.26Å; C326-A329 VanDerWaalsContact CB-O 3.32Å; C326-A329 WeakPolarHBondContact CB-O 3.49Å; C326-A329 PolarHBondContact N-O 2.94Å; C326-A329 PolarHBondContact O-N 2.84Å; C326-F331 HydrophobicContact CB-CE2 4.41Å; C326-F331 VanDerWaalsContact SG-CD2 3.56Å; C326-F331 VanDerWaalsContact SG-CE2 3.52Å; C326-Y351 CarbonylContact O-C 3.59Å; C326-Y351 WeakPolarHBondContact O-CB 3.48Å; C326-G352 PolarHBondContact O-N 2.88Å; C326-G352 VanDerWaalsContact O-N 3.1Å
327	N	91	Very high	92.1	Very high	27 Å²	27	35.9 Å²	35.9	14%	0.144	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	-40.1	-177	-71.6	-24.4	0	0	0	113.5	Q311 G349 A350 Y351 R368	Q311-N327 HydrophobicContact CB-CB 4.44Å; Q311-N327 PolarHBondContact O-N 2.67Å; N327-G349 CarbonylContact O-C 3.56Å; N327-G349 VanDerWaalsContact O-C 3.23Å; N327-G349 WeakPolarHBondContact O-CA 3.24Å; N327-G349 PolarHBondContact O-N 2.77Å; N327-G349 VanDerWaalsContact O-N 3.12Å; N327-A350 PolarHBondContact O-N 3.42Å; N327-Y351 PolarHBondContact O-N 2.92Å; N327-Y351 VanDerWaalsContact O-N 3.12Å; N327-R368 PolarHBondContact OD1-NH1 2.95Å
328	N	89.2	Confident	91.6	Very high	63 Å²	63	41.9 Å²	41.9	34%	0.337	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-3.5	-171	-59.7	-35.3	0	0	0	114.3	Q311 C326 A345 P348 G349	Q311-N328 PolarHBondContact OE1-ND2 2.97Å; Q311-N328 VanDerWaalsContact OE1-ND2 3.13Å; C326-N328 PolarHBondContact O-N 3.41Å; N328-A345 VanDerWaalsContact C-CB 3.41Å; N328-A345 WeakPolarHBondContact O-CB 3.36Å; N328-A345 PolarHBondContact O-N 2.9Å; N328-P348 VanDerWaalsContact OD1-CA 3.26Å; N328-P348 WeakPolarHBondContact OD1-CA 3.46Å; N328-G349 PolarHBondContact OD1-N 3.22Å
329	A	91	Very high	91.3	Very high	11 Å²	11	44.7 Å²	44.7	9%	0.091	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.4	163.6	-175.1	0	0	0	0	0	112.1	C326 F331 T342 I343	C326-A329 CarbonylContact C-O 3.58Å; C326-A329 WeakPolarHBondContact CA-O 3.26Å; C326-A329 VanDerWaalsContact CB-O 3.32Å; C326-A329 WeakPolarHBondContact CB-O 3.49Å; C326-A329 PolarHBondContact N-O 2.94Å; C326-A329 PolarHBondContact O-N 2.84Å; A329-F331 HydrophobicContact CB-CZ 4.42Å; A329-T342 HydrophobicContact CB-CG2 3.64Å; A329-I343 CarbonylContact C-O 3.5Å; A329-I343 VanDerWaalsContact CA-O 3.25Å; A329-I343 WeakPolarHBondContact CA-O 3.34Å
330	I	92.7	Very high	91.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	129.6	165.3	-56.2	161.3	0	0	0	107.7	I324 V332 T342 I343 Y351 I355 V365 Y376	I324-I330 CarbonylContact O-C 3.56Å; I324-I330 VanDerWaalsContact O-CA 3.27Å; I324-I330 WeakPolarHBondContact O-CA 3.1Å; I330-V332 HydrophobicContact CG2-CG2 4.24Å; I330-T342 WeakPolarHBondContact O-CA 3.23Å; I330-I343 HydrophobicContact CB-CB 4.21Å; I330-I343 PolarHBondContact N-O 3.22Å; I330-I343 PolarHBondContact O-N 2.98Å; I330-Y351 HydrophobicContact CD1-CD2 4.18Å; I330-Y351 HydrophobicContact CD1-CE2 4.01Å; I330-Y351 HydrophobicContact CG1-CD2 3.98Å; I330-Y351 HydrophobicContact CG1-CE2 4.24Å; I330-I355 HydrophobicContact CD1-CD1 4.34Å; I330-I355 HydrophobicContact CG1-CD1 4.32Å; I330-I355 HydrophobicContact CG2-CD1 3.45Å; I330-I355 VanDerWaalsContact CG2-CD1 3.45Å; I330-V365 HydrophobicContact CD1-CB 3.7Å; I330-V365 HydrophobicContact CD1-CG1 3.69Å; I330-V365 HydrophobicContact CD1-CG2 3.83Å; I330-V365 HydrophobicContact CG1-CG2 4.24Å; I330-Y376 HydrophobicContact CD1-CE2 4.32Å
331	F	93.1	Very high	91.1	Very high	9 Å²	9	38 Å²	38	4%	0.039	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	126.9	169.5	-60.1	-76.4	0	0	0	109.3	P119 V304 S306 M307 Y323 I324 C326 A329 V333 T342	P119-F331 HydrophobicContact CB-CD1 4.44Å; P119-F331 HydrophobicContact CG-CD1 4.31Å; P119-F331 HydrophobicContact CG-CE1 4.26Å; V304-F331 HydrophobicContact CG1-CD1 3.91Å; V304-F331 HydrophobicContact CG1-CE1 4.22Å; V304-F331 HydrophobicContact CG1-CG 4.32Å; S306-F331 WeakPolarHBondContact O-CZ 3.42Å; S306-F331 WeakPolarHBondContact OG-CE1 3.48Å; M307-F331 HydrophobicContact CB-CD2 4.32Å; M307-F331 HydrophobicContact CB-CE2 3.95Å; M307-F331 HydrophobicContact CB-CZ 4.29Å; M307-F331 HydrophobicContact CG-CD2 4.1Å; M307-F331 HydrophobicContact CG-CE2 3.87Å; M307-F331 HydrophobicContact SD-CD2 4.2Å; Y323-F331 CarbonylContact C-O 3.56Å; Y323-F331 WeakPolarHBondContact CA-O 3.38Å; I324-F331 HydrophobicContact CB-CB 4.21Å; I324-F331 HydrophobicContact CD1-CB 4.44Å; I324-F331 PolarHBondContact N-O 3.21Å; I324-F331 PolarHBondContact O-N 2.9Å; C326-F331 HydrophobicContact CB-CE2 4.41Å; C326-F331 VanDerWaalsContact SG-CD2 3.56Å; C326-F331 VanDerWaalsContact SG-CE2 3.52Å; A329-F331 HydrophobicContact CB-CZ 4.42Å; F331-V333 HydrophobicContact CB-CG2 4.42Å; F331-T342 HydrophobicContact CD1-CG2 4.14Å; F331-T342 WeakPolarHBondContact CD1-OG1 3.25Å; F331-T342 HydrophobicContact CE1-CG2 3.82Å; F331-T342 WeakPolarHBondContact CE1-OG1 3.4Å; F331-T342 HydrophobicContact CZ-CG2 4.47Å
332	V	93.3	Very high	91	Very high	6 Å²	6	37.1 Å²	37.1	4%	0.036	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	116.4	173.8	-174.5	0	0	0	0	107.1	V321 I322 Y323 I330 A340 F341 I343 I363	V321-V332 HydrophobicContact CG1-CG1 3.59Å; I322-V332 WeakPolarHBondContact O-CA 3.18Å; Y323-V332 HydrophobicContact CD1-CB 4.46Å; Y323-V332 HydrophobicContact CD1-CG1 3.96Å; Y323-V332 HydrophobicContact CD1-CG2 3.96Å; Y323-V332 HydrophobicContact CE1-CG1 3.7Å; Y323-V332 HydrophobicContact CE1-CG2 4.31Å; I330-V332 HydrophobicContact CG2-CG2 4.24Å; V332-A340 CarbonylContact O-C 3.46Å; V332-A340 WeakPolarHBondContact O-CA 3.32Å; V332-A340 WeakPolarHBondContact O-CB 3.48Å; V332-F341 HydrophobicContact CB-CD1 3.97Å; V332-F341 HydrophobicContact CB-CD2 4.24Å; V332-F341 HydrophobicContact CB-CE1 3.54Å; V332-F341 HydrophobicContact CB-CE2 3.82Å; V332-F341 HydrophobicContact CB-CG 4.31Å; V332-F341 HydrophobicContact CB-CZ 3.46Å; V332-F341 VanDerWaalsContact CB-CZ 3.46Å; V332-F341 HydrophobicContact CG1-CD1 4.28Å; V332-F341 HydrophobicContact CG1-CE1 3.5Å; V332-F341 HydrophobicContact CG1-CE2 4.45Å; V332-F341 HydrophobicContact CG1-CZ 3.61Å; V332-F341 HydrophobicContact CG2-CD2 4.32Å; V332-F341 HydrophobicContact CG2-CE1 4.2Å; V332-F341 HydrophobicContact CG2-CE2 3.63Å; V332-F341 HydrophobicContact CG2-CZ 3.58Å; V332-F341 PolarHBondContact N-O 3.04Å; V332-F341 PolarHBondContact O-N 2.02Å; V332-I343 HydrophobicContact CG2-CD1 4.16Å; V332-I363 HydrophobicContact CG2-CD1 3.84Å
333	V	92.4	Very high	90.7	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	110.3	-170.1	-176.7	0	0	0	0	108.9	I117 I302 V304 V321 I322 I324 F331 I335 A340	I117-V333 HydrophobicContact CD1-CG1 3.31Å; I117-V333 HydrophobicContact CG2-CG1 4.44Å; I302-V333 HydrophobicContact CG2-CG1 4.33Å; V304-V333 HydrophobicContact CG2-CG2 3.99Å; V321-V333 CarbonylContact C-O 3.55Å; V321-V333 VanDerWaalsContact CA-O 3.3Å; V321-V333 WeakPolarHBondContact CA-O 3.47Å; I322-V333 HydrophobicContact CB-CB 4.31Å; I322-V333 PolarHBondContact N-O 2.97Å; I322-V333 PolarHBondContact O-N 2.79Å; I324-V333 HydrophobicContact CD1-CG2 4.38Å; F331-V333 HydrophobicContact CB-CG2 4.42Å; V333-I335 PolarHBondContact O-N 3.41Å; V333-A340 HydrophobicContact CB-CB 4.43Å; V333-A340 HydrophobicContact CG2-CB 3.99Å
334	D	90.8	Very high	90.4	Very high	58 Å²	58	39 Å²	39	31%	0.31	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	107.6	168.8	-171.3	-38.1	0	0	0	108.6	R336 A337 E338 Q339	D334-R336 VanDerWaalsContact C-N 3.3Å; D334-R336 PolarHBondContact O-N 3.01Å; D334-R336 PolarHBondContact OD1-N 2.98Å; D334-A337 HydrophobicContact CB-CB 4.02Å; D334-A337 VanDerWaalsContact CG-CB 3.5Å; D334-A337 PolarHBondContact OD1-N 3.32Å; D334-E338 WeakPolarHBondContact O-CA 3.22Å; D334-E338 PolarHBondContact O-N 2.84Å; D334-Q339 PolarHBondContact N-O 2.91Å; D334-Q339 PolarHBondContact O-N 3.06Å
335	I	87.3	Confident	89.7	Confident	32 Å²	32	39.7 Å²	39.7	16%	0.164	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-39.8	-177	-55.3	169.9	0	0	0	110.2	Y280 I302 D320 I322 V333 E338	Y280-I335 HydrophobicContact CE1-CD1 3.83Å; Y280-I335 WeakPolarHBondContact OH-CD1 3.3Å; I302-I335 HydrophobicContact CD1-CG1 4.26Å; D320-I335 WeakPolarHBondContact O-CB 3.39Å; D320-I335 VanDerWaalsContact O-CG1 3.28Å; D320-I335 WeakPolarHBondContact O-CG1 3.45Å; D320-I335 PolarHBondContact O-N 3.25Å; I322-I335 HydrophobicContact CD1-CD1 3.68Å; I322-I335 HydrophobicContact CD1-CG1 3.86Å; I322-I335 HydrophobicContact CG1-CD1 3.72Å; I322-I335 HydrophobicContact CG1-CG1 3.95Å; V333-I335 PolarHBondContact O-N 3.41Å; I335-E338 PolarHBondContact O-N 3.17Å
336	R	87.5	Confident	89	Confident	204 Å²	204	42.2 Å²	42.2	77%	0.77	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-38.2	-172.9	-176.9	178.3	177.4	-176.6	-0.9	111.6	D320 D334 E338	D320-R336 HydrophobicContact CB-CB 4.15Å; D334-R336 VanDerWaalsContact C-N 3.3Å; D334-R336 PolarHBondContact O-N 3.01Å; D334-R336 PolarHBondContact OD1-N 2.98Å; R336-E338 VanDerWaalsContact C-N 3.27Å
337	A	87.5	Confident	88.4	Confident	44 Å²	44	44.5 Å²	44.5	36%	0.364	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-9.5	176.3	0	0	0	0	0	112.8	D334 Q339	D334-A337 HydrophobicContact CB-CB 4.02Å; D334-A337 VanDerWaalsContact CG-CB 3.5Å; D334-A337 PolarHBondContact OD1-N 3.32Å; A337-Q339 HydrophobicContact CB-CB 4.29Å; A337-Q339 HydrophobicContact CB-CG 4.39Å; A337-Q339 WeakPolarHBondContact O-CG 3.32Å; A337-Q339 PolarHBondContact O-N 3.3Å
338	E	86	Confident	87.9	Confident	133 Å²	133	48.9 Å²	48.9	62%	0.621	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	40.7	-172.9	-60.9	-179	178.4	0	0	111.9	V115 D334 I335 R336	V115-E338 HydrophobicContact CG1-CG 4.31Å; D334-E338 WeakPolarHBondContact O-CA 3.22Å; D334-E338 PolarHBondContact O-N 2.84Å; I335-E338 PolarHBondContact O-N 3.17Å; R336-E338 VanDerWaalsContact C-N 3.27Å
339	Q	86	Confident	87.7	Confident	119 Å²	119	47.1 Å²	47.1	56%	0.556	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	147.1	-177	-75.7	176.5	24.8	0	0	110.1	I117 D334 A337	I117-Q339 VanDerWaalsContact CG2-C 3.44Å; D334-Q339 PolarHBondContact N-O 2.91Å; D334-Q339 PolarHBondContact O-N 3.06Å; A337-Q339 HydrophobicContact CB-CB 4.29Å; A337-Q339 HydrophobicContact CB-CG 4.39Å; A337-Q339 WeakPolarHBondContact O-CG 3.32Å; A337-Q339 PolarHBondContact O-N 3.3Å
340	A	88.1	Confident	87.4	Confident	7 Å²	7	47 Å²	47	6%	0.058	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	159.1	169.8	0	0	0	0	0	111.1	I117 P119 K120 V332 V333	I117-A340 HydrophobicContact CG2-CB 3.44Å; I117-A340 VanDerWaalsContact CG2-CB 3.44Å; P119-A340 CarbonylContact C-O 3.23Å; P119-A340 VanDerWaalsContact CA-O 3.26Å; P119-A340 WeakPolarHBondContact CA-O 3.35Å; P119-A340 HydrophobicContact CB-CB 3.87Å; K120-A340 PolarHBondContact N-O 3.11Å; V332-A340 CarbonylContact O-C 3.46Å; V332-A340 WeakPolarHBondContact O-CA 3.32Å; V332-A340 WeakPolarHBondContact O-CB 3.48Å; V333-A340 HydrophobicContact CB-CB 4.43Å; V333-A340 HydrophobicContact CG2-CB 3.99Å
341	F	87.7	Confident	87.3	Confident	37 Å²	37	47 Å²	47	16%	0.162	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	162	163.5	69	-92.4	0	0	0	110.7	K120 Y122 V332 I343 N378	K120-F341 HydrophobicContact CB-CB 4.41Å; K120-F341 CarbonylContact O-C 3.53Å; K120-F341 WeakPolarHBondContact O-CA 3.47Å; K120-F341 WeakPolarHBondContact O-CB 3.21Å; Y122-F341 HydrophobicContact CD2-CB 4.2Å; Y122-F341 HydrophobicContact CD2-CD2 4.04Å; Y122-F341 HydrophobicContact CD2-CG 4.42Å; Y122-F341 HydrophobicContact CE2-CB 3.87Å; Y122-F341 HydrophobicContact CE2-CD2 4.14Å; Y122-F341 HydrophobicContact CE2-CG 4.13Å; V332-F341 HydrophobicContact CB-CD1 3.97Å; V332-F341 HydrophobicContact CB-CD2 4.24Å; V332-F341 HydrophobicContact CB-CE1 3.54Å; V332-F341 HydrophobicContact CB-CE2 3.82Å; V332-F341 HydrophobicContact CB-CG 4.31Å; V332-F341 HydrophobicContact CB-CZ 3.46Å; V332-F341 VanDerWaalsContact CB-CZ 3.46Å; V332-F341 HydrophobicContact CG1-CD1 4.28Å; V332-F341 HydrophobicContact CG1-CE1 3.5Å; V332-F341 HydrophobicContact CG1-CE2 4.45Å; V332-F341 HydrophobicContact CG1-CZ 3.61Å; V332-F341 HydrophobicContact CG2-CD2 4.32Å; V332-F341 HydrophobicContact CG2-CE1 4.2Å; V332-F341 HydrophobicContact CG2-CE2 3.63Å; V332-F341 HydrophobicContact CG2-CZ 3.58Å; V332-F341 PolarHBondContact N-O 3.04Å; V332-F341 PolarHBondContact O-N 2.02Å; F341-I343 HydrophobicContact CD2-CG1 4.18Å; F341-I343 HydrophobicContact CE2-CD1 4.04Å; F341-I343 HydrophobicContact CE2-CG1 3.77Å; F341-N378 WeakPolarHBondContact CZ-O 3.5Å
342	T	90.6	Very high	87	Confident	10 Å²	10	46.6 Å²	46.6	6%	0.061	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	132.3	-177.3	-53.3	0	0	0	0	109.6	P119 K120 Y122 A329 I330 F331	P119-T342 WeakPolarHBondContact CB-OG1 3.25Å; K120-T342 PolarHBondContact O-N 2.71Å; Y122-T342 PolarHBondContact N-O 3.14Å; Y122-T342 VanDerWaalsContact N-O 3.12Å; A329-T342 HydrophobicContact CB-CG2 3.64Å; I330-T342 WeakPolarHBondContact O-CA 3.23Å; F331-T342 HydrophobicContact CD1-CG2 4.14Å; F331-T342 WeakPolarHBondContact CD1-OG1 3.25Å; F331-T342 HydrophobicContact CE1-CG2 3.82Å; F331-T342 WeakPolarHBondContact CE1-OG1 3.4Å; F331-T342 HydrophobicContact CZ-CG2 4.47Å
343	I	89.4	Confident	87	Confident	5 Å²	5	46.9 Å²	46.9	3%	0.026	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	112.4	166.9	-53.4	171.8	0	0	0	106.9	A329 I330 V332 F341 I363 Y376	A329-I343 CarbonylContact C-O 3.5Å; A329-I343 VanDerWaalsContact CA-O 3.25Å; A329-I343 WeakPolarHBondContact CA-O 3.34Å; I330-I343 HydrophobicContact CB-CB 4.21Å; I330-I343 PolarHBondContact N-O 3.22Å; I330-I343 PolarHBondContact O-N 2.98Å; V332-I343 HydrophobicContact CG2-CD1 4.16Å; F341-I343 HydrophobicContact CD2-CG1 4.18Å; F341-I343 HydrophobicContact CE2-CD1 4.04Å; F341-I343 HydrophobicContact CE2-CG1 3.77Å; I343-I363 HydrophobicContact CD1-CD1 3.93Å; I343-Y376 HydrophobicContact CD1-CD1 4.26Å; I343-Y376 HydrophobicContact CD1-CG 4.11Å; I343-Y376 HydrophobicContact CG2-CD1 3.74Å; I343-Y376 HydrophobicContact CG2-CE1 3.33Å; I343-Y376 HydrophobicContact CG2-CE2 4.25Å; I343-Y376 HydrophobicContact CG2-CG 4.36Å
344	N	88.5	Confident	87.1	Confident	49 Å²	49	46.9 Å²	46.9	26%	0.262	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	138.7	178.8	-69.4	-23.6	0	0	0	110.6	D123	D123-N344 PolarHBondContact OD1-ND2 2.93Å; D123-N344 VanDerWaalsContact OD1-ND2 3.14Å
345	A	82.9	Confident	87.4	Confident	17 Å²	17	44.4 Å²	44.4	14%	0.14	24%	0.24	C	C	.	.			trans	-65	144.9	172.5	0	0	0	0	0	110.8	N328 T347 A350 Y351	N328-A345 VanDerWaalsContact C-CB 3.41Å; N328-A345 WeakPolarHBondContact O-CB 3.36Å; N328-A345 PolarHBondContact O-N 2.9Å; A345-T347 WeakPolarHBondContact CB-O 3.16Å; A345-T347 PolarHBondContact O-N 3.13Å; A345-A350 HydrophobicContact CB-CB 4.23Å; A345-Y351 HydrophobicContact CB-CD2 3.61Å; A345-Y351 HydrophobicContact CB-CE2 3.76Å; A345-Y351 HydrophobicContact CB-CG 4.39Å
346	P	80.6	Confident	87.9	Confident	53 Å²	53	43.3 Å²	43.3	34%	0.344	24%	0.235	S	C	.	.	S	Bend	trans	-64.4	-27.6	178.6	25.9	-34.8	0	0	0	112.4	A350 Y351	P346-A350 HydrophobicContact CG-CB 4.31Å; P346-Y351 WeakPolarHBondContact CD-OH 3.36Å
347	T	80.1	Confident	88.2	Confident	50 Å²	50	33.8 Å²	33.8	31%	0.307	20%	0.2	S	C	.	.	S	Bend	trans	-142.5	152.4	171.2	56.1	0	0	0	0	110	L144 A345 G349 A350	L144-T347 HydrophobicContact CD2-CG2 4.35Å; A345-T347 WeakPolarHBondContact CB-O 3.16Å; A345-T347 PolarHBondContact O-N 3.13Å; T347-G349 PolarHBondContact O-N 3.09Å; T347-A350 VanDerWaalsContact O-CB 3.28Å; T347-A350 WeakPolarHBondContact O-CB 3.25Å; T347-A350 PolarHBondContact O-N 2.72Å
348	P	82.2	Confident	88.3	Confident	118 Å²	118	32 Å²	32	77%	0.766	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	132.8	175.1	-25.7	34.7	0	0	0	111.8	N328 A350	N328-P348 VanDerWaalsContact OD1-CA 3.26Å; N328-P348 WeakPolarHBondContact OD1-CA 3.46Å; P348-A350 VanDerWaalsContact C-N 3.29Å; P348-A350 PolarHBondContact O-N 3.37Å
349	G	84.5	Confident	88.5	Confident	26 Å²	26	29.6 Å²	29.6	27%	0.268	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.5	5.6	178.8	0	0	0	0	0	115.7	N327 N328 T347 Y351	N327-G349 CarbonylContact O-C 3.56Å; N327-G349 VanDerWaalsContact O-C 3.23Å; N327-G349 WeakPolarHBondContact O-CA 3.24Å; N327-G349 PolarHBondContact O-N 2.77Å; N327-G349 VanDerWaalsContact O-N 3.12Å; N328-G349 PolarHBondContact OD1-N 3.22Å; T347-G349 PolarHBondContact O-N 3.09Å; G349-Y351 PolarHBondContact O-N 3.21Å
350	A	84.1	Confident	88.6	Confident	9 Å²	9	28 Å²	28	7%	0.074	19%	0.186	C	C	.	.	S	Bend	trans	-64.3	-24.2	179.9	0	0	0	0	0	113.4	N327 A345 P346 T347 P348 R367 R368	N327-A350 PolarHBondContact O-N 3.42Å; A345-A350 HydrophobicContact CB-CB 4.23Å; P346-A350 HydrophobicContact CG-CB 4.31Å; T347-A350 VanDerWaalsContact O-CB 3.28Å; T347-A350 WeakPolarHBondContact O-CB 3.25Å; T347-A350 PolarHBondContact O-N 2.72Å; P348-A350 VanDerWaalsContact C-N 3.29Å; P348-A350 PolarHBondContact O-N 3.37Å; A350-R367 CarbonylContact O-C 3.51Å; A350-R367 WeakPolarHBondContact O-CA 3.33Å; A350-R368 PolarHBondContact O-N 3.23Å
351	Y	89.8	Confident	88.8	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	19%	0.189	C	C	.	.			trans	-117.3	-153.7	-176.1	-61.7	-33.2	0	0	0	111.7	C326 N327 I330 A345 P346 G349 V365 R367 D374 Y376	C326-Y351 CarbonylContact O-C 3.59Å; C326-Y351 WeakPolarHBondContact O-CB 3.48Å; N327-Y351 PolarHBondContact O-N 2.92Å; N327-Y351 VanDerWaalsContact O-N 3.12Å; I330-Y351 HydrophobicContact CD1-CD2 4.18Å; I330-Y351 HydrophobicContact CD1-CE2 4.01Å; I330-Y351 HydrophobicContact CG1-CD2 3.98Å; I330-Y351 HydrophobicContact CG1-CE2 4.24Å; A345-Y351 HydrophobicContact CB-CD2 3.61Å; A345-Y351 HydrophobicContact CB-CE2 3.76Å; A345-Y351 HydrophobicContact CB-CG 4.39Å; P346-Y351 WeakPolarHBondContact CD-OH 3.36Å; G349-Y351 PolarHBondContact O-N 3.21Å; Y351-V365 HydrophobicContact CD1-CB 4.41Å; Y351-V365 HydrophobicContact CD1-CG1 3.97Å; Y351-V365 HydrophobicContact CD1-CG2 3.57Å; Y351-V365 HydrophobicContact CD2-CG2 4.45Å; Y351-V365 HydrophobicContact CE1-CB 4.36Å; Y351-V365 HydrophobicContact CE1-CG1 3.45Å; Y351-V365 VanDerWaalsContact CE1-CG1 3.45Å; Y351-V365 HydrophobicContact CE1-CG2 4Å; Y351-V365 HydrophobicContact CE2-CG1 4.34Å; Y351-V365 HydrophobicContact CG-CG2 3.87Å; Y351-R367 HydrophobicContact CE1-CG 4.09Å; Y351-D374 WeakPolarHBondContact CE1-OD2 3.1Å; Y351-D374 PolarHBondContact OH-OD2 2.87Å; Y351-Y376 PolarHBondContact OH-OH 3.21Å
352	G	88.4	Confident	89.1	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	83.2	27.5	-174.9	0	0	0	0	0	113.2	K313 S325 C326	K313-G352 WeakPolarHBondContact CD-O 3.11Å; S325-G352 PolarHBondContact OG-N 3.43Å; C326-G352 PolarHBondContact O-N 2.88Å; C326-G352 VanDerWaalsContact O-N 3.1Å
353	I	92.7	Very high	89.4	Confident	13 Å²	13	29.8 Å²	29.8	7%	0.067	19%	0.193	C	C	.	.	S	Bend	trans	-132.6	-164.4	170.1	62.2	160.8	0	0	0	109.7	Y314 S325 A366 R367 R368 W394 S395	Y314-I353 HydrophobicContact CE2-CB 4.34Å; S325-I353 WeakPolarHBondContact CB-O 3.31Å; S325-I353 PolarHBondContact OG-N 3.26Å; S325-I353 PolarHBondContact OG-O 2.84Å; I353-A366 HydrophobicContact CD1-CB 3.36Å; I353-A366 HydrophobicContact CG1-CB 3.77Å; I353-A366 WeakPolarHBondContact CG1-O 3.22Å; I353-R367 WeakPolarHBondContact CD1-O 3.19Å; I353-R368 HydrophobicContact CG2-CB 4.48Å; I353-R368 HydrophobicContact CG2-CG 4.33Å; I353-W394 HydrophobicContact CD1-CB 4.48Å; I353-W394 VanDerWaalsContact CD1-O 3.31Å; I353-W394 WeakPolarHBondContact CD1-O 3.42Å; I353-S395 WeakPolarHBondContact CB-O 3.5Å
354	G	94.4	Very high	89.7	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	19%	0.192	C	C	.	.			trans	-46.5	142.8	-174.7	0	0	0	0	0	116.8	A366 S395 D396	G354-A366 PolarHBondContact O-N 3.26Å; G354-S395 PolarHBondContact N-O 3.46Å; G354-S395 VanDerWaalsContact N-O 3.13Å; G354-D396 WeakPolarHBondContact CA-OD1 3.27Å
355	I	97.5	Very high	90.1	Very high	7 Å²	7	27.5 Å²	27.5	4%	0.036	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	138.2	177.9	-176.8	162.5	0	0	0	109.2	H316 I330 I363 Y364	H316-I355 HydrophobicContact CB-CG2 3.92Å; H316-I355 WeakPolarHBondContact CB-O 3.21Å; I330-I355 HydrophobicContact CD1-CD1 4.34Å; I330-I355 HydrophobicContact CG1-CD1 4.32Å; I330-I355 HydrophobicContact CG2-CD1 3.45Å; I330-I355 VanDerWaalsContact CG2-CD1 3.45Å; I355-I363 HydrophobicContact CD1-CG2 3.92Å; I355-I363 HydrophobicContact CG1-CG2 4.15Å; I355-Y364 CarbonylContact C-O 3.57Å; I355-Y364 VanDerWaalsContact CA-O 3.31Å; I355-Y364 WeakPolarHBondContact CA-O 3.28Å
356	S	96.7	Very high	90.7	Very high	8 Å²	8	26.7 Å²	26.7	6%	0.056	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	166.7	-176.7	-166.2	0	0	0	0	111	Y364 I399	S356-Y364 PolarHBondContact N-O 3.13Å; S356-Y364 WeakPolarHBondContact O-CB 3.01Å; S356-Y364 PolarHBondContact O-N 2.82Å; S356-I399 PolarHBondContact OG-N 3.12Å
357	N	94.1	Very high	91.2	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.021	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	146.1	-178	-42.6	-37.6	0	0	0	111.7	H316 R318 Y323 R362	H316-N357 VanDerWaalsContact CD2-CG 3.46Å; H316-N357 PolarHBondContact CD2-ND2 2.86Å; H316-N357 PolarHBondContact NE2-ND2 2.88Å; R318-N357 WeakPolarHBondContact CB-ND2 3.28Å; R318-N357 PolarHBondContact NH1-O 2.94Å; Y323-N357 WeakPolarHBondContact CD2-ND2 3.49Å; Y323-N357 WeakPolarHBondContact CE2-ND2 3.01Å; Y323-N357 VanDerWaalsContact CZ-ND2 3.29Å; N357-R362 WeakPolarHBondContact CA-O 3.45Å; N357-R362 WeakPolarHBondContact CB-O 3.24Å
358	D	91	Very high	91.6	Very high	7 Å²	7	30.6 Å²	30.6	4%	0.037	18%	0.176	C	C	.	.			trans	-94.6	175.6	173.9	78.6	5.7	0	0	0	113.6	R318 T360 G361 R362 Y364 I399 R419	R318-D358 PolarHBondContact NE-O 2.88Å; R318-D358 PolarHBondContact NH1-O 2.73Å; R318-D358 PolarHBondContact NH2-O 3.01Å; D358-T360 PolarHBondContact O-N 2.93Å; D358-T360 WeakPolarHBondContact OD1-CA 3.47Å; D358-T360 WeakPolarHBondContact OD1-CB 3.26Å; D358-T360 PolarHBondContact OD1-N 2.83Å; D358-T360 PolarHBondContact OD1-OG1 2.89Å; D358-T360 PolarHBondContact OD2-OG1 2.72Å; D358-G361 PolarHBondContact O-N 2.84Å; D358-G361 PolarHBondContact OD1-N 2.99Å; D358-R362 PolarHBondContact N-O 3.47Å; D358-R362 PolarHBondContact OD1-N 2.78Å; D358-Y364 HydrophobicContact CB-CE2 3.81Å; D358-Y364 PolarHBondContact OD2-OH 2.9Å; D358-I399 HydrophobicContact CB-CG2 4.01Å; D358-R419 IonicContact OD2-NH1 2.7Å; D358-R419 IonicContact OD2-NH2 3.85Å
359	A	88.5	Confident	91.8	Very high	83 Å²	83	27.2 Å²	27.2	69%	0.686	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-47.4	-30.7	177.6	0	0	0	0	0	114.7	G361	A359-G361 VanDerWaalsContact C-N 3.34Å
360	T	89.7	Confident	92	Very high	86 Å²	86	28.5 Å²	28.5	53%	0.528	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-8.8	-176.5	73.1	0	0	0	0	113.2	D358 R362	D358-T360 PolarHBondContact O-N 2.93Å; D358-T360 WeakPolarHBondContact OD1-CA 3.47Å; D358-T360 WeakPolarHBondContact OD1-CB 3.26Å; D358-T360 PolarHBondContact OD1-N 2.83Å; D358-T360 PolarHBondContact OD1-OG1 2.89Å; D358-T360 PolarHBondContact OD2-OG1 2.72Å; T360-R362 VanDerWaalsContact C-N 3.35Å; T360-R362 WeakPolarHBondContact OG1-CG 3.04Å; T360-R362 PolarHBondContact OG1-NH1 3.4Å
361	G	90.8	Very high	92.3	Very high	13 Å²	13	28.5 Å²	28.5	13%	0.134	16%	0.164	C	C	.	.			trans	83	10.6	-177	0	0	0	0	0	113.7	D358 A359 N378	D358-G361 PolarHBondContact O-N 2.84Å; D358-G361 PolarHBondContact OD1-N 2.99Å; A359-G361 VanDerWaalsContact C-N 3.34Å; G361-N378 WeakPolarHBondContact O-CB 3.07Å
362	R	94.8	Very high	92.4	Very high	77 Å²	77	29 Å²	29	29%	0.291	17%	0.168	S	C	.	.			trans	-64.3	142.7	168.3	-76.6	179.1	178.5	106.4	-7.6	110	N357 D358 T360 Y364 V375 Y376 E383	N357-R362 WeakPolarHBondContact CA-O 3.45Å; N357-R362 WeakPolarHBondContact CB-O 3.24Å; D358-R362 PolarHBondContact N-O 3.47Å; D358-R362 PolarHBondContact OD1-N 2.78Å; T360-R362 VanDerWaalsContact C-N 3.35Å; T360-R362 WeakPolarHBondContact OG1-CG 3.04Å; T360-R362 PolarHBondContact OG1-NH1 3.4Å; R362-Y364 HydrophobicContact CB-CD2 4.45Å; R362-Y364 HydrophobicContact CB-CE2 3.53Å; R362-Y364 WeakPolarHBondContact CD-OH 3.32Å; R362-Y364 WeakPolarHBondContact O-CD2 3.29Å; R362-Y364 WeakPolarHBondContact O-CE2 3.05Å; R362-V375 HydrophobicContact CB-CG1 4.35Å; R362-Y376 CarbonylContact C-O 3.51Å; R362-Y376 VanDerWaalsContact CA-O 3.3Å; R362-Y376 WeakPolarHBondContact CA-O 3.42Å; R362-E383 IonicContact CZ-OE2 3.04Å; R362-E383 IonicContact NE-OE1 3.86Å; R362-E383 IonicContact NE-OE2 2.74Å; R362-E383 PolarHBondContact NE-OE2 3.14Å; R362-E383 IonicContact NH2-OE2 3.95Å
363	I	95.9	Very high	92.7	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	125.7	-178.2	-48.7	170.1	0	0	0	107.5	Y323 V332 I343 I355 V375 Y376	Y323-I363 HydrophobicContact CD1-CD1 3.93Å; Y323-I363 HydrophobicContact CD1-CG1 4.01Å; Y323-I363 HydrophobicContact CD1-CG2 4.1Å; Y323-I363 HydrophobicContact CE1-CD1 3.66Å; Y323-I363 HydrophobicContact CE1-CG1 3.64Å; V332-I363 HydrophobicContact CG2-CD1 3.84Å; I343-I363 HydrophobicContact CD1-CD1 3.93Å; I355-I363 HydrophobicContact CD1-CG2 3.92Å; I355-I363 HydrophobicContact CG1-CG2 4.15Å; I363-V375 CarbonylContact O-C 3.59Å; I363-V375 WeakPolarHBondContact O-CA 3.24Å; I363-Y376 PolarHBondContact N-O 2.73Å; I363-Y376 PolarHBondContact O-N 3.28Å
364	Y	97.2	Very high	92.7	Very high	6 Å²	6	28.4 Å²	28.4	2%	0.024	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	122.5	178.4	-61.4	-94.7	0	0	0	107.9	I355 S356 D358 R362 M373 D374 V375 L386 I399 R419	I355-Y364 CarbonylContact C-O 3.57Å; I355-Y364 VanDerWaalsContact CA-O 3.31Å; I355-Y364 WeakPolarHBondContact CA-O 3.28Å; S356-Y364 PolarHBondContact N-O 3.13Å; S356-Y364 WeakPolarHBondContact O-CB 3.01Å; S356-Y364 PolarHBondContact O-N 2.82Å; D358-Y364 HydrophobicContact CB-CE2 3.81Å; D358-Y364 PolarHBondContact OD2-OH 2.9Å; R362-Y364 HydrophobicContact CB-CD2 4.45Å; R362-Y364 HydrophobicContact CB-CE2 3.53Å; R362-Y364 WeakPolarHBondContact CD-OH 3.32Å; R362-Y364 WeakPolarHBondContact O-CD2 3.29Å; R362-Y364 WeakPolarHBondContact O-CE2 3.05Å; Y364-M373 HydrophobicContact CD1-CE 3.87Å; Y364-M373 HydrophobicContact CD1-SD 3.87Å; Y364-M373 HydrophobicContact CE1-CE 4.46Å; Y364-M373 HydrophobicContact CG-SD 4.39Å; Y364-D374 WeakPolarHBondContact CA-O 3.2Å; Y364-V375 HydrophobicContact CD1-CB 4.43Å; Y364-V375 HydrophobicContact CD1-CG1 4.19Å; Y364-V375 HydrophobicContact CD1-CG2 3.68Å; Y364-V375 HydrophobicContact CE1-CB 4.23Å; Y364-V375 HydrophobicContact CE1-CG1 3.65Å; Y364-V375 HydrophobicContact CE1-CG2 3.57Å; Y364-L386 HydrophobicContact CE1-CD1 4.46Å; Y364-I399 HydrophobicContact CD1-CD1 4.36Å; Y364-I399 HydrophobicContact CD2-CG1 4.05Å; Y364-I399 HydrophobicContact CD2-CG2 4.42Å; Y364-I399 HydrophobicContact CE2-CG2 4.4Å; Y364-I399 HydrophobicContact CG-CD1 4.22Å; Y364-I399 HydrophobicContact CG-CG1 3.92Å; Y364-R419 PolarHBondContact OH-NH1 3.13Å
365	V	96.7	Very high	92.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	124.6	179.7	62.1	0	0	0	0	109.3	I330 Y351 M373 D374 Y376	I330-V365 HydrophobicContact CD1-CB 3.7Å; I330-V365 HydrophobicContact CD1-CG1 3.69Å; I330-V365 HydrophobicContact CD1-CG2 3.83Å; I330-V365 HydrophobicContact CG1-CG2 4.24Å; Y351-V365 HydrophobicContact CD1-CB 4.41Å; Y351-V365 HydrophobicContact CD1-CG1 3.97Å; Y351-V365 HydrophobicContact CD1-CG2 3.57Å; Y351-V365 HydrophobicContact CD2-CG2 4.45Å; Y351-V365 HydrophobicContact CE1-CB 4.36Å; Y351-V365 HydrophobicContact CE1-CG1 3.45Å; Y351-V365 VanDerWaalsContact CE1-CG1 3.45Å; Y351-V365 HydrophobicContact CE1-CG2 4Å; Y351-V365 HydrophobicContact CE2-CG1 4.34Å; Y351-V365 HydrophobicContact CG-CG2 3.87Å; V365-M373 CarbonylContact O-C 3.6Å; V365-M373 WeakPolarHBondContact O-CA 3.19Å; V365-M373 WeakPolarHBondContact O-CB 3.26Å; V365-D374 HydrophobicContact CG1-CB 3.89Å; V365-D374 PolarHBondContact N-O 2.81Å; V365-D374 PolarHBondContact O-N 2.88Å; V365-Y376 HydrophobicContact CG1-CD2 4.35Å; V365-Y376 HydrophobicContact CG1-CE2 3.86Å
366	A	95.4	Very high	92.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	140.8	175.9	0	0	0	0	0	110.1	I353 G354 W394 I397	I353-A366 HydrophobicContact CD1-CB 3.36Å; I353-A366 HydrophobicContact CG1-CB 3.77Å; I353-A366 WeakPolarHBondContact CG1-O 3.22Å; G354-A366 PolarHBondContact O-N 3.26Å; A366-W394 HydrophobicContact CB-CE3 4.12Å; A366-I397 HydrophobicContact CB-CD1 4Å; A366-I397 HydrophobicContact CB-CG1 4.04Å; A366-I397 HydrophobicContact CB-CG2 3.82Å
367	R	91.8	Very high	92.2	Very high	63 Å²	63	30.4 Å²	30.4	24%	0.238	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-89.7	129.2	176.7	-71.2	179.8	73.7	147.3	-0.4	110.3	A350 Y351 I353 G369 T370 S372 D374	A350-R367 CarbonylContact O-C 3.51Å; A350-R367 WeakPolarHBondContact O-CA 3.33Å; Y351-R367 HydrophobicContact CE1-CG 4.09Å; I353-R367 WeakPolarHBondContact CD1-O 3.19Å; R367-G369 PolarHBondContact O-N 3.12Å; R367-T370 VanDerWaalsContact CB-OG1 3.25Å; R367-T370 WeakPolarHBondContact CB-OG1 3.41Å; R367-T370 PolarHBondContact O-N 3.22Å; R367-T370 PolarHBondContact O-OG1 3.04Å; R367-S372 PolarHBondContact N-O 3.36Å; R367-D374 WeakPolarHBondContact CD-OD1 3.42Å; R367-D374 WeakPolarHBondContact CD-OD2 3.17Å; R367-D374 IonicContact NE-OD2 3.35Å; R367-D374 IonicContact NH1-OD1 2.67Å; R367-D374 PolarHBondContact NH1-OD1 3.34Å; R367-D374 IonicContact NH1-OD2 3.29Å
368	R	88.2	Confident	92.1	Very high	122 Å²	122	35.2 Å²	35.2	46%	0.46	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	132.2	-179	-171	174.3	-176.7	-177.8	-6.6	110.2	N327 A350 I353 T370	N327-R368 PolarHBondContact OD1-NH1 2.95Å; A350-R368 PolarHBondContact O-N 3.23Å; I353-R368 HydrophobicContact CG2-CB 4.48Å; I353-R368 HydrophobicContact CG2-CG 4.33Å; R368-T370 VanDerWaalsContact C-N 3.3Å
369	G	85.5	Confident	91.9	Very high	48 Å²	48	37.5 Å²	37.5	50%	0.495	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.5	7.2	176.4	0	0	0	0	0	114.4	R367 L393	R367-G369 PolarHBondContact O-N 3.12Å; G369-L393 VanDerWaalsContact C-CD2 3.5Å; G369-L393 VanDerWaalsContact O-CD2 3.26Å; G369-L393 WeakPolarHBondContact O-CD2 3.4Å
370	T	88.2	Confident	91.9	Very high	52 Å²	52	33.9 Å²	33.9	32%	0.319	18%	0.182	S	C	.	.	S	Bend	trans	-136.8	172.3	-179.8	69	0	0	0	0	111.5	R367 R368 S372 F392 W394	R367-T370 VanDerWaalsContact CB-OG1 3.25Å; R367-T370 WeakPolarHBondContact CB-OG1 3.41Å; R367-T370 PolarHBondContact O-N 3.22Å; R367-T370 PolarHBondContact O-OG1 3.04Å; R368-T370 VanDerWaalsContact C-N 3.3Å; T370-S372 PolarHBondContact OG1-N 3.12Å; T370-S372 PolarHBondContact OG1-OG 3.23Å; T370-F392 CarbonylContact C-O 3.56Å; T370-W394 PolarHBondContact O-N 2.94Å
371	S	90.4	Very high	91.8	Very high	9 Å²	9	35.8 Å²	35.8	6%	0.063	18%	0.18	C	C	.	.	S	Bend	trans	-104.4	52.8	167.8	49.2	0	0	0	0	110.4	A388 Q390 Q391 F392	S371-A388 PolarHBondContact O-N 3.12Å; S371-Q390 WeakPolarHBondContact CB-O 3.35Å; S371-Q390 PolarHBondContact OG-O 3.1Å; S371-Q391 WeakPolarHBondContact OG-CA 3.17Å; S371-F392 WeakPolarHBondContact CB-O 3.07Å; S371-F392 PolarHBondContact N-O 3.45Å; S371-F392 VanDerWaalsContact N-O 3.1Å; S371-F392 PolarHBondContact OG-N 3.23Å
372	S	92.7	Very high	91.8	Very high	11 Å²	11	39 Å²	39	8%	0.077	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	161	179.3	61.1	0	0	0	0	111.8	R367 T370 L386 S387	R367-S372 PolarHBondContact N-O 3.36Å; T370-S372 PolarHBondContact OG1-N 3.12Å; T370-S372 PolarHBondContact OG1-OG 3.23Å; S372-L386 CarbonylContact C-O 3.06Å; S372-L386 WeakPolarHBondContact CA-O 3Å; S372-L386 VanDerWaalsContact CB-O 3.25Å; S372-L386 WeakPolarHBondContact CB-O 3.32Å; S372-S387 VanDerWaalsContact CB-OG 3.28Å; S372-S387 WeakPolarHBondContact CB-OG 3.38Å
373	M	94.1	Very high	91.4	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	145.7	175.1	58.5	-177.9	178.5	0	0	111	L173 Y364 V365 T385 L386 W394 I397 I399 V404	L173-M373 HydrophobicContact CD1-CE 4.4Å; L173-M373 HydrophobicContact CD2-CE 4.06Å; Y364-M373 HydrophobicContact CD1-CE 3.87Å; Y364-M373 HydrophobicContact CD1-SD 3.87Å; Y364-M373 HydrophobicContact CE1-CE 4.46Å; Y364-M373 HydrophobicContact CG-SD 4.39Å; V365-M373 CarbonylContact O-C 3.6Å; V365-M373 WeakPolarHBondContact O-CA 3.19Å; V365-M373 WeakPolarHBondContact O-CB 3.26Å; M373-T385 CarbonylContact O-C 3.57Å; M373-T385 WeakPolarHBondContact O-CA 3.27Å; M373-L386 HydrophobicContact CE-CB 4.18Å; M373-L386 HydrophobicContact CE-CD1 3.68Å; M373-L386 HydrophobicContact CG-CB 4.12Å; M373-L386 PolarHBondContact N-O 3.14Å; M373-L386 PolarHBondContact O-N 2.89Å; M373-W394 HydrophobicContact CB-CZ3 4.12Å; M373-W394 HydrophobicContact CG-CZ3 4.22Å; M373-I397 HydrophobicContact CB-CD1 4.41Å; M373-I397 HydrophobicContact SD-CD1 4.04Å; M373-I399 HydrophobicContact CE-CD1 3.96Å; M373-I399 HydrophobicContact SD-CD1 3.98Å; M373-V404 HydrophobicContact CE-CB 4.36Å; M373-V404 HydrophobicContact CE-CG1 3.92Å; M373-V404 HydrophobicContact CE-CG2 3.53Å; M373-V404 HydrophobicContact SD-CG1 4.21Å
374	D	93.6	Very high	91.2	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	145.4	170.1	-62.3	-35.3	0	0	0	109.5	Y351 Y364 V365 R367 Y376 Y382 T385	Y351-D374 WeakPolarHBondContact CE1-OD2 3.1Å; Y351-D374 PolarHBondContact OH-OD2 2.87Å; Y364-D374 WeakPolarHBondContact CA-O 3.2Å; V365-D374 HydrophobicContact CG1-CB 3.89Å; V365-D374 PolarHBondContact N-O 2.81Å; V365-D374 PolarHBondContact O-N 2.88Å; R367-D374 WeakPolarHBondContact CD-OD1 3.42Å; R367-D374 WeakPolarHBondContact CD-OD2 3.17Å; R367-D374 IonicContact NE-OD2 3.35Å; R367-D374 IonicContact NH1-OD1 2.67Å; R367-D374 PolarHBondContact NH1-OD1 3.34Å; R367-D374 IonicContact NH1-OD2 3.29Å; D374-Y376 HydrophobicContact CB-CD2 4.44Å; D374-Y376 HydrophobicContact CB-CE2 3.67Å; D374-Y382 HydrophobicContact CB-CE2 4.2Å; D374-T385 WeakPolarHBondContact OD1-CB 3.31Å; D374-T385 WeakPolarHBondContact OD1-CG2 3.15Å; D374-T385 PolarHBondContact OD1-OG1 3.4Å
375	V	93.2	Very high	90.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	128.9	-179.8	-171.8	0	0	0	0	108.4	R362 I363 Y364 E383 K384 L386	R362-V375 HydrophobicContact CB-CG1 4.35Å; I363-V375 CarbonylContact O-C 3.59Å; I363-V375 WeakPolarHBondContact O-CA 3.24Å; Y364-V375 HydrophobicContact CD1-CB 4.43Å; Y364-V375 HydrophobicContact CD1-CG1 4.19Å; Y364-V375 HydrophobicContact CD1-CG2 3.68Å; Y364-V375 HydrophobicContact CE1-CB 4.23Å; Y364-V375 HydrophobicContact CE1-CG1 3.65Å; Y364-V375 HydrophobicContact CE1-CG2 3.57Å; V375-E383 HydrophobicContact CB-CB 4.36Å; V375-E383 HydrophobicContact CG1-CB 4.33Å; V375-E383 WeakPolarHBondContact O-CB 3.07Å; V375-E383 PolarHBondContact O-N 2.92Å; V375-K384 HydrophobicContact CB-CG 4.19Å; V375-K384 WeakPolarHBondContact CB-O 3.28Å; V375-K384 HydrophobicContact CG2-CG 4.19Å; V375-K384 PolarHBondContact N-O 2.72Å; V375-K384 PolarHBondContact O-N 3.29Å; V375-L386 HydrophobicContact CG2-CD1 3.71Å; V375-L386 HydrophobicContact CG2-CG 3.98Å
376	Y	92.7	Very high	90.7	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.008	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	149.5	175.6	-61.5	-94.5	0	0	0	110.4	I330 I343 Y351 R362 I363 V365 D374 G380 R381 Y382	I330-Y376 HydrophobicContact CD1-CE2 4.32Å; I343-Y376 HydrophobicContact CD1-CD1 4.26Å; I343-Y376 HydrophobicContact CD1-CG 4.11Å; I343-Y376 HydrophobicContact CG2-CD1 3.74Å; I343-Y376 HydrophobicContact CG2-CE1 3.33Å; I343-Y376 HydrophobicContact CG2-CE2 4.25Å; I343-Y376 HydrophobicContact CG2-CG 4.36Å; Y351-Y376 PolarHBondContact OH-OH 3.21Å; R362-Y376 CarbonylContact C-O 3.51Å; R362-Y376 VanDerWaalsContact CA-O 3.3Å; R362-Y376 WeakPolarHBondContact CA-O 3.42Å; I363-Y376 PolarHBondContact N-O 2.73Å; I363-Y376 PolarHBondContact O-N 3.28Å; V365-Y376 HydrophobicContact CG1-CD2 4.35Å; V365-Y376 HydrophobicContact CG1-CE2 3.86Å; D374-Y376 HydrophobicContact CB-CD2 4.44Å; D374-Y376 HydrophobicContact CB-CE2 3.67Å; Y376-G380 WeakPolarHBondContact CD1-O 3.12Å; Y376-R381 CarbonylContact C-O 3.48Å; Y376-R381 WeakPolarHBondContact CA-O 3.29Å; Y376-Y382 VanDerWaalsContact CD1-CA 3.47Å; Y376-Y382 HydrophobicContact CD1-CD2 4.44Å; Y376-Y382 AromaticContact CE1-CD2 3.89Å; Y376-Y382 HydrophobicContact CE1-CD2 3.89Å; Y376-Y382 HydrophobicContact CE1-CG 4.31Å; Y376-Y382 AromaticContact CZ-CD2 3.99Å
377	H	92.7	Very high	90.6	Very high	55 Å²	55	46.3 Å²	46.3	26%	0.255	23%	0.232	S	C	.	.			trans	-65.3	163	163.5	-64.1	-64.6	0	0	0	110.4	D379 G380 R381 E383	H377-D379 VanDerWaalsContact CB-OD1 3.22Å; H377-D379 WeakPolarHBondContact CB-OD1 3.16Å; H377-D379 PolarHBondContact O-N 2.63Å; H377-G380 PolarHBondContact O-N 2.77Å; H377-R381 PolarHBondContact CD2-O 3.1Å; H377-R381 PolarHBondContact N-O 3.24Å; H377-E383 IonicContact CE1-OE2 3.41Å; H377-E383 PolarHBondContact CE1-OE2 2.66Å; H377-E383 IonicContact ND1-OE2 3.93Å; H377-E383 IonicContact NE2-OE2 2.85Å
378	N	91	Very high	90.4	Very high	104 Å²	104	43.9 Å²	43.9	56%	0.556	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-21.5	178.2	63.5	-21.5	0	0	0	113.7	F341 G361 G380	F341-N378 WeakPolarHBondContact CZ-O 3.5Å; G361-N378 WeakPolarHBondContact O-CB 3.07Å; N378-G380 VanDerWaalsContact C-N 3.3Å
379	D	87.6	Confident	89.9	Confident	56 Å²	56	42 Å²	42	30%	0.299	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	1.2	174.2	64.8	11.2	0	0	0	113.5	H377 R381	H377-D379 VanDerWaalsContact CB-OD1 3.22Å; H377-D379 WeakPolarHBondContact CB-OD1 3.16Å; H377-D379 PolarHBondContact O-N 2.63Å; D379-R381 WeakPolarHBondContact OD1-CB 3.39Å; D379-R381 WeakPolarHBondContact OD1-CG 3.47Å; D379-R381 PolarHBondContact OD1-N 3.29Å; D379-R381 IonicContact OD1-NE 3.8Å; D379-R381 PolarHBondContact OD1-NE 3.46Å; D379-R381 IonicContact OD2-CZ 2.72Å; D379-R381 VanDerWaalsContact OD2-CZ 3.29Å; D379-R381 IonicContact OD2-NE 2.77Å; D379-R381 PolarHBondContact OD2-NE 3.37Å; D379-R381 IonicContact OD2-NH2 3.56Å; D379-R381 PolarHBondContact OD2-NH2 2.61Å
380	G	88.6	Confident	89.5	Confident	7 Å²	7	43.5 Å²	43.5	7%	0.072	23%	0.226	C	C	.	.	S	Bend	trans	85.4	0.9	179.9	0	0	0	0	0	115.3	Y376 H377 N378	Y376-G380 WeakPolarHBondContact CD1-O 3.12Å; H377-G380 PolarHBondContact O-N 2.77Å; N378-G380 VanDerWaalsContact C-N 3.3Å
381	R	87.7	Confident	88.9	Confident	126 Å²	126	50 Å²	50	48%	0.475	25%	0.253	S	S	.	.			trans	-71	133.2	173.6	-69.8	-175.2	-64.2	143.5	3.9	110.7	Y376 H377 D379	Y376-R381 CarbonylContact C-O 3.48Å; Y376-R381 WeakPolarHBondContact CA-O 3.29Å; H377-R381 PolarHBondContact CD2-O 3.1Å; H377-R381 PolarHBondContact N-O 3.24Å; D379-R381 WeakPolarHBondContact OD1-CB 3.39Å; D379-R381 WeakPolarHBondContact OD1-CG 3.47Å; D379-R381 PolarHBondContact OD1-N 3.29Å; D379-R381 IonicContact OD1-NE 3.8Å; D379-R381 PolarHBondContact OD1-NE 3.46Å; D379-R381 IonicContact OD2-CZ 2.72Å; D379-R381 VanDerWaalsContact OD2-CZ 3.29Å; D379-R381 IonicContact OD2-NE 2.77Å; D379-R381 PolarHBondContact OD2-NE 3.37Å; D379-R381 IonicContact OD2-NH2 3.56Å; D379-R381 PolarHBondContact OD2-NH2 2.61Å
382	Y	89.1	Confident	88.3	Confident	79 Å²	79	51 Å²	51	31%	0.31	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	136.3	176.8	174.8	-99.5	0	0	0	111.4	Y124 D374 Y376 K384 T385	Y124-Y382 AromaticContact CE2-CD1 3.92Å; Y124-Y382 HydrophobicContact CE2-CD1 3.92Å; Y124-Y382 HydrophobicContact CE2-CD2 4.01Å; Y124-Y382 AromaticContact CE2-CG 3.57Å; Y124-Y382 HydrophobicContact CE2-CG 3.57Å; Y124-Y382 WeakPolarHBondContact OH-CD1 3.34Å; Y124-Y382 WeakPolarHBondContact OH-CE1 3.37Å; D374-Y382 HydrophobicContact CB-CE2 4.2Å; Y376-Y382 VanDerWaalsContact CD1-CA 3.47Å; Y376-Y382 HydrophobicContact CD1-CD2 4.44Å; Y376-Y382 AromaticContact CE1-CD2 3.89Å; Y376-Y382 HydrophobicContact CE1-CD2 3.89Å; Y376-Y382 HydrophobicContact CE1-CG 4.31Å; Y376-Y382 AromaticContact CZ-CD2 3.99Å; Y382-K384 VanDerWaalsContact CZ-C 3.47Å; Y382-K384 VanDerWaalsContact CZ-CA 3.47Å; Y382-K384 WeakPolarHBondContact OH-CA 3.13Å; Y382-T385 PolarHBondContact OH-N 3.2Å; Y382-T385 PolarHBondContact OH-OG1 2.7Å
383	E	87.5	Confident	88	Confident	56 Å²	56	53.6 Å²	53.6	26%	0.262	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	-61.7	175.6	-171	-176.4	132.4	0	0	110.8	R362 V375 H377	R362-E383 IonicContact CZ-OE2 3.04Å; R362-E383 IonicContact NE-OE1 3.86Å; R362-E383 IonicContact NE-OE2 2.74Å; R362-E383 PolarHBondContact NE-OE2 3.14Å; R362-E383 IonicContact NH2-OE2 3.95Å; V375-E383 HydrophobicContact CB-CB 4.36Å; V375-E383 HydrophobicContact CG1-CB 4.33Å; V375-E383 WeakPolarHBondContact O-CB 3.07Å; V375-E383 PolarHBondContact O-N 2.92Å; H377-E383 IonicContact CE1-OE2 3.41Å; H377-E383 PolarHBondContact CE1-OE2 2.66Å; H377-E383 IonicContact ND1-OE2 3.93Å; H377-E383 IonicContact NE2-OE2 2.85Å
384	K	90.8	Very high	87.8	Confident	87 Å²	87	53.9 Å²	53.9	38%	0.378	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.8	165.6	-174.2	59.2	-176.6	174.9	176.8	0	113	V375 Y382 L386	V375-K384 HydrophobicContact CB-CG 4.19Å; V375-K384 WeakPolarHBondContact CB-O 3.28Å; V375-K384 HydrophobicContact CG2-CG 4.19Å; V375-K384 PolarHBondContact N-O 2.72Å; V375-K384 PolarHBondContact O-N 3.29Å; Y382-K384 VanDerWaalsContact CZ-C 3.47Å; Y382-K384 VanDerWaalsContact CZ-CA 3.47Å; Y382-K384 WeakPolarHBondContact OH-CA 3.13Å; K384-L386 HydrophobicContact CD-CD2 4.07Å; K384-L386 HydrophobicContact CG-CD2 4.49Å
385	T	92.1	Very high	87.7	Confident	44 Å²	44	54.1 Å²	54.1	27%	0.27	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.6	165.5	-55.2	0	0	0	0	109.6	M373 D374 Y382	M373-T385 CarbonylContact O-C 3.57Å; M373-T385 WeakPolarHBondContact O-CA 3.27Å; D374-T385 WeakPolarHBondContact OD1-CB 3.31Å; D374-T385 WeakPolarHBondContact OD1-CG2 3.15Å; D374-T385 PolarHBondContact OD1-OG1 3.4Å; Y382-T385 PolarHBondContact OH-N 3.2Å; Y382-T385 PolarHBondContact OH-OG1 2.7Å
386	L	92.5	Very high	87.9	Confident	6 Å²	6	54.4 Å²	54.4	3%	0.031	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	127.4	173.4	-64.3	175.2	0	0	0	108.9	L173 Y364 S372 M373 V375 K384 R419	L173-L386 HydrophobicContact CD1-CB 4.15Å; L173-L386 HydrophobicContact CD2-CB 4.42Å; L173-L386 HydrophobicContact CG-CB 4.01Å; Y364-L386 HydrophobicContact CE1-CD1 4.46Å; S372-L386 CarbonylContact C-O 3.06Å; S372-L386 WeakPolarHBondContact CA-O 3Å; S372-L386 VanDerWaalsContact CB-O 3.25Å; S372-L386 WeakPolarHBondContact CB-O 3.32Å; M373-L386 HydrophobicContact CE-CB 4.18Å; M373-L386 HydrophobicContact CE-CD1 3.68Å; M373-L386 HydrophobicContact CG-CB 4.12Å; M373-L386 PolarHBondContact N-O 3.14Å; M373-L386 PolarHBondContact O-N 2.89Å; V375-L386 HydrophobicContact CG2-CD1 3.71Å; V375-L386 HydrophobicContact CG2-CG 3.98Å; K384-L386 HydrophobicContact CD-CD2 4.07Å; K384-L386 HydrophobicContact CG-CD2 4.49Å; L386-R419 HydrophobicContact CD1-CG 4.21Å
387	S	92.5	Very high	88.1	Confident	44 Å²	44	54.5 Å²	54.5	31%	0.308	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136.8	-173.8	-63.1	0	0	0	0	111.5	A170 K171 S372	A170-S387 WeakPolarHBondContact CB-O 3.34Å; K171-S387 PolarHBondContact O-N 3.34Å; S372-S387 VanDerWaalsContact CB-OG 3.28Å; S372-S387 WeakPolarHBondContact CB-OG 3.38Å
388	A	88.4	Confident	88.3	Confident	12 Å²	12	52 Å²	52	10%	0.099	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	154.3	171	0	0	0	0	0	111.5	L173 S371 W394 Y417	L173-A388 HydrophobicContact CB-CB 4.44Å; S371-A388 PolarHBondContact O-N 3.12Å; A388-W394 HydrophobicContact CB-CZ2 4.36Å; A388-Y417 HydrophobicContact CB-CD1 4.19Å; A388-Y417 HydrophobicContact CB-CE1 3.55Å
389	S	77.1	Confident	88.6	Confident	82 Å²	82	47.7 Å²	47.7	57%	0.573	24%	0.239	S	C	*	.	S	Bend	trans	-72.8	-32.1	176.7	53.2	0	0	0	0	113.2	A170	A170-S389 VanDerWaalsContact CB-CA 3.5Å; A170-S389 VanDerWaalsContact CB-N 3.27Å
390	Q	77.2	Confident	88.8	Confident	81 Å²	81	47.4 Å²	47.4	38%	0.379	24%	0.236	S	C	.	.	S	Bend	trans	-92.6	130.8	177.9	-66.5	-178	-8.4	0	0	109.1	S371 F392	S371-Q390 WeakPolarHBondContact CB-O 3.35Å; S371-Q390 PolarHBondContact OG-O 3.1Å; Q390-F392 HydrophobicContact CB-CD2 4.04Å; Q390-F392 HydrophobicContact CB-CE2 3.48Å; Q390-F392 VanDerWaalsContact CB-CE2 3.48Å; Q390-F392 HydrophobicContact CB-CZ 4.02Å; Q390-F392 PolarHBondContact O-N 3.46Å
391	Q	74.6	Confident	88.9	Confident	189 Å²	189	50.9 Å²	50.9	88%	0.883	26%	0.259	S	S	*	.			trans	-76.2	111.8	175.3	-69.1	-168.6	-14.3	0	0	109.5	S371	S371-Q391 WeakPolarHBondContact OG-CA 3.17Å
392	F	78.8	Confident	89.1	Confident	28 Å²	28	49.7 Å²	49.7	12%	0.123	26%	0.259	C	S	.	.			trans	-121.6	160	168.1	-63.4	-68.6	0	0	0	108.1	T370 S371 Q390 D408 V415 Y417	T370-F392 CarbonylContact C-O 3.56Å; S371-F392 WeakPolarHBondContact CB-O 3.07Å; S371-F392 PolarHBondContact N-O 3.45Å; S371-F392 VanDerWaalsContact N-O 3.1Å; S371-F392 PolarHBondContact OG-N 3.23Å; Q390-F392 HydrophobicContact CB-CD2 4.04Å; Q390-F392 HydrophobicContact CB-CE2 3.48Å; Q390-F392 VanDerWaalsContact CB-CE2 3.48Å; Q390-F392 HydrophobicContact CB-CZ 4.02Å; Q390-F392 PolarHBondContact O-N 3.46Å; F392-D408 HydrophobicContact CB-CB 4.07Å; F392-D408 HydrophobicContact CD1-CB 3.87Å; F392-D408 WeakPolarHBondContact CD1-OD2 3.45Å; F392-D408 HydrophobicContact CG-CB 4.14Å; F392-V415 HydrophobicContact CE2-CG2 4.36Å; F392-V415 HydrophobicContact CZ-CG2 4.49Å; F392-Y417 WeakPolarHBondContact CD2-OH 3.43Å; F392-Y417 WeakPolarHBondContact CE2-OH 3.4Å
393	L	86.1	Confident	89.4	Confident	66 Å²	66	47.9 Å²	47.9	35%	0.346	26%	0.255	S	S	.	.			trans	-100.2	102.8	170.2	-60.2	-166.2	0	0	0	107.8	G369 Y409 I410	G369-L393 VanDerWaalsContact C-CD2 3.5Å; G369-L393 VanDerWaalsContact O-CD2 3.26Å; G369-L393 WeakPolarHBondContact O-CD2 3.4Å; L393-Y409 WeakPolarHBondContact O-CB 3.46Å; L393-Y409 PolarHBondContact O-N 3.35Å; L393-I410 HydrophobicContact CB-CG1 4.4Å; L393-I410 HydrophobicContact CD1-CD1 3.4Å; L393-I410 VanDerWaalsContact CD1-CD1 3.4Å; L393-I410 HydrophobicContact CD1-CG1 3.87Å; L393-I410 HydrophobicContact CG-CD1 4.06Å; L393-I410 HydrophobicContact CG-CG1 4.29Å
394	W	91	Very high	89.8	Confident	7 Å²	7	45.2 Å²	45.2	3%	0.027	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	138.9	177.8	-65.1	-10.6	0	0	0	111.2	L173 I353 A366 T370 M373 A388 I397 A406 I407 Y417	L173-W394 HydrophobicContact CD1-CH2 3.53Å; L173-W394 HydrophobicContact CD1-CZ2 4.25Å; L173-W394 HydrophobicContact CD1-CZ3 4.5Å; I353-W394 HydrophobicContact CD1-CB 4.48Å; I353-W394 VanDerWaalsContact CD1-O 3.31Å; I353-W394 WeakPolarHBondContact CD1-O 3.42Å; A366-W394 HydrophobicContact CB-CE3 4.12Å; T370-W394 PolarHBondContact O-N 2.94Å; M373-W394 HydrophobicContact CB-CZ3 4.12Å; M373-W394 HydrophobicContact CG-CZ3 4.22Å; A388-W394 HydrophobicContact CB-CZ2 4.36Å; W394-I397 HydrophobicContact CD2-CG2 4.29Å; W394-I397 HydrophobicContact CE3-CG2 3.7Å; W394-I397 HydrophobicContact CZ3-CG2 4.08Å; W394-A406 HydrophobicContact CD2-CB 3.73Å; W394-A406 HydrophobicContact CE3-CB 4.35Å; W394-A406 HydrophobicContact CG-CB 3.91Å; W394-A406 HydrophobicContact CZ2-CB 4.05Å; W394-I407 VanDerWaalsContact CA-O 3.28Å; W394-I407 WeakPolarHBondContact CA-O 3.35Å; W394-Y417 HydrophobicContact CZ2-CD2 4.19Å; W394-Y417 AromaticContact CZ2-CE2 3.63Å; W394-Y417 HydrophobicContact CZ2-CE2 3.63Å; W394-Y417 AromaticContact CZ2-CZ 3.99Å
395	S	91.3	Very high	90.1	Very high	6 Å²	6	41.2 Å²	41.2	4%	0.042	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	-34.6	169	47.1	0	0	0	0	112.2	Y314 I353 G354 I407	Y314-S395 PolarHBondContact OH-O 3.04Å; I353-S395 WeakPolarHBondContact CB-O 3.5Å; G354-S395 PolarHBondContact N-O 3.46Å; G354-S395 VanDerWaalsContact N-O 3.13Å; S395-I407 PolarHBondContact N-O 3.3Å; S395-I407 VanDerWaalsContact N-O 3.09Å; S395-I407 WeakPolarHBondContact OG-CB 3.43Å; S395-I407 WeakPolarHBondContact OG-CG2 3.45Å
396	D	96.5	Very high	90.4	Very high	6 Å²	6	39.1 Å²	39.1	3%	0.032	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	159.7	179.7	-155	-1.9	0	0	0	111.6	V188 L190 Y314 G354 A406 I407	V188-D396 WeakPolarHBondContact O-CB 3.45Å; L190-D396 HydrophobicContact CB-CB 3.83Å; L190-D396 PolarHBondContact N-OD2 3.43Å; Y314-D396 HydrophobicContact CE1-CB 4Å; Y314-D396 WeakPolarHBondContact CE1-OD2 3.39Å; G354-D396 WeakPolarHBondContact CA-OD1 3.27Å; D396-A406 WeakPolarHBondContact O-CA 3.35Å; D396-I407 HydrophobicContact CB-CD1 4.39Å; D396-I407 PolarHBondContact O-N 3.11Å
397	I	97.6	Very high	90.5	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.015	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	147.8	-178.5	57.4	164.6	0	0	0	112.3	A366 M373 W394 Y405 A406	A366-I397 HydrophobicContact CB-CD1 4Å; A366-I397 HydrophobicContact CB-CG1 4.04Å; A366-I397 HydrophobicContact CB-CG2 3.82Å; M373-I397 HydrophobicContact CB-CD1 4.41Å; M373-I397 HydrophobicContact SD-CD1 4.04Å; W394-I397 HydrophobicContact CD2-CG2 4.29Å; W394-I397 HydrophobicContact CE3-CG2 3.7Å; W394-I397 HydrophobicContact CZ3-CG2 4.08Å; I397-Y405 CarbonylContact C-O 3.57Å; I397-Y405 VanDerWaalsContact CA-O 3.24Å; I397-Y405 WeakPolarHBondContact CA-O 3.28Å; I397-A406 HydrophobicContact CG2-CB 3.91Å
398	A	97.2	Very high	90.5	Very high	4 Å²	4	37.1 Å²	37.1	3%	0.033	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	140.3	171.3	0	0	0	0	0	110.3	L190 L192 L197 Y405	L190-A398 HydrophobicContact CD2-CB 3.87Å; L190-A398 HydrophobicContact CG-CB 4.11Å; L192-A398 HydrophobicContact CB-CB 3.73Å; L192-A398 HydrophobicContact CD2-CB 4.47Å; L197-A398 HydrophobicContact CD1-CB 4.25Å; A398-Y405 PolarHBondContact N-O 3Å; A398-Y405 PolarHBondContact O-N 3.28Å
399	I	95.4	Very high	90.4	Very high	13 Å²	13	40.9 Å²	40.9	7%	0.067	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	133.4	-173.3	-52.2	-70.2	0	0	0	110.2	S356 D358 Y364 M373 N403 V404	S356-I399 PolarHBondContact OG-N 3.12Å; D358-I399 HydrophobicContact CB-CG2 4.01Å; Y364-I399 HydrophobicContact CD1-CD1 4.36Å; Y364-I399 HydrophobicContact CD2-CG1 4.05Å; Y364-I399 HydrophobicContact CD2-CG2 4.42Å; Y364-I399 HydrophobicContact CE2-CG2 4.4Å; Y364-I399 HydrophobicContact CG-CD1 4.22Å; Y364-I399 HydrophobicContact CG-CG1 3.92Å; M373-I399 HydrophobicContact CE-CD1 3.96Å; M373-I399 HydrophobicContact SD-CD1 3.98Å; I399-N403 WeakPolarHBondContact CA-O 3.25Å; I399-V404 HydrophobicContact CD1-CB 3.99Å; I399-V404 HydrophobicContact CD1-CG1 3.72Å; I399-V404 HydrophobicContact CD1-CG2 3.65Å
400	Q	92.5	Very high	90.6	Very high	49 Å²	49	42.7 Å²	42.7	23%	0.229	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	114.4	167.2	-176.9	-176.1	54.3	0	0	110	L192 H195 E402 N403	L192-Q400 HydrophobicContact CD2-CB 3.49Å; L192-Q400 VanDerWaalsContact CD2-CB 3.49Å; H195-Q400 PolarHBondContact ND1-OE1 3Å; Q400-E402 PolarHBondContact O-N 3.13Å; Q400-N403 PolarHBondContact N-O 3.26Å; Q400-N403 WeakPolarHBondContact O-CB 3.41Å; Q400-N403 PolarHBondContact O-N 2.84Å; Q400-N403 PolarHBondContact O-ND2 2.82Å
401	S	90.4	Very high	91.1	Very high	80 Å²	80	39.6 Å²	39.6	56%	0.559	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.2	-127.2	-173.2	-53.9	0	0	0	0	109.6	N403 R419	S401-N403 VanDerWaalsContact C-N 3.27Å; S401-N403 PolarHBondContact O-N 3.28Å; S401-R419 PolarHBondContact O-NH1 3.33Å; S401-R419 PolarHBondContact O-NH2 3.27Å
402	E	92.6	Very high	91.8	Very high	102 Å²	102	31.2 Å²	31.2	48%	0.477	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-2.5	177.4	-57.1	-53.5	151.5	0	0	114.7	Q400 I418 R419	Q400-E402 PolarHBondContact O-N 3.13Å; E402-I418 HydrophobicContact CB-CG2 4.38Å; E402-I418 WeakPolarHBondContact O-CA 3.41Å; E402-R419 PolarHBondContact O-N 3.34Å; E402-R419 IonicContact OE1-NH2 3.51Å; E402-R419 PolarHBondContact OE1-NH2 3.29Å; E402-R419 IonicContact OE2-CZ 3.98Å; E402-R419 VanDerWaalsContact OE2-CZ 3.31Å; E402-R419 IonicContact OE2-NE 2.96Å; E402-R419 PolarHBondContact OE2-NE 3.03Å; E402-R419 IonicContact OE2-NH2 2.81Å; E402-R419 PolarHBondContact OE2-NH2 2.69Å
403	N	95.1	Very high	92.6	Very high	41 Å²	41	31.8 Å²	31.8	22%	0.219	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	136.6	-176.7	-57.4	-73.6	0	0	0	111.2	I399 Q400 S401 Y405 H416 Y417	I399-N403 WeakPolarHBondContact CA-O 3.25Å; Q400-N403 PolarHBondContact N-O 3.26Å; Q400-N403 WeakPolarHBondContact O-CB 3.41Å; Q400-N403 PolarHBondContact O-N 2.84Å; Q400-N403 PolarHBondContact O-ND2 2.82Å; S401-N403 VanDerWaalsContact C-N 3.27Å; S401-N403 PolarHBondContact O-N 3.28Å; N403-Y405 HydrophobicContact CB-CE2 3.66Å; N403-H416 PolarHBondContact OD1-CE1 3.42Å; N403-H416 PolarHBondContact OD1-NE2 2.94Å; N403-Y417 WeakPolarHBondContact CA-O 3.26Å
404	V	96.3	Very high	93	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	120.9	174.9	-176.5	0	0	0	0	107.6	L173 M373 I399 H416 Y417 R419	L173-V404 HydrophobicContact CD2-CB 4.35Å; L173-V404 HydrophobicContact CD2-CG2 3.76Å; M373-V404 HydrophobicContact CE-CB 4.36Å; M373-V404 HydrophobicContact CE-CG1 3.92Å; M373-V404 HydrophobicContact CE-CG2 3.53Å; M373-V404 HydrophobicContact SD-CG1 4.21Å; I399-V404 HydrophobicContact CD1-CB 3.99Å; I399-V404 HydrophobicContact CD1-CG1 3.72Å; I399-V404 HydrophobicContact CD1-CG2 3.65Å; V404-H416 CarbonylContact O-C 3.52Å; V404-H416 WeakPolarHBondContact O-CA 3.12Å; V404-Y417 PolarHBondContact N-O 3.18Å; V404-Y417 PolarHBondContact O-N 2.97Å; V404-R419 HydrophobicContact CG2-CG 3.52Å
405	Y	97.6	Very high	93.3	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.008	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	132.1	171.9	-55	-86.1	0	0	0	107.4	L190 L192 L197 I212 M215 I397 A398 N403 V415 H416	L190-Y405 WeakPolarHBondContact CD2-O 3.17Å; L192-Y405 HydrophobicContact CD2-CD2 3.78Å; L192-Y405 HydrophobicContact CD2-CE2 3.74Å; L197-Y405 HydrophobicContact CD1-CD2 4.31Å; L197-Y405 HydrophobicContact CD1-CG 4.02Å; L197-Y405 HydrophobicContact CD2-CD1 3.91Å; L197-Y405 HydrophobicContact CD2-CG 4.07Å; I212-Y405 HydrophobicContact CB-CE1 4.2Å; I212-Y405 HydrophobicContact CG2-CE1 4.36Å; M215-Y405 HydrophobicContact SD-CD1 4.2Å; M215-Y405 HydrophobicContact SD-CE1 4.08Å; I397-Y405 CarbonylContact C-O 3.57Å; I397-Y405 VanDerWaalsContact CA-O 3.24Å; I397-Y405 WeakPolarHBondContact CA-O 3.28Å; A398-Y405 PolarHBondContact N-O 3Å; A398-Y405 PolarHBondContact O-N 3.28Å; N403-Y405 HydrophobicContact CB-CE2 3.66Å; Y405-V415 WeakPolarHBondContact CA-O 3.1Å; Y405-H416 HydrophobicContact CD1-CB 3.97Å; Y405-H416 AromaticContact CD1-CD2 3.95Å; Y405-H416 HydrophobicContact CE1-CB 3.92Å; Y405-H416 AromaticContact CE1-CD2 3.43Å; Y405-H416 VanDerWaalsContact CE1-CD2 3.43Å; Y405-H416 WeakPolarHBondContact CE1-CD2 3.38Å; Y405-H416 AromaticContact CE1-CG 3.65Å; Y405-H416 AromaticContact CZ-CD2 3.73Å; Y405-H416 AromaticContact CZ-NE2 3.99Å
406	A	97.1	Very high	93.5	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	145.8	179.6	0	0	0	0	0	110.6	W394 D396 I397 V414 V415 Y417	W394-A406 HydrophobicContact CD2-CB 3.73Å; W394-A406 HydrophobicContact CE3-CB 4.35Å; W394-A406 HydrophobicContact CG-CB 3.91Å; W394-A406 HydrophobicContact CZ2-CB 4.05Å; D396-A406 WeakPolarHBondContact O-CA 3.35Å; I397-A406 HydrophobicContact CG2-CB 3.91Å; A406-V414 WeakPolarHBondContact O-CA 3.37Å; A406-V415 PolarHBondContact N-O 3.41Å; A406-V415 PolarHBondContact O-N 3.5Å; A406-Y417 HydrophobicContact CB-CE2 4.24Å
407	I	95.8	Very high	93.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	116	170.3	-64.8	177.7	0	0	0	109.1	M187 G189 L190 W394 S395 D396 Y409 K413	M187-I407 HydrophobicContact CB-CD1 4.33Å; M187-I407 HydrophobicContact CB-CG2 3.63Å; G189-I407 VanDerWaalsContact O-CD1 3.28Å; G189-I407 WeakPolarHBondContact O-CD1 3.18Å; L190-I407 HydrophobicContact CB-CD1 3.75Å; L190-I407 HydrophobicContact CB-CG1 4.11Å; L190-I407 HydrophobicContact CD1-CD1 4.23Å; L190-I407 HydrophobicContact CD1-CG1 4.08Å; L190-I407 HydrophobicContact CD2-CG1 4.34Å; L190-I407 HydrophobicContact CG-CG1 4.43Å; W394-I407 VanDerWaalsContact CA-O 3.28Å; W394-I407 WeakPolarHBondContact CA-O 3.35Å; S395-I407 PolarHBondContact N-O 3.3Å; S395-I407 VanDerWaalsContact N-O 3.09Å; S395-I407 WeakPolarHBondContact OG-CB 3.43Å; S395-I407 WeakPolarHBondContact OG-CG2 3.45Å; D396-I407 HydrophobicContact CB-CD1 4.39Å; D396-I407 PolarHBondContact O-N 3.11Å; I407-Y409 PolarHBondContact O-N 2.87Å; I407-K413 CarbonylContact C-O 3.54Å; I407-K413 WeakPolarHBondContact CA-O 3.42Å
408	D	91.5	Very high	93.3	Very high	9 Å²	9	30.5 Å²	30.5	5%	0.048	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	104.8	160.2	173.4	19.5	0	0	0	109	F392 I410 G411 S412 K413 V415	F392-D408 HydrophobicContact CB-CB 4.07Å; F392-D408 HydrophobicContact CD1-CB 3.87Å; F392-D408 WeakPolarHBondContact CD1-OD2 3.45Å; F392-D408 HydrophobicContact CG-CB 4.14Å; D408-I410 PolarHBondContact O-N 2.84Å; D408-I410 PolarHBondContact OD1-N 2.83Å; D408-G411 VanDerWaalsContact CG-N 3.33Å; D408-G411 PolarHBondContact OD1-N 2.67Å; D408-G411 WeakPolarHBondContact OD2-CA 3.44Å; D408-G411 PolarHBondContact OD2-N 2.75Å; D408-G411 VanDerWaalsContact OD2-N 3.12Å; D408-S412 VanDerWaalsContact O-CA 3.29Å; D408-S412 WeakPolarHBondContact O-CA 3.25Å; D408-S412 PolarHBondContact O-N 3.29Å; D408-K413 HydrophobicContact CB-CB 4.29Å; D408-K413 PolarHBondContact N-O 2.87Å; D408-K413 PolarHBondContact O-N 3.24Å; D408-V415 HydrophobicContact CB-CG2 4.39Å
409	Y	86.5	Confident	93	Very high	90 Å²	90	31.7 Å²	31.7	35%	0.353	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-39.2	-175.2	177.2	-92.1	0	0	0	113	K186 V188 L393 I407	K186-Y409 HydrophobicContact CD-CE2 3.82Å; K186-Y409 VanDerWaalsContact CE-OH 3.24Å; K186-Y409 WeakPolarHBondContact CE-OH 3.48Å; K186-Y409 HydrophobicContact CG-CD2 4.41Å; K186-Y409 HydrophobicContact CG-CE2 3.99Å; K186-Y409 PolarHBondContact NZ-OH 3.48Å; V188-Y409 HydrophobicContact CG2-CE2 4.38Å; L393-Y409 WeakPolarHBondContact O-CB 3.46Å; L393-Y409 PolarHBondContact O-N 3.35Å; I407-Y409 PolarHBondContact O-N 2.87Å
410	I	82.2	Confident	92.4	Very high	121 Å²	121	38.4 Å²	38.4	62%	0.621	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-49.6	-178.1	-67.7	-166.1	0	0	0	109.9	L393 D408 S412	L393-I410 HydrophobicContact CB-CG1 4.4Å; L393-I410 HydrophobicContact CD1-CD1 3.4Å; L393-I410 VanDerWaalsContact CD1-CD1 3.4Å; L393-I410 HydrophobicContact CD1-CG1 3.87Å; L393-I410 HydrophobicContact CG-CD1 4.06Å; L393-I410 HydrophobicContact CG-CG1 4.29Å; D408-I410 PolarHBondContact O-N 2.84Å; D408-I410 PolarHBondContact OD1-N 2.83Å; I410-S412 PolarHBondContact O-N 3.41Å
411	G	86.1	Confident	92.4	Very high	16 Å²	16	37.9 Å²	37.9	17%	0.165	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-13.1	-179.3	0	0	0	0	0	113.6	R182 D408 K413	R182-G411 WeakPolarHBondContact CG-O 3.25Å; D408-G411 VanDerWaalsContact CG-N 3.33Å; D408-G411 PolarHBondContact OD1-N 2.67Å; D408-G411 WeakPolarHBondContact OD2-CA 3.44Å; D408-G411 PolarHBondContact OD2-N 2.75Å; D408-G411 VanDerWaalsContact OD2-N 3.12Å; G411-K413 WeakPolarHBondContact O-CG 3.28Å
412	S	90.7	Very high	92.5	Very high	13 Å²	13	35.7 Å²	35.7	9%	0.091	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	56.2	-173.7	-55.4	0	0	0	0	110.6	L181 R182 G185 D408 I410	L181-S412 CarbonylContact C-O 3.58Å; L181-S412 VanDerWaalsContact C-O 3.24Å; L181-S412 VanDerWaalsContact CA-O 3.24Å; L181-S412 WeakPolarHBondContact CA-O 3.15Å; L181-S412 VanDerWaalsContact CB-O 3.28Å; L181-S412 WeakPolarHBondContact CB-O 3.49Å; L181-S412 PolarHBondContact N-O 2.93Å; R182-S412 PolarHBondContact N-O 3.44Å; G185-S412 WeakPolarHBondContact O-CB 3.43Å; G185-S412 PolarHBondContact O-OG 3.11Å; D408-S412 VanDerWaalsContact O-CA 3.29Å; D408-S412 WeakPolarHBondContact O-CA 3.25Å; D408-S412 PolarHBondContact O-N 3.29Å; I410-S412 PolarHBondContact O-N 3.41Å
413	K	94.2	Very high	92.5	Very high	39 Å²	39	32 Å²	32	17%	0.17	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	151.6	-179.7	-56.3	-175.8	178.7	-176.6	0	110.4	E178 L179 I407 D408 G411 V415	E178-K413 IonicContact OE1-NZ 3.31Å; E178-K413 PolarHBondContact OE1-NZ 2.83Å; L179-K413 VanDerWaalsContact O-CA 3.31Å; L179-K413 WeakPolarHBondContact O-CA 3.4Å; L179-K413 WeakPolarHBondContact O-CB 3.41Å; I407-K413 CarbonylContact C-O 3.54Å; I407-K413 WeakPolarHBondContact CA-O 3.42Å; D408-K413 HydrophobicContact CB-CB 4.29Å; D408-K413 PolarHBondContact N-O 2.87Å; D408-K413 PolarHBondContact O-N 3.24Å; G411-K413 WeakPolarHBondContact O-CG 3.28Å; K413-V415 HydrophobicContact CB-CG2 4.32Å
414	V	96.4	Very high	92.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	130	158.7	-177.1	0	0	0	0	107.5	E178 L179 L181 L197 V199 I210 M215 A406	E178-V414 CarbonylContact C-O 3.59Å; E178-V414 VanDerWaalsContact CA-O 3.26Å; E178-V414 WeakPolarHBondContact CA-O 3.37Å; L179-V414 PolarHBondContact N-O 3.25Å; L179-V414 PolarHBondContact O-N 2.7Å; L179-V414 VanDerWaalsContact O-N 3.09Å; L181-V414 HydrophobicContact CD1-CG2 3.62Å; L197-V414 HydrophobicContact CD2-CG1 3.6Å; V199-V414 HydrophobicContact CG1-CG2 3.58Å; I210-V414 HydrophobicContact CD1-CG2 4.12Å; M215-V414 HydrophobicContact CE-CB 4Å; M215-V414 HydrophobicContact CE-CG1 3.71Å; A406-V414 WeakPolarHBondContact O-CA 3.37Å
415	V	95.5	Very high	92	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	131.3	177.4	-167.2	0	0	0	0	109	K175 E178 F392 Y405 A406 D408 K413 Y417	K175-V415 HydrophobicContact CD-CG1 3.62Å; K175-V415 HydrophobicContact CG-CG1 3.71Å; E178-V415 HydrophobicContact CB-CG2 4.39Å; F392-V415 HydrophobicContact CE2-CG2 4.36Å; F392-V415 HydrophobicContact CZ-CG2 4.49Å; Y405-V415 WeakPolarHBondContact CA-O 3.1Å; A406-V415 PolarHBondContact N-O 3.41Å; A406-V415 PolarHBondContact O-N 3.5Å; D408-V415 HydrophobicContact CB-CG2 4.39Å; K413-V415 HydrophobicContact CB-CG2 4.32Å; V415-Y417 HydrophobicContact CB-CD2 4.47Å; V415-Y417 HydrophobicContact CB-CE2 3.63Å; V415-Y417 HydrophobicContact CG1-CD2 4.19Å; V415-Y417 HydrophobicContact CG1-CE1 3.92Å; V415-Y417 HydrophobicContact CG1-CE2 3.48Å; V415-Y417 VanDerWaalsContact CG1-CE2 3.48Å; V415-Y417 WeakPolarHBondContact CG1-OH 3.26Å
416	H	95.9	Very high	91.7	Very high	14 Å²	14	35.5 Å²	35.5	7%	0.065	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	126.5	175.9	171.6	-142.5	0	0	0	109.6	V176 R177 M215 N403 V404 Y405	V176-H416 PolarHBondContact N-O 3.13Å; R177-H416 HydrophobicContact CB-CB 4.43Å; R177-H416 PolarHBondContact N-O 3.4Å; R177-H416 PolarHBondContact O-N 3.44Å; M215-H416 HydrophobicContact CE-CB 4.4Å; M215-H416 HydrophobicContact SD-CB 4.18Å; N403-H416 PolarHBondContact OD1-CE1 3.42Å; N403-H416 PolarHBondContact OD1-NE2 2.94Å; V404-H416 CarbonylContact O-C 3.52Å; V404-H416 WeakPolarHBondContact O-CA 3.12Å; Y405-H416 HydrophobicContact CD1-CB 3.97Å; Y405-H416 AromaticContact CD1-CD2 3.95Å; Y405-H416 HydrophobicContact CE1-CB 3.92Å; Y405-H416 AromaticContact CE1-CD2 3.43Å; Y405-H416 VanDerWaalsContact CE1-CD2 3.43Å; Y405-H416 WeakPolarHBondContact CE1-CD2 3.38Å; Y405-H416 AromaticContact CE1-CG 3.65Å; Y405-H416 AromaticContact CZ-CD2 3.73Å; Y405-H416 AromaticContact CZ-NE2 3.99Å
417	Y	95.5	Very high	91.3	Very high	1 Å²	1	38.1 Å²	38.1	0%	0.004	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	156.6	174.1	-51.4	-94.9	0	0	0	111	L173 R174 K175 A388 F392 W394 N403 V404 A406 V415	L173-Y417 HydrophobicContact CB-CD1 4.26Å; L173-Y417 HydrophobicContact CB-CG 4.46Å; R174-Y417 CarbonylContact O-C 3.51Å; R174-Y417 WeakPolarHBondContact O-CA 3.28Å; K175-Y417 HydrophobicContact CB-CD1 3.93Å; K175-Y417 HydrophobicContact CB-CE1 3.89Å; K175-Y417 HydrophobicContact CG-CD1 4.49Å; K175-Y417 HydrophobicContact CG-CE1 4.27Å; A388-Y417 HydrophobicContact CB-CD1 4.19Å; A388-Y417 HydrophobicContact CB-CE1 3.55Å; F392-Y417 WeakPolarHBondContact CD2-OH 3.43Å; F392-Y417 WeakPolarHBondContact CE2-OH 3.4Å; W394-Y417 HydrophobicContact CZ2-CD2 4.19Å; W394-Y417 AromaticContact CZ2-CE2 3.63Å; W394-Y417 HydrophobicContact CZ2-CE2 3.63Å; W394-Y417 AromaticContact CZ2-CZ 3.99Å; N403-Y417 WeakPolarHBondContact CA-O 3.26Å; V404-Y417 PolarHBondContact N-O 3.18Å; V404-Y417 PolarHBondContact O-N 2.97Å; A406-Y417 HydrophobicContact CB-CE2 4.24Å; V415-Y417 HydrophobicContact CB-CD2 4.47Å; V415-Y417 HydrophobicContact CB-CE2 3.63Å; V415-Y417 HydrophobicContact CG1-CD2 4.19Å; V415-Y417 HydrophobicContact CG1-CE1 3.92Å; V415-Y417 HydrophobicContact CG1-CE2 3.48Å; V415-Y417 VanDerWaalsContact CG1-CE2 3.48Å; V415-Y417 WeakPolarHBondContact CG1-OH 3.26Å
418	I	93.8	Very high	90.9	Very high	46 Å²	46	41 Å²	41	24%	0.236	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	137.1	164.6	-73.4	166.1	0	0	0	108.2	L173 R174 V176 E402	L173-I418 WeakPolarHBondContact CA-O 3.47Å; R174-I418 PolarHBondContact N-O 2.77Å; R174-I418 PolarHBondContact O-N 3.07Å; V176-I418 HydrophobicContact CG2-CB 4.14Å; V176-I418 HydrophobicContact CG2-CD1 3.5Å; V176-I418 HydrophobicContact CG2-CG1 3.6Å; E402-I418 HydrophobicContact CB-CG2 4.38Å; E402-I418 WeakPolarHBondContact O-CA 3.41Å
419	R	91.6	Very high	90.9	Very high	29 Å²	29	43.7 Å²	43.7	11%	0.109	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	136.5	172.5	-56.5	-179.8	-52.5	-167.6	9.7	110.4	G172 L173 D358 Y364 L386 S401 E402 V404	G172-R419 CarbonylContact O-C 3.52Å; G172-R419 VanDerWaalsContact O-CA 3.23Å; G172-R419 WeakPolarHBondContact O-CA 3.32Å; L173-R419 HydrophobicContact CD2-CB 4.45Å; L173-R419 HydrophobicContact CD2-CG 3.82Å; D358-R419 IonicContact OD2-NH1 2.7Å; D358-R419 IonicContact OD2-NH2 3.85Å; Y364-R419 PolarHBondContact OH-NH1 3.13Å; L386-R419 HydrophobicContact CD1-CG 4.21Å; S401-R419 PolarHBondContact O-NH1 3.33Å; S401-R419 PolarHBondContact O-NH2 3.27Å; E402-R419 PolarHBondContact O-N 3.34Å; E402-R419 IonicContact OE1-NH2 3.51Å; E402-R419 PolarHBondContact OE1-NH2 3.29Å; E402-R419 IonicContact OE2-CZ 3.98Å; E402-R419 VanDerWaalsContact OE2-CZ 3.31Å; E402-R419 IonicContact OE2-NE 2.96Å; E402-R419 PolarHBondContact OE2-NE 3.03Å; E402-R419 IonicContact OE2-NH2 2.81Å; E402-R419 PolarHBondContact OE2-NH2 2.69Å; V404-R419 HydrophobicContact CG2-CG 3.52Å
420	E	82.3	Confident	91.3	Very high	155 Å²	155	39.5 Å²	39.5	72%	0.724	20%	0.199	S	C	*	.			trans	-109.8	0	178.3	-63.9	-172.7	155.6	0	0	112.8	G172 R174	G172-E420 PolarHBondContact O-N 2.9Å; R174-E420 HydrophobicContact CB-CG 4.2Å; R174-E420 VanDerWaalsContact CB-OE1 3.25Å; R174-E420 WeakPolarHBondContact CB-OE1 3.34Å; R174-E420 VanDerWaalsContact CD-OE1 3.25Å; R174-E420 WeakPolarHBondContact CD-OE1 3.5Å; R174-E420 IonicContact NE-OE1 3.7Å; R174-E420 PolarHBondContact NE-OE1 3.11Å

Retrieved 420 of 420 residues in 469.8 ms (Link to these results)

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