A0A3Q0KP87_SCHMA Loading...

Putative dnaj (Hsp40) homolog, subfamily C, member

AlphaFold DB , UniProt , Accession A0A3Q0KP87, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 662 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	40	Very low	37.2	Very low	237 Å²	237	164.9 Å²	164.9	100%	1.167	85%	0.851	S	S	*	*				0	98.2	0	-72.7	179.7	174.4	0	0	106.3
2	Y	42.7	Very low	36.7	Very low	234 Å²	234	158.6 Å²	158.6	92%	0.918	83%	0.832	S	S	*	*			cis	-135	144.5	12.9	-98.4	-104.6	0	0	0	107.9
3	A	33.4	Very low	36.2	Very low	82 Å²	82	153.9 Å²	153.9	68%	0.678	82%	0.821	S	S	*	*			trans	-119.3	147.3	173.1	0	0	0	0	0	109.5
4	D	35.8	Very low	36.1	Very low	148 Å²	148	159.4 Å²	159.4	79%	0.791	83%	0.827	S	S	*	*			trans	51.4	120.5	153	-58.7	-21.3	0	0	0	120.7
5	H	45.3	Very low	35.6	Very low	198 Å²	198	162 Å²	162	92%	0.917	83%	0.833	S	S	*	*				-151.9	124.6	124.1	-109.2	-64.1	0	0	0	111.6
6	N	35.3	Very low	35.5	Very low	149 Å²	149	156.7 Å²	156.7	80%	0.797	83%	0.831	S	S	*	*			trans	-92.7	135.7	176.1	-149.7	15.3	0	0	0	108.2
7	S	40.2	Very low	35.2	Very low	116 Å²	116	158.6 Å²	158.6	81%	0.811	83%	0.834	S	S	*	*			trans	-161.1	114.6	155.3	57.8	0	0	0	0	111.2
8	N	34.2	Very low	35.2	Very low	151 Å²	151	160.9 Å²	160.9	81%	0.807	84%	0.839	S	S	*	*			trans	-56.8	139.9	165.7	-75.1	-19.9	0	0	0	111.4
9	F	34.4	Very low	35.1	Very low	200 Å²	200	157.1 Å²	157.1	88%	0.877	83%	0.833	S	S	*	*			trans	-153.1	107.8	150.3	-134	-90.4	0	0	0	108.9
10	D	32.1	Very low	35.3	Very low	150 Å²	150	155.9 Å²	155.9	80%	0.802	83%	0.832	S	S	*	*			trans	-80.2	130.2	156.2	-84	-35.1	0	0	0	107
11	D	35.9	Very low	35.3	Very low	149 Å²	149	155.2 Å²	155.2	80%	0.797	83%	0.829	S	S	*	*				-173.1	137.2	123.5	-115.2	-21.4	0	0	0	113.3
12	S	31.2	Very low	35.1	Very low	89 Å²	89	149.3 Å²	149.3	62%	0.622	81%	0.811	S	S	*	*			trans	8.4	129.2	155.5	63.5	0	0	0	0	122.2
13	S	30.4	Very low	34.8	Very low	98 Å²	98	143.1 Å²	143.1	69%	0.685	81%	0.808	S	S	*	*			trans	46.7	118.2	134.3	64.7	0	0	0	0	119.6
14	Y	34.2	Very low	34.8	Very low	231 Å²	231	145.5 Å²	145.5	91%	0.906	81%	0.809	S	S	*	*			trans	-162.9	124.5	134.7	-105.6	-76.2	0	0	0	110.5
15	Q	29.4	Very low	34.9	Very low	198 Å²	198	146.5 Å²	146.5	93%	0.925	81%	0.814	S	S	*	*			trans	-73.1	140.8	161.4	-86.3	171.4	-37.2	0	0	109.3
16	G	33.4	Very low	34.2	Very low	77 Å²	77	141.7 Å²	141.7	79%	0.794	80%	0.803	S	S	*	*			trans	-172.3	96	171.4	0	0	0	0	0	110.6
17	H	30.7	Very low	34.3	Very low	190 Å²	190	142.3 Å²	142.3	88%	0.88	81%	0.806	S	S	*	*			trans	-65.2	132.3	171.4	-112.5	-88.6	0	0	0	110.7
18	E	35.4	Very low	34	Very low	200 Å²	200	145.3 Å²	145.3	94%	0.935	81%	0.807	S	S	*	*			trans	-137.4	134.2	148.7	-81.4	-168.7	159.3	0	0	109.3
19	A	33.7	Very low	34.3	Very low	87 Å²	87	142.3 Å²	142.3	72%	0.719	80%	0.804	S	S	*	*			trans	-104.5	141.2	-176.2	0	0	0	0	0	110
20	V	38.2	Very low	34.6	Very low	134 Å²	134	136.9 Å²	136.9	81%	0.812	79%	0.787	S	S	*	*			trans	-156.1	112.7	147.1	-178.9	0	0	0	0	110.4
21	D	36.1	Very low	34.8	Very low	142 Å²	142	135.2 Å²	135.2	76%	0.759	78%	0.778	S	S	*	*			trans	28	121.7	138.2	-55.5	-25.6	0	0	0	122.1
22	S	34.3	Very low	35.1	Very low	113 Å²	113	132.5 Å²	132.5	79%	0.79	77%	0.769	S	S	*	*				151.9	127.2	88.3	48.3	0	0	0	0	113.7
23	A	38.2	Very low	35.7	Very low	104 Å²	104	136 Å²	136	86%	0.86	78%	0.775	S	S	*	*			trans	52	142.6	143.4	0	0	0	0	0	120.5
24	D	31.7	Very low	36.2	Very low	132 Å²	132	137 Å²	137	71%	0.706	77%	0.767	S	S	*	*			cis	179.3	115.4	-8.7	-176.9	15.8	0	0	0	102.4
25	D	38.1	Very low	36.6	Very low	168 Å²	168	130.2 Å²	130.2	90%	0.898	75%	0.746	S	S	*	*			trans	-170.7	101.1	152.7	-109	-17.8	0	0	0	108.1	D27	D25-D27 PolarHBondContact O-N 2.97Å
26	S	30.3	Very low	37.5	Very low	97 Å²	97	124.5 Å²	124.5	68%	0.678	72%	0.722	S	S	*	*			trans	-88.7	85.1	-167.4	35.1	0	0	0	0	111.3	E28	S26-E28 VanDerWaalsContact C-N 3.3Å; S26-E28 PolarHBondContact O-N 2.96Å
27	D	39	Very low	38.1	Very low	162 Å²	162	125.8 Å²	125.8	87%	0.866	71%	0.709	S	S	*	*			trans	-80	88.3	148.3	-84.2	-26.3	0	0	0	106.7	D25 A29	D25-D27 PolarHBondContact O-N 2.97Å; D27-A29 VanDerWaalsContact C-N 3.3Å; D27-A29 PolarHBondContact O-N 3.45Å
28	E	32.7	Very low	38.8	Very low	179 Å²	179	121.6 Å²	121.6	84%	0.836	69%	0.693	S	S	*	*			trans	-52.6	96.5	170.6	-87.4	-179.1	155.4	0	0	108.8	S26 V30	S26-E28 VanDerWaalsContact C-N 3.3Å; S26-E28 PolarHBondContact O-N 2.96Å; E28-V30 PolarHBondContact O-N 3.35Å
29	A	41.3	Very low	39.5	Very low	88 Å²	88	117.7 Å²	117.7	73%	0.727	68%	0.675	S	S	*	*			trans	-60.1	96.6	163.8	0	0	0	0	0	106.2	D27 D31	D27-A29 VanDerWaalsContact C-N 3.3Å; D27-A29 PolarHBondContact O-N 3.45Å; A29-D31 PolarHBondContact O-N 2.86Å
30	V	41.1	Very low	40.1	Very low	87 Å²	87	118.7 Å²	118.7	53%	0.527	67%	0.668	S	S	.	*			trans	-43.2	117.6	170.5	177.8	0	0	0	0	107.1	E28 F34 I35	E28-V30 PolarHBondContact O-N 3.35Å; V30-F34 HydrophobicContact CG1-CB 4.49Å; V30-F34 HydrophobicContact CG1-CD1 4.37Å; V30-I35 HydrophobicContact CB-CD1 4.12Å; V30-I35 HydrophobicContact CG1-CD1 3.82Å; V30-I35 HydrophobicContact CG1-CG1 3.75Å
31	D	34.8	Very low	40.6	Very low	114 Å²	114	118.4 Å²	118.4	61%	0.61	66%	0.661	S	S	*	*			trans	-46.4	125.8	-175.7	-90.5	-38.8	0	0	0	109.3	A29 E33 F34 I35	A29-D31 PolarHBondContact O-N 2.86Å; D31-E33 PolarHBondContact O-N 3.34Å; D31-F34 HydrophobicContact CB-CB 4.5Å; D31-F34 PolarHBondContact O-N 3.04Å; D31-I35 PolarHBondContact O-N 3.43Å
32	P	42.7	Very low	40.9	Very low	93 Å²	93	120.2 Å²	120.2	60%	0.604	66%	0.664	S	S	*	*	H	α-helix	trans	-59	-18.1	178.4	22.8	-31.7	0	0	0	112	N36	P32-N36 WeakPolarHBondContact O-CB 3.27Å; P32-N36 VanDerWaalsContact O-CG 3.23Å; P32-N36 PolarHBondContact O-N 3.31Å; P32-N36 PolarHBondContact O-ND2 3.18Å
33	E	43.9	Very low	41.1	Very low	162 Å²	162	117.6 Å²	117.6	76%	0.757	66%	0.656	S	S	*	*	H	α-helix	trans	-70.2	-36.1	169.9	-69.8	-166.8	158.9	0	0	113.5	D31 L37	D31-E33 PolarHBondContact O-N 3.34Å; E33-L37 WeakPolarHBondContact O-CB 3.36Å; E33-L37 PolarHBondContact O-N 3.25Å
34	F	40.9	Very low	41.5	Very low	120 Å²	120	118 Å²	118	53%	0.526	64%	0.643	S	S	.	*	H	α-helix	trans	-74.5	-30.4	180	-167.3	-99	0	0	0	112.6	V30 D31 L37 L38	V30-F34 HydrophobicContact CG1-CB 4.49Å; V30-F34 HydrophobicContact CG1-CD1 4.37Å; D31-F34 HydrophobicContact CB-CB 4.5Å; D31-F34 PolarHBondContact O-N 3.04Å; F34-L37 WeakPolarHBondContact O-CB 3.48Å; F34-L37 PolarHBondContact O-N 3.38Å; F34-L38 HydrophobicContact CD1-CD1 3.95Å; F34-L38 HydrophobicContact CE1-CD1 3.58Å; F34-L38 HydrophobicContact CZ-CD1 4.27Å; F34-L38 PolarHBondContact O-N 3.19Å
35	I	43	Very low	42.4	Very low	87 Å²	87	120.1 Å²	120.1	45%	0.446	65%	0.649	S	S	.	*	H	α-helix	trans	-76.8	-37.3	174.9	-65.3	174.1	0	0	0	111.2	V30 D31 L37 L38 E39	V30-I35 HydrophobicContact CB-CD1 4.12Å; V30-I35 HydrophobicContact CG1-CD1 3.82Å; V30-I35 HydrophobicContact CG1-CG1 3.75Å; D31-I35 PolarHBondContact O-N 3.43Å; I35-L37 VanDerWaalsContact C-N 3.28Å; I35-L37 PolarHBondContact O-N 3.46Å; I35-L38 PolarHBondContact O-N 2.94Å; I35-E39 PolarHBondContact O-N 3.33Å
36	N	47.5	Very low	43.1	Very low	79 Å²	79	117.4 Å²	117.4	42%	0.422	63%	0.631	S	S	.	*	H	α-helix	trans	-61.1	-41	168.6	-74.2	-22.7	0	0	0	110.4	P32 L38 E39 D40	P32-N36 WeakPolarHBondContact O-CB 3.27Å; P32-N36 VanDerWaalsContact O-CG 3.23Å; P32-N36 PolarHBondContact O-N 3.31Å; P32-N36 PolarHBondContact O-ND2 3.18Å; N36-L38 PolarHBondContact O-N 3.12Å; N36-E39 PolarHBondContact O-N 3.48Å; N36-D40 WeakPolarHBondContact O-CB 3.36Å; N36-D40 PolarHBondContact O-N 3.28Å
37	L	46.2	Very low	44.5	Very low	103 Å²	103	116.7 Å²	116.7	54%	0.539	62%	0.617	S	S	.	*	H	α-helix	trans	-61	-29	177	-157.1	83.2	0	0	0	113.7	E33 F34 I35 I41	E33-L37 WeakPolarHBondContact O-CB 3.36Å; E33-L37 PolarHBondContact O-N 3.25Å; F34-L37 WeakPolarHBondContact O-CB 3.48Å; F34-L37 PolarHBondContact O-N 3.38Å; I35-L37 VanDerWaalsContact C-N 3.28Å; I35-L37 PolarHBondContact O-N 3.46Å; L37-I41 VanDerWaalsContact O-CD1 3.28Å; L37-I41 WeakPolarHBondContact O-CD1 3.36Å; L37-I41 VanDerWaalsContact O-CG1 3.28Å; L37-I41 WeakPolarHBondContact O-CG1 3.08Å
38	L	45.7	Very low	45.7	Very low	102 Å²	102	116.6 Å²	116.6	53%	0.534	62%	0.616	S	S	.	*	H	α-helix	trans	-88	-30.9	177.3	-93.3	149.4	0	0	0	113.2	F34 I35 N36 D40	F34-L38 HydrophobicContact CD1-CD1 3.95Å; F34-L38 HydrophobicContact CE1-CD1 3.58Å; F34-L38 HydrophobicContact CZ-CD1 4.27Å; F34-L38 PolarHBondContact O-N 3.19Å; I35-L38 PolarHBondContact O-N 2.94Å; N36-L38 PolarHBondContact O-N 3.12Å; L38-D40 VanDerWaalsContact C-N 3.35Å
39	E	49.1	Very low	47.8	Very low	119 Å²	119	110.9 Å²	110.9	56%	0.556	59%	0.591	S	S	*	*	H	α-helix	trans	-70.5	-30.3	168.7	-92.9	-175.2	173.3	0	0	112	I35 N36 I41 E42 K129	I35-E39 PolarHBondContact O-N 3.33Å; N36-E39 PolarHBondContact O-N 3.48Å; E39-I41 PolarHBondContact O-N 3.48Å; E39-E42 PolarHBondContact O-N 3.47Å; E39-K129 IonicContact OE2-NZ 3.69Å
40	D	48.2	Very low	50	Low	108 Å²	108	109.2 Å²	109.2	58%	0.578	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-16.2	176.8	-68.5	-21.4	0	0	0	113.1	N36 L38	N36-D40 WeakPolarHBondContact O-CB 3.36Å; N36-D40 PolarHBondContact O-N 3.28Å; L38-D40 VanDerWaalsContact C-N 3.35Å
41	I	47.5	Very low	52.4	Low	127 Å²	127	105.4 Å²	105.4	65%	0.651	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-20.1	-179.5	-65.2	166.8	0	0	0	111.9	L37 E39	L37-I41 VanDerWaalsContact O-CD1 3.28Å; L37-I41 WeakPolarHBondContact O-CD1 3.36Å; L37-I41 VanDerWaalsContact O-CG1 3.28Å; L37-I41 WeakPolarHBondContact O-CG1 3.08Å; E39-I41 PolarHBondContact O-N 3.48Å
42	E	43.2	Very low	55.2	Low	180 Å²	180	100.1 Å²	100.1	84%	0.841	52%	0.518	S	S	*	.	S	Bend	trans	-103.4	52.2	174.4	-68.7	-170	163.2	0	0	111	E39 N44	E39-E42 PolarHBondContact O-N 3.47Å; E42-N44 PolarHBondContact O-N 3.22Å; E42-N44 VanDerWaalsContact O-N 3.07Å
43	G	37.5	Very low	57.6	Low	59 Å²	59	99.3 Å²	99.3	61%	0.608	51%	0.514	S	S	*	.			trans	-63.8	105.2	-176.1	0	0	0	0	0	113.9	E45	G43-E45 PolarHBondContact O-N 2.97Å
44	N	46.1	Very low	59.8	Low	111 Å²	111	92.9 Å²	92.9	59%	0.594	49%	0.486	S	S	*	.			trans	-71.3	115.2	155.8	-125.8	-8	0	0	0	106.9	E42 H46 E47	E42-N44 PolarHBondContact O-N 3.22Å; E42-N44 VanDerWaalsContact O-N 3.07Å; N44-H46 PolarHBondContact O-N 3.37Å; N44-E47 PolarHBondContact O-N 2.76Å
45	E	51.1	Low	62.2	Low	177 Å²	177	87.5 Å²	87.5	83%	0.827	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-8.5	-173	-65.6	179.9	161.2	0	0	114.9	G43	G43-E45 PolarHBondContact O-N 2.97Å
46	H	54.3	Low	64.6	Low	112 Å²	112	86.7 Å²	86.7	52%	0.519	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-13.6	176.4	-63.7	-60.8	0	0	0	115	N44	N44-H46 PolarHBondContact O-N 3.37Å
47	E	58.4	Low	66.8	Low	81 Å²	81	84.2 Å²	84.2	38%	0.379	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-18.1	-173.4	-65.5	-163.2	177.1	0	0	114.9	N44 K129	N44-E47 PolarHBondContact O-N 2.76Å; E47-K129 WeakPolarHBondContact OE2-CE 3.32Å; E47-K129 IonicContact OE2-NZ 3.26Å
48	N	64.4	Low	69	Low	161 Å²	161	84.5 Å²	84.5	86%	0.861	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	6.7	-173.1	-96.6	-26.2	0	0	0	115.2
49	I	76.3	Confident	71.1	Confident	58 Å²	58	86 Å²	86	30%	0.297	47%	0.468	S	S	.	.			trans	-96.1	108.1	-176.6	-50.2	177.1	0	0	0	109.7	L51 V54	I49-L51 PolarHBondContact O-N 2.92Å; I49-V54 HydrophobicContact CG2-CG2 3.23Å
50	D	88.5	Confident	73.1	Confident	53 Å²	53	85 Å²	85	28%	0.283	47%	0.474	S	S	.	.			trans	-66.5	118.3	174.3	-171.9	-0.1	0	0	0	110	Y52 S53 V54 Y123	D50-Y52 PolarHBondContact O-N 3.42Å; D50-Y52 VanDerWaalsContact O-N 3.16Å; D50-Y52 WeakPolarHBondContact OD1-CD2 3.34Å; D50-Y52 PolarHBondContact OD1-N 2.95Å; D50-S53 WeakPolarHBondContact O-CA 3.48Å; D50-S53 WeakPolarHBondContact O-CB 3.33Å; D50-S53 PolarHBondContact O-N 2.67Å; D50-S53 PolarHBondContact O-OG 3.05Å; D50-V54 PolarHBondContact O-N 3.09Å; D50-V54 VanDerWaalsContact O-N 3.14Å; D50-Y123 WeakPolarHBondContact CA-OH 3.44Å; D50-Y123 PolarHBondContact OD1-OH 3.13Å
51	L	91.4	Very high	75.1	Confident	7 Å²	7	80.4 Å²	80.4	4%	0.037	45%	0.45	C	S	.	.	H	α-helix	trans	-56.7	-33.3	-177.2	-60.1	179.9	0	0	0	112.9	I49 S53 V54 L55 A110 I113 L114 Y123	I49-L51 PolarHBondContact O-N 2.92Å; L51-S53 VanDerWaalsContact C-N 3.32Å; L51-V54 PolarHBondContact O-N 3.16Å; L51-L55 PolarHBondContact O-N 2.6Å; L51-A110 HydrophobicContact CB-CB 4.19Å; L51-A110 HydrophobicContact CD2-CB 4Å; L51-I113 HydrophobicContact CD1-CB 3.92Å; L51-I113 HydrophobicContact CD1-CD1 3.8Å; L51-I113 HydrophobicContact CD1-CG1 4.47Å; L51-I113 HydrophobicContact CD1-CG2 3.54Å; L51-I113 HydrophobicContact CD2-CD1 4.39Å; L51-L114 HydrophobicContact CB-CD1 3.88Å; L51-L114 HydrophobicContact CB-CD2 4.42Å; L51-L114 HydrophobicContact CB-CG 4.15Å; L51-L114 HydrophobicContact CD1-CG 4.48Å; L51-Y123 HydrophobicContact CB-CE1 4.02Å; L51-Y123 HydrophobicContact CB-CE2 4.31Å; L51-Y123 HydrophobicContact CD1-CD1 4.17Å; L51-Y123 HydrophobicContact CD1-CD2 3.53Å; L51-Y123 HydrophobicContact CD1-CE1 4.11Å; L51-Y123 HydrophobicContact CD1-CE2 3.47Å; L51-Y123 VanDerWaalsContact CD1-CE2 3.47Å; L51-Y123 HydrophobicContact CD1-CG 3.89Å; L51-Y123 HydrophobicContact CG-CD2 4.17Å; L51-Y123 HydrophobicContact CG-CE1 4.16Å; L51-Y123 HydrophobicContact CG-CE2 3.56Å; L51-Y123 PolarHBondContact N-OH 3.49Å
52	Y	94	Very high	77.3	Confident	4 Å²	4	77 Å²	77	2%	0.016	44%	0.438	C	S	.	.	H	α-helix	trans	-66	-37.7	175	-67.3	-73.3	0	0	0	111.5	D50 L55 G56 V57 K59 L114 R120 Y123 D124	D50-Y52 PolarHBondContact O-N 3.42Å; D50-Y52 VanDerWaalsContact O-N 3.16Å; D50-Y52 WeakPolarHBondContact OD1-CD2 3.34Å; D50-Y52 PolarHBondContact OD1-N 2.95Å; Y52-L55 PolarHBondContact O-N 3.3Å; Y52-G56 PolarHBondContact O-N 3.23Å; Y52-V57 WeakPolarHBondContact CB-O 3.19Å; Y52-V57 HydrophobicContact CD1-CG2 4.06Å; Y52-V57 PolarHBondContact O-N 2.78Å; Y52-K59 HydrophobicContact CD2-CB 4.43Å; Y52-K59 HydrophobicContact CD2-CD 4.41Å; Y52-K59 HydrophobicContact CD2-CG 3.69Å; Y52-K59 HydrophobicContact CE2-CB 4.3Å; Y52-K59 HydrophobicContact CE2-CG 3.94Å; Y52-K59 HydrophobicContact CG-CG 3.99Å; Y52-L114 HydrophobicContact CD1-CD1 3.86Å; Y52-L114 HydrophobicContact CD1-CD2 4.35Å; Y52-L114 HydrophobicContact CE1-CD1 3.97Å; Y52-L114 HydrophobicContact CE1-CD2 3.73Å; Y52-L114 HydrophobicContact CE1-CG 4.46Å; Y52-L114 HydrophobicContact CE2-CD2 4.02Å; Y52-L114 HydrophobicContact CG-CD1 4.32Å; Y52-R120 PolarHBondContact OH-NE 3.47Å; Y52-Y123 HydrophobicContact CD2-CD1 4.44Å; Y52-Y123 AromaticContact CD2-CE1 3.73Å; Y52-Y123 HydrophobicContact CD2-CE1 3.73Å; Y52-Y123 AromaticContact CE2-CD1 3.83Å; Y52-Y123 HydrophobicContact CE2-CD1 3.83Å; Y52-Y123 AromaticContact CE2-CE1 3.56Å; Y52-Y123 HydrophobicContact CE2-CE1 3.56Å; Y52-D124 VanDerWaalsContact CE2-OD1 3.28Å; Y52-D124 WeakPolarHBondContact CE2-OD1 3.4Å; Y52-D124 PolarHBondContact OH-OD1 3.11Å; Y52-D124 PolarHBondContact OH-OD2 3.25Å
53	S	91.6	Very high	79.6	Confident	76 Å²	76	71.4 Å²	71.4	53%	0.531	42%	0.423	S	S	.	.	H	α-helix	trans	-68.5	-35.5	176.7	78.5	0	0	0	0	112.7	D50 L51 L55 G56	D50-S53 WeakPolarHBondContact O-CA 3.48Å; D50-S53 WeakPolarHBondContact O-CB 3.33Å; D50-S53 PolarHBondContact O-N 2.67Å; D50-S53 PolarHBondContact O-OG 3.05Å; L51-S53 VanDerWaalsContact C-N 3.32Å; S53-L55 VanDerWaalsContact C-N 3.29Å; S53-L55 PolarHBondContact O-N 3.32Å; S53-G56 PolarHBondContact O-N 3.37Å
54	V	90.7	Very high	82.2	Confident	27 Å²	27	70.6 Å²	70.6	16%	0.164	41%	0.41	C	S	.	.	H	α-helix	trans	-60.6	-40.7	175.9	-179.5	0	0	0	0	111.3	I49 D50 L51 G56 L73 Q106 I107 A110	I49-V54 HydrophobicContact CG2-CG2 3.23Å; D50-V54 PolarHBondContact O-N 3.09Å; D50-V54 VanDerWaalsContact O-N 3.14Å; L51-V54 PolarHBondContact O-N 3.16Å; V54-G56 VanDerWaalsContact C-N 3.34Å; V54-L73 WeakPolarHBondContact O-CD1 3.37Å; V54-Q106 HydrophobicContact CG1-CB 4.22Å; V54-I107 HydrophobicContact CG1-CG1 3.97Å; V54-A110 HydrophobicContact CB-CB 4.09Å; V54-A110 HydrophobicContact CG1-CB 4.08Å
55	L	92.4	Very high	84.5	Confident	7 Å²	7	68.4 Å²	68.4	4%	0.037	40%	0.398	C	S	.	.	H	α-helix	trans	-83.6	-11.9	177.2	-65.4	-179.7	0	0	0	113.1	L51 Y52 S53 V57 L66 A69 L73 I107 A110 L114	L51-L55 PolarHBondContact O-N 2.6Å; Y52-L55 PolarHBondContact O-N 3.3Å; S53-L55 VanDerWaalsContact C-N 3.29Å; S53-L55 PolarHBondContact O-N 3.32Å; L55-V57 VanDerWaalsContact C-N 3.31Å; L55-V57 HydrophobicContact CB-CG1 4.22Å; L55-V57 HydrophobicContact CB-CG2 3.77Å; L55-V57 HydrophobicContact CD1-CG2 4.49Å; L55-L66 HydrophobicContact CD1-CD2 3.93Å; L55-A69 HydrophobicContact CB-CB 4.36Å; L55-L73 HydrophobicContact CD2-CD1 4.09Å; L55-I107 HydrophobicContact CD2-CG2 4.06Å; L55-A110 HydrophobicContact CD1-CB 4.4Å; L55-A110 HydrophobicContact CD2-CB 4.42Å; L55-A110 HydrophobicContact CG-CB 4.07Å; L55-L114 HydrophobicContact CD1-CD1 3.9Å
56	G	91.6	Very high	86.5	Confident	69 Å²	69	60 Å²	60	71%	0.711	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	35.3	-174.2	0	0	0	0	0	112.7	Y52 S53 V54	Y52-G56 PolarHBondContact O-N 3.23Å; S53-G56 PolarHBondContact O-N 3.37Å; V54-G56 VanDerWaalsContact C-N 3.34Å
57	V	94.2	Very high	88.3	Confident	27 Å²	27	61.6 Å²	61.6	16%	0.164	36%	0.361	C	S	.	.			trans	-118.3	152.4	-178.4	-63.6	0	0	0	0	110.8	Y52 L55 A61 L66 A69	Y52-V57 WeakPolarHBondContact CB-O 3.19Å; Y52-V57 HydrophobicContact CD1-CG2 4.06Å; Y52-V57 PolarHBondContact O-N 2.78Å; L55-V57 VanDerWaalsContact C-N 3.31Å; L55-V57 HydrophobicContact CB-CG1 4.22Å; L55-V57 HydrophobicContact CB-CG2 3.77Å; L55-V57 HydrophobicContact CD1-CG2 4.49Å; V57-A61 HydrophobicContact CB-CB 3.93Å; V57-A61 HydrophobicContact CG2-CB 4.25Å; V57-L66 HydrophobicContact CB-CD2 4.5Å; V57-L66 HydrophobicContact CG2-CD2 3.59Å; V57-A69 HydrophobicContact CG1-CB 3.48Å; V57-A69 VanDerWaalsContact CG1-CB 3.48Å
58	D	93.2	Very high	90	Very high	109 Å²	109	63.2 Å²	63.2	58%	0.583	37%	0.37	S	S	*	.			trans	-72.4	155.4	174.5	-165.6	-68.8	0	0	0	110.8	S60 A61	D58-S60 VanDerWaalsContact CG-OG 3.3Å; D58-S60 PolarHBondContact O-N 2.85Å; D58-S60 VanDerWaalsContact O-N 3.16Å; D58-S60 WeakPolarHBondContact OD1-CB 3.43Å; D58-S60 PolarHBondContact OD1-N 3.4Å; D58-S60 PolarHBondContact OD1-OG 3.03Å; D58-A61 WeakPolarHBondContact O-CB 3.48Å; D58-A61 PolarHBondContact O-N 3.42Å
59	K	90.4	Very high	91.4	Very high	134 Å²	134	56.2 Å²	56.2	58%	0.583	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-24.9	173.8	-61.4	-172.1	176.6	-174.6	0	112.4	Y52 A61 R120	Y52-K59 HydrophobicContact CD2-CB 4.43Å; Y52-K59 HydrophobicContact CD2-CD 4.41Å; Y52-K59 HydrophobicContact CD2-CG 3.69Å; Y52-K59 HydrophobicContact CE2-CB 4.3Å; Y52-K59 HydrophobicContact CE2-CG 3.94Å; Y52-K59 HydrophobicContact CG-CG 3.99Å; K59-A61 VanDerWaalsContact C-N 3.33Å; K59-R120 PolarHBondContact O-NH2 3.21Å
60	S	90.7	Very high	92.2	Very high	99 Å²	99	56.5 Å²	56.5	69%	0.692	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	1.4	174.9	59.5	0	0	0	0	115.1	D58	D58-S60 VanDerWaalsContact CG-OG 3.3Å; D58-S60 PolarHBondContact O-N 2.85Å; D58-S60 VanDerWaalsContact O-N 3.16Å; D58-S60 WeakPolarHBondContact OD1-CB 3.43Å; D58-S60 PolarHBondContact OD1-N 3.4Å; D58-S60 PolarHBondContact OD1-OG 3.03Å
61	A	89.8	Confident	92.4	Very high	10 Å²	10	61 Å²	61	8%	0.083	35%	0.349	C	S	.	.			trans	-61.3	139.4	-174.5	0	0	0	0	0	113.9	V57 D58 K59 D65 L66 R120	V57-A61 HydrophobicContact CB-CB 3.93Å; V57-A61 HydrophobicContact CG2-CB 4.25Å; D58-A61 WeakPolarHBondContact O-CB 3.48Å; D58-A61 PolarHBondContact O-N 3.42Å; K59-A61 VanDerWaalsContact C-N 3.33Å; A61-D65 HydrophobicContact CB-CB 4.14Å; A61-L66 HydrophobicContact CB-CD2 4.33Å; A61-R120 PolarHBondContact O-NH1 2.99Å; A61-R120 PolarHBondContact O-NH2 2.87Å
62	S	92.8	Very high	92.5	Very high	56 Å²	56	69.4 Å²	69.4	39%	0.392	38%	0.38	S	S	.	.			trans	-75.1	162	176.6	76.5	0	0	0	0	111.8	A64 D65 L66	S62-A64 PolarHBondContact O-N 2.96Å; S62-A64 VanDerWaalsContact O-N 3.14Å; S62-A64 PolarHBondContact OG-N 3.36Å; S62-D65 VanDerWaalsContact CB-OD2 3.32Å; S62-D65 WeakPolarHBondContact CB-OD2 3.41Å; S62-D65 PolarHBondContact N-OD2 3.26Å; S62-D65 PolarHBondContact O-N 3.24Å; S62-D65 PolarHBondContact OG-N 3.5Å; S62-D65 PolarHBondContact OG-OD2 3.18Å; S62-L66 PolarHBondContact O-N 3.03Å; S62-L66 VanDerWaalsContact O-N 3.07Å
63	A	91.4	Very high	92.3	Very high	63 Å²	63	70.6 Å²	70.6	52%	0.521	39%	0.387	S	S	.	.	H	α-helix	trans	-61.1	-21.1	174.3	0	0	0	0	0	113.3	R67	A63-R67 WeakPolarHBondContact O-CG 3.46Å; A63-R67 PolarHBondContact O-N 3.34Å; A63-R67 PolarHBondContact O-NE 3.49Å
64	A	92.7	Very high	92.1	Very high	42 Å²	42	67.8 Å²	67.8	35%	0.347	37%	0.367	S	S	.	.	H	α-helix	trans	-74.5	-42.4	172	0	0	0	0	0	111.3	S62 R67 M68	S62-A64 PolarHBondContact O-N 2.96Å; S62-A64 VanDerWaalsContact O-N 3.14Å; S62-A64 PolarHBondContact OG-N 3.36Å; A64-R67 WeakPolarHBondContact O-CB 3.48Å; A64-R67 PolarHBondContact O-N 3.03Å; A64-M68 WeakPolarHBondContact O-CG 3.21Å; A64-M68 PolarHBondContact O-N 3.32Å
65	D	94.3	Very high	91.9	Very high	64 Å²	64	71.1 Å²	71.1	34%	0.342	38%	0.383	S	S	.	.	H	α-helix	trans	-65.5	-42.8	-179.7	-56.1	-39.6	0	0	0	111.6	A61 S62 R67 M68 A69	A61-D65 HydrophobicContact CB-CB 4.14Å; S62-D65 VanDerWaalsContact CB-OD2 3.32Å; S62-D65 WeakPolarHBondContact CB-OD2 3.41Å; S62-D65 PolarHBondContact N-OD2 3.26Å; S62-D65 PolarHBondContact O-N 3.24Å; S62-D65 PolarHBondContact OG-N 3.5Å; S62-D65 PolarHBondContact OG-OD2 3.18Å; D65-R67 VanDerWaalsContact C-N 3.29Å; D65-R67 PolarHBondContact O-N 3.27Å; D65-M68 HydrophobicContact CB-CE 4.48Å; D65-M68 PolarHBondContact O-N 2.89Å; D65-M68 WeakPolarHBondContact OD1-CE 3.2Å; D65-A69 WeakPolarHBondContact O-CB 3.16Å; D65-A69 PolarHBondContact O-N 3.02Å
66	L	93	Very high	91.6	Very high	2 Å²	2	75.2 Å²	75.2	1%	0.01	41%	0.405	C	S	.	.	H	α-helix	trans	-56.8	-43.2	174	-66.3	176.2	0	0	0	111.8	L55 V57 A61 S62 Y70 L114	L55-L66 HydrophobicContact CD1-CD2 3.93Å; V57-L66 HydrophobicContact CB-CD2 4.5Å; V57-L66 HydrophobicContact CG2-CD2 3.59Å; A61-L66 HydrophobicContact CB-CD2 4.33Å; S62-L66 PolarHBondContact O-N 3.03Å; S62-L66 VanDerWaalsContact O-N 3.07Å; L66-Y70 WeakPolarHBondContact O-CB 3.34Å; L66-Y70 PolarHBondContact O-N 2.83Å; L66-L114 HydrophobicContact CD1-CB 3.92Å; L66-L114 WeakPolarHBondContact CD1-O 2.96Å; L66-L114 HydrophobicContact CD2-CB 4.26Å; L66-L114 HydrophobicContact CD2-CD1 4.14Å
67	R	93.1	Very high	91.2	Very high	144 Å²	144	75.6 Å²	75.6	54%	0.543	39%	0.387	S	S	.	.	H	α-helix	trans	-65.3	-42.1	176.6	-78.4	-176.7	-67.7	169.1	1.4	112.5	A63 A64 D65 K71 Y111	A63-R67 WeakPolarHBondContact O-CG 3.46Å; A63-R67 PolarHBondContact O-N 3.34Å; A63-R67 PolarHBondContact O-NE 3.49Å; A64-R67 WeakPolarHBondContact O-CB 3.48Å; A64-R67 PolarHBondContact O-N 3.03Å; D65-R67 VanDerWaalsContact C-N 3.29Å; D65-R67 PolarHBondContact O-N 3.27Å; R67-K71 WeakPolarHBondContact O-CB 3.39Å; R67-K71 PolarHBondContact O-N 3Å; R67-Y111 HydrophobicContact CB-CE2 4.4Å; R67-Y111 HydrophobicContact CG-CE2 3.69Å; R67-Y111 VanDerWaalsContact CG-OH 3.26Å; R67-Y111 WeakPolarHBondContact CG-OH 3.49Å
68	M	94.1	Very high	90.7	Very high	116 Å²	116	78.1 Å²	78.1	57%	0.571	40%	0.397	S	S	*	.	H	α-helix	trans	-66	-44.4	177.9	-71.1	-170.6	-64	0	0	111.8	A64 D65 K71 R72	A64-M68 WeakPolarHBondContact O-CG 3.21Å; A64-M68 PolarHBondContact O-N 3.32Å; D65-M68 HydrophobicContact CB-CE 4.48Å; D65-M68 PolarHBondContact O-N 2.89Å; D65-M68 WeakPolarHBondContact OD1-CE 3.2Å; M68-K71 PolarHBondContact O-N 3.47Å; M68-R72 WeakPolarHBondContact O-CB 3.45Å; M68-R72 PolarHBondContact O-N 3.16Å
69	A	92.9	Very high	90.1	Very high	14 Å²	14	75.5 Å²	75.5	12%	0.116	39%	0.386	C	S	.	.	H	α-helix	trans	-61.9	-48.6	177.6	0	0	0	0	0	111.7	L55 V57 D65 K71 R72 L73	L55-A69 HydrophobicContact CB-CB 4.36Å; V57-A69 HydrophobicContact CG1-CB 3.48Å; V57-A69 VanDerWaalsContact CG1-CB 3.48Å; D65-A69 WeakPolarHBondContact O-CB 3.16Å; D65-A69 PolarHBondContact O-N 3.02Å; A69-K71 VanDerWaalsContact C-N 3.35Å; A69-K71 PolarHBondContact O-N 3Å; A69-R72 PolarHBondContact O-N 3.36Å; A69-L73 WeakPolarHBondContact O-CG 3.2Å; A69-L73 PolarHBondContact O-N 3.43Å
70	Y	93.1	Very high	89.7	Confident	63 Å²	63	73.9 Å²	73.9	25%	0.247	38%	0.384	C	S	.	.	H	α-helix	trans	-57.7	-45.4	175.6	175.3	-108.3	0	0	0	112.3	L66 R72 L73 S74 I107 A108 Y111	L66-Y70 WeakPolarHBondContact O-CB 3.34Å; L66-Y70 PolarHBondContact O-N 2.83Å; Y70-R72 PolarHBondContact O-N 3.27Å; Y70-L73 PolarHBondContact O-N 3.07Å; Y70-S74 WeakPolarHBondContact CE2-OG 3.34Å; Y70-S74 VanDerWaalsContact CZ-OG 3.28Å; Y70-S74 WeakPolarHBondContact O-CB 3.25Å; Y70-S74 PolarHBondContact O-N 3.09Å; Y70-S74 PolarHBondContact O-OG 3.27Å; Y70-I107 HydrophobicContact CD2-CG2 3.62Å; Y70-I107 HydrophobicContact CE2-CG2 3.94Å; Y70-A108 HydrophobicContact CE2-CB 4.29Å; Y70-Y111 AromaticContact CD1-CD1 3.88Å; Y70-Y111 HydrophobicContact CD1-CD1 3.88Å; Y70-Y111 HydrophobicContact CD1-CD2 4.31Å; Y70-Y111 HydrophobicContact CD1-CE1 4.14Å; Y70-Y111 AromaticContact CD1-CG 3.98Å; Y70-Y111 HydrophobicContact CD1-CG 3.98Å; Y70-Y111 VanDerWaalsContact CD2-CB 3.45Å; Y70-Y111 HydrophobicContact CD2-CD1 4.12Å; Y70-Y111 HydrophobicContact CD2-CD2 4.45Å; Y70-Y111 AromaticContact CD2-CG 3.75Å; Y70-Y111 HydrophobicContact CD2-CG 3.75Å; Y70-Y111 HydrophobicContact CE1-CD1 4.12Å; Y70-Y111 HydrophobicContact CE1-CE1 4.4Å; Y70-Y111 HydrophobicContact CE2-CD1 4.37Å; Y70-Y111 HydrophobicContact CE2-CG 4.41Å; Y70-Y111 AromaticContact CG-CD1 3.88Å; Y70-Y111 HydrophobicContact CG-CD1 3.88Å; Y70-Y111 AromaticContact CG-CD2 3.85Å; Y70-Y111 HydrophobicContact CG-CD2 3.85Å; Y70-Y111 HydrophobicContact CG-CE2 4.48Å; Y70-Y111 AromaticContact CG-CG 3.52Å; Y70-Y111 HydrophobicContact CG-CG 3.52Å
71	K	92.7	Very high	89	Confident	147 Å²	147	75.3 Å²	75.3	64%	0.639	38%	0.377	S	S	*	.	H	α-helix	trans	-61.5	-43.1	177.6	-174.1	178.7	-179.3	-179.8	0	111.9	R67 M68 A69 L75	R67-K71 WeakPolarHBondContact O-CB 3.39Å; R67-K71 PolarHBondContact O-N 3Å; M68-K71 PolarHBondContact O-N 3.47Å; A69-K71 VanDerWaalsContact C-N 3.35Å; A69-K71 PolarHBondContact O-N 3Å; K71-L75 HydrophobicContact CG-CD1 4.45Å; K71-L75 WeakPolarHBondContact O-CG 3.26Å; K71-L75 PolarHBondContact O-N 3.01Å
72	R	93	Very high	88	Confident	185 Å²	185	77.7 Å²	77.7	70%	0.698	39%	0.387	S	S	*	.	H	α-helix	trans	-62.2	-49.3	177.6	179.2	-178.5	175.2	178.9	-1.6	111.4	M68 A69 Y70 L75 L76	M68-R72 WeakPolarHBondContact O-CB 3.45Å; M68-R72 PolarHBondContact O-N 3.16Å; A69-R72 PolarHBondContact O-N 3.36Å; Y70-R72 PolarHBondContact O-N 3.27Å; R72-L75 PolarHBondContact O-N 3.05Å; R72-L76 HydrophobicContact CG-CD1 4.36Å; R72-L76 WeakPolarHBondContact O-CG 3.4Å; R72-L76 PolarHBondContact O-N 3.11Å
73	L	90.6	Very high	86.4	Confident	28 Å²	28	78.8 Å²	78.8	15%	0.147	40%	0.395	C	S	.	.	H	α-helix	trans	-70.4	-39.8	-177.1	-69.8	171.2	0	0	0	112.3	V54 L55 A69 Y70 L75 L76 F77 I107	V54-L73 WeakPolarHBondContact O-CD1 3.37Å; L55-L73 HydrophobicContact CD2-CD1 4.09Å; A69-L73 WeakPolarHBondContact O-CG 3.2Å; A69-L73 PolarHBondContact O-N 3.43Å; Y70-L73 PolarHBondContact O-N 3.07Å; L73-L75 VanDerWaalsContact C-N 3.27Å; L73-L75 PolarHBondContact O-N 3.13Å; L73-L76 PolarHBondContact O-N 3.02Å; L73-F77 HydrophobicContact CD2-CD2 4.43Å; L73-F77 HydrophobicContact CD2-CE2 4.06Å; L73-F77 WeakPolarHBondContact O-CD2 3.42Å; L73-F77 PolarHBondContact O-N 3.36Å; L73-I107 HydrophobicContact CB-CD1 3.79Å; L73-I107 HydrophobicContact CB-CG1 4.25Å; L73-I107 HydrophobicContact CB-CG2 3.87Å; L73-I107 HydrophobicContact CD1-CD1 4.47Å; L73-I107 HydrophobicContact CD1-CG1 4.25Å; L73-I107 HydrophobicContact CD1-CG2 4.36Å
74	S	87.5	Confident	84.7	Confident	17 Å²	17	81.8 Å²	81.8	12%	0.119	40%	0.4	C	S	.	.	H	α-helix	trans	-59.8	-37.3	176.1	-64.5	0	0	0	0	112.5	Y70 L76 H78	Y70-S74 WeakPolarHBondContact CE2-OG 3.34Å; Y70-S74 VanDerWaalsContact CZ-OG 3.28Å; Y70-S74 WeakPolarHBondContact O-CB 3.25Å; Y70-S74 PolarHBondContact O-N 3.09Å; Y70-S74 PolarHBondContact O-OG 3.27Å; S74-L76 VanDerWaalsContact C-N 3.3Å; S74-L76 PolarHBondContact O-N 2.98Å; S74-H78 WeakPolarHBondContact O-CB 3.25Å; S74-H78 PolarHBondContact O-N 2.94Å
75	L	87.2	Confident	82.7	Confident	97 Å²	97	83.1 Å²	83.1	51%	0.508	41%	0.407	S	S	.	.	H	α-helix	trans	-71.1	-24.5	176.5	-74.8	169.9	0	0	0	113.7	K71 R72 L73 K81	K71-L75 HydrophobicContact CG-CD1 4.45Å; K71-L75 WeakPolarHBondContact O-CG 3.26Å; K71-L75 PolarHBondContact O-N 3.01Å; R72-L75 PolarHBondContact O-N 3.05Å; L73-L75 VanDerWaalsContact C-N 3.27Å; L73-L75 PolarHBondContact O-N 3.13Å; L75-K81 WeakPolarHBondContact O-CD 3.49Å; L75-K81 WeakPolarHBondContact O-CE 3.48Å; L75-K81 PolarHBondContact O-NZ 3.36Å
76	L	85.2	Confident	80.3	Confident	94 Å²	94	85.3 Å²	85.3	49%	0.492	42%	0.423	S	S	.	.	H	α-helix	trans	-86.1	-43.4	179.7	-71	169.3	0	0	0	111.6	R72 L73 S74 H82	R72-L76 HydrophobicContact CG-CD1 4.36Å; R72-L76 WeakPolarHBondContact O-CG 3.4Å; R72-L76 PolarHBondContact O-N 3.11Å; L73-L76 PolarHBondContact O-N 3.02Å; S74-L76 VanDerWaalsContact C-N 3.3Å; S74-L76 PolarHBondContact O-N 2.98Å; L76-H82 PolarHBondContact O-NE2 3.15Å
77	F	83.9	Confident	78.2	Confident	76 Å²	76	90.3 Å²	90.3	33%	0.333	46%	0.456	S	S	.	.	S	Bend	trans	-98.5	13.4	-175.5	-67.7	-76	0	0	0	114	L73 A103 F104 I107	L73-F77 HydrophobicContact CD2-CD2 4.43Å; L73-F77 HydrophobicContact CD2-CE2 4.06Å; L73-F77 WeakPolarHBondContact O-CD2 3.42Å; L73-F77 PolarHBondContact O-N 3.36Å; F77-A103 HydrophobicContact CD1-CB 3.79Å; F77-A103 HydrophobicContact CE1-CB 4.12Å; F77-A103 HydrophobicContact CG-CB 4.14Å; F77-F104 HydrophobicContact CB-CB 4.39Å; F77-I107 HydrophobicContact CB-CD1 4.21Å; F77-I107 HydrophobicContact CD2-CD1 3.46Å; F77-I107 VanDerWaalsContact CD2-CD1 3.46Å; F77-I107 HydrophobicContact CE2-CD1 4.1Å; F77-I107 HydrophobicContact CG-CD1 4.04Å
78	H	83	Confident	76.1	Confident	81 Å²	81	92 Å²	92	38%	0.375	47%	0.47	S	S	.	.			trans	-62	128	178.7	-163.3	-91.7	0	0	0	111	S74 D80 K81 H82	S74-H78 WeakPolarHBondContact O-CB 3.25Å; S74-H78 PolarHBondContact O-N 2.94Å; H78-D80 VanDerWaalsContact CE1-CB 3.48Å; H78-D80 WeakPolarHBondContact CE1-CB 3.35Å; H78-D80 WeakPolarHBondContact ND1-CB 3.36Å; H78-D80 PolarHBondContact ND1-N 3.49Å; H78-D80 PolarHBondContact O-N 2.98Å; H78-D80 VanDerWaalsContact O-N 3.12Å; H78-K81 HydrophobicContact CB-CG 4.49Å; H78-K81 PolarHBondContact O-N 2.9Å; H78-H82 PolarHBondContact O-CD2 2.81Å
79	P	80.7	Confident	73.8	Confident	53 Å²	53	93.5 Å²	93.5	34%	0.344	48%	0.48	S	S	.	.	H	α-helix	trans	-59.9	-30.7	-174	22.9	-34.1	0	0	0	113.1	K81 H82 S83 V101	P79-K81 VanDerWaalsContact C-N 3.3Å; P79-K81 PolarHBondContact O-N 2.91Å; P79-H82 PolarHBondContact O-N 3.06Å; P79-S83 PolarHBondContact O-N 3.24Å; P79-V101 HydrophobicContact CB-CG2 3.93Å
80	D	81.7	Confident	71.5	Confident	101 Å²	101	95.5 Å²	95.5	54%	0.54	49%	0.489	S	S	.	.	H	α-helix	trans	-58.2	-39.7	177.1	-163.7	40.8	0	0	0	112.5	H78 H82 S83	H78-D80 VanDerWaalsContact CE1-CB 3.48Å; H78-D80 WeakPolarHBondContact CE1-CB 3.35Å; H78-D80 WeakPolarHBondContact ND1-CB 3.36Å; H78-D80 PolarHBondContact ND1-N 3.49Å; H78-D80 PolarHBondContact O-N 2.98Å; H78-D80 VanDerWaalsContact O-N 3.12Å; D80-H82 VanDerWaalsContact C-N 3.34Å; D80-H82 PolarHBondContact O-N 3.42Å; D80-S83 PolarHBondContact O-N 3.4Å; D80-S83 PolarHBondContact O-OG 3.05Å
81	K	75.8	Confident	69.1	Low	128 Å²	128	101.5 Å²	101.5	56%	0.557	52%	0.519	S	S	*	.	H	α-helix	trans	-74.6	-25.2	-178.1	-64.5	-168.7	179.3	-173.9	0	113.5	L75 H78 P79	L75-K81 WeakPolarHBondContact O-CD 3.49Å; L75-K81 WeakPolarHBondContact O-CE 3.48Å; L75-K81 PolarHBondContact O-NZ 3.36Å; H78-K81 HydrophobicContact CB-CG 4.49Å; H78-K81 PolarHBondContact O-N 2.9Å; P79-K81 VanDerWaalsContact C-N 3.3Å; P79-K81 PolarHBondContact O-N 2.91Å
82	H	68.8	Low	66.8	Low	60 Å²	60	104 Å²	104	28%	0.278	53%	0.53	S	S	.	.	H	α-helix	trans	-95.7	0.6	-179.9	-64	-69.9	0	0	0	112.9	L76 H78 P79 D80 A100	L76-H82 PolarHBondContact O-NE2 3.15Å; H78-H82 PolarHBondContact O-CD2 2.81Å; P79-H82 PolarHBondContact O-N 3.06Å; D80-H82 VanDerWaalsContact C-N 3.34Å; D80-H82 PolarHBondContact O-N 3.42Å; H82-A100 HydrophobicContact CB-CB 3.97Å; H82-A100 VanDerWaalsContact CD2-CB 3.43Å; H82-A100 WeakPolarHBondContact CD2-CB 3.5Å
83	S	59.8	Low	64.6	Low	80 Å²	80	99.4 Å²	99.4	56%	0.559	52%	0.518	S	S	*	.	S	Bend	trans	-87.3	-10.6	178.6	74.6	0	0	0	0	114.4	P79 D80	P79-S83 PolarHBondContact O-N 3.24Å; D80-S83 PolarHBondContact O-N 3.4Å; D80-S83 PolarHBondContact O-OG 3.05Å
84	I	56	Low	62.2	Low	125 Å²	125	104.4 Å²	104.4	64%	0.641	55%	0.55	S	S	*	*			trans	-114.9	8.6	-166.5	-57.3	171.4	0	0	0	113.1	T86	I84-T86 PolarHBondContact O-N 3.12Å
85	S	50	Low	60.3	Low	71 Å²	71	106.7 Å²	106.7	50%	0.497	57%	0.567	S	S	.	*			trans	-68.8	104.5	-179.8	54	0	0	0	0	112.1
86	T	45.2	Very low	58.9	Low	110 Å²	110	103.4 Å²	103.4	68%	0.675	55%	0.552	S	S	*	*			trans	-64.6	156.6	172.4	41.1	0	0	0	0	112.5	I84 E88 N90	I84-T86 PolarHBondContact O-N 3.12Å; T86-E88 VanDerWaalsContact C-N 3.31Å; T86-E88 PolarHBondContact O-N 3Å; T86-N90 PolarHBondContact O-ND2 3.4Å
87	P	47	Very low	58.1	Low	106 Å²	106	101.5 Å²	101.5	69%	0.688	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	6.1	-153.5	-20.1	34.2	0	0	0	119	N90	P87-N90 VanDerWaalsContact CA-ND2 3.27Å; P87-N90 WeakPolarHBondContact CA-ND2 3.36Å
88	E	50	Low	57.6	Low	179 Å²	179	102.3 Å²	102.3	84%	0.836	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	-10.1	-155.7	-64.6	-173.5	165.8	0	0	116.5	T86	T86-E88 VanDerWaalsContact C-N 3.31Å; T86-E88 PolarHBondContact O-N 3Å
89	D	46.7	Very low	57.3	Low	148 Å²	148	102.5 Å²	102.5	79%	0.791	57%	0.568	S	S	*	*	S	Bend	trans	-114.4	21.3	176.6	-70.2	-37.3	0	0	0	113.4	E91	D89-E91 PolarHBondContact O-N 2.99Å
90	N	43.4	Very low	57.2	Low	57 Å²	57	100.1 Å²	100.1	31%	0.305	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97	37.4	-154.2	-76.5	-18.2	0	0	0	117.2	T86 P87	T86-N90 PolarHBondContact O-ND2 3.4Å; P87-N90 VanDerWaalsContact CA-ND2 3.27Å; P87-N90 WeakPolarHBondContact CA-ND2 3.36Å
91	E	43.1	Very low	57.2	Low	188 Å²	188	99.3 Å²	99.3	88%	0.879	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-9	173.3	-82.7	-169.7	161.5	0	0	114.8	D89	D89-E91 PolarHBondContact O-N 2.99Å
92	K	44	Very low	57.6	Low	200 Å²	200	95.8 Å²	95.8	87%	0.87	55%	0.546	S	S	*	.	S	Bend	trans	-122.1	1.6	175.9	-71.5	-176.2	179.8	176.9	0	115
93	I	46.3	Very low	58.3	Low	88 Å²	88	93.9 Å²	93.9	45%	0.451	54%	0.541	S	S	.	.			trans	-128.3	54.8	-170	-47.6	177	0	0	0	109.2	S96	I93-S96 VanDerWaalsContact CG2-CB 3.45Å
94	T	40.5	Very low	59.7	Low	133 Å²	133	92.7 Å²	92.7	82%	0.816	53%	0.526	S	S	*	.	S	Bend	trans	-96.1	9.1	176.9	42.5	0	0	0	0	113.3
95	S	48.9	Very low	61.1	Low	66 Å²	66	88.6 Å²	88.6	46%	0.462	51%	0.514	S	S	.	.	S	Bend	trans	-120.4	5.6	179.1	72.9	0	0	0	0	114.5	A97 D99	S95-A97 PolarHBondContact O-N 3.38Å; S95-D99 WeakPolarHBondContact CB-OD2 3.25Å; S95-D99 WeakPolarHBondContact O-CB 3.31Å; S95-D99 PolarHBondContact O-N 2.95Å; S95-D99 VanDerWaalsContact O-OD2 3.08Å; S95-D99 PolarHBondContact OG-OD2 3.04Å
96	S	58.1	Low	62.9	Low	28 Å²	28	88.6 Å²	88.6	20%	0.196	51%	0.506	C	S	.	.	H	α-helix	trans	-67.9	-41.7	-158.3	41	0	0	0	0	118.2	I93 A100	I93-S96 VanDerWaalsContact CG2-CB 3.45Å; S96-A100 WeakPolarHBondContact O-CB 3.31Å; S96-A100 PolarHBondContact O-N 3.07Å; S96-A100 VanDerWaalsContact O-N 3.11Å
97	A	67.1	Low	65.1	Low	54 Å²	54	83.6 Å²	83.6	45%	0.446	48%	0.476	S	S	.	.	H	α-helix	trans	-78.1	-44.2	-171.8	0	0	0	0	0	112.8	S95 V101	S95-A97 PolarHBondContact O-N 3.38Å; A97-V101 WeakPolarHBondContact O-CG2 3.4Å; A97-V101 PolarHBondContact O-N 2.64Å
98	S	73.2	Confident	67.2	Low	93 Å²	93	80 Å²	80	65%	0.65	46%	0.455	S	S	*	.	H	α-helix	trans	-68.2	-41.5	177.7	-174.6	0	0	0	0	111.2	V101 A102	S98-V101 PolarHBondContact O-N 3.01Å; S98-A102 PolarHBondContact O-N 3.22Å
99	D	77.9	Confident	69	Low	85 Å²	85	73.8 Å²	73.8	46%	0.455	43%	0.431	S	S	.	.	H	α-helix	trans	-66.9	-37.9	179.5	-66	-3.2	0	0	0	111.5	S95 V101 A102 A103	S95-D99 WeakPolarHBondContact CB-OD2 3.25Å; S95-D99 WeakPolarHBondContact O-CB 3.31Å; S95-D99 PolarHBondContact O-N 2.95Å; S95-D99 VanDerWaalsContact O-OD2 3.08Å; S95-D99 PolarHBondContact OG-OD2 3.04Å; D99-V101 PolarHBondContact O-N 3.19Å; D99-A102 PolarHBondContact O-N 3.39Å; D99-A103 VanDerWaalsContact O-CB 3.25Å; D99-A103 WeakPolarHBondContact O-CB 3.32Å; D99-A103 PolarHBondContact O-N 3.14Å
100	A	78.1	Confident	71.1	Confident	3 Å²	3	66.7 Å²	66.7	3%	0.025	39%	0.393	C	S	.	.	H	α-helix	trans	-63.1	-41.1	175.5	0	0	0	0	0	112.2	H82 S96 F104	H82-A100 HydrophobicContact CB-CB 3.97Å; H82-A100 VanDerWaalsContact CD2-CB 3.43Å; H82-A100 WeakPolarHBondContact CD2-CB 3.5Å; S96-A100 WeakPolarHBondContact O-CB 3.31Å; S96-A100 PolarHBondContact O-N 3.07Å; S96-A100 VanDerWaalsContact O-N 3.11Å; A100-F104 VanDerWaalsContact O-CB 3.25Å; A100-F104 WeakPolarHBondContact O-CB 3.33Å; A100-F104 PolarHBondContact O-N 3.4Å
101	V	82.3	Confident	73.4	Confident	84 Å²	84	66.8 Å²	66.8	51%	0.509	39%	0.389	S	S	.	.	H	α-helix	trans	-63.7	-45.6	175.5	173.5	0	0	0	0	110.9	P79 A97 S98 D99 F104 G105	P79-V101 HydrophobicContact CB-CG2 3.93Å; A97-V101 WeakPolarHBondContact O-CG2 3.4Å; A97-V101 PolarHBondContact O-N 2.64Å; S98-V101 PolarHBondContact O-N 3.01Å; D99-V101 PolarHBondContact O-N 3.19Å; V101-F104 PolarHBondContact O-N 2.94Å; V101-G105 PolarHBondContact O-N 3.04Å
102	A	83.2	Confident	75.7	Confident	53 Å²	53	60.2 Å²	60.2	44%	0.438	37%	0.367	S	S	.	.	H	α-helix	trans	-63.6	-46	178.3	0	0	0	0	0	112	S98 D99 G105 Q106	S98-A102 PolarHBondContact O-N 3.22Å; D99-A102 PolarHBondContact O-N 3.39Å; A102-G105 PolarHBondContact O-N 2.92Å; A102-Q106 WeakPolarHBondContact O-CG 3.26Å; A102-Q106 PolarHBondContact O-N 2.95Å
103	A	84.7	Confident	77.9	Confident	21 Å²	21	51.7 Å²	51.7	17%	0.174	33%	0.331	C	S	.	.	H	α-helix	trans	-62	-44.7	177.1	0	0	0	0	0	111.7	F77 D99 G105 Q106 I107	F77-A103 HydrophobicContact CD1-CB 3.79Å; F77-A103 HydrophobicContact CE1-CB 4.12Å; F77-A103 HydrophobicContact CG-CB 4.14Å; D99-A103 VanDerWaalsContact O-CB 3.25Å; D99-A103 WeakPolarHBondContact O-CB 3.32Å; D99-A103 PolarHBondContact O-N 3.14Å; A103-G105 VanDerWaalsContact C-N 3.29Å; A103-G105 PolarHBondContact O-N 2.8Å; A103-Q106 PolarHBondContact O-N 2.97Å; A103-I107 WeakPolarHBondContact O-CD1 3.32Å; A103-I107 VanDerWaalsContact O-CG1 3.26Å; A103-I107 WeakPolarHBondContact O-CG1 3.41Å; A103-I107 PolarHBondContact O-N 3.24Å
104	F	88	Confident	80.1	Confident	55 Å²	55	47.7 Å²	47.7	24%	0.241	31%	0.31	C	S	.	.	H	α-helix	trans	-59.6	-41.3	175.6	-176.5	-97.6	0	0	0	111.8	F77 A100 V101 I107 A108	F77-F104 HydrophobicContact CB-CB 4.39Å; A100-F104 VanDerWaalsContact O-CB 3.25Å; A100-F104 WeakPolarHBondContact O-CB 3.33Å; A100-F104 PolarHBondContact O-N 3.4Å; V101-F104 PolarHBondContact O-N 2.94Å; F104-I107 PolarHBondContact O-N 3.45Å; F104-A108 WeakPolarHBondContact O-CB 3.38Å; F104-A108 PolarHBondContact O-N 3.41Å
105	G	86.3	Confident	82.5	Confident	38 Å²	38	44 Å²	44	39%	0.392	29%	0.29	S	S	.	.	H	α-helix	trans	-57.6	-47.8	173.7	0	0	0	0	0	112.7	V101 A102 A103 A108 S109	V101-G105 PolarHBondContact O-N 3.04Å; A102-G105 PolarHBondContact O-N 2.92Å; A103-G105 VanDerWaalsContact C-N 3.29Å; A103-G105 PolarHBondContact O-N 2.8Å; G105-A108 PolarHBondContact O-N 3.14Å; G105-S109 PolarHBondContact O-N 2.9Å; G105-S109 PolarHBondContact O-OG 2.95Å
106	Q	87.8	Confident	84.3	Confident	71 Å²	71	43.4 Å²	43.4	33%	0.332	28%	0.282	S	S	.	.	H	α-helix	trans	-63.5	-43.2	178.2	-68.5	175.7	2.4	0	0	112.5	V54 A102 A103 S109 A110	V54-Q106 HydrophobicContact CG1-CB 4.22Å; A102-Q106 WeakPolarHBondContact O-CG 3.26Å; A102-Q106 PolarHBondContact O-N 2.95Å; A103-Q106 PolarHBondContact O-N 2.97Å; Q106-S109 WeakPolarHBondContact CA-OG 3.4Å; Q106-S109 PolarHBondContact O-N 2.74Å; Q106-S109 PolarHBondContact O-OG 3.39Å; Q106-A110 WeakPolarHBondContact O-CB 3.36Å; Q106-A110 PolarHBondContact O-N 3.39Å
107	I	91.1	Very high	85.8	Confident	6 Å²	6	47 Å²	47	3%	0.031	30%	0.304	C	S	.	.	H	α-helix	trans	-62.3	-44.4	177.8	-69.9	157.6	0	0	0	110.8	V54 L55 Y70 L73 F77 A103 F104 A110 Y111	V54-I107 HydrophobicContact CG1-CG1 3.97Å; L55-I107 HydrophobicContact CD2-CG2 4.06Å; Y70-I107 HydrophobicContact CD2-CG2 3.62Å; Y70-I107 HydrophobicContact CE2-CG2 3.94Å; L73-I107 HydrophobicContact CB-CD1 3.79Å; L73-I107 HydrophobicContact CB-CG1 4.25Å; L73-I107 HydrophobicContact CB-CG2 3.87Å; L73-I107 HydrophobicContact CD1-CD1 4.47Å; L73-I107 HydrophobicContact CD1-CG1 4.25Å; L73-I107 HydrophobicContact CD1-CG2 4.36Å; F77-I107 HydrophobicContact CB-CD1 4.21Å; F77-I107 HydrophobicContact CD2-CD1 3.46Å; F77-I107 VanDerWaalsContact CD2-CD1 3.46Å; F77-I107 HydrophobicContact CE2-CD1 4.1Å; F77-I107 HydrophobicContact CG-CD1 4.04Å; A103-I107 WeakPolarHBondContact O-CD1 3.32Å; A103-I107 VanDerWaalsContact O-CG1 3.26Å; A103-I107 WeakPolarHBondContact O-CG1 3.41Å; A103-I107 PolarHBondContact O-N 3.24Å; F104-I107 PolarHBondContact O-N 3.45Å; I107-A110 PolarHBondContact O-N 3.4Å; I107-Y111 PolarHBondContact O-N 3.08Å
108	A	89.8	Confident	86.7	Confident	30 Å²	30	47.2 Å²	47.2	25%	0.248	30%	0.296	C	S	.	.	H	α-helix	trans	-64.5	-42.9	177.4	0	0	0	0	0	112.1	Y70 F104 G105 A112	Y70-A108 HydrophobicContact CE2-CB 4.29Å; F104-A108 WeakPolarHBondContact O-CB 3.38Å; F104-A108 PolarHBondContact O-N 3.41Å; G105-A108 PolarHBondContact O-N 3.14Å; A108-A112 WeakPolarHBondContact O-CB 3.45Å; A108-A112 PolarHBondContact O-N 2.88Å
109	S	88.3	Confident	87.3	Confident	48 Å²	48	46.1 Å²	46.1	34%	0.336	28%	0.281	S	S	.	.	H	α-helix	trans	-64.5	-42.2	176	55.6	0	0	0	0	112.5	G105 Q106 A112 I113	G105-S109 PolarHBondContact O-N 2.9Å; G105-S109 PolarHBondContact O-OG 2.95Å; Q106-S109 WeakPolarHBondContact CA-OG 3.4Å; Q106-S109 PolarHBondContact O-N 2.74Å; Q106-S109 PolarHBondContact O-OG 3.39Å; S109-A112 PolarHBondContact O-N 3.16Å; S109-I113 WeakPolarHBondContact O-CD1 3.11Å; S109-I113 WeakPolarHBondContact O-CG1 3.38Å; S109-I113 PolarHBondContact O-N 3.24Å; S109-I113 VanDerWaalsContact O-N 3.1Å
110	A	90.6	Very high	87.9	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.4	-44.8	179.4	0	0	0	0	0	111.7	L51 V54 L55 Q106 I107 I113 L114	L51-A110 HydrophobicContact CB-CB 4.19Å; L51-A110 HydrophobicContact CD2-CB 4Å; V54-A110 HydrophobicContact CB-CB 4.09Å; V54-A110 HydrophobicContact CG1-CB 4.08Å; L55-A110 HydrophobicContact CD1-CB 4.4Å; L55-A110 HydrophobicContact CD2-CB 4.42Å; L55-A110 HydrophobicContact CG-CB 4.07Å; Q106-A110 WeakPolarHBondContact O-CB 3.36Å; Q106-A110 PolarHBondContact O-N 3.39Å; I107-A110 PolarHBondContact O-N 3.4Å; A110-I113 PolarHBondContact O-N 3.3Å; A110-L114 WeakPolarHBondContact O-CB 3.41Å; A110-L114 WeakPolarHBondContact O-CG 3.46Å; A110-L114 PolarHBondContact O-N 3.04Å
111	Y	92.2	Very high	88.4	Confident	58 Å²	58	45.9 Å²	45.9	23%	0.227	28%	0.281	C	S	.	.	H	α-helix	trans	-63.9	-43.2	175.4	175.4	-103.1	0	0	0	112.1	R67 Y70 I107 I113 L114 S115	R67-Y111 HydrophobicContact CB-CE2 4.4Å; R67-Y111 HydrophobicContact CG-CE2 3.69Å; R67-Y111 VanDerWaalsContact CG-OH 3.26Å; R67-Y111 WeakPolarHBondContact CG-OH 3.49Å; Y70-Y111 AromaticContact CD1-CD1 3.88Å; Y70-Y111 HydrophobicContact CD1-CD1 3.88Å; Y70-Y111 HydrophobicContact CD1-CD2 4.31Å; Y70-Y111 HydrophobicContact CD1-CE1 4.14Å; Y70-Y111 AromaticContact CD1-CG 3.98Å; Y70-Y111 HydrophobicContact CD1-CG 3.98Å; Y70-Y111 VanDerWaalsContact CD2-CB 3.45Å; Y70-Y111 HydrophobicContact CD2-CD1 4.12Å; Y70-Y111 HydrophobicContact CD2-CD2 4.45Å; Y70-Y111 AromaticContact CD2-CG 3.75Å; Y70-Y111 HydrophobicContact CD2-CG 3.75Å; Y70-Y111 HydrophobicContact CE1-CD1 4.12Å; Y70-Y111 HydrophobicContact CE1-CE1 4.4Å; Y70-Y111 HydrophobicContact CE2-CD1 4.37Å; Y70-Y111 HydrophobicContact CE2-CG 4.41Å; Y70-Y111 AromaticContact CG-CD1 3.88Å; Y70-Y111 HydrophobicContact CG-CD1 3.88Å; Y70-Y111 AromaticContact CG-CD2 3.85Å; Y70-Y111 HydrophobicContact CG-CD2 3.85Å; Y70-Y111 HydrophobicContact CG-CE2 4.48Å; Y70-Y111 AromaticContact CG-CG 3.52Å; Y70-Y111 HydrophobicContact CG-CG 3.52Å; I107-Y111 PolarHBondContact O-N 3.08Å; Y111-I113 VanDerWaalsContact C-N 3.34Å; Y111-I113 PolarHBondContact O-N 3.24Å; Y111-L114 PolarHBondContact O-N 2.83Å; Y111-S115 WeakPolarHBondContact O-CB 3.33Å; Y111-S115 PolarHBondContact O-N 2.89Å; Y111-S115 PolarHBondContact O-OG 2.93Å
112	A	91	Very high	88.6	Confident	50 Å²	50	42.5 Å²	42.5	41%	0.413	26%	0.26	S	S	.	.	H	α-helix	trans	-57	-47.4	178.6	0	0	0	0	0	111.8	A108 S109 S115	A108-A112 WeakPolarHBondContact O-CB 3.45Å; A108-A112 PolarHBondContact O-N 2.88Å; S109-A112 PolarHBondContact O-N 3.16Å; A112-S115 PolarHBondContact O-OG 2.75Å
113	I	90.6	Very high	88.9	Confident	22 Å²	22	41.2 Å²	41.2	11%	0.113	24%	0.244	C	C	.	.	H	α-helix	trans	-67.1	-51.3	179.8	-65.6	162.3	0	0	0	111.6	L51 S109 A110 Y111 S115 N116 Q119 Y128 L131	L51-I113 HydrophobicContact CD1-CB 3.92Å; L51-I113 HydrophobicContact CD1-CD1 3.8Å; L51-I113 HydrophobicContact CD1-CG1 4.47Å; L51-I113 HydrophobicContact CD1-CG2 3.54Å; L51-I113 HydrophobicContact CD2-CD1 4.39Å; S109-I113 WeakPolarHBondContact O-CD1 3.11Å; S109-I113 WeakPolarHBondContact O-CG1 3.38Å; S109-I113 PolarHBondContact O-N 3.24Å; S109-I113 VanDerWaalsContact O-N 3.1Å; A110-I113 PolarHBondContact O-N 3.3Å; Y111-I113 VanDerWaalsContact C-N 3.34Å; Y111-I113 PolarHBondContact O-N 3.24Å; I113-S115 VanDerWaalsContact C-N 3.3Å; I113-S115 PolarHBondContact O-N 3.44Å; I113-N116 PolarHBondContact O-N 2.99Å; I113-Q119 HydrophobicContact CG2-CB 4.2Å; I113-Q119 WeakPolarHBondContact O-CB 3.02Å; I113-Y128 HydrophobicContact CD1-CE2 4.11Å; I113-L131 HydrophobicContact CB-CD1 4.46Å; I113-L131 HydrophobicContact CD1-CD1 3.87Å; I113-L131 HydrophobicContact CG1-CD1 4.18Å; I113-L131 HydrophobicContact CG2-CD1 3.44Å; I113-L131 VanDerWaalsContact CG2-CD1 3.44Å; I113-L131 HydrophobicContact CG2-CD2 4.25Å
114	L	92.4	Very high	89.2	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-73.7	-21.9	-174.6	-66.3	176.4	0	0	0	113.2	L51 Y52 L55 L66 A110 Y111 R120 Y123	L51-L114 HydrophobicContact CB-CD1 3.88Å; L51-L114 HydrophobicContact CB-CD2 4.42Å; L51-L114 HydrophobicContact CB-CG 4.15Å; L51-L114 HydrophobicContact CD1-CG 4.48Å; Y52-L114 HydrophobicContact CD1-CD1 3.86Å; Y52-L114 HydrophobicContact CD1-CD2 4.35Å; Y52-L114 HydrophobicContact CE1-CD1 3.97Å; Y52-L114 HydrophobicContact CE1-CD2 3.73Å; Y52-L114 HydrophobicContact CE1-CG 4.46Å; Y52-L114 HydrophobicContact CE2-CD2 4.02Å; Y52-L114 HydrophobicContact CG-CD1 4.32Å; L55-L114 HydrophobicContact CD1-CD1 3.9Å; L66-L114 HydrophobicContact CD1-CB 3.92Å; L66-L114 WeakPolarHBondContact CD1-O 2.96Å; L66-L114 HydrophobicContact CD2-CB 4.26Å; L66-L114 HydrophobicContact CD2-CD1 4.14Å; A110-L114 WeakPolarHBondContact O-CB 3.41Å; A110-L114 WeakPolarHBondContact O-CG 3.46Å; A110-L114 PolarHBondContact O-N 3.04Å; Y111-L114 PolarHBondContact O-N 2.83Å; L114-R120 HydrophobicContact CD2-CG 4.15Å; L114-Y123 HydrophobicContact CD2-CD1 4.05Å; L114-Y123 HydrophobicContact CD2-CE1 4.47Å
115	S	90.1	Very high	89.1	Confident	56 Å²	56	44.5 Å²	44.5	39%	0.392	27%	0.266	S	S	.	.	H	α-helix	trans	-71.9	-29.3	176.2	70.7	0	0	0	0	112.9	Y111 A112 I113	Y111-S115 WeakPolarHBondContact O-CB 3.33Å; Y111-S115 PolarHBondContact O-N 2.89Å; Y111-S115 PolarHBondContact O-OG 2.93Å; A112-S115 PolarHBondContact O-OG 2.75Å; I113-S115 VanDerWaalsContact C-N 3.3Å; I113-S115 PolarHBondContact O-N 3.44Å
116	N	88.2	Confident	89	Confident	54 Å²	54	44.9 Å²	44.9	29%	0.289	26%	0.257	S	S	.	.	S	Bend	trans	-87.1	119.5	177	-177.3	-21	0	0	0	109.7	I113 E118 Q119 R120	I113-N116 PolarHBondContact O-N 2.99Å; N116-E118 VanDerWaalsContact C-N 3.25Å; N116-E118 PolarHBondContact O-N 2.76Å; N116-E118 PolarHBondContact OD1-N 2.85Å; N116-E118 VanDerWaalsContact OD1-N 3.07Å; N116-Q119 HydrophobicContact CB-CB 4.1Å; N116-Q119 HydrophobicContact CB-CG 4.15Å; N116-Q119 PolarHBondContact O-N 3.39Å; N116-R120 WeakPolarHBondContact O-CB 3.27Å; N116-R120 PolarHBondContact O-N 3.23Å
117	P	88.8	Confident	89	Confident	102 Å²	102	42.7 Å²	42.7	66%	0.662	25%	0.254	S	S	*	.	H	α-helix	trans	-60.6	-32.5	-176	25	-35	0	0	0	113.4	A121	P117-A121 WeakPolarHBondContact O-CB 3.46Å; P117-A121 PolarHBondContact O-N 2.94Å
118	E	85.2	Confident	88.7	Confident	60 Å²	60	46 Å²	46	28%	0.28	27%	0.267	S	S	.	.	H	α-helix	trans	-73.6	-45.1	179.8	-62.3	-175.7	-175.2	0	0	111.6	N116 R120 A121 I122 I138	N116-E118 VanDerWaalsContact C-N 3.25Å; N116-E118 PolarHBondContact O-N 2.76Å; N116-E118 PolarHBondContact OD1-N 2.85Å; N116-E118 VanDerWaalsContact OD1-N 3.07Å; E118-R120 VanDerWaalsContact C-N 3.33Å; E118-A121 PolarHBondContact O-N 2.91Å; E118-I122 WeakPolarHBondContact O-CG1 3.29Å; E118-I122 PolarHBondContact O-N 2.77Å; E118-I138 WeakPolarHBondContact OE2-CG2 3.29Å
119	Q	86.7	Confident	88.4	Confident	69 Å²	69	48.5 Å²	48.5	32%	0.322	27%	0.272	S	S	.	.	H	α-helix	trans	-66.7	-37.9	176.9	-66.3	-177.3	-14.4	0	0	111.1	I113 N116 I122 Y123 L131	I113-Q119 HydrophobicContact CG2-CB 4.2Å; I113-Q119 WeakPolarHBondContact O-CB 3.02Å; N116-Q119 HydrophobicContact CB-CB 4.1Å; N116-Q119 HydrophobicContact CB-CG 4.15Å; N116-Q119 PolarHBondContact O-N 3.39Å; Q119-I122 PolarHBondContact O-N 2.94Å; Q119-Y123 WeakPolarHBondContact O-CB 3.34Å; Q119-Y123 PolarHBondContact O-N 3.45Å; Q119-L131 HydrophobicContact CB-CD2 3.97Å; Q119-L131 HydrophobicContact CG-CD2 4.37Å
120	R	91.1	Very high	88.1	Confident	44 Å²	44	46.2 Å²	46.2	17%	0.166	26%	0.256	C	S	.	.	H	α-helix	trans	-60	-45.6	171.4	-176	175	-179.7	173.4	-0.4	111.6	Y52 K59 A61 L114 N116 E118 I122 Y123 D124	Y52-R120 PolarHBondContact OH-NE 3.47Å; K59-R120 PolarHBondContact O-NH2 3.21Å; A61-R120 PolarHBondContact O-NH1 2.99Å; A61-R120 PolarHBondContact O-NH2 2.87Å; L114-R120 HydrophobicContact CD2-CG 4.15Å; N116-R120 WeakPolarHBondContact O-CB 3.27Å; N116-R120 PolarHBondContact O-N 3.23Å; E118-R120 VanDerWaalsContact C-N 3.33Å; R120-I122 PolarHBondContact O-N 3.17Å; R120-Y123 PolarHBondContact O-N 3.44Å; R120-D124 IonicContact NE-OD2 3.94Å; R120-D124 WeakPolarHBondContact O-CB 3.45Å; R120-D124 PolarHBondContact O-N 2.84Å
121	A	88.3	Confident	87.7	Confident	39 Å²	39	48.1 Å²	48.1	32%	0.322	27%	0.266	S	S	.	.	H	α-helix	trans	-60.9	-43.2	176.8	0	0	0	0	0	112.2	P117 E118 D124 S125	P117-A121 WeakPolarHBondContact O-CB 3.46Å; P117-A121 PolarHBondContact O-N 2.94Å; E118-A121 PolarHBondContact O-N 2.91Å; A121-D124 PolarHBondContact O-N 3.39Å; A121-S125 WeakPolarHBondContact O-CB 3.22Å; A121-S125 PolarHBondContact O-N 3.12Å; A121-S125 PolarHBondContact O-OG 3.44Å
122	I	86.5	Confident	87.2	Confident	14 Å²	14	50.6 Å²	50.6	7%	0.072	28%	0.279	C	S	.	.	H	α-helix	trans	-63	-42.6	175.9	-67	163.8	0	0	0	111	E118 Q119 R120 S125 F126 L131 W136	E118-I122 WeakPolarHBondContact O-CG1 3.29Å; E118-I122 PolarHBondContact O-N 2.77Å; Q119-I122 PolarHBondContact O-N 2.94Å; R120-I122 PolarHBondContact O-N 3.17Å; I122-S125 PolarHBondContact O-N 3.33Å; I122-S125 PolarHBondContact O-OG 3.43Å; I122-S125 VanDerWaalsContact O-OG 3.13Å; I122-F126 HydrophobicContact CG2-CD2 4.32Å; I122-F126 PolarHBondContact O-N 2.8Å; I122-L131 HydrophobicContact CB-CD2 4.15Å; I122-L131 HydrophobicContact CG2-CD2 3.92Å; I122-L131 HydrophobicContact CG2-CG 4.33Å; I122-W136 HydrophobicContact CD1-CD2 3.76Å; I122-W136 HydrophobicContact CD1-CE3 4.12Å; I122-W136 HydrophobicContact CD1-CG 4.05Å; I122-W136 HydrophobicContact CD1-CZ2 4.23Å; I122-W136 HydrophobicContact CG1-CD2 4.43Å; I122-W136 HydrophobicContact CG1-CH2 4.2Å; I122-W136 HydrophobicContact CG1-CZ2 4.12Å; I122-W136 HydrophobicContact CG1-CZ3 4.4Å; I122-W136 HydrophobicContact CG2-CH2 4.5Å; I122-W136 HydrophobicContact CG2-CZ2 3.81Å
123	Y	90.1	Very high	86.5	Confident	25 Å²	25	49.9 Å²	49.9	10%	0.098	27%	0.268	C	S	.	.	H	α-helix	trans	-65.1	-44.5	177.7	-179.8	-103.2	0	0	0	111.9	D50 L51 Y52 L114 Q119 R120 S125 G127 L131	D50-Y123 WeakPolarHBondContact CA-OH 3.44Å; D50-Y123 PolarHBondContact OD1-OH 3.13Å; L51-Y123 HydrophobicContact CB-CE1 4.02Å; L51-Y123 HydrophobicContact CB-CE2 4.31Å; L51-Y123 HydrophobicContact CD1-CD1 4.17Å; L51-Y123 HydrophobicContact CD1-CD2 3.53Å; L51-Y123 HydrophobicContact CD1-CE1 4.11Å; L51-Y123 HydrophobicContact CD1-CE2 3.47Å; L51-Y123 VanDerWaalsContact CD1-CE2 3.47Å; L51-Y123 HydrophobicContact CD1-CG 3.89Å; L51-Y123 HydrophobicContact CG-CD2 4.17Å; L51-Y123 HydrophobicContact CG-CE1 4.16Å; L51-Y123 HydrophobicContact CG-CE2 3.56Å; L51-Y123 PolarHBondContact N-OH 3.49Å; Y52-Y123 HydrophobicContact CD2-CD1 4.44Å; Y52-Y123 AromaticContact CD2-CE1 3.73Å; Y52-Y123 HydrophobicContact CD2-CE1 3.73Å; Y52-Y123 AromaticContact CE2-CD1 3.83Å; Y52-Y123 HydrophobicContact CE2-CD1 3.83Å; Y52-Y123 AromaticContact CE2-CE1 3.56Å; Y52-Y123 HydrophobicContact CE2-CE1 3.56Å; L114-Y123 HydrophobicContact CD2-CD1 4.05Å; L114-Y123 HydrophobicContact CD2-CE1 4.47Å; Q119-Y123 WeakPolarHBondContact O-CB 3.34Å; Q119-Y123 PolarHBondContact O-N 3.45Å; R120-Y123 PolarHBondContact O-N 3.44Å; Y123-S125 VanDerWaalsContact C-N 3.26Å; Y123-S125 PolarHBondContact O-N 3.33Å; Y123-G127 WeakPolarHBondContact O-CA 3.24Å; Y123-G127 PolarHBondContact O-N 3.33Å; Y123-L131 HydrophobicContact CD2-CD1 3.95Å; Y123-L131 HydrophobicContact CG-CD1 4.48Å
124	D	90.9	Very high	85.5	Confident	87 Å²	87	57.5 Å²	57.5	47%	0.465	30%	0.303	S	S	.	.	H	α-helix	trans	-65.3	-31.4	179.1	-69.1	-19	0	0	0	111.6	Y52 R120 A121	Y52-D124 VanDerWaalsContact CE2-OD1 3.28Å; Y52-D124 WeakPolarHBondContact CE2-OD1 3.4Å; Y52-D124 PolarHBondContact OH-OD1 3.11Å; Y52-D124 PolarHBondContact OH-OD2 3.25Å; R120-D124 IonicContact NE-OD2 3.94Å; R120-D124 WeakPolarHBondContact O-CB 3.45Å; R120-D124 PolarHBondContact O-N 2.84Å; A121-D124 PolarHBondContact O-N 3.39Å
125	S	85.7	Confident	84.4	Confident	59 Å²	59	59.9 Å²	59.9	41%	0.413	33%	0.328	S	S	.	.	H	α-helix	trans	-88.7	-36.8	179.3	61.3	0	0	0	0	115.1	A121 I122 Y123	A121-S125 WeakPolarHBondContact O-CB 3.22Å; A121-S125 PolarHBondContact O-N 3.12Å; A121-S125 PolarHBondContact O-OG 3.44Å; I122-S125 PolarHBondContact O-N 3.33Å; I122-S125 PolarHBondContact O-OG 3.43Å; I122-S125 VanDerWaalsContact O-OG 3.13Å; Y123-S125 VanDerWaalsContact C-N 3.26Å; Y123-S125 PolarHBondContact O-N 3.33Å
126	F	83.6	Confident	83.4	Confident	45 Å²	45	59 Å²	59	20%	0.197	32%	0.316	C	S	.	.	H	α-helix	trans	-128.5	-0.9	-170.6	-54.3	-65.2	0	0	0	114.6	I122 W136 L148 R149 Y152	I122-F126 HydrophobicContact CG2-CD2 4.32Å; I122-F126 PolarHBondContact O-N 2.8Å; F126-W136 HydrophobicContact CD2-CH2 4.18Å; F126-W136 HydrophobicContact CD2-CZ2 4.36Å; F126-W136 AromaticContact CE2-CH2 3.9Å; F126-W136 HydrophobicContact CE2-CH2 3.9Å; F126-L148 HydrophobicContact CE2-CB 4.28Å; F126-R149 HydrophobicContact CZ-CB 4.28Å; F126-Y152 HydrophobicContact CB-CE2 4.46Å; F126-Y152 AromaticContact CD1-CD1 3.73Å; F126-Y152 HydrophobicContact CD1-CD1 3.73Å; F126-Y152 HydrophobicContact CD1-CD2 4.24Å; F126-Y152 AromaticContact CD1-CE1 3.95Å; F126-Y152 HydrophobicContact CD1-CE1 3.95Å; F126-Y152 HydrophobicContact CD1-CE2 4.46Å; F126-Y152 AromaticContact CD1-CG 3.87Å; F126-Y152 HydrophobicContact CD1-CG 3.87Å; F126-Y152 HydrophobicContact CD2-CD2 4.23Å; F126-Y152 HydrophobicContact CD2-CG 4.23Å; F126-Y152 AromaticContact CE1-CD1 3.64Å; F126-Y152 HydrophobicContact CE1-CD1 3.64Å; F126-Y152 HydrophobicContact CE1-CE1 4.27Å; F126-Y152 AromaticContact CE1-CG 3.8Å; F126-Y152 HydrophobicContact CE1-CG 3.8Å; F126-Y152 HydrophobicContact CE2-CG 4.18Å; F126-Y152 HydrophobicContact CG-CD1 4.39Å; F126-Y152 HydrophobicContact CG-CD2 4.09Å; F126-Y152 HydrophobicContact CG-CE2 4.35Å; F126-Y152 HydrophobicContact CG-CG 4.12Å; F126-Y152 HydrophobicContact CZ-CD1 4.25Å; F126-Y152 AromaticContact CZ-CG 4Å; F126-Y152 HydrophobicContact CZ-CG 4Å
127	G	87.8	Confident	82.1	Confident	26 Å²	26	63 Å²	63	27%	0.268	33%	0.333	S	S	.	.	H	α-helix	trans	66.1	-160.4	-175.6	0	0	0	0	0	113.5	Y123 K129 G130	Y123-G127 WeakPolarHBondContact O-CA 3.24Å; Y123-G127 PolarHBondContact O-N 3.33Å; G127-K129 VanDerWaalsContact C-N 3.25Å; G127-K129 PolarHBondContact O-N 3.22Å; G127-G130 PolarHBondContact O-N 3.09Å
128	Y	85.1	Confident	80.5	Confident	76 Å²	76	64 Å²	64	30%	0.298	33%	0.332	S	S	.	.	H	α-helix	trans	-63.7	-30.8	-177.8	-157.7	-100.4	0	0	0	112.8	I113 G130 L131 Q132	I113-Y128 HydrophobicContact CD1-CE2 4.11Å; Y128-G130 VanDerWaalsContact C-N 3.26Å; Y128-G130 PolarHBondContact O-N 2.89Å; Y128-L131 HydrophobicContact CD2-CD1 4.38Å; Y128-L131 PolarHBondContact O-N 2.94Å; Y128-L131 VanDerWaalsContact O-N 3.16Å; Y128-Q132 HydrophobicContact CD1-CG 4.25Å; Y128-Q132 VanDerWaalsContact CD1-NE2 3.27Å; Y128-Q132 HydrophobicContact CE1-CG 4.21Å; Y128-Q132 VanDerWaalsContact CE1-NE2 3.32Å; Y128-Q132 PolarHBondContact O-N 3.1Å
129	K	82.4	Confident	78.9	Confident	81 Å²	81	64.7 Å²	64.7	35%	0.352	34%	0.34	S	S	.	.	H	α-helix	trans	-59.1	-34.6	176.6	-65.6	-171.6	178.1	-172.6	0	112.2	E39 E47 G127	E39-K129 IonicContact OE2-NZ 3.69Å; E47-K129 WeakPolarHBondContact OE2-CE 3.32Å; E47-K129 IonicContact OE2-NZ 3.26Å; G127-K129 VanDerWaalsContact C-N 3.25Å; G127-K129 PolarHBondContact O-N 3.22Å
130	G	82.4	Confident	77.3	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-68.8	-32.8	177.7	0	0	0	0	0	114.1	G127 Y128 W136	G127-G130 PolarHBondContact O-N 3.09Å; Y128-G130 VanDerWaalsContact C-N 3.26Å; Y128-G130 PolarHBondContact O-N 2.89Å; G130-W136 PolarHBondContact O-NE1 2.98Å
131	L	83.7	Confident	75.8	Confident	40 Å²	40	68.2 Å²	68.2	21%	0.209	38%	0.379	C	S	.	.	H	α-helix	trans	-76	-26.7	-178.5	-64.4	170.8	0	0	0	113.1	I113 Q119 I122 Y123 Y128 M133	I113-L131 HydrophobicContact CB-CD1 4.46Å; I113-L131 HydrophobicContact CD1-CD1 3.87Å; I113-L131 HydrophobicContact CG1-CD1 4.18Å; I113-L131 HydrophobicContact CG2-CD1 3.44Å; I113-L131 VanDerWaalsContact CG2-CD1 3.44Å; I113-L131 HydrophobicContact CG2-CD2 4.25Å; Q119-L131 HydrophobicContact CB-CD2 3.97Å; Q119-L131 HydrophobicContact CG-CD2 4.37Å; I122-L131 HydrophobicContact CB-CD2 4.15Å; I122-L131 HydrophobicContact CG2-CD2 3.92Å; I122-L131 HydrophobicContact CG2-CG 4.33Å; Y123-L131 HydrophobicContact CD2-CD1 3.95Å; Y123-L131 HydrophobicContact CG-CD1 4.48Å; Y128-L131 HydrophobicContact CD2-CD1 4.38Å; Y128-L131 PolarHBondContact O-N 2.94Å; Y128-L131 VanDerWaalsContact O-N 3.16Å; L131-M133 VanDerWaalsContact C-N 3.26Å; L131-M133 PolarHBondContact O-N 2.99Å
132	Q	81.6	Confident	74.5	Confident	110 Å²	110	75.6 Å²	75.6	51%	0.514	41%	0.407	S	S	.	.	H	α-helix	trans	-73.9	-19	177.9	-65.9	-177.4	10.6	0	0	113	Y128 Q134	Y128-Q132 HydrophobicContact CD1-CG 4.25Å; Y128-Q132 VanDerWaalsContact CD1-NE2 3.27Å; Y128-Q132 HydrophobicContact CE1-CG 4.21Å; Y128-Q132 VanDerWaalsContact CE1-NE2 3.32Å; Y128-Q132 PolarHBondContact O-N 3.1Å; Q132-Q134 PolarHBondContact O-N 3.37Å
133	M	75.3	Confident	73.6	Confident	35 Å²	35	77.6 Å²	77.6	17%	0.172	42%	0.415	C	S	.	.			trans	-70.3	119	-178.8	-68.5	-64.5	-64.8	0	0	111	L131 W136 Y152 L155 K156 A159	L131-M133 VanDerWaalsContact C-N 3.26Å; L131-M133 PolarHBondContact O-N 2.99Å; M133-W136 PolarHBondContact O-NE1 3.33Å; M133-Y152 HydrophobicContact CG-CE2 4.24Å; M133-L155 HydrophobicContact CE-CB 3.84Å; M133-L155 WeakPolarHBondContact CE-O 3.36Å; M133-K156 VanDerWaalsContact CE-CA 3.4Å; M133-K156 HydrophobicContact CE-CB 4.26Å; M133-K156 VanDerWaalsContact CE-N 3.29Å; M133-A159 HydrophobicContact CE-CB 3.59Å; M133-A159 HydrophobicContact SD-CB 4.25Å
134	Q	70.1	Confident	73.1	Confident	183 Å²	183	79.3 Å²	79.3	86%	0.855	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	143.6	174.4	-65.5	-180	-5.7	0	0	111	Q132	Q132-Q134 PolarHBondContact O-N 3.37Å
135	G	68	Low	72.5	Confident	53 Å²	53	78.6 Å²	78.6	55%	0.546	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.9	12.9	169.8	0	0	0	0	0	116.4	Q137	G135-Q137 PolarHBondContact O-N 3.46Å
136	W	69.1	Low	72.4	Confident	37 Å²	37	80 Å²	80	14%	0.14	44%	0.444	C	S	.	.			trans	-53.4	122.8	164.3	-71.1	104	0	0	0	109.8	I122 F126 G130 M133 I138 L148 E151 Y152 L155	I122-W136 HydrophobicContact CD1-CD2 3.76Å; I122-W136 HydrophobicContact CD1-CE3 4.12Å; I122-W136 HydrophobicContact CD1-CG 4.05Å; I122-W136 HydrophobicContact CD1-CZ2 4.23Å; I122-W136 HydrophobicContact CG1-CD2 4.43Å; I122-W136 HydrophobicContact CG1-CH2 4.2Å; I122-W136 HydrophobicContact CG1-CZ2 4.12Å; I122-W136 HydrophobicContact CG1-CZ3 4.4Å; I122-W136 HydrophobicContact CG2-CH2 4.5Å; I122-W136 HydrophobicContact CG2-CZ2 3.81Å; F126-W136 HydrophobicContact CD2-CH2 4.18Å; F126-W136 HydrophobicContact CD2-CZ2 4.36Å; F126-W136 AromaticContact CE2-CH2 3.9Å; F126-W136 HydrophobicContact CE2-CH2 3.9Å; G130-W136 PolarHBondContact O-NE1 2.98Å; M133-W136 PolarHBondContact O-NE1 3.33Å; W136-I138 VanDerWaalsContact C-N 3.35Å; W136-I138 PolarHBondContact O-N 3.39Å; W136-L148 HydrophobicContact CZ3-CD2 3.9Å; W136-E151 HydrophobicContact CE3-CG 4.08Å; W136-E151 HydrophobicContact CZ3-CB 4.2Å; W136-E151 HydrophobicContact CZ3-CG 4.05Å; W136-Y152 HydrophobicContact CZ2-CD2 4.18Å; W136-L155 HydrophobicContact CD2-CD1 3.94Å; W136-L155 HydrophobicContact CE3-CD1 4.22Å; W136-L155 HydrophobicContact CG-CD1 4.16Å
137	Q	61.3	Low	72.3	Confident	138 Å²	138	83.2 Å²	83.2	65%	0.645	46%	0.46	S	S	*	.			trans	-77	93.9	170.7	-67.9	-178.1	7.9	0	0	107.3	G135 T139 K143 E151	G135-Q137 PolarHBondContact O-N 3.46Å; Q137-T139 PolarHBondContact O-N 3.5Å; Q137-K143 PolarHBondContact O-NZ 3.41Å; Q137-E151 PolarHBondContact N-OE1 2.99Å
138	I	54.7	Low	71.6	Confident	122 Å²	122	82.9 Å²	82.9	63%	0.626	45%	0.452	S	S	*	.			trans	-71.1	77.4	174.6	-62.4	164	0	0	0	107.5	E118 W136	E118-I138 WeakPolarHBondContact OE2-CG2 3.29Å; W136-I138 VanDerWaalsContact C-N 3.35Å; W136-I138 PolarHBondContact O-N 3.39Å
139	T	52.6	Low	71.3	Confident	76 Å²	76	87.1 Å²	87.1	47%	0.466	47%	0.468	S	S	.	.			trans	-93.5	133.1	166.7	-59.5	0	0	0	0	106.2	Q137 S141	Q137-T139 PolarHBondContact O-N 3.5Å; T139-S141 PolarHBondContact O-N 2.86Å
140	S	54	Low	71.3	Confident	120 Å²	120	88.6 Å²	88.6	84%	0.839	48%	0.479	S	S	*	.	S	Bend	trans	-62.2	12.1	179.9	64.9	0	0	0	0	115.6
141	S	57.6	Low	71.1	Confident	66 Å²	66	90 Å²	90	46%	0.462	49%	0.485	S	S	.	.	S	Bend	trans	-92.1	123.1	174.3	-172.6	0	0	0	0	108.6	T139 K143	T139-S141 PolarHBondContact O-N 2.86Å; S141-K143 PolarHBondContact O-N 3.39Å
142	Q	61.9	Low	71	Confident	195 Å²	195	89.8 Å²	89.8	91%	0.911	48%	0.482	S	S	*	.			trans	-58.5	103.4	175.1	-63.7	-172.5	-4.2	0	0	109.8
143	K	68.1	Low	71.1	Confident	56 Å²	56	89.1 Å²	89.1	24%	0.243	48%	0.481	C	S	.	.			trans	-74.1	138.5	177.3	-69.9	174	176.9	173.6	0	109.6	Q137 S141 L148 E151	Q137-K143 PolarHBondContact O-NZ 3.41Å; S141-K143 PolarHBondContact O-N 3.39Å; K143-L148 HydrophobicContact CB-CD2 3.73Å; K143-L148 HydrophobicContact CB-CG 3.79Å; K143-L148 HydrophobicContact CD-CD2 3.95Å; K143-L148 HydrophobicContact CG-CD2 4.48Å; K143-E151 WeakPolarHBondContact CD-OE2 3.39Å; K143-E151 WeakPolarHBondContact CE-OE2 3.37Å; K143-E151 VanDerWaalsContact NZ-CD 3.25Å; K143-E151 IonicContact NZ-OE1 2.93Å; K143-E151 PolarHBondContact NZ-OE1 2.63Å; K143-E151 IonicContact NZ-OE2 3.92Å; K143-E151 PolarHBondContact NZ-OE2 3.27Å
144	S	78.5	Confident	71.4	Confident	61 Å²	61	91.4 Å²	91.4	43%	0.427	49%	0.494	S	S	.	.			trans	-68.7	151.9	178.3	-177.1	0	0	0	0	111.1	P146 E147 L148	S144-P146 WeakPolarHBondContact OG-CD 3.34Å; S144-P146 WeakPolarHBondContact OG-CG 3.17Å; S144-E147 PolarHBondContact N-OE2 3.01Å; S144-E147 WeakPolarHBondContact O-CA 3.42Å; S144-E147 WeakPolarHBondContact O-CB 3.47Å; S144-E147 PolarHBondContact O-N 2.76Å; S144-L148 PolarHBondContact O-N 3.26Å
145	A	79.5	Confident	71.8	Confident	71 Å²	71	83.6 Å²	83.6	59%	0.587	46%	0.458	S	S	*	.	H	α-helix	trans	-51.3	-45.6	177.5	0	0	0	0	0	114.4	E147 L148 R149	A145-E147 PolarHBondContact O-N 2.89Å; A145-L148 PolarHBondContact O-N 2.66Å; A145-R149 WeakPolarHBondContact O-CB 3.38Å; A145-R149 PolarHBondContact O-N 3.38Å
146	P	83.5	Confident	72.5	Confident	88 Å²	88	86.6 Å²	86.6	57%	0.571	46%	0.456	S	S	*	.	H	α-helix	trans	-63.1	-33.8	171.6	22.4	-36.6	0	0	0	114.5	S144 R149 L150	S144-P146 WeakPolarHBondContact OG-CD 3.34Å; S144-P146 WeakPolarHBondContact OG-CG 3.17Å; P146-R149 WeakPolarHBondContact O-CB 3.32Å; P146-R149 PolarHBondContact O-N 3.16Å; P146-L150 PolarHBondContact O-N 2.87Å
147	E	80.6	Confident	73.1	Confident	113 Å²	113	90.8 Å²	90.8	53%	0.528	48%	0.477	S	S	.	.	H	α-helix	trans	-70.3	-43.8	177.5	-65.9	175.9	160.2	0	0	110.9	S144 A145 R149 L150 E151	S144-E147 PolarHBondContact N-OE2 3.01Å; S144-E147 WeakPolarHBondContact O-CA 3.42Å; S144-E147 WeakPolarHBondContact O-CB 3.47Å; S144-E147 PolarHBondContact O-N 2.76Å; A145-E147 PolarHBondContact O-N 2.89Å; E147-R149 VanDerWaalsContact C-N 3.26Å; E147-R149 PolarHBondContact O-N 2.6Å; E147-L150 PolarHBondContact O-N 2.92Å; E147-E151 PolarHBondContact O-N 2.87Å
148	L	73.1	Confident	74.1	Confident	20 Å²	20	90.6 Å²	90.6	11%	0.105	47%	0.474	C	S	.	.	H	α-helix	trans	-59.1	-39.4	172.1	-71.6	172.8	0	0	0	111.2	F126 W136 K143 S144 A145 E151 Y152	F126-L148 HydrophobicContact CE2-CB 4.28Å; W136-L148 HydrophobicContact CZ3-CD2 3.9Å; K143-L148 HydrophobicContact CB-CD2 3.73Å; K143-L148 HydrophobicContact CB-CG 3.79Å; K143-L148 HydrophobicContact CD-CD2 3.95Å; K143-L148 HydrophobicContact CG-CD2 4.48Å; S144-L148 PolarHBondContact O-N 3.26Å; A145-L148 PolarHBondContact O-N 2.66Å; L148-E151 PolarHBondContact O-N 3.49Å; L148-Y152 VanDerWaalsContact O-CB 3.24Å; L148-Y152 WeakPolarHBondContact O-CB 3.27Å; L148-Y152 PolarHBondContact O-N 3.25Å
149	R	79.7	Confident	75.2	Confident	165 Å²	165	86.7 Å²	86.7	62%	0.623	46%	0.46	S	S	*	.	H	α-helix	trans	-62.5	-44.6	174	-175.2	177.4	178.1	169.7	0.1	112.2	F126 A145 P146 E147 L153	F126-R149 HydrophobicContact CZ-CB 4.28Å; A145-R149 WeakPolarHBondContact O-CB 3.38Å; A145-R149 PolarHBondContact O-N 3.38Å; P146-R149 WeakPolarHBondContact O-CB 3.32Å; P146-R149 PolarHBondContact O-N 3.16Å; E147-R149 VanDerWaalsContact C-N 3.26Å; E147-R149 PolarHBondContact O-N 2.6Å; R149-L153 HydrophobicContact CG-CD1 4.38Å; R149-L153 VanDerWaalsContact O-CG 3.27Å; R149-L153 WeakPolarHBondContact O-CG 3.48Å; R149-L153 PolarHBondContact O-N 3.28Å
150	L	82.9	Confident	76.6	Confident	112 Å²	112	92.4 Å²	92.4	59%	0.586	47%	0.473	S	S	*	.	H	α-helix	trans	-65.8	-43.1	177.7	-174.5	127.2	0	0	0	111.6	P146 E147 L153 L154	P146-L150 PolarHBondContact O-N 2.87Å; E147-L150 PolarHBondContact O-N 2.92Å; L150-L153 PolarHBondContact O-N 2.85Å; L150-L154 HydrophobicContact CD2-CD1 3.76Å; L150-L154 HydrophobicContact CG-CD1 4.39Å; L150-L154 VanDerWaalsContact O-CG 3.32Å; L150-L154 WeakPolarHBondContact O-CG 3.36Å; L150-L154 PolarHBondContact O-N 2.98Å
151	E	77.6	Confident	77.7	Confident	28 Å²	28	90.1 Å²	90.1	13%	0.131	45%	0.454	C	S	.	.	H	α-helix	trans	-63.3	-44.8	175.9	-173.4	173.9	-170	0	0	111.8	W136 Q137 K143 E147 L148 L153 L154 L155	W136-E151 HydrophobicContact CE3-CG 4.08Å; W136-E151 HydrophobicContact CZ3-CB 4.2Å; W136-E151 HydrophobicContact CZ3-CG 4.05Å; Q137-E151 PolarHBondContact N-OE1 2.99Å; K143-E151 WeakPolarHBondContact CD-OE2 3.39Å; K143-E151 WeakPolarHBondContact CE-OE2 3.37Å; K143-E151 VanDerWaalsContact NZ-CD 3.25Å; K143-E151 IonicContact NZ-OE1 2.93Å; K143-E151 PolarHBondContact NZ-OE1 2.63Å; K143-E151 IonicContact NZ-OE2 3.92Å; K143-E151 PolarHBondContact NZ-OE2 3.27Å; E147-E151 PolarHBondContact O-N 2.87Å; L148-E151 PolarHBondContact O-N 3.49Å; E151-L153 PolarHBondContact O-N 2.98Å; E151-L154 PolarHBondContact O-N 2.97Å; E151-L155 HydrophobicContact CG-CD1 4.06Å; E151-L155 HydrophobicContact CG-CG 4.4Å; E151-L155 WeakPolarHBondContact O-CB 3.05Å; E151-L155 WeakPolarHBondContact O-CG 3.37Å; E151-L155 PolarHBondContact O-N 3.21Å
152	Y	80.4	Confident	78.5	Confident	37 Å²	37	89.8 Å²	89.8	15%	0.145	45%	0.452	C	S	.	.	H	α-helix	trans	-56.9	-47.3	174.3	173.3	-106.1	0	0	0	111.8	F126 M133 W136 L148 L154 L155 K156	F126-Y152 HydrophobicContact CB-CE2 4.46Å; F126-Y152 AromaticContact CD1-CD1 3.73Å; F126-Y152 HydrophobicContact CD1-CD1 3.73Å; F126-Y152 HydrophobicContact CD1-CD2 4.24Å; F126-Y152 AromaticContact CD1-CE1 3.95Å; F126-Y152 HydrophobicContact CD1-CE1 3.95Å; F126-Y152 HydrophobicContact CD1-CE2 4.46Å; F126-Y152 AromaticContact CD1-CG 3.87Å; F126-Y152 HydrophobicContact CD1-CG 3.87Å; F126-Y152 HydrophobicContact CD2-CD2 4.23Å; F126-Y152 HydrophobicContact CD2-CG 4.23Å; F126-Y152 AromaticContact CE1-CD1 3.64Å; F126-Y152 HydrophobicContact CE1-CD1 3.64Å; F126-Y152 HydrophobicContact CE1-CE1 4.27Å; F126-Y152 AromaticContact CE1-CG 3.8Å; F126-Y152 HydrophobicContact CE1-CG 3.8Å; F126-Y152 HydrophobicContact CE2-CG 4.18Å; F126-Y152 HydrophobicContact CG-CD1 4.39Å; F126-Y152 HydrophobicContact CG-CD2 4.09Å; F126-Y152 HydrophobicContact CG-CE2 4.35Å; F126-Y152 HydrophobicContact CG-CG 4.12Å; F126-Y152 HydrophobicContact CZ-CD1 4.25Å; F126-Y152 AromaticContact CZ-CG 4Å; F126-Y152 HydrophobicContact CZ-CG 4Å; M133-Y152 HydrophobicContact CG-CE2 4.24Å; W136-Y152 HydrophobicContact CZ2-CD2 4.18Å; L148-Y152 VanDerWaalsContact O-CB 3.24Å; L148-Y152 WeakPolarHBondContact O-CB 3.27Å; L148-Y152 PolarHBondContact O-N 3.25Å; Y152-L154 PolarHBondContact O-N 2.84Å; Y152-L155 PolarHBondContact O-N 3.24Å; Y152-K156 HydrophobicContact CE1-CD 4.28Å; Y152-K156 VanDerWaalsContact O-CB 3.27Å; Y152-K156 WeakPolarHBondContact O-CB 3.36Å; Y152-K156 PolarHBondContact O-N 3.47Å
153	L	83.8	Confident	79.1	Confident	95 Å²	95	87.5 Å²	87.5	50%	0.497	44%	0.439	S	S	.	.	H	α-helix	trans	-61.8	-44.4	178.1	-71.9	174.7	0	0	0	111.9	R149 L150 E151 K156 E157	R149-L153 HydrophobicContact CG-CD1 4.38Å; R149-L153 VanDerWaalsContact O-CG 3.27Å; R149-L153 WeakPolarHBondContact O-CG 3.48Å; R149-L153 PolarHBondContact O-N 3.28Å; L150-L153 PolarHBondContact O-N 2.85Å; E151-L153 PolarHBondContact O-N 2.98Å; L153-K156 PolarHBondContact O-N 3.32Å; L153-E157 PolarHBondContact O-N 2.89Å
154	L	82.9	Confident	79.4	Confident	84 Å²	84	90.7 Å²	90.7	44%	0.44	45%	0.454	S	S	.	.	H	α-helix	trans	-64	-40.6	176.9	-72.2	174.7	0	0	0	112.5	L150 E151 Y152 K158	L150-L154 HydrophobicContact CD2-CD1 3.76Å; L150-L154 HydrophobicContact CG-CD1 4.39Å; L150-L154 VanDerWaalsContact O-CG 3.32Å; L150-L154 WeakPolarHBondContact O-CG 3.36Å; L150-L154 PolarHBondContact O-N 2.98Å; E151-L154 PolarHBondContact O-N 2.97Å; Y152-L154 PolarHBondContact O-N 2.84Å; L154-K158 WeakPolarHBondContact O-CB 3.33Å; L154-K158 WeakPolarHBondContact O-CG 3.28Å; L154-K158 PolarHBondContact O-N 3.47Å
155	L	77.3	Confident	79.2	Confident	18 Å²	18	92.7 Å²	92.7	9%	0.094	46%	0.46	C	S	.	.	H	α-helix	trans	-67.3	-41.3	175.6	-72.2	175.7	0	0	0	111	M133 W136 E151 Y152 E157 K158 A159	M133-L155 HydrophobicContact CE-CB 3.84Å; M133-L155 WeakPolarHBondContact CE-O 3.36Å; W136-L155 HydrophobicContact CD2-CD1 3.94Å; W136-L155 HydrophobicContact CE3-CD1 4.22Å; W136-L155 HydrophobicContact CG-CD1 4.16Å; E151-L155 HydrophobicContact CG-CD1 4.06Å; E151-L155 HydrophobicContact CG-CG 4.4Å; E151-L155 WeakPolarHBondContact O-CB 3.05Å; E151-L155 WeakPolarHBondContact O-CG 3.37Å; E151-L155 PolarHBondContact O-N 3.21Å; Y152-L155 PolarHBondContact O-N 3.24Å; L155-E157 VanDerWaalsContact C-N 3.32Å; L155-E157 PolarHBondContact O-N 3.44Å; L155-K158 PolarHBondContact O-N 3.34Å; L155-A159 WeakPolarHBondContact O-CB 3.46Å; L155-A159 PolarHBondContact O-N 3.02Å
156	K	82.7	Confident	78.9	Confident	117 Å²	117	96.3 Å²	96.3	51%	0.509	46%	0.464	S	S	.	.	H	α-helix	trans	-58.6	-44.6	176.2	-172.1	175.6	-180	177.8	0	111.1	M133 Y152 L153 R160	M133-K156 VanDerWaalsContact CE-CA 3.4Å; M133-K156 HydrophobicContact CE-CB 4.26Å; M133-K156 VanDerWaalsContact CE-N 3.29Å; Y152-K156 HydrophobicContact CE1-CD 4.28Å; Y152-K156 VanDerWaalsContact O-CB 3.27Å; Y152-K156 WeakPolarHBondContact O-CB 3.36Å; Y152-K156 PolarHBondContact O-N 3.47Å; L153-K156 PolarHBondContact O-N 3.32Å; K156-R160 WeakPolarHBondContact O-CB 3.37Å; K156-R160 PolarHBondContact O-N 3.12Å
157	E	83.3	Confident	78.6	Confident	125 Å²	125	96.6 Å²	96.6	58%	0.584	46%	0.461	S	S	*	.	H	α-helix	trans	-63.8	-48.2	175.4	-168.6	178.8	-177.5	0	0	111.9	L153 L155 A159 R160 V161	L153-E157 PolarHBondContact O-N 2.89Å; L155-E157 VanDerWaalsContact C-N 3.32Å; L155-E157 PolarHBondContact O-N 3.44Å; E157-A159 PolarHBondContact O-N 2.99Å; E157-R160 WeakPolarHBondContact O-CB 3.32Å; E157-R160 PolarHBondContact O-N 3.05Å; E157-V161 WeakPolarHBondContact O-CG2 3.47Å; E157-V161 PolarHBondContact O-N 3.32Å
158	K	80.5	Confident	78.7	Confident	134 Å²	134	93.5 Å²	93.5	58%	0.583	45%	0.45	S	S	*	.	H	α-helix	trans	-60.6	-41.3	176.9	-76.7	176.7	-178.8	173.7	0	113	L154 L155 S162	L154-K158 WeakPolarHBondContact O-CB 3.33Å; L154-K158 WeakPolarHBondContact O-CG 3.28Å; L154-K158 PolarHBondContact O-N 3.47Å; L155-K158 PolarHBondContact O-N 3.34Å; K158-S162 VanDerWaalsContact O-CB 3.3Å; K158-S162 WeakPolarHBondContact O-CB 2.95Å; K158-S162 PolarHBondContact O-N 2.95Å; K158-S162 PolarHBondContact O-OG 3.07Å
159	A	78.7	Confident	79.2	Confident	40 Å²	40	97.8 Å²	97.8	33%	0.331	47%	0.469	S	S	.	.	H	α-helix	trans	-67.5	-39.6	177.6	0	0	0	0	0	111.3	M133 L155 E157 S162 K163	M133-A159 HydrophobicContact CE-CB 3.59Å; M133-A159 HydrophobicContact SD-CB 4.25Å; L155-A159 WeakPolarHBondContact O-CB 3.46Å; L155-A159 PolarHBondContact O-N 3.02Å; E157-A159 PolarHBondContact O-N 2.99Å; A159-S162 PolarHBondContact O-N 3.49Å; A159-K163 VanDerWaalsContact O-CB 3.3Å; A159-K163 WeakPolarHBondContact O-CB 3.45Å; A159-K163 PolarHBondContact O-N 2.89Å
160	R	82.1	Confident	79.7	Confident	195 Å²	195	92.4 Å²	92.4	74%	0.736	46%	0.455	S	S	*	.	H	α-helix	trans	-60.2	-49.2	174.4	-172.5	178.3	-177.1	166.5	2.6	111.2	K156 E157 S162 K163 Q164	K156-R160 WeakPolarHBondContact O-CB 3.37Å; K156-R160 PolarHBondContact O-N 3.12Å; E157-R160 WeakPolarHBondContact O-CB 3.32Å; E157-R160 PolarHBondContact O-N 3.05Å; R160-S162 VanDerWaalsContact C-N 3.34Å; R160-S162 PolarHBondContact O-N 2.99Å; R160-K163 PolarHBondContact O-N 3.29Å; R160-Q164 WeakPolarHBondContact O-CB 3.38Å; R160-Q164 PolarHBondContact O-N 3.23Å
161	V	77.5	Confident	80	Confident	72 Å²	72	90 Å²	90	44%	0.436	45%	0.446	S	S	.	.	H	α-helix	trans	-61	-43.5	176	173.6	0	0	0	0	110.9	E157 Q164 L165	E157-V161 WeakPolarHBondContact O-CG2 3.47Å; E157-V161 PolarHBondContact O-N 3.32Å; V161-Q164 PolarHBondContact O-N 2.75Å; V161-L165 HydrophobicContact CG1-CD1 3.92Å; V161-L165 HydrophobicContact CG1-CG 4.44Å; V161-L165 WeakPolarHBondContact O-CB 3.41Å; V161-L165 WeakPolarHBondContact O-CG 3.2Å; V161-L165 PolarHBondContact O-N 2.81Å
162	S	74.9	Confident	80.8	Confident	60 Å²	60	90.4 Å²	90.4	42%	0.42	45%	0.451	S	S	.	.	H	α-helix	trans	-66.3	-42.6	179.7	-59	0	0	0	0	112.5	K158 A159 R160 Q164 L165 Q166	K158-S162 VanDerWaalsContact O-CB 3.3Å; K158-S162 WeakPolarHBondContact O-CB 2.95Å; K158-S162 PolarHBondContact O-N 2.95Å; K158-S162 PolarHBondContact O-OG 3.07Å; A159-S162 PolarHBondContact O-N 3.49Å; R160-S162 VanDerWaalsContact C-N 3.34Å; R160-S162 PolarHBondContact O-N 2.99Å; S162-Q164 VanDerWaalsContact C-N 3.31Å; S162-Q164 PolarHBondContact O-N 3.47Å; S162-L165 CarbonylContact O-C 3.57Å; S162-L165 PolarHBondContact O-N 3.44Å; S162-Q166 WeakPolarHBondContact O-CB 3.46Å; S162-Q166 WeakPolarHBondContact O-CG 3.39Å; S162-Q166 PolarHBondContact O-N 3.23Å
163	K	74.3	Confident	81.5	Confident	147 Å²	147	92.6 Å²	92.6	64%	0.639	46%	0.463	S	S	*	.	H	α-helix	trans	-61.7	-40.9	174.9	-170.7	174.6	-179.9	-179.4	0	110.4	A159 R160 Q166 L167	A159-K163 VanDerWaalsContact O-CB 3.3Å; A159-K163 WeakPolarHBondContact O-CB 3.45Å; A159-K163 PolarHBondContact O-N 2.89Å; R160-K163 PolarHBondContact O-N 3.29Å; K163-Q166 PolarHBondContact O-N 3.44Å; K163-L167 VanDerWaalsContact O-CG 3.3Å; K163-L167 WeakPolarHBondContact O-CG 3.45Å; K163-L167 PolarHBondContact O-N 2.87Å
164	Q	74.3	Confident	82	Confident	122 Å²	122	91.2 Å²	91.2	57%	0.57	45%	0.453	S	S	*	.	H	α-helix	trans	-65.4	-41.2	175.9	-172.5	173	-13.4	0	0	112.9	R160 V161 S162 Q166 L167 T168	R160-Q164 WeakPolarHBondContact O-CB 3.38Å; R160-Q164 PolarHBondContact O-N 3.23Å; V161-Q164 PolarHBondContact O-N 2.75Å; S162-Q164 VanDerWaalsContact C-N 3.31Å; S162-Q164 PolarHBondContact O-N 3.47Å; Q164-Q166 VanDerWaalsContact C-N 3.31Å; Q164-L167 PolarHBondContact O-N 3.34Å; Q164-T168 PolarHBondContact O-N 3.36Å; Q164-T168 PolarHBondContact O-OG1 2.99Å
165	L	72.9	Confident	82.6	Confident	103 Å²	103	87.5 Å²	87.5	54%	0.539	43%	0.434	S	S	.	.	H	α-helix	trans	-72.7	-20.1	174.6	-69.1	172.5	0	0	0	113.4	V161 S162 T168	V161-L165 HydrophobicContact CG1-CD1 3.92Å; V161-L165 HydrophobicContact CG1-CG 4.44Å; V161-L165 WeakPolarHBondContact O-CB 3.41Å; V161-L165 WeakPolarHBondContact O-CG 3.2Å; V161-L165 PolarHBondContact O-N 2.81Å; S162-L165 CarbonylContact O-C 3.57Å; S162-L165 PolarHBondContact O-N 3.44Å; L165-T168 CarbonylContact C-O 3.53Å
166	Q	73.9	Confident	83.4	Confident	147 Å²	147	88.6 Å²	88.6	69%	0.687	44%	0.44	S	S	*	.	H	α-helix	trans	-77.4	-39.2	170.1	-78.5	178.4	0.8	0	0	111.5	S162 K163 Q164	S162-Q166 WeakPolarHBondContact O-CB 3.46Å; S162-Q166 WeakPolarHBondContact O-CG 3.39Å; S162-Q166 PolarHBondContact O-N 3.23Å; K163-Q166 PolarHBondContact O-N 3.44Å; Q164-Q166 VanDerWaalsContact C-N 3.31Å
167	L	78.2	Confident	83.9	Confident	94 Å²	94	83 Å²	83	49%	0.492	42%	0.416	S	S	.	.	H	α-helix	trans	-68.7	-37.9	178.2	-70.2	173.3	0	0	0	112.3	K163 Q164 A214 G215	K163-L167 VanDerWaalsContact O-CG 3.3Å; K163-L167 WeakPolarHBondContact O-CG 3.45Å; K163-L167 PolarHBondContact O-N 2.87Å; Q164-L167 PolarHBondContact O-N 3.34Å; L167-A214 WeakPolarHBondContact O-CA 3.49Å; L167-G215 PolarHBondContact O-N 2.85Å; L167-G215 VanDerWaalsContact O-N 3.09Å
168	T	81.5	Confident	84.4	Confident	49 Å²	49	78.9 Å²	78.9	30%	0.301	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	120.4	179.3	61.2	0	0	0	0	109.9	Q164 L165 P170 N213 A214	Q164-T168 PolarHBondContact O-N 3.36Å; Q164-T168 PolarHBondContact O-OG1 2.99Å; L165-T168 CarbonylContact C-O 3.53Å; T168-P170 WeakPolarHBondContact O-CD 3.48Å; T168-N213 WeakPolarHBondContact CA-O 3.47Å; T168-A214 HydrophobicContact CG2-CB 4.49Å
169	Q	83.7	Confident	84.8	Confident	110 Å²	110	74.3 Å²	74.3	51%	0.514	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	82.1	174.5	-65.1	177.5	-7.9	0	0	109.2	N213	Q169-N213 HydrophobicContact CB-CB 4.37Å; Q169-N213 PolarHBondContact N-O 2.81Å; Q169-N213 PolarHBondContact O-N 3.07Å
170	P	89.5	Confident	85.3	Confident	51 Å²	51	73.7 Å²	73.7	33%	0.331	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	132	176.3	30.9	-34.5	0	0	0	109.8	T168 S211 I212 T468	T168-P170 WeakPolarHBondContact O-CD 3.48Å; P170-S211 CarbonylContact C-O 3.5Å; P170-S211 WeakPolarHBondContact CA-O 3.33Å; P170-I212 HydrophobicContact CB-CG1 4.33Å; P170-T468 WeakPolarHBondContact O-CB 2.97Å; P170-T468 WeakPolarHBondContact O-CG2 3.39Å; P170-T468 PolarHBondContact O-OG1 2.8Å
171	T	91	Very high	85.5	Confident	62 Å²	62	64.6 Å²	64.6	38%	0.38	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	140.4	172.3	58.4	0	0	0	0	109.1	Q210 S211 T468	T171-Q210 WeakPolarHBondContact O-CA 3.3Å; T171-S211 PolarHBondContact N-O 3.43Å; T171-S211 PolarHBondContact O-N 3.25Å; T171-S211 PolarHBondContact OG1-O 3.46Å; T171-S211 PolarHBondContact OG1-OG 3.16Å; T171-T468 WeakPolarHBondContact CA-O 3.42Å
172	S	93.1	Very high	85.6	Confident	36 Å²	36	64 Å²	64	25%	0.252	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	143.5	174.1	66.2	0	0	0	0	111.1	A209 T468 Q469 T470	S172-A209 CarbonylContact C-O 3.45Å; S172-A209 WeakPolarHBondContact CA-O 3.3Å; S172-T468 PolarHBondContact N-O 2.79Å; S172-Q469 CarbonylContact O-C 3.5Å; S172-Q469 WeakPolarHBondContact O-CA 3.35Å; S172-Q469 VanDerWaalsContact OG-CG 3.31Å; S172-Q469 WeakPolarHBondContact OG-CG 3.34Å; S172-T470 PolarHBondContact O-N 2.88Å
173	E	95.2	Very high	85.8	Confident	84 Å²	84	63.1 Å²	63.1	39%	0.393	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.1	173.1	-176	174.7	-170.8	0	0	108.4	V208 A209 T470	E173-V208 CarbonylContact O-C 3.52Å; E173-V208 WeakPolarHBondContact O-CA 3.32Å; E173-A209 HydrophobicContact CB-CB 4.22Å; E173-A209 PolarHBondContact N-O 2.78Å; E173-A209 PolarHBondContact O-N 3.44Å; E173-T470 CarbonylContact C-O 3.54Å; E173-T470 WeakPolarHBondContact CA-O 3.36Å
174	F	95.4	Very high	86	Confident	66 Å²	66	58.4 Å²	58.4	29%	0.289	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	122.3	174.8	175.5	-94.6	0	0	0	107.8	L176 L206 S207 V208 T470 Y471 S472 F473	F174-L176 HydrophobicContact CE1-CB 3.81Å; F174-L176 HydrophobicContact CZ-CB 4.06Å; F174-L206 HydrophobicContact CE2-CD1 3.82Å; F174-L206 HydrophobicContact CZ-CD1 3.93Å; F174-S207 CarbonylContact C-O 3.53Å; F174-S207 WeakPolarHBondContact CA-O 3.46Å; F174-V208 HydrophobicContact CD2-CG2 3.99Å; F174-V208 HydrophobicContact CE2-CG2 4.38Å; F174-T470 PolarHBondContact N-O 3.07Å; F174-Y471 HydrophobicContact CB-CD1 4.05Å; F174-Y471 HydrophobicContact CB-CE1 4.48Å; F174-Y471 HydrophobicContact CD1-CD1 4.06Å; F174-Y471 HydrophobicContact CG-CD1 4.37Å; F174-Y471 CarbonylContact O-C 3.59Å; F174-Y471 WeakPolarHBondContact O-CA 3.43Å; F174-S472 PolarHBondContact O-N 2.77Å; F174-F473 HydrophobicContact CE1-CE1 4.15Å
175	S	94.4	Very high	85.8	Confident	5 Å²	5	53.7 Å²	53.7	4%	0.035	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	133.2	169.8	82.6	0	0	0	0	111.6	E205 L206 S207 S472	S175-E205 PolarHBondContact OG-OE1 3.44Å; S175-L206 WeakPolarHBondContact O-CA 3.39Å; S175-S207 WeakPolarHBondContact CB-OG 3.24Å; S175-S207 PolarHBondContact N-O 2.99Å; S175-S207 PolarHBondContact O-N 3.02Å; S175-S207 WeakPolarHBondContact OG-CB 3.36Å; S175-S207 PolarHBondContact OG-N 3.26Å; S175-S207 PolarHBondContact OG-OG 3.05Å; S175-S472 CarbonylContact C-O 3.59Å; S175-S472 WeakPolarHBondContact CA-O 3.44Å
176	L	95.1	Very high	85.5	Confident	42 Å²	42	54.9 Å²	54.9	22%	0.22	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	103	171.4	175.8	69.7	0	0	0	108.4	F174 L178 I203 L206 S472 F473 P474	F174-L176 HydrophobicContact CE1-CB 3.81Å; F174-L176 HydrophobicContact CZ-CB 4.06Å; L176-L178 HydrophobicContact CD1-CD2 4.39Å; L176-L178 HydrophobicContact CD2-CD2 4.39Å; L176-L178 HydrophobicContact CG-CD2 4.16Å; L176-I203 HydrophobicContact CD1-CD1 4.28Å; L176-I203 HydrophobicContact CD1-CG1 4.34Å; L176-I203 HydrophobicContact CD1-CG2 3.76Å; L176-L206 HydrophobicContact CD1-CD1 3.95Å; L176-S472 PolarHBondContact N-O 2.8Å; L176-F473 HydrophobicContact CB-CD1 4.06Å; L176-F473 HydrophobicContact CB-CE1 4.27Å; L176-P474 WeakPolarHBondContact O-CD 3.24Å
177	G	93.2	Very high	85.1	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	121.9	177	0	0	0	0	0	111.8	I203 Y204 E205 P474	G177-I203 WeakPolarHBondContact O-CA 3.36Å; G177-Y204 VanDerWaalsContact C-CD1 3.4Å; G177-Y204 WeakPolarHBondContact O-CD1 3.33Å; G177-Y204 PolarHBondContact O-N 3.11Å; G177-E205 PolarHBondContact N-O 2.92Å; G177-E205 PolarHBondContact O-N 3.46Å; G177-P474 VanDerWaalsContact CA-O 3.29Å; G177-P474 WeakPolarHBondContact CA-O 3.45Å
178	L	92.7	Very high	84.6	Confident	37 Å²	37	51.4 Å²	51.4	19%	0.194	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	136.1	174.5	-57.8	-175	0	0	0	110.2	L176 L180 S202 I203 P474 F475 I476	L176-L178 HydrophobicContact CD1-CD2 4.39Å; L176-L178 HydrophobicContact CD2-CD2 4.39Å; L176-L178 HydrophobicContact CG-CD2 4.16Å; L178-L180 HydrophobicContact CB-CD2 4.22Å; L178-L180 HydrophobicContact CB-CG 4.49Å; L178-S202 CarbonylContact C-O 3.51Å; L178-S202 WeakPolarHBondContact CA-O 3.4Å; L178-I203 HydrophobicContact CD2-CB 4.4Å; L178-I203 HydrophobicContact CD2-CG1 3.65Å; L178-P474 PolarHBondContact N-O 2.77Å; L178-F475 HydrophobicContact CB-CD1 4Å; L178-F475 HydrophobicContact CB-CE1 4.46Å; L178-F475 HydrophobicContact CD1-CD1 4.13Å; L178-F475 HydrophobicContact CD1-CE1 3.83Å; L178-F475 HydrophobicContact CG-CD1 4.35Å; L178-F475 HydrophobicContact CG-CE1 4.32Å; L178-F475 CarbonylContact O-C 3.55Å; L178-F475 WeakPolarHBondContact O-CA 3.32Å; L178-I476 PolarHBondContact O-N 3.29Å
179	D	90.2	Very high	84	Confident	38 Å²	38	55.3 Å²	55.3	20%	0.203	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	114.9	168.6	-175.9	7.3	0	0	0	108.8	T181 S202 Y204	D179-T181 WeakPolarHBondContact OD1-CB 3.17Å; D179-T181 PolarHBondContact OD1-N 3.36Å; D179-T181 PolarHBondContact OD1-OG1 2.74Å; D179-S202 PolarHBondContact N-O 3.22Å; D179-S202 PolarHBondContact O-N 2.87Å; D179-S202 VanDerWaalsContact O-N 3.16Å; D179-Y204 HydrophobicContact CB-CD1 4.31Å
180	L	88.9	Confident	83.4	Confident	28 Å²	28	53.2 Å²	53.2	15%	0.147	26%	0.262	C	S	.	.			trans	-110	12.7	179.8	-51.9	-177.9	0	0	0	111.2	L178 D182 V183 F184 P201 F475 I476 L477	L178-L180 HydrophobicContact CB-CD2 4.22Å; L178-L180 HydrophobicContact CB-CG 4.49Å; L180-D182 PolarHBondContact O-N 2.87Å; L180-V183 HydrophobicContact CB-CB 4.44Å; L180-V183 WeakPolarHBondContact O-CA 3.33Å; L180-V183 WeakPolarHBondContact O-CB 3.38Å; L180-V183 PolarHBondContact O-N 2.92Å; L180-F184 HydrophobicContact CB-CD2 3.73Å; L180-F184 HydrophobicContact CB-CE2 3.9Å; L180-F184 HydrophobicContact CD1-CE2 3.85Å; L180-F184 WeakPolarHBondContact O-CD2 3.39Å; L180-F184 PolarHBondContact O-N 2.81Å; L180-P201 HydrophobicContact CD2-CB 3.41Å; L180-P201 VanDerWaalsContact CD2-CB 3.41Å; L180-F475 HydrophobicContact CD1-CB 3.97Å; L180-F475 HydrophobicContact CD1-CD1 3.86Å; L180-F475 HydrophobicContact CD1-CG 4.21Å; L180-F475 HydrophobicContact CG-CB 4.49Å; L180-F475 HydrophobicContact CG-CD1 4.48Å; L180-I476 CarbonylContact C-O 3.52Å; L180-I476 WeakPolarHBondContact CA-O 3.46Å; L180-I476 WeakPolarHBondContact CB-O 3.45Å; L180-I476 PolarHBondContact N-O 3.26Å; L180-L477 HydrophobicContact CD1-CD2 4.37Å
181	T	85.7	Confident	82.5	Confident	4 Å²	4	54 Å²	54	3%	0.025	27%	0.267	C	S	.	.	H	α-helix	trans	-55.8	-37.4	179.2	-59.2	0	0	0	0	111.7	D179 V183 D185 R186 I476	D179-T181 WeakPolarHBondContact OD1-CB 3.17Å; D179-T181 PolarHBondContact OD1-N 3.36Å; D179-T181 PolarHBondContact OD1-OG1 2.74Å; T181-V183 VanDerWaalsContact C-N 3.3Å; T181-V183 PolarHBondContact O-N 3.18Å; T181-D185 HydrophobicContact CG2-CB 3.86Å; T181-D185 WeakPolarHBondContact O-CA 3.42Å; T181-D185 VanDerWaalsContact O-CB 3.23Å; T181-D185 WeakPolarHBondContact O-CB 3.47Å; T181-D185 PolarHBondContact O-N 2.59Å; T181-R186 PolarHBondContact O-N 2.89Å; T181-I476 PolarHBondContact N-O 3.18Å
182	D	80.4	Confident	81.4	Confident	58 Å²	58	55.9 Å²	55.9	31%	0.31	28%	0.28	S	S	.	.	I	π-helix	trans	-64.4	-34.1	175.3	-75.7	-17.1	0	0	0	112.8	L180 R186 Y187	L180-D182 PolarHBondContact O-N 2.87Å; D182-R186 VanDerWaalsContact OD1-CD 3.23Å; D182-R186 WeakPolarHBondContact OD1-CD 3.15Å; D182-R186 IonicContact OD1-CZ 3.31Å; D182-R186 VanDerWaalsContact OD1-CZ 3.31Å; D182-R186 IonicContact OD1-NE 3.46Å; D182-R186 PolarHBondContact OD1-NE 3.18Å; D182-R186 IonicContact OD1-NH1 2.72Å; D182-R186 PolarHBondContact OD1-NH1 2.92Å; D182-R186 IonicContact OD2-NH1 3.92Å; D182-Y187 WeakPolarHBondContact O-CB 3.25Å; D182-Y187 PolarHBondContact O-N 2.91Å; D182-Y187 VanDerWaalsContact O-N 3.09Å
183	V	79.2	Confident	80.4	Confident	43 Å²	43	62.8 Å²	62.8	26%	0.261	31%	0.309	S	S	.	.	I	π-helix	trans	-75.8	-41.3	-179.4	-177.7	0	0	0	0	111.5	L180 T181 Y187 P199	L180-V183 HydrophobicContact CB-CB 4.44Å; L180-V183 WeakPolarHBondContact O-CA 3.33Å; L180-V183 WeakPolarHBondContact O-CB 3.38Å; L180-V183 PolarHBondContact O-N 2.92Å; T181-V183 VanDerWaalsContact C-N 3.3Å; T181-V183 PolarHBondContact O-N 3.18Å; V183-Y187 WeakPolarHBondContact O-CB 3.41Å; V183-P199 HydrophobicContact CB-CB 4.42Å; V183-P199 HydrophobicContact CG1-CG 4.48Å; V183-P199 HydrophobicContact CG2-CB 3.89Å; V183-P199 HydrophobicContact CG2-CG 4.2Å
184	F	76.6	Confident	79.1	Confident	47 Å²	47	64.2 Å²	64.2	21%	0.206	32%	0.319	C	S	.	.	I	π-helix	trans	-101.3	-35.7	-171.1	-73.1	-79.8	0	0	0	114.3	L180 L188 L477 Y488	L180-F184 HydrophobicContact CB-CD2 3.73Å; L180-F184 HydrophobicContact CB-CE2 3.9Å; L180-F184 HydrophobicContact CD1-CE2 3.85Å; L180-F184 WeakPolarHBondContact O-CD2 3.39Å; L180-F184 PolarHBondContact O-N 2.81Å; F184-L188 WeakPolarHBondContact O-CD1 3.36Å; F184-L477 WeakPolarHBondContact CB-O 3.37Å; F184-L477 HydrophobicContact CD2-CD2 3.57Å; F184-L477 HydrophobicContact CE2-CD2 3.51Å; F184-L477 HydrophobicContact CG-CD2 4.23Å; F184-L477 HydrophobicContact CZ-CD2 4.13Å; F184-Y488 HydrophobicContact CD1-CD2 4.31Å
185	D	71.3	Confident	77.8	Confident	23 Å²	23	65.3 Å²	65.3	12%	0.123	32%	0.321	C	S	.	.	I	π-helix	trans	-95.4	-55.6	-174.7	-155.1	-9.5	0	0	0	110.9	T181 K189 S478	T181-D185 HydrophobicContact CG2-CB 3.86Å; T181-D185 WeakPolarHBondContact O-CA 3.42Å; T181-D185 VanDerWaalsContact O-CB 3.23Å; T181-D185 WeakPolarHBondContact O-CB 3.47Å; T181-D185 PolarHBondContact O-N 2.59Å; D185-K189 WeakPolarHBondContact O-CB 3.27Å; D185-K189 WeakPolarHBondContact O-CG 3.35Å; D185-K189 PolarHBondContact O-N 2.85Å; D185-K189 WeakPolarHBondContact OD1-CD 3.23Å; D185-K189 VanDerWaalsContact OD1-CE 3.23Å; D185-K189 WeakPolarHBondContact OD1-CE 3.49Å; D185-K189 IonicContact OD1-NZ 2.8Å; D185-K189 PolarHBondContact OD1-NZ 3.25Å; D185-S478 PolarHBondContact OD2-OG 3.36Å
186	R	67.4	Low	76.2	Confident	128 Å²	128	68.4 Å²	68.4	48%	0.483	34%	0.343	S	S	.	.	I	π-helix	trans	-72.1	-52.2	-175.9	-63.6	-164.2	-176.3	148.9	-6.4	112.8	T181 D182 L188 K189 E190	T181-R186 PolarHBondContact O-N 2.89Å; D182-R186 VanDerWaalsContact OD1-CD 3.23Å; D182-R186 WeakPolarHBondContact OD1-CD 3.15Å; D182-R186 IonicContact OD1-CZ 3.31Å; D182-R186 VanDerWaalsContact OD1-CZ 3.31Å; D182-R186 IonicContact OD1-NE 3.46Å; D182-R186 PolarHBondContact OD1-NE 3.18Å; D182-R186 IonicContact OD1-NH1 2.72Å; D182-R186 PolarHBondContact OD1-NH1 2.92Å; D182-R186 IonicContact OD2-NH1 3.92Å; R186-L188 PolarHBondContact O-N 2.93Å; R186-L188 VanDerWaalsContact O-N 3.16Å; R186-K189 PolarHBondContact O-N 3.27Å; R186-K189 VanDerWaalsContact O-N 3.08Å; R186-E190 WeakPolarHBondContact O-CB 3.14Å; R186-E190 WeakPolarHBondContact O-CG 3.18Å; R186-E190 PolarHBondContact O-N 3.22Å
187	Y	65	Low	74.8	Confident	84 Å²	84	74.7 Å²	74.7	33%	0.329	38%	0.376	S	S	.	.	H	α-helix	trans	-58.6	-34	-176.8	-172.1	-94.1	0	0	0	113.6	D182 V183 R195 P199	D182-Y187 WeakPolarHBondContact O-CB 3.25Å; D182-Y187 PolarHBondContact O-N 2.91Å; D182-Y187 VanDerWaalsContact O-N 3.09Å; V183-Y187 WeakPolarHBondContact O-CB 3.41Å; Y187-R195 HydrophobicContact CD2-CB 4.32Å; Y187-R195 HydrophobicContact CD2-CG 4.36Å; Y187-R195 HydrophobicContact CE2-CB 4.11Å; Y187-R195 HydrophobicContact CE2-CG 4.34Å; Y187-R195 PolarHBondContact O-NE 3.05Å; Y187-P199 HydrophobicContact CD2-CG 4.22Å
188	L	66.9	Low	73.8	Confident	84 Å²	84	81 Å²	81	44%	0.44	41%	0.408	S	S	.	.	H	α-helix	trans	-81.2	-26.9	179.2	-66	-176.2	0	0	0	113.4	F184 R186 Y488	F184-L188 WeakPolarHBondContact O-CD1 3.36Å; R186-L188 PolarHBondContact O-N 2.93Å; R186-L188 VanDerWaalsContact O-N 3.16Å; L188-Y488 HydrophobicContact CD1-CE2 3.62Å
189	K	70.4	Confident	72.7	Confident	132 Å²	132	80.8 Å²	80.8	57%	0.574	41%	0.409	S	S	*	.	H	α-helix	trans	-92	-28.8	-178.8	-72.4	177.3	-178.9	163.1	0	113.6	D185 R186 D482	D185-K189 WeakPolarHBondContact O-CB 3.27Å; D185-K189 WeakPolarHBondContact O-CG 3.35Å; D185-K189 PolarHBondContact O-N 2.85Å; D185-K189 WeakPolarHBondContact OD1-CD 3.23Å; D185-K189 VanDerWaalsContact OD1-CE 3.23Å; D185-K189 WeakPolarHBondContact OD1-CE 3.49Å; D185-K189 IonicContact OD1-NZ 2.8Å; D185-K189 PolarHBondContact OD1-NZ 3.25Å; R186-K189 PolarHBondContact O-N 3.27Å; R186-K189 VanDerWaalsContact O-N 3.08Å; K189-D482 WeakPolarHBondContact CE-OD2 3.28Å; K189-D482 IonicContact NZ-OD2 2.66Å; K189-D482 PolarHBondContact NZ-OD2 2.76Å
190	E	69.4	Low	72.2	Confident	66 Å²	66	85 Å²	85	31%	0.308	43%	0.43	S	S	.	.	S	Bend	trans	-73.1	138	-179.3	-74.2	169.6	-173.6	0	0	111.9	R186 R195	R186-E190 WeakPolarHBondContact O-CB 3.14Å; R186-E190 WeakPolarHBondContact O-CG 3.18Å; R186-E190 PolarHBondContact O-N 3.22Å; E190-R195 HydrophobicContact CB-CG 4.33Å; E190-R195 PolarHBondContact O-NE 3.46Å; E190-R195 PolarHBondContact O-NH2 2.8Å; E190-R195 VanDerWaalsContact O-NH2 3.17Å
191	P	71	Confident	71.9	Confident	68 Å²	68	87 Å²	87	44%	0.442	44%	0.444	S	S	.	.			trans	-59.6	150	172.1	27.5	-33.3	0	0	0	109.6	E193 D194	P191-E193 PolarHBondContact O-N 2.96Å; P191-D194 HydrophobicContact CG-CB 4.43Å; P191-D194 WeakPolarHBondContact CG-OD2 3.46Å; P191-D194 PolarHBondContact O-N 3.03Å
192	P	68.9	Low	72	Confident	100 Å²	100	89.3 Å²	89.3	65%	0.649	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-21	-172.1	22.4	-33.4	0	0	0	114.4
193	E	70.8	Confident	72.5	Confident	182 Å²	182	91.7 Å²	91.7	85%	0.85	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-29.3	179	-61.1	178.5	-170.8	0	0	113.4	P191	P191-E193 PolarHBondContact O-N 2.96Å
194	D	69.2	Low	73	Confident	113 Å²	113	91.7 Å²	91.7	60%	0.604	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-7.1	-176.2	-67.5	-32	0	0	0	113.2	P191 S196	P191-D194 HydrophobicContact CG-CB 4.43Å; P191-D194 WeakPolarHBondContact CG-OD2 3.46Å; P191-D194 PolarHBondContact O-N 3.03Å; D194-S196 PolarHBondContact O-N 3.33Å
195	R	66.4	Low	73.8	Confident	89 Å²	89	91.3 Å²	91.3	34%	0.336	47%	0.467	S	S	.	.			trans	-66.1	119.9	-176.6	-66.2	-179.7	-172.7	176.7	-3.8	110.2	Y187 E190 L197	Y187-R195 HydrophobicContact CD2-CB 4.32Å; Y187-R195 HydrophobicContact CD2-CG 4.36Å; Y187-R195 HydrophobicContact CE2-CB 4.11Å; Y187-R195 HydrophobicContact CE2-CG 4.34Å; Y187-R195 PolarHBondContact O-NE 3.05Å; E190-R195 HydrophobicContact CB-CG 4.33Å; E190-R195 PolarHBondContact O-NE 3.46Å; E190-R195 PolarHBondContact O-NH2 2.8Å; E190-R195 VanDerWaalsContact O-NH2 3.17Å; R195-L197 PolarHBondContact O-N 3.38Å
196	S	62.7	Low	74.9	Confident	70 Å²	70	93.5 Å²	93.5	49%	0.49	48%	0.479	S	S	.	.			trans	-53.2	130.8	164.3	63	0	0	0	0	109.2	D194 I198	D194-S196 PolarHBondContact O-N 3.33Å; S196-I198 PolarHBondContact O-N 2.96Å
197	L	64.3	Low	76.1	Confident	175 Å²	175	87.8 Å²	87.8	92%	0.916	46%	0.458	S	S	*	.	S	Bend	trans	-54.9	-24.3	-172.2	-86.9	114	0	0	0	113.9	R195	R195-L197 PolarHBondContact O-N 3.38Å
198	I	71.7	Confident	77.5	Confident	131 Å²	131	86.2 Å²	86.2	67%	0.672	46%	0.457	S	S	*	.	S	Bend	trans	-145.9	112.1	177.8	-52.3	175.6	0	0	0	107.8	S196 I200	S196-I198 PolarHBondContact O-N 2.96Å; I198-I200 PolarHBondContact O-N 3.38Å
199	P	70.9	Confident	78.9	Confident	34 Å²	34	83.1 Å²	83.1	22%	0.221	44%	0.444	C	S	.	.			trans	-67.5	124.4	173.6	29.1	-33.9	0	0	0	109.1	V183 Y187	V183-P199 HydrophobicContact CB-CB 4.42Å; V183-P199 HydrophobicContact CG1-CG 4.48Å; V183-P199 HydrophobicContact CG2-CB 3.89Å; V183-P199 HydrophobicContact CG2-CG 4.2Å; Y187-P199 HydrophobicContact CD2-CG 4.22Å
200	I	78.3	Confident	80	Confident	127 Å²	127	82.9 Å²	82.9	65%	0.651	45%	0.445	S	S	*	.			trans	-100.5	114.3	-175.3	-57.7	169	0	0	0	108.3	I198 S202	I198-I200 PolarHBondContact O-N 3.38Å; I200-S202 PolarHBondContact O-N 3.49Å
201	P	83.9	Confident	81.2	Confident	68 Å²	68	81.7 Å²	81.7	44%	0.442	44%	0.444	S	S	.	.			trans	-63.4	134.6	174.4	28.7	-35.2	0	0	0	109.9	L180	L180-P201 HydrophobicContact CD2-CB 3.41Å; L180-P201 VanDerWaalsContact CD2-CB 3.41Å
202	S	87.8	Confident	82.2	Confident	53 Å²	53	82.4 Å²	82.4	37%	0.371	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	150.4	179	79.6	0	0	0	0	111.3	L178 D179 I200	L178-S202 CarbonylContact C-O 3.51Å; L178-S202 WeakPolarHBondContact CA-O 3.4Å; D179-S202 PolarHBondContact N-O 3.22Å; D179-S202 PolarHBondContact O-N 2.87Å; D179-S202 VanDerWaalsContact O-N 3.16Å; I200-S202 PolarHBondContact O-N 3.49Å
203	I	90.8	Very high	83.3	Confident	109 Å²	109	80 Å²	80	56%	0.559	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	113.2	176	-58.2	169.6	0	0	0	107.5	L176 G177 L178	L176-I203 HydrophobicContact CD1-CD1 4.28Å; L176-I203 HydrophobicContact CD1-CG1 4.34Å; L176-I203 HydrophobicContact CD1-CG2 3.76Å; G177-I203 WeakPolarHBondContact O-CA 3.36Å; L178-I203 HydrophobicContact CD2-CB 4.4Å; L178-I203 HydrophobicContact CD2-CG1 3.65Å
204	Y	90.1	Very high	84.2	Confident	42 Å²	42	72.6 Å²	72.6	17%	0.165	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-28.4	178.2	79.8	-92.6	0	0	0	112.5	G177 D179 H231 N232 P474 I476	G177-Y204 VanDerWaalsContact C-CD1 3.4Å; G177-Y204 WeakPolarHBondContact O-CD1 3.33Å; G177-Y204 PolarHBondContact O-N 3.11Å; D179-Y204 HydrophobicContact CB-CD1 4.31Å; Y204-H231 WeakPolarHBondContact O-CA 3.49Å; Y204-N232 PolarHBondContact O-N 3.23Å; Y204-N232 PolarHBondContact O-OD1 2.86Å; Y204-P474 WeakPolarHBondContact OH-CG 3.25Å; Y204-I476 HydrophobicContact CD1-CD1 3.74Å; Y204-I476 HydrophobicContact CD1-CG1 4.31Å; Y204-I476 HydrophobicContact CD2-CD1 4.35Å; Y204-I476 HydrophobicContact CE1-CD1 3.56Å; Y204-I476 HydrophobicContact CE1-CG1 3.78Å; Y204-I476 HydrophobicContact CE2-CD1 4.22Å; Y204-I476 HydrophobicContact CG-CD1 4.14Å
205	E	91.9	Very high	85.1	Confident	39 Å²	39	69.1 Å²	69.1	18%	0.182	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	135	-177.4	-179.3	-177.8	157.9	0	0	111	S175 G177 A230 H231	S175-E205 PolarHBondContact OG-OE1 3.44Å; G177-E205 PolarHBondContact N-O 2.92Å; G177-E205 PolarHBondContact O-N 3.46Å; E205-A230 WeakPolarHBondContact CA-O 3.35Å; E205-H231 WeakPolarHBondContact CG-CE1 3.38Å; E205-H231 IonicContact OE2-CE1 2.74Å; E205-H231 PolarHBondContact OE2-CE1 3.28Å
206	L	94.2	Very high	86.1	Confident	70 Å²	70	70.6 Å²	70.6	37%	0.366	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	120	163.3	-179.6	71.1	0	0	0	107.6	F174 S175 L176 T229 A230	F174-L206 HydrophobicContact CE2-CD1 3.82Å; F174-L206 HydrophobicContact CZ-CD1 3.93Å; S175-L206 WeakPolarHBondContact O-CA 3.39Å; L176-L206 HydrophobicContact CD1-CD1 3.95Å; L206-T229 CarbonylContact O-C 3.55Å; L206-T229 WeakPolarHBondContact O-CA 3.27Å; L206-A230 PolarHBondContact N-O 3.48Å; L206-A230 PolarHBondContact O-N 3.06Å
207	S	93.5	Very high	87.2	Confident	7 Å²	7	70.4 Å²	70.4	5%	0.049	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	140.6	172.4	92.1	0	0	0	0	112.8	F174 S175 V228	F174-S207 CarbonylContact C-O 3.53Å; F174-S207 WeakPolarHBondContact CA-O 3.46Å; S175-S207 WeakPolarHBondContact CB-OG 3.24Å; S175-S207 PolarHBondContact N-O 2.99Å; S175-S207 PolarHBondContact O-N 3.02Å; S175-S207 WeakPolarHBondContact OG-CB 3.36Å; S175-S207 PolarHBondContact OG-N 3.26Å; S175-S207 PolarHBondContact OG-OG 3.05Å; S207-V228 CarbonylContact C-O 3.57Å; S207-V228 VanDerWaalsContact CA-O 3.25Å; S207-V228 WeakPolarHBondContact CA-O 3.29Å
208	V	95.3	Very high	88.2	Confident	52 Å²	52	70.3 Å²	70.3	32%	0.315	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	119.1	173.1	-175.7	0	0	0	0	107.3	E173 F174 Q210 Q227 V228	E173-V208 CarbonylContact O-C 3.52Å; E173-V208 WeakPolarHBondContact O-CA 3.32Å; F174-V208 HydrophobicContact CD2-CG2 3.99Å; F174-V208 HydrophobicContact CE2-CG2 4.38Å; V208-Q210 HydrophobicContact CG1-CG 4.46Å; V208-Q227 CarbonylContact O-C 3.6Å; V208-Q227 WeakPolarHBondContact O-CA 3.34Å; V208-V228 PolarHBondContact N-O 3.11Å; V208-V228 PolarHBondContact O-N 3.37Å
209	A	95	Very high	89	Confident	19 Å²	19	69.3 Å²	69.3	16%	0.157	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	136.7	170.5	0	0	0	0	0	109.8	S172 E173 G226 Q227	S172-A209 CarbonylContact C-O 3.45Å; S172-A209 WeakPolarHBondContact CA-O 3.3Å; E173-A209 HydrophobicContact CB-CB 4.22Å; E173-A209 PolarHBondContact N-O 2.78Å; E173-A209 PolarHBondContact O-N 3.44Å; A209-G226 CarbonylContact C-O 3.57Å; A209-G226 WeakPolarHBondContact CA-O 3.23Å; A209-Q227 HydrophobicContact CB-CB 4.11Å; A209-Q227 HydrophobicContact CB-CG 4.01Å
210	Q	94.6	Very high	90	Very high	127 Å²	127	69.5 Å²	69.5	59%	0.593	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.4	135	174.5	-64.4	-177.1	14.4	0	0	108	T171 V208 A225 G226	T171-Q210 WeakPolarHBondContact O-CA 3.3Å; V208-Q210 HydrophobicContact CG1-CG 4.46Å; Q210-A225 CarbonylContact O-C 3.56Å; Q210-A225 VanDerWaalsContact O-CA 3.29Å; Q210-A225 WeakPolarHBondContact O-CA 3.25Å; Q210-G226 PolarHBondContact N-O 3.2Å; Q210-G226 PolarHBondContact O-N 2.99Å
211	S	93.8	Very high	90.6	Very high	41 Å²	41	64.1 Å²	64.1	29%	0.287	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	146.2	170.2	80.6	0	0	0	0	112.1	P170 T171 L224	P170-S211 CarbonylContact C-O 3.5Å; P170-S211 WeakPolarHBondContact CA-O 3.33Å; T171-S211 PolarHBondContact N-O 3.43Å; T171-S211 PolarHBondContact O-N 3.25Å; T171-S211 PolarHBondContact OG1-O 3.46Å; T171-S211 PolarHBondContact OG1-OG 3.16Å; S211-L224 CarbonylContact C-O 3.58Å; S211-L224 WeakPolarHBondContact CA-O 3.46Å; S211-L224 WeakPolarHBondContact CB-O 3.32Å
212	I	92.6	Very high	91.1	Very high	82 Å²	82	62.5 Å²	62.5	42%	0.421	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	121.8	178.3	-58.1	171.8	0	0	0	106.5	P170 S223 L224	P170-I212 HydrophobicContact CB-CG1 4.33Å; I212-S223 CarbonylContact O-C 3.59Å; I212-S223 VanDerWaalsContact O-CA 3.31Å; I212-S223 WeakPolarHBondContact O-CA 2.94Å; I212-L224 PolarHBondContact N-O 3.29Å; I212-L224 PolarHBondContact O-N 3.13Å
213	N	91.6	Very high	91.4	Very high	49 Å²	49	61.1 Å²	61.1	26%	0.262	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	117.3	169	-169.6	20.5	0	0	0	109.1	T168 Q169 S223	T168-N213 WeakPolarHBondContact CA-O 3.47Å; Q169-N213 HydrophobicContact CB-CB 4.37Å; Q169-N213 PolarHBondContact N-O 2.81Å; Q169-N213 PolarHBondContact O-N 3.07Å; N213-S223 PolarHBondContact OD1-OG 3.3Å
214	A	90.1	Very high	91.6	Very high	27 Å²	27	59.7 Å²	59.7	22%	0.223	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	121.4	-177.7	0	0	0	0	0	110.7	L167 T168 I216 S221 V222	L167-A214 WeakPolarHBondContact O-CA 3.49Å; T168-A214 HydrophobicContact CG2-CB 4.49Å; A214-I216 PolarHBondContact O-N 2.98Å; A214-S221 CarbonylContact O-C 3.5Å; A214-S221 WeakPolarHBondContact O-CA 3.5Å; A214-V222 PolarHBondContact N-O 2.9Å; A214-V222 PolarHBondContact O-N 3.05Å
215	G	87.8	Confident	91.9	Very high	40 Å²	40	59 Å²	59	41%	0.412	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	101	171	0	0	0	0	0	110.7	L167	L167-G215 PolarHBondContact O-N 2.85Å; L167-G215 VanDerWaalsContact O-N 3.09Å
216	I	86.4	Confident	92	Very high	120 Å²	120	58.6 Å²	58.6	62%	0.615	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	-38.3	179	-60.3	-178.1	0	0	0	110.8	A214 N220 V222	A214-I216 PolarHBondContact O-N 2.98Å; I216-N220 PolarHBondContact N-O 3.48Å; I216-V222 HydrophobicContact CD1-CB 3.94Å; I216-V222 HydrophobicContact CD1-CG2 3.34Å; I216-V222 HydrophobicContact CG1-CB 4.49Å; I216-V222 HydrophobicContact CG1-CG2 4.24Å
217	S	86	Confident	92	Very high	67 Å²	67	59.3 Å²	59.3	47%	0.469	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	165.2	177.9	176	0	0	0	0	109	K219 N220	S217-K219 PolarHBondContact O-N 3.06Å; S217-N220 PolarHBondContact N-O 2.86Å; S217-N220 CarbonylContact O-C 3.59Å; S217-N220 PolarHBondContact O-N 3.44Å
218	I	84.9	Confident	92	Very high	172 Å²	172	63.1 Å²	63.1	88%	0.882	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-29.5	173.7	-55.7	170	0	0	0	111.5
219	K	88.8	Confident	91.8	Very high	110 Å²	110	61.7 Å²	61.7	48%	0.478	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-17.3	178.5	-64.2	178.2	-176	167.3	0	114.6	S217 H245 H246	S217-K219 PolarHBondContact O-N 3.06Å; K219-H245 CarbonylContact O-C 3.51Å; K219-H245 WeakPolarHBondContact O-CA 3.48Å; K219-H246 PolarHBondContact O-N 2.72Å
220	N	91.7	Very high	91.7	Very high	38 Å²	38	62.4 Å²	62.4	20%	0.203	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	123.3	-170.2	-71.6	-28.3	0	0	0	111	I216 S217 W243 R244 H245	I216-N220 PolarHBondContact N-O 3.48Å; S217-N220 PolarHBondContact N-O 2.86Å; S217-N220 CarbonylContact O-C 3.59Å; S217-N220 PolarHBondContact O-N 3.44Å; N220-W243 PolarHBondContact OD1-NE1 3.1Å; N220-R244 WeakPolarHBondContact CA-O 3.44Å; N220-H245 PolarHBondContact OD1-ND1 2.93Å
221	S	92.7	Very high	91.4	Very high	15 Å²	15	60.2 Å²	60.2	11%	0.105	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	140.7	168.7	62.4	0	0	0	0	110.4	A214 R244	A214-S221 CarbonylContact O-C 3.5Å; A214-S221 WeakPolarHBondContact O-CA 3.5Å; S221-R244 PolarHBondContact N-O 3.43Å; S221-R244 PolarHBondContact O-N 3.39Å; S221-R244 WeakPolarHBondContact OG-CB 3.43Å
222	V	94.1	Very high	91	Very high	33 Å²	33	64.7 Å²	64.7	20%	0.2	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	126.9	174.6	172.4	0	0	0	0	108.7	A214 I216 L224 I242 W243	A214-V222 PolarHBondContact N-O 2.9Å; A214-V222 PolarHBondContact O-N 3.05Å; I216-V222 HydrophobicContact CD1-CB 3.94Å; I216-V222 HydrophobicContact CD1-CG2 3.34Å; I216-V222 HydrophobicContact CG1-CB 4.49Å; I216-V222 HydrophobicContact CG1-CG2 4.24Å; V222-L224 HydrophobicContact CG1-CD2 4.12Å; V222-L224 HydrophobicContact CG1-CG 4.21Å; V222-I242 CarbonylContact C-O 3.6Å; V222-I242 WeakPolarHBondContact CA-O 3.36Å; V222-W243 HydrophobicContact CG2-CB 4.16Å; V222-W243 HydrophobicContact CG2-CG 4.14Å
223	S	93.6	Very high	90.4	Very high	24 Å²	24	64.6 Å²	64.6	17%	0.168	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122.6	173.9	-48.4	0	0	0	0	109.3	I212 N213 A241 I242	I212-S223 CarbonylContact O-C 3.59Å; I212-S223 VanDerWaalsContact O-CA 3.31Å; I212-S223 WeakPolarHBondContact O-CA 2.94Å; N213-S223 PolarHBondContact OD1-OG 3.3Å; S223-A241 CarbonylContact O-C 3.56Å; S223-A241 WeakPolarHBondContact O-CA 3.33Å; S223-I242 PolarHBondContact N-O 2.99Å; S223-I242 PolarHBondContact O-N 3.34Å
224	L	95.7	Very high	90.2	Very high	79 Å²	79	67 Å²	67	41%	0.414	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130	173.6	-60.2	177.3	0	0	0	108.2	S211 I212 V222 F239 L240 A241	S211-L224 CarbonylContact C-O 3.58Å; S211-L224 WeakPolarHBondContact CA-O 3.46Å; S211-L224 WeakPolarHBondContact CB-O 3.32Å; I212-L224 PolarHBondContact N-O 3.29Å; I212-L224 PolarHBondContact O-N 3.13Å; V222-L224 HydrophobicContact CG1-CD2 4.12Å; V222-L224 HydrophobicContact CG1-CG 4.21Å; L224-F239 HydrophobicContact CD2-CZ 4.19Å; L224-L240 CarbonylContact C-O 3.56Å; L224-A241 HydrophobicContact CD2-CB 3.65Å
225	A	94.7	Very high	90	Very high	29 Å²	29	67.9 Å²	67.9	24%	0.24	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	136	178.3	0	0	0	0	0	110.7	Q210 F239 L240	Q210-A225 CarbonylContact O-C 3.56Å; Q210-A225 VanDerWaalsContact O-CA 3.29Å; Q210-A225 WeakPolarHBondContact O-CA 3.25Å; A225-F239 CarbonylContact O-C 3.56Å; A225-F239 WeakPolarHBondContact O-CA 3.36Å; A225-L240 HydrophobicContact CB-CB 4.36Å; A225-L240 PolarHBondContact N-O 3.46Å; A225-L240 PolarHBondContact O-N 3.48Å
226	G	94.2	Very high	90.1	Very high	30 Å²	30	68.4 Å²	68.4	31%	0.309	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	133.6	172.4	0	0	0	0	0	109.5	A209 Q210 T238	A209-G226 CarbonylContact C-O 3.57Å; A209-G226 WeakPolarHBondContact CA-O 3.23Å; Q210-G226 PolarHBondContact N-O 3.2Å; Q210-G226 PolarHBondContact O-N 2.99Å; G226-T238 WeakPolarHBondContact CA-O 3.47Å
227	Q	93.8	Very high	90.3	Very high	85 Å²	85	64 Å²	64	40%	0.397	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	133.2	174.8	-179.3	177.3	-1.3	0	0	109.6	V208 A209 T229 G237 T238	V208-Q227 CarbonylContact O-C 3.6Å; V208-Q227 WeakPolarHBondContact O-CA 3.34Å; A209-Q227 HydrophobicContact CB-CB 4.11Å; A209-Q227 HydrophobicContact CB-CG 4.01Å; Q227-T229 HydrophobicContact CG-CG2 4.12Å; Q227-G237 CarbonylContact O-C 3.54Å; Q227-G237 WeakPolarHBondContact O-CA 3.42Å; Q227-T238 PolarHBondContact N-O 2.95Å; Q227-T238 PolarHBondContact O-N 3.28Å
228	V	93.5	Very high	90.6	Very high	86 Å²	86	62.9 Å²	62.9	52%	0.521	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	122.5	173.7	-177.7	0	0	0	0	107.6	S207 V208 I236	S207-V228 CarbonylContact C-O 3.57Å; S207-V228 VanDerWaalsContact CA-O 3.25Å; S207-V228 WeakPolarHBondContact CA-O 3.29Å; V208-V228 PolarHBondContact N-O 3.11Å; V208-V228 PolarHBondContact O-N 3.37Å; V228-I236 WeakPolarHBondContact CA-O 3.28Å
229	T	92.4	Very high	91	Very high	23 Å²	23	59.6 Å²	59.6	14%	0.141	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	122	177.1	52.7	0	0	0	0	108.4	L206 Q227 G235 I236	L206-T229 CarbonylContact O-C 3.55Å; L206-T229 WeakPolarHBondContact O-CA 3.27Å; Q227-T229 HydrophobicContact CG-CG2 4.12Å; T229-G235 CarbonylContact O-C 3.51Å; T229-G235 WeakPolarHBondContact O-CA 3.46Å; T229-I236 PolarHBondContact N-O 3.28Å; T229-I236 PolarHBondContact O-N 2.86Å; T229-I236 PolarHBondContact OG1-O 2.89Å
230	A	92.2	Very high	91.2	Very high	33 Å²	33	57 Å²	57	27%	0.273	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	119.1	169.9	0	0	0	0	0	108.9	E205 L206 V234	E205-A230 WeakPolarHBondContact CA-O 3.35Å; L206-A230 PolarHBondContact N-O 3.48Å; L206-A230 PolarHBondContact O-N 3.06Å; A230-V234 WeakPolarHBondContact CA-O 3.45Å
231	H	88.8	Confident	91.4	Very high	82 Å²	82	56.2 Å²	56.2	38%	0.38	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	123	173.9	-77.7	-79.1	0	0	0	109.3	Y204 E205 G233 V234	Y204-H231 WeakPolarHBondContact O-CA 3.49Å; E205-H231 WeakPolarHBondContact CG-CE1 3.38Å; E205-H231 IonicContact OE2-CE1 2.74Å; E205-H231 PolarHBondContact OE2-CE1 3.28Å; H231-G233 PolarHBondContact O-N 3.39Å; H231-G233 VanDerWaalsContact O-N 3.12Å; H231-V234 PolarHBondContact N-O 2.81Å; H231-V234 PolarHBondContact O-N 2.83Å
232	N	84.4	Confident	91.5	Very high	134 Å²	134	56.9 Å²	56.9	72%	0.717	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	43.1	178.5	-63.1	-20.9	0	0	0	113.6	Y204 V234	Y204-N232 PolarHBondContact O-N 3.23Å; Y204-N232 PolarHBondContact O-OD1 2.86Å; N232-V234 VanDerWaalsContact C-N 3.31Å; N232-V234 PolarHBondContact O-N 2.8Å
233	G	81.3	Confident	91.6	Very high	80 Å²	80	61.7 Å²	61.7	83%	0.825	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	-6.1	-179.3	0	0	0	0	0	115.9	H231	H231-G233 PolarHBondContact O-N 3.39Å; H231-G233 VanDerWaalsContact O-N 3.12Å
234	V	87	Confident	91.6	Very high	100 Å²	100	63.5 Å²	63.5	61%	0.606	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.9	112.5	175.3	-177.1	0	0	0	0	110.1	A230 H231 N232	A230-V234 WeakPolarHBondContact CA-O 3.45Å; H231-V234 PolarHBondContact N-O 2.81Å; H231-V234 PolarHBondContact O-N 2.83Å; N232-V234 VanDerWaalsContact C-N 3.31Å; N232-V234 PolarHBondContact O-N 2.8Å
235	G	86.1	Confident	91.5	Very high	45 Å²	45	63 Å²	63	46%	0.464	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	131.4	177.7	0	0	0	0	0	113.4	T229	T229-G235 CarbonylContact O-C 3.51Å; T229-G235 WeakPolarHBondContact O-CA 3.46Å
236	I	90	Very high	91.3	Very high	51 Å²	51	65.4 Å²	65.4	26%	0.262	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	131	168.5	-55.5	174.8	0	0	0	107.4	V228 T229 A267	V228-I236 WeakPolarHBondContact CA-O 3.28Å; T229-I236 PolarHBondContact N-O 3.28Å; T229-I236 PolarHBondContact O-N 2.86Å; T229-I236 PolarHBondContact OG1-O 2.89Å; I236-A267 HydrophobicContact CD1-CB 4.33Å; I236-A267 HydrophobicContact CG1-CB 3.96Å; I236-A267 HydrophobicContact CG2-CB 4.38Å
237	G	90.4	Very high	91	Very high	27 Å²	27	64.8 Å²	64.8	28%	0.278	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	135.8	175.1	0	0	0	0	0	110.1	Q227 G265 R266	Q227-G237 CarbonylContact O-C 3.54Å; Q227-G237 WeakPolarHBondContact O-CA 3.42Å; G237-G265 WeakPolarHBondContact O-CA 3.35Å; G237-R266 PolarHBondContact O-N 3.47Å
238	T	91.6	Very high	90.5	Very high	45 Å²	45	63.6 Å²	63.6	28%	0.276	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	132.2	174.2	55.9	0	0	0	0	110	G226 Q227 Y264	G226-T238 WeakPolarHBondContact CA-O 3.47Å; Q227-T238 PolarHBondContact N-O 2.95Å; Q227-T238 PolarHBondContact O-N 3.28Å; T238-Y264 CarbonylContact C-O 3.59Å; T238-Y264 WeakPolarHBondContact CA-O 3.35Å
239	F	93.5	Very high	89.8	Confident	102 Å²	102	69.8 Å²	69.8	45%	0.447	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	137.5	169.7	177.6	-96.6	0	0	0	108.6	L224 A225 A241 S263 Y264	L224-F239 HydrophobicContact CD2-CZ 4.19Å; A225-F239 CarbonylContact O-C 3.56Å; A225-F239 WeakPolarHBondContact O-CA 3.36Å; F239-A241 HydrophobicContact CE1-CB 4.03Å; F239-A241 HydrophobicContact CZ-CB 4.41Å; F239-S263 CarbonylContact O-C 3.58Å; F239-S263 WeakPolarHBondContact O-CA 3.46Å; F239-S263 WeakPolarHBondContact O-CB 3.18Å; F239-Y264 PolarHBondContact N-O 3.05Å; F239-Y264 PolarHBondContact O-N 2.88Å
240	L	93.6	Very high	89.1	Confident	57 Å²	57	78.6 Å²	78.6	30%	0.298	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	124	-178.7	176.3	69.5	0	0	0	108.9	L224 A225 I242 F262	L224-L240 CarbonylContact C-O 3.56Å; A225-L240 HydrophobicContact CB-CB 4.36Å; A225-L240 PolarHBondContact N-O 3.46Å; A225-L240 PolarHBondContact O-N 3.48Å; L240-I242 HydrophobicContact CD1-CG1 4.17Å; L240-I242 HydrophobicContact CD2-CD1 3.96Å; L240-I242 HydrophobicContact CD2-CG1 4.23Å; L240-I242 HydrophobicContact CG-CD1 4.26Å; L240-I242 HydrophobicContact CG-CG1 3.96Å; L240-F262 CarbonylContact C-O 3.54Å; L240-F262 WeakPolarHBondContact CA-O 3.49Å
241	A	95	Very high	88.3	Confident	20 Å²	20	79.1 Å²	79.1	17%	0.165	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	127.5	170.3	0	0	0	0	0	108.7	S223 L224 F239 E261 F262	S223-A241 CarbonylContact O-C 3.56Å; S223-A241 WeakPolarHBondContact O-CA 3.33Å; L224-A241 HydrophobicContact CD2-CB 3.65Å; F239-A241 HydrophobicContact CE1-CB 4.03Å; F239-A241 HydrophobicContact CZ-CB 4.41Å; A241-E261 CarbonylContact O-C 3.5Å; A241-F262 PolarHBondContact N-O 3.32Å; A241-F262 PolarHBondContact O-N 2.91Å
242	I	95.2	Very high	87.6	Confident	30 Å²	30	83.2 Å²	83.2	15%	0.154	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	120.2	177.6	-52.1	178.1	0	0	0	107.5	V222 S223 L240 D259 T260 E261	V222-I242 CarbonylContact C-O 3.6Å; V222-I242 WeakPolarHBondContact CA-O 3.36Å; S223-I242 PolarHBondContact N-O 2.99Å; S223-I242 PolarHBondContact O-N 3.34Å; L240-I242 HydrophobicContact CD1-CG1 4.17Å; L240-I242 HydrophobicContact CD2-CD1 3.96Å; L240-I242 HydrophobicContact CD2-CG1 4.23Å; L240-I242 HydrophobicContact CG-CD1 4.26Å; L240-I242 HydrophobicContact CG-CG1 3.96Å; I242-D259 HydrophobicContact CG2-CB 4.1Å; I242-T260 WeakPolarHBondContact CA-O 3.45Å; I242-E261 HydrophobicContact CG1-CG 4.28Å; I242-E261 HydrophobicContact CG2-CG 4.3Å
243	W	95.8	Very high	86.9	Confident	133 Å²	133	82.6 Å²	82.6	50%	0.504	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	118.2	166.3	174.2	15.5	0	0	0	108.7	N220 V222 D259 T260	N220-W243 PolarHBondContact OD1-NE1 3.1Å; V222-W243 HydrophobicContact CG2-CB 4.16Å; V222-W243 HydrophobicContact CG2-CG 4.14Å; W243-D259 CarbonylContact O-C 3.52Å; W243-D259 WeakPolarHBondContact O-CA 3.43Å; W243-T260 WeakPolarHBondContact CB-OG1 3.49Å; W243-T260 PolarHBondContact N-O 2.74Å; W243-T260 PolarHBondContact O-N 3.05Å; W243-T260 PolarHBondContact O-OG1 2.82Å
244	R	94.6	Very high	86.8	Confident	63 Å²	63	79.2 Å²	79.2	24%	0.238	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.8	177.5	172.8	177.5	-61.3	146.3	8.5	110.2	N220 S221 H246 I258 D259	N220-R244 WeakPolarHBondContact CA-O 3.44Å; S221-R244 PolarHBondContact N-O 3.43Å; S221-R244 PolarHBondContact O-N 3.39Å; S221-R244 WeakPolarHBondContact OG-CB 3.43Å; R244-H246 WeakPolarHBondContact CD-NE2 3.22Å; R244-I258 CarbonylContact C-O 3.56Å; R244-I258 WeakPolarHBondContact CA-O 3.39Å; R244-D259 VanDerWaalsContact CB-OD1 3.31Å; R244-D259 WeakPolarHBondContact CB-OD1 3.44Å; R244-D259 VanDerWaalsContact CG-OD1 3.22Å; R244-D259 WeakPolarHBondContact CG-OD1 3.43Å; R244-D259 IonicContact CZ-OD1 3.07Å; R244-D259 IonicContact NE-OD1 3.18Å; R244-D259 PolarHBondContact NE-OD1 2.82Å; R244-D259 IonicContact NH2-OD1 3.05Å; R244-D259 IonicContact NH2-OD2 3.43Å
245	H	93.6	Very high	86.6	Confident	68 Å²	68	77.9 Å²	77.9	32%	0.315	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	123.7	173.8	-177.4	66	0	0	0	110.4	K219 N220 T257 I258	K219-H245 CarbonylContact O-C 3.51Å; K219-H245 WeakPolarHBondContact O-CA 3.48Å; N220-H245 PolarHBondContact OD1-ND1 2.93Å; H245-T257 CarbonylContact O-C 3.57Å; H245-T257 WeakPolarHBondContact O-CA 3.35Å; H245-I258 PolarHBondContact N-O 2.76Å; H245-I258 PolarHBondContact O-N 2.7Å
246	H	91.4	Very high	86.8	Confident	79 Å²	79	76.1 Å²	76.1	37%	0.366	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	108.3	173.9	-66.1	-87.6	0	0	0	109.7	K219 R244 T257	K219-H246 PolarHBondContact O-N 2.72Å; R244-H246 WeakPolarHBondContact CD-NE2 3.22Å; H246-T257 WeakPolarHBondContact ND1-CG2 3.28Å
247	C	87.9	Confident	86.9	Confident	17 Å²	17	75.3 Å²	75.3	12%	0.115	37%	0.372	C	S	.	.			trans	-73.5	134.4	175.7	-63.3	0	0	0	0	111.1	T256	C247-T256 VanDerWaalsContact CB-O 3.22Å; C247-T256 WeakPolarHBondContact CB-O 3.22Å; C247-T256 PolarHBondContact N-O 3.23Å
248	S	82	Confident	87	Confident	60 Å²	60	76 Å²	76	42%	0.42	37%	0.369	S	S	.	.			trans	-67	156.6	172.3	178	0	0	0	0	111.2	K250 S251	S248-K250 PolarHBondContact O-N 3.34Å; S248-S251 VanDerWaalsContact O-CB 3.23Å; S248-S251 WeakPolarHBondContact O-CB 3.36Å; S248-S251 PolarHBondContact O-N 2.95Å
249	R	78.6	Confident	87.1	Confident	216 Å²	216	73.8 Å²	73.8	82%	0.815	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-25.3	175.8	-166.2	175.2	-177	-176.5	0.6	113.5	S251	R249-S251 VanDerWaalsContact C-N 3.34Å
250	K	77.6	Confident	87.2	Confident	208 Å²	208	70.6 Å²	70.6	90%	0.904	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-10.9	176.6	-64.9	-173.8	178.9	-177.8	0	114.2	S248	S248-K250 PolarHBondContact O-N 3.34Å
251	S	75.5	Confident	87.2	Confident	44 Å²	44	70.1 Å²	70.1	31%	0.308	34%	0.341	S	S	.	.	S	Bend	trans	-68.7	152.2	176.8	-178.1	0	0	0	0	110.7	S248 R249 F253 G254	S248-S251 VanDerWaalsContact O-CB 3.23Å; S248-S251 WeakPolarHBondContact O-CB 3.36Å; S248-S251 PolarHBondContact O-N 2.95Å; R249-S251 VanDerWaalsContact C-N 3.34Å; S251-F253 PolarHBondContact O-N 2.99Å; S251-F253 VanDerWaalsContact O-N 3.1Å; S251-G254 PolarHBondContact O-N 2.77Å
252	I	75.3	Confident	87.2	Confident	169 Å²	169	74.2 Å²	74.2	87%	0.867	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-31.9	175.2	-59.3	170.4	0	0	0	111	G254	I252-G254 VanDerWaalsContact C-N 3.32Å; I252-G254 PolarHBondContact O-N 2.95Å
253	F	69.7	Low	86.9	Confident	121 Å²	121	74.3 Å²	74.3	53%	0.531	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-3.8	178.8	-61.2	-72.2	0	0	0	114.3	S251 T256 R279	S251-F253 PolarHBondContact O-N 2.99Å; S251-F253 VanDerWaalsContact O-N 3.1Å; F253-T256 PolarHBondContact O-OG1 3.03Å; F253-R279 PolarHBondContact O-NH1 3.5Å
254	G	78.1	Confident	86.7	Confident	9 Å²	9	74.8 Å²	74.8	9%	0.093	36%	0.361	C	S	.	.			trans	63.2	-158.7	-170	0	0	0	0	0	112.6	S251 I252 T256	S251-G254 PolarHBondContact O-N 2.77Å; I252-G254 VanDerWaalsContact C-N 3.32Å; I252-G254 PolarHBondContact O-N 2.95Å; G254-T256 VanDerWaalsContact C-N 3.25Å; G254-T256 PolarHBondContact O-N 3.04Å
255	P	84.4	Confident	86.2	Confident	72 Å²	72	72 Å²	72	47%	0.468	35%	0.352	S	S	.	.	S	Bend	trans	-73.2	81.4	176.6	31.8	-34	0	0	0	110.3
256	T	88.7	Confident	85.3	Confident	8 Å²	8	77.9 Å²	77.9	5%	0.049	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	138.6	-179	-63	0	0	0	0	108.9	C247 F253 G254 I258 A277 R278 R279	C247-T256 VanDerWaalsContact CB-O 3.22Å; C247-T256 WeakPolarHBondContact CB-O 3.22Å; C247-T256 PolarHBondContact N-O 3.23Å; F253-T256 PolarHBondContact O-OG1 3.03Å; G254-T256 VanDerWaalsContact C-N 3.25Å; G254-T256 PolarHBondContact O-N 3.04Å; T256-I258 HydrophobicContact CG2-CG1 4.33Å; T256-A277 HydrophobicContact CG2-CB 4.07Å; T256-R278 CarbonylContact C-O 3.51Å; T256-R278 WeakPolarHBondContact CA-O 3.36Å; T256-R278 WeakPolarHBondContact CG2-O 3.45Å; T256-R279 HydrophobicContact CG2-CB 4.37Å; T256-R279 WeakPolarHBondContact OG1-CD 3.48Å
257	T	92	Very high	84.1	Confident	34 Å²	34	77.6 Å²	77.6	21%	0.209	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	122.7	172.3	62.9	0	0	0	0	108.9	H245 H246 A277 R278	H245-T257 CarbonylContact O-C 3.57Å; H245-T257 WeakPolarHBondContact O-CA 3.35Å; H246-T257 WeakPolarHBondContact ND1-CG2 3.28Å; T257-A277 CarbonylContact O-C 3.55Å; T257-A277 WeakPolarHBondContact O-CA 3.49Å; T257-R278 PolarHBondContact N-O 3.01Å; T257-R278 PolarHBondContact O-N 3.23Å; T257-R278 WeakPolarHBondContact OG1-CB 3.43Å; T257-R278 PolarHBondContact OG1-O 3.22Å
258	I	93.8	Very high	82.9	Confident	40 Å²	40	79.1 Å²	79.1	21%	0.205	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	116	179.2	-57.9	173.9	0	0	0	107.6	R244 H245 T256 I275	R244-I258 CarbonylContact C-O 3.56Å; R244-I258 WeakPolarHBondContact CA-O 3.39Å; H245-I258 PolarHBondContact N-O 2.76Å; H245-I258 PolarHBondContact O-N 2.7Å; T256-I258 HydrophobicContact CG2-CG1 4.33Å; I258-I275 HydrophobicContact CG2-CG2 3.85Å
259	D	94	Very high	82.2	Confident	0 Å²	0	84.1 Å²	84.1	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	118	173.1	-61.8	-30.8	0	0	0	108.4	I242 W243 R244 I275 R276 R278	I242-D259 HydrophobicContact CG2-CB 4.1Å; W243-D259 CarbonylContact O-C 3.52Å; W243-D259 WeakPolarHBondContact O-CA 3.43Å; R244-D259 VanDerWaalsContact CB-OD1 3.31Å; R244-D259 WeakPolarHBondContact CB-OD1 3.44Å; R244-D259 VanDerWaalsContact CG-OD1 3.22Å; R244-D259 WeakPolarHBondContact CG-OD1 3.43Å; R244-D259 IonicContact CZ-OD1 3.07Å; R244-D259 IonicContact NE-OD1 3.18Å; R244-D259 PolarHBondContact NE-OD1 2.82Å; R244-D259 IonicContact NH2-OD1 3.05Å; R244-D259 IonicContact NH2-OD2 3.43Å; D259-I275 CarbonylContact O-C 3.51Å; D259-I275 WeakPolarHBondContact O-CA 3.4Å; D259-R276 HydrophobicContact CB-CB 4.26Å; D259-R276 PolarHBondContact N-O 2.9Å; D259-R276 PolarHBondContact O-N 2.84Å; D259-R278 IonicContact OD2-CZ 2.68Å; D259-R278 IonicContact OD2-NE 3.69Å; D259-R278 PolarHBondContact OD2-NE 3.21Å; D259-R278 IonicContact OD2-NH2 3.19Å; D259-R278 PolarHBondContact OD2-NH2 2.68Å
260	T	95.4	Very high	82.1	Confident	34 Å²	34	74.3 Å²	74.3	21%	0.209	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	115.2	166.7	56.9	0	0	0	0	108.6	I242 W243 G274 I275	I242-T260 WeakPolarHBondContact CA-O 3.45Å; W243-T260 WeakPolarHBondContact CB-OG1 3.49Å; W243-T260 PolarHBondContact N-O 2.74Å; W243-T260 PolarHBondContact O-N 3.05Å; W243-T260 PolarHBondContact O-OG1 2.82Å; T260-G274 CarbonylContact C-O 3.39Å; T260-G274 WeakPolarHBondContact CA-O 3.24Å; T260-I275 HydrophobicContact CG2-CG1 4.34Å
261	E	93.7	Very high	82.6	Confident	48 Å²	48	69.3 Å²	69.3	22%	0.224	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132.5	-174.8	-59.7	173.9	-167.1	0	0	109.2	A241 I242 T273 G274 R276	A241-E261 CarbonylContact O-C 3.5Å; I242-E261 HydrophobicContact CG1-CG 4.28Å; I242-E261 HydrophobicContact CG2-CG 4.3Å; E261-T273 CarbonylContact O-C 3.51Å; E261-T273 VanDerWaalsContact O-CA 3.24Å; E261-T273 WeakPolarHBondContact O-CA 3.36Å; E261-G274 PolarHBondContact N-O 2.95Å; E261-G274 PolarHBondContact O-N 2.89Å; E261-R276 IonicContact OE1-NE 3.93Å; E261-R276 PolarHBondContact OE1-NE 2.99Å
262	F	93.3	Very high	83.2	Confident	106 Å²	106	68.4 Å²	68.4	47%	0.465	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	124.9	168.8	-65.7	-84.3	0	0	0	107.6	L240 A241 S272 T273	L240-F262 CarbonylContact C-O 3.54Å; L240-F262 WeakPolarHBondContact CA-O 3.49Å; A241-F262 PolarHBondContact N-O 3.32Å; A241-F262 PolarHBondContact O-N 2.91Å; F262-S272 CarbonylContact C-O 3.59Å; F262-S272 WeakPolarHBondContact CA-O 3.39Å; F262-T273 VanDerWaalsContact CE1-OG1 3.25Å; F262-T273 WeakPolarHBondContact CE1-OG1 3.2Å
263	S	90.3	Very high	84	Confident	32 Å²	32	62.9 Å²	62.9	22%	0.224	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	146.7	173.7	83	0	0	0	0	111.9	F239 L271 S272	F239-S263 CarbonylContact O-C 3.58Å; F239-S263 WeakPolarHBondContact O-CA 3.46Å; F239-S263 WeakPolarHBondContact O-CB 3.18Å; S263-L271 CarbonylContact O-C 3.57Å; S263-L271 WeakPolarHBondContact O-CA 3.37Å; S263-S272 PolarHBondContact N-O 3.49Å; S263-S272 PolarHBondContact O-N 3.5Å; S263-S272 PolarHBondContact OG-OG 3.5Å
264	Y	90.2	Very high	85.1	Confident	143 Å²	143	57.3 Å²	57.3	56%	0.561	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.4	126	174.8	175.9	-105.3	0	0	0	108.8	T238 F239 G270 L271	T238-Y264 CarbonylContact C-O 3.59Å; T238-Y264 WeakPolarHBondContact CA-O 3.35Å; F239-Y264 PolarHBondContact N-O 3.05Å; F239-Y264 PolarHBondContact O-N 2.88Å; Y264-G270 CarbonylContact C-O 3.52Å; Y264-G270 WeakPolarHBondContact CA-O 3.47Å; Y264-L271 HydrophobicContact CD2-CB 4.49Å
265	G	84.2	Confident	85.9	Confident	4 Å²	4	61.5 Å²	61.5	4%	0.041	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	137.4	-177.5	0	0	0	0	0	113	G237 G270	G237-G265 WeakPolarHBondContact O-CA 3.35Å; G265-G270 PolarHBondContact N-O 3.34Å; G265-G270 PolarHBondContact O-N 3.01Å
266	R	76.5	Confident	86.3	Confident	192 Å²	192	60 Å²	60	73%	0.725	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	163.9	168.1	-159.1	172.5	175.6	156.4	-1.5	109.9	G237	G237-R266 PolarHBondContact O-N 3.47Å
267	A	65.9	Low	86.5	Confident	72 Å²	72	61.4 Å²	61.4	60%	0.595	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	45.6	-178.1	0	0	0	0	0	114.9	I236	I236-A267 HydrophobicContact CD1-CB 4.33Å; I236-A267 HydrophobicContact CG1-CB 3.96Å; I236-A267 HydrophobicContact CG2-CB 4.38Å
268	G	61.9	Low	86.5	Confident	50 Å²	50	64.7 Å²	64.7	52%	0.515	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	94	0.7	168.6	0	0	0	0	0	116.2
269	R	67.1	Low	86.3	Confident	164 Å²	164	67.6 Å²	67.6	62%	0.619	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-12.3	177.2	-70.5	-169.7	170.6	117.8	0.9	115
270	G	77.6	Confident	85.9	Confident	10 Å²	10	72 Å²	72	10%	0.103	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	51.2	-154.4	170.2	0	0	0	0	0	114.1	Y264 G265 S295	Y264-G270 CarbonylContact C-O 3.52Å; Y264-G270 WeakPolarHBondContact CA-O 3.47Å; G265-G270 PolarHBondContact N-O 3.34Å; G265-G270 PolarHBondContact O-N 3.01Å; G270-S295 WeakPolarHBondContact CA-O 3.27Å
271	L	87.5	Confident	85.4	Confident	103 Å²	103	75.7 Å²	75.7	54%	0.539	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	130.9	169.6	-179.7	71.6	0	0	0	107.9	S263 Y264 A294 S295	S263-L271 CarbonylContact O-C 3.57Å; S263-L271 WeakPolarHBondContact O-CA 3.37Å; Y264-L271 HydrophobicContact CD2-CB 4.49Å; L271-A294 CarbonylContact O-C 3.58Å; L271-A294 WeakPolarHBondContact O-CA 3.33Å; L271-S295 PolarHBondContact N-OG 2.95Å; L271-S295 PolarHBondContact O-N 3.11Å; L271-S295 PolarHBondContact O-OG 2.97Å
272	S	87.3	Confident	84.8	Confident	25 Å²	25	76.5 Å²	76.5	18%	0.175	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	148.2	168.6	64.4	0	0	0	0	111.6	F262 S263 L293	F262-S272 CarbonylContact C-O 3.59Å; F262-S272 WeakPolarHBondContact CA-O 3.39Å; S263-S272 PolarHBondContact N-O 3.49Å; S263-S272 PolarHBondContact O-N 3.5Å; S263-S272 PolarHBondContact OG-OG 3.5Å; S272-L293 CarbonylContact C-O 3.48Å; S272-L293 WeakPolarHBondContact CA-O 3.24Å; S272-L293 WeakPolarHBondContact CB-O 3.46Å
273	T	92.5	Very high	84.2	Confident	53 Å²	53	79.8 Å²	79.8	33%	0.325	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	145.5	173.8	-178.2	0	0	0	0	108.4	E261 F262 S292 L293	E261-T273 CarbonylContact O-C 3.51Å; E261-T273 VanDerWaalsContact O-CA 3.24Å; E261-T273 WeakPolarHBondContact O-CA 3.36Å; F262-T273 VanDerWaalsContact CE1-OG1 3.25Å; F262-T273 WeakPolarHBondContact CE1-OG1 3.2Å; T273-S292 CarbonylContact O-C 3.53Å; T273-S292 WeakPolarHBondContact O-CA 3.35Å; T273-L293 HydrophobicContact CG2-CB 4.14Å; T273-L293 PolarHBondContact N-O 3.36Å; T273-L293 PolarHBondContact O-N 3.3Å
274	G	92.4	Very high	83.9	Confident	5 Å²	5	85.9 Å²	85.9	5%	0.052	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	158.4	177.6	0	0	0	0	0	112.2	T260 E261 L291	T260-G274 CarbonylContact C-O 3.39Å; T260-G274 WeakPolarHBondContact CA-O 3.24Å; E261-G274 PolarHBondContact N-O 2.95Å; E261-G274 PolarHBondContact O-N 2.89Å; G274-L291 CarbonylContact C-O 3.53Å; G274-L291 WeakPolarHBondContact CA-O 3.34Å
275	I	94.9	Very high	83.7	Confident	97 Å²	97	83.8 Å²	83.8	50%	0.497	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	123.4	174.7	-55	177.7	0	0	0	106.7	I258 D259 T260 G290 L291	I258-I275 HydrophobicContact CG2-CG2 3.85Å; D259-I275 CarbonylContact O-C 3.51Å; D259-I275 WeakPolarHBondContact O-CA 3.4Å; T260-I275 HydrophobicContact CG2-CG1 4.34Å; I275-G290 CarbonylContact O-C 3.6Å; I275-G290 WeakPolarHBondContact O-CA 3.32Å; I275-L291 PolarHBondContact N-O 3.31Å; I275-L291 PolarHBondContact O-N 2.7Å
276	R	93.3	Very high	84	Confident	39 Å²	39	87 Å²	87	15%	0.147	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	112.9	178.6	-179.1	-174.3	-60	-80.3	-8.1	110.1	D259 E261 R278 L289 S312	D259-R276 HydrophobicContact CB-CB 4.26Å; D259-R276 PolarHBondContact N-O 2.9Å; D259-R276 PolarHBondContact O-N 2.84Å; E261-R276 IonicContact OE1-NE 3.93Å; E261-R276 PolarHBondContact OE1-NE 2.99Å; R276-R278 HydrophobicContact CG-CG 4.39Å; R276-L289 CarbonylContact C-O 3.55Å; R276-L289 WeakPolarHBondContact CA-O 3.4Å; R276-S312 PolarHBondContact NH1-OG 3.29Å; R276-S312 VanDerWaalsContact NH1-OG 3.11Å; R276-S312 PolarHBondContact NH2-OG 3.43Å
277	A	93.6	Very high	84.7	Confident	39 Å²	39	78.6 Å²	78.6	32%	0.322	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	132.8	171.4	0	0	0	0	0	109.8	T256 T257 S288 L289	T256-A277 HydrophobicContact CG2-CB 4.07Å; T257-A277 CarbonylContact O-C 3.55Å; T257-A277 WeakPolarHBondContact O-CA 3.49Å; A277-S288 CarbonylContact O-C 3.56Å; A277-S288 VanDerWaalsContact O-CA 3.24Å; A277-S288 WeakPolarHBondContact O-CA 3.5Å; A277-L289 PolarHBondContact N-O 2.92Å; A277-L289 PolarHBondContact O-N 3.47Å
278	R	92	Very high	86	Confident	102 Å²	102	76.1 Å²	76.1	39%	0.385	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	133.1	171.7	-37.4	178.9	-169.4	-154.5	-3.5	109.4	T256 T257 D259 R276 G287	T256-R278 CarbonylContact C-O 3.51Å; T256-R278 WeakPolarHBondContact CA-O 3.36Å; T256-R278 WeakPolarHBondContact CG2-O 3.45Å; T257-R278 PolarHBondContact N-O 3.01Å; T257-R278 PolarHBondContact O-N 3.23Å; T257-R278 WeakPolarHBondContact OG1-CB 3.43Å; T257-R278 PolarHBondContact OG1-O 3.22Å; D259-R278 IonicContact OD2-CZ 2.68Å; D259-R278 IonicContact OD2-NE 3.69Å; D259-R278 PolarHBondContact OD2-NE 3.21Å; D259-R278 IonicContact OD2-NH2 3.19Å; D259-R278 PolarHBondContact OD2-NH2 2.68Å; R276-R278 HydrophobicContact CG-CG 4.39Å; R278-G287 CarbonylContact C-O 3.6Å; R278-G287 WeakPolarHBondContact CA-O 3.35Å
279	R	89.7	Confident	87.6	Confident	102 Å²	102	78.7 Å²	78.7	39%	0.385	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	137.7	-177.4	-174.1	174	176.3	169.6	-1.3	110.5	F253 T256 F281 G287	F253-R279 PolarHBondContact O-NH1 3.5Å; T256-R279 HydrophobicContact CG2-CB 4.37Å; T256-R279 WeakPolarHBondContact OG1-CD 3.48Å; R279-F281 HydrophobicContact CB-CE2 4.1Å; R279-F281 HydrophobicContact CB-CZ 4.17Å; R279-F281 HydrophobicContact CG-CE1 4.36Å; R279-F281 HydrophobicContact CG-CE2 4.36Å; R279-F281 HydrophobicContact CG-CZ 4.16Å; R279-G287 PolarHBondContact N-O 2.97Å; R279-G287 PolarHBondContact O-N 3.25Å
280	N	85.5	Confident	88.8	Confident	91 Å²	91	71 Å²	71	49%	0.487	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	123.6	174.1	-59.4	-3.9	0	0	0	108.5	H286	N280-H286 VanDerWaalsContact CG-CE1 3.49Å; N280-H286 PolarHBondContact OD1-ND1 3.18Å
281	F	83.5	Confident	89.6	Confident	113 Å²	113	75.6 Å²	75.6	50%	0.496	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	88.2	175.9	-62.6	-82.7	0	0	0	108.4	R279 F285	R279-F281 HydrophobicContact CB-CE2 4.1Å; R279-F281 HydrophobicContact CB-CZ 4.17Å; R279-F281 HydrophobicContact CG-CE1 4.36Å; R279-F281 HydrophobicContact CG-CE2 4.36Å; R279-F281 HydrophobicContact CG-CZ 4.16Å; F281-F285 HydrophobicContact CB-CB 4.04Å; F281-F285 PolarHBondContact N-O 3.27Å; F281-F285 WeakPolarHBondContact O-CB 3.37Å
282	G	81	Confident	89.7	Confident	64 Å²	64	72.8 Å²	72.8	66%	0.66	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	-152.6	-171.2	0	0	0	0	0	112.1
283	Q	80.6	Confident	89.9	Confident	176 Å²	176	74.8 Å²	74.8	82%	0.822	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-21	-176.2	-68.7	-178.3	-12.6	0	0	114.2
284	R	83.8	Confident	89.5	Confident	159 Å²	159	72.6 Å²	72.6	60%	0.6	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	-18.1	-169.9	-64.1	-173.7	-175.7	177.7	0.9	114.9	I317 Q318	R284-I317 WeakPolarHBondContact O-CA 3.36Å; R284-Q318 HydrophobicContact CB-CB 4.28Å; R284-Q318 HydrophobicContact CG-CB 4.47Å; R284-Q318 PolarHBondContact O-N 3.43Å
285	F	87.2	Confident	89	Confident	99 Å²	99	73.6 Å²	73.6	43%	0.434	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	127.1	-174.3	-66.7	-89.4	0	0	0	110.5	F281 I317	F281-F285 HydrophobicContact CB-CB 4.04Å; F281-F285 PolarHBondContact N-O 3.27Å; F281-F285 WeakPolarHBondContact O-CB 3.37Å; F285-I317 HydrophobicContact CD1-CB 4.43Å; F285-I317 HydrophobicContact CD1-CD1 4.37Å; F285-I317 HydrophobicContact CD1-CG1 3.89Å; F285-I317 HydrophobicContact CD1-CG2 4.08Å; F285-I317 HydrophobicContact CE1-CB 4.37Å; F285-I317 HydrophobicContact CE1-CD1 4.05Å; F285-I317 HydrophobicContact CE1-CG1 3.96Å; F285-I317 HydrophobicContact CE1-CG2 3.64Å; F285-I317 HydrophobicContact CZ-CG2 4.16Å
286	H	89.5	Confident	87.8	Confident	71 Å²	71	72 Å²	72	33%	0.329	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	115.7	171.7	-54.2	-91.2	0	0	0	108.7	N280 V315 N316	N280-H286 VanDerWaalsContact CG-CE1 3.49Å; N280-H286 PolarHBondContact OD1-ND1 3.18Å; H286-V315 CarbonylContact O-C 3.44Å; H286-V315 WeakPolarHBondContact O-CA 3.25Å; H286-N316 HydrophobicContact CB-CB 4.14Å; H286-N316 PolarHBondContact N-O 3.15Å; H286-N316 PolarHBondContact O-N 3.33Å
287	G	92.1	Very high	86.3	Confident	16 Å²	16	78.5 Å²	78.5	17%	0.165	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	148.8	176.5	0	0	0	0	0	111.2	R278 R279 G314	R278-G287 CarbonylContact C-O 3.6Å; R278-G287 WeakPolarHBondContact CA-O 3.35Å; R279-G287 PolarHBondContact N-O 2.97Å; R279-G287 PolarHBondContact O-N 3.25Å; G287-G314 CarbonylContact C-O 3.59Å; G287-G314 WeakPolarHBondContact CA-O 3.48Å
288	S	93.3	Very high	84.7	Confident	21 Å²	21	81.4 Å²	81.4	15%	0.147	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	139.7	170.7	63.2	0	0	0	0	110.2	A277 A313 G314	A277-S288 CarbonylContact O-C 3.56Å; A277-S288 VanDerWaalsContact O-CA 3.24Å; A277-S288 WeakPolarHBondContact O-CA 3.5Å; S288-A313 CarbonylContact O-C 3.58Å; S288-A313 WeakPolarHBondContact O-CA 3.31Å; S288-G314 PolarHBondContact N-O 3.35Å; S288-G314 PolarHBondContact O-N 3.48Å; S288-G314 VanDerWaalsContact OG-CA 3.31Å; S288-G314 WeakPolarHBondContact OG-CA 3.37Å; S288-G314 PolarHBondContact OG-N 3.39Å; S288-G314 PolarHBondContact OG-O 2.95Å
289	L	94.7	Very high	83.1	Confident	104 Å²	104	88.2 Å²	88.2	55%	0.545	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	127.7	175.9	-175	71.9	0	0	0	107.6	R276 A277 S312 A313	R276-L289 CarbonylContact C-O 3.55Å; R276-L289 WeakPolarHBondContact CA-O 3.4Å; A277-L289 PolarHBondContact N-O 2.92Å; A277-L289 PolarHBondContact O-N 3.47Å; L289-S312 CarbonylContact C-O 3.6Å; L289-S312 WeakPolarHBondContact CA-O 3.33Å; L289-A313 HydrophobicContact CD1-CB 4.14Å
290	G	92.6	Very high	81.6	Confident	2 Å²	2	85.9 Å²	85.9	2%	0.021	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	139.6	-178.8	0	0	0	0	0	112.4	I275 I311 S312	I275-G290 CarbonylContact O-C 3.6Å; I275-G290 WeakPolarHBondContact O-CA 3.32Å; G290-I311 CarbonylContact O-C 3.48Å; G290-I311 WeakPolarHBondContact O-CA 3.42Å; G290-S312 PolarHBondContact N-O 2.86Å; G290-S312 PolarHBondContact O-N 3.44Å
291	L	94.4	Very high	80.4	Confident	106 Å²	106	88.3 Å²	88.3	56%	0.555	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	134	169.8	-60.3	176.7	0	0	0	107.6	G274 I275 G310 I311	G274-L291 CarbonylContact C-O 3.53Å; G274-L291 WeakPolarHBondContact CA-O 3.34Å; I275-L291 PolarHBondContact N-O 3.31Å; I275-L291 PolarHBondContact O-N 2.7Å; L291-G310 CarbonylContact C-O 3.52Å; L291-G310 WeakPolarHBondContact CA-O 3.41Å; L291-I311 HydrophobicContact CD2-CD1 4.49Å; L291-I311 HydrophobicContact CD2-CG1 3.83Å; L291-I311 HydrophobicContact CD2-CG2 4.4Å
292	S	90.3	Very high	79.4	Confident	45 Å²	45	91.2 Å²	91.2	32%	0.315	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	154.7	175.5	63.7	0	0	0	0	110.5	T273 P309 G310	T273-S292 CarbonylContact O-C 3.53Å; T273-S292 WeakPolarHBondContact O-CA 3.35Å; S292-P309 CarbonylContact O-C 3.56Å; S292-P309 WeakPolarHBondContact O-CA 3.24Å; S292-G310 PolarHBondContact N-O 3.44Å; S292-G310 PolarHBondContact O-N 3.15Å; S292-G310 WeakPolarHBondContact OG-CA 3.45Å
293	L	90	Very high	78.2	Confident	66 Å²	66	93.3 Å²	93.3	35%	0.346	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	121.4	175.6	-171.3	71.9	0	0	0	107	S272 T273 L307 I308 P309	S272-L293 CarbonylContact C-O 3.48Å; S272-L293 WeakPolarHBondContact CA-O 3.24Å; S272-L293 WeakPolarHBondContact CB-O 3.46Å; T273-L293 HydrophobicContact CG2-CB 4.14Å; T273-L293 PolarHBondContact N-O 3.36Å; T273-L293 PolarHBondContact O-N 3.3Å; L293-L307 HydrophobicContact CD1-CB 3.97Å; L293-L307 HydrophobicContact CD2-CD1 4.33Å; L293-L307 HydrophobicContact CD2-CD2 4.29Å; L293-L307 HydrophobicContact CG-CB 4.42Å; L293-L307 HydrophobicContact CG-CD2 4.32Å; L293-I308 WeakPolarHBondContact CA-O 3.39Å; L293-P309 HydrophobicContact CD1-CB 4.37Å
294	A	85.3	Confident	77.5	Confident	8 Å²	8	87.7 Å²	87.7	7%	0.066	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	142	176.2	0	0	0	0	0	111.5	L271 L307 I308 M333	L271-A294 CarbonylContact O-C 3.58Å; L271-A294 WeakPolarHBondContact O-CA 3.33Å; A294-L307 CarbonylContact O-C 3.58Å; A294-L307 WeakPolarHBondContact O-CA 3.19Å; A294-I308 PolarHBondContact N-O 2.91Å; A294-I308 PolarHBondContact O-N 3.48Å; A294-M333 HydrophobicContact CB-CE 3.28Å; A294-M333 HydrophobicContact CB-SD 3.45Å; A294-M333 WeakPolarHBondContact CB-SD 3.31Å
295	S	81.7	Confident	76.8	Confident	26 Å²	26	86 Å²	86	18%	0.182	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	126.8	168.5	68.7	0	0	0	0	109.9	G270 L271 N306	G270-S295 WeakPolarHBondContact CA-O 3.27Å; L271-S295 PolarHBondContact N-OG 2.95Å; L271-S295 PolarHBondContact O-N 3.11Å; L271-S295 PolarHBondContact O-OG 2.97Å; S295-N306 WeakPolarHBondContact CA-O 3.42Å
296	L	69.4	Low	76.3	Confident	64 Å²	64	84.5 Å²	84.5	34%	0.335	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	111	167.2	-153.5	93.7	0	0	0	107.3	E298 N306 I308	L296-E298 HydrophobicContact CD2-CG 4.4Å; L296-E298 PolarHBondContact O-N 3.43Å; L296-N306 HydrophobicContact CB-CB 4.44Å; L296-N306 PolarHBondContact N-O 3.22Å; L296-I308 HydrophobicContact CB-CD1 4.11Å; L296-I308 HydrophobicContact CD1-CD1 3.93Å; L296-I308 HydrophobicContact CG-CD1 4.49Å
297	Y	62.4	Low	75.9	Confident	174 Å²	174	86.2 Å²	86.2	68%	0.682	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	93.8	171.9	-163.7	-90.2	0	0	0	108.7
298	E	59.1	Low	75.6	Confident	100 Å²	100	88.3 Å²	88.3	47%	0.467	46%	0.46	S	S	.	.			trans	-74.2	129.4	171.1	-116	168.9	-179.5	0	0	109.4	L296 S300 N306	L296-E298 HydrophobicContact CD2-CG 4.4Å; L296-E298 PolarHBondContact O-N 3.43Å; E298-S300 PolarHBondContact O-N 3.29Å; E298-N306 PolarHBondContact OE2-ND2 3.18Å
299	R	58.8	Low	75.4	Confident	246 Å²	246	90.5 Å²	90.5	93%	0.928	47%	0.474	S	S	*	.			trans	-75	31.3	-178.7	-155.9	178.5	-174.1	179.8	0.1	112.8
300	S	57.6	Low	75.1	Confident	52 Å²	52	85.7 Å²	85.7	36%	0.364	45%	0.449	S	S	.	.	S	Bend	trans	-84	148.3	178.7	97.2	0	0	0	0	110.4	E298 K302	E298-S300 PolarHBondContact O-N 3.29Å; S300-K302 PolarHBondContact O-N 3.04Å; S300-K302 VanDerWaalsContact O-N 3.09Å; S300-K302 PolarHBondContact OG-O 3.11Å
301	P	61	Low	75.2	Confident	142 Å²	142	89.1 Å²	89.1	92%	0.922	47%	0.466	S	S	*	.	S	Bend	trans	-65.8	-11.3	-176.9	25.8	-34	0	0	0	113.9
302	K	62	Low	75.1	Confident	175 Å²	175	84.4 Å²	84.4	76%	0.761	44%	0.442	S	S	*	.	S	Bend	trans	-99.3	110.6	170	-66.9	-178.7	179.9	178.5	0	107.6	S300 S304	S300-K302 PolarHBondContact O-N 3.04Å; S300-K302 VanDerWaalsContact O-N 3.09Å; S300-K302 PolarHBondContact OG-O 3.11Å; K302-S304 PolarHBondContact O-N 3.15Å
303	S	56.5	Low	75.3	Confident	107 Å²	107	84 Å²	84	75%	0.748	44%	0.441	S	S	*	.			trans	-70.1	72.4	-178.4	60.8	0	0	0	0	112
304	S	66	Low	75.5	Confident	58 Å²	58	80.9 Å²	80.9	41%	0.406	43%	0.425	S	S	.	.			trans	-88.9	116.6	167	54	0	0	0	0	109.3	K302 N306	K302-S304 PolarHBondContact O-N 3.15Å; S304-N306 PolarHBondContact O-N 3.46Å
305	I	69.2	Low	75.9	Confident	124 Å²	124	83.3 Å²	83.3	64%	0.636	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	105.4	170.4	-60.6	171.3	0	0	0	107	L307	I305-L307 HydrophobicContact CG2-CD2 4.22Å
306	N	75.8	Confident	76.4	Confident	68 Å²	68	85 Å²	85	36%	0.364	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	123	174.7	-70.3	-27.4	0	0	0	109.1	S295 L296 E298 S304	S295-N306 WeakPolarHBondContact CA-O 3.42Å; L296-N306 HydrophobicContact CB-CB 4.44Å; L296-N306 PolarHBondContact N-O 3.22Å; E298-N306 PolarHBondContact OE2-ND2 3.18Å; S304-N306 PolarHBondContact O-N 3.46Å
307	L	82.4	Confident	77.4	Confident	106 Å²	106	84.5 Å²	84.5	56%	0.555	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.2	125.9	176.3	-64.3	173.5	0	0	0	109.4	L293 A294 I305	L293-L307 HydrophobicContact CD1-CB 3.97Å; L293-L307 HydrophobicContact CD2-CD1 4.33Å; L293-L307 HydrophobicContact CD2-CD2 4.29Å; L293-L307 HydrophobicContact CG-CB 4.42Å; L293-L307 HydrophobicContact CG-CD2 4.32Å; A294-L307 CarbonylContact O-C 3.58Å; A294-L307 WeakPolarHBondContact O-CA 3.19Å; I305-L307 HydrophobicContact CG2-CD2 4.22Å
308	I	84.3	Confident	78.8	Confident	61 Å²	61	79.1 Å²	79.1	31%	0.313	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	111.1	178.8	-48.2	178.6	0	0	0	107.9	L293 A294 L296 M333	L293-I308 WeakPolarHBondContact CA-O 3.39Å; A294-I308 PolarHBondContact N-O 2.91Å; A294-I308 PolarHBondContact O-N 3.48Å; L296-I308 HydrophobicContact CB-CD1 4.11Å; L296-I308 HydrophobicContact CD1-CD1 3.93Å; L296-I308 HydrophobicContact CG-CD1 4.49Å; I308-M333 HydrophobicContact CB-CG 3.85Å; I308-M333 HydrophobicContact CB-SD 4.32Å; I308-M333 HydrophobicContact CG2-CB 4.49Å; I308-M333 HydrophobicContact CG2-CG 3.37Å; I308-M333 HydrophobicContact CG2-SD 4.46Å; I308-M333 WeakPolarHBondContact O-CG 3.18Å
309	P	89.9	Confident	80.1	Confident	67 Å²	67	78.9 Å²	78.9	44%	0.435	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	148.1	173.2	31.3	-33.9	0	0	0	109.9	S292 L293 L332 M333	S292-P309 CarbonylContact O-C 3.56Å; S292-P309 WeakPolarHBondContact O-CA 3.24Å; L293-P309 HydrophobicContact CD1-CB 4.37Å; P309-L332 HydrophobicContact CG-CD2 4.4Å; P309-L332 WeakPolarHBondContact O-CB 3.45Å; P309-M333 WeakPolarHBondContact O-CG 3.49Å; P309-M333 PolarHBondContact O-N 2.85Å
310	G	89.1	Confident	81.4	Confident	2 Å²	2	72.5 Å²	72.5	2%	0.021	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	141.1	178.2	0	0	0	0	0	110.8	L291 S292	L291-G310 CarbonylContact C-O 3.52Å; L291-G310 WeakPolarHBondContact CA-O 3.41Å; S292-G310 PolarHBondContact N-O 3.44Å; S292-G310 PolarHBondContact O-N 3.15Å; S292-G310 WeakPolarHBondContact OG-CA 3.45Å
311	I	93.5	Very high	82.7	Confident	74 Å²	74	73.9 Å²	73.9	38%	0.379	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	132.1	174.2	-58.4	174.4	0	0	0	107.1	G290 L291 R330 C331 L332	G290-I311 CarbonylContact O-C 3.48Å; G290-I311 WeakPolarHBondContact O-CA 3.42Å; L291-I311 HydrophobicContact CD2-CD1 4.49Å; L291-I311 HydrophobicContact CD2-CG1 3.83Å; L291-I311 HydrophobicContact CD2-CG2 4.4Å; I311-R330 CarbonylContact O-C 3.55Å; I311-R330 WeakPolarHBondContact O-CA 3.27Å; I311-C331 HydrophobicContact CB-CB 4.4Å; I311-C331 PolarHBondContact N-O 3.26Å; I311-C331 PolarHBondContact O-N 3.25Å; I311-L332 HydrophobicContact CB-CD1 4.33Å; I311-L332 HydrophobicContact CD1-CD1 3.65Å; I311-L332 HydrophobicContact CG1-CD1 3.69Å
312	S	92.7	Very high	83.9	Confident	8 Å²	8	70.7 Å²	70.7	6%	0.056	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	135.1	173	61.8	0	0	0	0	110.4	R276 L289 G290 L329	R276-S312 PolarHBondContact NH1-OG 3.29Å; R276-S312 VanDerWaalsContact NH1-OG 3.11Å; R276-S312 PolarHBondContact NH2-OG 3.43Å; L289-S312 CarbonylContact C-O 3.6Å; L289-S312 WeakPolarHBondContact CA-O 3.33Å; G290-S312 PolarHBondContact N-O 2.86Å; G290-S312 PolarHBondContact O-N 3.44Å; S312-L329 CarbonylContact C-O 3.59Å; S312-L329 VanDerWaalsContact CA-O 3.23Å; S312-L329 WeakPolarHBondContact CA-O 3.23Å
313	A	94.9	Very high	85.3	Confident	36 Å²	36	63.5 Å²	63.5	30%	0.298	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	124.9	175.2	0	0	0	0	0	108.3	S288 L289 E328 L329	S288-A313 CarbonylContact O-C 3.58Å; S288-A313 WeakPolarHBondContact O-CA 3.31Å; L289-A313 HydrophobicContact CD1-CB 4.14Å; A313-E328 CarbonylContact O-C 3.57Å; A313-L329 PolarHBondContact N-O 3.05Å; A313-L329 PolarHBondContact O-N 2.91Å
314	G	93.3	Very high	87	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.01	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	140.8	-179.6	0	0	0	0	0	111.4	G287 S288 L327	G287-G314 CarbonylContact C-O 3.59Å; G287-G314 WeakPolarHBondContact CA-O 3.48Å; S288-G314 PolarHBondContact N-O 3.35Å; S288-G314 PolarHBondContact O-N 3.48Å; S288-G314 VanDerWaalsContact OG-CA 3.31Å; S288-G314 WeakPolarHBondContact OG-CA 3.37Å; S288-G314 PolarHBondContact OG-N 3.39Å; S288-G314 PolarHBondContact OG-O 2.95Å; G314-L327 CarbonylContact C-O 3.55Å; G314-L327 VanDerWaalsContact CA-O 3.23Å; G314-L327 WeakPolarHBondContact CA-O 3.32Å
315	V	93.8	Very high	88.3	Confident	59 Å²	59	60.6 Å²	60.6	36%	0.358	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	125	177.4	-172.2	0	0	0	0	108.6	H286 I317 H326 L327	H286-V315 CarbonylContact O-C 3.44Å; H286-V315 WeakPolarHBondContact O-CA 3.25Å; V315-I317 HydrophobicContact CG1-CD1 3.99Å; V315-I317 HydrophobicContact CG1-CG1 3.64Å; V315-H326 WeakPolarHBondContact O-CA 3.32Å; V315-L327 PolarHBondContact N-O 3.25Å; V315-L327 PolarHBondContact O-N 2.97Å
316	N	92.1	Very high	89.5	Confident	61 Å²	61	57 Å²	57	33%	0.326	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	127.1	166.9	-60.7	-75.4	0	0	0	109.1	H286 A325 H326	H286-N316 HydrophobicContact CB-CB 4.14Å; H286-N316 PolarHBondContact N-O 3.15Å; H286-N316 PolarHBondContact O-N 3.33Å; N316-A325 CarbonylContact C-O 3.51Å; N316-A325 WeakPolarHBondContact CA-O 3.45Å; N316-H326 WeakPolarHBondContact OD1-CB 3.2Å; N316-H326 PolarHBondContact OD1-CD2 3.02Å
317	I	91.3	Very high	90.4	Very high	53 Å²	53	58.2 Å²	58.2	27%	0.272	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	123.5	-176.7	-51.1	177.6	0	0	0	108.2	R284 F285 V315 L319 A325	R284-I317 WeakPolarHBondContact O-CA 3.36Å; F285-I317 HydrophobicContact CD1-CB 4.43Å; F285-I317 HydrophobicContact CD1-CD1 4.37Å; F285-I317 HydrophobicContact CD1-CG1 3.89Å; F285-I317 HydrophobicContact CD1-CG2 4.08Å; F285-I317 HydrophobicContact CE1-CB 4.37Å; F285-I317 HydrophobicContact CE1-CD1 4.05Å; F285-I317 HydrophobicContact CE1-CG1 3.96Å; F285-I317 HydrophobicContact CE1-CG2 3.64Å; F285-I317 HydrophobicContact CZ-CG2 4.16Å; V315-I317 HydrophobicContact CG1-CD1 3.99Å; V315-I317 HydrophobicContact CG1-CG1 3.64Å; I317-L319 HydrophobicContact CG2-CD2 4.13Å; I317-L319 HydrophobicContact CG2-CG 4.43Å; I317-L319 PolarHBondContact O-N 3.39Å; I317-A325 PolarHBondContact N-O 3.49Å; I317-A325 PolarHBondContact O-N 3.45Å
318	Q	90.9	Very high	90.9	Very high	61 Å²	61	54.5 Å²	54.5	29%	0.285	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	99.7	166.4	-173.4	175	17.5	0	0	109	R284 L320	R284-Q318 HydrophobicContact CB-CB 4.28Å; R284-Q318 HydrophobicContact CG-CB 4.47Å; R284-Q318 PolarHBondContact O-N 3.43Å; Q318-L320 WeakPolarHBondContact CG-O 3.33Å
319	L	86.9	Confident	91.4	Very high	95 Å²	95	55.3 Å²	55.3	50%	0.497	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	-46.1	-177.7	-68.6	167.3	0	0	0	111.1	I317 V323 A325 L341	I317-L319 HydrophobicContact CG2-CD2 4.13Å; I317-L319 HydrophobicContact CG2-CG 4.43Å; I317-L319 PolarHBondContact O-N 3.39Å; L319-V323 HydrophobicContact CB-CB 4.35Å; L319-V323 HydrophobicContact CB-CG1 4.18Å; L319-V323 HydrophobicContact CD1-CG1 4.01Å; L319-V323 PolarHBondContact N-O 2.98Å; L319-A325 HydrophobicContact CD1-CB 3.77Å; L319-A325 HydrophobicContact CG-CB 4.26Å; L319-L341 HydrophobicContact CD1-CD1 4.03Å
320	L	86.8	Confident	91.4	Very high	112 Å²	112	57.5 Å²	57.5	59%	0.586	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135	170.2	172.8	-67.5	95.4	0	0	0	108.9	Q318 H322 V323	Q318-L320 WeakPolarHBondContact CG-O 3.33Å; L320-H322 PolarHBondContact O-N 3.32Å; L320-V323 HydrophobicContact CB-CB 4.16Å; L320-V323 HydrophobicContact CB-CG2 4.22Å; L320-V323 HydrophobicContact CD1-CB 4.17Å; L320-V323 HydrophobicContact CD1-CG2 4.16Å; L320-V323 PolarHBondContact N-O 2.95Å; L320-V323 PolarHBondContact O-N 3.45Å; L320-V323 VanDerWaalsContact O-N 3.15Å
321	S	84.3	Confident	91.4	Very high	81 Å²	81	59.8 Å²	59.8	57%	0.566	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-30.1	176	49.8	0	0	0	0	113.3
322	H	87	Confident	91	Very high	75 Å²	75	61.2 Å²	61.2	35%	0.347	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	0.2	-173.7	-65.6	-52.5	0	0	0	114.1	L320 F343 A344	L320-H322 PolarHBondContact O-N 3.32Å; H322-F343 WeakPolarHBondContact O-CA 3.3Å; H322-A344 WeakPolarHBondContact CB-O 3.31Å; H322-A344 PolarHBondContact ND1-O 3.45Å; H322-A344 PolarHBondContact O-N 3.34Å
323	V	91.1	Very high	90.4	Very high	24 Å²	24	62.9 Å²	62.9	15%	0.145	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	117.7	-173.9	-176	0	0	0	0	110.4	L319 L320 L341 F342 F343	L319-V323 HydrophobicContact CB-CB 4.35Å; L319-V323 HydrophobicContact CB-CG1 4.18Å; L319-V323 HydrophobicContact CD1-CG1 4.01Å; L319-V323 PolarHBondContact N-O 2.98Å; L320-V323 HydrophobicContact CB-CB 4.16Å; L320-V323 HydrophobicContact CB-CG2 4.22Å; L320-V323 HydrophobicContact CD1-CB 4.17Å; L320-V323 HydrophobicContact CD1-CG2 4.16Å; L320-V323 PolarHBondContact N-O 2.95Å; L320-V323 PolarHBondContact O-N 3.45Å; L320-V323 VanDerWaalsContact O-N 3.15Å; V323-L341 HydrophobicContact CG1-CD1 3.67Å; V323-L341 HydrophobicContact CG1-CG 4.43Å; V323-F342 CarbonylContact C-O 3.48Å; V323-F342 WeakPolarHBondContact CA-O 3.41Å; V323-F343 HydrophobicContact CG2-CD2 3.89Å
324	H	92	Very high	89.7	Confident	80 Å²	80	66.7 Å²	66.7	37%	0.37	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.2	176.4	-62.9	-86.8	0	0	0	110	F342	H324-F342 PolarHBondContact N-O 3.44Å; H324-F342 PolarHBondContact O-N 3.27Å
325	A	93.9	Very high	89.5	Confident	24 Å²	24	69.1 Å²	69.1	20%	0.198	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136	173.6	0	0	0	0	0	109.8	N316 I317 L319 E340 L341	N316-A325 CarbonylContact C-O 3.51Å; N316-A325 WeakPolarHBondContact CA-O 3.45Å; I317-A325 PolarHBondContact N-O 3.49Å; I317-A325 PolarHBondContact O-N 3.45Å; L319-A325 HydrophobicContact CD1-CB 3.77Å; L319-A325 HydrophobicContact CG-CB 4.26Å; A325-E340 CarbonylContact C-O 3.48Å; A325-E340 WeakPolarHBondContact CA-O 3.46Å; A325-L341 HydrophobicContact CB-CD1 4.02Å
326	H	93.9	Very high	89.4	Confident	49 Å²	49	66.9 Å²	66.9	23%	0.227	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	130.6	173.6	-178.5	-163.4	0	0	0	108.3	V315 N316 S339 E340	V315-H326 WeakPolarHBondContact O-CA 3.32Å; N316-H326 WeakPolarHBondContact OD1-CB 3.2Å; N316-H326 PolarHBondContact OD1-CD2 3.02Å; H326-S339 CarbonylContact O-C 3.53Å; H326-S339 VanDerWaalsContact O-CA 3.29Å; H326-S339 WeakPolarHBondContact O-CA 3.49Å; H326-E340 HydrophobicContact CB-CB 4.25Å; H326-E340 PolarHBondContact N-O 2.95Å; H326-E340 PolarHBondContact O-N 2.81Å
327	L	94.4	Very high	89.5	Confident	93 Å²	93	67.9 Å²	67.9	49%	0.487	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	126.4	173.2	-175.8	73.7	0	0	0	108.3	G314 V315 I337 S338	G314-L327 CarbonylContact C-O 3.55Å; G314-L327 VanDerWaalsContact CA-O 3.23Å; G314-L327 WeakPolarHBondContact CA-O 3.32Å; V315-L327 PolarHBondContact N-O 3.25Å; V315-L327 PolarHBondContact O-N 2.97Å; L327-I337 HydrophobicContact CD1-CG2 4.12Å; L327-S338 CarbonylContact C-O 3.46Å; L327-S338 WeakPolarHBondContact CA-O 3.24Å
328	E	93.1	Very high	89.6	Confident	29 Å²	29	66.1 Å²	66.1	14%	0.136	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	127.6	175.1	-157.1	-168.8	163.3	0	0	109.7	A313 R330 I337 S338	A313-E328 CarbonylContact O-C 3.57Å; E328-R330 IonicContact OE1-CZ 3Å; E328-R330 VanDerWaalsContact OE1-CZ 3.23Å; E328-R330 IonicContact OE1-NE 3.32Å; E328-R330 PolarHBondContact OE1-NE 2.89Å; E328-R330 IonicContact OE1-NH2 2.99Å; E328-R330 PolarHBondContact OE1-NH2 2.84Å; E328-R330 IonicContact OE2-NE 2.84Å; E328-R330 IonicContact OE2-NH2 2.8Å; E328-R330 PolarHBondContact OE2-NH2 3.07Å; E328-I337 CarbonylContact O-C 3.53Å; E328-I337 WeakPolarHBondContact O-CA 3.4Å; E328-S338 WeakPolarHBondContact CB-OG 3.34Å; E328-S338 PolarHBondContact N-O 2.8Å; E328-S338 PolarHBondContact O-N 3.32Å
329	L	94	Very high	89.9	Confident	78 Å²	78	65.4 Å²	65.4	41%	0.408	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.2	172.8	-176.1	76.4	0	0	0	108.4	S312 A313 I337	S312-L329 CarbonylContact C-O 3.59Å; S312-L329 VanDerWaalsContact CA-O 3.23Å; S312-L329 WeakPolarHBondContact CA-O 3.23Å; A313-L329 PolarHBondContact N-O 3.05Å; A313-L329 PolarHBondContact O-N 2.91Å; L329-I337 HydrophobicContact CD1-CD1 4.22Å; L329-I337 HydrophobicContact CD1-CG1 3.56Å
330	R	91.1	Very high	90.3	Very high	112 Å²	112	63.5 Å²	63.5	42%	0.423	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	135.8	170.8	-62.5	-176.1	-177.4	-176.8	3.7	109.3	I311 E328 P335 G336	I311-R330 CarbonylContact O-C 3.55Å; I311-R330 WeakPolarHBondContact O-CA 3.27Å; E328-R330 IonicContact OE1-CZ 3Å; E328-R330 VanDerWaalsContact OE1-CZ 3.23Å; E328-R330 IonicContact OE1-NE 3.32Å; E328-R330 PolarHBondContact OE1-NE 2.89Å; E328-R330 IonicContact OE1-NH2 2.99Å; E328-R330 PolarHBondContact OE1-NH2 2.84Å; E328-R330 IonicContact OE2-NE 2.84Å; E328-R330 IonicContact OE2-NH2 2.8Å; E328-R330 PolarHBondContact OE2-NH2 3.07Å; R330-P335 CarbonylContact O-C 3.52Å; R330-P335 WeakPolarHBondContact O-CA 3.43Å; R330-G336 PolarHBondContact N-O 2.71Å; R330-G336 PolarHBondContact O-N 2.85Å
331	C	88.6	Confident	90.7	Very high	51 Å²	51	61.5 Å²	61.5	35%	0.345	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	153.1	179.8	-64.1	0	0	0	0	109.9	I311 M333	I311-C331 HydrophobicContact CB-CB 4.4Å; I311-C331 PolarHBondContact N-O 3.26Å; I311-C331 PolarHBondContact O-N 3.25Å; C331-M333 VanDerWaalsContact C-N 3.34Å; C331-M333 PolarHBondContact O-N 3.18Å
332	L	85	Confident	91.2	Very high	103 Å²	103	60.4 Å²	60.4	54%	0.539	32%	0.317	S	S	.	.	S	Bend	trans	66	-74.1	180	-55	133.8	0	0	0	114	P309 I311 P335	P309-L332 HydrophobicContact CG-CD2 4.4Å; P309-L332 WeakPolarHBondContact O-CB 3.45Å; I311-L332 HydrophobicContact CB-CD1 4.33Å; I311-L332 HydrophobicContact CD1-CD1 3.65Å; I311-L332 HydrophobicContact CG1-CD1 3.69Å; L332-P335 WeakPolarHBondContact O-CD 3.35Å
333	M	80.8	Confident	91.5	Very high	43 Å²	43	61.3 Å²	61.3	21%	0.212	32%	0.32	C	S	.	.	S	Bend	trans	-81.8	117.3	173.4	-85	-161.2	73.8	0	0	110.7	A294 I308 P309 C331	A294-M333 HydrophobicContact CB-CE 3.28Å; A294-M333 HydrophobicContact CB-SD 3.45Å; A294-M333 WeakPolarHBondContact CB-SD 3.31Å; I308-M333 HydrophobicContact CB-CG 3.85Å; I308-M333 HydrophobicContact CB-SD 4.32Å; I308-M333 HydrophobicContact CG2-CB 4.49Å; I308-M333 HydrophobicContact CG2-CG 3.37Å; I308-M333 HydrophobicContact CG2-SD 4.46Å; I308-M333 WeakPolarHBondContact O-CG 3.18Å; P309-M333 WeakPolarHBondContact O-CG 3.49Å; P309-M333 PolarHBondContact O-N 2.85Å; C331-M333 VanDerWaalsContact C-N 3.34Å; C331-M333 PolarHBondContact O-N 3.18Å
334	N	79.8	Confident	91.5	Very high	117 Å²	117	61 Å²	61	63%	0.626	32%	0.32	S	S	*	.	S	Bend	trans	46.4	60.8	-177.8	-63.1	-36.7	0	0	0	112	G336	N334-G336 PolarHBondContact O-N 2.89Å
335	P	88.9	Confident	91.4	Very high	51 Å²	51	58.6 Å²	58.6	33%	0.331	31%	0.312	S	S	.	.			trans	-62.5	137.4	-174.3	16	-16.1	0	0	0	110.3	R330 L332 A360	R330-P335 CarbonylContact O-C 3.52Å; R330-P335 WeakPolarHBondContact O-CA 3.43Å; L332-P335 WeakPolarHBondContact O-CD 3.35Å; P335-A360 HydrophobicContact CB-CB 4.19Å; P335-A360 HydrophobicContact CG-CB 3.65Å; P335-A360 WeakPolarHBondContact O-CB 3.31Å; P335-A360 PolarHBondContact O-N 2.71Å
336	G	91.9	Very high	91.1	Very high	13 Å²	13	61 Å²	61	13%	0.134	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.6	164.8	-174.2	0	0	0	0	0	113.1	R330 N334 L358	R330-G336 PolarHBondContact N-O 2.71Å; R330-G336 PolarHBondContact O-N 2.85Å; N334-G336 PolarHBondContact O-N 2.89Å; G336-L358 CarbonylContact C-O 3.49Å; G336-L358 WeakPolarHBondContact CA-O 3.22Å
337	I	94.6	Very high	90.6	Very high	82 Å²	82	64.9 Å²	64.9	42%	0.421	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	128.7	176.9	-62.5	164.6	0	0	0	107.2	L327 E328 L329 K357 L358	L327-I337 HydrophobicContact CD1-CG2 4.12Å; E328-I337 CarbonylContact O-C 3.53Å; E328-I337 WeakPolarHBondContact O-CA 3.4Å; L329-I337 HydrophobicContact CD1-CD1 4.22Å; L329-I337 HydrophobicContact CD1-CG1 3.56Å; I337-K357 CarbonylContact O-C 3.5Å; I337-K357 WeakPolarHBondContact O-CA 3.42Å; I337-L358 PolarHBondContact N-O 2.83Å; I337-L358 PolarHBondContact O-N 3.45Å
338	S	93.6	Very high	90	Very high	15 Å²	15	62.4 Å²	62.4	11%	0.105	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	139.1	165.9	78.1	0	0	0	0	109.5	L327 E328 S356	L327-S338 CarbonylContact C-O 3.46Å; L327-S338 WeakPolarHBondContact CA-O 3.24Å; E328-S338 WeakPolarHBondContact CB-OG 3.34Å; E328-S338 PolarHBondContact N-O 2.8Å; E328-S338 PolarHBondContact O-N 3.32Å; S338-S356 CarbonylContact C-O 3.5Å; S338-S356 VanDerWaalsContact CA-O 3.31Å; S338-S356 WeakPolarHBondContact CA-O 3.19Å
339	S	95.3	Very high	89.8	Confident	46 Å²	46	64 Å²	64	32%	0.322	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	134.7	172.7	59.9	0	0	0	0	108.9	H326 S355 S356	H326-S339 CarbonylContact O-C 3.53Å; H326-S339 VanDerWaalsContact O-CA 3.29Å; H326-S339 WeakPolarHBondContact O-CA 3.49Å; S339-S355 CarbonylContact O-C 3.49Å; S339-S355 WeakPolarHBondContact O-CA 3.32Å; S339-S356 PolarHBondContact N-O 3.4Å; S339-S356 PolarHBondContact O-N 3.4Å
340	E	95.5	Very high	89.6	Confident	56 Å²	56	65.4 Å²	65.4	26%	0.262	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	128.2	177.1	-53.7	-173.2	162.6	0	0	109.1	A325 H326 I354	A325-E340 CarbonylContact C-O 3.48Å; A325-E340 WeakPolarHBondContact CA-O 3.46Å; H326-E340 HydrophobicContact CB-CB 4.25Å; H326-E340 PolarHBondContact N-O 2.95Å; H326-E340 PolarHBondContact O-N 2.81Å; E340-I354 CarbonylContact C-O 3.54Å; E340-I354 VanDerWaalsContact CA-O 3.3Å; E340-I354 WeakPolarHBondContact CA-O 3.49Å
341	L	95.6	Very high	89.7	Confident	69 Å²	69	61.7 Å²	61.7	36%	0.361	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	123.7	172.8	-174.2	71.7	0	0	0	107.9	L319 V323 A325 R353 I354	L319-L341 HydrophobicContact CD1-CD1 4.03Å; V323-L341 HydrophobicContact CG1-CD1 3.67Å; V323-L341 HydrophobicContact CG1-CG 4.43Å; A325-L341 HydrophobicContact CB-CD1 4.02Å; L341-R353 CarbonylContact O-C 3.52Å; L341-R353 VanDerWaalsContact O-CA 3.26Å; L341-R353 WeakPolarHBondContact O-CA 3.4Å; L341-I354 HydrophobicContact CB-CB 4.4Å; L341-I354 PolarHBondContact N-O 2.98Å; L341-I354 PolarHBondContact O-N 3.18Å
342	F	94.6	Very high	90	Very high	58 Å²	58	60.5 Å²	60.5	25%	0.254	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126.1	178.1	178.7	-100.8	0	0	0	109.7	V323 H324 A344 N351 R353	V323-F342 CarbonylContact C-O 3.48Å; V323-F342 WeakPolarHBondContact CA-O 3.41Å; H324-F342 PolarHBondContact N-O 3.44Å; H324-F342 PolarHBondContact O-N 3.27Å; F342-A344 HydrophobicContact CE1-CB 3.77Å; F342-A344 HydrophobicContact CZ-CB 4.06Å; F342-N351 HydrophobicContact CE2-CB 4.07Å; F342-N351 HydrophobicContact CZ-CB 4.23Å; F342-R353 HydrophobicContact CD2-CB 4.26Å
343	F	93.5	Very high	90.5	Very high	95 Å²	95	60.3 Å²	60.3	42%	0.417	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133	174.7	168.5	-90.5	0	0	0	108.8	H322 V323 N351 A352	H322-F343 WeakPolarHBondContact O-CA 3.3Å; V323-F343 HydrophobicContact CG2-CD2 3.89Å; F343-N351 CarbonylContact O-C 3.57Å; F343-N351 VanDerWaalsContact O-CA 3.31Å; F343-N351 WeakPolarHBondContact O-CA 3.34Å; F343-A352 HydrophobicContact CB-CB 4.34Å; F343-A352 HydrophobicContact CD1-CB 4.26Å; F343-A352 PolarHBondContact N-O 2.82Å; F343-A352 PolarHBondContact O-N 3.31Å
344	A	92.4	Very high	91.3	Very high	18 Å²	18	62 Å²	62	15%	0.149	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	131.6	172.3	0	0	0	0	0	109.9	H322 F342 N351	H322-A344 WeakPolarHBondContact CB-O 3.31Å; H322-A344 PolarHBondContact ND1-O 3.45Å; H322-A344 PolarHBondContact O-N 3.34Å; F342-A344 HydrophobicContact CE1-CB 3.77Å; F342-A344 HydrophobicContact CZ-CB 4.06Å; A344-N351 WeakPolarHBondContact CB-OD1 3.5Å
345	S	89.9	Confident	92	Very high	29 Å²	29	57 Å²	57	20%	0.203	32%	0.316	C	S	.	.			trans	-58.5	155.8	174.9	-177.1	0	0	0	0	111.5	D347 G348 Y350	S345-D347 PolarHBondContact O-N 3.44Å; S345-G348 PolarHBondContact O-N 3.49Å; S345-Y350 PolarHBondContact N-O 2.84Å
346	A	86.7	Confident	92.2	Very high	73 Å²	73	56.4 Å²	56.4	60%	0.603	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-35.2	175.9	0	0	0	0	0	112.6	G348	A346-G348 VanDerWaalsContact C-N 3.29Å; A346-G348 PolarHBondContact O-N 3.27Å
347	D	83.3	Confident	92.3	Very high	132 Å²	132	60 Å²	60	71%	0.706	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-6.8	178.1	-53.5	-36.4	0	0	0	113.2	S345 E349	S345-D347 PolarHBondContact O-N 3.44Å; D347-E349 HydrophobicContact CB-CG 4.04Å; D347-E349 PolarHBondContact O-N 3.36Å
348	G	81.8	Confident	92.3	Very high	40 Å²	40	60.5 Å²	60.5	41%	0.412	33%	0.329	S	S	.	.	S	Bend	trans	70.5	5.6	-175	0	0	0	0	0	115	S345 A346	S345-G348 PolarHBondContact O-N 3.49Å; A346-G348 VanDerWaalsContact C-N 3.29Å; A346-G348 PolarHBondContact O-N 3.27Å
349	E	88.1	Confident	92	Very high	62 Å²	62	62.7 Å²	62.7	29%	0.29	34%	0.339	S	S	.	.	S	Bend	trans	-82.1	-27.7	-174.8	-60.5	-154.4	142.5	0	0	114.4	D347 K372 S373 K415	D347-E349 HydrophobicContact CB-CG 4.04Å; D347-E349 PolarHBondContact O-N 3.36Å; E349-K372 CarbonylContact O-C 3.56Å; E349-K372 VanDerWaalsContact O-CA 3.3Å; E349-K372 WeakPolarHBondContact O-CA 3.45Å; E349-S373 WeakPolarHBondContact CA-OG 3.3Å; E349-S373 PolarHBondContact O-N 2.99Å; E349-K415 IonicContact OE1-NZ 3.19Å; E349-K415 PolarHBondContact OE1-NZ 2.85Å
350	Y	91.7	Very high	91.6	Very high	109 Å²	109	64.2 Å²	64.2	43%	0.427	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.5	-179.7	-59.1	-88	0	0	0	109.2	S345 E371 K372	S345-Y350 PolarHBondContact N-O 2.84Å; Y350-E371 WeakPolarHBondContact CA-O 3.42Å; Y350-K372 HydrophobicContact CD1-CB 4.4Å; Y350-K372 HydrophobicContact CD1-CD 4.37Å; Y350-K372 HydrophobicContact CD1-CG 4.12Å; Y350-K372 HydrophobicContact CE1-CD 3.67Å; Y350-K372 HydrophobicContact CE1-CG 3.86Å; Y350-K372 WeakPolarHBondContact OH-CE 3.36Å; Y350-K372 PolarHBondContact OH-NZ 3.48Å
351	N	93.2	Very high	90.9	Very high	34 Å²	34	66.4 Å²	66.4	18%	0.182	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	140.6	174	-55.1	-44	0	0	0	109.6	F342 F343 A344 E371	F342-N351 HydrophobicContact CE2-CB 4.07Å; F342-N351 HydrophobicContact CZ-CB 4.23Å; F343-N351 CarbonylContact O-C 3.57Å; F343-N351 VanDerWaalsContact O-CA 3.31Å; F343-N351 WeakPolarHBondContact O-CA 3.34Å; A344-N351 WeakPolarHBondContact CB-OD1 3.5Å; N351-E371 HydrophobicContact CB-CB 4.26Å; N351-E371 PolarHBondContact N-O 3.37Å; N351-E371 PolarHBondContact O-N 2.9Å
352	A	94.3	Very high	90.4	Very high	25 Å²	25	65.7 Å²	65.7	21%	0.207	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	133.6	172.8	0	0	0	0	0	109.3	F343 I369 L370	F343-A352 HydrophobicContact CB-CB 4.34Å; F343-A352 HydrophobicContact CD1-CB 4.26Å; F343-A352 PolarHBondContact N-O 2.82Å; F343-A352 PolarHBondContact O-N 3.31Å; A352-I369 CarbonylContact C-O 3.5Å; A352-I369 VanDerWaalsContact CA-O 3.29Å; A352-I369 WeakPolarHBondContact CA-O 3.49Å; A352-L370 HydrophobicContact CB-CD2 3.76Å
353	R	95.5	Very high	90.1	Very high	100 Å²	100	66.6 Å²	66.6	38%	0.377	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	125.5	174.9	-177.1	178.9	-73.9	152.8	-0.4	109.6	L341 F342 L368 I369	L341-R353 CarbonylContact O-C 3.52Å; L341-R353 VanDerWaalsContact O-CA 3.26Å; L341-R353 WeakPolarHBondContact O-CA 3.4Å; F342-R353 HydrophobicContact CD2-CB 4.26Å; R353-L368 CarbonylContact O-C 3.54Å; R353-L368 WeakPolarHBondContact O-CA 3.3Å; R353-I369 HydrophobicContact CB-CB 4.21Å; R353-I369 PolarHBondContact N-O 2.88Å; R353-I369 PolarHBondContact O-N 2.91Å
354	I	96.3	Very high	90.1	Very high	77 Å²	77	63.6 Å²	63.6	40%	0.395	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	123.4	170.4	-61.6	169.2	0	0	0	106.5	E340 L341 L366 S367 L368	E340-I354 CarbonylContact C-O 3.54Å; E340-I354 VanDerWaalsContact CA-O 3.3Å; E340-I354 WeakPolarHBondContact CA-O 3.49Å; L341-I354 HydrophobicContact CB-CB 4.4Å; L341-I354 PolarHBondContact N-O 2.98Å; L341-I354 PolarHBondContact O-N 3.18Å; I354-L366 HydrophobicContact CG2-CD1 4.4Å; I354-S367 CarbonylContact C-O 3.52Å; I354-S367 WeakPolarHBondContact CA-O 3.32Å; I354-L368 HydrophobicContact CD1-CD1 4.29Å; I354-L368 HydrophobicContact CG1-CD1 3.55Å
355	S	94.5	Very high	90.1	Very high	12 Å²	12	63.6 Å²	63.6	8%	0.084	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	137.2	175.1	78.8	0	0	0	0	110.9	S339 L366 S367	S339-S355 CarbonylContact O-C 3.49Å; S339-S355 WeakPolarHBondContact O-CA 3.32Å; S355-L366 CarbonylContact O-C 3.57Å; S355-L366 WeakPolarHBondContact O-CA 3.44Å; S355-S367 PolarHBondContact N-O 2.84Å; S355-S367 PolarHBondContact O-N 3Å; S355-S367 PolarHBondContact OG-OG 2.75Å
356	S	94.6	Very high	90.4	Very high	40 Å²	40	66.7 Å²	66.7	28%	0.28	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	134.2	171.6	178.2	0	0	0	0	109.2	S338 S339 S365	S338-S356 CarbonylContact C-O 3.5Å; S338-S356 VanDerWaalsContact CA-O 3.31Å; S338-S356 WeakPolarHBondContact CA-O 3.19Å; S339-S356 PolarHBondContact N-O 3.4Å; S339-S356 PolarHBondContact O-N 3.4Å; S356-S365 CarbonylContact C-O 3.53Å; S356-S365 WeakPolarHBondContact CA-O 3.4Å
357	K	93.5	Very high	90.7	Very high	87 Å²	87	64.4 Å²	64.4	38%	0.378	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	133.3	175.4	-59.5	-175.3	178.1	177	0	108.6	I337 A364 S365	I337-K357 CarbonylContact O-C 3.5Å; I337-K357 WeakPolarHBondContact O-CA 3.42Å; K357-A364 CarbonylContact O-C 3.52Å; K357-A364 VanDerWaalsContact O-CA 3.26Å; K357-A364 WeakPolarHBondContact O-CA 3.33Å; K357-S365 WeakPolarHBondContact CB-OG 3.38Å; K357-S365 PolarHBondContact N-O 2.86Å; K357-S365 PolarHBondContact O-N 2.78Å
358	L	93.8	Very high	91.4	Very high	93 Å²	93	60.9 Å²	60.9	49%	0.487	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	118.6	176.6	-178.6	69	0	0	0	108.1	G336 I337 Y363 A364	G336-L358 CarbonylContact C-O 3.49Å; G336-L358 WeakPolarHBondContact CA-O 3.22Å; I337-L358 PolarHBondContact N-O 2.83Å; I337-L358 PolarHBondContact O-N 3.45Å; L358-Y363 CarbonylContact C-O 3.32Å; L358-Y363 WeakPolarHBondContact CA-O 3.46Å; L358-A364 HydrophobicContact CD1-CB 3.74Å
359	N	88.5	Confident	92	Very high	61 Å²	61	60.8 Å²	60.8	33%	0.326	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	148.2	175.8	-64.1	-11	0	0	0	109.9	S361 G362 Y363	N359-S361 PolarHBondContact O-N 2.82Å; N359-S361 VanDerWaalsContact O-N 3.09Å; N359-G362 PolarHBondContact O-N 2.99Å; N359-Y363 PolarHBondContact N-O 2.99Å
360	A	85.7	Confident	92.4	Very high	79 Å²	79	61.5 Å²	61.5	65%	0.653	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-16.1	175.2	0	0	0	0	0	113.5	P335 G362	P335-A360 HydrophobicContact CB-CB 4.19Å; P335-A360 HydrophobicContact CG-CB 3.65Å; P335-A360 WeakPolarHBondContact O-CB 3.31Å; P335-A360 PolarHBondContact O-N 2.71Å; A360-G362 PolarHBondContact O-N 3.46Å
361	S	81.8	Confident	92.5	Very high	101 Å²	101	59.3 Å²	59.3	71%	0.706	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	2.5	172	68.5	0	0	0	0	113.8	N359 Y363	N359-S361 PolarHBondContact O-N 2.82Å; N359-S361 VanDerWaalsContact O-N 3.09Å; S361-Y363 VanDerWaalsContact C-N 3.34Å
362	G	84.2	Confident	92.5	Very high	54 Å²	54	62 Å²	62	56%	0.557	35%	0.353	S	S	*	.	S	Bend	trans	82.9	8.2	-175.8	0	0	0	0	0	114.2	N359 A360 A364 T426	N359-G362 PolarHBondContact O-N 2.99Å; A360-G362 PolarHBondContact O-N 3.46Å; G362-A364 PolarHBondContact O-N 2.94Å; G362-T426 WeakPolarHBondContact O-CG2 3.36Å; G362-T426 PolarHBondContact O-OG1 2.79Å
363	Y	89.8	Confident	92.3	Very high	78 Å²	78	61.7 Å²	61.7	31%	0.306	35%	0.349	S	S	.	.			trans	-82.5	113.9	172.5	-175	-96.9	0	0	0	109.8	L358 N359 S361 T426 T427	L358-Y363 CarbonylContact C-O 3.32Å; L358-Y363 WeakPolarHBondContact CA-O 3.46Å; N359-Y363 PolarHBondContact N-O 2.99Å; S361-Y363 VanDerWaalsContact C-N 3.34Å; Y363-T426 WeakPolarHBondContact CA-OG1 3.31Å; Y363-T427 HydrophobicContact CD2-CG2 4.37Å; Y363-T427 HydrophobicContact CE2-CG2 4.28Å
364	A	92.6	Very high	91.8	Very high	32 Å²	32	58.8 Å²	58.8	26%	0.264	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	137	169.8	0	0	0	0	0	109.2	K357 L358 G362 N425 T426	K357-A364 CarbonylContact O-C 3.52Å; K357-A364 VanDerWaalsContact O-CA 3.26Å; K357-A364 WeakPolarHBondContact O-CA 3.33Å; L358-A364 HydrophobicContact CD1-CB 3.74Å; G362-A364 PolarHBondContact O-N 2.94Å; A364-N425 CarbonylContact O-C 3.55Å; A364-N425 VanDerWaalsContact O-CA 3.25Å; A364-N425 WeakPolarHBondContact O-CA 3.41Å; A364-T426 HydrophobicContact CB-CG2 3.71Å; A364-T426 PolarHBondContact N-OG1 2.83Å; A364-T426 PolarHBondContact O-N 3.46Å
365	S	93.2	Very high	91.1	Very high	17 Å²	17	58.3 Å²	58.3	12%	0.119	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	141.5	173.4	72.3	0	0	0	0	110.8	S356 K357 V424	S356-S365 CarbonylContact C-O 3.53Å; S356-S365 WeakPolarHBondContact CA-O 3.4Å; K357-S365 WeakPolarHBondContact CB-OG 3.38Å; K357-S365 PolarHBondContact N-O 2.86Å; K357-S365 PolarHBondContact O-N 2.78Å; S365-V424 CarbonylContact C-O 3.53Å; S365-V424 VanDerWaalsContact CA-O 3.29Å; S365-V424 WeakPolarHBondContact CA-O 3.4Å
366	L	95.4	Very high	90	Very high	95 Å²	95	59.8 Å²	59.8	50%	0.497	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	123.3	169.3	180	68.7	0	0	0	107.2	I354 S355 G423 V424	I354-L366 HydrophobicContact CG2-CD1 4.4Å; S355-L366 CarbonylContact O-C 3.57Å; S355-L366 WeakPolarHBondContact O-CA 3.44Å; L366-G423 CarbonylContact O-C 3.55Å; L366-G423 WeakPolarHBondContact O-CA 3.34Å; L366-V424 PolarHBondContact N-O 2.99Å; L366-V424 PolarHBondContact O-N 2.85Å
367	S	94	Very high	88.7	Confident	25 Å²	25	62.3 Å²	62.3	18%	0.175	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	143.7	177	69	0	0	0	0	112.5	I354 S355 I422	I354-S367 CarbonylContact C-O 3.52Å; I354-S367 WeakPolarHBondContact CA-O 3.32Å; S355-S367 PolarHBondContact N-O 2.84Å; S355-S367 PolarHBondContact O-N 3Å; S355-S367 PolarHBondContact OG-OG 2.75Å; S367-I422 CarbonylContact C-O 3.55Å; S367-I422 VanDerWaalsContact CA-O 3.29Å; S367-I422 WeakPolarHBondContact CA-O 3.01Å
368	L	96.3	Very high	87.4	Confident	58 Å²	58	64.4 Å²	64.4	30%	0.304	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	121.1	171.9	174.7	69.5	0	0	0	107.8	R353 I354 L370 T421 I422	R353-L368 CarbonylContact O-C 3.54Å; R353-L368 WeakPolarHBondContact O-CA 3.3Å; I354-L368 HydrophobicContact CD1-CD1 4.29Å; I354-L368 HydrophobicContact CG1-CD1 3.55Å; L368-L370 HydrophobicContact CD1-CD2 4.05Å; L368-L370 HydrophobicContact CD2-CD1 4.37Å; L368-L370 HydrophobicContact CD2-CD2 4.47Å; L368-L370 HydrophobicContact CD2-CG 4.37Å; L368-L370 HydrophobicContact CG-CD2 4.25Å; L368-L370 HydrophobicContact CG-CG 4.2Å; L368-T421 CarbonylContact O-C 3.57Å; L368-T421 VanDerWaalsContact O-CA 3.32Å; L368-T421 WeakPolarHBondContact O-CA 3.44Å; L368-I422 PolarHBondContact N-O 3.24Å; L368-I422 PolarHBondContact O-N 3.01Å
369	I	95.7	Very high	86	Confident	38 Å²	38	60.8 Å²	60.8	20%	0.195	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	122.7	175.5	-49	-175.2	0	0	0	107.3	A352 R353 E371 C420 T421	A352-I369 CarbonylContact C-O 3.5Å; A352-I369 VanDerWaalsContact CA-O 3.29Å; A352-I369 WeakPolarHBondContact CA-O 3.49Å; R353-I369 HydrophobicContact CB-CB 4.21Å; R353-I369 PolarHBondContact N-O 2.88Å; R353-I369 PolarHBondContact O-N 2.91Å; I369-E371 HydrophobicContact CG2-CG 4.02Å; I369-C420 CarbonylContact C-O 3.35Å; I369-C420 WeakPolarHBondContact CA-O 3.42Å; I369-T421 HydrophobicContact CB-CG2 4.24Å; I369-T421 HydrophobicContact CG1-CG2 4.03Å; I369-T421 HydrophobicContact CG2-CG2 3.82Å
370	L	95.9	Very high	84.5	Confident	77 Å²	77	59.8 Å²	59.8	40%	0.403	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	126.9	174.5	-59.3	175.1	0	0	0	107.8	A352 L368 S419 C420	A352-L370 HydrophobicContact CB-CD2 3.76Å; L368-L370 HydrophobicContact CD1-CD2 4.05Å; L368-L370 HydrophobicContact CD2-CD1 4.37Å; L368-L370 HydrophobicContact CD2-CD2 4.47Å; L368-L370 HydrophobicContact CD2-CG 4.37Å; L368-L370 HydrophobicContact CG-CD2 4.25Å; L368-L370 HydrophobicContact CG-CG 4.2Å; L370-S419 CarbonylContact O-C 3.5Å; L370-S419 VanDerWaalsContact O-CA 3.24Å; L370-S419 WeakPolarHBondContact O-CA 3.38Å; L370-C420 PolarHBondContact N-O 2.82Å; L370-C420 PolarHBondContact O-N 2.84Å
371	E	94.1	Very high	83	Confident	62 Å²	62	58.8 Å²	58.8	29%	0.29	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	138.8	178.2	-55.2	-177.1	165.9	0	0	110.2	Y350 N351 I369 I418	Y350-E371 WeakPolarHBondContact CA-O 3.42Å; N351-E371 HydrophobicContact CB-CB 4.26Å; N351-E371 PolarHBondContact N-O 3.37Å; N351-E371 PolarHBondContact O-N 2.9Å; I369-E371 HydrophobicContact CG2-CG 4.02Å; E371-I418 CarbonylContact C-O 3.56Å; E371-I418 WeakPolarHBondContact CA-O 3.29Å
372	K	93.1	Very high	81.7	Confident	92 Å²	92	58.9 Å²	58.9	40%	0.4	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	127.2	172.3	-177.2	178.1	-178.5	168.6	0	109.8	E349 Y350 V374 N417 I418	E349-K372 CarbonylContact O-C 3.56Å; E349-K372 VanDerWaalsContact O-CA 3.3Å; E349-K372 WeakPolarHBondContact O-CA 3.45Å; Y350-K372 HydrophobicContact CD1-CB 4.4Å; Y350-K372 HydrophobicContact CD1-CD 4.37Å; Y350-K372 HydrophobicContact CD1-CG 4.12Å; Y350-K372 HydrophobicContact CE1-CD 3.67Å; Y350-K372 HydrophobicContact CE1-CG 3.86Å; Y350-K372 WeakPolarHBondContact OH-CE 3.36Å; Y350-K372 PolarHBondContact OH-NZ 3.48Å; K372-V374 HydrophobicContact CD-CG2 4.44Å; K372-V374 HydrophobicContact CG-CG2 4.22Å; K372-N417 CarbonylContact O-C 3.52Å; K372-N417 VanDerWaalsContact O-CA 3.32Å; K372-N417 WeakPolarHBondContact O-CA 3.49Å; K372-I418 PolarHBondContact N-O 3.47Å; K372-I418 PolarHBondContact O-N 3.3Å
373	S	89.1	Confident	80.1	Confident	18 Å²	18	64 Å²	64	13%	0.126	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	133.1	170.8	75.9	0	0	0	0	110.5	E349 G416	E349-S373 WeakPolarHBondContact CA-OG 3.3Å; E349-S373 PolarHBondContact O-N 2.99Å; S373-G416 CarbonylContact C-O 3.56Å; S373-G416 WeakPolarHBondContact CA-O 3.29Å
374	V	85.3	Confident	77.8	Confident	39 Å²	39	62.5 Å²	62.5	24%	0.236	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	132.7	-177.5	-178.1	0	0	0	0	109.9	K372 W376 G416 I418	K372-V374 HydrophobicContact CD-CG2 4.44Å; K372-V374 HydrophobicContact CG-CG2 4.22Å; V374-W376 PolarHBondContact O-N 3.17Å; V374-G416 PolarHBondContact N-O 3.39Å; V374-G416 CarbonylContact O-C 3.54Å; V374-G416 PolarHBondContact O-N 2.79Å; V374-G416 VanDerWaalsContact O-O 3.08Å; V374-I418 HydrophobicContact CB-CD1 4.49Å; V374-I418 HydrophobicContact CG2-CD1 3.76Å; V374-I418 HydrophobicContact CG2-CG1 3.91Å
375	S	81.3	Confident	75.1	Confident	66 Å²	66	65.6 Å²	65.6	46%	0.462	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	118.4	173.4	56.1	0	0	0	0	110.8	T377	S375-T377 VanDerWaalsContact C-N 3.31Å; S375-T377 PolarHBondContact O-N 2.82Å
376	W	72.8	Confident	72.3	Confident	43 Å²	43	68.2 Å²	68.2	16%	0.163	39%	0.389	C	S	.	.			trans	-93.2	53.8	178	-60.7	99.2	0	0	0	111.5	V374 W378 L379 N380 I418 A436 Q437 C438	V374-W376 PolarHBondContact O-N 3.17Å; W376-W378 AromaticContact CE3-CE2 3.98Å; W376-W378 AromaticContact CE3-CZ2 3.99Å; W376-W378 HydrophobicContact CE3-CZ2 3.99Å; W376-W378 AromaticContact CE3-NE1 3.51Å; W376-W378 HydrophobicContact CZ3-CZ2 4.08Å; W376-W378 PolarHBondContact O-N 3.36Å; W376-L379 HydrophobicContact CB-CB 4.06Å; W376-L379 HydrophobicContact CB-CD1 4.2Å; W376-L379 HydrophobicContact CD2-CD1 4.33Å; W376-L379 HydrophobicContact CE3-CD1 3.87Å; W376-L379 HydrophobicContact CG-CD1 4.5Å; W376-L379 WeakPolarHBondContact O-CB 3.3Å; W376-L379 PolarHBondContact O-N 2.75Å; W376-N380 PolarHBondContact O-N 2.97Å; W376-I418 HydrophobicContact CH2-CD1 4.37Å; W376-I418 HydrophobicContact CH2-CG1 4.45Å; W376-I418 HydrophobicContact CZ2-CD1 4.29Å; W376-I418 HydrophobicContact CZ2-CG1 3.96Å; W376-A436 HydrophobicContact CZ2-CB 4.32Å; W376-Q437 PolarHBondContact NE1-O 2.82Å; W376-C438 VanDerWaalsContact CB-SG 3.55Å; W376-C438 HydrophobicContact CD2-CB 4.43Å; W376-C438 HydrophobicContact CG-CB 4.14Å
377	T	67.3	Low	69.2	Low	93 Å²	93	69.3 Å²	69.3	57%	0.571	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-35.5	-173.8	51.2	0	0	0	0	113.1	S375 L379 N380	S375-T377 VanDerWaalsContact C-N 3.31Å; S375-T377 PolarHBondContact O-N 2.82Å; T377-L379 VanDerWaalsContact C-N 3.28Å; T377-L379 PolarHBondContact O-N 2.83Å; T377-N380 CarbonylContact O-C 3.53Å; T377-N380 PolarHBondContact O-N 3.26Å
378	W	65.1	Low	66.3	Low	132 Å²	132	75.1 Å²	75.1	50%	0.5	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-23.5	176.6	68.2	-86.9	0	0	0	113.5	W376 F497 R501	W376-W378 AromaticContact CE3-CE2 3.98Å; W376-W378 AromaticContact CE3-CZ2 3.99Å; W376-W378 HydrophobicContact CE3-CZ2 3.99Å; W376-W378 AromaticContact CE3-NE1 3.51Å; W376-W378 HydrophobicContact CZ3-CZ2 4.08Å; W376-W378 PolarHBondContact O-N 3.36Å; W378-F497 HydrophobicContact CH2-CD1 4.49Å; W378-F497 AromaticContact CH2-CE1 3.75Å; W378-F497 HydrophobicContact CH2-CE1 3.75Å; W378-F497 AromaticContact CZ3-CE1 3.97Å; W378-F497 HydrophobicContact CZ3-CE1 3.97Å; W378-R501 PolarHBondContact O-NH1 2.92Å; W378-R501 PolarHBondContact O-NH2 3.04Å
379	L	64.3	Low	63.4	Low	17 Å²	17	78.9 Å²	78.9	9%	0.089	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-24.3	177.4	-108.1	128.6	0	0	0	113.3	W376 T377 F497	W376-L379 HydrophobicContact CB-CB 4.06Å; W376-L379 HydrophobicContact CB-CD1 4.2Å; W376-L379 HydrophobicContact CD2-CD1 4.33Å; W376-L379 HydrophobicContact CE3-CD1 3.87Å; W376-L379 HydrophobicContact CG-CD1 4.5Å; W376-L379 WeakPolarHBondContact O-CB 3.3Å; W376-L379 PolarHBondContact O-N 2.75Å; T377-L379 VanDerWaalsContact C-N 3.28Å; T377-L379 PolarHBondContact O-N 2.83Å; L379-F497 HydrophobicContact CD1-CE1 4.48Å; L379-F497 HydrophobicContact CD1-CZ 4.29Å; L379-F497 HydrophobicContact CD2-CE1 4.28Å; L379-F497 HydrophobicContact CD2-CE2 3.98Å; L379-F497 HydrophobicContact CD2-CZ 3.36Å; L379-F497 HydrophobicContact CG-CE1 4.41Å; L379-F497 HydrophobicContact CG-CZ 3.92Å
380	N	58.2	Low	60.6	Low	40 Å²	40	85.9 Å²	85.9	21%	0.214	48%	0.477	C	S	.	.	S	Bend	trans	-138	74.6	-177.7	-122	-14.4	0	0	0	109.4	W376 T377 Q439 I440	W376-N380 PolarHBondContact O-N 2.97Å; T377-N380 CarbonylContact O-C 3.53Å; T377-N380 PolarHBondContact O-N 3.26Å; N380-Q439 PolarHBondContact ND2-O 2.88Å; N380-I440 VanDerWaalsContact ND2-C 3.25Å; N380-I440 PolarHBondContact ND2-O 2.89Å; N380-I440 PolarHBondContact OD1-O 2.96Å
381	P	53.7	Low	57.9	Low	58 Å²	58	90.5 Å²	90.5	38%	0.377	50%	0.496	S	S	.	.			trans	-61.2	141.7	175.7	25.7	-32.6	0	0	0	109.4	R383 L509	P381-R383 PolarHBondContact O-N 3.37Å; P381-L509 HydrophobicContact CG-CD2 4.5Å
382	P	53.4	Low	55	Low	102 Å²	102	95 Å²	95	66%	0.662	52%	0.522	S	S	*	.			trans	-56	127	-178.1	22.2	-32.1	0	0	0	109.9	G384	P382-G384 PolarHBondContact O-N 3.17Å
383	R	51.7	Low	52.3	Low	161 Å²	161	96.6 Å²	96.6	61%	0.608	54%	0.54	S	S	*	.	S	Bend	trans	-79.8	66.2	-179.4	-67.4	-176.3	-178.2	-179.2	0.1	110.5	P381	P381-R383 PolarHBondContact O-N 3.37Å
384	G	42	Very low	49.9	Very low	47 Å²	47	101.2 Å²	101.2	49%	0.485	57%	0.569	S	S	.	*	S	Bend	trans	100	102.1	156.1	0	0	0	0	0	117.4	P382	P382-G384 PolarHBondContact O-N 3.17Å
385	S	35.7	Very low	47.6	Very low	98 Å²	98	108.2 Å²	108.2	69%	0.685	60%	0.599	S	S	*	*	S	Bend		-153.7	157.5	107.6	69.2	0	0	0	0	104.9	V387	S385-V387 PolarHBondContact O-N 2.76Å
386	G	33.1	Very low	45.5	Very low	71 Å²	71	109.5 Å²	109.5	73%	0.732	61%	0.606	S	S	*	*			trans	-54.6	114.2	-176.9	0	0	0	0	0	110.3	I388	G386-I388 PolarHBondContact O-N 3.49Å
387	V	32.3	Very low	43.7	Very low	119 Å²	119	115.6 Å²	115.6	72%	0.721	64%	0.642	S	S	*	*			trans	-68.3	88.2	170.3	179.5	0	0	0	0	106.2	S385	S385-V387 PolarHBondContact O-N 2.76Å
388	I	33	Very low	42.1	Very low	147 Å²	147	113 Å²	113	75%	0.754	63%	0.627	S	S	*	*			trans	-84	126.4	151.1	-62.3	174.7	0	0	0	104.4	G386 K390	G386-I388 PolarHBondContact O-N 3.49Å; I388-K390 PolarHBondContact O-N 3.42Å; I388-K390 VanDerWaalsContact O-N 3.11Å
389	D	34.4	Very low	40.5	Very low	137 Å²	137	115.3 Å²	115.3	73%	0.733	64%	0.643	S	S	*	*			trans	-48.4	117.3	173.6	-71	-43.9	0	0	0	109.9	E391	D389-E391 PolarHBondContact O-N 2.78Å
390	K	37.2	Very low	39.3	Very low	184 Å²	184	123.2 Å²	123.2	80%	0.8	67%	0.672	S	S	*	*	S	Bend	trans	-73.8	40.3	-176.9	-79.8	-172	172.7	-179.3	0	112.4	I388 D404	I388-K390 PolarHBondContact O-N 3.42Å; I388-K390 VanDerWaalsContact O-N 3.11Å; K390-D404 IonicContact NZ-OD2 2.8Å; K390-D404 PolarHBondContact NZ-OD2 2.99Å
391	E	39.1	Very low	38.2	Very low	174 Å²	174	123.5 Å²	123.5	81%	0.813	68%	0.68	S	S	*	*	S	Bend	trans	-89.5	-5.1	-177.4	-111.8	-178.8	178.9	0	0	114.8	D389	D389-E391 PolarHBondContact O-N 2.78Å
392	N	33.9	Very low	37.3	Very low	157 Å²	157	125.7 Å²	125.7	84%	0.84	69%	0.689	S	S	*	*	S	Bend	trans	-150.3	25.3	-172.4	-97.2	-29.3	0	0	0	118.8
393	V	36.2	Very low	36.6	Very low	126 Å²	126	124.4 Å²	124.4	76%	0.764	68%	0.682	S	S	*	*			trans	-114.2	118.1	176.7	-173.4	0	0	0	0	111.4	Q395	V393-Q395 PolarHBondContact O-N 2.87Å
394	P	37.9	Very low	35.8	Very low	114 Å²	114	119.8 Å²	119.8	74%	0.74	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-64.2	130.1	169.2	-7.5	21.5	0	0	0	109.3	P396	P394-P396 WeakPolarHBondContact O-CD 3.45Å
395	Q	37.6	Very low	35.5	Very low	186 Å²	186	122.2 Å²	122.2	87%	0.869	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-52.9	124.4	176.1	-77.4	172.7	-50.6	0	0	111.1	V393	V393-Q395 PolarHBondContact O-N 2.87Å
396	P	37.1	Very low	35.4	Very low	93 Å²	93	121.3 Å²	121.3	60%	0.604	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-86.1	137.8	158.8	30.9	-23.9	0	0	0	109.3	P394 C398	P394-P396 WeakPolarHBondContact O-CD 3.45Å; P396-C398 PolarHBondContact O-N 3.24Å
397	D	35.2	Very low	35.7	Very low	171 Å²	171	121.2 Å²	121.2	91%	0.914	65%	0.647	S	S	*	*			trans	-66.7	57.3	178	-62.8	-40.4	0	0	0	113
398	C	32.4	Very low	36	Very low	39 Å²	39	120.3 Å²	120.3	26%	0.264	64%	0.637	S	S	.	*			trans	-110.5	101	-173.4	-89	0	0	0	0	110.6	P396 W400 A401	P396-C398 PolarHBondContact O-N 3.24Å; C398-W400 HydrophobicContact CB-CD2 4.05Å; C398-W400 HydrophobicContact CB-CG 4.43Å; C398-W400 HydrophobicContact CB-CH2 4.29Å; C398-W400 HydrophobicContact CB-CZ2 3.49Å; C398-W400 VanDerWaalsContact CB-CZ2 3.49Å; C398-W400 VanDerWaalsContact CB-NE1 3.28Å; C398-W400 PolarHBondContact O-N 3.22Å; C398-W400 VanDerWaalsContact SG-CE2 3.56Å; C398-W400 WeakPolarHBondContact SG-CZ2 3.37Å; C398-W400 PolarHBondContact SG-NE1 3.32Å; C398-A401 PolarHBondContact O-N 3.09Å
399	E	32.9	Very low	36.3	Very low	181 Å²	181	119 Å²	119	85%	0.846	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-56.2	-7.5	179.2	-70.9	177	143.3	0	0	115.4	A401	E399-A401 VanDerWaalsContact C-N 3.29Å
400	W	39.1	Very low	36.8	Very low	182 Å²	182	117.8 Å²	117.8	69%	0.689	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-84.8	-0.4	173.3	44	-89.7	0	0	0	113.6	C398	C398-W400 HydrophobicContact CB-CD2 4.05Å; C398-W400 HydrophobicContact CB-CG 4.43Å; C398-W400 HydrophobicContact CB-CH2 4.29Å; C398-W400 HydrophobicContact CB-CZ2 3.49Å; C398-W400 VanDerWaalsContact CB-CZ2 3.49Å; C398-W400 VanDerWaalsContact CB-NE1 3.28Å; C398-W400 PolarHBondContact O-N 3.22Å; C398-W400 VanDerWaalsContact SG-CE2 3.56Å; C398-W400 WeakPolarHBondContact SG-CZ2 3.37Å; C398-W400 PolarHBondContact SG-NE1 3.32Å
401	A	35	Very low	37.1	Very low	47 Å²	47	114.6 Å²	114.6	39%	0.388	61%	0.606	S	S	.	*	G	3₁₀ helix	trans	-88.7	4.4	171.7	0	0	0	0	0	113.9	C398 E399 S403 D404	C398-A401 PolarHBondContact O-N 3.09Å; E399-A401 VanDerWaalsContact C-N 3.29Å; A401-S403 PolarHBondContact O-N 3.35Å; A401-D404 WeakPolarHBondContact O-CB 3.32Å; A401-D404 PolarHBondContact O-N 3.26Å
402	D	34.4	Very low	37.4	Very low	104 Å²	104	116.3 Å²	116.3	56%	0.556	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-1.4	177.1	-93	-28.7	0	0	0	114.6	D404 N405	D402-D404 PolarHBondContact O-N 3.08Å; D402-N405 PolarHBondContact O-N 2.93Å; D402-N405 PolarHBondContact OD1-ND2 2.94Å
403	S	38.5	Very low	38.3	Very low	75 Å²	75	116 Å²	116	52%	0.524	59%	0.592	S	S	.	*	H	α-helix	trans	-62.6	-26.8	162	57.7	0	0	0	0	112.6	A401 N405 C406 D407	A401-S403 PolarHBondContact O-N 3.35Å; S403-N405 VanDerWaalsContact C-N 3.32Å; S403-N405 PolarHBondContact O-N 3.15Å; S403-C406 WeakPolarHBondContact O-CB 3.46Å; S403-C406 PolarHBondContact O-N 3.36Å; S403-D407 PolarHBondContact O-N 2.76Å
404	D	35.8	Very low	39.5	Very low	63 Å²	63	111.6 Å²	111.6	34%	0.337	57%	0.567	S	S	.	*	H	α-helix	trans	-73.2	-22.8	-177.4	-75.5	19.4	0	0	0	112.3	K390 A401 D402 D407 L408	K390-D404 IonicContact NZ-OD2 2.8Å; K390-D404 PolarHBondContact NZ-OD2 2.99Å; A401-D404 WeakPolarHBondContact O-CB 3.32Å; A401-D404 PolarHBondContact O-N 3.26Å; D402-D404 PolarHBondContact O-N 3.08Å; D404-D407 PolarHBondContact O-N 3.48Å; D404-L408 PolarHBondContact O-N 2.87Å
405	N	34.4	Very low	41.2	Very low	98 Å²	98	110.2 Å²	110.2	52%	0.524	55%	0.549	S	S	.	.	H	α-helix	trans	-75	-32.1	174.3	-89.5	-31.7	0	0	0	112.3	D402 S403 D407 L408 E409	D402-N405 PolarHBondContact O-N 2.93Å; D402-N405 PolarHBondContact OD1-ND2 2.94Å; S403-N405 VanDerWaalsContact C-N 3.32Å; S403-N405 PolarHBondContact O-N 3.15Å; N405-D407 PolarHBondContact O-N 2.79Å; N405-L408 PolarHBondContact O-N 2.8Å; N405-E409 PolarHBondContact O-N 2.73Å
406	C	33.3	Very low	43.4	Very low	79 Å²	79	101.5 Å²	101.5	53%	0.534	51%	0.51	S	S	.	.	H	α-helix	trans	-62.5	-34.9	168.3	-98.9	0	0	0	0	111.4	S403 Q410	S403-C406 WeakPolarHBondContact O-CB 3.46Å; S403-C406 PolarHBondContact O-N 3.36Å; C406-Q410 WeakPolarHBondContact O-CB 3.3Å; C406-Q410 VanDerWaalsContact O-CG 3.24Å; C406-Q410 WeakPolarHBondContact O-CG 3.26Å; C406-Q410 PolarHBondContact O-N 3.04Å
407	D	40.4	Very low	46	Very low	69 Å²	69	99.3 Å²	99.3	37%	0.369	49%	0.493	S	S	.	.	H	α-helix	trans	-71.6	-32.7	-179	-70.3	-21.3	0	0	0	112.5	S403 D404 N405 Q410 Q411	S403-D407 PolarHBondContact O-N 2.76Å; D404-D407 PolarHBondContact O-N 3.48Å; N405-D407 PolarHBondContact O-N 2.79Å; D407-Q410 PolarHBondContact O-N 2.79Å; D407-Q411 VanDerWaalsContact O-CB 3.25Å; D407-Q411 WeakPolarHBondContact O-CB 3.25Å; D407-Q411 WeakPolarHBondContact O-CG 3.36Å; D407-Q411 PolarHBondContact O-N 2.84Å
408	L	37.5	Very low	48.7	Very low	100 Å²	100	94.4 Å²	94.4	52%	0.524	47%	0.466	S	S	.	.	H	α-helix	trans	-68.9	-40.6	175.4	-75.1	166.4	0	0	0	112.8	D404 N405 Q411 R412	D404-L408 PolarHBondContact O-N 2.87Å; N405-L408 PolarHBondContact O-N 2.8Å; L408-Q411 PolarHBondContact O-N 2.99Å; L408-R412 PolarHBondContact O-N 3.17Å; L408-R412 VanDerWaalsContact O-N 3.15Å
409	E	41	Very low	51.6	Low	119 Å²	119	93.4 Å²	93.4	56%	0.556	46%	0.459	S	S	*	.	H	α-helix	trans	-67.6	-40	171.9	-78.3	-154.9	168.7	0	0	111.9	N405 Q411 R412 R413	N405-E409 PolarHBondContact O-N 2.73Å; E409-Q411 VanDerWaalsContact C-N 3.31Å; E409-Q411 PolarHBondContact O-N 2.74Å; E409-R412 PolarHBondContact O-N 2.8Å; E409-R413 VanDerWaalsContact O-CG 3.31Å; E409-R413 WeakPolarHBondContact O-CG 3.41Å; E409-R413 PolarHBondContact O-N 3.26Å; E409-R413 VanDerWaalsContact O-N 3.09Å; E409-R413 IonicContact OE2-CZ 2.8Å; E409-R413 IonicContact OE2-NH2 2.72Å; E409-R413 PolarHBondContact OE2-NH2 2.93Å
410	Q	43.2	Very low	54.6	Low	113 Å²	113	86.4 Å²	86.4	53%	0.528	43%	0.43	S	S	.	.	H	α-helix	trans	-65.9	-34.2	175.3	-76.6	176.1	3.6	0	0	112.1	C406 D407 R413 S414	C406-Q410 WeakPolarHBondContact O-CB 3.3Å; C406-Q410 VanDerWaalsContact O-CG 3.24Å; C406-Q410 WeakPolarHBondContact O-CG 3.26Å; C406-Q410 PolarHBondContact O-N 3.04Å; D407-Q410 PolarHBondContact O-N 2.79Å; Q410-R413 PolarHBondContact O-N 3.3Å; Q410-S414 PolarHBondContact O-N 3.34Å
411	Q	43.6	Very low	57.3	Low	117 Å²	117	78.9 Å²	78.9	55%	0.547	40%	0.404	S	S	.	.	H	α-helix	trans	-64.1	-44.3	173.9	-84.4	178.3	-12.6	0	0	111.6	D407 L408 E409 R413 S414	D407-Q411 VanDerWaalsContact O-CB 3.25Å; D407-Q411 WeakPolarHBondContact O-CB 3.25Å; D407-Q411 WeakPolarHBondContact O-CG 3.36Å; D407-Q411 PolarHBondContact O-N 2.84Å; L408-Q411 PolarHBondContact O-N 2.99Å; E409-Q411 VanDerWaalsContact C-N 3.31Å; E409-Q411 PolarHBondContact O-N 2.74Å; Q411-R413 VanDerWaalsContact C-N 3.27Å; Q411-R413 PolarHBondContact O-N 2.86Å; Q411-S414 PolarHBondContact O-N 2.87Å; Q411-S414 PolarHBondContact O-OG 2.81Å
412	R	46.9	Very low	60.1	Low	209 Å²	209	80.6 Å²	80.6	79%	0.789	41%	0.406	S	S	*	.	H	α-helix	trans	-61.2	-35.9	172.6	-76.2	-171.5	-176.3	-173.9	2.4	112.4	L408 E409 S414	L408-R412 PolarHBondContact O-N 3.17Å; L408-R412 VanDerWaalsContact O-N 3.15Å; E409-R412 PolarHBondContact O-N 2.8Å; R412-S414 PolarHBondContact O-N 2.86Å
413	R	52.8	Low	62.9	Low	152 Å²	152	76 Å²	76	57%	0.574	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-9.6	178.5	-71.3	174.3	-171.9	174.9	11.1	114	E409 Q410 Q411 Q439	E409-R413 VanDerWaalsContact O-CG 3.31Å; E409-R413 WeakPolarHBondContact O-CG 3.41Å; E409-R413 PolarHBondContact O-N 3.26Å; E409-R413 VanDerWaalsContact O-N 3.09Å; E409-R413 IonicContact OE2-CZ 2.8Å; E409-R413 IonicContact OE2-NH2 2.72Å; E409-R413 PolarHBondContact OE2-NH2 2.93Å; Q410-R413 PolarHBondContact O-N 3.3Å; Q411-R413 VanDerWaalsContact C-N 3.27Å; Q411-R413 PolarHBondContact O-N 2.86Å; R413-Q439 PolarHBondContact O-NE2 2.83Å; R413-Q439 VanDerWaalsContact O-NE2 3.08Å; R413-Q439 PolarHBondContact O-OE1 3.43Å
414	S	60.5	Low	65.5	Low	32 Å²	32	76.6 Å²	76.6	22%	0.224	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	0.4	-179.3	75.9	0	0	0	0	115.2	Q410 Q411 R412 G416	Q410-S414 PolarHBondContact O-N 3.34Å; Q411-S414 PolarHBondContact O-N 2.87Å; Q411-S414 PolarHBondContact O-OG 2.81Å; R412-S414 PolarHBondContact O-N 2.86Å; S414-G416 PolarHBondContact O-N 3.47Å
415	K	73.9	Confident	68	Low	85 Å²	85	74.3 Å²	74.3	37%	0.37	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	128	176.7	-66	-168.8	178.3	-169.3	0	110.2	E349	E349-K415 IonicContact OE1-NZ 3.19Å; E349-K415 PolarHBondContact OE1-NZ 2.85Å
416	G	83.7	Confident	70.5	Confident	4 Å²	4	73.2 Å²	73.2	4%	0.041	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-173.9	164.8	0	0	0	0	0	110.6	S373 V374 S414 Q437	S373-G416 CarbonylContact C-O 3.56Å; S373-G416 WeakPolarHBondContact CA-O 3.29Å; V374-G416 PolarHBondContact N-O 3.39Å; V374-G416 CarbonylContact O-C 3.54Å; V374-G416 PolarHBondContact O-N 2.79Å; V374-G416 VanDerWaalsContact O-O 3.08Å; S414-G416 PolarHBondContact O-N 3.47Å; G416-Q437 CarbonylContact C-O 3.56Å; G416-Q437 WeakPolarHBondContact CA-O 3.37Å
417	N	90.6	Very high	72.8	Confident	47 Å²	47	72.5 Å²	72.5	25%	0.251	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	144.5	-176.1	-66.5	-0.9	0	0	0	111.1	K372 A436 Q437	K372-N417 CarbonylContact O-C 3.52Å; K372-N417 VanDerWaalsContact O-CA 3.32Å; K372-N417 WeakPolarHBondContact O-CA 3.49Å; N417-A436 CarbonylContact O-C 3.6Å; N417-A436 WeakPolarHBondContact O-CA 3.44Å; N417-Q437 PolarHBondContact N-O 3.42Å; N417-Q437 PolarHBondContact O-N 2.75Å
418	I	93.1	Very high	74.5	Confident	67 Å²	67	69.3 Å²	69.3	34%	0.344	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.2	164.7	-59.7	178.9	0	0	0	106.9	E371 K372 V374 W376 G435	E371-I418 CarbonylContact C-O 3.56Å; E371-I418 WeakPolarHBondContact CA-O 3.29Å; K372-I418 PolarHBondContact N-O 3.47Å; K372-I418 PolarHBondContact O-N 3.3Å; V374-I418 HydrophobicContact CB-CD1 4.49Å; V374-I418 HydrophobicContact CG2-CD1 3.76Å; V374-I418 HydrophobicContact CG2-CG1 3.91Å; W376-I418 HydrophobicContact CH2-CD1 4.37Å; W376-I418 HydrophobicContact CH2-CG1 4.45Å; W376-I418 HydrophobicContact CZ2-CD1 4.29Å; W376-I418 HydrophobicContact CZ2-CG1 3.96Å; I418-G435 CarbonylContact C-O 3.57Å; I418-G435 WeakPolarHBondContact CA-O 3.33Å
419	S	93.3	Very high	76.8	Confident	19 Å²	19	69.3 Å²	69.3	13%	0.133	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	142.1	179.5	62.1	0	0	0	0	112.1	L370 G435	L370-S419 CarbonylContact O-C 3.5Å; L370-S419 VanDerWaalsContact O-CA 3.24Å; L370-S419 WeakPolarHBondContact O-CA 3.38Å; S419-G435 PolarHBondContact N-O 2.88Å; S419-G435 PolarHBondContact O-N 3.24Å
420	C	95.9	Very high	79	Confident	33 Å²	33	64.5 Å²	64.5	22%	0.223	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	136	171.8	-179.1	0	0	0	0	108.3	I369 L370 T433	I369-C420 CarbonylContact C-O 3.35Å; I369-C420 WeakPolarHBondContact CA-O 3.42Å; L370-C420 PolarHBondContact N-O 2.82Å; L370-C420 PolarHBondContact O-N 2.84Å; C420-T433 WeakPolarHBondContact CA-O 3.37Å
421	T	94.4	Very high	81.4	Confident	24 Å²	24	60.8 Å²	60.8	15%	0.147	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	121.7	-165.6	149	0	0	0	0	106.7	L368 I369 F432 T433	L368-T421 CarbonylContact O-C 3.57Å; L368-T421 VanDerWaalsContact O-CA 3.32Å; L368-T421 WeakPolarHBondContact O-CA 3.44Å; I369-T421 HydrophobicContact CB-CG2 4.24Å; I369-T421 HydrophobicContact CG1-CG2 4.03Å; I369-T421 HydrophobicContact CG2-CG2 3.82Å; T421-F432 CarbonylContact O-C 3.59Å; T421-F432 WeakPolarHBondContact O-CA 3.42Å; T421-T433 WeakPolarHBondContact CB-OG1 3.23Å; T421-T433 WeakPolarHBondContact CG2-OG1 3.42Å; T421-T433 PolarHBondContact N-O 3.32Å; T421-T433 PolarHBondContact O-N 2.84Å; T421-T433 PolarHBondContact OG1-OG1 3.41Å
422	I	95.1	Very high	83.7	Confident	83 Å²	83	59 Å²	59	43%	0.426	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	114.8	-179.6	-56	172.9	0	0	0	106.2	S367 L368 F432	S367-I422 CarbonylContact C-O 3.55Å; S367-I422 VanDerWaalsContact CA-O 3.29Å; S367-I422 WeakPolarHBondContact CA-O 3.01Å; L368-I422 PolarHBondContact N-O 3.24Å; L368-I422 PolarHBondContact O-N 3.01Å; I422-F432 HydrophobicContact CG1-CD2 4.02Å; I422-F432 HydrophobicContact CG1-CE2 4.29Å
423	G	92.3	Very high	86	Confident	8 Å²	8	49.6 Å²	49.6	8%	0.082	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	141.2	-176.3	0	0	0	0	0	112	L366 G430 E431	L366-G423 CarbonylContact O-C 3.55Å; L366-G423 WeakPolarHBondContact O-CA 3.34Å; G423-G430 CarbonylContact O-C 3.42Å; G423-G430 WeakPolarHBondContact O-CA 3.41Å; G423-E431 PolarHBondContact N-O 3.01Å; G423-E431 PolarHBondContact O-N 2.97Å
424	V	93.1	Very high	87.9	Confident	88 Å²	88	46 Å²	46	53%	0.533	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.2	166.3	172.9	0	0	0	0	106	S365 L366 I429	S365-V424 CarbonylContact C-O 3.53Å; S365-V424 VanDerWaalsContact CA-O 3.29Å; S365-V424 WeakPolarHBondContact CA-O 3.4Å; L366-V424 PolarHBondContact N-O 2.99Å; L366-V424 PolarHBondContact O-N 2.85Å; V424-I429 WeakPolarHBondContact CG1-O 3.04Å
425	N	88.3	Confident	89.5	Confident	15 Å²	15	44.6 Å²	44.6	8%	0.08	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	158.2	177.8	57.3	8.5	0	0	0	109.9	A364 T427 D428 I429	A364-N425 CarbonylContact O-C 3.55Å; A364-N425 VanDerWaalsContact O-CA 3.25Å; A364-N425 WeakPolarHBondContact O-CA 3.41Å; N425-T427 PolarHBondContact O-N 2.8Å; N425-D428 WeakPolarHBondContact OD1-CA 3.43Å; N425-D428 WeakPolarHBondContact OD1-CB 3.41Å; N425-D428 PolarHBondContact OD1-N 2.8Å; N425-I429 VanDerWaalsContact O-CA 3.26Å; N425-I429 WeakPolarHBondContact O-CA 3.39Å; N425-I429 PolarHBondContact O-N 2.84Å; N425-I429 PolarHBondContact OD1-N 3.09Å
426	T	87.6	Confident	90.4	Very high	75 Å²	75	42.5 Å²	42.5	46%	0.46	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-21	-177.6	52.2	0	0	0	0	113.4	G362 Y363 A364	G362-T426 WeakPolarHBondContact O-CG2 3.36Å; G362-T426 PolarHBondContact O-OG1 2.79Å; Y363-T426 WeakPolarHBondContact CA-OG1 3.31Å; A364-T426 HydrophobicContact CB-CG2 3.71Å; A364-T426 PolarHBondContact N-OG1 2.83Å; A364-T426 PolarHBondContact O-N 3.46Å
427	T	81.7	Confident	90.7	Very high	63 Å²	63	45.2 Å²	45.2	39%	0.387	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-71.1	172.1	61.4	0	0	0	0	109.6	Y363 N425 I429 Q455	Y363-T427 HydrophobicContact CD2-CG2 4.37Å; Y363-T427 HydrophobicContact CE2-CG2 4.28Å; N425-T427 PolarHBondContact O-N 2.8Å; T427-I429 VanDerWaalsContact C-N 3.33Å; T427-I429 PolarHBondContact O-N 3.33Å; T427-Q455 PolarHBondContact O-NE2 2.76Å; T427-Q455 PolarHBondContact O-OE1 2.94Å
428	D	76.6	Confident	90.5	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.011	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-6.5	-165.6	-56.4	13	0	0	0	113.9	N425 G430 R451 S453 K456	N425-D428 WeakPolarHBondContact OD1-CA 3.43Å; N425-D428 WeakPolarHBondContact OD1-CB 3.41Å; N425-D428 PolarHBondContact OD1-N 2.8Å; D428-G430 PolarHBondContact O-N 3.04Å; D428-R451 IonicContact OD2-CZ 3.2Å; D428-R451 IonicContact OD2-NH2 3.69Å; D428-R451 PolarHBondContact OD2-NH2 3.48Å; D428-S453 WeakPolarHBondContact CB-OG 3.49Å; D428-S453 PolarHBondContact OD2-OG 2.93Å; D428-S453 VanDerWaalsContact OD2-OG 3.13Å; D428-K456 WeakPolarHBondContact OD1-CE 3.13Å; D428-K456 IonicContact OD1-NZ 2.81Å; D428-K456 IonicContact OD2-NZ 3.85Å
429	I	84.6	Confident	90	Very high	100 Å²	100	41.3 Å²	41.3	51%	0.513	24%	0.238	S	C	.	.	S	Bend	trans	63.2	-45.8	-176.6	-56.2	172.3	0	0	0	113.2	V424 N425 T427 I454	V424-I429 WeakPolarHBondContact CG1-O 3.04Å; N425-I429 VanDerWaalsContact O-CA 3.26Å; N425-I429 WeakPolarHBondContact O-CA 3.39Å; N425-I429 PolarHBondContact O-N 2.84Å; N425-I429 PolarHBondContact OD1-N 3.09Å; T427-I429 VanDerWaalsContact C-N 3.33Å; T427-I429 PolarHBondContact O-N 3.33Å; I429-I454 HydrophobicContact CB-CD1 4.45Å; I429-I454 HydrophobicContact CG2-CD1 4.35Å
430	G	88.4	Confident	89.2	Confident	18 Å²	18	42.2 Å²	42.2	19%	0.186	24%	0.241	C	C	.	.			trans	-151.9	130.5	177.4	0	0	0	0	0	111.3	G423 D428 I454	G423-G430 CarbonylContact O-C 3.42Å; G423-G430 WeakPolarHBondContact O-CA 3.41Å; D428-G430 PolarHBondContact O-N 3.04Å; G430-I454 PolarHBondContact O-N 3.37Å
431	E	91.9	Very high	88.2	Confident	35 Å²	35	42.6 Å²	42.6	16%	0.164	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	127.8	177.2	-177.7	179.6	172.5	0	0	109.1	G423 T433 R451 L452	G423-E431 PolarHBondContact N-O 3.01Å; G423-E431 PolarHBondContact O-N 2.97Å; E431-T433 HydrophobicContact CG-CG2 3.83Å; E431-T433 WeakPolarHBondContact OE1-CG2 3.14Å; E431-R451 VanDerWaalsContact CD-NE 3.28Å; E431-R451 HydrophobicContact CG-CG 4.13Å; E431-R451 VanDerWaalsContact OE1-CD 3.29Å; E431-R451 WeakPolarHBondContact OE1-CD 3.37Å; E431-R451 IonicContact OE1-CZ 2.71Å; E431-R451 IonicContact OE1-NE 3.17Å; E431-R451 PolarHBondContact OE1-NE 2.95Å; E431-R451 IonicContact OE1-NH1 3.73Å; E431-R451 PolarHBondContact OE1-NH1 2.99Å; E431-R451 IonicContact OE1-NH2 3.67Å; E431-R451 PolarHBondContact OE1-NH2 2.97Å; E431-R451 IonicContact OE2-CZ 3.95Å; E431-R451 IonicContact OE2-NE 2.82Å; E431-R451 IonicContact OE2-NH1 3.85Å; E431-R451 IonicContact OE2-NH2 3.84Å; E431-R451 PolarHBondContact OE2-NH2 2.98Å; E431-L452 CarbonylContact C-O 3.55Å; E431-L452 WeakPolarHBondContact CA-O 3.24Å
432	F	93.7	Very high	87.2	Confident	80 Å²	80	45.3 Å²	45.3	35%	0.351	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123	171.3	177.6	-92.3	0	0	0	108.7	T421 I422 L434 R451 L452	T421-F432 CarbonylContact O-C 3.59Å; T421-F432 WeakPolarHBondContact O-CA 3.42Å; I422-F432 HydrophobicContact CG1-CD2 4.02Å; I422-F432 HydrophobicContact CG1-CE2 4.29Å; F432-L434 HydrophobicContact CE1-CB 4.26Å; F432-R451 WeakPolarHBondContact O-CA 3.48Å; F432-L452 HydrophobicContact CB-CB 4.3Å; F432-L452 HydrophobicContact CD1-CD1 4Å; F432-L452 PolarHBondContact N-O 3.17Å; F432-L452 PolarHBondContact O-N 2.78Å
433	T	93.5	Very high	86.4	Confident	12 Å²	12	47.9 Å²	47.9	7%	0.074	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	129.4	176.1	87.4	0	0	0	0	112.1	C420 T421 E431 I450 R451	C420-T433 WeakPolarHBondContact CA-O 3.37Å; T421-T433 WeakPolarHBondContact CB-OG1 3.23Å; T421-T433 WeakPolarHBondContact CG2-OG1 3.42Å; T421-T433 PolarHBondContact N-O 3.32Å; T421-T433 PolarHBondContact O-N 2.84Å; T421-T433 PolarHBondContact OG1-OG1 3.41Å; E431-T433 HydrophobicContact CG-CG2 3.83Å; E431-T433 WeakPolarHBondContact OE1-CG2 3.14Å; T433-I450 CarbonylContact C-O 3.57Å; T433-I450 VanDerWaalsContact CA-O 3.22Å; T433-I450 WeakPolarHBondContact CA-O 3.32Å; T433-R451 HydrophobicContact CG2-CB 3.73Å; T433-R451 HydrophobicContact CG2-CG 3.76Å
434	L	94.6	Very high	86.1	Confident	75 Å²	75	48.6 Å²	48.6	39%	0.393	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.9	172.5	-175.3	69	0	0	0	108.7	F432 Q449 I450	F432-L434 HydrophobicContact CE1-CB 4.26Å; L434-Q449 CarbonylContact O-C 3.55Å; L434-Q449 VanDerWaalsContact O-CA 3.29Å; L434-Q449 WeakPolarHBondContact O-CA 3.4Å; L434-I450 PolarHBondContact N-O 3.37Å; L434-I450 PolarHBondContact O-N 3.01Å
435	G	93.3	Very high	85.9	Confident	3 Å²	3	49.4 Å²	49.4	3%	0.031	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	146.5	-176.7	0	0	0	0	0	112.9	I418 S419 G448	I418-G435 CarbonylContact C-O 3.57Å; I418-G435 WeakPolarHBondContact CA-O 3.33Å; S419-G435 PolarHBondContact N-O 2.88Å; S419-G435 PolarHBondContact O-N 3.24Å; G435-G448 CarbonylContact C-O 3.57Å; G435-G448 WeakPolarHBondContact CA-O 3.36Å
436	A	92	Very high	85.9	Confident	42 Å²	42	52 Å²	52	35%	0.347	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	136.4	168.1	0	0	0	0	0	109.4	W376 N417 S447 G448	W376-A436 HydrophobicContact CZ2-CB 4.32Å; N417-A436 CarbonylContact O-C 3.6Å; N417-A436 WeakPolarHBondContact O-CA 3.44Å; A436-S447 CarbonylContact O-C 3.39Å; A436-S447 WeakPolarHBondContact O-CA 3.46Å; A436-G448 PolarHBondContact N-O 2.96Å; A436-G448 PolarHBondContact O-N 3.3Å
437	Q	90.9	Very high	86.1	Confident	60 Å²	60	49.5 Å²	49.5	28%	0.28	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	131	176.4	-178.1	177.8	10.7	0	0	108.8	W376 G416 N417 I446	W376-Q437 PolarHBondContact NE1-O 2.82Å; G416-Q437 CarbonylContact C-O 3.56Å; G416-Q437 WeakPolarHBondContact CA-O 3.37Å; N417-Q437 PolarHBondContact N-O 3.42Å; N417-Q437 PolarHBondContact O-N 2.75Å; Q437-I446 CarbonylContact C-O 3.54Å; Q437-I446 WeakPolarHBondContact CA-O 3.21Å
438	C	85.4	Confident	86.7	Confident	14 Å²	14	47.8 Å²	47.8	10%	0.095	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	138.7	178.4	-176.2	0	0	0	0	110.6	W376 R445 I446	W376-C438 VanDerWaalsContact CB-SG 3.55Å; W376-C438 HydrophobicContact CD2-CB 4.43Å; W376-C438 HydrophobicContact CG-CB 4.14Å; C438-R445 CarbonylContact O-C 3.56Å; C438-R445 WeakPolarHBondContact O-CA 3.5Å; C438-I446 PolarHBondContact N-O 3.08Å; C438-I446 PolarHBondContact O-N 2.8Å; C438-I446 VanDerWaalsContact O-O 3.12Å
439	Q	83	Confident	87.5	Confident	19 Å²	19	51 Å²	51	9%	0.089	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	119.2	173.5	-174.3	160.9	-36.5	0	0	110.2	N380 R413 S441 R445	N380-Q439 PolarHBondContact ND2-O 2.88Å; R413-Q439 PolarHBondContact O-NE2 2.83Å; R413-Q439 VanDerWaalsContact O-NE2 3.08Å; R413-Q439 PolarHBondContact O-OE1 3.43Å; Q439-S441 WeakPolarHBondContact CG-O 3.38Å; Q439-S441 PolarHBondContact NE2-O 2.74Å; Q439-R445 HydrophobicContact CB-CG 4.19Å; Q439-R445 HydrophobicContact CG-CG 4.1Å
440	I	76.6	Confident	87.9	Confident	38 Å²	38	47.3 Å²	47.3	20%	0.195	27%	0.266	C	S	.	.			trans	-98.4	-34	-176.8	-61.8	-173.6	0	0	0	111.6	N380 S444 I446	N380-I440 VanDerWaalsContact ND2-C 3.25Å; N380-I440 PolarHBondContact ND2-O 2.89Å; N380-I440 PolarHBondContact OD1-O 2.96Å; I440-S444 PolarHBondContact N-O 3.21Å; I440-I446 HydrophobicContact CD1-CB 3.88Å; I440-I446 HydrophobicContact CD1-CD1 3.18Å; I440-I446 HydrophobicContact CD1-CG1 3.4Å; I440-I446 VanDerWaalsContact CD1-CG1 3.4Å; I440-I446 HydrophobicContact CG1-CD1 4.47Å; I440-I446 HydrophobicContact CG1-CG1 4.27Å
441	S	75	Confident	88.1	Confident	40 Å²	40	49.8 Å²	49.8	28%	0.28	27%	0.269	S	S	.	.	S	Bend	trans	-138.5	176	175.8	85.1	0	0	0	0	110.3	Q439 H443 S444	Q439-S441 WeakPolarHBondContact CG-O 3.38Å; Q439-S441 PolarHBondContact NE2-O 2.74Å; S441-H443 PolarHBondContact O-N 3.2Å; S441-H443 VanDerWaalsContact O-N 3.14Å; S441-H443 PolarHBondContact OG-N 2.78Å; S441-H443 VanDerWaalsContact OG-N 3.14Å; S441-S444 PolarHBondContact N-O 3.47Å; S441-S444 VanDerWaalsContact N-O 3.13Å; S441-S444 PolarHBondContact O-N 2.83Å; S441-S444 WeakPolarHBondContact OG-CB 3.41Å; S441-S444 PolarHBondContact OG-N 2.79Å; S441-S444 PolarHBondContact OG-OG 2.76Å
442	A	73.2	Confident	88.1	Confident	81 Å²	81	50.2 Å²	50.2	67%	0.669	27%	0.272	S	S	*	.	S	Bend	trans	-57	-25	173	0	0	0	0	0	113.2
443	H	79.8	Confident	88	Confident	138 Å²	138	46.5 Å²	46.5	64%	0.639	26%	0.257	S	S	*	.	S	Bend	trans	-122.1	-0.3	-176.7	-53.1	-61.4	0	0	0	113.5	S441 R466 G467	S441-H443 PolarHBondContact O-N 3.2Å; S441-H443 VanDerWaalsContact O-N 3.14Å; S441-H443 PolarHBondContact OG-N 2.78Å; S441-H443 VanDerWaalsContact OG-N 3.14Å; H443-R466 CarbonylContact O-C 3.59Å; H443-R466 WeakPolarHBondContact O-CA 3.34Å; H443-G467 PolarHBondContact O-N 2.78Å
444	S	84.6	Confident	87.7	Confident	22 Å²	22	50.6 Å²	50.6	15%	0.154	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	124.3	-172.9	-51.7	0	0	0	0	111.8	I440 S441 L465	I440-S444 PolarHBondContact N-O 3.21Å; S441-S444 PolarHBondContact N-O 3.47Å; S441-S444 VanDerWaalsContact N-O 3.13Å; S441-S444 PolarHBondContact O-N 2.83Å; S441-S444 WeakPolarHBondContact OG-CB 3.41Å; S441-S444 PolarHBondContact OG-N 2.79Å; S441-S444 PolarHBondContact OG-OG 2.76Å; S444-L465 CarbonylContact C-O 3.56Å; S444-L465 VanDerWaalsContact CA-O 3.23Å; S444-L465 WeakPolarHBondContact CA-O 3.21Å
445	R	88.3	Confident	87.2	Confident	105 Å²	105	52.2 Å²	52.2	40%	0.396	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	133.5	173.3	-59.3	-178.8	170.9	164.3	-6.5	109.4	C438 Q439 L464 L465	C438-R445 CarbonylContact O-C 3.56Å; C438-R445 WeakPolarHBondContact O-CA 3.5Å; Q439-R445 HydrophobicContact CB-CG 4.19Å; Q439-R445 HydrophobicContact CG-CG 4.1Å; R445-L464 WeakPolarHBondContact O-CA 3.42Å; R445-L465 HydrophobicContact CB-CB 4.22Å; R445-L465 HydrophobicContact CB-CD2 4.42Å; R445-L465 HydrophobicContact CG-CD2 4.43Å; R445-L465 PolarHBondContact N-O 2.99Å; R445-L465 PolarHBondContact O-N 3.3Å
446	I	90.4	Very high	86.8	Confident	71 Å²	71	57 Å²	57	36%	0.364	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	141	172.3	-67.4	-166.8	0	0	0	108.1	Q437 C438 I440 S463 L464	Q437-I446 CarbonylContact C-O 3.54Å; Q437-I446 WeakPolarHBondContact CA-O 3.21Å; C438-I446 PolarHBondContact N-O 3.08Å; C438-I446 PolarHBondContact O-N 2.8Å; C438-I446 VanDerWaalsContact O-O 3.12Å; I440-I446 HydrophobicContact CD1-CB 3.88Å; I440-I446 HydrophobicContact CD1-CD1 3.18Å; I440-I446 HydrophobicContact CD1-CG1 3.4Å; I440-I446 VanDerWaalsContact CD1-CG1 3.4Å; I440-I446 HydrophobicContact CG1-CD1 4.47Å; I440-I446 HydrophobicContact CG1-CG1 4.27Å; I446-S463 CarbonylContact C-O 3.55Å; I446-S463 WeakPolarHBondContact CA-O 3.31Å; I446-L464 HydrophobicContact CD1-CD1 4.17Å; I446-L464 HydrophobicContact CG1-CD1 3.63Å
447	S	91.7	Very high	86.6	Confident	21 Å²	21	55 Å²	55	15%	0.147	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	145.2	173.3	55.3	0	0	0	0	110.6	A436 S463	A436-S447 CarbonylContact O-C 3.39Å; A436-S447 WeakPolarHBondContact O-CA 3.46Å; S447-S463 PolarHBondContact N-O 3.36Å; S447-S463 PolarHBondContact O-N 2.99Å; S447-S463 WeakPolarHBondContact OG-CB 3.36Å; S447-S463 PolarHBondContact OG-O 3.49Å
448	G	92.4	Very high	86.7	Confident	27 Å²	27	52.2 Å²	52.2	28%	0.278	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	133.9	172	0	0	0	0	0	108.7	G435 A436 K461	G435-G448 CarbonylContact C-O 3.57Å; G435-G448 WeakPolarHBondContact CA-O 3.36Å; A436-G448 PolarHBondContact N-O 2.96Å; A436-G448 PolarHBondContact O-N 3.3Å; G448-K461 CarbonylContact C-O 3.58Å; G448-K461 WeakPolarHBondContact CA-O 3Å
449	Q	93.8	Very high	87	Confident	69 Å²	69	52.3 Å²	52.3	32%	0.322	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	141.3	178.5	-59.2	178.3	-9	0	0	109.6	L434 V460 K461	L434-Q449 CarbonylContact O-C 3.55Å; L434-Q449 VanDerWaalsContact O-CA 3.29Å; L434-Q449 WeakPolarHBondContact O-CA 3.4Å; Q449-V460 CarbonylContact O-C 3.53Å; Q449-V460 WeakPolarHBondContact O-CA 3.23Å; Q449-K461 HydrophobicContact CB-CB 4.36Å; Q449-K461 PolarHBondContact N-O 2.8Å; Q449-K461 PolarHBondContact O-N 2.93Å
450	I	93.5	Very high	87.5	Confident	24 Å²	24	51.8 Å²	51.8	12%	0.123	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	119.8	174.8	-58.4	170.3	0	0	0	106.5	T433 L434 T459 V460 L486 G489 L490	T433-I450 CarbonylContact C-O 3.57Å; T433-I450 VanDerWaalsContact CA-O 3.22Å; T433-I450 WeakPolarHBondContact CA-O 3.32Å; L434-I450 PolarHBondContact N-O 3.37Å; L434-I450 PolarHBondContact O-N 3.01Å; I450-T459 CarbonylContact C-O 3.5Å; I450-T459 WeakPolarHBondContact CA-O 3.16Å; I450-V460 HydrophobicContact CG1-CG2 4.29Å; I450-L486 HydrophobicContact CG2-CD1 4.14Å; I450-G489 VanDerWaalsContact CD1-O 3.25Å; I450-G489 WeakPolarHBondContact CD1-O 3.29Å; I450-L490 HydrophobicContact CD1-CB 4.34Å; I450-L490 HydrophobicContact CD1-CD2 3.32Å; I450-L490 HydrophobicContact CD1-CG 3.75Å
451	R	92.7	Very high	88.4	Confident	69 Å²	69	53.3 Å²	53.3	26%	0.26	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	123.3	178.5	170.1	172.3	178.5	156.8	6.2	109	D428 E431 F432 T433 T459	D428-R451 IonicContact OD2-CZ 3.2Å; D428-R451 IonicContact OD2-NH2 3.69Å; D428-R451 PolarHBondContact OD2-NH2 3.48Å; E431-R451 VanDerWaalsContact CD-NE 3.28Å; E431-R451 HydrophobicContact CG-CG 4.13Å; E431-R451 VanDerWaalsContact OE1-CD 3.29Å; E431-R451 WeakPolarHBondContact OE1-CD 3.37Å; E431-R451 IonicContact OE1-CZ 2.71Å; E431-R451 IonicContact OE1-NE 3.17Å; E431-R451 PolarHBondContact OE1-NE 2.95Å; E431-R451 IonicContact OE1-NH1 3.73Å; E431-R451 PolarHBondContact OE1-NH1 2.99Å; E431-R451 IonicContact OE1-NH2 3.67Å; E431-R451 PolarHBondContact OE1-NH2 2.97Å; E431-R451 IonicContact OE2-CZ 3.95Å; E431-R451 IonicContact OE2-NE 2.82Å; E431-R451 IonicContact OE2-NH1 3.85Å; E431-R451 IonicContact OE2-NH2 3.84Å; E431-R451 PolarHBondContact OE2-NH2 2.98Å; F432-R451 WeakPolarHBondContact O-CA 3.48Å; T433-R451 HydrophobicContact CG2-CB 3.73Å; T433-R451 HydrophobicContact CG2-CG 3.76Å; R451-T459 PolarHBondContact N-O 3.37Å; R451-T459 PolarHBondContact O-N 3.43Å
452	L	92.5	Very high	89.2	Confident	44 Å²	44	54.8 Å²	54.8	23%	0.23	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	119.5	167.2	-66.8	172.6	0	0	0	107.5	E431 F432 V458 L486	E431-L452 CarbonylContact C-O 3.55Å; E431-L452 WeakPolarHBondContact CA-O 3.24Å; F432-L452 HydrophobicContact CB-CB 4.3Å; F432-L452 HydrophobicContact CD1-CD1 4Å; F432-L452 PolarHBondContact N-O 3.17Å; F432-L452 PolarHBondContact O-N 2.78Å; L452-V458 HydrophobicContact CD2-CB 4.46Å; L452-V458 HydrophobicContact CD2-CG1 4.3Å; L452-V458 HydrophobicContact CD2-CG2 3.75Å; L452-L486 HydrophobicContact CD1-CD1 3.97Å; L452-L486 HydrophobicContact CD1-CD2 4.08Å; L452-L486 HydrophobicContact CD2-CB 4.28Å; L452-L486 HydrophobicContact CD2-CD1 3.47Å; L452-L486 VanDerWaalsContact CD2-CD1 3.47Å; L452-L486 HydrophobicContact CD2-CD2 4.19Å; L452-L486 HydrophobicContact CD2-CG 4.15Å; L452-L486 HydrophobicContact CG-CD1 3.96Å
453	S	90.3	Very high	90.2	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.021	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	138.6	175.5	171.3	0	0	0	0	108.6	D428 Q455 K456 G457	D428-S453 WeakPolarHBondContact CB-OG 3.49Å; D428-S453 PolarHBondContact OD2-OG 2.93Å; D428-S453 VanDerWaalsContact OD2-OG 3.13Å; S453-Q455 VanDerWaalsContact C-N 3.26Å; S453-Q455 PolarHBondContact O-N 2.82Å; S453-Q455 PolarHBondContact OG-N 2.79Å; S453-K456 PolarHBondContact OG-N 2.82Å; S453-K456 VanDerWaalsContact OG-N 3.15Å; S453-G457 PolarHBondContact N-O 2.98Å; S453-G457 VanDerWaalsContact O-CA 3.24Å; S453-G457 WeakPolarHBondContact O-CA 3.17Å; S453-G457 PolarHBondContact O-N 3.34Å
454	I	87.3	Confident	90.8	Very high	97 Å²	97	47.7 Å²	47.7	50%	0.497	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-36.8	179.4	-62.8	172.3	0	0	0	110.4	I429 G430	I429-I454 HydrophobicContact CB-CD1 4.45Å; I429-I454 HydrophobicContact CG2-CD1 4.35Å; G430-I454 PolarHBondContact O-N 3.37Å
455	Q	85.5	Confident	91.2	Very high	109 Å²	109	49.3 Å²	49.3	51%	0.509	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-29.9	-179.1	-69.7	-165.5	-9.7	0	0	114.8	T427 S453	T427-Q455 PolarHBondContact O-NE2 2.76Å; T427-Q455 PolarHBondContact O-OE1 2.94Å; S453-Q455 VanDerWaalsContact C-N 3.26Å; S453-Q455 PolarHBondContact O-N 2.82Å; S453-Q455 PolarHBondContact OG-N 2.79Å
456	K	84.1	Confident	91.3	Very high	105 Å²	105	52.1 Å²	52.1	46%	0.457	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	4.4	-178	-56.6	-178.4	-179.1	174.4	0	113.6	D428 S453	D428-K456 WeakPolarHBondContact OD1-CE 3.13Å; D428-K456 IonicContact OD1-NZ 2.81Å; D428-K456 IonicContact OD2-NZ 3.85Å; S453-K456 PolarHBondContact OG-N 2.82Å; S453-K456 VanDerWaalsContact OG-N 3.15Å
457	G	88.8	Confident	91	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	61	-130.4	-178.9	0	0	0	0	0	114.3	S453 S478 D479 R480	S453-G457 PolarHBondContact N-O 2.98Å; S453-G457 VanDerWaalsContact O-CA 3.24Å; S453-G457 WeakPolarHBondContact O-CA 3.17Å; S453-G457 PolarHBondContact O-N 3.34Å; G457-S478 CarbonylContact C-O 3.57Å; G457-S478 VanDerWaalsContact CA-O 3.26Å; G457-S478 WeakPolarHBondContact CA-O 3.25Å; G457-D479 PolarHBondContact N-O 2.82Å; G457-R480 WeakPolarHBondContact CA-O 3.31Å
458	V	92.2	Very high	90.7	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	119.6	-173.1	-174.6	0	0	0	0	110	L452 L477 S478 A485 L486	L452-V458 HydrophobicContact CD2-CB 4.46Å; L452-V458 HydrophobicContact CD2-CG1 4.3Å; L452-V458 HydrophobicContact CD2-CG2 3.75Å; V458-L477 HydrophobicContact CB-CB 4.46Å; V458-L477 HydrophobicContact CG1-CD1 4.27Å; V458-L477 PolarHBondContact O-N 3.36Å; V458-S478 PolarHBondContact N-O 2.76Å; V458-A485 HydrophobicContact CB-CB 4.32Å; V458-A485 HydrophobicContact CG2-CB 4.12Å; V458-L486 HydrophobicContact CG2-CB 4.35Å
459	T	92.3	Very high	90.7	Very high	16 Å²	16	55.9 Å²	55.9	10%	0.098	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	132.3	177.2	-46.3	0	0	0	0	110.7	I450 R451 P474 F475 I476	I450-T459 CarbonylContact C-O 3.5Å; I450-T459 WeakPolarHBondContact CA-O 3.16Å; R451-T459 PolarHBondContact N-O 3.37Å; R451-T459 PolarHBondContact O-N 3.43Å; T459-P474 HydrophobicContact CG2-CB 4.33Å; T459-F475 CarbonylContact C-O 3.56Å; T459-F475 VanDerWaalsContact CA-O 3.32Å; T459-F475 WeakPolarHBondContact CA-O 3.32Å; T459-F475 WeakPolarHBondContact CG2-O 3.47Å; T459-I476 HydrophobicContact CG2-CG1 4.28Å
460	V	93.3	Very high	90.7	Very high	9 Å²	9	54.4 Å²	54.4	6%	0.055	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	120.9	172.8	178.5	0	0	0	0	108.9	Q449 I450 P474 F475 L477 P493	Q449-V460 CarbonylContact O-C 3.53Å; Q449-V460 WeakPolarHBondContact O-CA 3.23Å; I450-V460 HydrophobicContact CG1-CG2 4.29Å; V460-P474 CarbonylContact O-C 3.5Å; V460-F475 PolarHBondContact N-O 2.8Å; V460-F475 WeakPolarHBondContact O-CD2 3.4Å; V460-F475 PolarHBondContact O-N 2.8Å; V460-L477 HydrophobicContact CG2-CD1 3.52Å; V460-L477 HydrophobicContact CG2-CG 4.18Å; V460-P493 HydrophobicContact CG1-CG 4.08Å
461	K	94	Very high	90.8	Very high	70 Å²	70	57.2 Å²	57.2	30%	0.304	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	117.8	177.2	-177.4	179.2	178.7	176.3	0	110.1	G448 Q449 S463 P474	G448-K461 CarbonylContact C-O 3.58Å; G448-K461 WeakPolarHBondContact CA-O 3Å; Q449-K461 HydrophobicContact CB-CB 4.36Å; Q449-K461 PolarHBondContact N-O 2.8Å; Q449-K461 PolarHBondContact O-N 2.93Å; K461-S463 WeakPolarHBondContact CE-OG 3.36Å; K461-P474 HydrophobicContact CB-CB 4.42Å; K461-P474 HydrophobicContact CG-CB 4.37Å
462	L	93.6	Very high	90.9	Very high	71 Å²	71	54 Å²	54	37%	0.372	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	136.5	167.8	-60.6	-178.7	0	0	0	108.8	F473 F475	L462-F473 PolarHBondContact N-O 2.88Å; L462-F473 PolarHBondContact O-N 2.79Å; L462-F475 HydrophobicContact CB-CE2 4.39Å; L462-F475 HydrophobicContact CD1-CE2 3.9Å; L462-F475 HydrophobicContact CG-CE2 4.05Å
463	S	93.2	Very high	91	Very high	12 Å²	12	55 Å²	55	8%	0.084	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	135.8	176.1	-44.8	0	0	0	0	112.8	I446 S447 K461 Y471 S472	I446-S463 CarbonylContact C-O 3.55Å; I446-S463 WeakPolarHBondContact CA-O 3.31Å; S447-S463 PolarHBondContact N-O 3.36Å; S447-S463 PolarHBondContact O-N 2.99Å; S447-S463 WeakPolarHBondContact OG-CB 3.36Å; S447-S463 PolarHBondContact OG-O 3.49Å; K461-S463 WeakPolarHBondContact CE-OG 3.36Å; S463-Y471 CarbonylContact C-O 3.58Å; S463-Y471 WeakPolarHBondContact CA-O 3.49Å; S463-S472 PolarHBondContact OG-OG 3.11Å
464	L	93.1	Very high	91.1	Very high	57 Å²	57	55.5 Å²	55.5	30%	0.298	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	115.2	177.3	173.2	70.9	0	0	0	108.9	R445 I446 Y471	R445-L464 WeakPolarHBondContact O-CA 3.42Å; I446-L464 HydrophobicContact CD1-CD1 4.17Å; I446-L464 HydrophobicContact CG1-CD1 3.63Å; L464-Y471 HydrophobicContact CD2-CD2 4.27Å; L464-Y471 PolarHBondContact N-O 3.23Å; L464-Y471 PolarHBondContact O-N 3.19Å
465	L	91.8	Very high	91.4	Very high	56 Å²	56	53.1 Å²	53.1	29%	0.293	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	115.3	168.2	-177.4	82.9	0	0	0	107.9	S444 R445 Q469 T470	S444-L465 CarbonylContact C-O 3.56Å; S444-L465 VanDerWaalsContact CA-O 3.23Å; S444-L465 WeakPolarHBondContact CA-O 3.21Å; R445-L465 HydrophobicContact CB-CB 4.22Å; R445-L465 HydrophobicContact CB-CD2 4.42Å; R445-L465 HydrophobicContact CG-CD2 4.43Å; R445-L465 PolarHBondContact N-O 2.99Å; R445-L465 PolarHBondContact O-N 3.3Å; L465-Q469 CarbonylContact C-O 3.48Å; L465-Q469 WeakPolarHBondContact CA-O 3.4Å; L465-T470 VanDerWaalsContact CD1-OG1 3.25Å; L465-T470 WeakPolarHBondContact CD1-OG1 3.16Å
466	R	90.6	Very high	91.7	Very high	164 Å²	164	49.1 Å²	49.1	62%	0.619	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	108.5	173.4	-175.8	176.7	-178.6	176.2	-1	109.7	H443 T468 Q469	H443-R466 CarbonylContact O-C 3.59Å; H443-R466 WeakPolarHBondContact O-CA 3.34Å; R466-T468 PolarHBondContact O-N 2.89Å; R466-T468 VanDerWaalsContact O-N 3.15Å; R466-Q469 PolarHBondContact N-O 2.86Å; R466-Q469 PolarHBondContact O-N 2.82Å
467	G	84.3	Confident	91.9	Very high	45 Å²	45	44.6 Å²	44.6	46%	0.464	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	-113.1	-174	0	0	0	0	0	110.2	H443	H443-G467 PolarHBondContact O-N 2.78Å
468	T	86	Confident	91.9	Very high	75 Å²	75	44.6 Å²	44.6	46%	0.46	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	8.2	177.3	60.7	0	0	0	0	113.8	P170 T171 S172 R466	P170-T468 WeakPolarHBondContact O-CB 2.97Å; P170-T468 WeakPolarHBondContact O-CG2 3.39Å; P170-T468 PolarHBondContact O-OG1 2.8Å; T171-T468 WeakPolarHBondContact CA-O 3.42Å; S172-T468 PolarHBondContact N-O 2.79Å; R466-T468 PolarHBondContact O-N 2.89Å; R466-T468 VanDerWaalsContact O-N 3.15Å
469	Q	91.7	Very high	91.6	Very high	79 Å²	79	48.5 Å²	48.5	37%	0.369	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	130.5	-179.4	-51	-172.5	-23	0	0	110.6	S172 L465 R466 Y471	S172-Q469 CarbonylContact O-C 3.5Å; S172-Q469 WeakPolarHBondContact O-CA 3.35Å; S172-Q469 VanDerWaalsContact OG-CG 3.31Å; S172-Q469 WeakPolarHBondContact OG-CG 3.34Å; L465-Q469 CarbonylContact C-O 3.48Å; L465-Q469 WeakPolarHBondContact CA-O 3.4Å; R466-Q469 PolarHBondContact N-O 2.86Å; R466-Q469 PolarHBondContact O-N 2.82Å; Q469-Y471 HydrophobicContact CB-CE2 4.07Å; Q469-Y471 PolarHBondContact OE1-OH 2.8Å
470	T	94.4	Very high	91.3	Very high	38 Å²	38	56.8 Å²	56.8	23%	0.233	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	120.5	177.2	-53.3	0	0	0	0	109.7	S172 E173 F174 L465	S172-T470 PolarHBondContact O-N 2.88Å; E173-T470 CarbonylContact C-O 3.54Å; E173-T470 WeakPolarHBondContact CA-O 3.36Å; F174-T470 PolarHBondContact N-O 3.07Å; L465-T470 VanDerWaalsContact CD1-OG1 3.25Å; L465-T470 WeakPolarHBondContact CD1-OG1 3.16Å
471	Y	95.4	Very high	90.8	Very high	82 Å²	82	60 Å²	60	32%	0.322	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	120.9	172.9	-59.3	-84.4	0	0	0	109.1	F174 S463 L464 Q469	F174-Y471 HydrophobicContact CB-CD1 4.05Å; F174-Y471 HydrophobicContact CB-CE1 4.48Å; F174-Y471 HydrophobicContact CD1-CD1 4.06Å; F174-Y471 HydrophobicContact CG-CD1 4.37Å; F174-Y471 CarbonylContact O-C 3.59Å; F174-Y471 WeakPolarHBondContact O-CA 3.43Å; S463-Y471 CarbonylContact C-O 3.58Å; S463-Y471 WeakPolarHBondContact CA-O 3.49Å; L464-Y471 HydrophobicContact CD2-CD2 4.27Å; L464-Y471 PolarHBondContact N-O 3.23Å; L464-Y471 PolarHBondContact O-N 3.19Å; Q469-Y471 HydrophobicContact CB-CE2 4.07Å; Q469-Y471 PolarHBondContact OE1-OH 2.8Å
472	S	94.2	Very high	90.3	Very high	3 Å²	3	58.4 Å²	58.4	2%	0.021	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	127.3	-177.6	-71.7	0	0	0	0	111	F174 S175 L176 S463 P474	F174-S472 PolarHBondContact O-N 2.77Å; S175-S472 CarbonylContact C-O 3.59Å; S175-S472 WeakPolarHBondContact CA-O 3.44Å; L176-S472 PolarHBondContact N-O 2.8Å; S463-S472 PolarHBondContact OG-OG 3.11Å; S472-P474 WeakPolarHBondContact O-CD 3.42Å
473	F	94.6	Very high	90	Very high	65 Å²	65	65.8 Å²	65.8	29%	0.285	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	87.8	179.4	-55.5	-81.2	0	0	0	109.7	F174 L176 L462 F475	F174-F473 HydrophobicContact CE1-CE1 4.15Å; L176-F473 HydrophobicContact CB-CD1 4.06Å; L176-F473 HydrophobicContact CB-CE1 4.27Å; L462-F473 PolarHBondContact N-O 2.88Å; L462-F473 PolarHBondContact O-N 2.79Å; F473-F475 HydrophobicContact CB-CE1 4.42Å; F473-F475 HydrophobicContact CB-CE2 3.83Å; F473-F475 HydrophobicContact CB-CZ 3.64Å; F473-F475 WeakPolarHBondContact O-CD2 3.41Å; F473-F475 VanDerWaalsContact O-CE2 3.3Å; F473-F475 WeakPolarHBondContact O-CE2 3.16Å
474	P	93.6	Very high	89.6	Confident	13 Å²	13	68.8 Å²	68.8	8%	0.084	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	117.8	172.4	29.5	-30.5	0	0	0	111.5	L176 G177 L178 Y204 T459 V460 K461 S472	L176-P474 WeakPolarHBondContact O-CD 3.24Å; G177-P474 VanDerWaalsContact CA-O 3.29Å; G177-P474 WeakPolarHBondContact CA-O 3.45Å; L178-P474 PolarHBondContact N-O 2.77Å; Y204-P474 WeakPolarHBondContact OH-CG 3.25Å; T459-P474 HydrophobicContact CG2-CB 4.33Å; V460-P474 CarbonylContact O-C 3.5Å; K461-P474 HydrophobicContact CB-CB 4.42Å; K461-P474 HydrophobicContact CG-CB 4.37Å; S472-P474 WeakPolarHBondContact O-CD 3.42Å
475	F	92.5	Very high	89.3	Confident	46 Å²	46	66.3 Å²	66.3	20%	0.202	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	119.6	175.2	-51.4	-77.8	0	0	0	109.8	L178 L180 T459 V460 L462 F473	L178-F475 HydrophobicContact CB-CD1 4Å; L178-F475 HydrophobicContact CB-CE1 4.46Å; L178-F475 HydrophobicContact CD1-CD1 4.13Å; L178-F475 HydrophobicContact CD1-CE1 3.83Å; L178-F475 HydrophobicContact CG-CD1 4.35Å; L178-F475 HydrophobicContact CG-CE1 4.32Å; L178-F475 CarbonylContact O-C 3.55Å; L178-F475 WeakPolarHBondContact O-CA 3.32Å; L180-F475 HydrophobicContact CD1-CB 3.97Å; L180-F475 HydrophobicContact CD1-CD1 3.86Å; L180-F475 HydrophobicContact CD1-CG 4.21Å; L180-F475 HydrophobicContact CG-CB 4.49Å; L180-F475 HydrophobicContact CG-CD1 4.48Å; T459-F475 CarbonylContact C-O 3.56Å; T459-F475 VanDerWaalsContact CA-O 3.32Å; T459-F475 WeakPolarHBondContact CA-O 3.32Å; T459-F475 WeakPolarHBondContact CG2-O 3.47Å; V460-F475 PolarHBondContact N-O 2.8Å; V460-F475 WeakPolarHBondContact O-CD2 3.4Å; V460-F475 PolarHBondContact O-N 2.8Å; L462-F475 HydrophobicContact CB-CE2 4.39Å; L462-F475 HydrophobicContact CD1-CE2 3.9Å; L462-F475 HydrophobicContact CG-CE2 4.05Å; F473-F475 HydrophobicContact CB-CE1 4.42Å; F473-F475 HydrophobicContact CB-CE2 3.83Å; F473-F475 HydrophobicContact CB-CZ 3.64Å; F473-F475 WeakPolarHBondContact O-CD2 3.41Å; F473-F475 VanDerWaalsContact O-CE2 3.3Å; F473-F475 WeakPolarHBondContact O-CE2 3.16Å
476	I	91.4	Very high	89	Confident	26 Å²	26	66 Å²	66	13%	0.133	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	122.2	169.4	-57.8	173	0	0	0	107.2	L178 L180 T181 Y204 T459	L178-I476 PolarHBondContact O-N 3.29Å; L180-I476 CarbonylContact C-O 3.52Å; L180-I476 WeakPolarHBondContact CA-O 3.46Å; L180-I476 WeakPolarHBondContact CB-O 3.45Å; L180-I476 PolarHBondContact N-O 3.26Å; T181-I476 PolarHBondContact N-O 3.18Å; Y204-I476 HydrophobicContact CD1-CD1 3.74Å; Y204-I476 HydrophobicContact CD1-CG1 4.31Å; Y204-I476 HydrophobicContact CD2-CD1 4.35Å; Y204-I476 HydrophobicContact CE1-CD1 3.56Å; Y204-I476 HydrophobicContact CE1-CG1 3.78Å; Y204-I476 HydrophobicContact CE2-CD1 4.22Å; Y204-I476 HydrophobicContact CG-CD1 4.14Å; T459-I476 HydrophobicContact CG2-CG1 4.28Å
477	L	90	Very high	88.9	Confident	10 Å²	10	59.3 Å²	59.3	5%	0.052	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-30	-178.9	-61.6	-178.2	0	0	0	112.5	L180 F184 V458 V460 A485 G489	L180-L477 HydrophobicContact CD1-CD2 4.37Å; F184-L477 WeakPolarHBondContact CB-O 3.37Å; F184-L477 HydrophobicContact CD2-CD2 3.57Å; F184-L477 HydrophobicContact CE2-CD2 3.51Å; F184-L477 HydrophobicContact CG-CD2 4.23Å; F184-L477 HydrophobicContact CZ-CD2 4.13Å; V458-L477 HydrophobicContact CB-CB 4.46Å; V458-L477 HydrophobicContact CG1-CD1 4.27Å; V458-L477 PolarHBondContact O-N 3.36Å; V460-L477 HydrophobicContact CG2-CD1 3.52Å; V460-L477 HydrophobicContact CG2-CG 4.18Å; L477-A485 HydrophobicContact CB-CB 4.43Å; L477-G489 VanDerWaalsContact CD1-CA 3.44Å
478	S	88.4	Confident	88.9	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	143.5	174.9	174.3	0	0	0	0	109.4	D185 G457 V458 R480	D185-S478 PolarHBondContact OD2-OG 3.36Å; G457-S478 CarbonylContact C-O 3.57Å; G457-S478 VanDerWaalsContact CA-O 3.26Å; G457-S478 WeakPolarHBondContact CA-O 3.25Å; V458-S478 PolarHBondContact N-O 2.76Å; S478-R480 WeakPolarHBondContact CB-O 3.3Å; S478-R480 PolarHBondContact O-N 2.8Å; S478-R480 PolarHBondContact OG-N 2.76Å; S478-R480 PolarHBondContact OG-O 2.77Å
479	D	85.6	Confident	88.9	Confident	81 Å²	81	58.6 Å²	58.6	43%	0.433	28%	0.277	S	S	.	.	S	Bend	trans	-72.5	-13.5	173.8	-68.3	-28.2	0	0	0	113.1	G457	G457-D479 PolarHBondContact N-O 2.82Å
480	R	86	Confident	88.6	Confident	191 Å²	191	57.9 Å²	57.9	72%	0.721	28%	0.275	S	S	*	.	S	Bend	trans	-121.3	155.2	179.8	-66.4	-176.7	-178.1	165.3	2.5	110.2	G457 S478 D482	G457-R480 WeakPolarHBondContact CA-O 3.31Å; S478-R480 WeakPolarHBondContact CB-O 3.3Å; S478-R480 PolarHBondContact O-N 2.8Å; S478-R480 PolarHBondContact OG-N 2.76Å; S478-R480 PolarHBondContact OG-O 2.77Å; R480-D482 PolarHBondContact O-N 2.83Å
481	P	83.2	Confident	88.4	Confident	76 Å²	76	60.8 Å²	60.8	49%	0.494	29%	0.289	S	S	.	.			trans	-72	77.8	174.4	29.5	-34.8	0	0	0	110.2
482	D	83.5	Confident	88	Confident	36 Å²	36	63.1 Å²	63.1	19%	0.193	30%	0.301	C	S	.	.			trans	-87	136.3	175.5	-164.5	-5.6	0	0	0	111.1	K189 R480 V484 A485 L486	K189-D482 WeakPolarHBondContact CE-OD2 3.28Å; K189-D482 IonicContact NZ-OD2 2.66Å; K189-D482 PolarHBondContact NZ-OD2 2.76Å; R480-D482 PolarHBondContact O-N 2.83Å; D482-V484 VanDerWaalsContact C-N 3.27Å; D482-V484 PolarHBondContact O-N 2.92Å; D482-V484 PolarHBondContact OD1-N 2.82Å; D482-A485 HydrophobicContact CB-CB 4.07Å; D482-L486 WeakPolarHBondContact O-CB 3.34Å; D482-L486 PolarHBondContact O-N 3.49Å
483	R	86.4	Confident	87.6	Confident	227 Å²	227	64.7 Å²	64.7	86%	0.857	31%	0.311	S	S	*	.	H	α-helix	trans	-65.1	-35.6	177.8	-61.6	-178.9	-176.8	178.9	0.9	111.1	G487	R483-G487 PolarHBondContact O-N 3.35Å
484	V	85.9	Confident	87.1	Confident	75 Å²	75	67 Å²	67	46%	0.455	33%	0.325	S	S	.	.	H	α-helix	trans	-70.3	-47.3	-179.3	177.7	0	0	0	0	110.6	D482 L486 G487 Y488	D482-V484 VanDerWaalsContact C-N 3.27Å; D482-V484 PolarHBondContact O-N 2.92Å; D482-V484 PolarHBondContact OD1-N 2.82Å; V484-L486 VanDerWaalsContact C-N 3.3Å; V484-L486 PolarHBondContact O-N 2.97Å; V484-G487 PolarHBondContact O-N 2.94Å; V484-G487 VanDerWaalsContact O-N 3.09Å; V484-Y488 HydrophobicContact CG1-CD2 3.87Å; V484-Y488 HydrophobicContact CG1-CE2 3.27Å; V484-Y488 VanDerWaalsContact O-CD2 3.28Å; V484-Y488 WeakPolarHBondContact O-CD2 3.43Å; V484-Y488 PolarHBondContact O-N 2.77Å
485	A	84.9	Confident	87	Confident	4 Å²	4	71.4 Å²	71.4	3%	0.033	35%	0.347	C	S	.	.	H	α-helix	trans	-60.5	-39	175.5	0	0	0	0	0	112.1	V458 L477 D482 Y488 G489	V458-A485 HydrophobicContact CB-CB 4.32Å; V458-A485 HydrophobicContact CG2-CB 4.12Å; L477-A485 HydrophobicContact CB-CB 4.43Å; D482-A485 HydrophobicContact CB-CB 4.07Å; A485-Y488 PolarHBondContact O-N 2.82Å; A485-G489 PolarHBondContact O-N 2.82Å
486	L	86.5	Confident	86.7	Confident	49 Å²	49	70.7 Å²	70.7	26%	0.257	35%	0.35	S	S	.	.	H	α-helix	trans	-62.8	-41.7	173.2	176.7	63.8	0	0	0	112.1	I450 L452 V458 D482 V484 G489 L490	I450-L486 HydrophobicContact CG2-CD1 4.14Å; L452-L486 HydrophobicContact CD1-CD1 3.97Å; L452-L486 HydrophobicContact CD1-CD2 4.08Å; L452-L486 HydrophobicContact CD2-CB 4.28Å; L452-L486 HydrophobicContact CD2-CD1 3.47Å; L452-L486 VanDerWaalsContact CD2-CD1 3.47Å; L452-L486 HydrophobicContact CD2-CD2 4.19Å; L452-L486 HydrophobicContact CD2-CG 4.15Å; L452-L486 HydrophobicContact CG-CD1 3.96Å; V458-L486 HydrophobicContact CG2-CB 4.35Å; D482-L486 WeakPolarHBondContact O-CB 3.34Å; D482-L486 PolarHBondContact O-N 3.49Å; V484-L486 VanDerWaalsContact C-N 3.3Å; V484-L486 PolarHBondContact O-N 2.97Å; L486-G489 PolarHBondContact O-N 3.37Å; L486-L490 HydrophobicContact CD1-CD1 3.96Å; L486-L490 HydrophobicContact CD1-CG 4.3Å; L486-L490 HydrophobicContact CG-CD1 4.04Å; L486-L490 PolarHBondContact O-N 2.87Å
487	G	87.5	Confident	86.4	Confident	25 Å²	25	73.1 Å²	73.1	26%	0.258	36%	0.36	S	S	.	.	H	α-helix	trans	-58.6	-49.1	176	0	0	0	0	0	112.3	R483 V484 L490 I491	R483-G487 PolarHBondContact O-N 3.35Å; V484-G487 PolarHBondContact O-N 2.94Å; V484-G487 VanDerWaalsContact O-N 3.09Å; G487-L490 PolarHBondContact O-N 3.38Å; G487-I491 WeakPolarHBondContact O-CB 3.45Å; G487-I491 VanDerWaalsContact O-CG1 3.26Å; G487-I491 WeakPolarHBondContact O-CG1 3.5Å; G487-I491 PolarHBondContact O-N 3.13Å
488	Y	85.3	Confident	86.2	Confident	104 Å²	104	75.5 Å²	75.5	41%	0.408	38%	0.377	S	S	.	.	H	α-helix	trans	-65.5	-41.1	175.5	-63	-53.4	0	0	0	112.4	F184 L188 V484 A485 L490 I491 F492	F184-Y488 HydrophobicContact CD1-CD2 4.31Å; L188-Y488 HydrophobicContact CD1-CE2 3.62Å; V484-Y488 HydrophobicContact CG1-CD2 3.87Å; V484-Y488 HydrophobicContact CG1-CE2 3.27Å; V484-Y488 VanDerWaalsContact O-CD2 3.28Å; V484-Y488 WeakPolarHBondContact O-CD2 3.43Å; V484-Y488 PolarHBondContact O-N 2.77Å; A485-Y488 PolarHBondContact O-N 2.82Å; Y488-L490 PolarHBondContact O-N 3.02Å; Y488-I491 PolarHBondContact O-N 3.27Å; Y488-F492 WeakPolarHBondContact O-CB 3.35Å; Y488-F492 PolarHBondContact O-N 2.9Å
489	G	85.1	Confident	86.3	Confident	1 Å²	1	77.4 Å²	77.4	1%	0.01	39%	0.393	C	S	.	.	H	α-helix	trans	-61.5	-28	177.7	0	0	0	0	0	114.1	I450 L477 A485 L486 P493	I450-G489 VanDerWaalsContact CD1-O 3.25Å; I450-G489 WeakPolarHBondContact CD1-O 3.29Å; L477-G489 VanDerWaalsContact CD1-CA 3.44Å; A485-G489 PolarHBondContact O-N 2.82Å; L486-G489 PolarHBondContact O-N 3.37Å; G489-P493 VanDerWaalsContact O-CD 3.23Å; G489-P493 WeakPolarHBondContact O-CD 2.97Å; G489-P493 VanDerWaalsContact O-CG 3.28Å; G489-P493 WeakPolarHBondContact O-CG 3.46Å
490	L	87.2	Confident	86.4	Confident	64 Å²	64	78.5 Å²	78.5	34%	0.335	40%	0.398	S	S	.	.	H	α-helix	trans	-83.6	-50.4	172.6	-76.6	162.3	0	0	0	112.2	I450 L486 G487 Y488 I494	I450-L490 HydrophobicContact CD1-CB 4.34Å; I450-L490 HydrophobicContact CD1-CD2 3.32Å; I450-L490 HydrophobicContact CD1-CG 3.75Å; L486-L490 HydrophobicContact CD1-CD1 3.96Å; L486-L490 HydrophobicContact CD1-CG 4.3Å; L486-L490 HydrophobicContact CG-CD1 4.04Å; L486-L490 PolarHBondContact O-N 2.87Å; G487-L490 PolarHBondContact O-N 3.38Å; Y488-L490 PolarHBondContact O-N 3.02Å; L490-I494 WeakPolarHBondContact O-CD1 3.42Å; L490-I494 VanDerWaalsContact O-CG1 3.26Å; L490-I494 WeakPolarHBondContact O-CG1 3.17Å
491	I	89.1	Confident	86.3	Confident	99 Å²	99	71.4 Å²	71.4	51%	0.508	37%	0.371	S	S	.	.	H	α-helix	trans	-77.9	-44	-168.3	-64.5	168.4	0	0	0	111.5	G487 Y488 I494 L495	G487-I491 WeakPolarHBondContact O-CB 3.45Å; G487-I491 VanDerWaalsContact O-CG1 3.26Å; G487-I491 WeakPolarHBondContact O-CG1 3.5Å; G487-I491 PolarHBondContact O-N 3.13Å; Y488-I491 PolarHBondContact O-N 3.27Å; I491-I494 PolarHBondContact O-N 2.85Å; I491-L495 HydrophobicContact CG2-CD1 3.49Å; I491-L495 VanDerWaalsContact CG2-CD1 3.49Å; I491-L495 HydrophobicContact CG2-CG 3.9Å; I491-L495 WeakPolarHBondContact O-CB 3.37Å; I491-L495 WeakPolarHBondContact O-CG 3.4Å; I491-L495 PolarHBondContact O-N 2.85Å
492	F	88.1	Confident	86.4	Confident	131 Å²	131	73.7 Å²	73.7	58%	0.575	38%	0.377	S	S	*	.	H	α-helix	trans	-64.3	-47.6	-172.8	179.2	-93.2	0	0	0	113.2	Y488 I494 L495 A496	Y488-F492 WeakPolarHBondContact O-CB 3.35Å; Y488-F492 PolarHBondContact O-N 2.9Å; F492-I494 VanDerWaalsContact C-N 3.28Å; F492-I494 PolarHBondContact O-N 3.37Å; F492-L495 PolarHBondContact O-N 2.8Å; F492-A496 HydrophobicContact CE1-CB 4.49Å; F492-A496 VanDerWaalsContact O-CB 3.25Å; F492-A496 WeakPolarHBondContact O-CB 3.35Å; F492-A496 PolarHBondContact O-N 2.88Å
493	P	84.4	Confident	86.7	Confident	36 Å²	36	77.7 Å²	77.7	23%	0.234	40%	0.397	C	S	.	.	H	α-helix	trans	-62	-35.1	177.4	-24.6	36.4	0	0	0	113.1	V460 G489 F497	V460-P493 HydrophobicContact CG1-CG 4.08Å; G489-P493 VanDerWaalsContact O-CD 3.23Å; G489-P493 WeakPolarHBondContact O-CD 2.97Å; G489-P493 VanDerWaalsContact O-CG 3.28Å; G489-P493 WeakPolarHBondContact O-CG 3.46Å; P493-F497 WeakPolarHBondContact O-CB 3.26Å; P493-F497 PolarHBondContact O-N 3.26Å
494	I	84.9	Confident	86.7	Confident	114 Å²	114	71.3 Å²	71.3	59%	0.585	38%	0.383	S	S	*	.	H	α-helix	trans	-69.8	-46.5	177.7	-63.2	173.9	0	0	0	110.4	L490 I491 F492 F497 S498	L490-I494 WeakPolarHBondContact O-CD1 3.42Å; L490-I494 VanDerWaalsContact O-CG1 3.26Å; L490-I494 WeakPolarHBondContact O-CG1 3.17Å; I491-I494 PolarHBondContact O-N 2.85Å; F492-I494 VanDerWaalsContact C-N 3.28Å; F492-I494 PolarHBondContact O-N 3.37Å; I494-F497 PolarHBondContact O-N 2.9Å; I494-S498 PolarHBondContact O-N 3.3Å
495	L	90.4	Very high	86.5	Confident	104 Å²	104	70.4 Å²	70.4	55%	0.545	37%	0.372	S	S	.	.	H	α-helix	trans	-62.3	-47.4	175.7	-73.8	179.5	0	0	0	111.4	I491 F492 F497 S498 A499	I491-L495 HydrophobicContact CG2-CD1 3.49Å; I491-L495 VanDerWaalsContact CG2-CD1 3.49Å; I491-L495 HydrophobicContact CG2-CG 3.9Å; I491-L495 WeakPolarHBondContact O-CB 3.37Å; I491-L495 WeakPolarHBondContact O-CG 3.4Å; I491-L495 PolarHBondContact O-N 2.85Å; F492-L495 PolarHBondContact O-N 2.8Å; L495-F497 VanDerWaalsContact C-N 3.31Å; L495-F497 PolarHBondContact O-N 2.91Å; L495-S498 PolarHBondContact O-N 2.81Å; L495-S498 PolarHBondContact O-OG 2.8Å; L495-A499 WeakPolarHBondContact O-CB 3.48Å; L495-A499 PolarHBondContact O-N 2.77Å
496	A	87.9	Confident	86.3	Confident	32 Å²	32	73.8 Å²	73.8	26%	0.264	39%	0.387	S	S	.	.	H	α-helix	trans	-58.7	-43.3	176.7	0	0	0	0	0	111.5	F492 A499 I500	F492-A496 HydrophobicContact CE1-CB 4.49Å; F492-A496 VanDerWaalsContact O-CB 3.25Å; F492-A496 WeakPolarHBondContact O-CB 3.35Å; F492-A496 PolarHBondContact O-N 2.88Å; A496-A499 PolarHBondContact O-N 2.83Å; A496-I500 WeakPolarHBondContact O-CB 3.39Å; A496-I500 VanDerWaalsContact O-CG1 3.24Å; A496-I500 WeakPolarHBondContact O-CG1 3.47Å; A496-I500 PolarHBondContact O-N 3.44Å
497	F	84.9	Confident	86.3	Confident	77 Å²	77	73.7 Å²	73.7	34%	0.338	39%	0.389	S	S	.	.	H	α-helix	trans	-61.1	-46.4	175	177.5	-94.8	0	0	0	112.1	W378 L379 P493 I494 L495 A499 I500 R501	W378-F497 HydrophobicContact CH2-CD1 4.49Å; W378-F497 AromaticContact CH2-CE1 3.75Å; W378-F497 HydrophobicContact CH2-CE1 3.75Å; W378-F497 AromaticContact CZ3-CE1 3.97Å; W378-F497 HydrophobicContact CZ3-CE1 3.97Å; L379-F497 HydrophobicContact CD1-CE1 4.48Å; L379-F497 HydrophobicContact CD1-CZ 4.29Å; L379-F497 HydrophobicContact CD2-CE1 4.28Å; L379-F497 HydrophobicContact CD2-CE2 3.98Å; L379-F497 HydrophobicContact CD2-CZ 3.36Å; L379-F497 HydrophobicContact CG-CE1 4.41Å; L379-F497 HydrophobicContact CG-CZ 3.92Å; P493-F497 WeakPolarHBondContact O-CB 3.26Å; P493-F497 PolarHBondContact O-N 3.26Å; I494-F497 PolarHBondContact O-N 2.9Å; L495-F497 VanDerWaalsContact C-N 3.31Å; L495-F497 PolarHBondContact O-N 2.91Å; F497-A499 VanDerWaalsContact C-N 3.35Å; F497-A499 PolarHBondContact O-N 3.14Å; F497-I500 PolarHBondContact O-N 3.14Å; F497-R501 VanDerWaalsContact O-CB 3.23Å; F497-R501 WeakPolarHBondContact O-CB 3.36Å; F497-R501 PolarHBondContact O-N 3.01Å
498	S	85.2	Confident	86.2	Confident	59 Å²	59	79 Å²	79	41%	0.413	40%	0.403	S	S	.	.	H	α-helix	trans	-61.8	-40.9	177.2	72.7	0	0	0	0	112.5	I494 L495 R501 M502	I494-S498 PolarHBondContact O-N 3.3Å; L495-S498 PolarHBondContact O-N 2.81Å; L495-S498 PolarHBondContact O-OG 2.8Å; S498-R501 PolarHBondContact O-N 2.78Å; S498-M502 WeakPolarHBondContact O-CB 3.48Å; S498-M502 PolarHBondContact O-N 2.78Å
499	A	90.8	Very high	85.8	Confident	41 Å²	41	75.2 Å²	75.2	34%	0.339	39%	0.389	S	S	.	.	H	α-helix	trans	-67.1	-48.3	178	0	0	0	0	0	111.9	L495 A496 F497 R501 M502 L503	L495-A499 WeakPolarHBondContact O-CB 3.48Å; L495-A499 PolarHBondContact O-N 2.77Å; A496-A499 PolarHBondContact O-N 2.83Å; F497-A499 VanDerWaalsContact C-N 3.35Å; F497-A499 PolarHBondContact O-N 3.14Å; A499-R501 VanDerWaalsContact C-N 3.26Å; A499-R501 PolarHBondContact O-N 2.8Å; A499-M502 PolarHBondContact O-N 3.42Å; A499-L503 VanDerWaalsContact O-CB 3.24Å; A499-L503 WeakPolarHBondContact O-CB 2.96Å; A499-L503 WeakPolarHBondContact O-CG 3.43Å; A499-L503 PolarHBondContact O-N 2.93Å
500	I	87.9	Confident	85.6	Confident	104 Å²	104	78 Å²	78	53%	0.533	41%	0.409	S	S	.	.	H	α-helix	trans	-59.4	-41.5	176.2	-69.5	166.2	0	0	0	110.4	A496 F497 V504 Y505	A496-I500 WeakPolarHBondContact O-CB 3.39Å; A496-I500 VanDerWaalsContact O-CG1 3.24Å; A496-I500 WeakPolarHBondContact O-CG1 3.47Å; A496-I500 PolarHBondContact O-N 3.44Å; F497-I500 PolarHBondContact O-N 3.14Å; I500-V504 WeakPolarHBondContact O-CA 3.39Å; I500-V504 VanDerWaalsContact O-CB 3.31Å; I500-V504 WeakPolarHBondContact O-CB 3.35Å; I500-V504 PolarHBondContact O-N 3.42Å; I500-Y505 PolarHBondContact O-N 3.34Å; I500-Y505 VanDerWaalsContact O-N 3.13Å
501	R	83.3	Confident	85.5	Confident	41 Å²	41	83.7 Å²	83.7	16%	0.155	43%	0.426	C	S	.	.	I	π-helix	trans	-62.3	-52.4	178.5	179.8	-175.3	166.3	127.4	5.2	111.7	W378 F497 S498 A499 Y505 E506	W378-R501 PolarHBondContact O-NH1 2.92Å; W378-R501 PolarHBondContact O-NH2 3.04Å; F497-R501 VanDerWaalsContact O-CB 3.23Å; F497-R501 WeakPolarHBondContact O-CB 3.36Å; F497-R501 PolarHBondContact O-N 3.01Å; S498-R501 PolarHBondContact O-N 2.78Å; A499-R501 VanDerWaalsContact C-N 3.26Å; A499-R501 PolarHBondContact O-N 2.8Å; R501-Y505 PolarHBondContact O-N 2.71Å; R501-E506 HydrophobicContact CG-CG 4.16Å; R501-E506 IonicContact CZ-OE1 2.82Å; R501-E506 IonicContact NE-OE1 3.18Å; R501-E506 PolarHBondContact NE-OE1 3.07Å; R501-E506 IonicContact NH2-OE1 2.87Å; R501-E506 PolarHBondContact NH2-OE1 2.66Å; R501-E506 PolarHBondContact O-N 2.87Å
502	M	85.7	Confident	84.9	Confident	125 Å²	125	83.2 Å²	83.2	62%	0.616	42%	0.421	S	S	*	.	I	π-helix	trans	-68.1	-40.6	-176.4	-170.3	-177.1	78.4	0	0	112.1	S498 A499 P507	S498-M502 WeakPolarHBondContact O-CB 3.48Å; S498-M502 PolarHBondContact O-N 2.78Å; A499-M502 PolarHBondContact O-N 3.42Å; M502-P507 WeakPolarHBondContact O-CD 3.34Å
503	L	90.3	Very high	84.2	Confident	119 Å²	119	80.6 Å²	80.6	62%	0.623	41%	0.413	S	S	*	.	I	π-helix	trans	-89.2	-28.8	-172.6	-63.5	173.9	0	0	0	113.9	A499 P507	A499-L503 VanDerWaalsContact O-CB 3.24Å; A499-L503 WeakPolarHBondContact O-CB 2.96Å; A499-L503 WeakPolarHBondContact O-CG 3.43Å; A499-L503 PolarHBondContact O-N 2.93Å; L503-P507 WeakPolarHBondContact O-CG 3.31Å
504	V	86.2	Confident	84.1	Confident	93 Å²	93	85.4 Å²	85.4	56%	0.564	43%	0.43	S	S	*	.	I	π-helix	trans	-117.9	-55.8	-173.4	-173.7	0	0	0	0	111.6	I500 P507 Y508	I500-V504 WeakPolarHBondContact O-CA 3.39Å; I500-V504 VanDerWaalsContact O-CB 3.31Å; I500-V504 WeakPolarHBondContact O-CB 3.35Å; I500-V504 PolarHBondContact O-N 3.42Å; V504-P507 WeakPolarHBondContact O-CG 3.44Å; V504-Y508 WeakPolarHBondContact O-CB 3.5Å; V504-Y508 PolarHBondContact O-N 2.76Å; V504-Y508 VanDerWaalsContact O-N 3.14Å
505	Y	80.1	Confident	84	Confident	57 Å²	57	84.8 Å²	84.8	22%	0.224	43%	0.428	C	S	.	.	I	π-helix	trans	-71.2	-52.3	-168.9	-178.1	-96.8	0	0	0	113.3	I500 R501 Y508 L509	I500-Y505 PolarHBondContact O-N 3.34Å; I500-Y505 VanDerWaalsContact O-N 3.13Å; R501-Y505 PolarHBondContact O-N 2.71Å; Y505-Y508 PolarHBondContact O-N 2.77Å; Y505-L509 HydrophobicContact CE1-CD2 3.91Å; Y505-L509 VanDerWaalsContact O-CB 3.31Å; Y505-L509 WeakPolarHBondContact O-CB 3.45Å; Y505-L509 PolarHBondContact O-N 2.8Å
506	E	81.6	Confident	83.3	Confident	74 Å²	74	81.7 Å²	81.7	35%	0.346	42%	0.417	S	S	.	.	H	α-helix	trans	-61.6	-45.2	-179.7	-74.6	179.7	-177.9	0	0	113.8	R501 L509 S510	R501-E506 HydrophobicContact CG-CG 4.16Å; R501-E506 IonicContact CZ-OE1 2.82Å; R501-E506 IonicContact NE-OE1 3.18Å; R501-E506 PolarHBondContact NE-OE1 3.07Å; R501-E506 IonicContact NH2-OE1 2.87Å; R501-E506 PolarHBondContact NH2-OE1 2.66Å; R501-E506 PolarHBondContact O-N 2.87Å; E506-L509 PolarHBondContact O-N 2.75Å; E506-S510 VanDerWaalsContact O-CB 3.3Å; E506-S510 WeakPolarHBondContact O-CB 3.36Å; E506-S510 PolarHBondContact O-N 3.31Å; E506-S510 PolarHBondContact O-OG 2.76Å
507	P	87.4	Confident	82.7	Confident	47 Å²	47	85.4 Å²	85.4	31%	0.305	43%	0.429	S	S	.	.	H	α-helix	trans	-67.6	-36.4	175.5	22.9	-31.1	0	0	0	112.1	M502 L503 V504 R511	M502-P507 WeakPolarHBondContact O-CD 3.34Å; L503-P507 WeakPolarHBondContact O-CG 3.31Å; V504-P507 WeakPolarHBondContact O-CG 3.44Å; P507-R511 WeakPolarHBondContact O-CB 3.32Å; P507-R511 VanDerWaalsContact O-CG 3.24Å; P507-R511 WeakPolarHBondContact O-CG 3.29Å; P507-R511 PolarHBondContact O-N 3.19Å
508	Y	83.7	Confident	82.3	Confident	138 Å²	138	89 Å²	89	54%	0.541	44%	0.444	S	S	.	.	H	α-helix	trans	-62.3	-48.8	173.4	172.1	-96.2	0	0	0	111.7	V504 Y505 S510 R511 Q512	V504-Y508 WeakPolarHBondContact O-CB 3.5Å; V504-Y508 PolarHBondContact O-N 2.76Å; V504-Y508 VanDerWaalsContact O-N 3.14Å; Y505-Y508 PolarHBondContact O-N 2.77Å; Y508-S510 PolarHBondContact O-N 2.92Å; Y508-R511 WeakPolarHBondContact O-CB 3.48Å; Y508-R511 PolarHBondContact O-N 2.79Å; Y508-Q512 HydrophobicContact CD1-CG 4.33Å; Y508-Q512 HydrophobicContact CE1-CG 3.89Å; Y508-Q512 HydrophobicContact CE2-CG 4.14Å; Y508-Q512 WeakPolarHBondContact O-CG 3.15Å; Y508-Q512 PolarHBondContact O-N 2.84Å; Y508-Q512 PolarHBondContact OH-NE2 2.8Å
509	L	78.6	Confident	81.8	Confident	23 Å²	23	89 Å²	89	12%	0.12	44%	0.444	C	S	.	.	H	α-helix	trans	-62.6	-43.1	179.3	-177.1	64.1	0	0	0	111.2	P381 Y505 E506 R511 Q512 L513	P381-L509 HydrophobicContact CG-CD2 4.5Å; Y505-L509 HydrophobicContact CE1-CD2 3.91Å; Y505-L509 VanDerWaalsContact O-CB 3.31Å; Y505-L509 WeakPolarHBondContact O-CB 3.45Å; Y505-L509 PolarHBondContact O-N 2.8Å; E506-L509 PolarHBondContact O-N 2.75Å; L509-R511 VanDerWaalsContact C-N 3.34Å; L509-R511 PolarHBondContact O-N 2.84Å; L509-Q512 PolarHBondContact O-N 2.77Å; L509-L513 HydrophobicContact CD1-CG 4.46Å; L509-L513 HydrophobicContact CG-CD1 4.12Å; L509-L513 HydrophobicContact CG-CG 4.48Å; L509-L513 WeakPolarHBondContact O-CB 3.47Å; L509-L513 WeakPolarHBondContact O-CG 3.41Å; L509-L513 PolarHBondContact O-N 2.79Å
510	S	80.3	Confident	80.8	Confident	60 Å²	60	95 Å²	95	42%	0.42	46%	0.458	S	S	.	.	H	α-helix	trans	-62.8	-39	176.6	-61.5	0	0	0	0	112.3	E506 Y508 K514	E506-S510 VanDerWaalsContact O-CB 3.3Å; E506-S510 WeakPolarHBondContact O-CB 3.36Å; E506-S510 PolarHBondContact O-N 3.31Å; E506-S510 PolarHBondContact O-OG 2.76Å; Y508-S510 PolarHBondContact O-N 2.92Å; S510-K514 WeakPolarHBondContact O-CB 3.44Å; S510-K514 VanDerWaalsContact O-CG 3.28Å; S510-K514 WeakPolarHBondContact O-CG 3.5Å; S510-K514 PolarHBondContact O-N 3.44Å
511	R	85.1	Confident	80	Confident	184 Å²	184	98.1 Å²	98.1	69%	0.694	46%	0.463	S	S	*	.	H	α-helix	trans	-64.2	-45.9	173.5	-75.6	173.3	-177.6	-171.3	2.2	111.2	P507 Y508 L509 K514 L515	P507-R511 WeakPolarHBondContact O-CB 3.32Å; P507-R511 VanDerWaalsContact O-CG 3.24Å; P507-R511 WeakPolarHBondContact O-CG 3.29Å; P507-R511 PolarHBondContact O-N 3.19Å; Y508-R511 WeakPolarHBondContact O-CB 3.48Å; Y508-R511 PolarHBondContact O-N 2.79Å; L509-R511 VanDerWaalsContact C-N 3.34Å; L509-R511 PolarHBondContact O-N 2.84Å; R511-K514 PolarHBondContact O-N 3Å; R511-L515 WeakPolarHBondContact O-CG 3.32Å; R511-L515 PolarHBondContact O-N 3.47Å
512	Q	75.5	Confident	79.8	Confident	88 Å²	88	98.7 Å²	98.7	41%	0.411	48%	0.476	S	S	.	.	H	α-helix	trans	-61.2	-45.6	176.9	-73.9	-69.4	-13	0	0	111.9	Y508 L509 K514 L515 A516	Y508-Q512 HydrophobicContact CD1-CG 4.33Å; Y508-Q512 HydrophobicContact CE1-CG 3.89Å; Y508-Q512 HydrophobicContact CE2-CG 4.14Å; Y508-Q512 WeakPolarHBondContact O-CG 3.15Å; Y508-Q512 PolarHBondContact O-N 2.84Å; Y508-Q512 PolarHBondContact OH-NE2 2.8Å; L509-Q512 PolarHBondContact O-N 2.77Å; Q512-K514 PolarHBondContact O-N 3.25Å; Q512-L515 PolarHBondContact O-N 2.91Å; Q512-A516 WeakPolarHBondContact O-CB 3.22Å; Q512-A516 PolarHBondContact O-N 2.83Å
513	L	75	Confident	79.4	Confident	77 Å²	77	99.3 Å²	99.3	40%	0.403	48%	0.476	S	S	.	.	H	α-helix	trans	-62.2	-42	176.8	-73.4	172.1	0	0	0	111.9	L509 A516 Q517	L509-L513 HydrophobicContact CD1-CG 4.46Å; L509-L513 HydrophobicContact CG-CD1 4.12Å; L509-L513 HydrophobicContact CG-CG 4.48Å; L509-L513 WeakPolarHBondContact O-CB 3.47Å; L509-L513 WeakPolarHBondContact O-CG 3.41Å; L509-L513 PolarHBondContact O-N 2.79Å; L513-A516 PolarHBondContact O-N 2.83Å; L513-Q517 WeakPolarHBondContact O-CB 3.45Å; L513-Q517 WeakPolarHBondContact O-CG 3.29Å; L513-Q517 PolarHBondContact O-N 2.84Å
514	K	81.4	Confident	78.6	Confident	136 Å²	136	96.2 Å²	96.2	59%	0.591	46%	0.46	S	S	*	.	H	α-helix	trans	-63.6	-41.5	174.7	-75.6	176.1	-178.6	-178.5	0	112.3	S510 R511 Q512 Q517 K518	S510-K514 WeakPolarHBondContact O-CB 3.44Å; S510-K514 VanDerWaalsContact O-CG 3.28Å; S510-K514 WeakPolarHBondContact O-CG 3.5Å; S510-K514 PolarHBondContact O-N 3.44Å; R511-K514 PolarHBondContact O-N 3Å; Q512-K514 PolarHBondContact O-N 3.25Å; K514-Q517 PolarHBondContact O-N 2.82Å; K514-K518 WeakPolarHBondContact O-CG 3.48Å; K514-K518 PolarHBondContact O-N 2.9Å
515	L	83.5	Confident	78.2	Confident	102 Å²	102	97.5 Å²	97.5	53%	0.534	45%	0.454	S	S	.	.	H	α-helix	trans	-64.2	-42.5	175.5	-72.8	172	0	0	0	111.4	R511 Q512 K518 S519	R511-L515 WeakPolarHBondContact O-CG 3.32Å; R511-L515 PolarHBondContact O-N 3.47Å; Q512-L515 PolarHBondContact O-N 2.91Å; L515-K518 PolarHBondContact O-N 2.79Å; L515-S519 PolarHBondContact O-N 2.79Å; L515-S519 PolarHBondContact O-OG 2.86Å
516	A	75.1	Confident	78.3	Confident	38 Å²	38	101.6 Å²	101.6	31%	0.314	48%	0.475	S	S	.	.	H	α-helix	trans	-63.8	-39.5	175	0	0	0	0	0	112.3	Q512 L513 S519 R520	Q512-A516 WeakPolarHBondContact O-CB 3.22Å; Q512-A516 PolarHBondContact O-N 2.83Å; L513-A516 PolarHBondContact O-N 2.83Å; A516-S519 PolarHBondContact O-N 3.24Å; A516-S519 PolarHBondContact O-OG 3.01Å; A516-R520 WeakPolarHBondContact O-CB 3.5Å; A516-R520 VanDerWaalsContact O-CG 3.25Å; A516-R520 WeakPolarHBondContact O-CG 3.35Å; A516-R520 PolarHBondContact O-N 3.35Å
517	Q	74.3	Confident	78.3	Confident	111 Å²	111	102.7 Å²	102.7	52%	0.519	48%	0.481	S	S	.	.	H	α-helix	trans	-64.7	-42.6	173.7	-76.9	178.1	-19.1	0	0	111.9	L513 K514 R520 R521	L513-Q517 WeakPolarHBondContact O-CB 3.45Å; L513-Q517 WeakPolarHBondContact O-CG 3.29Å; L513-Q517 PolarHBondContact O-N 2.84Å; K514-Q517 PolarHBondContact O-N 2.82Å; Q517-R520 PolarHBondContact O-N 3.47Å; Q517-R521 WeakPolarHBondContact O-CB 3.35Å; Q517-R521 WeakPolarHBondContact O-CG 3.44Å; Q517-R521 PolarHBondContact O-N 2.8Å
518	K	78	Confident	78	Confident	151 Å²	151	101.3 Å²	101.3	66%	0.657	47%	0.47	S	S	*	.	H	α-helix	trans	-62.2	-45.2	175.5	-75.6	-178.8	178.4	-172.3	0	111.8	K514 L515 R521 A522	K514-K518 WeakPolarHBondContact O-CG 3.48Å; K514-K518 PolarHBondContact O-N 2.9Å; L515-K518 PolarHBondContact O-N 2.79Å; K518-R521 PolarHBondContact O-N 2.85Å; K518-A522 WeakPolarHBondContact O-CB 3.38Å; K518-A522 PolarHBondContact O-N 2.94Å
519	S	73.3	Confident	78	Confident	60 Å²	60	96.9 Å²	96.9	42%	0.42	46%	0.462	S	S	.	.	H	α-helix	trans	-66.8	-39.6	178.6	68	0	0	0	0	112.2	L515 A516 A522 K523	L515-S519 PolarHBondContact O-N 2.79Å; L515-S519 PolarHBondContact O-OG 2.86Å; A516-S519 PolarHBondContact O-N 3.24Å; A516-S519 PolarHBondContact O-OG 3.01Å; S519-A522 PolarHBondContact O-N 2.69Å; S519-K523 WeakPolarHBondContact O-CG 3.23Å; S519-K523 PolarHBondContact O-N 3Å
520	R	69.7	Low	78.5	Confident	167 Å²	167	101.1 Å²	101.1	63%	0.63	48%	0.477	S	S	*	.	H	α-helix	trans	-59.7	-46.9	172.2	-76.1	176.7	-176.2	-172.9	0.9	111.9	A516 Q517 A522 K523 L524	A516-R520 WeakPolarHBondContact O-CB 3.5Å; A516-R520 VanDerWaalsContact O-CG 3.25Å; A516-R520 WeakPolarHBondContact O-CG 3.35Å; A516-R520 PolarHBondContact O-N 3.35Å; Q517-R520 PolarHBondContact O-N 3.47Å; R520-A522 VanDerWaalsContact C-N 3.35Å; R520-A522 PolarHBondContact O-N 2.77Å; R520-K523 PolarHBondContact O-N 2.78Å; R520-L524 WeakPolarHBondContact O-CB 3.4Å; R520-L524 PolarHBondContact O-N 3.24Å
521	R	72.6	Confident	78.8	Confident	170 Å²	170	103.2 Å²	103.2	64%	0.642	48%	0.478	S	S	*	.	H	α-helix	trans	-63.7	-38.1	177	-73.1	177.6	179.7	-171.4	-0.2	112.5	Q517 K518 R525	Q517-R521 WeakPolarHBondContact O-CB 3.35Å; Q517-R521 WeakPolarHBondContact O-CG 3.44Å; Q517-R521 PolarHBondContact O-N 2.8Å; K518-R521 PolarHBondContact O-N 2.85Å; R521-R525 WeakPolarHBondContact O-CG 3.24Å; R521-R525 PolarHBondContact O-N 3.42Å; R521-R525 VanDerWaalsContact O-N 3.08Å
522	A	78.7	Confident	78.9	Confident	52 Å²	52	98.4 Å²	98.4	43%	0.43	46%	0.46	S	S	.	.	H	α-helix	trans	-65.9	-46.2	176.8	0	0	0	0	0	112.1	K518 S519 R520 R525 E526	K518-A522 WeakPolarHBondContact O-CB 3.38Å; K518-A522 PolarHBondContact O-N 2.94Å; S519-A522 PolarHBondContact O-N 2.69Å; R520-A522 VanDerWaalsContact C-N 3.35Å; R520-A522 PolarHBondContact O-N 2.77Å; A522-R525 WeakPolarHBondContact O-CB 3.29Å; A522-R525 PolarHBondContact O-N 2.81Å; A522-E526 PolarHBondContact O-N 3.09Å
523	K	77.9	Confident	79.6	Confident	138 Å²	138	102 Å²	102	60%	0.6	47%	0.47	S	S	*	.	H	α-helix	trans	-59.3	-46.8	174.8	-72.9	-176.7	176.5	-167.1	0	112.1	S519 R520 R525 E526 E527	S519-K523 WeakPolarHBondContact O-CG 3.23Å; S519-K523 PolarHBondContact O-N 3Å; R520-K523 PolarHBondContact O-N 2.78Å; K523-R525 VanDerWaalsContact C-N 3.3Å; K523-R525 PolarHBondContact O-N 3.04Å; K523-E526 PolarHBondContact O-N 2.95Å; K523-E526 VanDerWaalsContact O-N 3.15Å; K523-E527 WeakPolarHBondContact O-CG 3.45Å; K523-E527 PolarHBondContact O-N 2.8Å
524	L	72.3	Confident	80.4	Confident	55 Å²	55	102.9 Å²	102.9	29%	0.288	47%	0.472	S	S	.	.	H	α-helix	trans	-59.2	-40.8	177.6	-177.2	65.5	0	0	0	112	R520 E527 L528 V620	R520-L524 WeakPolarHBondContact O-CB 3.4Å; R520-L524 PolarHBondContact O-N 3.24Å; L524-E527 PolarHBondContact O-N 2.82Å; L524-L528 HydrophobicContact CG-CD1 4.17Å; L524-L528 WeakPolarHBondContact O-CB 3.33Å; L524-L528 WeakPolarHBondContact O-CG 3.41Å; L524-L528 PolarHBondContact O-N 3.02Å; L524-V620 HydrophobicContact CD1-CG1 4.08Å
525	R	78.5	Confident	80.8	Confident	120 Å²	120	96.6 Å²	96.6	45%	0.453	45%	0.445	S	S	.	.	H	α-helix	trans	-63.4	-42.2	175.4	-77.2	176.1	-179.9	155.3	-3	112.5	R521 A522 K523 L528 A529 D580	R521-R525 WeakPolarHBondContact O-CG 3.24Å; R521-R525 PolarHBondContact O-N 3.42Å; R521-R525 VanDerWaalsContact O-N 3.08Å; A522-R525 WeakPolarHBondContact O-CB 3.29Å; A522-R525 PolarHBondContact O-N 2.81Å; K523-R525 VanDerWaalsContact C-N 3.3Å; K523-R525 PolarHBondContact O-N 3.04Å; R525-L528 PolarHBondContact O-N 3.15Å; R525-A529 WeakPolarHBondContact O-CB 3.12Å; R525-A529 PolarHBondContact O-N 2.93Å; R525-D580 PolarHBondContact NE-O 2.79Å; R525-D580 PolarHBondContact NH2-O 2.77Å
526	E	82.5	Confident	81.2	Confident	142 Å²	142	95.4 Å²	95.4	66%	0.664	44%	0.439	S	S	*	.	H	α-helix	trans	-65.3	-43.1	178.2	-173.2	174.8	-173.4	0	0	111.6	A522 K523 A529 R530	A522-E526 PolarHBondContact O-N 3.09Å; K523-E526 PolarHBondContact O-N 2.95Å; K523-E526 VanDerWaalsContact O-N 3.15Å; E526-A529 PolarHBondContact O-N 2.82Å; E526-R530 WeakPolarHBondContact O-CB 3.43Å; E526-R530 PolarHBondContact O-N 2.82Å
527	E	80.9	Confident	82.1	Confident	98 Å²	98	96.7 Å²	96.7	46%	0.458	45%	0.445	S	S	.	.	H	α-helix	trans	-61.7	-46.2	174.7	-73.9	176.8	-174.3	0	0	112.1	K523 L524 R530 K531	K523-E527 WeakPolarHBondContact O-CG 3.45Å; K523-E527 PolarHBondContact O-N 2.8Å; L524-E527 PolarHBondContact O-N 2.82Å; E527-R530 PolarHBondContact O-N 2.83Å; E527-K531 PolarHBondContact O-N 2.83Å
528	L	81.7	Confident	83	Confident	17 Å²	17	93.4 Å²	93.4	9%	0.089	43%	0.433	C	S	.	.	H	α-helix	trans	-61.7	-42.7	175.8	-78.9	171	0	0	0	111.9	L524 R525 R530 K531 R532 V581 D617 V620	L524-L528 HydrophobicContact CG-CD1 4.17Å; L524-L528 WeakPolarHBondContact O-CB 3.33Å; L524-L528 WeakPolarHBondContact O-CG 3.41Å; L524-L528 PolarHBondContact O-N 3.02Å; R525-L528 PolarHBondContact O-N 3.15Å; L528-R530 VanDerWaalsContact C-N 3.32Å; L528-R530 PolarHBondContact O-N 2.8Å; L528-K531 PolarHBondContact O-N 2.8Å; L528-R532 WeakPolarHBondContact O-CB 3.29Å; L528-R532 PolarHBondContact O-N 2.8Å; L528-V581 HydrophobicContact CD1-CG1 3.66Å; L528-D617 WeakPolarHBondContact CD2-O 3.2Å; L528-V620 HydrophobicContact CD2-CB 4.01Å; L528-V620 HydrophobicContact CD2-CG2 3.92Å
529	A	84.2	Confident	83.8	Confident	45 Å²	45	86.9 Å²	86.9	37%	0.372	41%	0.405	S	S	.	.	H	α-helix	trans	-66.2	-32.6	176.4	0	0	0	0	0	112.9	R525 E526 R533	R525-A529 WeakPolarHBondContact O-CB 3.12Å; R525-A529 PolarHBondContact O-N 2.93Å; E526-A529 PolarHBondContact O-N 2.82Å; A529-R533 WeakPolarHBondContact O-CG 3.25Å; A529-R533 PolarHBondContact O-N 2.78Å; A529-R533 PolarHBondContact O-NE 2.86Å
530	R	88.2	Confident	84.8	Confident	113 Å²	113	88.8 Å²	88.8	43%	0.426	41%	0.407	S	S	.	.	H	α-helix	trans	-67.1	-53.5	173.1	-172.8	-176.6	69.7	-165.5	-1.8	110.8	E526 E527 L528 R532 R533 E534	E526-R530 WeakPolarHBondContact O-CB 3.43Å; E526-R530 PolarHBondContact O-N 2.82Å; E527-R530 PolarHBondContact O-N 2.83Å; L528-R530 VanDerWaalsContact C-N 3.32Å; L528-R530 PolarHBondContact O-N 2.8Å; R530-R532 VanDerWaalsContact C-N 3.3Å; R530-R532 PolarHBondContact O-N 2.82Å; R530-R533 WeakPolarHBondContact O-CB 3.47Å; R530-R533 PolarHBondContact O-N 3Å; R530-E534 WeakPolarHBondContact CG-OE1 3.13Å; R530-E534 IonicContact NE-OE1 3.23Å; R530-E534 WeakPolarHBondContact O-CG 3.34Å; R530-E534 PolarHBondContact O-N 2.77Å
531	K	86.8	Confident	85.9	Confident	103 Å²	103	87.8 Å²	87.8	45%	0.448	41%	0.414	S	S	.	.	H	α-helix	trans	-58.4	-40.2	178.8	-72.2	-171.6	177.5	-174.1	0	112.6	E527 L528 R533 E534 A535	E527-K531 PolarHBondContact O-N 2.83Å; L528-K531 PolarHBondContact O-N 2.8Å; K531-R533 PolarHBondContact O-N 2.62Å; K531-E534 PolarHBondContact O-N 2.84Å; K531-A535 WeakPolarHBondContact O-CB 3.4Å; K531-A535 PolarHBondContact O-N 3.17Å
532	R	87.7	Confident	86.9	Confident	84 Å²	84	81.4 Å²	81.4	32%	0.317	39%	0.392	S	S	.	.	H	α-helix	trans	-60.3	-42.6	174.6	179	174.6	-178.8	-175.8	1.3	112.4	L528 R530 A535 L536 Y616	L528-R532 WeakPolarHBondContact O-CB 3.29Å; L528-R532 PolarHBondContact O-N 2.8Å; R530-R532 VanDerWaalsContact C-N 3.3Å; R530-R532 PolarHBondContact O-N 2.82Å; R532-A535 PolarHBondContact O-N 2.76Å; R532-L536 HydrophobicContact CG-CD1 4.23Å; R532-L536 WeakPolarHBondContact O-CG 3.46Å; R532-L536 PolarHBondContact O-N 2.82Å; R532-Y616 HydrophobicContact CB-CD1 4.36Å; R532-Y616 HydrophobicContact CB-CD2 4.46Å; R532-Y616 HydrophobicContact CB-CE1 3.86Å; R532-Y616 HydrophobicContact CB-CE2 4.03Å; R532-Y616 WeakPolarHBondContact CD-OH 3.46Å; R532-Y616 HydrophobicContact CG-CE1 3.69Å; R532-Y616 HydrophobicContact CG-CE2 4.43Å
533	R	90.2	Very high	87.7	Confident	163 Å²	163	84.4 Å²	84.4	62%	0.615	39%	0.392	S	S	*	.	H	α-helix	trans	-66.7	-41.2	177.2	-76.5	-179.2	-71.5	145.7	-6.7	111.9	A529 R530 K531 L536 S537	A529-R533 WeakPolarHBondContact O-CG 3.25Å; A529-R533 PolarHBondContact O-N 2.78Å; A529-R533 PolarHBondContact O-NE 2.86Å; R530-R533 WeakPolarHBondContact O-CB 3.47Å; R530-R533 PolarHBondContact O-N 3Å; K531-R533 PolarHBondContact O-N 2.62Å; R533-L536 PolarHBondContact O-N 2.82Å; R533-S537 PolarHBondContact O-N 2.81Å; R533-S537 PolarHBondContact O-OG 2.9Å
534	E	91.1	Very high	88.5	Confident	96 Å²	96	88.2 Å²	88.2	45%	0.449	40%	0.402	S	S	.	.	H	α-helix	trans	-62.7	-42.1	174.8	-69.2	166.6	179.7	0	0	111.9	R530 K531 S537 T538	R530-E534 WeakPolarHBondContact CG-OE1 3.13Å; R530-E534 IonicContact NE-OE1 3.23Å; R530-E534 WeakPolarHBondContact O-CG 3.34Å; R530-E534 PolarHBondContact O-N 2.77Å; K531-E534 PolarHBondContact O-N 2.84Å; E534-S537 PolarHBondContact O-OG 2.81Å; E534-T538 WeakPolarHBondContact O-CG2 3.42Å; E534-T538 PolarHBondContact O-N 2.91Å; E534-T538 PolarHBondContact O-OG1 2.81Å
535	A	90.4	Very high	89.5	Confident	3 Å²	3	88.2 Å²	88.2	3%	0.025	41%	0.41	C	S	.	.	H	α-helix	trans	-64.9	-43.5	174.9	0	0	0	0	0	112	K531 R532 T538 Q539 F587 Y616	K531-A535 WeakPolarHBondContact O-CB 3.4Å; K531-A535 PolarHBondContact O-N 3.17Å; R532-A535 PolarHBondContact O-N 2.76Å; A535-T538 WeakPolarHBondContact CA-OG1 3.45Å; A535-T538 PolarHBondContact O-N 3.01Å; A535-T538 PolarHBondContact O-OG1 2.8Å; A535-Q539 VanDerWaalsContact O-CG 3.25Å; A535-Q539 WeakPolarHBondContact O-CG 3.4Å; A535-Q539 PolarHBondContact O-N 3.27Å; A535-F587 HydrophobicContact CB-CE1 3.97Å; A535-F587 HydrophobicContact CB-CZ 3.95Å; A535-Y616 HydrophobicContact CB-CD1 3.54Å; A535-Y616 HydrophobicContact CB-CE1 4.43Å; A535-Y616 HydrophobicContact CB-CG 4.25Å
536	L	92	Very high	90.3	Very high	78 Å²	78	82.8 Å²	82.8	41%	0.408	39%	0.391	S	S	.	.	H	α-helix	trans	-65.7	-39.9	177.3	-74.1	172.1	0	0	0	112.8	R532 R533 Q539 E540 F587	R532-L536 HydrophobicContact CG-CD1 4.23Å; R532-L536 WeakPolarHBondContact O-CG 3.46Å; R532-L536 PolarHBondContact O-N 2.82Å; R533-L536 PolarHBondContact O-N 2.82Å; L536-Q539 PolarHBondContact O-N 3.13Å; L536-E540 PolarHBondContact O-N 3Å; L536-F587 HydrophobicContact CD2-CE2 3.85Å; L536-F587 HydrophobicContact CD2-CZ 4.1Å; L536-F587 HydrophobicContact CG-CE2 4.24Å; L536-F587 HydrophobicContact CG-CZ 4.38Å
537	S	93.5	Very high	90.9	Very high	64 Å²	64	78.3 Å²	78.3	45%	0.448	38%	0.376	S	S	.	.	H	α-helix	trans	-66.6	-39.3	177.4	66.6	0	0	0	0	112	R533 E534 E540 L541	R533-S537 PolarHBondContact O-N 2.81Å; R533-S537 PolarHBondContact O-OG 2.9Å; E534-S537 PolarHBondContact O-OG 2.81Å; S537-E540 WeakPolarHBondContact O-CB 3.4Å; S537-E540 PolarHBondContact O-N 2.99Å; S537-L541 WeakPolarHBondContact O-CG 3.37Å; S537-L541 PolarHBondContact O-N 2.77Å; S537-L541 VanDerWaalsContact O-N 3.11Å
538	T	93.7	Very high	91.6	Very high	43 Å²	43	82.3 Å²	82.3	26%	0.264	39%	0.386	S	S	.	.	H	α-helix	trans	-66.2	-39.1	174.3	49.3	0	0	0	0	112.2	E534 A535 E540 L541 M542 G614	E534-T538 WeakPolarHBondContact O-CG2 3.42Å; E534-T538 PolarHBondContact O-N 2.91Å; E534-T538 PolarHBondContact O-OG1 2.81Å; A535-T538 WeakPolarHBondContact CA-OG1 3.45Å; A535-T538 PolarHBondContact O-N 3.01Å; A535-T538 PolarHBondContact O-OG1 2.8Å; T538-E540 VanDerWaalsContact C-N 3.32Å; T538-E540 PolarHBondContact O-N 3.32Å; T538-L541 PolarHBondContact O-N 3.33Å; T538-M542 WeakPolarHBondContact O-CG 3.32Å; T538-M542 PolarHBondContact O-N 2.81Å; T538-G614 VanDerWaalsContact OG1-CA 3.3Å; T538-G614 WeakPolarHBondContact OG1-CA 3.35Å; T538-G614 PolarHBondContact OG1-N 2.98Å
539	Q	93.5	Very high	92.1	Very high	13 Å²	13	82.3 Å²	82.3	6%	0.061	39%	0.388	C	S	.	.	H	α-helix	trans	-60.3	-40.1	171.6	-72	-175.2	-1.9	0	0	112.4	A535 L536 L541 M542 R543 D588 I591 P592 G614	A535-Q539 VanDerWaalsContact O-CG 3.25Å; A535-Q539 WeakPolarHBondContact O-CG 3.4Å; A535-Q539 PolarHBondContact O-N 3.27Å; L536-Q539 PolarHBondContact O-N 3.13Å; Q539-L541 PolarHBondContact O-N 3.43Å; Q539-M542 PolarHBondContact O-N 2.79Å; Q539-R543 PolarHBondContact O-N 3.24Å; Q539-D588 PolarHBondContact NE2-O 2.77Å; Q539-I591 HydrophobicContact CB-CD1 4.39Å; Q539-I591 WeakPolarHBondContact O-CG2 3.17Å; Q539-P592 HydrophobicContact CG-CG 4.44Å; Q539-G614 PolarHBondContact NE2-O 2.79Å
540	E	94	Very high	92.6	Very high	101 Å²	101	83.8 Å²	83.8	47%	0.472	39%	0.386	S	S	.	.	H	α-helix	trans	-63.2	-41.2	176.4	-166.7	60.8	-140.7	0	0	111.8	L536 S537 T538 M542 R543	L536-E540 PolarHBondContact O-N 3Å; S537-E540 WeakPolarHBondContact O-CB 3.4Å; S537-E540 PolarHBondContact O-N 2.99Å; T538-E540 VanDerWaalsContact C-N 3.32Å; T538-E540 PolarHBondContact O-N 3.32Å; E540-M542 VanDerWaalsContact C-N 3.33Å; E540-M542 PolarHBondContact O-N 2.82Å; E540-R543 VanDerWaalsContact CD-CZ 3.45Å; E540-R543 VanDerWaalsContact O-CB 3.32Å; E540-R543 WeakPolarHBondContact O-CB 3.45Å; E540-R543 PolarHBondContact O-N 2.91Å; E540-R543 IonicContact OE1-CZ 3.11Å; E540-R543 VanDerWaalsContact OE1-CZ 3.26Å; E540-R543 IonicContact OE1-NE 2.91Å; E540-R543 IonicContact OE1-NH1 2.76Å; E540-R543 PolarHBondContact OE1-NH1 3.35Å; E540-R543 IonicContact OE1-NH2 3.97Å; E540-R543 IonicContact OE2-CZ 3.9Å; E540-R543 IonicContact OE2-NE 3.93Å; E540-R543 IonicContact OE2-NH1 3.39Å; E540-R543 PolarHBondContact OE2-NH1 2.79Å; E540-R543 IonicContact OE2-NH2 3.98Å; E540-R543 PolarHBondContact OE2-NH2 2.82Å
541	L	93.7	Very high	92.9	Very high	145 Å²	145	87 Å²	87	76%	0.759	40%	0.398	S	S	*	.	H	α-helix	trans	-63.3	-38.2	174	-67.9	172.9	0	0	0	112.2	S537 T538 Q539 R543	S537-L541 WeakPolarHBondContact O-CG 3.37Å; S537-L541 PolarHBondContact O-N 2.77Å; S537-L541 VanDerWaalsContact O-N 3.11Å; T538-L541 PolarHBondContact O-N 3.33Å; Q539-L541 PolarHBondContact O-N 3.43Å; L541-R543 VanDerWaalsContact C-N 3.32Å; L541-R543 PolarHBondContact O-N 2.71Å
542	M	92.9	Very high	93.3	Very high	36 Å²	36	86 Å²	86	18%	0.177	40%	0.397	C	S	.	.	H	α-helix	trans	-75.2	-16.9	179.3	-72.2	-176.5	167.4	0	0	114.1	T538 Q539 E540 R544 A545 A546 I591 P592 Q613	T538-M542 WeakPolarHBondContact O-CG 3.32Å; T538-M542 PolarHBondContact O-N 2.81Å; Q539-M542 PolarHBondContact O-N 2.79Å; E540-M542 VanDerWaalsContact C-N 3.33Å; E540-M542 PolarHBondContact O-N 2.82Å; M542-R544 PolarHBondContact O-N 3.14Å; M542-R544 VanDerWaalsContact O-N 3.12Å; M542-A545 PolarHBondContact O-N 3.32Å; M542-A546 PolarHBondContact O-N 2.58Å; M542-I591 HydrophobicContact CB-CG2 4.04Å; M542-P592 HydrophobicContact SD-CB 3.87Å; M542-Q613 HydrophobicContact CE-CB 3.41Å; M542-Q613 VanDerWaalsContact CE-CB 3.41Å; M542-Q613 HydrophobicContact CE-CG 4.45Å
543	R	95.2	Very high	93.5	Very high	116 Å²	116	82.7 Å²	82.7	44%	0.438	39%	0.386	S	S	.	.	H	α-helix	trans	-53.7	-38.8	-174.5	-176	174.3	-73.2	167.7	0.8	113.3	Q539 E540 L541 S547	Q539-R543 PolarHBondContact O-N 3.24Å; E540-R543 VanDerWaalsContact CD-CZ 3.45Å; E540-R543 VanDerWaalsContact O-CB 3.32Å; E540-R543 WeakPolarHBondContact O-CB 3.45Å; E540-R543 PolarHBondContact O-N 2.91Å; E540-R543 IonicContact OE1-CZ 3.11Å; E540-R543 VanDerWaalsContact OE1-CZ 3.26Å; E540-R543 IonicContact OE1-NE 2.91Å; E540-R543 IonicContact OE1-NH1 2.76Å; E540-R543 PolarHBondContact OE1-NH1 3.35Å; E540-R543 IonicContact OE1-NH2 3.97Å; E540-R543 IonicContact OE2-CZ 3.9Å; E540-R543 IonicContact OE2-NE 3.93Å; E540-R543 IonicContact OE2-NH1 3.39Å; E540-R543 PolarHBondContact OE2-NH1 2.79Å; E540-R543 IonicContact OE2-NH2 3.98Å; E540-R543 PolarHBondContact OE2-NH2 2.82Å; L541-R543 VanDerWaalsContact C-N 3.32Å; L541-R543 PolarHBondContact O-N 2.71Å; R543-S547 VanDerWaalsContact O-CB 3.32Å; R543-S547 WeakPolarHBondContact O-CB 3.21Å; R543-S547 PolarHBondContact O-N 2.83Å; R543-S547 PolarHBondContact O-OG 2.85Å
544	R	95.6	Very high	93.6	Very high	218 Å²	218	79.9 Å²	79.9	82%	0.823	38%	0.381	S	S	*	.	H	α-helix	trans	-67.2	-43.1	177.8	-68.9	-175.9	-178.6	170.1	1.3	112.1	M542 S547 R548	M542-R544 PolarHBondContact O-N 3.14Å; M542-R544 VanDerWaalsContact O-N 3.12Å; R544-S547 PolarHBondContact O-N 2.83Å; R544-R548 PolarHBondContact O-N 2.83Å; R544-R548 VanDerWaalsContact O-N 3.09Å
545	A	94.3	Very high	93.7	Very high	54 Å²	54	79.8 Å²	79.8	45%	0.446	39%	0.391	S	S	.	.	H	α-helix	trans	-66.6	-45.7	177.6	0	0	0	0	0	111.3	M542 S547 R548 S549 A595	M542-A545 PolarHBondContact O-N 3.32Å; A545-S547 PolarHBondContact O-N 3.45Å; A545-R548 PolarHBondContact O-N 3.19Å; A545-S549 WeakPolarHBondContact O-CB 3.36Å; A545-S549 PolarHBondContact O-N 2.79Å; A545-A595 HydrophobicContact CB-CB 4.38Å
546	A	94.6	Very high	93.7	Very high	7 Å²	7	85.3 Å²	85.3	6%	0.058	42%	0.419	C	S	.	.	H	α-helix	trans	-58.6	-44.4	174.9	0	0	0	0	0	112.1	M542 R548 S549 K550 I591 Q594 A595	M542-A546 PolarHBondContact O-N 2.58Å; A546-R548 VanDerWaalsContact C-N 3.34Å; A546-R548 PolarHBondContact O-N 2.8Å; A546-S549 PolarHBondContact O-N 2.83Å; A546-K550 VanDerWaalsContact O-CB 3.27Å; A546-K550 WeakPolarHBondContact O-CB 3.25Å; A546-K550 PolarHBondContact O-N 3.02Å; A546-I591 HydrophobicContact CB-CG2 3.87Å; A546-I591 WeakPolarHBondContact CB-O 3.43Å; A546-Q594 HydrophobicContact CB-CB 4.16Å; A546-Q594 HydrophobicContact CB-CG 4.19Å; A546-Q594 WeakPolarHBondContact O-CG 3.39Å; A546-A595 HydrophobicContact CB-CB 4.16Å
547	S	95.5	Very high	93.6	Very high	48 Å²	48	84 Å²	84	34%	0.336	42%	0.416	S	S	.	.	H	α-helix	trans	-64.1	-37.3	177.8	-60.9	0	0	0	0	112.6	R543 R544 A545 R551	R543-S547 VanDerWaalsContact O-CB 3.32Å; R543-S547 WeakPolarHBondContact O-CB 3.21Å; R543-S547 PolarHBondContact O-N 2.83Å; R543-S547 PolarHBondContact O-OG 2.85Å; R544-S547 PolarHBondContact O-N 2.83Å; A545-S547 PolarHBondContact O-N 3.45Å; S547-R551 WeakPolarHBondContact O-CG 3.26Å; S547-R551 PolarHBondContact O-N 2.87Å; S547-R551 VanDerWaalsContact O-N 3.13Å
548	R	95	Very high	93.5	Very high	181 Å²	181	81.1 Å²	81.1	68%	0.683	40%	0.397	S	S	*	.	H	α-helix	trans	-68.3	-47.7	175.7	-176.9	-177.9	179.3	-173	-1.4	111.4	R544 A545 A546 K550 R551 N552	R544-R548 PolarHBondContact O-N 2.83Å; R544-R548 VanDerWaalsContact O-N 3.09Å; A545-R548 PolarHBondContact O-N 3.19Å; A546-R548 VanDerWaalsContact C-N 3.34Å; A546-R548 PolarHBondContact O-N 2.8Å; R548-K550 VanDerWaalsContact C-N 3.35Å; R548-K550 PolarHBondContact O-N 2.86Å; R548-R551 PolarHBondContact O-N 2.9Å; R548-N552 VanDerWaalsContact O-CG 3.3Å; R548-N552 PolarHBondContact O-N 3.31Å
549	S	92.8	Very high	93.5	Very high	17 Å²	17	79.1 Å²	79.1	12%	0.119	38%	0.384	C	S	.	.	H	α-helix	trans	-55.1	-50.5	174.1	169.5	0	0	0	0	110.6	A545 A546 R551 N552 E553 Q594	A545-S549 WeakPolarHBondContact O-CB 3.36Å; A545-S549 PolarHBondContact O-N 2.79Å; A546-S549 PolarHBondContact O-N 2.83Å; S549-R551 PolarHBondContact O-N 3.02Å; S549-N552 PolarHBondContact O-N 3.23Å; S549-N552 VanDerWaalsContact O-N 3.15Å; S549-E553 WeakPolarHBondContact O-CB 3.23Å; S549-E553 WeakPolarHBondContact O-CG 3.2Å; S549-E553 PolarHBondContact O-N 2.72Å; S549-Q594 WeakPolarHBondContact CB-O 3.42Å; S549-Q594 PolarHBondContact OG-NE2 2.78Å; S549-Q594 PolarHBondContact OG-O 3.39Å
550	K	94.5	Very high	93.5	Very high	76 Å²	76	78.8 Å²	78.8	33%	0.33	38%	0.383	S	S	.	.	H	α-helix	trans	-55.1	-46.5	178.1	-174.5	162.7	-176.1	158.7	0	112.7	A546 R548 M554 V560 Q594	A546-K550 VanDerWaalsContact O-CB 3.27Å; A546-K550 WeakPolarHBondContact O-CB 3.25Å; A546-K550 PolarHBondContact O-N 3.02Å; R548-K550 VanDerWaalsContact C-N 3.35Å; R548-K550 PolarHBondContact O-N 2.86Å; K550-M554 HydrophobicContact CD-CE 4Å; K550-M554 HydrophobicContact CG-CE 3.57Å; K550-M554 HydrophobicContact CG-SD 4.2Å; K550-M554 WeakPolarHBondContact O-CB 3.43Å; K550-M554 WeakPolarHBondContact O-CG 3.44Å; K550-M554 PolarHBondContact O-N 3.37Å; K550-V560 HydrophobicContact CD-CG1 4.27Å; K550-V560 HydrophobicContact CG-CG1 4.07Å; K550-Q594 HydrophobicContact CB-CG 4.08Å
551	R	95.1	Very high	93.5	Very high	182 Å²	182	74 Å²	74	69%	0.687	36%	0.361	S	S	*	.	H	α-helix	trans	-65.7	-40.8	178	-71.7	177.3	-165.4	157	3.7	113	S547 R548 S549 M554 S555	S547-R551 WeakPolarHBondContact O-CG 3.26Å; S547-R551 PolarHBondContact O-N 2.87Å; S547-R551 VanDerWaalsContact O-N 3.13Å; R548-R551 PolarHBondContact O-N 2.9Å; S549-R551 PolarHBondContact O-N 3.02Å; R551-M554 PolarHBondContact O-N 2.96Å; R551-S555 PolarHBondContact O-N 3.44Å; R551-S555 VanDerWaalsContact O-N 3.12Å
552	N	93.3	Very high	93.4	Very high	81 Å²	81	71 Å²	71	43%	0.433	35%	0.345	S	S	.	.	H	α-helix	trans	-67.3	-43	179.2	-71.3	-7.5	0	0	0	111.9	R548 S549 S555 I556	R548-N552 VanDerWaalsContact O-CG 3.3Å; R548-N552 PolarHBondContact O-N 3.31Å; S549-N552 PolarHBondContact O-N 3.23Å; S549-N552 VanDerWaalsContact O-N 3.15Å; N552-S555 PolarHBondContact O-N 2.89Å; N552-S555 PolarHBondContact O-OG 3.31Å; N552-I556 WeakPolarHBondContact O-CG1 3.31Å; N552-I556 PolarHBondContact O-N 3.33Å
553	E	93	Very high	93.5	Very high	15 Å²	15	73.6 Å²	73.6	7%	0.07	36%	0.357	C	S	.	.	H	α-helix	trans	-67.5	-38.3	177.3	-68.4	-68.3	156.7	0	0	110.7	S549 S555 I556 S557 G558 L559 V560 I597 S600	S549-E553 WeakPolarHBondContact O-CB 3.23Å; S549-E553 WeakPolarHBondContact O-CG 3.2Å; S549-E553 PolarHBondContact O-N 2.72Å; E553-S555 PolarHBondContact O-N 2.93Å; E553-I556 PolarHBondContact O-N 2.93Å; E553-S557 PolarHBondContact O-N 3.48Å; E553-G558 PolarHBondContact O-N 3.4Å; E553-G558 VanDerWaalsContact OE2-CA 3.32Å; E553-G558 WeakPolarHBondContact OE2-CA 3.24Å; E553-L559 VanDerWaalsContact CB-O 3.31Å; E553-L559 WeakPolarHBondContact CB-O 3.28Å; E553-L559 WeakPolarHBondContact CG-O 3.44Å; E553-L559 PolarHBondContact OE2-N 2.91Å; E553-V560 HydrophobicContact CB-CG2 4.07Å; E553-I597 HydrophobicContact CG-CG2 4.15Å; E553-S600 PolarHBondContact OE1-N 3.01Å; E553-S600 VanDerWaalsContact OE2-CA 3.31Å; E553-S600 WeakPolarHBondContact OE2-CA 3.21Å; E553-S600 VanDerWaalsContact OE2-CB 3.25Å; E553-S600 WeakPolarHBondContact OE2-CB 3.38Å; E553-S600 PolarHBondContact OE2-OG 2.93Å
554	M	92.6	Very high	93.4	Very high	103 Å²	103	68.1 Å²	68.1	51%	0.507	34%	0.336	S	S	.	.	H	α-helix	trans	-59.3	-42.1	172.8	-77.6	174	179	0	0	112.9	K550 R551 I556 S557 V560	K550-M554 HydrophobicContact CD-CE 4Å; K550-M554 HydrophobicContact CG-CE 3.57Å; K550-M554 HydrophobicContact CG-SD 4.2Å; K550-M554 WeakPolarHBondContact O-CB 3.43Å; K550-M554 WeakPolarHBondContact O-CG 3.44Å; K550-M554 PolarHBondContact O-N 3.37Å; R551-M554 PolarHBondContact O-N 2.96Å; M554-I556 PolarHBondContact O-N 3.18Å; M554-S557 PolarHBondContact O-N 3.46Å; M554-V560 HydrophobicContact CE-CG1 4.08Å; M554-V560 HydrophobicContact CG-CG2 3.84Å
555	S	92.1	Very high	93.1	Very high	95 Å²	95	58.7 Å²	58.7	66%	0.664	30%	0.302	S	S	*	.	H	α-helix	trans	-69.4	-22.2	-179.3	65.2	0	0	0	0	113.4	R551 N552 E553	R551-S555 PolarHBondContact O-N 3.44Å; R551-S555 VanDerWaalsContact O-N 3.12Å; N552-S555 PolarHBondContact O-N 2.89Å; N552-S555 PolarHBondContact O-OG 3.31Å; E553-S555 PolarHBondContact O-N 2.93Å
556	I	90.6	Very high	93	Very high	119 Å²	119	56.1 Å²	56.1	61%	0.61	28%	0.281	S	S	*	.	H	α-helix	trans	-99.3	-0.8	179.6	-58.2	168.7	0	0	0	110.9	N552 E553 M554 G558	N552-I556 WeakPolarHBondContact O-CG1 3.31Å; N552-I556 PolarHBondContact O-N 3.33Å; E553-I556 PolarHBondContact O-N 2.93Å; M554-I556 PolarHBondContact O-N 3.18Å; I556-G558 PolarHBondContact O-N 2.93Å
557	S	90.2	Very high	92.5	Very high	50 Å²	50	55.8 Å²	55.8	35%	0.35	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	33.4	-168.6	-59.7	0	0	0	0	112.8	E553 M554 H636	E553-S557 PolarHBondContact O-N 3.48Å; M554-S557 PolarHBondContact O-N 3.46Å; S557-H636 WeakPolarHBondContact O-CA 3.48Å; S557-H636 PolarHBondContact O-N 3.17Å
558	G	91.3	Very high	91.8	Very high	4 Å²	4	54.3 Å²	54.3	4%	0.041	27%	0.267	C	S	.	.			trans	-81.4	-146	179.2	0	0	0	0	0	113	E553 I556 S600 F635	E553-G558 PolarHBondContact O-N 3.4Å; E553-G558 VanDerWaalsContact OE2-CA 3.32Å; E553-G558 WeakPolarHBondContact OE2-CA 3.24Å; I556-G558 PolarHBondContact O-N 2.93Å; G558-S600 WeakPolarHBondContact CA-OG 3.21Å; G558-F635 WeakPolarHBondContact O-CA 3.28Å
559	L	93.4	Very high	90.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	119	-171	-178.3	71.3	0	0	0	111.4	E553 I597 L602 Y633 F635 I652	E553-L559 VanDerWaalsContact CB-O 3.31Å; E553-L559 WeakPolarHBondContact CB-O 3.28Å; E553-L559 WeakPolarHBondContact CG-O 3.44Å; E553-L559 PolarHBondContact OE2-N 2.91Å; L559-I597 HydrophobicContact CB-CD1 4.44Å; L559-I597 HydrophobicContact CB-CG2 4.3Å; L559-I597 HydrophobicContact CD2-CD1 4.01Å; L559-I597 HydrophobicContact CD2-CG1 4.22Å; L559-I597 HydrophobicContact CD2-CG2 4.14Å; L559-I597 HydrophobicContact CG-CD1 4.05Å; L559-I597 WeakPolarHBondContact O-CD1 3.4Å; L559-L602 HydrophobicContact CD2-CB 4.1Å; L559-Y633 HydrophobicContact CD1-CD2 3.19Å; L559-Y633 HydrophobicContact CD1-CE2 3.64Å; L559-Y633 HydrophobicContact CD1-CG 3.99Å; L559-F635 HydrophobicContact CB-CD2 4.21Å; L559-F635 HydrophobicContact CD1-CB 4.36Å; L559-I652 HydrophobicContact CD1-CD1 4.3Å; L559-I652 HydrophobicContact CD2-CD1 3.91Å; L559-I652 HydrophobicContact CD2-CG1 3.87Å
560	V	94.3	Very high	89.4	Confident	7 Å²	7	49.8 Å²	49.8	4%	0.042	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	125.9	176.7	176.5	0	0	0	0	109.8	K550 E553 M554 Y633 T634	K550-V560 HydrophobicContact CD-CG1 4.27Å; K550-V560 HydrophobicContact CG-CG1 4.07Å; E553-V560 HydrophobicContact CB-CG2 4.07Å; M554-V560 HydrophobicContact CE-CG1 4.08Å; M554-V560 HydrophobicContact CG-CG2 3.84Å; V560-Y633 CarbonylContact O-C 3.45Å; V560-Y633 WeakPolarHBondContact O-CA 3.36Å; V560-Y633 VanDerWaalsContact O-CB 3.29Å; V560-Y633 WeakPolarHBondContact O-CB 3.34Å; V560-T634 PolarHBondContact N-O 3.38Å; V560-T634 PolarHBondContact O-N 3.26Å; V560-T634 PolarHBondContact O-OG1 3.44Å
561	I	94.4	Very high	87.7	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	127.1	177.4	-57.1	172.6	0	0	0	108.8	A564 T590 L593 I597 L602 L631	I561-A564 HydrophobicContact CG2-CB 4.18Å; I561-T590 HydrophobicContact CG2-CG2 4.14Å; I561-L593 HydrophobicContact CD1-CB 3.5Å; I561-L593 VanDerWaalsContact CD1-CB 3.5Å; I561-I597 HydrophobicContact CD1-CD1 4.07Å; I561-I597 HydrophobicContact CD1-CG1 4.48Å; I561-I597 HydrophobicContact CG1-CD1 4.07Å; I561-L602 HydrophobicContact CD1-CD2 4.23Å; I561-L631 HydrophobicContact CD1-CD1 4.09Å; I561-L631 HydrophobicContact CG1-CD1 4.43Å; I561-L631 HydrophobicContact CG2-CD1 4.14Å; I561-L631 HydrophobicContact CG2-CG 4.37Å
562	D	91.5	Very high	85.7	Confident	81 Å²	81	50.7 Å²	50.7	43%	0.433	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-46.9	179.5	-63.8	-42.9	0	0	0	110.7	S632 T634	D562-S632 PolarHBondContact N-O 2.87Å; D562-T634 WeakPolarHBondContact OD2-CG2 3.41Å
563	Q	93.4	Very high	83.7	Confident	92 Å²	92	49.1 Å²	49.1	43%	0.43	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	139.7	176.2	-170.7	176.7	10.2	0	0	110.9	I565 L631 S632	Q563-I565 HydrophobicContact CG-CD1 4.3Å; Q563-I565 HydrophobicContact CG-CG1 4.17Å; Q563-I565 VanDerWaalsContact NE2-CD1 3.3Å; Q563-L631 WeakPolarHBondContact O-CA 3.35Å; Q563-S632 WeakPolarHBondContact CB-OG 3.49Å; Q563-S632 PolarHBondContact N-O 3.12Å; Q563-S632 PolarHBondContact N-OG 3.01Å; Q563-S632 PolarHBondContact O-N 2.95Å; Q563-S632 PolarHBondContact O-OG 3.09Å
564	A	92.7	Very high	81.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	126	171.2	0	0	0	0	0	111.8	I561 D588 V589 T590 L593 H630 L631	I561-A564 HydrophobicContact CG2-CB 4.18Å; A564-D588 WeakPolarHBondContact O-CA 3.33Å; A564-D588 VanDerWaalsContact O-OD1 3.1Å; A564-V589 HydrophobicContact CB-CG2 3.89Å; A564-V589 PolarHBondContact O-N 2.89Å; A564-T590 PolarHBondContact N-OG1 3.38Å; A564-L593 HydrophobicContact CB-CD1 3.68Å; A564-H630 CarbonylContact C-O 3.45Å; A564-H630 VanDerWaalsContact CA-O 3.27Å; A564-H630 WeakPolarHBondContact CA-O 3.42Å; A564-L631 HydrophobicContact CB-CD1 4.05Å; A564-L631 HydrophobicContact CB-CG 4.49Å
565	I	91.2	Very high	79.7	Confident	21 Å²	21	52.8 Å²	52.8	11%	0.108	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	125	-176.1	-56.4	169.4	0	0	0	109.6	Q563 L569 A586 F587 L629 H630	Q563-I565 HydrophobicContact CG-CD1 4.3Å; Q563-I565 HydrophobicContact CG-CG1 4.17Å; Q563-I565 VanDerWaalsContact NE2-CD1 3.3Å; I565-L569 HydrophobicContact CG2-CD2 3.96Å; I565-A586 HydrophobicContact CG2-CB 3.65Å; I565-F587 WeakPolarHBondContact CA-O 3.26Å; I565-L629 WeakPolarHBondContact O-CA 3.29Å; I565-H630 PolarHBondContact N-O 3.04Å; I565-H630 PolarHBondContact O-N 3.47Å
566	Y	90.4	Very high	77.7	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	130.6	178.3	-178.6	-114.4	0	0	0	111.4	F587 W609 F615 R627 Q628 L629 E646	Y566-F587 PolarHBondContact N-O 3.35Å; Y566-F587 PolarHBondContact O-N 2.8Å; Y566-W609 HydrophobicContact CD2-CE3 4.2Å; Y566-W609 HydrophobicContact CE2-CB 4.31Å; Y566-W609 AromaticContact CE2-CE3 3.87Å; Y566-W609 HydrophobicContact CE2-CE3 3.87Å; Y566-F615 HydrophobicContact CD1-CD1 4.19Å; Y566-F615 HydrophobicContact CG-CD1 4.25Å; Y566-F615 HydrophobicContact CG-CE1 4.33Å; Y566-R627 HydrophobicContact CE2-CB 4.12Å; Y566-Q628 WeakPolarHBondContact CA-O 3.33Å; Y566-L629 HydrophobicContact CD2-CB 4.32Å; Y566-L629 HydrophobicContact CD2-CD1 4.45Å; Y566-E646 PolarHBondContact OH-OE1 2.66Å
567	G	85.5	Confident	75.6	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.5	-153.3	175.9	0	0	0	0	0	113.9	L569 L585 Q628	G567-L569 PolarHBondContact O-N 3.37Å; G567-L585 WeakPolarHBondContact CA-O 3.24Å; G567-Q628 PolarHBondContact N-O 2.93Å; G567-Q628 PolarHBondContact O-N 2.77Å
568	C	79.6	Confident	73.7	Confident	16 Å²	16	56.1 Å²	56.1	11%	0.108	33%	0.33	C	S	.	.			trans	-92	96.3	175.7	-179.7	0	0	0	0	110.1	S570 L585 C619 N625	C568-S570 PolarHBondContact O-N 2.87Å; C568-L585 PolarHBondContact N-O 2.93Å; C568-C619 VanDerWaalsContact CB-SG 3.56Å; C568-N625 HydrophobicContact CB-CB 4.49Å; C568-N625 WeakPolarHBondContact SG-CB 3.32Å; C568-N625 PolarHBondContact SG-ND2 3.07Å
569	L	71.7	Confident	71.9	Confident	51 Å²	51	57.3 Å²	57.3	27%	0.267	34%	0.337	S	S	.	.			trans	-88.5	96.7	-179.9	-61.7	165.4	0	0	0	109.4	I565 G567 Q628 H630	I565-L569 HydrophobicContact CG2-CD2 3.96Å; G567-L569 PolarHBondContact O-N 3.37Å; L569-Q628 HydrophobicContact CD1-CB 3.98Å; L569-H630 HydrophobicContact CD1-CB 3.39Å
570	S	65.8	Low	70	Confident	52 Å²	52	64.2 Å²	64.2	36%	0.364	38%	0.375	S	S	.	.			trans	-90.3	134.7	170.8	-48.5	0	0	0	0	109.2	C568 T572 S573	C568-S570 PolarHBondContact O-N 2.87Å; S570-T572 PolarHBondContact O-N 3.23Å; S570-S573 WeakPolarHBondContact CB-OG 3.21Å; S570-S573 PolarHBondContact O-N 2.73Å; S570-S573 PolarHBondContact O-OG 3.3Å
571	P	59.3	Low	68.1	Low	137 Å²	137	66 Å²	66	89%	0.89	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-3.1	-177.7	25.8	-34.2	0	0	0	114.2
572	T	52.8	Low	66.2	Low	140 Å²	140	68.8 Å²	68.8	86%	0.859	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.2	-1	-172.4	-37.1	0	0	0	0	113	S570	S570-T572 PolarHBondContact O-N 3.23Å
573	S	51.1	Low	64.8	Low	49 Å²	49	65.4 Å²	65.4	34%	0.343	40%	0.398	S	S	.	.	S	Bend	trans	-119	123.6	-176.2	57.1	0	0	0	0	111.1	S570	S570-S573 WeakPolarHBondContact CB-OG 3.21Å; S570-S573 PolarHBondContact O-N 2.73Å; S570-S573 PolarHBondContact O-OG 3.3Å
574	D	52.6	Low	63.9	Low	114 Å²	114	62.4 Å²	62.4	61%	0.61	39%	0.387	S	S	*	.			trans	-53.1	134.6	170.8	-71.6	-37.5	0	0	0	109.6	T576 T577	D574-T576 PolarHBondContact O-N 2.96Å; D574-T577 HydrophobicContact CB-CG2 4.28Å; D574-T577 PolarHBondContact O-N 3.48Å; D574-T577 PolarHBondContact O-OG1 3.21Å
575	P	50.7	Low	63.1	Low	81 Å²	81	64.7 Å²	64.7	53%	0.526	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-7.1	179.8	23.8	-33.1	0	0	0	113.5
576	T	48.8	Very low	62.7	Low	111 Å²	111	64.4 Å²	64.4	68%	0.681	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-1.5	176.2	45.6	0	0	0	0	114.3	D574 L578	D574-T576 PolarHBondContact O-N 2.96Å; T576-L578 PolarHBondContact O-N 3.15Å; T576-L578 VanDerWaalsContact O-N 3.17Å
577	T	47.9	Very low	62.5	Low	70 Å²	70	65 Å²	65	43%	0.429	40%	0.402	S	S	.	.			trans	-65.6	115.1	177.4	44.4	0	0	0	0	111.4	D574 S579	D574-T577 HydrophobicContact CB-CG2 4.28Å; D574-T577 PolarHBondContact O-N 3.48Å; D574-T577 PolarHBondContact O-OG1 3.21Å; T577-S579 PolarHBondContact O-N 3.13Å
578	L	49.6	Very low	62.8	Low	153 Å²	153	69 Å²	69	80%	0.801	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	118.7	179.1	-85.6	139.8	0	0	0	110.4	T576	T576-L578 PolarHBondContact O-N 3.15Å; T576-L578 VanDerWaalsContact O-N 3.17Å
579	S	52.4	Low	63.4	Low	28 Å²	28	68.2 Å²	68.2	20%	0.196	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	149.5	168.8	71.2	0	0	0	0	111.2	T577 V581 G582 G583	T577-S579 PolarHBondContact O-N 3.13Å; S579-V581 PolarHBondContact O-N 2.83Å; S579-G582 PolarHBondContact O-N 2.86Å; S579-G583 PolarHBondContact N-O 2.77Å; S579-G583 PolarHBondContact OG-O 2.82Å
580	D	53.5	Low	64.5	Low	146 Å²	146	66.9 Å²	66.9	78%	0.781	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-0.2	173	-80.3	-22.4	0	0	0	114.3	R525	R525-D580 PolarHBondContact NE-O 2.79Å; R525-D580 PolarHBondContact NH2-O 2.77Å
581	V	54.3	Low	65.8	Low	44 Å²	44	66.2 Å²	66.2	27%	0.267	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	3.6	-172.9	-159.8	0	0	0	0	112.7	L528 S579	L528-V581 HydrophobicContact CD1-CG1 3.66Å; S579-V581 PolarHBondContact O-N 2.83Å
582	G	55	Low	67.5	Low	59 Å²	59	59.7 Å²	59.7	61%	0.608	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.7	21.5	166	0	0	0	0	0	115.8	S579	S579-G582 PolarHBondContact O-N 2.86Å
583	G	63.3	Low	69.5	Low	9 Å²	9	53 Å²	53	9%	0.093	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.7	173.5	172.6	0	0	0	0	0	113.3	S579	S579-G583 PolarHBondContact N-O 2.77Å; S579-G583 PolarHBondContact OG-O 2.82Å
584	P	73.5	Confident	71.6	Confident	30 Å²	30	51 Å²	51	20%	0.195	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	143.6	167.5	28.7	-32.7	0	0	0	109.5	A586	P584-A586 WeakPolarHBondContact CG-O 3.48Å; P584-A586 PolarHBondContact O-N 2.75Å; P584-A586 VanDerWaalsContact O-N 3.15Å
585	L	77.4	Confident	73.5	Confident	47 Å²	47	47.1 Å²	47.1	25%	0.246	29%	0.29	C	S	.	.	S	Bend	trans	-73.5	4.2	175.8	-68.5	167.3	0	0	0	113.1	G567 C568 P618 L622	G567-L585 WeakPolarHBondContact CA-O 3.24Å; C568-L585 PolarHBondContact N-O 2.93Å; L585-P618 WeakPolarHBondContact O-CG 3.24Å; L585-L622 HydrophobicContact CD2-CD1 3.91Å
586	A	81.1	Confident	75.5	Confident	15 Å²	15	46.9 Å²	46.9	12%	0.124	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	137.2	-178.9	0	0	0	0	0	109	I565 P584	I565-A586 HydrophobicContact CG2-CB 3.65Å; P584-A586 WeakPolarHBondContact CG-O 3.48Å; P584-A586 PolarHBondContact O-N 2.75Å; P584-A586 VanDerWaalsContact O-N 3.15Å
587	F	87.9	Confident	77.6	Confident	12 Å²	12	42.1 Å²	42.1	5%	0.053	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	131.1	-179.9	-175.4	-122.9	0	0	0	111	A535 L536 I565 Y566 V589 G614 Y616	A535-F587 HydrophobicContact CB-CE1 3.97Å; A535-F587 HydrophobicContact CB-CZ 3.95Å; L536-F587 HydrophobicContact CD2-CE2 3.85Å; L536-F587 HydrophobicContact CD2-CZ 4.1Å; L536-F587 HydrophobicContact CG-CE2 4.24Å; L536-F587 HydrophobicContact CG-CZ 4.38Å; I565-F587 WeakPolarHBondContact CA-O 3.26Å; Y566-F587 PolarHBondContact N-O 3.35Å; Y566-F587 PolarHBondContact O-N 2.8Å; F587-V589 HydrophobicContact CD1-CG1 3.76Å; F587-V589 HydrophobicContact CE1-CG1 4.19Å; F587-V589 PolarHBondContact O-N 3.3Å; F587-G614 WeakPolarHBondContact CE1-O 3.38Å; F587-Y616 HydrophobicContact CB-CE1 4.02Å; F587-Y616 AromaticContact CD1-CD1 3.53Å; F587-Y616 HydrophobicContact CD1-CD1 3.53Å; F587-Y616 AromaticContact CD1-CE1 3.49Å; F587-Y616 HydrophobicContact CD1-CE1 3.49Å; F587-Y616 VanDerWaalsContact CD1-CE1 3.49Å; F587-Y616 HydrophobicContact CD2-CD1 4.1Å; F587-Y616 AromaticContact CD2-CE1 3.22Å; F587-Y616 HydrophobicContact CD2-CE1 3.22Å; F587-Y616 AromaticContact CD2-CZ 3.86Å; F587-Y616 AromaticContact CE1-CD1 3.48Å; F587-Y616 HydrophobicContact CE1-CD1 3.48Å; F587-Y616 VanDerWaalsContact CE1-CD1 3.48Å; F587-Y616 AromaticContact CE1-CE1 3.62Å; F587-Y616 HydrophobicContact CE1-CE1 3.62Å; F587-Y616 HydrophobicContact CE2-CD1 4.09Å; F587-Y616 AromaticContact CE2-CE1 3.38Å; F587-Y616 HydrophobicContact CE2-CE1 3.38Å; F587-Y616 AromaticContact CG-CD1 3.83Å; F587-Y616 HydrophobicContact CG-CD1 3.83Å; F587-Y616 AromaticContact CG-CE1 3.27Å; F587-Y616 HydrophobicContact CG-CE1 3.27Å; F587-Y616 AromaticContact CG-CZ 3.9Å; F587-Y616 AromaticContact CZ-CD1 3.77Å; F587-Y616 HydrophobicContact CZ-CD1 3.77Å; F587-Y616 AromaticContact CZ-CE1 3.56Å; F587-Y616 HydrophobicContact CZ-CE1 3.56Å
588	D	90.6	Very high	79.6	Confident	84 Å²	84	46.1 Å²	46.1	45%	0.449	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	123.8	178.1	-175.6	-4.5	0	0	0	110.1	Q539 A564 T590	Q539-D588 PolarHBondContact NE2-O 2.77Å; A564-D588 WeakPolarHBondContact O-CA 3.33Å; A564-D588 VanDerWaalsContact O-OD1 3.1Å; D588-T590 VanDerWaalsContact OD1-CB 3.23Å; D588-T590 WeakPolarHBondContact OD1-CB 3.46Å; D588-T590 PolarHBondContact OD1-N 2.82Å; D588-T590 PolarHBondContact OD1-OG1 3.02Å
589	V	92.6	Very high	81.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.267	C	S	.	.			trans	-123.6	22.6	-178.6	-65.2	0	0	0	0	111.9	A564 F587 I591 P592 L593 F615 L629	A564-V589 HydrophobicContact CB-CG2 3.89Å; A564-V589 PolarHBondContact O-N 2.89Å; F587-V589 HydrophobicContact CD1-CG1 3.76Å; F587-V589 HydrophobicContact CE1-CG1 4.19Å; F587-V589 PolarHBondContact O-N 3.3Å; V589-I591 PolarHBondContact O-N 2.75Å; V589-P592 HydrophobicContact CB-CG 4.08Å; V589-P592 VanDerWaalsContact O-CD 3.24Å; V589-P592 WeakPolarHBondContact O-CD 3.36Å; V589-P592 VanDerWaalsContact O-CG 3.3Å; V589-P592 WeakPolarHBondContact O-CG 3.47Å; V589-L593 HydrophobicContact CG2-CD1 4.02Å; V589-L593 WeakPolarHBondContact O-CG 3.39Å; V589-L593 PolarHBondContact O-N 3.2Å; V589-F615 HydrophobicContact CB-CD1 4.46Å; V589-F615 HydrophobicContact CB-CD2 4.41Å; V589-F615 HydrophobicContact CB-CE1 3.91Å; V589-F615 HydrophobicContact CB-CE2 3.84Å; V589-F615 HydrophobicContact CB-CZ 3.54Å; V589-F615 HydrophobicContact CG1-CD1 3.84Å; V589-F615 HydrophobicContact CG1-CD2 4.13Å; V589-F615 HydrophobicContact CG1-CE1 3.75Å; V589-F615 HydrophobicContact CG1-CE2 4.05Å; V589-F615 HydrophobicContact CG1-CG 4.01Å; V589-F615 HydrophobicContact CG1-CZ 3.84Å; V589-F615 HydrophobicContact CG2-CE1 3.92Å; V589-F615 HydrophobicContact CG2-CZ 3.75Å; V589-L629 HydrophobicContact CG2-CD1 3.52Å
590	T	94	Very high	83.3	Confident	24 Å²	24	47.3 Å²	47.3	15%	0.147	26%	0.264	C	S	.	.	H	α-helix	trans	-60.8	-45.1	-179.3	-54.2	0	0	0	0	112.4	I561 A564 D588 Q594	I561-T590 HydrophobicContact CG2-CG2 4.14Å; A564-T590 PolarHBondContact N-OG1 3.38Å; D588-T590 VanDerWaalsContact OD1-CB 3.23Å; D588-T590 WeakPolarHBondContact OD1-CB 3.46Å; D588-T590 PolarHBondContact OD1-N 2.82Å; D588-T590 PolarHBondContact OD1-OG1 3.02Å; T590-Q594 WeakPolarHBondContact O-CB 3.3Å; T590-Q594 PolarHBondContact O-N 3.21Å
591	I	94.5	Very high	85.2	Confident	37 Å²	37	45.1 Å²	45.1	19%	0.19	25%	0.249	C	C	.	.	H	α-helix	trans	-62.2	-53.9	-177.7	-59.3	173	0	0	0	112.6	Q539 M542 A546 V589 L593 Q594 A595	Q539-I591 HydrophobicContact CB-CD1 4.39Å; Q539-I591 WeakPolarHBondContact O-CG2 3.17Å; M542-I591 HydrophobicContact CB-CG2 4.04Å; A546-I591 HydrophobicContact CB-CG2 3.87Å; A546-I591 WeakPolarHBondContact CB-O 3.43Å; V589-I591 PolarHBondContact O-N 2.75Å; I591-L593 PolarHBondContact O-N 2.99Å; I591-Q594 PolarHBondContact O-N 3.39Å; I591-A595 PolarHBondContact O-N 2.78Å; I591-A595 VanDerWaalsContact O-N 3.12Å
592	P	94.9	Very high	87	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.006	24%	0.237	C	C	.	.	H	α-helix	trans	-64.5	-40.6	-177.8	22.8	-32.6	0	0	0	111.6	Q539 M542 V589 Q594 A595 M596 Q613 F615	Q539-P592 HydrophobicContact CG-CG 4.44Å; M542-P592 HydrophobicContact SD-CB 3.87Å; V589-P592 HydrophobicContact CB-CG 4.08Å; V589-P592 VanDerWaalsContact O-CD 3.24Å; V589-P592 WeakPolarHBondContact O-CD 3.36Å; V589-P592 VanDerWaalsContact O-CG 3.3Å; V589-P592 WeakPolarHBondContact O-CG 3.47Å; P592-Q594 PolarHBondContact O-N 2.86Å; P592-A595 PolarHBondContact O-N 2.84Å; P592-M596 VanDerWaalsContact O-CG 3.32Å; P592-M596 WeakPolarHBondContact O-CG 3.47Å; P592-M596 PolarHBondContact O-N 2.86Å; P592-Q613 WeakPolarHBondContact CB-O 3.13Å; P592-F615 HydrophobicContact CB-CD2 4.28Å; P592-F615 HydrophobicContact CB-CE2 3.97Å; P592-F615 HydrophobicContact CG-CD2 4Å; P592-F615 HydrophobicContact CG-CE2 3.66Å
593	L	94.3	Very high	88.8	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-38.1	177.9	-66	-178.2	0	0	0	112.6	I561 A564 V589 I591 A595 M596 L602 L604 F615 L629 L631	I561-L593 HydrophobicContact CD1-CB 3.5Å; I561-L593 VanDerWaalsContact CD1-CB 3.5Å; A564-L593 HydrophobicContact CB-CD1 3.68Å; V589-L593 HydrophobicContact CG2-CD1 4.02Å; V589-L593 WeakPolarHBondContact O-CG 3.39Å; V589-L593 PolarHBondContact O-N 3.2Å; I591-L593 PolarHBondContact O-N 2.99Å; L593-A595 VanDerWaalsContact C-N 3.3Å; L593-A595 PolarHBondContact O-N 3.32Å; L593-M596 HydrophobicContact CD2-SD 4.41Å; L593-M596 PolarHBondContact O-N 2.81Å; L593-L602 HydrophobicContact CB-CD2 4.38Å; L593-L602 HydrophobicContact CD2-CD2 4.27Å; L593-L604 HydrophobicContact CD2-CD1 3.84Å; L593-L604 HydrophobicContact CD2-CD2 4.14Å; L593-L604 HydrophobicContact CD2-CG 4.5Å; L593-F615 HydrophobicContact CD1-CZ 4.2Å; L593-F615 HydrophobicContact CD2-CE2 4.02Å; L593-F615 HydrophobicContact CD2-CZ 3.64Å; L593-F615 HydrophobicContact CG-CE2 4.19Å; L593-F615 HydrophobicContact CG-CZ 3.81Å; L593-L629 HydrophobicContact CD1-CD1 4.21Å; L593-L629 HydrophobicContact CD1-CD2 4.07Å; L593-L631 HydrophobicContact CD1-CD1 3.66Å
594	Q	94.5	Very high	90.1	Very high	6 Å²	6	49.8 Å²	49.8	3%	0.028	24%	0.242	C	C	.	.	H	α-helix	trans	-66	-34.1	176.1	-178	64.7	48.6	0	0	111.9	A546 S549 K550 T590 I591 P592 M596	A546-Q594 HydrophobicContact CB-CB 4.16Å; A546-Q594 HydrophobicContact CB-CG 4.19Å; A546-Q594 WeakPolarHBondContact O-CG 3.39Å; S549-Q594 WeakPolarHBondContact CB-O 3.42Å; S549-Q594 PolarHBondContact OG-NE2 2.78Å; S549-Q594 PolarHBondContact OG-O 3.39Å; K550-Q594 HydrophobicContact CB-CG 4.08Å; T590-Q594 WeakPolarHBondContact O-CB 3.3Å; T590-Q594 PolarHBondContact O-N 3.21Å; I591-Q594 PolarHBondContact O-N 3.39Å; P592-Q594 PolarHBondContact O-N 2.86Å; Q594-M596 VanDerWaalsContact C-N 3.3Å
595	A	93.3	Very high	90.9	Very high	33 Å²	33	52.8 Å²	52.8	27%	0.273	26%	0.261	S	S	.	.	H	α-helix	trans	-71	-24.5	176.6	0	0	0	0	0	113.1	A545 A546 I591 P592 L593	A545-A595 HydrophobicContact CB-CB 4.38Å; A546-A595 HydrophobicContact CB-CB 4.16Å; I591-A595 PolarHBondContact O-N 2.78Å; I591-A595 VanDerWaalsContact O-N 3.12Å; P592-A595 PolarHBondContact O-N 2.84Å; L593-A595 VanDerWaalsContact C-N 3.3Å; L593-A595 PolarHBondContact O-N 3.32Å
596	M	92.6	Very high	91.4	Very high	75 Å²	75	54.6 Å²	54.6	37%	0.369	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-3.2	-178.8	-71.7	176.6	67.6	0	0	114.7	P592 L593 Q594 E598 L602 L604 I612	P592-M596 VanDerWaalsContact O-CG 3.32Å; P592-M596 WeakPolarHBondContact O-CG 3.47Å; P592-M596 PolarHBondContact O-N 2.86Å; L593-M596 HydrophobicContact CD2-SD 4.41Å; L593-M596 PolarHBondContact O-N 2.81Å; Q594-M596 VanDerWaalsContact C-N 3.3Å; M596-E598 PolarHBondContact O-N 3.02Å; M596-L602 HydrophobicContact CB-CD1 3.63Å; M596-L604 HydrophobicContact CE-CD2 3.7Å; M596-L604 HydrophobicContact SD-CD2 4.48Å; M596-I612 HydrophobicContact CE-CG2 4.42Å; M596-I612 HydrophobicContact SD-CG2 3.8Å
597	I	93.5	Very high	91.5	Very high	12 Å²	12	55.6 Å²	55.6	6%	0.062	29%	0.288	C	S	.	.			trans	-70.5	126.3	-179.2	-58.6	177.9	0	0	0	109.9	E553 L559 I561	E553-I597 HydrophobicContact CG-CG2 4.15Å; L559-I597 HydrophobicContact CB-CD1 4.44Å; L559-I597 HydrophobicContact CB-CG2 4.3Å; L559-I597 HydrophobicContact CD2-CD1 4.01Å; L559-I597 HydrophobicContact CD2-CG1 4.22Å; L559-I597 HydrophobicContact CD2-CG2 4.14Å; L559-I597 HydrophobicContact CG-CD1 4.05Å; L559-I597 WeakPolarHBondContact O-CD1 3.4Å; I561-I597 HydrophobicContact CD1-CD1 4.07Å; I561-I597 HydrophobicContact CD1-CG1 4.48Å; I561-I597 HydrophobicContact CG1-CD1 4.07Å
598	E	89.7	Confident	91.3	Very high	153 Å²	153	62.3 Å²	62.3	72%	0.715	31%	0.313	S	S	*	.	B	Isolated β-bridge	trans	-125.2	122.6	174.4	-67.9	-173.7	177.4	0	0	109.8	M596 S600 H601	M596-E598 PolarHBondContact O-N 3.02Å; E598-S600 VanDerWaalsContact C-N 3.33Å; E598-S600 PolarHBondContact O-N 3.33Å; E598-H601 PolarHBondContact N-O 3.04Å; E598-H601 VanDerWaalsContact N-O 3.13Å; E598-H601 PolarHBondContact O-N 3.35Å; E598-H601 VanDerWaalsContact O-N 3.11Å
599	K	89.1	Confident	91.1	Very high	186 Å²	186	58.5 Å²	58.5	81%	0.809	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	46.6	177.9	-54.9	176.2	-178.2	174.5	0	112.5	H601	K599-H601 PolarHBondContact O-CD2 3.46Å; K599-H601 PolarHBondContact O-N 3.09Å; K599-H601 VanDerWaalsContact O-N 3.16Å
600	S	91.1	Very high	90.7	Very high	20 Å²	20	60.2 Å²	60.2	14%	0.14	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	22	-178.4	-44.7	0	0	0	0	115.8	E553 G558 E598 P653	E553-S600 PolarHBondContact OE1-N 3.01Å; E553-S600 VanDerWaalsContact OE2-CA 3.31Å; E553-S600 WeakPolarHBondContact OE2-CA 3.21Å; E553-S600 VanDerWaalsContact OE2-CB 3.25Å; E553-S600 WeakPolarHBondContact OE2-CB 3.38Å; E553-S600 PolarHBondContact OE2-OG 2.93Å; G558-S600 WeakPolarHBondContact CA-OG 3.21Å; E598-S600 VanDerWaalsContact C-N 3.33Å; E598-S600 PolarHBondContact O-N 3.33Å; S600-P653 WeakPolarHBondContact O-CD 3.41Å
601	H	92.7	Very high	90.2	Very high	100 Å²	100	65.1 Å²	65.1	46%	0.463	33%	0.329	S	S	.	.	B	Isolated β-bridge	trans	-127.2	146.3	174	-65.4	-74.4	0	0	0	111.1	E598 K599 I652	E598-H601 PolarHBondContact N-O 3.04Å; E598-H601 VanDerWaalsContact N-O 3.13Å; E598-H601 PolarHBondContact O-N 3.35Å; E598-H601 VanDerWaalsContact O-N 3.11Å; K599-H601 PolarHBondContact O-CD2 3.46Å; K599-H601 PolarHBondContact O-N 3.09Å; K599-H601 VanDerWaalsContact O-N 3.16Å; H601-I652 WeakPolarHBondContact CA-O 3.23Å
602	L	92.3	Very high	89.9	Confident	3 Å²	3	65.2 Å²	65.2	2%	0.016	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	129	170.3	176.3	78.5	0	0	0	108.9	L559 I561 L593 M596 L650 A651 I652	L559-L602 HydrophobicContact CD2-CB 4.1Å; I561-L602 HydrophobicContact CD1-CD2 4.23Å; L593-L602 HydrophobicContact CB-CD2 4.38Å; L593-L602 HydrophobicContact CD2-CD2 4.27Å; M596-L602 HydrophobicContact CB-CD1 3.63Å; L602-L650 HydrophobicContact CD2-CD2 4.47Å; L602-A651 WeakPolarHBondContact O-CA 3.33Å; L602-I652 HydrophobicContact CB-CD1 3.98Å; L602-I652 HydrophobicContact CB-CG1 3.63Å; L602-I652 HydrophobicContact CD2-CD1 3.68Å; L602-I652 HydrophobicContact CD2-CG1 4.11Å; L602-I652 HydrophobicContact CG-CD1 4.41Å; L602-I652 HydrophobicContact CG-CG1 4.35Å; L602-I652 PolarHBondContact N-O 2.9Å; L602-I652 PolarHBondContact O-N 3.46Å
603	R	91.7	Very high	89.5	Confident	202 Å²	202	71.9 Å²	71.9	76%	0.762	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.1	117.6	177.6	-66	-176.5	-179.7	-177.6	0.3	109.8	L650 A651	R603-L650 CarbonylContact C-O 3.49Å; R603-L650 WeakPolarHBondContact CA-O 3.4Å; R603-A651 HydrophobicContact CG-CB 4.4Å
604	L	91.4	Very high	89.1	Confident	5 Å²	5	72 Å²	72	3%	0.026	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	118.3	169.8	-56.2	176.1	0	0	0	108.1	L593 M596 W609 I612 L629 G649 L650	L593-L604 HydrophobicContact CD2-CD1 3.84Å; L593-L604 HydrophobicContact CD2-CD2 4.14Å; L593-L604 HydrophobicContact CD2-CG 4.5Å; M596-L604 HydrophobicContact CE-CD2 3.7Å; M596-L604 HydrophobicContact SD-CD2 4.48Å; L604-W609 HydrophobicContact CB-CZ2 4.43Å; L604-I612 HydrophobicContact CD2-CD1 4Å; L604-L629 HydrophobicContact CD1-CD2 3.88Å; L604-G649 CarbonylContact O-C 3.52Å; L604-G649 VanDerWaalsContact O-CA 3.24Å; L604-G649 WeakPolarHBondContact O-CA 3.36Å; L604-L650 HydrophobicContact CB-CB 4.07Å; L604-L650 HydrophobicContact CD1-CB 4.15Å; L604-L650 HydrophobicContact CD1-CD2 3.93Å; L604-L650 HydrophobicContact CG-CB 4.33Å; L604-L650 PolarHBondContact N-O 2.72Å; L604-L650 PolarHBondContact O-N 3.09Å
605	P	90	Very high	88.9	Confident	94 Å²	94	72.3 Å²	72.3	61%	0.61	36%	0.363	S	S	*	.			trans	-64.2	155.4	175	27.7	-33.2	0	0	0	110.9	G607 W609	P605-G607 PolarHBondContact O-N 3.37Å; P605-W609 PolarHBondContact O-NE1 3.33Å
606	P	87.4	Confident	88.6	Confident	85 Å²	85	71.3 Å²	71.3	55%	0.552	35%	0.352	S	S	*	.	S	Bend	trans	-63.6	131.6	168.2	28.7	-33.9	0	0	0	109.1	N647	P606-N647 WeakPolarHBondContact CB-O 3.25Å
607	G	83.7	Confident	88.2	Confident	36 Å²	36	68.7 Å²	68.7	37%	0.371	34%	0.339	S	S	.	.	S	Bend	trans	149.5	-175.5	-174.4	0	0	0	0	0	111.7	P605 W609 E646	P605-G607 PolarHBondContact O-N 3.37Å; G607-W609 PolarHBondContact O-N 3.06Å; G607-E646 PolarHBondContact N-O 2.74Å; G607-E646 WeakPolarHBondContact O-CG 3.46Å
608	R	84.1	Confident	87.6	Confident	153 Å²	153	68.6 Å²	68.6	58%	0.577	34%	0.34	S	S	*	.			trans	-69.4	97.4	-174.5	-75.1	-174.4	-175.9	-177.9	2	112.2	C610 D611 E646	R608-C610 PolarHBondContact O-N 2.87Å; R608-D611 PolarHBondContact O-N 3.26Å; R608-E646 WeakPolarHBondContact CA-OE1 3.37Å
609	W	85.4	Confident	86.8	Confident	4 Å²	4	61.5 Å²	61.5	2%	0.015	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-69.7	-15.4	178.6	-65.1	-18.6	0	0	0	112.2	Y566 L604 P605 G607 D611 I612 F615 L629 V644 E646 L650	Y566-W609 HydrophobicContact CD2-CE3 4.2Å; Y566-W609 HydrophobicContact CE2-CB 4.31Å; Y566-W609 AromaticContact CE2-CE3 3.87Å; Y566-W609 HydrophobicContact CE2-CE3 3.87Å; L604-W609 HydrophobicContact CB-CZ2 4.43Å; P605-W609 PolarHBondContact O-NE1 3.33Å; G607-W609 PolarHBondContact O-N 3.06Å; W609-D611 PolarHBondContact O-N 2.81Å; W609-I612 HydrophobicContact CB-CD1 4.1Å; W609-I612 HydrophobicContact CG-CD1 4.28Å; W609-I612 WeakPolarHBondContact O-CB 3.47Å; W609-I612 WeakPolarHBondContact O-CG1 3.26Å; W609-I612 PolarHBondContact O-N 2.87Å; W609-F615 HydrophobicContact CB-CD1 4.28Å; W609-F615 HydrophobicContact CB-CE1 4.38Å; W609-F615 VanDerWaalsContact O-CB 3.29Å; W609-F615 WeakPolarHBondContact O-CB 3.42Å; W609-F615 WeakPolarHBondContact O-CD1 3.43Å; W609-F615 WeakPolarHBondContact O-CG 3.46Å; W609-L629 HydrophobicContact CE3-CB 3.89Å; W609-L629 HydrophobicContact CE3-CD2 4.16Å; W609-L629 HydrophobicContact CH2-CB 4.22Å; W609-L629 HydrophobicContact CH2-CD2 4.42Å; W609-L629 HydrophobicContact CZ3-CB 3.34Å; W609-L629 HydrophobicContact CZ3-CD2 3.97Å; W609-L629 HydrophobicContact CZ3-CG 4.31Å; W609-V644 HydrophobicContact CH2-CB 4.17Å; W609-V644 HydrophobicContact CH2-CG1 3.97Å; W609-E646 HydrophobicContact CD2-CG 4.37Å; W609-E646 HydrophobicContact CE3-CB 4.49Å; W609-E646 HydrophobicContact CG-CG 4.45Å; W609-E646 PolarHBondContact N-OE1 3.33Å; W609-L650 HydrophobicContact CZ2-CB 4.41Å
610	C	83.8	Confident	86	Confident	35 Å²	35	55.1 Å²	55.1	24%	0.236	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-63.4	-18.9	171.8	64.1	0	0	0	0	114.4	R608 I612 D617	R608-C610 PolarHBondContact O-N 2.87Å; C610-I612 VanDerWaalsContact C-N 3.3Å; C610-D617 HydrophobicContact CB-CB 4.11Å
611	D	84.1	Confident	84.8	Confident	127 Å²	127	57.2 Å²	57.2	68%	0.679	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-85.6	-5.6	179.9	-60.2	-21.6	0	0	0	112.1	R608 W609	R608-D611 PolarHBondContact O-N 3.26Å; W609-D611 PolarHBondContact O-N 2.81Å
612	I	87.8	Confident	83.5	Confident	39 Å²	39	56.3 Å²	56.3	20%	0.2	31%	0.306	C	S	.	.	S	Bend	trans	-74.7	139.2	176.5	-58.5	173.5	0	0	0	109.7	M596 L604 W609 C610 G614 F615	M596-I612 HydrophobicContact CE-CG2 4.42Å; M596-I612 HydrophobicContact SD-CG2 3.8Å; L604-I612 HydrophobicContact CD2-CD1 4Å; W609-I612 HydrophobicContact CB-CD1 4.1Å; W609-I612 HydrophobicContact CG-CD1 4.28Å; W609-I612 WeakPolarHBondContact O-CB 3.47Å; W609-I612 WeakPolarHBondContact O-CG1 3.26Å; W609-I612 PolarHBondContact O-N 2.87Å; C610-I612 VanDerWaalsContact C-N 3.3Å; I612-G614 PolarHBondContact O-N 3.41Å; I612-F615 HydrophobicContact CB-CB 4.37Å; I612-F615 HydrophobicContact CB-CD2 3.85Å; I612-F615 HydrophobicContact CB-CE2 4.38Å; I612-F615 HydrophobicContact CB-CG 4.1Å; I612-F615 HydrophobicContact CG2-CD2 3.78Å; I612-F615 HydrophobicContact CG2-CE2 4.01Å; I612-F615 WeakPolarHBondContact O-CB 3.39Å; I612-F615 PolarHBondContact O-N 2.95Å
613	Q	87.7	Confident	81.9	Confident	142 Å²	142	63.6 Å²	63.6	66%	0.664	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	130.7	177.2	-67.7	-178.5	11.1	0	0	111.3	M542 P592 F615	M542-Q613 HydrophobicContact CE-CB 3.41Å; M542-Q613 VanDerWaalsContact CE-CB 3.41Å; M542-Q613 HydrophobicContact CE-CG 4.45Å; P592-Q613 WeakPolarHBondContact CB-O 3.13Å; Q613-F615 VanDerWaalsContact C-N 3.33Å
614	G	85.5	Confident	80.5	Confident	2 Å²	2	62.9 Å²	62.9	2%	0.021	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	2.7	-175.8	0	0	0	0	0	115	T538 Q539 F587 I612	T538-G614 VanDerWaalsContact OG1-CA 3.3Å; T538-G614 WeakPolarHBondContact OG1-CA 3.35Å; T538-G614 PolarHBondContact OG1-N 2.98Å; Q539-G614 PolarHBondContact NE2-O 2.79Å; F587-G614 WeakPolarHBondContact CE1-O 3.38Å; I612-G614 PolarHBondContact O-N 3.41Å
615	F	90.5	Very high	79.1	Confident	12 Å²	12	66.5 Å²	66.5	5%	0.053	37%	0.369	C	S	.	.			trans	-102.5	154.1	170.8	-76.8	-121.6	0	0	0	110.9	Y566 V589 P592 L593 W609 I612 Q613	Y566-F615 HydrophobicContact CD1-CD1 4.19Å; Y566-F615 HydrophobicContact CG-CD1 4.25Å; Y566-F615 HydrophobicContact CG-CE1 4.33Å; V589-F615 HydrophobicContact CB-CD1 4.46Å; V589-F615 HydrophobicContact CB-CD2 4.41Å; V589-F615 HydrophobicContact CB-CE1 3.91Å; V589-F615 HydrophobicContact CB-CE2 3.84Å; V589-F615 HydrophobicContact CB-CZ 3.54Å; V589-F615 HydrophobicContact CG1-CD1 3.84Å; V589-F615 HydrophobicContact CG1-CD2 4.13Å; V589-F615 HydrophobicContact CG1-CE1 3.75Å; V589-F615 HydrophobicContact CG1-CE2 4.05Å; V589-F615 HydrophobicContact CG1-CG 4.01Å; V589-F615 HydrophobicContact CG1-CZ 3.84Å; V589-F615 HydrophobicContact CG2-CE1 3.92Å; V589-F615 HydrophobicContact CG2-CZ 3.75Å; P592-F615 HydrophobicContact CB-CD2 4.28Å; P592-F615 HydrophobicContact CB-CE2 3.97Å; P592-F615 HydrophobicContact CG-CD2 4Å; P592-F615 HydrophobicContact CG-CE2 3.66Å; L593-F615 HydrophobicContact CD1-CZ 4.2Å; L593-F615 HydrophobicContact CD2-CE2 4.02Å; L593-F615 HydrophobicContact CD2-CZ 3.64Å; L593-F615 HydrophobicContact CG-CE2 4.19Å; L593-F615 HydrophobicContact CG-CZ 3.81Å; W609-F615 HydrophobicContact CB-CD1 4.28Å; W609-F615 HydrophobicContact CB-CE1 4.38Å; W609-F615 VanDerWaalsContact O-CB 3.29Å; W609-F615 WeakPolarHBondContact O-CB 3.42Å; W609-F615 WeakPolarHBondContact O-CD1 3.43Å; W609-F615 WeakPolarHBondContact O-CG 3.46Å; I612-F615 HydrophobicContact CB-CB 4.37Å; I612-F615 HydrophobicContact CB-CD2 3.85Å; I612-F615 HydrophobicContact CB-CE2 4.38Å; I612-F615 HydrophobicContact CB-CG 4.1Å; I612-F615 HydrophobicContact CG2-CD2 3.78Å; I612-F615 HydrophobicContact CG2-CE2 4.01Å; I612-F615 WeakPolarHBondContact O-CB 3.39Å; I612-F615 PolarHBondContact O-N 2.95Å; Q613-F615 VanDerWaalsContact C-N 3.33Å
616	Y	87.5	Confident	78.3	Confident	13 Å²	13	65.5 Å²	65.5	5%	0.051	36%	0.363	C	S	.	.			trans	-149.1	159.7	159.7	78.2	-85.6	0	0	0	109.3	R532 A535 F587 P618	R532-Y616 HydrophobicContact CB-CD1 4.36Å; R532-Y616 HydrophobicContact CB-CD2 4.46Å; R532-Y616 HydrophobicContact CB-CE1 3.86Å; R532-Y616 HydrophobicContact CB-CE2 4.03Å; R532-Y616 WeakPolarHBondContact CD-OH 3.46Å; R532-Y616 HydrophobicContact CG-CE1 3.69Å; R532-Y616 HydrophobicContact CG-CE2 4.43Å; A535-Y616 HydrophobicContact CB-CD1 3.54Å; A535-Y616 HydrophobicContact CB-CE1 4.43Å; A535-Y616 HydrophobicContact CB-CG 4.25Å; F587-Y616 HydrophobicContact CB-CE1 4.02Å; F587-Y616 AromaticContact CD1-CD1 3.53Å; F587-Y616 HydrophobicContact CD1-CD1 3.53Å; F587-Y616 AromaticContact CD1-CE1 3.49Å; F587-Y616 HydrophobicContact CD1-CE1 3.49Å; F587-Y616 VanDerWaalsContact CD1-CE1 3.49Å; F587-Y616 HydrophobicContact CD2-CD1 4.1Å; F587-Y616 AromaticContact CD2-CE1 3.22Å; F587-Y616 HydrophobicContact CD2-CE1 3.22Å; F587-Y616 AromaticContact CD2-CZ 3.86Å; F587-Y616 AromaticContact CE1-CD1 3.48Å; F587-Y616 HydrophobicContact CE1-CD1 3.48Å; F587-Y616 VanDerWaalsContact CE1-CD1 3.48Å; F587-Y616 AromaticContact CE1-CE1 3.62Å; F587-Y616 HydrophobicContact CE1-CE1 3.62Å; F587-Y616 HydrophobicContact CE2-CD1 4.09Å; F587-Y616 AromaticContact CE2-CE1 3.38Å; F587-Y616 HydrophobicContact CE2-CE1 3.38Å; F587-Y616 AromaticContact CG-CD1 3.83Å; F587-Y616 HydrophobicContact CG-CD1 3.83Å; F587-Y616 AromaticContact CG-CE1 3.27Å; F587-Y616 HydrophobicContact CG-CE1 3.27Å; F587-Y616 AromaticContact CG-CZ 3.9Å; F587-Y616 AromaticContact CZ-CD1 3.77Å; F587-Y616 HydrophobicContact CZ-CD1 3.77Å; F587-Y616 AromaticContact CZ-CE1 3.56Å; F587-Y616 HydrophobicContact CZ-CE1 3.56Å; Y616-P618 HydrophobicContact CE2-CB 3.93Å; Y616-P618 VanDerWaalsContact O-CD 3.27Å; Y616-P618 WeakPolarHBondContact O-CD 3.26Å
617	D	84	Confident	78.1	Confident	19 Å²	19	65 Å²	65	10%	0.102	35%	0.35	C	S	.	.			trans	-89.8	112.2	176.5	-175.9	3.9	0	0	0	110.8	L528 C610 C619 V620 R627	L528-D617 WeakPolarHBondContact CD2-O 3.2Å; C610-D617 HydrophobicContact CB-CB 4.11Å; D617-C619 VanDerWaalsContact C-N 3.28Å; D617-C619 WeakPolarHBondContact OD1-CA 3.25Å; D617-C619 PolarHBondContact OD1-N 3.42Å; D617-V620 HydrophobicContact CB-CG2 3.82Å; D617-R627 IonicContact OD2-CZ 3.71Å; D617-R627 IonicContact OD2-NE 3.92Å; D617-R627 PolarHBondContact OD2-NE 3.46Å; D617-R627 IonicContact OD2-NH2 3.92Å
618	P	79.4	Confident	78.3	Confident	11 Å²	11	65.5 Å²	65.5	7%	0.071	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-9.5	174.5	31.9	-34.8	0	0	0	113.7	L585 Y616	L585-P618 WeakPolarHBondContact O-CG 3.24Å; Y616-P618 HydrophobicContact CE2-CB 3.93Å; Y616-P618 VanDerWaalsContact O-CD 3.27Å; Y616-P618 WeakPolarHBondContact O-CD 3.26Å
619	C	74.4	Confident	78.6	Confident	4 Å²	4	58.3 Å²	58.3	3%	0.027	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	18.5	-171.9	-60.9	0	0	0	0	113.9	C568 D617 G621 L622	C568-C619 VanDerWaalsContact CB-SG 3.56Å; D617-C619 VanDerWaalsContact C-N 3.28Å; D617-C619 WeakPolarHBondContact OD1-CA 3.25Å; D617-C619 PolarHBondContact OD1-N 3.42Å; C619-G621 PolarHBondContact O-N 2.85Å; C619-G621 VanDerWaalsContact O-N 3.11Å; C619-L622 PolarHBondContact O-N 2.9Å
620	V	72.2	Confident	78.9	Confident	51 Å²	51	59.9 Å²	59.9	31%	0.309	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	119.3	178.8	-177.6	0	0	0	0	110.4	L524 L528 D617	L524-V620 HydrophobicContact CD1-CG1 4.08Å; L528-V620 HydrophobicContact CD2-CB 4.01Å; L528-V620 HydrophobicContact CD2-CG2 3.92Å; D617-V620 HydrophobicContact CB-CG2 3.82Å
621	G	65.4	Low	79.4	Confident	64 Å²	64	58.2 Å²	58.2	66%	0.66	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.3	-6.5	-179.6	0	0	0	0	0	115.4	C619	C619-G621 PolarHBondContact O-N 2.85Å; C619-G621 VanDerWaalsContact O-N 3.11Å
622	L	65.8	Low	79.8	Confident	81 Å²	81	53.4 Å²	53.4	42%	0.424	29%	0.288	S	S	.	.			trans	-104.8	88.1	172.2	-66	165.7	0	0	0	108.4	L585 C619 E624	L585-L622 HydrophobicContact CD2-CD1 3.91Å; C619-L622 PolarHBondContact O-N 2.9Å; L622-E624 VanDerWaalsContact C-N 3.27Å; L622-E624 PolarHBondContact O-N 3.02Å
623	L	58.1	Low	80.1	Confident	157 Å²	157	51.5 Å²	51.5	82%	0.822	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-11.2	-175.5	-75.7	162.7	0	0	0	113.9
624	E	62.8	Low	80.4	Confident	186 Å²	186	46.5 Å²	46.5	87%	0.869	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-23	-170.3	-68.7	-177.9	168.8	0	0	113.9	L622	L622-E624 VanDerWaalsContact C-N 3.27Å; L622-E624 PolarHBondContact O-N 3.02Å
625	N	62.3	Low	80.7	Confident	81 Å²	81	48.6 Å²	48.6	43%	0.433	27%	0.266	S	S	.	.	S	Bend	trans	-113.6	132.9	-174.1	-64.2	-23	0	0	0	112.2	C568	C568-N625 HydrophobicContact CB-CB 4.49Å; C568-N625 WeakPolarHBondContact SG-CB 3.32Å; C568-N625 PolarHBondContact SG-ND2 3.07Å
626	P	73.6	Confident	80.6	Confident	74 Å²	74	53.4 Å²	53.4	48%	0.481	29%	0.288	S	S	.	.			trans	-67	139.6	177.1	27.9	-33.3	0	0	0	110.9
627	R	81.7	Confident	80.5	Confident	73 Å²	73	59.9 Å²	59.9	28%	0.275	32%	0.324	S	S	.	.			trans	-73.4	128	171.4	-61.9	125.7	-171	147.7	9.2	109.2	Y566 D617 E646	Y566-R627 HydrophobicContact CE2-CB 4.12Å; D617-R627 IonicContact OD2-CZ 3.71Å; D617-R627 IonicContact OD2-NE 3.92Å; D617-R627 PolarHBondContact OD2-NE 3.46Å; D617-R627 IonicContact OD2-NH2 3.92Å; R627-E646 WeakPolarHBondContact CD-OE2 3.23Å; R627-E646 IonicContact NH1-OE2 3.92Å; R627-E646 PolarHBondContact O-N 3.39Å
628	Q	88.5	Confident	80.8	Confident	48 Å²	48	60.6 Å²	60.6	22%	0.224	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	146.6	-175.8	-63.1	-171	-18.4	0	0	110.6	Y566 G567 L569 V644 N645	Y566-Q628 WeakPolarHBondContact CA-O 3.33Å; G567-Q628 PolarHBondContact N-O 2.93Å; G567-Q628 PolarHBondContact O-N 2.77Å; L569-Q628 HydrophobicContact CD1-CB 3.98Å; Q628-V644 WeakPolarHBondContact CA-O 3.34Å; Q628-N645 VanDerWaalsContact CG-OD1 3.25Å; Q628-N645 WeakPolarHBondContact CG-OD1 3.17Å; Q628-N645 PolarHBondContact NE2-OD1 3.44Å
629	L	90.7	Very high	81.3	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	119.5	169.6	179.9	66.5	0	0	0	108.3	I565 Y566 V589 L593 L604 W609 T643 V644 L650	I565-L629 WeakPolarHBondContact O-CA 3.29Å; Y566-L629 HydrophobicContact CD2-CB 4.32Å; Y566-L629 HydrophobicContact CD2-CD1 4.45Å; V589-L629 HydrophobicContact CG2-CD1 3.52Å; L593-L629 HydrophobicContact CD1-CD1 4.21Å; L593-L629 HydrophobicContact CD1-CD2 4.07Å; L604-L629 HydrophobicContact CD1-CD2 3.88Å; W609-L629 HydrophobicContact CE3-CB 3.89Å; W609-L629 HydrophobicContact CE3-CD2 4.16Å; W609-L629 HydrophobicContact CH2-CB 4.22Å; W609-L629 HydrophobicContact CH2-CD2 4.42Å; W609-L629 HydrophobicContact CZ3-CB 3.34Å; W609-L629 HydrophobicContact CZ3-CD2 3.97Å; W609-L629 HydrophobicContact CZ3-CG 4.31Å; L629-T643 WeakPolarHBondContact O-CA 3.48Å; L629-V644 PolarHBondContact N-O 2.8Å; L629-V644 PolarHBondContact O-N 3.16Å; L629-L650 HydrophobicContact CD2-CD2 3.94Å
630	H	91.8	Very high	82.2	Confident	38 Å²	38	63 Å²	63	18%	0.176	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	126.8	170.9	175.7	84.9	0	0	0	109.3	A564 I565 L569 E641 V642 T643	A564-H630 CarbonylContact C-O 3.45Å; A564-H630 VanDerWaalsContact CA-O 3.27Å; A564-H630 WeakPolarHBondContact CA-O 3.42Å; I565-H630 PolarHBondContact N-O 3.04Å; I565-H630 PolarHBondContact O-N 3.47Å; L569-H630 HydrophobicContact CD1-CB 3.39Å; H630-E641 IonicContact CE1-OE1 3.37Å; H630-E641 PolarHBondContact CE1-OE1 2.82Å; H630-E641 IonicContact NE2-OE1 3.69Å; H630-V642 WeakPolarHBondContact CA-O 3.39Å; H630-T643 HydrophobicContact CB-CG2 3.98Å; H630-T643 WeakPolarHBondContact ND1-CG2 3.36Å
631	L	93.3	Very high	83.2	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	125.8	-172.9	176.7	134.6	0	0	0	110.7	I561 Q563 A564 L593 Y633 E641 V642 L650 I652	I561-L631 HydrophobicContact CD1-CD1 4.09Å; I561-L631 HydrophobicContact CG1-CD1 4.43Å; I561-L631 HydrophobicContact CG2-CD1 4.14Å; I561-L631 HydrophobicContact CG2-CG 4.37Å; Q563-L631 WeakPolarHBondContact O-CA 3.35Å; A564-L631 HydrophobicContact CB-CD1 4.05Å; A564-L631 HydrophobicContact CB-CG 4.49Å; L593-L631 HydrophobicContact CD1-CD1 3.66Å; L631-Y633 HydrophobicContact CD2-CD1 3.25Å; L631-Y633 HydrophobicContact CD2-CE1 3.78Å; L631-Y633 HydrophobicContact CD2-CG 4.08Å; L631-Y633 HydrophobicContact CG-CD1 4.44Å; L631-E641 WeakPolarHBondContact O-CA 3.48Å; L631-V642 HydrophobicContact CB-CG1 4.1Å; L631-V642 HydrophobicContact CD2-CG1 3.89Å; L631-V642 PolarHBondContact N-O 2.97Å; L631-V642 PolarHBondContact O-N 2.7Å; L631-L650 HydrophobicContact CD1-CD2 4.28Å; L631-I652 HydrophobicContact CD1-CD1 4.32Å; L631-I652 HydrophobicContact CD2-CD1 3.6Å; L631-I652 HydrophobicContact CD2-CG2 4.35Å
632	S	93.3	Very high	84.5	Confident	25 Å²	25	63 Å²	63	18%	0.175	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134.2	171	62	0	0	0	0	110.2	D562 Q563 H640	D562-S632 PolarHBondContact N-O 2.87Å; Q563-S632 WeakPolarHBondContact CB-OG 3.49Å; Q563-S632 PolarHBondContact N-O 3.12Å; Q563-S632 PolarHBondContact N-OG 3.01Å; Q563-S632 PolarHBondContact O-N 2.95Å; Q563-S632 PolarHBondContact O-OG 3.09Å; S632-H640 CarbonylContact C-O 3.5Å; S632-H640 WeakPolarHBondContact CA-O 3.48Å
633	Y	94.4	Very high	85.7	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	156.3	-173.7	67	-82	0	0	0	112.7	L559 V560 L631 F635 H640 V642 I652 P653 M654 H657	L559-Y633 HydrophobicContact CD1-CD2 3.19Å; L559-Y633 HydrophobicContact CD1-CE2 3.64Å; L559-Y633 HydrophobicContact CD1-CG 3.99Å; V560-Y633 CarbonylContact O-C 3.45Å; V560-Y633 WeakPolarHBondContact O-CA 3.36Å; V560-Y633 VanDerWaalsContact O-CB 3.29Å; V560-Y633 WeakPolarHBondContact O-CB 3.34Å; L631-Y633 HydrophobicContact CD2-CD1 3.25Å; L631-Y633 HydrophobicContact CD2-CE1 3.78Å; L631-Y633 HydrophobicContact CD2-CG 4.08Å; L631-Y633 HydrophobicContact CG-CD1 4.44Å; Y633-F635 HydrophobicContact CD2-CB 4.42Å; Y633-F635 HydrophobicContact CE2-CB 4.39Å; Y633-H640 HydrophobicContact CD1-CB 3.8Å; Y633-H640 HydrophobicContact CD2-CB 3.85Å; Y633-H640 HydrophobicContact CE1-CB 3.39Å; Y633-H640 HydrophobicContact CE2-CB 3.46Å; Y633-H640 VanDerWaalsContact CE2-CB 3.46Å; Y633-H640 AromaticContact CE2-CG 3.66Å; Y633-H640 HydrophobicContact CG-CB 4.06Å; Y633-H640 AromaticContact CZ-CG 3.74Å; Y633-H640 PolarHBondContact N-O 2.93Å; Y633-H640 PolarHBondContact O-N 3.03Å; Y633-V642 HydrophobicContact CE1-CG1 4.43Å; Y633-I652 HydrophobicContact CD1-CD1 4.48Å; Y633-I652 HydrophobicContact CE1-CB 4.31Å; Y633-I652 HydrophobicContact CE1-CG2 3.84Å; Y633-I652 HydrophobicContact CE2-CB 4.31Å; Y633-P653 HydrophobicContact CE2-CB 3.99Å; Y633-M654 PolarHBondContact OH-N 3.08Å; Y633-H657 HydrophobicContact CE1-CB 4.16Å; Y633-H657 AromaticContact CZ-ND1 3.99Å; Y633-H657 VanDerWaalsContact OH-CB 3.27Å; Y633-H657 WeakPolarHBondContact OH-CB 3.35Å; Y633-H657 PolarHBondContact OH-ND1 3.17Å
634	T	93.3	Very high	87.2	Confident	37 Å²	37	56.4 Å²	56.4	23%	0.227	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	134.7	174	42.2	0	0	0	0	110.6	V560 D562 S638	V560-T634 PolarHBondContact N-O 3.38Å; V560-T634 PolarHBondContact O-N 3.26Å; V560-T634 PolarHBondContact O-OG1 3.44Å; D562-T634 WeakPolarHBondContact OD2-CG2 3.41Å; T634-S638 WeakPolarHBondContact CA-O 3.4Å
635	F	92.1	Very high	88.4	Confident	45 Å²	45	50 Å²	50	20%	0.197	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	126.4	175.4	-178.8	-109.6	0	0	0	109.2	G558 L559 Y633 N637 S638 P653	G558-F635 WeakPolarHBondContact O-CA 3.28Å; L559-F635 HydrophobicContact CB-CD2 4.21Å; L559-F635 HydrophobicContact CD1-CB 4.36Å; Y633-F635 HydrophobicContact CD2-CB 4.42Å; Y633-F635 HydrophobicContact CE2-CB 4.39Å; F635-N637 VanDerWaalsContact C-N 3.28Å; F635-N637 PolarHBondContact O-N 2.77Å; F635-S638 PolarHBondContact N-O 2.66Å; F635-S638 PolarHBondContact O-N 2.99Å; F635-P653 HydrophobicContact CB-CB 4.29Å; F635-P653 HydrophobicContact CD1-CB 3.8Å; F635-P653 HydrophobicContact CD1-CG 3.86Å; F635-P653 HydrophobicContact CD2-CB 4.26Å; F635-P653 HydrophobicContact CD2-CG 3.93Å; F635-P653 HydrophobicContact CE1-CB 4.11Å; F635-P653 HydrophobicContact CE1-CG 3.68Å; F635-P653 HydrophobicContact CE2-CG 3.77Å; F635-P653 HydrophobicContact CG-CB 3.86Å; F635-P653 HydrophobicContact CG-CG 3.97Å; F635-P653 HydrophobicContact CZ-CB 4.46Å; F635-P653 HydrophobicContact CZ-CG 3.62Å
636	H	88.5	Confident	89.5	Confident	114 Å²	114	46.8 Å²	46.8	53%	0.528	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	48.1	-175	-68.2	78.5	0	0	0	113.2	S557 S638	S557-H636 WeakPolarHBondContact O-CA 3.48Å; S557-H636 PolarHBondContact O-N 3.17Å; H636-S638 PolarHBondContact O-N 3.41Å; H636-S638 VanDerWaalsContact O-N 3.09Å
637	N	85.2	Confident	89.9	Confident	148 Å²	148	49.9 Å²	49.9	79%	0.791	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	17.3	-177.7	-61	-19.1	0	0	0	115.6	F635	F635-N637 VanDerWaalsContact C-N 3.28Å; F635-N637 PolarHBondContact O-N 2.77Å
638	S	89.6	Confident	90	Very high	35 Å²	35	52.9 Å²	52.9	25%	0.245	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	131.6	172.2	-63.2	0	0	0	0	110.6	T634 F635 H636 H640	T634-S638 WeakPolarHBondContact CA-O 3.4Å; F635-S638 PolarHBondContact N-O 2.66Å; F635-S638 PolarHBondContact O-N 2.99Å; H636-S638 PolarHBondContact O-N 3.41Å; H636-S638 VanDerWaalsContact O-N 3.09Å; S638-H640 PolarHBondContact O-CE1 3.47Å; S638-H640 PolarHBondContact O-ND1 3.24Å
639	S	91.2	Very high	89.9	Confident	50 Å²	50	51.3 Å²	51.3	35%	0.35	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	140.1	176	-57.7	0	0	0	0	111.4	V659	S639-V659 PolarHBondContact O-N 3.19Å
640	H	92.6	Very high	89.9	Confident	14 Å²	14	51.6 Å²	51.6	7%	0.065	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	147.2	180	-63.4	72.8	0	0	0	110.3	S632 Y633 S638 H657 K658	S632-H640 CarbonylContact C-O 3.5Å; S632-H640 WeakPolarHBondContact CA-O 3.48Å; Y633-H640 HydrophobicContact CD1-CB 3.8Å; Y633-H640 HydrophobicContact CD2-CB 3.85Å; Y633-H640 HydrophobicContact CE1-CB 3.39Å; Y633-H640 HydrophobicContact CE2-CB 3.46Å; Y633-H640 VanDerWaalsContact CE2-CB 3.46Å; Y633-H640 AromaticContact CE2-CG 3.66Å; Y633-H640 HydrophobicContact CG-CB 4.06Å; Y633-H640 AromaticContact CZ-CG 3.74Å; Y633-H640 PolarHBondContact N-O 2.93Å; Y633-H640 PolarHBondContact O-N 3.03Å; S638-H640 PolarHBondContact O-CE1 3.47Å; S638-H640 PolarHBondContact O-ND1 3.24Å; H640-H657 CarbonylContact C-O 3.39Å; H640-H657 WeakPolarHBondContact CA-O 3.23Å; H640-H657 HydrophobicContact CB-CB 3.94Å; H640-H657 VanDerWaalsContact CB-O 3.29Å; H640-H657 WeakPolarHBondContact CB-O 3.43Å; H640-K658 WeakPolarHBondContact CD2-CA 3.48Å; H640-K658 PolarHBondContact CD2-N 3Å
641	E	93.1	Very high	89.9	Confident	101 Å²	101	51.9 Å²	51.9	47%	0.472	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	139.9	-178.3	-169.3	-178.3	153.9	0	0	110.1	H630 L631 H657 V659	H630-E641 IonicContact CE1-OE1 3.37Å; H630-E641 PolarHBondContact CE1-OE1 2.82Å; H630-E641 IonicContact NE2-OE1 3.69Å; L631-E641 WeakPolarHBondContact O-CA 3.48Å; E641-H657 PolarHBondContact N-O 2.93Å; E641-V659 HydrophobicContact CB-CG2 3.58Å
642	V	91.8	Very high	89.8	Confident	16 Å²	16	52.1 Å²	52.1	10%	0.097	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	140	-178.7	67.5	0	0	0	0	111.9	H630 L631 Y633 V644 L650 H657	H630-V642 WeakPolarHBondContact CA-O 3.39Å; L631-V642 HydrophobicContact CB-CG1 4.1Å; L631-V642 HydrophobicContact CD2-CG1 3.89Å; L631-V642 PolarHBondContact N-O 2.97Å; L631-V642 PolarHBondContact O-N 2.7Å; Y633-V642 HydrophobicContact CE1-CG1 4.43Å; V642-V644 HydrophobicContact CG2-CG2 3.51Å; V642-L650 HydrophobicContact CG1-CD1 3.86Å; V642-L650 HydrophobicContact CG2-CD1 4.5Å; V642-H657 HydrophobicContact CB-CB 4.45Å; V642-H657 WeakPolarHBondContact CG2-NE2 3.45Å
643	T	90.6	Very high	89.7	Confident	86 Å²	86	52.2 Å²	52.2	53%	0.528	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.8	168.6	48.4	0	0	0	0	109.7	L629 H630	L629-T643 WeakPolarHBondContact O-CA 3.48Å; H630-T643 HydrophobicContact CB-CG2 3.98Å; H630-T643 WeakPolarHBondContact ND1-CG2 3.36Å
644	V	90.2	Very high	89.5	Confident	13 Å²	13	56.4 Å²	56.4	8%	0.079	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	139.2	-174.6	-171.6	0	0	0	0	111.1	W609 Q628 L629 V642 Q648 G649 L650	W609-V644 HydrophobicContact CH2-CB 4.17Å; W609-V644 HydrophobicContact CH2-CG1 3.97Å; Q628-V644 WeakPolarHBondContact CA-O 3.34Å; L629-V644 PolarHBondContact N-O 2.8Å; L629-V644 PolarHBondContact O-N 3.16Å; V642-V644 HydrophobicContact CG2-CG2 3.51Å; V644-Q648 HydrophobicContact CG1-CB 3.83Å; V644-G649 WeakPolarHBondContact CG1-O 3.35Å; V644-L650 HydrophobicContact CB-CD1 4.49Å; V644-L650 HydrophobicContact CG2-CD1 3.63Å
645	N	88.5	Confident	89.1	Confident	51 Å²	51	59.9 Å²	59.9	27%	0.273	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	147.8	170.8	-66.7	-31.6	0	0	0	110.7	Q628 N647 Q648	Q628-N645 VanDerWaalsContact CG-OD1 3.25Å; Q628-N645 WeakPolarHBondContact CG-OD1 3.17Å; Q628-N645 PolarHBondContact NE2-OD1 3.44Å; N645-N647 PolarHBondContact O-N 3.24Å; N645-Q648 PolarHBondContact O-N 2.83Å
646	E	84.8	Confident	89	Confident	14 Å²	14	66.3 Å²	66.3	7%	0.065	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-31.5	178.7	-169.4	169.9	-145	0	0	114.3	Y566 G607 R608 W609 R627 Q648	Y566-E646 PolarHBondContact OH-OE1 2.66Å; G607-E646 PolarHBondContact N-O 2.74Å; G607-E646 WeakPolarHBondContact O-CG 3.46Å; R608-E646 WeakPolarHBondContact CA-OE1 3.37Å; W609-E646 HydrophobicContact CD2-CG 4.37Å; W609-E646 HydrophobicContact CE3-CB 4.49Å; W609-E646 HydrophobicContact CG-CG 4.45Å; W609-E646 PolarHBondContact N-OE1 3.33Å; R627-E646 WeakPolarHBondContact CD-OE2 3.23Å; R627-E646 IonicContact NH1-OE2 3.92Å; R627-E646 PolarHBondContact O-N 3.39Å; E646-Q648 PolarHBondContact O-N 3.4Å
647	N	83.1	Confident	89.1	Confident	138 Å²	138	62.3 Å²	62.3	74%	0.738	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-16.3	-178.8	-64.5	-4.8	0	0	0	115.1	P606 N645	P606-N647 WeakPolarHBondContact CB-O 3.25Å; N645-N647 PolarHBondContact O-N 3.24Å
648	Q	83.6	Confident	89.2	Confident	137 Å²	137	60.8 Å²	60.8	64%	0.64	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-20.4	-172.7	-70.9	177.3	-11.4	0	0	112.9	V644 N645 E646	V644-Q648 HydrophobicContact CG1-CB 3.83Å; N645-Q648 PolarHBondContact O-N 2.83Å; E646-Q648 PolarHBondContact O-N 3.4Å
649	G	86.7	Confident	89	Confident	14 Å²	14	61.8 Å²	61.8	14%	0.144	33%	0.334	C	S	.	.			trans	69.8	158	-168.8	0	0	0	0	0	111.8	L604 V644	L604-G649 CarbonylContact O-C 3.52Å; L604-G649 VanDerWaalsContact O-CA 3.24Å; L604-G649 WeakPolarHBondContact O-CA 3.36Å; V644-G649 WeakPolarHBondContact CG1-O 3.35Å
650	L	90.9	Very high	88.4	Confident	7 Å²	7	67.9 Å²	67.9	4%	0.037	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	128.9	179.4	179.2	71.1	0	0	0	109.6	L602 R603 L604 W609 L629 L631 V642 V644 I652	L602-L650 HydrophobicContact CD2-CD2 4.47Å; R603-L650 CarbonylContact C-O 3.49Å; R603-L650 WeakPolarHBondContact CA-O 3.4Å; L604-L650 HydrophobicContact CB-CB 4.07Å; L604-L650 HydrophobicContact CD1-CB 4.15Å; L604-L650 HydrophobicContact CD1-CD2 3.93Å; L604-L650 HydrophobicContact CG-CB 4.33Å; L604-L650 PolarHBondContact N-O 2.72Å; L604-L650 PolarHBondContact O-N 3.09Å; W609-L650 HydrophobicContact CZ2-CB 4.41Å; L629-L650 HydrophobicContact CD2-CD2 3.94Å; L631-L650 HydrophobicContact CD1-CD2 4.28Å; V642-L650 HydrophobicContact CG1-CD1 3.86Å; V642-L650 HydrophobicContact CG2-CD1 4.5Å; V644-L650 HydrophobicContact CB-CD1 4.49Å; V644-L650 HydrophobicContact CG2-CD1 3.63Å; L650-I652 HydrophobicContact CD1-CG2 3.9Å; L650-I652 HydrophobicContact CG-CG2 4.19Å
651	A	91.2	Very high	87.3	Confident	44 Å²	44	73.8 Å²	73.8	36%	0.364	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	124.1	168.1	0	0	0	0	0	109	L602 R603 M654	L602-A651 WeakPolarHBondContact O-CA 3.33Å; R603-A651 HydrophobicContact CG-CB 4.4Å; A651-M654 WeakPolarHBondContact O-CG 3.49Å
652	I	91.8	Very high	85.4	Confident	5 Å²	5	78.1 Å²	78.1	3%	0.026	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	148.4	177.8	59.2	175.9	0	0	0	110.2	L559 H601 L602 L631 Y633 L650	L559-I652 HydrophobicContact CD1-CD1 4.3Å; L559-I652 HydrophobicContact CD2-CD1 3.91Å; L559-I652 HydrophobicContact CD2-CG1 3.87Å; H601-I652 WeakPolarHBondContact CA-O 3.23Å; L602-I652 HydrophobicContact CB-CD1 3.98Å; L602-I652 HydrophobicContact CB-CG1 3.63Å; L602-I652 HydrophobicContact CD2-CD1 3.68Å; L602-I652 HydrophobicContact CD2-CG1 4.11Å; L602-I652 HydrophobicContact CG-CD1 4.41Å; L602-I652 HydrophobicContact CG-CG1 4.35Å; L602-I652 PolarHBondContact N-O 2.9Å; L602-I652 PolarHBondContact O-N 3.46Å; L631-I652 HydrophobicContact CD1-CD1 4.32Å; L631-I652 HydrophobicContact CD2-CD1 3.6Å; L631-I652 HydrophobicContact CD2-CG2 4.35Å; Y633-I652 HydrophobicContact CD1-CD1 4.48Å; Y633-I652 HydrophobicContact CE1-CB 4.31Å; Y633-I652 HydrophobicContact CE1-CG2 3.84Å; Y633-I652 HydrophobicContact CE2-CB 4.31Å; L650-I652 HydrophobicContact CD1-CG2 3.9Å; L650-I652 HydrophobicContact CG-CG2 4.19Å
653	P	91	Very high	85.1	Confident	28 Å²	28	81.2 Å²	81.2	18%	0.182	44%	0.441	C	S	.	.			cis	-80	147.4	0.6	32.4	-35.9	0	0	0	113.5	S600 Y633 F635	S600-P653 WeakPolarHBondContact O-CD 3.41Å; Y633-P653 HydrophobicContact CE2-CB 3.99Å; F635-P653 HydrophobicContact CB-CB 4.29Å; F635-P653 HydrophobicContact CD1-CB 3.8Å; F635-P653 HydrophobicContact CD1-CG 3.86Å; F635-P653 HydrophobicContact CD2-CB 4.26Å; F635-P653 HydrophobicContact CD2-CG 3.93Å; F635-P653 HydrophobicContact CE1-CB 4.11Å; F635-P653 HydrophobicContact CE1-CG 3.68Å; F635-P653 HydrophobicContact CE2-CG 3.77Å; F635-P653 HydrophobicContact CG-CB 3.86Å; F635-P653 HydrophobicContact CG-CG 3.97Å; F635-P653 HydrophobicContact CZ-CB 4.46Å; F635-P653 HydrophobicContact CZ-CG 3.62Å
654	M	89.5	Confident	84.8	Confident	87 Å²	87	80.9 Å²	80.9	43%	0.429	44%	0.437	S	S	.	.			trans	-129	141.5	168.1	-67.7	-170.9	81.5	0	0	109.9	Y633 A651 K656 H657	Y633-M654 PolarHBondContact OH-N 3.08Å; A651-M654 WeakPolarHBondContact O-CG 3.49Å; M654-K656 PolarHBondContact O-N 3.33Å; M654-K656 VanDerWaalsContact O-N 3.16Å; M654-H657 PolarHBondContact O-N 3.02Å; M654-H657 VanDerWaalsContact O-N 3.08Å
655	S	85.7	Confident	84.5	Confident	110 Å²	110	84.7 Å²	84.7	77%	0.769	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-59.3	-28.1	179.8	51.8	0	0	0	0	113.7	H657 K658	S655-H657 PolarHBondContact O-N 3.16Å; S655-K658 PolarHBondContact O-N 3.23Å
656	K	90.2	Very high	84.3	Confident	181 Å²	181	86.7 Å²	86.7	79%	0.787	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-65.3	-19.8	177.6	-65.8	-176	178.2	-177.4	0	114.2	M654	M654-K656 PolarHBondContact O-N 3.33Å; M654-K656 VanDerWaalsContact O-N 3.16Å
657	H	89.3	Confident	84.2	Confident	29 Å²	29	91.3 Å²	91.3	13%	0.134	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-90.3	-5.1	-176.4	-55	163.3	0	0	0	112.1	Y633 H640 E641 V642 M654 S655 V659	Y633-H657 HydrophobicContact CE1-CB 4.16Å; Y633-H657 AromaticContact CZ-ND1 3.99Å; Y633-H657 VanDerWaalsContact OH-CB 3.27Å; Y633-H657 WeakPolarHBondContact OH-CB 3.35Å; Y633-H657 PolarHBondContact OH-ND1 3.17Å; H640-H657 CarbonylContact C-O 3.39Å; H640-H657 WeakPolarHBondContact CA-O 3.23Å; H640-H657 HydrophobicContact CB-CB 3.94Å; H640-H657 VanDerWaalsContact CB-O 3.29Å; H640-H657 WeakPolarHBondContact CB-O 3.43Å; E641-H657 PolarHBondContact N-O 2.93Å; V642-H657 HydrophobicContact CB-CB 4.45Å; V642-H657 WeakPolarHBondContact CG2-NE2 3.45Å; M654-H657 PolarHBondContact O-N 3.02Å; M654-H657 VanDerWaalsContact O-N 3.08Å; S655-H657 PolarHBondContact O-N 3.16Å; H657-V659 PolarHBondContact O-N 3.28Å
658	K	87.8	Confident	84.3	Confident	117 Å²	117	88.1 Å²	88.1	51%	0.509	48%	0.476	S	S	.	.	B	Isolated β-bridge	trans	-65.8	124.5	-174.3	-172	177	177.1	-179.9	0	109.9	H640 S655	H640-K658 WeakPolarHBondContact CD2-CA 3.48Å; H640-K658 PolarHBondContact CD2-N 3Å; S655-K658 PolarHBondContact O-N 3.23Å
659	V	86.1	Confident	84.4	Confident	55 Å²	55	84.6 Å²	84.6	33%	0.333	46%	0.464	S	S	.	.			trans	-82.7	116	174.5	-177.9	0	0	0	0	107.6	S639 E641 H657 I661	S639-V659 PolarHBondContact O-N 3.19Å; E641-V659 HydrophobicContact CB-CG2 3.58Å; H657-V659 PolarHBondContact O-N 3.28Å; V659-I661 PolarHBondContact O-N 2.93Å
660	E	77.8	Confident	84.2	Confident	178 Å²	178	90.1 Å²	90.1	83%	0.832	49%	0.489	S	S	*	.			trans	-73.6	107.9	167.1	-67.3	-175.5	173.8	0	0	107.3
661	I	69.7	Low	83.6	Confident	138 Å²	138	97 Å²	97	71%	0.708	53%	0.527	S	S	*	.			trans	-65.4	124.8	172.1	-54.9	171.4	0	0	0	106.1	V659	V659-I661 PolarHBondContact O-N 2.93Å
662	P	53.5	Low	82.9	Confident	192 Å²	192	101.8 Å²	101.8	100%	1.247	54%	0.541	S	S	*	.			trans	-63.2	0	-178	25.4	-34.5	0	0	0	114

Retrieved 662 of 662 residues in 573.2 ms (Link to these results)

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