A0A087YGP4_POEFO Loading...

Netrin-1

AlphaFold DB , UniProt , Accession A0A087YGP4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 615 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	P	33.8	Very low	33.1	Very low	170 Å²	170	154.2 Å²	154.2	100%	1.104	81%	0.813	S	S	*	*				0	104.7	0	13.8	9.6	0	0	0	110.6
2	L	31.9	Very low	34.2	Very low	166 Å²	166	151.1 Å²	151.1	87%	0.869	81%	0.808	S	S	*	*			trans	47.1	132.4	148.3	-62.1	137.5	0	0	0	117.9
3	S	29.4	Very low	34	Very low	88 Å²	88	151.1 Å²	151.1	62%	0.615	81%	0.807	S	S	*	*			cis	176.4	144.9	13.3	-96.6	0	0	0	0	109.7
4	R	34.1	Very low	33.7	Very low	220 Å²	220	145.4 Å²	145.4	83%	0.83	80%	0.802	S	S	*	*			trans	50.5	117.5	134.1	-77.3	-179.3	176.6	-177.9	-1.2	120.3
5	M	32.1	Very low	33.8	Very low	156 Å²	156	144.3 Å²	144.3	77%	0.768	79%	0.793	S	S	*	*				82.4	128.3	79.3	-99.2	-149	-126.1	0	0	115
6	R	30.3	Very low	33.7	Very low	234 Å²	234	147.7 Å²	147.7	88%	0.883	80%	0.798	S	S	*	*			trans	131.1	111.9	135.3	-87	171.4	177.6	-171.2	-3.4	116.4
7	E	33.5	Very low	33.6	Very low	177 Å²	177	148.5 Å²	148.5	83%	0.827	79%	0.793	S	S	*	*			trans	-52.7	172	139.1	-75.9	-174.5	153.8	0	0	111.2
8	P	50.4	Low	33.4	Very low	104 Å²	104	147.6 Å²	147.6	68%	0.675	79%	0.787	S	S	*	*			cis	-158.6	-174	40.3	27.9	2.8	0	0	0	119.3
9	L	30.3	Very low	33.4	Very low	155 Å²	155	146.8 Å²	146.8	81%	0.812	78%	0.783	S	S	*	*			trans	72.9	123.1	148.8	-74.8	139.2	0	0	0	120.8
10	S	29.1	Very low	33.2	Very low	121 Å²	121	146.5 Å²	146.5	85%	0.846	79%	0.786	S	S	*	*				-179.8	134.6	93.9	26.3	0	0	0	0	114.7
11	C	29.2	Very low	33.3	Very low	105 Å²	105	144.5 Å²	144.5	71%	0.709	78%	0.784	S	S	*	*			trans	-75.6	172.6	171.2	-134.6	0	0	0	0	111
12	P	46.3	Very low	33.1	Very low	117 Å²	117	143 Å²	143	76%	0.76	77%	0.771	S	S	*	*				-142.8	146.6	60.8	17.4	9.9	0	0	0	115.4
13	L	31.8	Very low	33.2	Very low	151 Å²	151	140.1 Å²	140.1	79%	0.791	77%	0.765	S	S	*	*				72.6	125.4	85.6	-86.6	145.7	0	0	0	117.8	L15	L13-L15 HydrophobicContact CD2-CD1 4.3Å
14	G	29.9	Very low	33.4	Very low	72 Å²	72	142 Å²	142	74%	0.742	77%	0.773	S	S	*	*			trans	157.1	60.2	165.4	0	0	0	0	0	113.2
15	L	34.4	Very low	33.5	Very low	128 Å²	128	140.3 Å²	140.3	67%	0.67	77%	0.774	S	S	*	*				56.4	112.7	102.1	-123.8	99.7	0	0	0	115.8	L13	L13-L15 HydrophobicContact CD2-CD1 4.3Å
16	F	32.1	Very low	33.6	Very low	199 Å²	199	138 Å²	138	87%	0.873	77%	0.774	S	S	*	*				-171	151.7	113.6	-116.1	-90	0	0	0	112.9
17	F	31.9	Very low	33.9	Very low	161 Å²	161	131.5 Å²	131.5	71%	0.706	77%	0.77	S	S	*	*			trans	-90	150.1	-159.5	-107.5	-127.4	0	0	0	114.4
18	L	31.5	Very low	34.4	Very low	132 Å²	132	129 Å²	129	69%	0.691	77%	0.767	S	S	*	*			trans	51.7	145.5	137.7	-64.3	-179.1	0	0	0	119.4
19	L	32.1	Very low	34.1	Very low	133 Å²	133	129.9 Å²	129.9	70%	0.696	77%	0.766	S	S	*	*			cis	-173.6	142.2	18	-114.3	156.2	0	0	0	106.9
20	T	30.5	Very low	34.6	Very low	140 Å²	140	128 Å²	128	86%	0.859	76%	0.763	S	S	*	*				149.9	141.2	125.8	51.7	0	0	0	0	113.6
21	S	33.7	Very low	35.4	Very low	105 Å²	105	131.2 Å²	131.2	73%	0.734	76%	0.762	S	S	*	*			trans	-69.2	141.9	-163.3	46.6	0	0	0	0	117.5
22	V	30.8	Very low	36.1	Very low	139 Å²	139	130.7 Å²	130.7	84%	0.842	77%	0.765	S	S	*	*			trans	-140	120.3	133.9	-177.5	0	0	0	0	109.1
23	S	34.3	Very low	35.7	Very low	105 Å²	105	127.9 Å²	127.9	73%	0.734	76%	0.758	S	S	*	*			trans	-73.5	124	174.9	-59.4	0	0	0	0	110.9
24	T	33	Very low	36.3	Very low	128 Å²	128	129.7 Å²	129.7	79%	0.785	76%	0.762	S	S	*	*			trans	-115.3	108.5	157	50	0	0	0	0	108.7	S26	T24-S26 PolarHBondContact O-N 3.39Å; T24-S26 VanDerWaalsContact O-N 3.1Å
25	H	35.5	Very low	36.9	Very low	184 Å²	184	134.8 Å²	134.8	85%	0.852	77%	0.767	S	S	*	*			trans	-52	110.6	172	-78.8	-80.4	0	0	0	110.4	A27	H25-A27 PolarHBondContact O-N 2.8Å
26	S	34.8	Very low	37.4	Very low	108 Å²	108	134.4 Å²	134.4	76%	0.755	77%	0.77	S	S	*	*			trans	-72.6	105	159	-63.7	0	0	0	0	106.9	T24 T28	T24-S26 PolarHBondContact O-N 3.39Å; T24-S26 VanDerWaalsContact O-N 3.1Å; S26-T28 VanDerWaalsContact C-N 3.25Å; S26-T28 PolarHBondContact O-N 3.31Å
27	A	37	Very low	38.6	Very low	98 Å²	98	130 Å²	130	81%	0.81	76%	0.764	S	S	*	*			trans	-66.4	89.7	169.2	0	0	0	0	0	108.3	H25 N29	H25-A27 PolarHBondContact O-N 2.8Å; A27-N29 PolarHBondContact O-N 3.43Å; A27-N29 VanDerWaalsContact O-N 3.07Å
28	T	44.3	Very low	40.8	Very low	123 Å²	123	128.2 Å²	128.2	76%	0.755	76%	0.761	S	S	*	*			trans	-59.6	108.3	161.6	46.2	0	0	0	0	107.2	S26 P30	S26-T28 VanDerWaalsContact C-N 3.25Å; S26-T28 PolarHBondContact O-N 3.31Å; T28-P30 VanDerWaalsContact O-CD 3.24Å; T28-P30 WeakPolarHBondContact O-CD 3.45Å; T28-P30 VanDerWaalsContact O-N 3.16Å
29	N	42.5	Very low	43.4	Very low	124 Å²	124	124.3 Å²	124.3	66%	0.663	74%	0.741	S	S	*	*			trans	-59.6	113.6	173.3	-165	-0.4	0	0	0	108.4	A27 F31	A27-N29 PolarHBondContact O-N 3.43Å; A27-N29 VanDerWaalsContact O-N 3.07Å; N29-F31 PolarHBondContact O-N 2.99Å; N29-F31 VanDerWaalsContact O-N 3.11Å
30	P	41.5	Very low	46.3	Very low	116 Å²	116	120.9 Å²	120.9	75%	0.753	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	2.5	-175	1.6	12.7	0	0	0	113.2	T28	T28-P30 VanDerWaalsContact O-CD 3.24Å; T28-P30 WeakPolarHBondContact O-CD 3.45Å; T28-P30 VanDerWaalsContact O-N 3.16Å
31	F	45.7	Very low	49.4	Very low	188 Å²	188	114.2 Å²	114.2	83%	0.825	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	23	-175.4	-83.9	-81.1	0	0	0	115	N29 G33	N29-F31 PolarHBondContact O-N 2.99Å; N29-F31 VanDerWaalsContact O-N 3.11Å; F31-G33 PolarHBondContact O-N 2.61Å
32	A	43.9	Very low	52.3	Low	93 Å²	93	112.7 Å²	112.7	77%	0.769	66%	0.664	S	S	*	*			trans	-88.5	48.7	161.6	0	0	0	0	0	110.8	Q34	A32-Q34 PolarHBondContact O-N 3.21Å
33	G	39	Very low	55.3	Low	59 Å²	59	109 Å²	109	61%	0.608	64%	0.64	S	S	*	*			trans	-69.3	116.7	162.5	0	0	0	0	0	107.6	F31 Q35	F31-G33 PolarHBondContact O-N 2.61Å; G33-Q35 PolarHBondContact O-N 3.22Å
34	Q	44.2	Very low	58	Low	189 Å²	189	112.9 Å²	112.9	88%	0.883	65%	0.646	S	S	*	*			trans	-59.6	83.9	171.9	-158.2	170.9	10.7	0	0	108.4	A32 T36	A32-Q34 PolarHBondContact O-N 3.21Å; Q34-T36 VanDerWaalsContact C-N 3.27Å; Q34-T36 PolarHBondContact O-N 3.06Å
35	Q	42.1	Very low	60.8	Low	179 Å²	179	111.3 Å²	111.3	84%	0.836	65%	0.646	S	S	*	*			trans	-67.7	91.3	172.3	-81.5	-177	-6	0	0	106.9	G33 S37	G33-Q35 PolarHBondContact O-N 3.22Å; Q35-S37 PolarHBondContact O-N 3.26Å
36	T	44.4	Very low	63.4	Low	119 Å²	119	104.9 Å²	104.9	73%	0.73	63%	0.63	S	S	*	*			trans	-57.1	96.5	147.1	48.1	0	0	0	0	104.9	Q34 L38	Q34-T36 VanDerWaalsContact C-N 3.27Å; Q34-T36 PolarHBondContact O-N 3.06Å; T36-L38 VanDerWaalsContact C-N 3.28Å; T36-L38 PolarHBondContact O-N 3.25Å
37	S	59	Low	66.2	Low	107 Å²	107	102.1 Å²	102.1	75%	0.748	61%	0.613	S	S	*	*			trans	-60.6	97.7	177.9	61	0	0	0	0	106.9	Q35 D39	Q35-S37 PolarHBondContact O-N 3.26Å; S37-D39 PolarHBondContact O-N 2.94Å
38	L	77.2	Confident	69	Low	124 Å²	124	98.9 Å²	98.9	65%	0.649	59%	0.586	S	S	*	*			trans	-55.1	127.8	173.7	-74.5	160.2	0	0	0	106.8	T36 P40	T36-L38 VanDerWaalsContact C-N 3.28Å; T36-L38 PolarHBondContact O-N 3.25Å; L38-P40 WeakPolarHBondContact O-CD 3.48Å; L38-P40 VanDerWaalsContact O-N 3.11Å
39	D	85.9	Confident	71.4	Confident	50 Å²	50	98.8 Å²	98.8	27%	0.267	57%	0.572	S	S	.	*			trans	-58.4	118	180	-178.3	-8.3	0	0	0	108.2	S37 C41 Y42 K322	S37-D39 PolarHBondContact O-N 2.94Å; D39-C41 PolarHBondContact O-N 2.83Å; D39-C41 WeakPolarHBondContact OD1-CB 3.49Å; D39-C41 PolarHBondContact OD1-N 2.04Å; D39-C41 VanDerWaalsContact OD1-N 3.14Å; D39-C41 PolarHBondContact OD1-SG 3.3Å; D39-Y42 HydrophobicContact CB-CD2 4.16Å; D39-Y42 PolarHBondContact O-N 3.29Å; D39-K322 WeakPolarHBondContact OD2-CE 3.48Å
40	P	93.3	Very high	74	Confident	60 Å²	60	96.7 Å²	96.7	39%	0.39	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.7	-9.4	-173.3	28.2	-37	0	0	0	112.9	L38 Y42 R49 S307	L38-P40 WeakPolarHBondContact O-CD 3.48Å; L38-P40 VanDerWaalsContact O-N 3.11Å; P40-Y42 PolarHBondContact O-N 3.32Å; P40-R49 WeakPolarHBondContact O-CG 3.42Å; P40-R49 PolarHBondContact O-NE 3.23Å; P40-R49 PolarHBondContact O-NH2 3.11Å; P40-S307 VanDerWaalsContact CG-CB 3.41Å
41	C	95.6	Very high	76.5	Confident	0 Å²	0	91.4 Å²	91.4	0%	0	52%	0.521	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-10.4	170.8	-59.3	0	0	0	0	114.4	D39 R49 C51 K322 H323	D39-C41 PolarHBondContact O-N 2.83Å; D39-C41 WeakPolarHBondContact OD1-CB 3.49Å; D39-C41 PolarHBondContact OD1-N 2.04Å; D39-C41 VanDerWaalsContact OD1-N 3.14Å; D39-C41 PolarHBondContact OD1-SG 3.3Å; C41-R49 PolarHBondContact O-N 3.42Å; C41-R49 VanDerWaalsContact O-O 3.05Å; C41-C51 WeakPolarHBondContact CA-SG 3.45Å; C41-C51 HydrophobicContact CB-CB 3.81Å; C41-C51 WeakPolarHBondContact CB-SG 3.32Å; C41-C51 WeakPolarHBondContact SG-CB 3.43Å; C41-C51 CovalentContact SG-SG 2.02Å; C41-C51 PolarHBondContact SG-SG 2.85Å; C41-K322 HydrophobicContact CB-CB 4.03Å; C41-K322 HydrophobicContact CB-CG 3.93Å; C41-K322 VanDerWaalsContact SG-CG 3.57Å; C41-H323 PolarHBondContact O-NE2 3.24Å; C41-H323 VanDerWaalsContact O-NE2 3.08Å
42	Y	95.4	Very high	78.9	Confident	73 Å²	73	86 Å²	86	29%	0.286	50%	0.5	S	S	.	.	B	Isolated β-bridge	trans	-125.7	148.3	177.6	-59	-86.1	0	0	0	110.2	D39 P40 A47 A48 R49 K322 H323	D39-Y42 HydrophobicContact CB-CD2 4.16Å; D39-Y42 PolarHBondContact O-N 3.29Å; P40-Y42 PolarHBondContact O-N 3.32Å; Y42-A47 CarbonylContact C-O 3.56Å; Y42-A47 VanDerWaalsContact CA-O 3.31Å; Y42-A47 WeakPolarHBondContact CA-O 3.37Å; Y42-A48 HydrophobicContact CD1-CB 4.43Å; Y42-A48 HydrophobicContact CE1-CB 4.29Å; Y42-R49 PolarHBondContact O-NE 3.39Å; Y42-R49 PolarHBondContact O-NH2 2.94Å; Y42-K322 HydrophobicContact CE2-CB 4.33Å; Y42-H323 PolarHBondContact OH-N 3.21Å
43	D	92.1	Very high	81.4	Confident	63 Å²	63	81.9 Å²	81.9	34%	0.337	47%	0.466	S	S	.	.			trans	-80.6	178.6	169.4	69.9	14.2	0	0	0	111.3	A45 G46 A47	D43-A45 PolarHBondContact O-N 2.84Å; D43-A45 WeakPolarHBondContact OD1-CA 3.19Å; D43-A45 WeakPolarHBondContact OD1-CB 3.45Å; D43-A45 PolarHBondContact OD1-N 3.27Å; D43-G46 PolarHBondContact O-N 2.52Å; D43-G46 PolarHBondContact OD1-N 3.19Å; D43-A47 PolarHBondContact N-O 2.81Å; D43-A47 PolarHBondContact OD1-N 3.48Å; D43-A47 WeakPolarHBondContact OD2-CB 3.09Å
44	E	91.6	Very high	84	Confident	185 Å²	185	86.8 Å²	86.8	86%	0.864	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-23.6	-179.7	-63	-179.6	178.3	0	0	112.9	G46	E44-G46 VanDerWaalsContact C-N 3.3Å
45	A	91.6	Very high	86.5	Confident	95 Å²	95	81.9 Å²	81.9	79%	0.785	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-4.3	174.6	0	0	0	0	0	112.9	D43 A47	D43-A45 PolarHBondContact O-N 2.84Å; D43-A45 WeakPolarHBondContact OD1-CA 3.19Å; D43-A45 WeakPolarHBondContact OD1-CB 3.45Å; D43-A45 PolarHBondContact OD1-N 3.27Å; A45-A47 VanDerWaalsContact C-N 3.35Å
46	G	90.8	Very high	89.1	Confident	49 Å²	49	76.9 Å²	76.9	51%	0.505	43%	0.427	S	S	.	.	S	Bend	trans	80.5	9.4	-176.4	0	0	0	0	0	114.6	D43 E44	D43-G46 PolarHBondContact O-N 2.52Å; D43-G46 PolarHBondContact OD1-N 3.19Å; E44-G46 VanDerWaalsContact C-N 3.3Å
47	A	93	Very high	91.5	Very high	50 Å²	50	73.1 Å²	73.1	41%	0.413	40%	0.402	S	S	.	.			trans	-75.5	143.4	172.1	0	0	0	0	0	110.5	Y42 D43 A45	Y42-A47 CarbonylContact C-O 3.56Å; Y42-A47 VanDerWaalsContact CA-O 3.31Å; Y42-A47 WeakPolarHBondContact CA-O 3.37Å; D43-A47 PolarHBondContact N-O 2.81Å; D43-A47 PolarHBondContact OD1-N 3.48Å; D43-A47 WeakPolarHBondContact OD2-CB 3.09Å; A45-A47 VanDerWaalsContact C-N 3.35Å
48	A	95.4	Very high	93.2	Very high	30 Å²	30	68.3 Å²	68.3	25%	0.248	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-67.6	137.2	-179.5	0	0	0	0	0	110.5	Y42 A350 E352	Y42-A48 HydrophobicContact CD1-CB 4.43Å; Y42-A48 HydrophobicContact CE1-CB 4.29Å; A48-A350 VanDerWaalsContact C-CB 3.4Å; A48-A350 HydrophobicContact CB-CB 3.67Å; A48-A350 VanDerWaalsContact O-CB 3.24Å; A48-A350 WeakPolarHBondContact O-CB 3.29Å; A48-E352 HydrophobicContact CB-CB 4.21Å; A48-E352 HydrophobicContact CB-CG 4.33Å
49	R	95.8	Very high	94.1	Very high	121 Å²	121	62.4 Å²	62.4	46%	0.457	34%	0.338	S	S	.	.			trans	-135.8	154.9	173.1	68.3	176.5	-177	-178.5	-7.9	110	P40 C41 Y42 C51 H323	P40-R49 WeakPolarHBondContact O-CG 3.42Å; P40-R49 PolarHBondContact O-NE 3.23Å; P40-R49 PolarHBondContact O-NH2 3.11Å; C41-R49 PolarHBondContact O-N 3.42Å; C41-R49 VanDerWaalsContact O-O 3.05Å; Y42-R49 PolarHBondContact O-NE 3.39Å; Y42-R49 PolarHBondContact O-NH2 2.94Å; R49-C51 PolarHBondContact O-N 3Å; R49-H323 PolarHBondContact O-CE1 2.71Å; R49-H323 PolarHBondContact O-NE2 2.04Å; R49-H323 VanDerWaalsContact O-NE2 3.15Å
50	R	95.9	Very high	94.5	Very high	80 Å²	80	65.4 Å²	65.4	30%	0.302	35%	0.349	S	S	.	.			trans	-56.9	129.9	177.5	-178.2	-176.1	71	175.4	-3.9	111.1	I52 D235 A345 N346	R50-I52 HydrophobicContact CG-CG2 4.39Å; R50-D235 IonicContact CZ-OD2 2.91Å; R50-D235 IonicContact NH1-OD1 3.36Å; R50-D235 PolarHBondContact NH1-OD1 2.94Å; R50-D235 IonicContact NH1-OD2 3.93Å; R50-D235 PolarHBondContact NH1-OD2 3.22Å; R50-D235 IonicContact NH2-OD2 3.1Å; R50-A345 HydrophobicContact CB-CB 4.01Å; R50-A345 HydrophobicContact CG-CB 3.92Å; R50-N346 WeakPolarHBondContact CB-O 3.48Å
51	C	95.6	Very high	94.5	Very high	6 Å²	6	65.5 Å²	65.5	4%	0.041	36%	0.361	C	S	.	.	B	Isolated β-bridge	trans	-128.4	137.2	171.5	54.1	0	0	0	0	110	C41 R49 G304 A306	C41-C51 WeakPolarHBondContact CA-SG 3.45Å; C41-C51 HydrophobicContact CB-CB 3.81Å; C41-C51 WeakPolarHBondContact CB-SG 3.32Å; C41-C51 WeakPolarHBondContact SG-CB 3.43Å; C41-C51 CovalentContact SG-SG 2.02Å; C41-C51 PolarHBondContact SG-SG 2.85Å; R49-C51 PolarHBondContact O-N 3Å; C51-G304 PolarHBondContact N-O 2.82Å; C51-G304 VanDerWaalsContact N-O 3.11Å; C51-G304 CarbonylContact O-C 3.59Å; C51-G304 WeakPolarHBondContact O-CA 3.25Å; C51-G304 VanDerWaalsContact O-O 3.07Å; C51-A306 CarbonylContact C-O 3.59Å; C51-A306 VanDerWaalsContact O-O 3.12Å; C51-A306 PolarHBondContact SG-N 3.46Å
52	I	95.4	Very high	94.4	Very high	73 Å²	73	69.4 Å²	69.4	37%	0.374	38%	0.378	S	S	.	.			trans	-126.9	146.5	-179.3	55.5	-179.1	0	0	0	109.4	R50 A306	R50-I52 HydrophobicContact CG-CG2 4.39Å; I52-A306 CarbonylContact C-O 3.56Å
53	P	96.4	Very high	94.3	Very high	8 Å²	8	74.2 Å²	74.2	5%	0.052	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-63.1	157.6	175.7	-22.9	36.2	0	0	0	112.6	R299 C300 C302 A306 S307	P53-R299 PolarHBondContact O-NH1 2.77Å; P53-C300 HydrophobicContact CB-CB 4.24Å; P53-C300 HydrophobicContact CG-CB 4.05Å; P53-C302 HydrophobicContact CG-CB 4.32Å; P53-A306 VanDerWaalsContact CD-O 3.26Å; P53-A306 WeakPolarHBondContact CD-O 3Å; P53-S307 WeakPolarHBondContact CA-O 3.38Å
54	E	94.4	Very high	94.6	Very high	161 Å²	161	71.4 Å²	71.4	75%	0.752	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-56.1	151	172.9	-66	-177.3	169.3	0	0	111.8
55	F	96.6	Very high	94.8	Very high	86 Å²	86	66.8 Å²	66.8	38%	0.377	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-81.7	128.2	175	-175.3	-89.4	0	0	0	109.2	Y148 G297	F55-Y148 HydrophobicContact CE1-CE1 4.02Å; F55-Y148 HydrophobicContact CZ-CD1 4.15Å; F55-Y148 AromaticContact CZ-CE1 3.61Å; F55-Y148 HydrophobicContact CZ-CE1 3.61Å; F55-G297 VanDerWaalsContact CZ-C 3.46Å
56	I	95.6	Very high	95.1	Very high	75 Å²	75	64 Å²	64	39%	0.385	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	158.6	-176.3	65.9	169.7	0	0	0	111.2	A58 F144 G298	I56-A58 PolarHBondContact O-N 3.01Å; I56-F144 HydrophobicContact CD1-CE1 4.03Å; I56-F144 HydrophobicContact CD1-CZ 4.49Å; I56-F144 HydrophobicContact CG1-CE1 4.29Å; I56-G298 PolarHBondContact N-O 3.41Å; I56-G298 PolarHBondContact O-N 3.41Å; I56-G298 VanDerWaalsContact O-O 3.05Å
57	N	95.6	Very high	95.3	Very high	40 Å²	40	64.9 Å²	64.9	21%	0.214	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	104	158.5	-179.6	6	0	0	0	108.3	A59 F60 V296	N57-A59 PolarHBondContact O-N 2.79Å; N57-A59 WeakPolarHBondContact OD1-CB 3.2Å; N57-A59 PolarHBondContact OD1-N 3.03Å; N57-A59 VanDerWaalsContact OD1-N 3.11Å; N57-F60 HydrophobicContact CB-CB 4.21Å; N57-F60 WeakPolarHBondContact O-CB 3.43Å; N57-F60 PolarHBondContact O-N 2.92Å; N57-V296 PolarHBondContact OD1-N 3.17Å
58	A	95.1	Very high	95.3	Very high	6 Å²	6	63 Å²	63	5%	0.05	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-14.6	-177	0	0	0	0	0	113.4	I56 L140 F144 V296	I56-A58 PolarHBondContact O-N 3.01Å; A58-L140 HydrophobicContact CB-CD2 3.87Å; A58-F144 HydrophobicContact CB-CD1 3.9Å; A58-F144 HydrophobicContact CB-CE1 3.72Å; A58-F144 HydrophobicContact CB-CG 4.43Å; A58-F144 HydrophobicContact CB-CZ 4.11Å; A58-V296 HydrophobicContact CB-CG1 4.38Å; A58-V296 PolarHBondContact N-O 3.31Å
59	A	95.4	Very high	95.3	Very high	0 Å²	0	64 Å²	64	0%	0	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-22.8	175.1	0	0	0	0	0	112.9	N57 G61 K62 T111 L138 F294 V296	N57-A59 PolarHBondContact O-N 2.79Å; N57-A59 WeakPolarHBondContact OD1-CB 3.2Å; N57-A59 PolarHBondContact OD1-N 3.03Å; N57-A59 VanDerWaalsContact OD1-N 3.11Å; A59-G61 PolarHBondContact O-N 3.32Å; A59-K62 VanDerWaalsContact O-CB 3.25Å; A59-K62 WeakPolarHBondContact O-CB 3.21Å; A59-K62 PolarHBondContact O-N 3.35Å; A59-T111 HydrophobicContact CB-CG2 4.02Å; A59-T111 WeakPolarHBondContact O-CB 3.28Å; A59-T111 WeakPolarHBondContact O-CG2 3.16Å; A59-L138 HydrophobicContact CB-CD2 3.51Å; A59-F294 VanDerWaalsContact CB-O 3.22Å; A59-F294 WeakPolarHBondContact CB-O 3.29Å; A59-V296 HydrophobicContact CB-CB 4.09Å; A59-V296 HydrophobicContact CB-CG2 4.07Å
60	F	94.7	Very high	95.2	Very high	112 Å²	112	58.4 Å²	58.4	49%	0.491	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	128.1	-173.3	-177.3	-102.1	0	0	0	112.6	N57 K62 L113	N57-F60 HydrophobicContact CB-CB 4.21Å; N57-F60 WeakPolarHBondContact O-CB 3.43Å; N57-F60 PolarHBondContact O-N 2.92Å; F60-K62 PolarHBondContact O-N 3.37Å; F60-L113 HydrophobicContact CE2-CB 4.3Å; F60-L113 HydrophobicContact CE2-CD1 4.03Å; F60-L113 HydrophobicContact CZ-CB 4.48Å; F60-L113 HydrophobicContact CZ-CD1 4.11Å
61	G	92	Very high	95	Very high	62 Å²	62	54.8 Å²	54.8	64%	0.639	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	11.3	-179.3	0	0	0	0	0	115	A59 T111	A59-G61 PolarHBondContact O-N 3.32Å; G61-T111 PolarHBondContact N-O 3.31Å
62	K	93.8	Very high	94.7	Very high	82 Å²	82	64.1 Å²	64.1	36%	0.357	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-93.9	139.8	176.4	-65.7	-72.4	-170.3	159	0	110.9	A59 F60 V64 T111 L138	A59-K62 VanDerWaalsContact O-CB 3.25Å; A59-K62 WeakPolarHBondContact O-CB 3.21Å; A59-K62 PolarHBondContact O-N 3.35Å; F60-K62 PolarHBondContact O-N 3.37Å; K62-V64 PolarHBondContact O-N 3.46Å; K62-T111 WeakPolarHBondContact O-CB 3.44Å; K62-T111 PolarHBondContact O-OG1 2.87Å; K62-L138 HydrophobicContact CB-CD1 3.56Å; K62-L138 HydrophobicContact CG-CD1 4.31Å
63	E	94.3	Very high	94.6	Very high	175 Å²	175	65.8 Å²	65.8	82%	0.818	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-70.8	129.7	172.4	-168.7	174.9	-172.7	0	0	110.7
64	V	96.9	Very high	94.4	Very high	4 Å²	4	69.2 Å²	69.2	2%	0.024	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	127.7	177.4	-177.1	0	0	0	0	108.6	K62 V66 A107 L110 T111 L136 L138 F294	K62-V64 PolarHBondContact O-N 3.46Å; V64-V66 HydrophobicContact CG1-CG1 4.09Å; V64-A107 WeakPolarHBondContact O-CB 3.5Å; V64-L110 HydrophobicContact CB-CD1 3.92Å; V64-L110 HydrophobicContact CG1-CD1 3.84Å; V64-L110 HydrophobicContact CG2-CB 4.22Å; V64-L110 HydrophobicContact CG2-CD1 4.3Å; V64-T111 HydrophobicContact CG2-CG2 3.59Å; V64-L136 HydrophobicContact CG1-CB 4.11Å; V64-L138 HydrophobicContact CG2-CD1 4.09Å; V64-F294 HydrophobicContact CG1-CD1 4.47Å; V64-F294 HydrophobicContact CG2-CD1 4.15Å
65	T	97	Very high	94.2	Very high	87 Å²	87	62.8 Å²	62.8	53%	0.534	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	126.9	174.3	54	0	0	0	0	109.7	L136 T137	T65-L136 CarbonylContact O-C 3.45Å; T65-T137 PolarHBondContact N-O 2.92Å; T65-T137 PolarHBondContact O-N 2.88Å; T65-T137 VanDerWaalsContact OG1-CB 3.29Å; T65-T137 WeakPolarHBondContact OG1-CB 3.25Å; T65-T137 PolarHBondContact OG1-O 3.35Å
66	V	96.9	Very high	93.8	Very high	37 Å²	37	67 Å²	67	22%	0.224	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	146.8	-174.1	-57.1	0	0	0	0	110.7	V64 V69 A107 L110 W122 T135 L136	V64-V66 HydrophobicContact CG1-CG1 4.09Å; V66-V69 HydrophobicContact CG2-CG2 3.25Å; V66-A107 HydrophobicContact CB-CB 4.46Å; V66-A107 HydrophobicContact CG1-CB 3.71Å; V66-A107 HydrophobicContact CG2-CB 3.82Å; V66-L110 HydrophobicContact CG1-CD1 3.95Å; V66-W122 HydrophobicContact CB-CZ2 4.41Å; V66-T135 WeakPolarHBondContact CA-O 3.47Å; V66-L136 HydrophobicContact CB-CD2 4.06Å; V66-L136 HydrophobicContact CG1-CD2 3.4Å
67	S	95.9	Very high	93.3	Very high	68 Å²	68	63.7 Å²	63.7	48%	0.476	34%	0.34	S	S	.	.	S	Bend	trans	-83.8	-21.3	-178.4	63.9	0	0	0	0	114.4	V134 T135	S67-V134 WeakPolarHBondContact OG-CA 3.19Å; S67-T135 WeakPolarHBondContact CB-OG1 3.3Å; S67-T135 PolarHBondContact N-O 3.28Å; S67-T135 PolarHBondContact OG-N 2.64Å
68	S	93.8	Very high	92.8	Very high	11 Å²	11	63.3 Å²	63.3	8%	0.077	34%	0.34	C	S	.	.			trans	-146.7	140.8	-177.7	177.8	0	0	0	0	110	W122 E125	S68-W122 VanDerWaalsContact O-CZ2 3.23Å; S68-W122 WeakPolarHBondContact O-CZ2 3.23Å; S68-W122 PolarHBondContact O-NE1 3.02Å; S68-E125 VanDerWaalsContact OG-CB 3.28Å; S68-E125 WeakPolarHBondContact OG-CB 3.11Å; S68-E125 VanDerWaalsContact OG-CG 3.26Å; S68-E125 WeakPolarHBondContact OG-CG 3.28Å; S68-E125 PolarHBondContact OG-N 3.31Å; S68-E125 PolarHBondContact OG-OE2 2.83Å
69	V	95.1	Very high	91.9	Very high	51 Å²	51	65.2 Å²	65.2	31%	0.309	35%	0.353	S	S	.	.			trans	-147	133.2	177.7	-172.2	0	0	0	0	108.2	V66 E125	V66-V69 HydrophobicContact CG2-CG2 3.25Å; V69-E125 VanDerWaalsContact O-CG 3.3Å; V69-E125 WeakPolarHBondContact O-CG 3.33Å
70	C	93.4	Very high	91	Very high	3 Å²	3	68 Å²	68	2%	0.02	37%	0.37	C	S	.	.	S	Bend	trans	-70.3	162.4	177.8	67.9	0	0	0	0	113.2	C96 Q123 S124	C70-C96 HydrophobicContact CB-CB 3.72Å; C70-C96 WeakPolarHBondContact CB-SG 3.42Å; C70-C96 PolarHBondContact O-SG 3.01Å; C70-C96 WeakPolarHBondContact SG-CB 3.43Å; C70-C96 CovalentContact SG-SG 2.03Å; C70-C96 PolarHBondContact SG-SG 3.5Å; C70-Q123 PolarHBondContact N-O 2.93Å; C70-S124 WeakPolarHBondContact CB-O 3.35Å
71	G	90.4	Very high	89.9	Confident	4 Å²	4	65.8 Å²	65.8	4%	0.041	37%	0.365	C	S	.	.			trans	104.5	3.8	168.4	0	0	0	0	0	116	P73 C96 A98	G71-P73 VanDerWaalsContact C-C 3.43Å; G71-P73 CarbonylContact C-O 3.44Å; G71-P73 VanDerWaalsContact C-O 3.28Å; G71-C96 WeakPolarHBondContact CA-O 3.37Å; G71-A98 WeakPolarHBondContact O-CB 2.95Å; G71-A98 PolarHBondContact O-N 2.75Å
72	R	90.6	Very high	88.6	Confident	202 Å²	202	67.5 Å²	67.5	76%	0.762	36%	0.357	S	S	*	.	S	Bend	trans	-136.4	89.5	172.7	-63.4	-173.8	-178	-176.5	1	111.8	A98	R72-A98 HydrophobicContact CG-CB 3.77Å
73	P	92.4	Very high	87.3	Confident	108 Å²	108	71.2 Å²	71.2	70%	0.701	37%	0.368	S	S	*	.	S	Bend	cis	-74	167	0.9	31.4	-35.9	0	0	0	113.2	G71 S75	G71-P73 VanDerWaalsContact C-C 3.43Å; G71-P73 CarbonylContact C-O 3.44Å; G71-P73 VanDerWaalsContact C-O 3.28Å; P73-S75 PolarHBondContact O-N 3.18Å
74	P	91.7	Very high	85.4	Confident	79 Å²	79	67.9 Å²	67.9	51%	0.513	37%	0.365	S	S	.	.			trans	-53.9	130.8	174.2	-26.2	35	0	0	0	111.7	C96 D97	P74-C96 CarbonylContact C-O 3.53Å; P74-C96 VanDerWaalsContact CA-O 3.27Å; P74-C96 WeakPolarHBondContact CA-O 3.48Å; P74-D97 HydrophobicContact CB-CB 4.27Å; P74-D97 HydrophobicContact CG-CB 4.41Å
75	S	90.2	Very high	83.4	Confident	27 Å²	27	74.3 Å²	74.3	19%	0.189	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	138.2	-170.6	64.5	0	0	0	0	111.5	P73 C96	P73-S75 PolarHBondContact O-N 3.18Å; S75-C96 PolarHBondContact N-O 2.04Å; S75-C96 PolarHBondContact O-N 3.35Å
76	R	89.5	Confident	81.4	Confident	174 Å²	174	78.9 Å²	78.9	66%	0.657	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	115.7	175.7	-174	-178.9	179.3	-158.4	-0.4	110.2	C93 Q94 N126	R76-C93 HydrophobicContact CG-CB 4.25Å; R76-Q94 WeakPolarHBondContact CA-O 3.07Å; R76-N126 PolarHBondContact O-ND2 3Å
77	S	85.2	Confident	79.6	Confident	5 Å²	5	86 Å²	86	4%	0.035	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	148.9	172.4	56.7	0	0	0	0	109.9	C93 Q94 Q123	S77-C93 CarbonylContact O-C 3.23Å; S77-C93 VanDerWaalsContact O-CA 3.23Å; S77-C93 WeakPolarHBondContact O-CA 3.35Å; S77-Q94 PolarHBondContact N-O 3.42Å; S77-Q94 PolarHBondContact O-N 2.8Å; S77-Q94 VanDerWaalsContact O-O 3.14Å; S77-Q123 PolarHBondContact OG-NE2 2.87Å
78	C	83.8	Confident	78	Confident	32 Å²	32	88 Å²	88	22%	0.216	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	133.2	178.1	-55.8	0	0	0	0	110.5	R91 A92 C93	C78-R91 HydrophobicContact CB-CG 3.96Å; C78-A92 CarbonylContact C-O 2.97Å; C78-A92 VanDerWaalsContact CA-O 3.25Å; C78-A92 WeakPolarHBondContact CA-O 3.35Å; C78-C93 HydrophobicContact CB-CB 4.03Å; C78-C93 WeakPolarHBondContact CB-SG 3.5Å; C78-C93 WeakPolarHBondContact SG-CB 3.34Å; C78-C93 CovalentContact SG-SG 2.04Å; C78-C93 PolarHBondContact SG-SG 3.39Å
79	S	76.9	Confident	76.7	Confident	47 Å²	47	90.3 Å²	90.3	33%	0.329	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	155.3	173.2	55.8	0	0	0	0	110.5	A92	S79-A92 PolarHBondContact N-O 2.8Å; S79-A92 PolarHBondContact O-N 3.39Å
80	V	76.3	Confident	75.6	Confident	58 Å²	58	91.2 Å²	91.2	35%	0.352	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	121.2	171.2	-179.2	0	0	0	0	107	L215	V80-L215 HydrophobicContact CG1-CD1 4.4Å
81	V	70.9	Confident	74.9	Confident	66 Å²	66	99.5 Å²	99.5	40%	0.4	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	119.9	177.1	-175.9	0	0	0	0	108.2	V90 A92	V81-V90 PolarHBondContact N-O 2.96Å; V81-V90 PolarHBondContact O-N 3.37Å; V81-A92 HydrophobicContact CG2-CB 3.9Å
82	E	66.4	Low	74.5	Confident	98 Å²	98	101.1 Å²	101.1	46%	0.458	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-78	129.8	170	-80.2	174.4	-179.2	0	0	109.8	Y213 L215	E82-Y213 WeakPolarHBondContact OE1-CE1 3.42Å; E82-Y213 PolarHBondContact OE1-OH 3.28Å; E82-Y213 WeakPolarHBondContact OE2-CE1 3.49Å; E82-L215 HydrophobicContact CG-CD1 3.72Å; E82-L215 WeakPolarHBondContact OE1-CD1 3.4Å
83	R	64.7	Low	74.2	Confident	159 Å²	159	93.6 Å²	93.6	60%	0.6	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-100.8	133.3	168.3	-76	-178	165.8	173.7	-4.9	107.4
84	S	56.2	Low	74	Confident	106 Å²	106	94.2 Å²	94.2	74%	0.741	49%	0.491	S	S	*	.	S	Bend	trans	-60.5	137.9	168.7	52.3	0	0	0	0	109.7
85	D	53.6	Low	74	Confident	138 Å²	138	94.6 Å²	94.6	74%	0.738	49%	0.488	S	S	*	.	S	Bend	trans	77.5	102.1	176.8	-52	-31.1	0	0	0	116.8	R87	D85-R87 PolarHBondContact O-N 2.05Å
86	D	56.5	Low	74.2	Confident	184 Å²	184	93.3 Å²	93.3	98%	0.984	48%	0.479	S	S	*	.	S	Bend	trans	47.2	13.1	156.7	-101	-6.7	0	0	0	119.1
87	R	58.6	Low	74.4	Confident	186 Å²	186	87 Å²	87	70%	0.702	46%	0.458	S	S	*	.			trans	-105.7	140.9	177.8	-68.3	-175.6	-171.8	-136.4	4.5	111	D85	D85-R87 PolarHBondContact O-N 2.05Å
88	P	60.9	Low	74.7	Confident	110 Å²	110	88.5 Å²	88.5	71%	0.714	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-60.3	143.9	178.5	24.4	-32.8	0	0	0	111	V90	P88-V90 PolarHBondContact O-N 2.06Å
89	S	67.3	Low	75.2	Confident	60 Å²	60	91.2 Å²	91.2	42%	0.42	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-56.9	131.5	176.9	57.8	0	0	0	0	110.5
90	V	72.3	Confident	76	Confident	70 Å²	70	90.7 Å²	90.7	42%	0.424	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	129.7	-175.3	-176.3	0	0	0	0	109.4	V81 P88 A92	V81-V90 PolarHBondContact N-O 2.96Å; V81-V90 PolarHBondContact O-N 3.37Å; P88-V90 PolarHBondContact O-N 2.06Å; V90-A92 PolarHBondContact O-N 3.06Å
91	R	79.3	Confident	76.7	Confident	177 Å²	177	92.7 Å²	92.7	67%	0.668	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	103.9	172.4	-169.7	176.8	-174.1	-176	1.8	109.6	C78	C78-R91 HydrophobicContact CB-CG 3.96Å
92	A	80.8	Confident	77.6	Confident	37 Å²	37	100 Å²	100	31%	0.306	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	128	174.5	0	0	0	0	0	109.5	C78 S79 V81 V90	C78-A92 CarbonylContact C-O 2.97Å; C78-A92 VanDerWaalsContact CA-O 3.25Å; C78-A92 WeakPolarHBondContact CA-O 3.35Å; S79-A92 PolarHBondContact N-O 2.8Å; S79-A92 PolarHBondContact O-N 3.39Å; V81-A92 HydrophobicContact CG2-CB 3.9Å; V90-A92 PolarHBondContact O-N 3.06Å
93	C	85.8	Confident	78.7	Confident	45 Å²	45	101.3 Å²	101.3	30%	0.304	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	137.4	178.4	-58.1	0	0	0	0	111	R76 S77 C78	R76-C93 HydrophobicContact CG-CB 4.25Å; S77-C93 CarbonylContact O-C 3.23Å; S77-C93 VanDerWaalsContact O-CA 3.23Å; S77-C93 WeakPolarHBondContact O-CA 3.35Å; C78-C93 HydrophobicContact CB-CB 4.03Å; C78-C93 WeakPolarHBondContact CB-SG 3.5Å; C78-C93 WeakPolarHBondContact SG-CB 3.34Å; C78-C93 CovalentContact SG-SG 2.04Å; C78-C93 PolarHBondContact SG-SG 3.39Å
94	Q	88	Confident	80.1	Confident	121 Å²	121	94.4 Å²	94.4	57%	0.565	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.1	154.2	178.6	-64.9	178.6	-13.5	0	0	109.5	R76 S77	R76-Q94 WeakPolarHBondContact CA-O 3.07Å; S77-Q94 PolarHBondContact N-O 3.42Å; S77-Q94 PolarHBondContact O-N 2.8Å; S77-Q94 VanDerWaalsContact O-O 3.14Å
95	I	91.1	Very high	81.9	Confident	86 Å²	86	91.1 Å²	91.1	44%	0.441	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	120.4	175.1	-60.9	173.4	0	0	0	106.6
96	C	93.7	Very high	83.9	Confident	1 Å²	1	86.6 Å²	86.6	1%	0.007	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	122.9	169	176.7	0	0	0	0	109	C70 G71 P74 S75 R103	C70-C96 HydrophobicContact CB-CB 3.72Å; C70-C96 WeakPolarHBondContact CB-SG 3.42Å; C70-C96 PolarHBondContact O-SG 3.01Å; C70-C96 WeakPolarHBondContact SG-CB 3.43Å; C70-C96 CovalentContact SG-SG 2.03Å; C70-C96 PolarHBondContact SG-SG 3.5Å; G71-C96 WeakPolarHBondContact CA-O 3.37Å; P74-C96 CarbonylContact C-O 3.53Å; P74-C96 VanDerWaalsContact CA-O 3.27Å; P74-C96 WeakPolarHBondContact CA-O 3.48Å; S75-C96 PolarHBondContact N-O 2.04Å; S75-C96 PolarHBondContact O-N 3.35Å; C96-R103 WeakPolarHBondContact CA-O 3.11Å
97	D	93.8	Very high	85.7	Confident	42 Å²	42	78.6 Å²	78.6	23%	0.225	41%	0.412	C	S	.	.			trans	-134.7	119.6	178.1	-175	-7.3	0	0	0	108.8	P74 A99 D100 R103 A104	P74-D97 HydrophobicContact CB-CB 4.27Å; P74-D97 HydrophobicContact CG-CB 4.41Å; D97-A99 PolarHBondContact O-N 2.98Å; D97-A99 WeakPolarHBondContact OD1-CB 3.11Å; D97-A99 PolarHBondContact OD1-N 3.44Å; D97-D100 PolarHBondContact O-N 2.93Å; D97-R103 HydrophobicContact CB-CB 4.44Å; D97-R103 PolarHBondContact N-O 3.46Å; D97-R103 CarbonylContact O-C 3.52Å; D97-A104 WeakPolarHBondContact O-CA 2.96Å; D97-A104 PolarHBondContact O-N 3.41Å
98	A	92.9	Very high	87.4	Confident	36 Å²	36	72.8 Å²	72.8	30%	0.298	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-13.1	-178.9	0	0	0	0	0	113	G71 R72	G71-A98 WeakPolarHBondContact O-CB 2.95Å; G71-A98 PolarHBondContact O-N 2.75Å; R72-A98 HydrophobicContact CG-CB 3.77Å
99	A	92.9	Very high	89	Confident	88 Å²	88	70.4 Å²	70.4	73%	0.727	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-25.1	177.4	0	0	0	0	0	113.3	D97 P101	D97-A99 PolarHBondContact O-N 2.98Å; D97-A99 WeakPolarHBondContact OD1-CB 3.11Å; D97-A99 PolarHBondContact OD1-N 3.44Å; A99-P101 WeakPolarHBondContact O-CD 3.1Å
100	D	93.8	Very high	90.3	Very high	37 Å²	37	67.5 Å²	67.5	20%	0.198	36%	0.357	C	S	.	.	S	Bend	trans	-100.2	111.3	177.5	-178	-5.9	0	0	0	110.5	D97 R102 R103 A104	D97-D100 PolarHBondContact O-N 2.93Å; D100-R102 PolarHBondContact O-N 3.28Å; D100-R102 PolarHBondContact OD1-N 3.33Å; D100-R102 IonicContact OD1-NE 2.87Å; D100-R103 HydrophobicContact CB-CB 4.32Å; D100-R103 CarbonylContact O-C 3.05Å; D100-R103 PolarHBondContact O-N 3.01Å; D100-A104 WeakPolarHBondContact O-CB 3.02Å; D100-A104 PolarHBondContact O-N 2.85Å
101	P	90.8	Very high	91.4	Very high	100 Å²	100	64.4 Å²	64.4	65%	0.649	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-25.3	179.9	-27.1	35.4	0	0	0	115.1	A99 R103	A99-P101 WeakPolarHBondContact O-CD 3.1Å; P101-R103 VanDerWaalsContact C-N 3.31Å
102	R	89.6	Confident	92	Very high	220 Å²	220	58.1 Å²	58.1	83%	0.83	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-15.8	178.3	-64.7	-175.3	-65.3	-177.1	-2.3	113.6	D100	D100-R102 PolarHBondContact O-N 3.28Å; D100-R102 PolarHBondContact OD1-N 3.33Å; D100-R102 IonicContact OD1-NE 2.87Å
103	R	90.4	Very high	92.4	Very high	124 Å²	124	63.5 Å²	63.5	47%	0.468	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	2.4	-177.5	-64	-178.5	179.8	174.5	1.7	112.4	C96 D97 D100 P101 H105	C96-R103 WeakPolarHBondContact CA-O 3.11Å; D97-R103 HydrophobicContact CB-CB 4.44Å; D97-R103 PolarHBondContact N-O 3.46Å; D97-R103 CarbonylContact O-C 3.52Å; D100-R103 HydrophobicContact CB-CB 4.32Å; D100-R103 CarbonylContact O-C 3.05Å; D100-R103 PolarHBondContact O-N 3.01Å; P101-R103 VanDerWaalsContact C-N 3.31Å; R103-H105 PolarHBondContact O-CD2 2.89Å
104	A	93.3	Very high	92.1	Very high	15 Å²	15	63 Å²	63	12%	0.124	34%	0.335	C	S	.	.			trans	-84.2	140.8	176.4	0	0	0	0	0	110.1	D97 D100 P106 Y109	D97-A104 WeakPolarHBondContact O-CA 2.96Å; D97-A104 PolarHBondContact O-N 3.41Å; D100-A104 WeakPolarHBondContact O-CB 3.02Å; D100-A104 PolarHBondContact O-N 2.85Å; A104-P106 WeakPolarHBondContact O-CD 3.14Å; A104-Y109 WeakPolarHBondContact O-CE2 3.46Å
105	H	94.6	Very high	91.3	Very high	36 Å²	36	60.7 Å²	60.7	17%	0.167	33%	0.332	C	S	.	.			trans	-125.3	61.2	179	-66.2	-77.8	0	0	0	111.1	R103 C121 Q123	R103-H105 PolarHBondContact O-CD2 2.89Å; H105-C121 VanDerWaalsContact CB-O 3.31Å; H105-C121 WeakPolarHBondContact CB-O 3.16Å; H105-C121 PolarHBondContact ND1-O 2.88Å; H105-Q123 HydrophobicContact CB-CB 3.73Å
106	P	95.3	Very high	90.2	Very high	43 Å²	43	60.3 Å²	60.3	28%	0.279	34%	0.342	S	S	.	.			trans	-69.2	163	-175.5	32	-38.5	0	0	0	112.9	A104 S108 Y109	A104-P106 WeakPolarHBondContact O-CD 3.14Å; P106-S108 WeakPolarHBondContact CG-OG 3.02Å; P106-S108 PolarHBondContact O-N 2.98Å; P106-Y109 HydrophobicContact CG-CD1 4.22Å; P106-Y109 HydrophobicContact CG-CD2 4.26Å; P106-Y109 HydrophobicContact CG-CE1 4.15Å; P106-Y109 HydrophobicContact CG-CE2 4.22Å; P106-Y109 HydrophobicContact CG-CG 4.26Å; P106-Y109 PolarHBondContact O-N 2.97Å
107	A	95.1	Very high	89.1	Confident	16 Å²	16	69.1 Å²	69.1	13%	0.132	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-64	-19.5	177.7	0	0	0	0	0	114.1	V64 V66 Y109 L110	V64-A107 WeakPolarHBondContact O-CB 3.5Å; V66-A107 HydrophobicContact CB-CB 4.46Å; V66-A107 HydrophobicContact CG1-CB 3.71Å; V66-A107 HydrophobicContact CG2-CB 3.82Å; A107-Y109 PolarHBondContact O-N 2.98Å; A107-L110 HydrophobicContact CB-CD1 4.43Å; A107-L110 WeakPolarHBondContact O-CB 3.41Å; A107-L110 WeakPolarHBondContact O-CG 3.48Å; A107-L110 PolarHBondContact O-N 3.28Å; A107-L110 VanDerWaalsContact O-N 3.13Å
108	S	93.9	Very high	88.4	Confident	65 Å²	65	73 Å²	73	46%	0.455	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-63.8	-23.5	176.8	53.6	0	0	0	0	113.3	P106 L110 T111 D112	P106-S108 WeakPolarHBondContact CG-OG 3.02Å; P106-S108 PolarHBondContact O-N 2.98Å; S108-L110 PolarHBondContact O-N 3.24Å; S108-T111 PolarHBondContact O-N 2.82Å; S108-D112 PolarHBondContact O-N 3.22Å
109	Y	94.4	Very high	87.8	Confident	59 Å²	59	74.1 Å²	74.1	23%	0.231	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-71.9	-8.6	175.4	-67.4	-12.6	0	0	0	113.4	A104 P106 A107 T111 T120	A104-Y109 WeakPolarHBondContact O-CE2 3.46Å; P106-Y109 HydrophobicContact CG-CD1 4.22Å; P106-Y109 HydrophobicContact CG-CD2 4.26Å; P106-Y109 HydrophobicContact CG-CE1 4.15Å; P106-Y109 HydrophobicContact CG-CE2 4.22Å; P106-Y109 HydrophobicContact CG-CG 4.26Å; P106-Y109 PolarHBondContact O-N 2.97Å; A107-Y109 PolarHBondContact O-N 2.98Å; Y109-T111 VanDerWaalsContact C-N 3.26Å; Y109-T111 PolarHBondContact O-N 3.06Å; Y109-T120 HydrophobicContact CD1-CG2 4.22Å; Y109-T120 HydrophobicContact CD2-CG2 4.46Å; Y109-T120 HydrophobicContact CE1-CG2 4.24Å; Y109-T120 HydrophobicContact CE2-CG2 4.44Å; Y109-T120 HydrophobicContact CG-CG2 4.36Å
110	L	94.9	Very high	87.7	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-72.8	-22.2	175.3	-67.9	167.6	0	0	0	112.4	V64 V66 A107 S108 W122 L136 V291 F294	V64-L110 HydrophobicContact CB-CD1 3.92Å; V64-L110 HydrophobicContact CG1-CD1 3.84Å; V64-L110 HydrophobicContact CG2-CB 4.22Å; V64-L110 HydrophobicContact CG2-CD1 4.3Å; V66-L110 HydrophobicContact CG1-CD1 3.95Å; A107-L110 HydrophobicContact CB-CD1 4.43Å; A107-L110 WeakPolarHBondContact O-CB 3.41Å; A107-L110 WeakPolarHBondContact O-CG 3.48Å; A107-L110 PolarHBondContact O-N 3.28Å; A107-L110 VanDerWaalsContact O-N 3.13Å; S108-L110 PolarHBondContact O-N 3.24Å; L110-W122 HydrophobicContact CD1-CB 4.3Å; L110-W122 HydrophobicContact CD1-CD2 4.36Å; L110-W122 HydrophobicContact CD1-CG 4.16Å; L110-W122 HydrophobicContact CD2-CB 3.78Å; L110-W122 HydrophobicContact CD2-CD2 4.31Å; L110-W122 HydrophobicContact CD2-CE3 4.11Å; L110-W122 HydrophobicContact CD2-CG 4.22Å; L110-W122 HydrophobicContact CG-CB 3.72Å; L110-W122 HydrophobicContact CG-CG 4.12Å; L110-L136 HydrophobicContact CD1-CD1 4.27Å; L110-L136 HydrophobicContact CD1-CD2 4.02Å; L110-L136 HydrophobicContact CD2-CD1 4.28Å; L110-V291 HydrophobicContact CD2-CB 3.6Å; L110-V291 HydrophobicContact CD2-CG1 3.61Å; L110-F294 HydrophobicContact CB-CB 4.13Å; L110-F294 HydrophobicContact CD2-CB 4.47Å; L110-F294 WeakPolarHBondContact O-CA 3.28Å; L110-F294 WeakPolarHBondContact O-CB 3.42Å; L110-F294 PolarHBondContact O-N 2.86Å
111	T	94.9	Very high	87.7	Confident	5 Å²	5	70.9 Å²	70.9	3%	0.031	38%	0.377	C	S	.	.	S	Bend	trans	-139.7	13.7	-166.6	57.1	0	0	0	0	113.2	A59 G61 K62 V64 S108 Y109	A59-T111 HydrophobicContact CB-CG2 4.02Å; A59-T111 WeakPolarHBondContact O-CB 3.28Å; A59-T111 WeakPolarHBondContact O-CG2 3.16Å; G61-T111 PolarHBondContact N-O 3.31Å; K62-T111 WeakPolarHBondContact O-CB 3.44Å; K62-T111 PolarHBondContact O-OG1 2.87Å; V64-T111 HydrophobicContact CG2-CG2 3.59Å; S108-T111 PolarHBondContact O-N 2.82Å; Y109-T111 VanDerWaalsContact C-N 3.26Å; Y109-T111 PolarHBondContact O-N 3.06Å
112	D	92.9	Very high	87.9	Confident	44 Å²	44	66.1 Å²	66.1	24%	0.235	35%	0.346	C	S	.	.	S	Bend	trans	-76.9	-175.7	176.6	65.7	-22.3	0	0	0	111.9	S108 N114 T120	S108-D112 PolarHBondContact O-N 3.22Å; D112-N114 PolarHBondContact O-N 3.45Å; D112-N114 PolarHBondContact OD1-ND2 3.3Å; D112-N114 VanDerWaalsContact OD1-ND2 3.11Å; D112-T120 VanDerWaalsContact CG-OG1 3.26Å; D112-T120 PolarHBondContact OD1-OG1 2.02Å; D112-T120 PolarHBondContact OD2-OG1 3.27Å
113	L	87.8	Confident	88.2	Confident	150 Å²	150	56 Å²	56	79%	0.785	31%	0.309	S	S	*	.			trans	-79.6	88.8	178.8	-175.2	68.7	0	0	0	109.9	F60	F60-L113 HydrophobicContact CE2-CB 4.3Å; F60-L113 HydrophobicContact CE2-CD1 4.03Å; F60-L113 HydrophobicContact CZ-CB 4.48Å; F60-L113 HydrophobicContact CZ-CD1 4.11Å
114	N	79.6	Confident	88.4	Confident	36 Å²	36	50.1 Å²	50.1	19%	0.193	29%	0.286	C	S	.	.			trans	-85.2	141.7	177.5	-85.2	-44.3	0	0	0	113	D112 T120 G292	D112-N114 PolarHBondContact O-N 3.45Å; D112-N114 PolarHBondContact OD1-ND2 3.3Å; D112-N114 VanDerWaalsContact OD1-ND2 3.11Å; N114-T120 PolarHBondContact OD1-N 2.03Å; N114-T120 PolarHBondContact OD1-OG1 3.06Å; N114-G292 PolarHBondContact ND2-O 2.86Å
115	S	72.2	Confident	88.3	Confident	72 Å²	72	53.5 Å²	53.5	50%	0.503	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-126.2	147	168	178.3	0	0	0	0	108.5	H117 N118	S115-H117 PolarHBondContact O-N 3.48Å; S115-N118 CarbonylContact O-C 3.21Å; S115-N118 PolarHBondContact O-N 3.28Å
116	A	67.9	Low	88	Confident	78 Å²	78	54.1 Å²	54.1	65%	0.645	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-22.2	-173.7	0	0	0	0	0	114.4
117	H	69.3	Low	87.5	Confident	185 Å²	185	53.2 Å²	53.2	86%	0.856	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-11.4	-178.9	-58.8	-58.2	0	0	0	114.6	S115	S115-H117 PolarHBondContact O-N 3.48Å
118	N	79.1	Confident	86.7	Confident	125 Å²	125	56.8 Å²	56.8	67%	0.668	31%	0.314	S	S	*	.	B	Isolated β-bridge	trans	-141.6	71.7	-177.7	-167.2	25.3	0	0	0	109.9	S115 T120	S115-N118 CarbonylContact O-C 3.21Å; S115-N118 PolarHBondContact O-N 3.28Å; N118-T120 PolarHBondContact O-N 3.27Å
119	L	81.1	Confident	85.8	Confident	58 Å²	58	56.6 Å²	56.6	30%	0.304	31%	0.31	S	S	.	.			trans	-78.3	114.8	178	-82.4	146.6	0	0	0	109.9
120	T	91.7	Very high	84.7	Confident	33 Å²	33	55.8 Å²	55.8	20%	0.202	31%	0.313	C	S	.	.			trans	-76.8	147.9	160	53.9	0	0	0	0	108	Y109 D112 N114 N118 G292	Y109-T120 HydrophobicContact CD1-CG2 4.22Å; Y109-T120 HydrophobicContact CD2-CG2 4.46Å; Y109-T120 HydrophobicContact CE1-CG2 4.24Å; Y109-T120 HydrophobicContact CE2-CG2 4.44Å; Y109-T120 HydrophobicContact CG-CG2 4.36Å; D112-T120 VanDerWaalsContact CG-OG1 3.26Å; D112-T120 PolarHBondContact OD1-OG1 2.02Å; D112-T120 PolarHBondContact OD2-OG1 3.27Å; N114-T120 PolarHBondContact OD1-N 2.03Å; N114-T120 PolarHBondContact OD1-OG1 3.06Å; N118-T120 PolarHBondContact O-N 3.27Å; T120-G292 WeakPolarHBondContact O-CA 3.05Å
121	C	92.7	Very high	83.4	Confident	24 Å²	24	60.1 Å²	60.1	16%	0.162	34%	0.341	C	S	.	.			trans	-133.4	126.5	-176.3	-54.4	0	0	0	0	110.4	H105 C154 V291	H105-C121 VanDerWaalsContact CB-O 3.31Å; H105-C121 WeakPolarHBondContact CB-O 3.16Å; H105-C121 PolarHBondContact ND1-O 2.88Å; C121-C154 HydrophobicContact CB-CB 3.78Å; C121-C154 WeakPolarHBondContact CB-SG 3.25Å; C121-C154 WeakPolarHBondContact SG-CB 3.37Å; C121-C154 CovalentContact SG-SG 2.03Å; C121-C154 PolarHBondContact SG-SG 2.89Å; C121-V291 WeakPolarHBondContact CA-O 3.04Å
122	W	95.8	Very high	82.7	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	145.8	160.3	163.1	80.8	0	0	0	109.4	V66 S68 L110 V134 L136 F253 A290 V291	V66-W122 HydrophobicContact CB-CZ2 4.41Å; S68-W122 VanDerWaalsContact O-CZ2 3.23Å; S68-W122 WeakPolarHBondContact O-CZ2 3.23Å; S68-W122 PolarHBondContact O-NE1 3.02Å; L110-W122 HydrophobicContact CD1-CB 4.3Å; L110-W122 HydrophobicContact CD1-CD2 4.36Å; L110-W122 HydrophobicContact CD1-CG 4.16Å; L110-W122 HydrophobicContact CD2-CB 3.78Å; L110-W122 HydrophobicContact CD2-CD2 4.31Å; L110-W122 HydrophobicContact CD2-CE3 4.11Å; L110-W122 HydrophobicContact CD2-CG 4.22Å; L110-W122 HydrophobicContact CG-CB 3.72Å; L110-W122 HydrophobicContact CG-CG 4.12Å; W122-V134 HydrophobicContact CH2-CG1 3.76Å; W122-V134 HydrophobicContact CZ2-CG1 4.09Å; W122-L136 HydrophobicContact CD2-CD2 4.38Å; W122-L136 HydrophobicContact CE3-CD2 4.29Å; W122-L136 HydrophobicContact CH2-CD2 3.7Å; W122-L136 HydrophobicContact CZ2-CD2 3.79Å; W122-L136 HydrophobicContact CZ3-CD2 3.97Å; W122-F253 HydrophobicContact CH2-CE2 4.03Å; W122-F253 AromaticContact CZ3-CE2 3.88Å; W122-F253 HydrophobicContact CZ3-CE2 3.88Å; W122-A290 CarbonylContact O-C 3.49Å; W122-A290 WeakPolarHBondContact O-CA 3.5Å; W122-V291 HydrophobicContact CE3-CB 4.02Å; W122-V291 HydrophobicContact CE3-CG2 4.12Å; W122-V291 HydrophobicContact CZ3-CB 4.46Å; W122-V291 HydrophobicContact CZ3-CG2 4.05Å; W122-V291 PolarHBondContact N-O 2.95Å; W122-V291 PolarHBondContact O-N 3Å
123	Q	95.1	Very high	82.7	Confident	9 Å²	9	66.4 Å²	66.4	4%	0.042	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	133	179.9	-167.5	-171.9	-71.7	0	0	111.3	C70 S77 H105 F288 Y289 A290	C70-Q123 PolarHBondContact N-O 2.93Å; S77-Q123 PolarHBondContact OG-NE2 2.87Å; H105-Q123 HydrophobicContact CB-CB 3.73Å; Q123-F288 HydrophobicContact CG-CB 4.5Å; Q123-F288 HydrophobicContact CG-CD2 3.54Å; Q123-F288 HydrophobicContact CG-CE2 4.04Å; Q123-F288 HydrophobicContact CG-CG 4.22Å; Q123-Y289 WeakPolarHBondContact CA-O 3.48Å; Q123-A290 HydrophobicContact CB-CB 4.39Å; Q123-A290 HydrophobicContact CG-CB 4.2Å
124	S	94.8	Very high	83	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-71.4	168.8	172	76.2	0	0	0	0	112	C70 Y289	C70-S124 WeakPolarHBondContact CB-O 3.35Å; S124-Y289 PolarHBondContact N-O 2.83Å; S124-Y289 PolarHBondContact OG-N 3.28Å
125	E	92.1	Very high	83.8	Confident	85 Å²	85	59.5 Å²	59.5	40%	0.397	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-63.2	164	165.9	-65.3	166.3	138.7	0	0	111.5	S68 V69 L127	S68-E125 VanDerWaalsContact OG-CB 3.28Å; S68-E125 WeakPolarHBondContact OG-CB 3.11Å; S68-E125 VanDerWaalsContact OG-CG 3.26Å; S68-E125 WeakPolarHBondContact OG-CG 3.28Å; S68-E125 PolarHBondContact OG-N 3.31Å; S68-E125 PolarHBondContact OG-OE2 2.83Å; V69-E125 VanDerWaalsContact O-CG 3.3Å; V69-E125 WeakPolarHBondContact O-CG 3.33Å; E125-L127 PolarHBondContact O-N 2.8Å
126	N	87.3	Confident	85	Confident	50 Å²	50	56 Å²	56	27%	0.267	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-73.1	118	173.5	-84.2	-11.2	0	0	0	110.2	R76 T286	R76-N126 PolarHBondContact O-ND2 3Å; N126-T286 HydrophobicContact CB-CG2 3.38Å
127	L	85.3	Confident	86.5	Confident	24 Å²	24	53.1 Å²	53.1	13%	0.126	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-104.5	141.9	-179.3	-60.2	169.9	0	0	0	110.2	E125 H132 V134 T286 Y287 Y289	E125-L127 PolarHBondContact O-N 2.8Å; L127-H132 HydrophobicContact CD1-CB 4.28Å; L127-H132 HydrophobicContact CD2-CB 4.46Å; L127-V134 HydrophobicContact CD1-CG2 3.82Å; L127-T286 WeakPolarHBondContact O-CA 3.38Å; L127-Y287 HydrophobicContact CB-CD1 4.26Å; L127-Y287 HydrophobicContact CB-CD2 4.23Å; L127-Y287 HydrophobicContact CB-CE1 3.76Å; L127-Y287 HydrophobicContact CB-CE2 3.76Å; L127-Y287 HydrophobicContact CB-CG 4.48Å; L127-Y287 VanDerWaalsContact CB-CZ 3.49Å; L127-Y287 HydrophobicContact CD1-CD2 4.47Å; L127-Y287 HydrophobicContact CD1-CE2 3.68Å; L127-Y287 HydrophobicContact CG-CE2 4.35Å; L127-Y287 PolarHBondContact N-O 2.91Å; L127-Y287 VanDerWaalsContact O-CD1 3.26Å; L127-Y287 WeakPolarHBondContact O-CD1 3.38Å; L127-Y287 PolarHBondContact O-N 3.46Å; L127-Y289 HydrophobicContact CD1-CD2 4.38Å; L127-Y289 HydrophobicContact CD1-CE2 4.08Å
128	N	79	Confident	87.8	Confident	90 Å²	90	44.3 Å²	44.3	48%	0.481	25%	0.246	S	C	.	.			trans	-121.6	-3.7	-178.1	62.9	2.1	0	0	0	113.5	L284	N128-L284 PolarHBondContact O-N 2.88Å
129	T	74.1	Confident	88.7	Confident	61 Å²	61	41.4 Å²	41.4	37%	0.374	24%	0.236	S	C	.	.	S	Bend	trans	-132.6	151.3	-174.3	29.1	0	0	0	0	108.7	H132 Y287	T129-H132 WeakPolarHBondContact CB-NE2 3.5Å; T129-H132 PolarHBondContact O-CD2 3.04Å; T129-H132 PolarHBondContact OG1-CD2 3.11Å; T129-H132 PolarHBondContact OG1-NE2 3.33Å; T129-Y287 PolarHBondContact O-OH 2.82Å
130	S	71	Confident	89.3	Confident	43 Å²	43	38.8 Å²	38.8	30%	0.301	22%	0.222	S	C	.	.	S	Bend	trans	-148.7	137.1	-179.9	164.7	0	0	0	0	108.4
131	P	67.7	Low	89.3	Confident	91 Å²	91	38.8 Å²	38.8	59%	0.591	23%	0.229	S	C	*	.	S	Bend	cis	-81.4	134	9.9	31.3	-33.5	0	0	0	113.1
132	H	81.4	Confident	89.5	Confident	78 Å²	78	37.7 Å²	37.7	36%	0.361	22%	0.221	S	C	.	.			trans	-127.3	127.5	168.5	-86.7	-43.2	0	0	0	109.6	L127 T129 F253	L127-H132 HydrophobicContact CD1-CB 4.28Å; L127-H132 HydrophobicContact CD2-CB 4.46Å; T129-H132 WeakPolarHBondContact CB-NE2 3.5Å; T129-H132 PolarHBondContact O-CD2 3.04Å; T129-H132 PolarHBondContact OG1-CD2 3.11Å; T129-H132 PolarHBondContact OG1-NE2 3.33Å; H132-F253 VanDerWaalsContact O-O 3.09Å
133	N	90.9	Very high	89.5	Confident	103 Å²	103	40.4 Å²	40.4	55%	0.551	23%	0.233	S	C	*	.			trans	-91.7	109	-175.2	-69	-13.7	0	0	0	110.2	V252 F253	N133-V252 HydrophobicContact CB-CG1 3.92Å; N133-F253 VanDerWaalsContact CA-O 3.32Å; N133-F253 WeakPolarHBondContact CA-O 3.45Å
134	V	94.9	Very high	89.7	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.024	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	126.7	168.8	-178.8	0	0	0	0	108.7	S67 W122 L127 V252 F253 Y289	S67-V134 WeakPolarHBondContact OG-CA 3.19Å; W122-V134 HydrophobicContact CH2-CG1 3.76Å; W122-V134 HydrophobicContact CZ2-CG1 4.09Å; L127-V134 HydrophobicContact CD1-CG2 3.82Å; V134-V252 WeakPolarHBondContact O-CA 3.24Å; V134-F253 HydrophobicContact CB-CB 4.42Å; V134-F253 HydrophobicContact CB-CD2 4.06Å; V134-F253 HydrophobicContact CG1-CD2 4.15Å; V134-F253 PolarHBondContact N-O 3.41Å; V134-F253 PolarHBondContact O-N 2.76Å; V134-Y289 HydrophobicContact CB-CD2 4.13Å; V134-Y289 HydrophobicContact CB-CE2 4.43Å; V134-Y289 HydrophobicContact CG2-CD2 3.94Å; V134-Y289 HydrophobicContact CG2-CE2 4.12Å
135	T	96.9	Very high	89.8	Confident	36 Å²	36	41 Å²	41	22%	0.221	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	135.4	-172.1	68.7	0	0	0	0	112.2	V66 S67 V251 V252	V66-T135 WeakPolarHBondContact CA-O 3.47Å; S67-T135 WeakPolarHBondContact CB-OG1 3.3Å; S67-T135 PolarHBondContact N-O 3.28Å; S67-T135 PolarHBondContact OG-N 2.64Å; T135-V251 CarbonylContact C-O 3.51Å; T135-V251 VanDerWaalsContact CA-O 3.26Å; T135-V251 WeakPolarHBondContact CA-O 3.44Å; T135-V252 HydrophobicContact CG2-CB 4.49Å; T135-V252 HydrophobicContact CG2-CG1 4.2Å; T135-V252 HydrophobicContact CG2-CG2 3.97Å
136	L	97.8	Very high	90	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	122.9	167.1	-49.9	-178.7	0	0	0	107.9	V64 T65 V66 L110 W122 L151 R250 V251 F253	V64-L136 HydrophobicContact CG1-CB 4.11Å; T65-L136 CarbonylContact O-C 3.45Å; V66-L136 HydrophobicContact CB-CD2 4.06Å; V66-L136 HydrophobicContact CG1-CD2 3.4Å; L110-L136 HydrophobicContact CD1-CD1 4.27Å; L110-L136 HydrophobicContact CD1-CD2 4.02Å; L110-L136 HydrophobicContact CD2-CD1 4.28Å; W122-L136 HydrophobicContact CD2-CD2 4.38Å; W122-L136 HydrophobicContact CE3-CD2 4.29Å; W122-L136 HydrophobicContact CH2-CD2 3.7Å; W122-L136 HydrophobicContact CZ2-CD2 3.79Å; W122-L136 HydrophobicContact CZ3-CD2 3.97Å; L136-L151 HydrophobicContact CD1-CD2 4.09Å; L136-R250 CarbonylContact O-C 3.36Å; L136-R250 VanDerWaalsContact O-CA 3.23Å; L136-R250 WeakPolarHBondContact O-CA 3.28Å; L136-V251 HydrophobicContact CB-CB 4.37Å; L136-V251 PolarHBondContact N-O 3.15Å; L136-V251 PolarHBondContact O-N 2.97Å; L136-F253 HydrophobicContact CD1-CE2 3.84Å; L136-F253 HydrophobicContact CD1-CZ 3.59Å; L136-F253 HydrophobicContact CD2-CE2 4.41Å; L136-F253 HydrophobicContact CG-CE2 3.92Å; L136-F253 HydrophobicContact CG-CZ 4.06Å
137	T	97.9	Very high	90.5	Very high	16 Å²	16	37.4 Å²	37.4	10%	0.098	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	120.2	179.1	-60.4	0	0	0	0	110.4	T65 W173 I249 R250	T65-T137 PolarHBondContact N-O 2.92Å; T65-T137 PolarHBondContact O-N 2.88Å; T65-T137 VanDerWaalsContact OG1-CB 3.29Å; T65-T137 WeakPolarHBondContact OG1-CB 3.25Å; T65-T137 PolarHBondContact OG1-O 3.35Å; T137-W173 HydrophobicContact CG2-CH2 3.77Å; T137-W173 HydrophobicContact CG2-CZ2 4.01Å; T137-I249 WeakPolarHBondContact CA-O 3.47Å; T137-R250 WeakPolarHBondContact OG1-CG 3.29Å; T137-R250 PolarHBondContact OG1-NE 2.98Å
138	L	97.4	Very high	91.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	126.1	180	172.1	72.5	0	0	0	110.2	A59 K62 V64 L140 D248 I249 F294 V296	A59-L138 HydrophobicContact CB-CD2 3.51Å; K62-L138 HydrophobicContact CB-CD1 3.56Å; K62-L138 HydrophobicContact CG-CD1 4.31Å; V64-L138 HydrophobicContact CG2-CD1 4.09Å; L138-L140 HydrophobicContact CD2-CD2 3.75Å; L138-L140 HydrophobicContact CG-CD2 4.03Å; L138-D248 CarbonylContact O-C 3.58Å; L138-D248 VanDerWaalsContact O-CA 3.24Å; L138-D248 WeakPolarHBondContact O-CA 3.38Å; L138-I249 PolarHBondContact N-O 3.4Å; L138-I249 PolarHBondContact O-N 3.43Å; L138-F294 HydrophobicContact CB-CE1 3.78Å; L138-F294 HydrophobicContact CB-CZ 4.33Å; L138-F294 HydrophobicContact CD2-CE1 4.12Å; L138-F294 HydrophobicContact CD2-CZ 4.33Å; L138-V296 HydrophobicContact CD2-CB 4.37Å; L138-V296 HydrophobicContact CD2-CG2 3.74Å
139	S	97	Very high	92	Very high	65 Å²	65	35.1 Å²	35.1	46%	0.455	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	117.7	176	-70.7	0	0	0	0	111.7	D248	S139-D248 VanDerWaalsContact CA-OD1 3.26Å; S139-D248 WeakPolarHBondContact CA-OD1 3.32Å; S139-D248 WeakPolarHBondContact CB-OD1 3.06Å; S139-D248 PolarHBondContact OG-OD1 2.89Å
140	L	95	Very high	93	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-25.4	-177	-53.9	176.8	0	0	0	112.2	A58 L138 K142 F144 I146 T247	A58-L140 HydrophobicContact CB-CD2 3.87Å; L138-L140 HydrophobicContact CD2-CD2 3.75Å; L138-L140 HydrophobicContact CG-CD2 4.03Å; L140-K142 PolarHBondContact O-N 3.39Å; L140-F144 HydrophobicContact CB-CD2 3.85Å; L140-F144 HydrophobicContact CB-CE2 3.95Å; L140-F144 HydrophobicContact CD1-CB 4.03Å; L140-F144 HydrophobicContact CD1-CD2 3.76Å; L140-F144 HydrophobicContact CD1-CG 4.03Å; L140-F144 HydrophobicContact CG-CD2 4.39Å; L140-I146 HydrophobicContact CD1-CD1 4.29Å; L140-T247 WeakPolarHBondContact CB-O 3.07Å; L140-T247 WeakPolarHBondContact CG-O 3.07Å; L140-T247 PolarHBondContact N-O 3.2Å
141	G	92.2	Very high	94.1	Very high	33 Å²	33	30.6 Å²	30.6	34%	0.34	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	78.4	-3.4	179	0	0	0	0	0	115.1
142	K	95.2	Very high	95.3	Very high	1 Å²	1	29 Å²	29	0%	0.004	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	160.5	173.5	174.2	173.3	166	57.8	0	109.1	L140 F144 K301 C309 L317 C319 P328 E329	L140-K142 PolarHBondContact O-N 3.39Å; K142-F144 HydrophobicContact CB-CE2 4.19Å; K142-F144 WeakPolarHBondContact O-CD2 3.07Å; K142-K301 PolarHBondContact NZ-O 2.86Å; K142-C309 VanDerWaalsContact CE-SG 3.57Å; K142-L317 HydrophobicContact CB-CB 4.13Å; K142-L317 HydrophobicContact CB-CD2 4.29Å; K142-L317 HydrophobicContact CB-CG 4.48Å; K142-L317 HydrophobicContact CD-CB 4.35Å; K142-L317 HydrophobicContact CD-CD2 4.25Å; K142-L317 HydrophobicContact CD-CG 4.04Å; K142-L317 WeakPolarHBondContact CD-O 3.49Å; K142-C319 WeakPolarHBondContact CE-SG 3.44Å; K142-C319 PolarHBondContact NZ-SG 3.05Å; K142-P328 PolarHBondContact NZ-O 3.39Å; K142-E329 IonicContact NZ-OE1 2.69Å; K142-E329 PolarHBondContact NZ-OE1 3.45Å
143	K	97.6	Very high	95.9	Very high	58 Å²	58	25.3 Å²	25.3	25%	0.252	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	126.4	168.6	-68.8	-177.6	179.6	-176.6	0	111.6	M167 T245 V246 T247 K301 E329	K143-M167 WeakPolarHBondContact CE-O 3.33Å; K143-T245 HydrophobicContact CB-CG2 4.19Å; K143-T245 HydrophobicContact CD-CG2 4.05Å; K143-T245 HydrophobicContact CG-CG2 4.22Å; K143-V246 CarbonylContact C-O 3.55Å; K143-V246 WeakPolarHBondContact CA-O 3.32Å; K143-T247 HydrophobicContact CB-CG2 4.43Å; K143-T247 HydrophobicContact CG-CG2 3.5Å; K143-T247 VanDerWaalsContact CG-CG2 3.5Å; K143-K301 HydrophobicContact CB-CB 4.1Å; K143-K301 HydrophobicContact CB-CD 4.33Å; K143-K301 VanDerWaalsContact O-CB 3.24Å; K143-K301 WeakPolarHBondContact O-CB 3.38Å; K143-K301 PolarHBondContact O-N 3.26Å; K143-E329 HydrophobicContact CB-CG 4.02Å; K143-E329 HydrophobicContact CD-CG 4.13Å
144	F	97.8	Very high	95.9	Very high	6 Å²	6	21.9 Å²	21.9	3%	0.026	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	153.3	172.2	-79.9	-105.3	0	0	0	110.7	I56 A58 L140 K142 I146 T245 V246 R299 C300 L317	I56-F144 HydrophobicContact CD1-CE1 4.03Å; I56-F144 HydrophobicContact CD1-CZ 4.49Å; I56-F144 HydrophobicContact CG1-CE1 4.29Å; A58-F144 HydrophobicContact CB-CD1 3.9Å; A58-F144 HydrophobicContact CB-CE1 3.72Å; A58-F144 HydrophobicContact CB-CG 4.43Å; A58-F144 HydrophobicContact CB-CZ 4.11Å; L140-F144 HydrophobicContact CB-CD2 3.85Å; L140-F144 HydrophobicContact CB-CE2 3.95Å; L140-F144 HydrophobicContact CD1-CB 4.03Å; L140-F144 HydrophobicContact CD1-CD2 3.76Å; L140-F144 HydrophobicContact CD1-CG 4.03Å; L140-F144 HydrophobicContact CG-CD2 4.39Å; K142-F144 HydrophobicContact CB-CE2 4.19Å; K142-F144 WeakPolarHBondContact O-CD2 3.07Å; F144-I146 HydrophobicContact CB-CD1 3.57Å; F144-I146 HydrophobicContact CB-CG1 4.25Å; F144-I146 HydrophobicContact CG-CD1 4.39Å; F144-T245 CarbonylContact O-C 3.52Å; F144-T245 VanDerWaalsContact O-CA 3.28Å; F144-T245 WeakPolarHBondContact O-CA 3.3Å; F144-V246 PolarHBondContact N-O 3.01Å; F144-V246 PolarHBondContact O-N 3.37Å; F144-R299 CarbonylContact C-O 3.24Å; F144-R299 WeakPolarHBondContact CA-O 3.35Å; F144-R299 VanDerWaalsContact CD1-C 3.41Å; F144-R299 WeakPolarHBondContact CD1-O 3.33Å; F144-C300 HydrophobicContact CE1-CB 4.37Å; F144-C300 WeakPolarHBondContact CE1-SG 3.44Å; F144-C300 WeakPolarHBondContact CZ-SG 3.4Å; F144-L317 HydrophobicContact CE2-CD2 4.17Å; F144-L317 HydrophobicContact CZ-CD2 3.92Å
145	E	97.4	Very high	95.6	Very high	15 Å²	15	21.9 Å²	21.9	7%	0.07	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	103	163.9	-62.2	-173.1	158.1	0	0	107.5	V244 G298 R299 K301 R344	E145-V244 WeakPolarHBondContact CA-O 3.02Å; E145-V244 HydrophobicContact CB-CG2 3.9Å; E145-V244 HydrophobicContact CG-CG2 4.13Å; E145-G298 VanDerWaalsContact O-CA 3.24Å; E145-G298 WeakPolarHBondContact O-CA 3.35Å; E145-R299 HydrophobicContact CB-CG 4.3Å; E145-R299 PolarHBondContact N-O 2.94Å; E145-R299 PolarHBondContact O-N 3.4Å; E145-K301 HydrophobicContact CG-CB 3.94Å; E145-K301 HydrophobicContact CG-CD 4.23Å; E145-K301 HydrophobicContact CG-CG 3.93Å; E145-R344 IonicContact OE1-CZ 3.01Å; E145-R344 IonicContact OE1-NH1 3.53Å; E145-R344 PolarHBondContact OE1-NH1 3.03Å; E145-R344 IonicContact OE1-NH2 2.8Å; E145-R344 PolarHBondContact OE1-NH2 3.45Å; E145-R344 IonicContact OE2-NH2 3.9Å; E145-R344 PolarHBondContact OE2-NH2 2.84Å
146	I	97.3	Very high	95.1	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	129.8	-174.3	-59.4	-52.1	0	0	0	110	L140 F144 Y148 V149 T224 V244 V246 V296	L140-I146 HydrophobicContact CD1-CD1 4.29Å; F144-I146 HydrophobicContact CB-CD1 3.57Å; F144-I146 HydrophobicContact CB-CG1 4.25Å; F144-I146 HydrophobicContact CG-CD1 4.39Å; I146-Y148 WeakPolarHBondContact CG2-O 3.42Å; I146-V149 HydrophobicContact CG2-CG2 3.97Å; I146-T224 HydrophobicContact CB-CG2 4.45Å; I146-T224 HydrophobicContact CG2-CG2 4.07Å; I146-T224 WeakPolarHBondContact O-CG2 3.42Å; I146-T224 PolarHBondContact O-OG1 3.28Å; I146-V244 PolarHBondContact N-O 2.71Å; I146-V244 WeakPolarHBondContact O-CB 3.46Å; I146-V246 HydrophobicContact CB-CG2 4.17Å; I146-V246 HydrophobicContact CG1-CB 3.79Å; I146-V246 HydrophobicContact CG1-CG2 3.7Å; I146-V296 HydrophobicContact CD1-CG1 3.42Å; I146-V296 VanDerWaalsContact CD1-CG1 3.42Å; I146-V296 HydrophobicContact CG1-CG1 4.09Å; I146-V296 HydrophobicContact CG2-CG1 4.23Å
147	T	96.9	Very high	94.8	Very high	59 Å²	59	23.1 Å²	23.1	36%	0.362	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-41.3	175.1	-56.9	0	0	0	0	110.8	T224 G297	T147-T224 PolarHBondContact O-N 2.86Å; T147-T224 PolarHBondContact O-OG1 2.85Å; T147-G297 PolarHBondContact N-O 2.95Å
148	Y	97.1	Very high	94.5	Very high	65 Å²	65	22.6 Å²	22.6	26%	0.255	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	159.6	176	69.4	-98.7	0	0	0	113.2	F55 I146 F222 Q295 G297	F55-Y148 HydrophobicContact CE1-CE1 4.02Å; F55-Y148 HydrophobicContact CZ-CD1 4.15Å; F55-Y148 AromaticContact CZ-CE1 3.61Å; F55-Y148 HydrophobicContact CZ-CE1 3.61Å; I146-Y148 WeakPolarHBondContact CG2-O 3.42Å; Y148-F222 CarbonylContact C-O 3.54Å; Y148-F222 WeakPolarHBondContact CA-O 3.32Å; Y148-F222 WeakPolarHBondContact CB-O 3.24Å; Y148-Q295 HydrophobicContact CE2-CB 4.17Å; Y148-Q295 PolarHBondContact OH-OE1 2.85Å; Y148-G297 PolarHBondContact N-O 3.38Å; Y148-G297 VanDerWaalsContact N-O 3.14Å; Y148-G297 PolarHBondContact O-N 3.21Å
149	V	97.5	Very high	94.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	124.8	167.7	-176.1	0	0	0	0	107.2	I146 L151 I163 F222 I249 F294 Q295 V296	I146-V149 HydrophobicContact CG2-CG2 3.97Å; V149-L151 HydrophobicContact CG1-CD1 4.43Å; V149-I163 HydrophobicContact CG1-CD1 4.41Å; V149-F222 HydrophobicContact CB-CB 4.48Å; V149-F222 HydrophobicContact CB-CD1 4.22Å; V149-F222 HydrophobicContact CG2-CD1 4.15Å; V149-F222 PolarHBondContact N-O 2.81Å; V149-F222 PolarHBondContact O-N 2.9Å; V149-I249 HydrophobicContact CG1-CG2 4.42Å; V149-I249 HydrophobicContact CG2-CD1 3.72Å; V149-F294 HydrophobicContact CG1-CE2 3.72Å; V149-Q295 WeakPolarHBondContact CA-O 3.26Å; V149-V296 HydrophobicContact CG1-CG2 4.38Å
150	S	95.8	Very high	93.9	Very high	10 Å²	10	20 Å²	20	7%	0.07	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	144.5	179.1	55.9	0	0	0	0	112.5	I220 Q295	S150-I220 CarbonylContact C-O 3.53Å; S150-I220 WeakPolarHBondContact CA-O 3.39Å; S150-Q295 PolarHBondContact N-O 3.12Å; S150-Q295 PolarHBondContact O-N 3.45Å; S150-Q295 WeakPolarHBondContact OG-CB 3.37Å
151	L	94.9	Very high	93.9	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	124.3	173.8	-63.6	95.6	0	0	0	108.8	L136 V149 F153 I220 V251 F253 V291 D293 F294	L136-L151 HydrophobicContact CD1-CD2 4.09Å; V149-L151 HydrophobicContact CG1-CD1 4.43Å; L151-F153 HydrophobicContact CB-CD2 4.31Å; L151-F153 HydrophobicContact CB-CE2 3.62Å; L151-F153 HydrophobicContact CB-CZ 4.05Å; L151-F153 HydrophobicContact CD2-CZ 4.38Å; L151-I220 PolarHBondContact N-O 3.32Å; L151-I220 PolarHBondContact O-N 2.83Å; L151-V251 HydrophobicContact CD1-CG1 4.47Å; L151-V251 HydrophobicContact CD1-CG2 4.26Å; L151-V251 HydrophobicContact CD2-CG1 4.12Å; L151-V251 HydrophobicContact CD2-CG2 4.36Å; L151-F253 HydrophobicContact CD2-CE1 4.24Å; L151-F253 HydrophobicContact CD2-CZ 4.05Å; L151-V291 HydrophobicContact CB-CG1 4.35Å; L151-V291 HydrophobicContact CD2-CG1 4.29Å; L151-V291 HydrophobicContact CD2-CG2 4.48Å; L151-D293 CarbonylContact C-O 3.54Å; L151-D293 VanDerWaalsContact CA-O 3.31Å; L151-D293 WeakPolarHBondContact CA-O 3.46Å; L151-F294 HydrophobicContact CD1-CD2 4.44Å; L151-F294 HydrophobicContact CD2-CD2 4.37Å; L151-F294 HydrophobicContact CG-CD2 3.98Å; L151-F294 HydrophobicContact CG-CE2 4.48Å
152	Q	93.4	Very high	94	Very high	57 Å²	57	18.4 Å²	18.4	27%	0.266	9%	0.094	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	120	171.2	-173.9	171.6	4.9	0	0	108.9	L219 V291 G292 D293	Q152-L219 HydrophobicContact CB-CD1 4.44Å; Q152-V291 CarbonylContact O-C 3.16Å; Q152-V291 WeakPolarHBondContact O-CG1 3.35Å; Q152-G292 PolarHBondContact O-N 3.44Å; Q152-D293 HydrophobicContact CB-CB 4.13Å; Q152-D293 PolarHBondContact N-O 3.19Å; Q152-D293 PolarHBondContact O-N 2.63Å
153	F	92.4	Very high	94.1	Very high	1 Å²	1	18.4 Å²	18.4	0%	0.004	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	141.5	-174.1	-69.1	-99.5	0	0	0	112	L151 S155 R157 P158 L161 G217 G218 I220 F253 A290 V291	L151-F153 HydrophobicContact CB-CD2 4.31Å; L151-F153 HydrophobicContact CB-CE2 3.62Å; L151-F153 HydrophobicContact CB-CZ 4.05Å; L151-F153 HydrophobicContact CD2-CZ 4.38Å; F153-S155 VanDerWaalsContact CB-O 3.22Å; F153-S155 WeakPolarHBondContact CB-O 3.42Å; F153-R157 HydrophobicContact CD2-CG 3.99Å; F153-R157 HydrophobicContact CG-CG 4.33Å; F153-P158 VanDerWaalsContact CE1-CD 3.42Å; F153-P158 HydrophobicContact CE1-CG 3.83Å; F153-P158 HydrophobicContact CZ-CG 4.1Å; F153-L161 HydrophobicContact CZ-CD1 4.08Å; F153-G217 VanDerWaalsContact O-CA 3.24Å; F153-G217 WeakPolarHBondContact O-CA 3.43Å; F153-G217 PolarHBondContact O-N 2.04Å; F153-G218 WeakPolarHBondContact CD2-O 3.15Å; F153-G218 PolarHBondContact N-O 3.37Å; F153-I220 HydrophobicContact CD2-CD1 4.48Å; F153-I220 HydrophobicContact CD2-CG1 4.41Å; F153-I220 HydrophobicContact CE2-CB 4.15Å; F153-I220 HydrophobicContact CE2-CD1 3.6Å; F153-I220 HydrophobicContact CE2-CG1 3.8Å; F153-I220 HydrophobicContact CZ-CD1 4.03Å; F153-F253 HydrophobicContact CE1-CE1 4.03Å; F153-F253 HydrophobicContact CE1-CZ 4.15Å; F153-F253 AromaticContact CZ-CE1 3.95Å; F153-F253 HydrophobicContact CZ-CE1 3.95Å; F153-F253 HydrophobicContact CZ-CZ 4.36Å; F153-A290 WeakPolarHBondContact CA-O 3.24Å; F153-V291 HydrophobicContact CD1-CG2 3.72Å; F153-V291 HydrophobicContact CE1-CG2 3.62Å; F153-V291 HydrophobicContact CG-CG2 4.45Å; F153-V291 HydrophobicContact CZ-CG2 4.3Å
154	C	90.6	Very high	94.2	Very high	30 Å²	30	18.6 Å²	18.6	20%	0.203	9%	0.094	C	C	.	.	S	Bend	trans	-95	-20.1	168.2	-52.4	0	0	0	0	111.9	C121 S216 A290 G292	C121-C154 HydrophobicContact CB-CB 3.78Å; C121-C154 WeakPolarHBondContact CB-SG 3.25Å; C121-C154 WeakPolarHBondContact SG-CB 3.37Å; C121-C154 CovalentContact SG-SG 2.03Å; C121-C154 PolarHBondContact SG-SG 2.89Å; C154-S216 PolarHBondContact O-OG 2.89Å; C154-A290 HydrophobicContact CB-CB 3.94Å; C154-A290 PolarHBondContact N-O 3Å; C154-G292 VanDerWaalsContact SG-CA 3.5Å; C154-G292 PolarHBondContact SG-N 3.45Å; C154-G292 VanDerWaalsContact SG-N 3.44Å
155	S	88.9	Confident	94.2	Very high	4 Å²	4	18.3 Å²	18.3	3%	0.028	9%	0.093	C	C	.	.	S	Bend	trans	-94	173.4	166.2	67.8	0	0	0	0	110.5	F153 L215 A290	F153-S155 VanDerWaalsContact CB-O 3.22Å; F153-S155 WeakPolarHBondContact CB-O 3.42Å; S155-L215 CarbonylContact C-O 3.59Å; S155-A290 PolarHBondContact N-O 3.47Å; S155-A290 PolarHBondContact OG-N 3.49Å; S155-A290 PolarHBondContact OG-O 3.02Å
156	P	87.9	Confident	94.2	Very high	41 Å²	41	17.6 Å²	17.6	27%	0.266	9%	0.09	S	C	.	.	P	Polyproline II helix	trans	-55.8	147.4	163.4	-24.6	34.7	0	0	0	110.4	L215	P156-L215 VanDerWaalsContact CD-O 3.26Å; P156-L215 WeakPolarHBondContact CD-O 3.32Å; P156-L215 HydrophobicContact CG-CB 4.5Å; P156-L215 HydrophobicContact CG-CD2 4.19Å
157	R	90.7	Very high	94.2	Very high	22 Å²	22	20 Å²	20	8%	0.083	10%	0.101	C	C	.	.	P	Polyproline II helix	trans	-61.5	148.1	177	-68.1	176	-65.2	-171.7	3.4	110.2	F153 H209 E211 Y213 L219 I220 Q257	F153-R157 HydrophobicContact CD2-CG 3.99Å; F153-R157 HydrophobicContact CG-CG 4.33Å; R157-H209 PolarHBondContact NE-O 3.42Å; R157-E211 PolarHBondContact NE-O 3.22Å; R157-E211 PolarHBondContact NH2-O 2.98Å; R157-Y213 PolarHBondContact NH2-O 2.79Å; R157-L219 PolarHBondContact NH1-O 2.74Å; R157-I220 HydrophobicContact CB-CD1 4.27Å; R157-I220 HydrophobicContact CG-CD1 4.28Å; R157-I220 HydrophobicContact CG-CG1 4.17Å; R157-Q257 WeakPolarHBondContact O-CG 3.42Å
158	P	90.9	Very high	94.2	Very high	4 Å²	4	19.4 Å²	19.4	3%	0.026	10%	0.096	C	C	.	.	P	Polyproline II helix	trans	-60.9	151.6	172.8	-21.6	32.6	0	0	0	112.1	F153 L161 F253 Y289	F153-P158 VanDerWaalsContact CE1-CD 3.42Å; F153-P158 HydrophobicContact CE1-CG 3.83Å; F153-P158 HydrophobicContact CZ-CG 4.1Å; P158-L161 HydrophobicContact CB-CB 4.38Å; P158-L161 HydrophobicContact CG-CD1 4.29Å; P158-F253 HydrophobicContact CG-CB 4.42Å; P158-F253 HydrophobicContact CG-CD1 3.81Å; P158-F253 HydrophobicContact CG-CE1 4.38Å; P158-F253 HydrophobicContact CG-CG 4.26Å; P158-Y289 HydrophobicContact CB-CE1 3.88Å; P158-Y289 HydrophobicContact CG-CD1 3.9Å; P158-Y289 HydrophobicContact CG-CE1 3.77Å
159	E	90.3	Very high	94.1	Very high	12 Å²	12	20.6 Å²	20.6	6%	0.056	10%	0.1	C	C	.	.	S	Bend	trans	-74.5	-41.8	170.4	-174.8	-77.9	146.6	0	0	110.7	S180 S181 T210 R255 P256 Q257	E159-S180 WeakPolarHBondContact O-CA 3.37Å; E159-S181 WeakPolarHBondContact OE1-CA 3.47Å; E159-S181 WeakPolarHBondContact OE1-CB 3.25Å; E159-S181 PolarHBondContact OE1-N 3.31Å; E159-S181 PolarHBondContact OE1-OG 2.87Å; E159-T210 VanDerWaalsContact O-CG2 3.25Å; E159-T210 WeakPolarHBondContact O-CG2 3.49Å; E159-R255 HydrophobicContact CB-CB 4.43Å; E159-R255 HydrophobicContact CB-CG 4.47Å; E159-R255 PolarHBondContact N-O 3.42Å; E159-R255 VanDerWaalsContact OE2-CD 3.28Å; E159-R255 WeakPolarHBondContact OE2-CD 3.35Å; E159-R255 IonicContact OE2-NE 2.7Å; E159-R255 IonicContact OE2-NH1 2.93Å; E159-P256 WeakPolarHBondContact CB-O 3.41Å; E159-Q257 HydrophobicContact CB-CG 4.1Å
160	S	92.6	Very high	94	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	123.4	176.5	-70.6	0	0	0	0	110.7	Y179 S180 S254 R255	S160-Y179 CarbonylContact C-O 3.46Å; S160-Y179 VanDerWaalsContact CA-O 3.27Å; S160-Y179 WeakPolarHBondContact CA-O 3.29Å; S160-S180 WeakPolarHBondContact OG-CB 3.47Å; S160-S180 PolarHBondContact OG-OG 2.98Å; S160-S254 PolarHBondContact O-N 3.44Å; S160-R255 PolarHBondContact N-O 3.17Å; S160-R255 PolarHBondContact O-N 2.02Å
161	L	93.9	Very high	94	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	144.2	179.3	178.5	155.5	0	0	0	110	F153 P158 I163 Y179 Y187 I220 V251 V252 F253	F153-L161 HydrophobicContact CZ-CD1 4.08Å; P158-L161 HydrophobicContact CB-CB 4.38Å; P158-L161 HydrophobicContact CG-CD1 4.29Å; L161-I163 HydrophobicContact CD2-CD1 4.28Å; L161-I163 HydrophobicContact CD2-CG1 3.63Å; L161-Y179 HydrophobicContact CD2-CD2 3.76Å; L161-Y179 HydrophobicContact CD2-CE2 4.35Å; L161-Y179 PolarHBondContact N-O 3.09Å; L161-Y179 PolarHBondContact O-N 3.21Å; L161-Y179 VanDerWaalsContact O-O 3.14Å; L161-Y187 VanDerWaalsContact C-OH 3.28Å; L161-Y187 PolarHBondContact N-OH 3.4Å; L161-Y187 PolarHBondContact O-OH 3.2Å; L161-I220 HydrophobicContact CD1-CD1 3.99Å; L161-V251 HydrophobicContact CD1-CG1 3.91Å; L161-V251 HydrophobicContact CD2-CG1 4.08Å; L161-V251 HydrophobicContact CG-CG1 3.99Å; L161-V252 CarbonylContact C-O 3.54Å; L161-V252 WeakPolarHBondContact CA-O 3.23Å; L161-F253 HydrophobicContact CD1-CD1 3.59Å; L161-F253 HydrophobicContact CD1-CE1 3.49Å; L161-F253 VanDerWaalsContact CD1-CE1 3.49Å; L161-F253 HydrophobicContact CG-CD1 4.03Å; L161-F253 HydrophobicContact CG-CE1 4.29Å
162	A	95.8	Very high	94.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	135.9	173.9	0	0	0	0	0	110.9	Y164 F178 Y187 V251 V252	A162-Y164 HydrophobicContact CB-CD2 4.26Å; A162-Y164 HydrophobicContact CB-CE2 3.49Å; A162-Y164 VanDerWaalsContact CB-CE2 3.49Å; A162-F178 HydrophobicContact CB-CD1 3.54Å; A162-F178 HydrophobicContact CB-CE1 3.66Å; A162-Y187 HydrophobicContact CB-CE1 4.1Å; A162-V251 CarbonylContact O-C 3.59Å; A162-V251 WeakPolarHBondContact O-CA 3.32Å; A162-V252 HydrophobicContact CB-CB 4.46Å; A162-V252 PolarHBondContact N-O 3.44Å; A162-V252 PolarHBondContact O-N 3.03Å
163	I	97.5	Very high	94.3	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	128.5	171.7	-52	-179.6	0	0	0	107.3	V149 L161 Y176 Q177 Y179 F222 I249 R250	V149-I163 HydrophobicContact CG1-CD1 4.41Å; L161-I163 HydrophobicContact CD2-CD1 4.28Å; L161-I163 HydrophobicContact CD2-CG1 3.63Å; I163-Y176 HydrophobicContact CG2-CD1 4.31Å; I163-Y176 WeakPolarHBondContact O-CA 3.21Å; I163-Y176 VanDerWaalsContact O-CB 3.27Å; I163-Y176 WeakPolarHBondContact O-CB 3.41Å; I163-Y176 PolarHBondContact O-N 2.92Å; I163-Q177 HydrophobicContact CB-CB 4.27Å; I163-Q177 HydrophobicContact CD1-CB 4.32Å; I163-Q177 HydrophobicContact CG1-CB 4.48Å; I163-Q177 PolarHBondContact N-O 3.24Å; I163-Q177 PolarHBondContact O-N 3.26Å; I163-Q177 VanDerWaalsContact O-N 3.12Å; I163-Y179 HydrophobicContact CD1-CE2 4.3Å; I163-F222 HydrophobicContact CD1-CB 3.87Å; I163-F222 HydrophobicContact CD1-CD1 4.24Å; I163-F222 HydrophobicContact CD1-CG 4.29Å; I163-I249 HydrophobicContact CG2-CG2 4.14Å; I163-R250 CarbonylContact C-O 3.48Å
164	Y	98.1	Very high	94.6	Very high	62 Å²	62	36.4 Å²	36.4	24%	0.243	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	153.2	174	-62	-93.7	0	0	0	109.4	A162 M174 P175 R250 V252	A162-Y164 HydrophobicContact CB-CD2 4.26Å; A162-Y164 HydrophobicContact CB-CE2 3.49Å; A162-Y164 VanDerWaalsContact CB-CE2 3.49Å; Y164-M174 CarbonylContact C-O 3.59Å; Y164-M174 VanDerWaalsContact CA-O 3.3Å; Y164-M174 WeakPolarHBondContact CA-O 3.34Å; Y164-P175 HydrophobicContact CD1-CB 4.36Å; Y164-P175 HydrophobicContact CE1-CB 4.27Å; Y164-R250 PolarHBondContact N-O 3.43Å; Y164-R250 PolarHBondContact O-N 2.95Å; Y164-V252 HydrophobicContact CD2-CG2 3.9Å; Y164-V252 HydrophobicContact CE2-CB 4.33Å; Y164-V252 HydrophobicContact CE2-CG2 3.78Å
165	K	97.9	Very high	94.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	157.4	171.3	63.3	165.1	-176.2	157.2	0	111.2	M174 Y176 D242 W243 T245 V246 D248	K165-M174 HydrophobicContact CD-CG 4.29Å; K165-M174 HydrophobicContact CD-SD 4.3Å; K165-M174 VanDerWaalsContact CE-CE 3.5Å; K165-M174 WeakPolarHBondContact CE-SD 3.3Å; K165-M174 HydrophobicContact CG-CG 3.54Å; K165-M174 HydrophobicContact CG-SD 4.18Å; K165-M174 PolarHBondContact N-O 2.75Å; K165-M174 WeakPolarHBondContact O-CG 3.17Å; K165-M174 PolarHBondContact O-N 2.9Å; K165-Y176 HydrophobicContact CB-CD1 3.64Å; K165-Y176 HydrophobicContact CB-CE1 4.01Å; K165-Y176 HydrophobicContact CB-CG 4.15Å; K165-Y176 HydrophobicContact CD-CD1 3.93Å; K165-Y176 HydrophobicContact CD-CD2 4.04Å; K165-Y176 HydrophobicContact CD-CE1 3.79Å; K165-Y176 HydrophobicContact CD-CE2 3.87Å; K165-Y176 HydrophobicContact CD-CG 4.04Å; K165-Y176 HydrophobicContact CG-CD1 3.88Å; K165-Y176 HydrophobicContact CG-CD2 4.35Å; K165-Y176 HydrophobicContact CG-CE1 4.23Å; K165-Y176 HydrophobicContact CG-CG 3.93Å; K165-D242 PolarHBondContact NZ-O 2.89Å; K165-W243 PolarHBondContact NZ-O 2.94Å; K165-T245 PolarHBondContact NZ-O 2.92Å; K165-T245 VanDerWaalsContact NZ-O 3.17Å; K165-V246 HydrophobicContact CB-CG1 3.99Å; K165-V246 HydrophobicContact CB-CG2 4.14Å; K165-V246 HydrophobicContact CD-CG2 3.81Å; K165-D248 CarbonylContact C-O 3.56Å; K165-D248 WeakPolarHBondContact CA-O 3.36Å
166	S	98.1	Very high	95.2	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.007	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	151	165.1	-178.7	0	0	0	0	109.6	D168 G170 T172 V246 T247 D248	S166-D168 PolarHBondContact OG-N 3.44Å; S166-D168 PolarHBondContact OG-OD1 2.86Å; S166-G170 WeakPolarHBondContact OG-CA 3.5Å; S166-G170 PolarHBondContact OG-N 3.11Å; S166-T172 WeakPolarHBondContact CA-O 3.13Å; S166-T172 WeakPolarHBondContact CB-O 3.49Å; S166-T172 PolarHBondContact OG-O 2.75Å; S166-V246 WeakPolarHBondContact O-CA 3.12Å; S166-T247 PolarHBondContact O-N 2.87Å; S166-T247 PolarHBondContact O-OG1 3.45Å; S166-D248 PolarHBondContact N-O 2.99Å
167	M	96.7	Very high	95.6	Very high	50 Å²	50	35.4 Å²	35.4	25%	0.246	17%	0.174	C	C	.	.	S	Bend	trans	-118.9	1.3	173.8	-57.2	-169.3	-61.1	0	0	112.3	K143 M174 T245	K143-M167 WeakPolarHBondContact CE-O 3.33Å; M167-M174 HydrophobicContact CE-SD 3.66Å; M167-M174 HydrophobicContact CG-SD 4.28Å; M167-M174 HydrophobicContact SD-SD 4.08Å; M167-T245 WeakPolarHBondContact CG-O 3Å
168	D	96.3	Very high	95.8	Very high	47 Å²	47	34.9 Å²	34.9	25%	0.251	17%	0.172	S	C	.	.	S	Bend	trans	-132.5	29.8	-169.9	65.7	-1.2	0	0	0	113.1	S166 K171 T172 T247	S166-D168 PolarHBondContact OG-N 3.44Å; S166-D168 PolarHBondContact OG-OD1 2.86Å; D168-K171 PolarHBondContact OD1-N 3.13Å; D168-T172 PolarHBondContact OD1-N 2.79Å; D168-T172 PolarHBondContact OD1-OG1 2.89Å; D168-T172 WeakPolarHBondContact OD2-CB 3.41Å; D168-T172 VanDerWaalsContact OD2-CG2 3.3Å; D168-T172 WeakPolarHBondContact OD2-CG2 3.03Å; D168-T172 PolarHBondContact OD2-N 2.89Å; D168-T172 PolarHBondContact OD2-OG1 2.81Å; D168-T247 PolarHBondContact N-OG1 3.35Å
169	Y	96.1	Very high	96	Very high	90 Å²	90	35.3 Å²	35.3	35%	0.353	17%	0.173	S	C	.	.	S	Bend	trans	66.6	44.5	176.2	-53.2	-89.2	0	0	0	113.2	T247 D248	Y169-T247 HydrophobicContact CD1-CG2 4.18Å; Y169-T247 HydrophobicContact CD2-CG2 4.48Å; Y169-T247 HydrophobicContact CE1-CG2 4.13Å; Y169-T247 HydrophobicContact CE2-CG2 4.41Å; Y169-T247 HydrophobicContact CG-CG2 4.37Å; Y169-T247 PolarHBondContact N-OG1 3.14Å; Y169-D248 VanDerWaalsContact C-OD2 3.27Å; Y169-D248 WeakPolarHBondContact CA-OD2 3.43Å
170	G	95.2	Very high	96.1	Very high	27 Å²	27	34.8 Å²	34.8	28%	0.278	17%	0.17	S	C	.	.	S	Bend	trans	84.9	5.3	172.3	0	0	0	0	0	115.6	S166 W173 D248	S166-G170 WeakPolarHBondContact OG-CA 3.5Å; S166-G170 PolarHBondContact OG-N 3.11Å; G170-W173 PolarHBondContact O-NE1 3.38Å; G170-D248 PolarHBondContact N-OD2 2.83Å
171	K	96.3	Very high	95.9	Very high	173 Å²	173	37.6 Å²	37.6	75%	0.752	19%	0.19	S	C	*	.	S	Bend	trans	-77.4	-44.9	-178.5	-62.5	177.5	-178.7	-178.2	0	111.9	D168	D168-K171 PolarHBondContact OD1-N 3.13Å
172	T	97.6	Very high	95.7	Very high	84 Å²	84	41 Å²	41	52%	0.515	21%	0.206	S	C	.	.	S	Bend	trans	-118.7	147.8	174.5	64.5	0	0	0	0	110.7	S166 D168	S166-T172 WeakPolarHBondContact CA-O 3.13Å; S166-T172 WeakPolarHBondContact CB-O 3.49Å; S166-T172 PolarHBondContact OG-O 2.75Å; D168-T172 PolarHBondContact OD1-N 2.79Å; D168-T172 PolarHBondContact OD1-OG1 2.89Å; D168-T172 WeakPolarHBondContact OD2-CB 3.41Å; D168-T172 VanDerWaalsContact OD2-CG2 3.3Å; D168-T172 WeakPolarHBondContact OD2-CG2 3.03Å; D168-T172 PolarHBondContact OD2-N 2.89Å; D168-T172 PolarHBondContact OD2-OG1 2.81Å
173	W	97.4	Very high	95.5	Very high	65 Å²	65	41.1 Å²	41.1	25%	0.246	21%	0.207	C	C	.	.			trans	-125.1	125.4	-177.8	-68	88.9	0	0	0	109	T137 G170 D248 R250	T137-W173 HydrophobicContact CG2-CH2 3.77Å; T137-W173 HydrophobicContact CG2-CZ2 4.01Å; G170-W173 PolarHBondContact O-NE1 3.38Å; W173-D248 HydrophobicContact CH2-CB 3.65Å; W173-D248 HydrophobicContact CZ2-CB 4.35Å; W173-D248 HydrophobicContact CZ3-CB 4.26Å; W173-R250 VanDerWaalsContact CE2-CZ 3.4Å; W173-R250 HydrophobicContact CE3-CB 3.71Å; W173-R250 HydrophobicContact CH2-CB 3.69Å; W173-R250 HydrophobicContact CZ2-CB 4.5Å; W173-R250 VanDerWaalsContact CZ2-NH2 3.33Å; W173-R250 HydrophobicContact CZ3-CB 3.26Å; W173-R250 VanDerWaalsContact NE1-NH2 3.16Å
174	M	97	Very high	95.3	Very high	51 Å²	51	49.1 Å²	49.1	25%	0.251	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	145.3	176.9	62.4	-173.7	-72.5	0	0	110.1	Y164 K165 M167 W243	Y164-M174 CarbonylContact C-O 3.59Å; Y164-M174 VanDerWaalsContact CA-O 3.3Å; Y164-M174 WeakPolarHBondContact CA-O 3.34Å; K165-M174 HydrophobicContact CD-CG 4.29Å; K165-M174 HydrophobicContact CD-SD 4.3Å; K165-M174 VanDerWaalsContact CE-CE 3.5Å; K165-M174 WeakPolarHBondContact CE-SD 3.3Å; K165-M174 HydrophobicContact CG-CG 3.54Å; K165-M174 HydrophobicContact CG-SD 4.18Å; K165-M174 PolarHBondContact N-O 2.75Å; K165-M174 WeakPolarHBondContact O-CG 3.17Å; K165-M174 PolarHBondContact O-N 2.9Å; M167-M174 HydrophobicContact CE-SD 3.66Å; M167-M174 HydrophobicContact CG-SD 4.28Å; M167-M174 HydrophobicContact SD-SD 4.08Å; M174-W243 HydrophobicContact CE-CZ3 4.36Å
175	P	97	Very high	95	Very high	41 Å²	41	56.2 Å²	56.2	27%	0.266	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	140.7	179.1	29	-35.6	0	0	0	110.4	Y164 F178 A203	Y164-P175 HydrophobicContact CD1-CB 4.36Å; Y164-P175 HydrophobicContact CE1-CB 4.27Å; P175-F178 HydrophobicContact CB-CE2 3.51Å; P175-F178 HydrophobicContact CB-CZ 3.46Å; P175-F178 VanDerWaalsContact CB-CZ 3.46Å; P175-F178 HydrophobicContact CG-CE2 4.49Å; P175-A203 HydrophobicContact CB-CB 3.82Å; P175-A203 HydrophobicContact CG-CB 4.19Å
176	Y	96.3	Very high	94.7	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	-48.7	-178.8	-148.6	178.5	0	0	0	111.8	I163 K165 A203 F222 T224 W243 V246	I163-Y176 HydrophobicContact CG2-CD1 4.31Å; I163-Y176 WeakPolarHBondContact O-CA 3.21Å; I163-Y176 VanDerWaalsContact O-CB 3.27Å; I163-Y176 WeakPolarHBondContact O-CB 3.41Å; I163-Y176 PolarHBondContact O-N 2.92Å; K165-Y176 HydrophobicContact CB-CD1 3.64Å; K165-Y176 HydrophobicContact CB-CE1 4.01Å; K165-Y176 HydrophobicContact CB-CG 4.15Å; K165-Y176 HydrophobicContact CD-CD1 3.93Å; K165-Y176 HydrophobicContact CD-CD2 4.04Å; K165-Y176 HydrophobicContact CD-CE1 3.79Å; K165-Y176 HydrophobicContact CD-CE2 3.87Å; K165-Y176 HydrophobicContact CD-CG 4.04Å; K165-Y176 HydrophobicContact CG-CD1 3.88Å; K165-Y176 HydrophobicContact CG-CD2 4.35Å; K165-Y176 HydrophobicContact CG-CE1 4.23Å; K165-Y176 HydrophobicContact CG-CG 3.93Å; Y176-A203 WeakPolarHBondContact O-CB 3.43Å; Y176-F222 AromaticContact CD1-CE1 3.74Å; Y176-F222 HydrophobicContact CD1-CE1 3.74Å; Y176-F222 AromaticContact CD2-CE1 3.6Å; Y176-F222 HydrophobicContact CD2-CE1 3.6Å; Y176-F222 AromaticContact CD2-CZ 3.64Å; Y176-F222 HydrophobicContact CD2-CZ 3.64Å; Y176-F222 AromaticContact CE1-CE1 3.91Å; Y176-F222 HydrophobicContact CE1-CE1 3.91Å; Y176-F222 AromaticContact CE2-CE1 3.82Å; Y176-F222 HydrophobicContact CE2-CE1 3.82Å; Y176-F222 AromaticContact CE2-CZ 3.89Å; Y176-F222 HydrophobicContact CE2-CZ 3.89Å; Y176-F222 AromaticContact CG-CE1 3.61Å; Y176-F222 HydrophobicContact CG-CE1 3.61Å; Y176-F222 HydrophobicContact CG-CZ 4.08Å; Y176-F222 AromaticContact CZ-CE1 3.98Å; Y176-T224 HydrophobicContact CE1-CG2 4.28Å; Y176-T224 HydrophobicContact CE2-CG2 4.18Å; Y176-T224 WeakPolarHBondContact OH-CG2 3.43Å; Y176-W243 HydrophobicContact CD2-CD2 4.46Å; Y176-W243 AromaticContact CD2-CE2 3.83Å; Y176-W243 AromaticContact CD2-CH2 3.49Å; Y176-W243 HydrophobicContact CD2-CH2 3.49Å; Y176-W243 VanDerWaalsContact CD2-CH2 3.49Å; Y176-W243 AromaticContact CD2-CZ2 3.31Å; Y176-W243 HydrophobicContact CD2-CZ2 3.31Å; Y176-W243 HydrophobicContact CD2-CZ3 4.09Å; Y176-W243 AromaticContact CE2-CD2 3.96Å; Y176-W243 HydrophobicContact CE2-CD2 3.96Å; Y176-W243 AromaticContact CE2-CE2 3.46Å; Y176-W243 VanDerWaalsContact CE2-CE2 3.46Å; Y176-W243 HydrophobicContact CE2-CE3 4.36Å; Y176-W243 AromaticContact CE2-CH2 3.97Å; Y176-W243 HydrophobicContact CE2-CH2 3.97Å; Y176-W243 AromaticContact CE2-CZ2 3.49Å; Y176-W243 HydrophobicContact CE2-CZ2 3.49Å; Y176-W243 VanDerWaalsContact CE2-CZ2 3.49Å; Y176-W243 HydrophobicContact CE2-CZ3 4.35Å; Y176-W243 AromaticContact CE2-NE1 3.78Å; Y176-W243 WeakPolarHBondContact CE2-O 3.48Å; Y176-W243 WeakPolarHBondContact O-CH2 3.4Å; Y176-W243 PolarHBondContact OH-O 2.8Å; Y176-V246 HydrophobicContact CE1-CG2 3.64Å
177	Q	95.7	Very high	94.4	Very high	14 Å²	14	60.1 Å²	60.1	7%	0.065	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	144.4	177.3	-179.6	59.5	40.2	0	0	110.4	I163 Y179 L204 F222	I163-Q177 HydrophobicContact CB-CB 4.27Å; I163-Q177 HydrophobicContact CD1-CB 4.32Å; I163-Q177 HydrophobicContact CG1-CB 4.48Å; I163-Q177 PolarHBondContact N-O 3.24Å; I163-Q177 PolarHBondContact O-N 3.26Å; I163-Q177 VanDerWaalsContact O-N 3.12Å; Q177-Y179 HydrophobicContact CB-CE2 4.48Å; Q177-Y179 HydrophobicContact CG-CD2 4.15Å; Q177-Y179 HydrophobicContact CG-CE1 4.13Å; Q177-Y179 HydrophobicContact CG-CE2 3.45Å; Q177-Y179 VanDerWaalsContact CG-CE2 3.45Å; Q177-Y179 VanDerWaalsContact CG-CZ 3.47Å; Q177-L204 PolarHBondContact NE2-O 3.12Å; Q177-F222 HydrophobicContact CB-CD1 4.15Å; Q177-F222 HydrophobicContact CB-CD2 3.63Å; Q177-F222 HydrophobicContact CB-CE1 4.24Å; Q177-F222 HydrophobicContact CB-CE2 3.74Å; Q177-F222 HydrophobicContact CB-CG 3.84Å; Q177-F222 HydrophobicContact CB-CZ 4.04Å; Q177-F222 HydrophobicContact CG-CB 4.4Å; Q177-F222 HydrophobicContact CG-CD2 3.6Å; Q177-F222 HydrophobicContact CG-CE2 4.05Å; Q177-F222 HydrophobicContact CG-CG 4.03Å
178	F	95.6	Very high	94.3	Very high	11 Å²	11	63 Å²	63	5%	0.048	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	145.2	173	-61.4	-81.2	0	0	0	111.1	A162 P175 Y187 R189 A203 L204 C205 A206	A162-F178 HydrophobicContact CB-CD1 3.54Å; A162-F178 HydrophobicContact CB-CE1 3.66Å; P175-F178 HydrophobicContact CB-CE2 3.51Å; P175-F178 HydrophobicContact CB-CZ 3.46Å; P175-F178 VanDerWaalsContact CB-CZ 3.46Å; P175-F178 HydrophobicContact CG-CE2 4.49Å; F178-Y187 HydrophobicContact CB-CD2 3.84Å; F178-Y187 HydrophobicContact CB-CE2 4.15Å; F178-Y187 HydrophobicContact CB-CG 4.47Å; F178-Y187 AromaticContact CD1-CD1 3.73Å; F178-Y187 HydrophobicContact CD1-CD1 3.73Å; F178-Y187 AromaticContact CD1-CD2 3.61Å; F178-Y187 HydrophobicContact CD1-CD2 3.61Å; F178-Y187 AromaticContact CD1-CE1 3.98Å; F178-Y187 HydrophobicContact CD1-CE1 3.98Å; F178-Y187 AromaticContact CD1-CE2 3.84Å; F178-Y187 HydrophobicContact CD1-CE2 3.84Å; F178-Y187 AromaticContact CD1-CG 3.55Å; F178-Y187 HydrophobicContact CD1-CG 3.55Å; F178-Y187 AromaticContact CE1-CD1 3.81Å; F178-Y187 HydrophobicContact CE1-CD1 3.81Å; F178-Y187 HydrophobicContact CE1-CD2 4.46Å; F178-Y187 HydrophobicContact CE1-CE1 4.19Å; F178-Y187 AromaticContact CE1-CG 3.97Å; F178-Y187 HydrophobicContact CE1-CG 3.97Å; F178-Y187 AromaticContact CG-CD2 3.99Å; F178-Y187 HydrophobicContact CG-CD2 3.99Å; F178-Y187 HydrophobicContact CG-CE2 4.43Å; F178-Y187 HydrophobicContact CG-CG 4.15Å; F178-R189 HydrophobicContact CD2-CG 4.49Å; F178-A203 HydrophobicContact CD2-CB 4.3Å; F178-A203 HydrophobicContact CE2-CB 4.07Å; F178-L204 PolarHBondContact N-O 3.43Å; F178-C205 HydrophobicContact CB-CB 3.82Å; F178-C205 WeakPolarHBondContact O-CA 3.48Å; F178-A206 PolarHBondContact O-N 3.19Å; F178-A206 VanDerWaalsContact O-N 3.08Å
179	Y	93.9	Very high	94.1	Very high	13 Å²	13	64.3 Å²	64.3	5%	0.051	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	126.9	170.1	-60.1	-75.2	0	0	0	108.9	S160 L161 I163 Q177 A206 H209 I220	S160-Y179 CarbonylContact C-O 3.46Å; S160-Y179 VanDerWaalsContact CA-O 3.27Å; S160-Y179 WeakPolarHBondContact CA-O 3.29Å; L161-Y179 HydrophobicContact CD2-CD2 3.76Å; L161-Y179 HydrophobicContact CD2-CE2 4.35Å; L161-Y179 PolarHBondContact N-O 3.09Å; L161-Y179 PolarHBondContact O-N 3.21Å; L161-Y179 VanDerWaalsContact O-O 3.14Å; I163-Y179 HydrophobicContact CD1-CE2 4.3Å; Q177-Y179 HydrophobicContact CB-CE2 4.48Å; Q177-Y179 HydrophobicContact CG-CD2 4.15Å; Q177-Y179 HydrophobicContact CG-CE1 4.13Å; Q177-Y179 HydrophobicContact CG-CE2 3.45Å; Q177-Y179 VanDerWaalsContact CG-CE2 3.45Å; Q177-Y179 VanDerWaalsContact CG-CZ 3.47Å; Y179-A206 VanDerWaalsContact CA-O 3.26Å; Y179-A206 WeakPolarHBondContact CA-O 3.26Å; Y179-A206 HydrophobicContact CD1-CB 4.29Å; Y179-A206 HydrophobicContact CE1-CB 4.42Å; Y179-H209 AromaticContact CD1-CD2 3.95Å; Y179-H209 AromaticContact CE1-CD2 3.49Å; Y179-H209 VanDerWaalsContact CE1-CD2 3.49Å; Y179-H209 WeakPolarHBondContact CE1-CD2 3.42Å; Y179-I220 HydrophobicContact CD2-CG2 4.07Å; Y179-I220 HydrophobicContact CE2-CG2 3.61Å
180	S	92.9	Very high	94	Very high	0 Å²	0	63 Å²	63	0%	0	30%	0.301	C	S	.	.			trans	-168.9	144.3	178.4	-174.3	0	0	0	0	110.4	E159 S160 Q182 C183 A206	E159-S180 WeakPolarHBondContact O-CA 3.37Å; S160-S180 WeakPolarHBondContact OG-CB 3.47Å; S160-S180 PolarHBondContact OG-OG 2.98Å; S180-Q182 PolarHBondContact O-N 3.08Å; S180-Q182 PolarHBondContact OG-N 3Å; S180-Q182 VanDerWaalsContact OG-N 3.1Å; S180-C183 PolarHBondContact O-SG 3.35Å; S180-A206 PolarHBondContact N-O 3.23Å; S180-A206 VanDerWaalsContact N-O 3.15Å
181	S	88.9	Confident	93.7	Very high	60 Å²	60	65.1 Å²	65.1	42%	0.42	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-21	168.2	71.8	0	0	0	0	111.7	E159	E159-S181 WeakPolarHBondContact OE1-CA 3.47Å; E159-S181 WeakPolarHBondContact OE1-CB 3.25Å; E159-S181 PolarHBondContact OE1-N 3.31Å; E159-S181 PolarHBondContact OE1-OG 2.87Å
182	Q	89.7	Confident	93.2	Very high	71 Å²	71	63 Å²	63	33%	0.332	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	51.7	-178.1	-66.8	177.6	60.1	0	0	111.9	S180 R184 R185 M186	S180-Q182 PolarHBondContact O-N 3.08Å; S180-Q182 PolarHBondContact OG-N 3Å; S180-Q182 VanDerWaalsContact OG-N 3.1Å; Q182-R184 PolarHBondContact O-N 2.99Å; Q182-R185 HydrophobicContact CB-CB 4.31Å; Q182-R185 PolarHBondContact O-N 3.05Å; Q182-M186 PolarHBondContact O-N 2.91Å
183	C	92.4	Very high	92.7	Very high	3 Å²	3	60.2 Å²	60.2	2%	0.02	28%	0.283	C	S	.	.	H	α-helix	trans	-43.5	-43.3	-179.1	-72.6	0	0	0	0	114.9	S180 Y187 N188 R189 N191 C205	S180-C183 PolarHBondContact O-SG 3.35Å; C183-Y187 CarbonylContact O-C 3.56Å; C183-Y187 PolarHBondContact O-N 2.94Å; C183-N188 PolarHBondContact O-N 3.29Å; C183-R189 CarbonylContact C-O 3.52Å; C183-R189 WeakPolarHBondContact CB-O 3.28Å; C183-R189 PolarHBondContact O-N 3.28Å; C183-N191 HydrophobicContact CB-CB 4.28Å; C183-C205 VanDerWaalsContact CA-SG 3.54Å; C183-C205 HydrophobicContact CB-CB 3.66Å; C183-C205 WeakPolarHBondContact CB-SG 3.4Å; C183-C205 WeakPolarHBondContact SG-CB 3.28Å; C183-C205 CovalentContact SG-SG 2.03Å; C183-C205 PolarHBondContact SG-SG 2.89Å
184	R	92.8	Very high	92.3	Very high	169 Å²	169	62.7 Å²	62.7	64%	0.638	31%	0.305	S	S	*	.	H	α-helix	trans	-71.2	-37.2	-178.3	-172.4	61.2	174	-171.1	-2.1	112.7	Q182 N188 R189	Q182-R184 PolarHBondContact O-N 2.99Å; R184-N188 PolarHBondContact NH1-OD1 3.21Å; R184-N188 VanDerWaalsContact O-CA 3.25Å; R184-N188 WeakPolarHBondContact O-CA 3.35Å; R184-N188 PolarHBondContact O-N 2.85Å; R184-R189 VanDerWaalsContact CA-O 3.29Å; R184-R189 WeakPolarHBondContact CA-O 3.31Å; R184-R189 PolarHBondContact N-O 2.89Å; R184-R189 VanDerWaalsContact N-O 3.11Å
185	R	91.4	Very high	91.9	Very high	211 Å²	211	61.2 Å²	61.2	80%	0.796	30%	0.298	S	S	*	.	H	α-helix	trans	-81.7	-37.4	-179.6	-68.2	179.4	174.1	179.9	-2.5	112	Q182	Q182-R185 HydrophobicContact CB-CB 4.31Å; Q182-R185 PolarHBondContact O-N 3.05Å
186	M	90.6	Very high	91.6	Very high	46 Å²	46	62.2 Å²	62.2	23%	0.227	30%	0.303	C	S	.	.	H	α-helix	trans	-82.2	-48.8	-175.9	-176.8	56.4	78.1	0	0	112.8	Q182 R255	Q182-M186 PolarHBondContact O-N 2.91Å; M186-R255 HydrophobicContact CE-CB 4.27Å; M186-R255 VanDerWaalsContact CE-NH2 3.25Å
187	Y	93.5	Very high	91.3	Very high	36 Å²	36	69.3 Å²	69.3	14%	0.141	33%	0.334	C	S	.	.	S	Bend	trans	-118.7	5.2	-171.9	-60	-56	0	0	0	113.5	L161 A162 F178 C183 R189 S254	L161-Y187 VanDerWaalsContact C-OH 3.28Å; L161-Y187 PolarHBondContact N-OH 3.4Å; L161-Y187 PolarHBondContact O-OH 3.2Å; A162-Y187 HydrophobicContact CB-CE1 4.1Å; F178-Y187 HydrophobicContact CB-CD2 3.84Å; F178-Y187 HydrophobicContact CB-CE2 4.15Å; F178-Y187 HydrophobicContact CB-CG 4.47Å; F178-Y187 AromaticContact CD1-CD1 3.73Å; F178-Y187 HydrophobicContact CD1-CD1 3.73Å; F178-Y187 AromaticContact CD1-CD2 3.61Å; F178-Y187 HydrophobicContact CD1-CD2 3.61Å; F178-Y187 AromaticContact CD1-CE1 3.98Å; F178-Y187 HydrophobicContact CD1-CE1 3.98Å; F178-Y187 AromaticContact CD1-CE2 3.84Å; F178-Y187 HydrophobicContact CD1-CE2 3.84Å; F178-Y187 AromaticContact CD1-CG 3.55Å; F178-Y187 HydrophobicContact CD1-CG 3.55Å; F178-Y187 AromaticContact CE1-CD1 3.81Å; F178-Y187 HydrophobicContact CE1-CD1 3.81Å; F178-Y187 HydrophobicContact CE1-CD2 4.46Å; F178-Y187 HydrophobicContact CE1-CE1 4.19Å; F178-Y187 AromaticContact CE1-CG 3.97Å; F178-Y187 HydrophobicContact CE1-CG 3.97Å; F178-Y187 AromaticContact CG-CD2 3.99Å; F178-Y187 HydrophobicContact CG-CD2 3.99Å; F178-Y187 HydrophobicContact CG-CE2 4.43Å; F178-Y187 HydrophobicContact CG-CG 4.15Å; C183-Y187 CarbonylContact O-C 3.56Å; C183-Y187 PolarHBondContact O-N 2.94Å; Y187-R189 PolarHBondContact O-N 3.04Å; Y187-S254 PolarHBondContact OH-OG 2.02Å
188	N	94.1	Very high	91	Very high	110 Å²	110	76.6 Å²	76.6	59%	0.588	37%	0.368	S	S	*	.	S	Bend	trans	53.3	34.1	-174.4	-164.8	22.2	0	0	0	113.4	C183 R184	C183-N188 PolarHBondContact O-N 3.29Å; R184-N188 PolarHBondContact NH1-OD1 3.21Å; R184-N188 VanDerWaalsContact O-CA 3.25Å; R184-N188 WeakPolarHBondContact O-CA 3.35Å; R184-N188 PolarHBondContact O-N 2.85Å
189	R	92.6	Very high	90.8	Very high	75 Å²	75	78 Å²	78	28%	0.283	38%	0.377	S	S	.	.			trans	-115.4	146.5	-179.9	-69.4	-70.1	178.2	172.6	-2.7	111.5	F178 C183 R184 Y187 E202 C205	F178-R189 HydrophobicContact CD2-CG 4.49Å; C183-R189 CarbonylContact C-O 3.52Å; C183-R189 WeakPolarHBondContact CB-O 3.28Å; C183-R189 PolarHBondContact O-N 3.28Å; R184-R189 VanDerWaalsContact CA-O 3.29Å; R184-R189 WeakPolarHBondContact CA-O 3.31Å; R184-R189 PolarHBondContact N-O 2.89Å; R184-R189 VanDerWaalsContact N-O 3.11Å; Y187-R189 PolarHBondContact O-N 3.04Å; R189-E202 IonicContact NH1-OE1 3.51Å; R189-E202 PolarHBondContact NH1-OE1 3.21Å; R189-C205 HydrophobicContact CB-CB 3.93Å
190	P	92.6	Very high	90.6	Very high	63 Å²	63	77.6 Å²	77.6	41%	0.409	38%	0.375	S	S	.	.			trans	-64.3	144.2	168.8	24.7	-29.1	0	0	0	110.7	A193	P190-A193 HydrophobicContact CB-CB 4.38Å; P190-A193 HydrophobicContact CG-CB 3.8Å
191	N	89.9	Confident	90.7	Very high	72 Å²	72	81.4 Å²	81.4	39%	0.385	39%	0.393	S	S	.	.	B	Isolated β-bridge	trans	-75.6	130.4	173.9	-173.6	12.7	0	0	0	109.3	C183 A193 D207	C183-N191 HydrophobicContact CB-CB 4.28Å; N191-A193 VanDerWaalsContact C-N 3.33Å; N191-A193 PolarHBondContact O-N 3.45Å; N191-D207 PolarHBondContact ND2-OD2 2.9Å
192	K	84.7	Confident	90.9	Very high	127 Å²	127	81.2 Å²	81.2	55%	0.552	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	49.8	178.8	-68.6	174.9	178.4	153.6	0	113.4	C205 D207	K192-C205 PolarHBondContact N-O 3.33Å; K192-D207 WeakPolarHBondContact CE-OD1 3.44Å; K192-D207 IonicContact NZ-OD1 2.65Å; K192-D207 PolarHBondContact NZ-OD1 3.41Å; K192-D207 IonicContact NZ-OD2 3.62Å
193	A	88.2	Confident	91.1	Very high	27 Å²	27	78 Å²	78	22%	0.223	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-58.4	141.2	173.5	0	0	0	0	0	110.7	P190 N191 L204	P190-A193 HydrophobicContact CB-CB 4.38Å; P190-A193 HydrophobicContact CG-CB 3.8Å; N191-A193 VanDerWaalsContact C-N 3.33Å; N191-A193 PolarHBondContact O-N 3.45Å; A193-L204 HydrophobicContact CB-CD2 3.89Å; A193-L204 WeakPolarHBondContact O-CD2 3.43Å
194	T	87.8	Confident	91.1	Very high	116 Å²	116	79.5 Å²	79.5	71%	0.712	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-77.9	134.6	175.5	49.6	0	0	0	0	110.4
195	I	89.8	Confident	91.2	Very high	21 Å²	21	71.5 Å²	71.5	11%	0.108	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-88.6	123.3	173.1	-61.2	176.9	0	0	0	108.6	E200 L204 R228	I195-E200 HydrophobicContact CG2-CB 4.46Å; I195-E200 HydrophobicContact CG2-CG 4.11Å; I195-L204 HydrophobicContact CD1-CD1 3.56Å; I195-L204 HydrophobicContact CD1-CD2 4.18Å; I195-L204 HydrophobicContact CD1-CG 3.85Å; I195-L204 HydrophobicContact CG1-CD1 3.81Å; I195-L204 HydrophobicContact CG1-CD2 3.79Å; I195-L204 HydrophobicContact CG1-CG 4.02Å; I195-R228 HydrophobicContact CD1-CG 3.85Å; I195-R228 HydrophobicContact CG2-CG 4.43Å
196	T	91.1	Very high	91.2	Very high	61 Å²	61	62.5 Å²	62.5	37%	0.374	32%	0.319	S	S	.	.			trans	-104.4	170.3	171.2	69.3	0	0	0	0	109.5	Q198 N199 E200	T196-Q198 PolarHBondContact O-N 2.81Å; T196-Q198 VanDerWaalsContact O-N 3.13Å; T196-Q198 PolarHBondContact OG1-N 3.31Å; T196-Q198 PolarHBondContact OG1-OE1 2.05Å; T196-Q198 VanDerWaalsContact OG1-OE1 3.13Å; T196-N199 WeakPolarHBondContact CA-OD1 3.28Å; T196-N199 PolarHBondContact N-OD1 3.03Å; T196-N199 PolarHBondContact O-N 2.92Å; T196-N199 PolarHBondContact O-OD1 3.24Å; T196-N199 VanDerWaalsContact O-OD1 3.13Å; T196-N199 PolarHBondContact OG1-OD1 2.71Å; T196-E200 VanDerWaalsContact O-CG 3.23Å; T196-E200 WeakPolarHBondContact O-CG 3.47Å; T196-E200 PolarHBondContact O-N 2.96Å
197	K	89.2	Confident	90.8	Very high	149 Å²	149	62.4 Å²	62.4	65%	0.648	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-22.8	176.5	-74.2	-169.2	174.8	-173.7	0	113.4	P229	K197-P229 HydrophobicContact CG-CB 4.06Å; K197-P229 HydrophobicContact CG-CG 4.47Å
198	Q	89.3	Confident	89.4	Confident	167 Å²	167	63 Å²	63	78%	0.78	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-26.7	-176.4	-65.6	79.5	-3.6	0	0	112.8	T196	T196-Q198 PolarHBondContact O-N 2.81Å; T196-Q198 VanDerWaalsContact O-N 3.13Å; T196-Q198 PolarHBondContact OG1-N 3.31Å; T196-Q198 PolarHBondContact OG1-OE1 2.05Å; T196-Q198 VanDerWaalsContact OG1-OE1 3.13Å
199	N	91	Very high	88.1	Confident	42 Å²	42	60.8 Å²	60.8	23%	0.225	32%	0.323	C	S	.	.	S	Bend	trans	-122.7	32.2	-176.1	69.1	-27.5	0	0	0	112.6	T196 Q201 E202	T196-N199 WeakPolarHBondContact CA-OD1 3.28Å; T196-N199 PolarHBondContact N-OD1 3.03Å; T196-N199 PolarHBondContact O-N 2.92Å; T196-N199 PolarHBondContact O-OD1 3.24Å; T196-N199 VanDerWaalsContact O-OD1 3.13Å; T196-N199 PolarHBondContact OG1-OD1 2.71Å; N199-Q201 PolarHBondContact O-N 3.31Å; N199-E202 HydrophobicContact CB-CB 4.2Å; N199-E202 PolarHBondContact ND2-OE2 2.94Å; N199-E202 VanDerWaalsContact O-CB 3.27Å; N199-E202 WeakPolarHBondContact O-CB 3.32Å; N199-E202 PolarHBondContact O-N 3.02Å
200	E	91.1	Very high	86.7	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.019	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-3.7	179.2	-66.4	-169.1	161.6	0	0	115.1	I195 T196 R228 P229 S230 V239 L240	I195-E200 HydrophobicContact CG2-CB 4.46Å; I195-E200 HydrophobicContact CG2-CG 4.11Å; T196-E200 VanDerWaalsContact O-CG 3.23Å; T196-E200 WeakPolarHBondContact O-CG 3.47Å; T196-E200 PolarHBondContact O-N 2.96Å; E200-R228 VanDerWaalsContact C-NH1 3.27Å; E200-R228 PolarHBondContact O-NH1 3.34Å; E200-P229 WeakPolarHBondContact OE1-CD 3.27Å; E200-S230 VanDerWaalsContact CD-OG 3.26Å; E200-S230 VanDerWaalsContact OE1-CB 3.25Å; E200-S230 WeakPolarHBondContact OE1-CB 3.4Å; E200-S230 PolarHBondContact OE1-N 2.92Å; E200-S230 PolarHBondContact OE1-OG 3.09Å; E200-S230 VanDerWaalsContact OE2-CB 3.27Å; E200-S230 WeakPolarHBondContact OE2-CB 3.47Å; E200-S230 PolarHBondContact OE2-OG 2.8Å; E200-S230 VanDerWaalsContact OE2-OG 3.11Å; E200-V239 HydrophobicContact CB-CG1 4.12Å; E200-L240 HydrophobicContact CB-CD2 4.01Å
201	Q	93.3	Very high	85.7	Confident	79 Å²	79	62 Å²	62	37%	0.369	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	8.6	172	-65.3	-175.4	-21.9	0	0	112.5	N199 V239 W243	N199-Q201 PolarHBondContact O-N 3.31Å; Q201-V239 HydrophobicContact CG-CG1 3.53Å; Q201-V239 PolarHBondContact NE2-O 3.34Å; Q201-W243 HydrophobicContact CB-CE3 4.04Å; Q201-W243 HydrophobicContact CG-CB 4.29Å; Q201-W243 HydrophobicContact CG-CE3 4.45Å; Q201-W243 WeakPolarHBondContact O-CZ3 3.18Å
202	E	93.3	Very high	84.7	Confident	56 Å²	56	60.6 Å²	60.6	26%	0.262	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-78.3	136.7	176.8	-167.7	171.1	-174.4	0	0	110.6	R189 N199 R228	R189-E202 IonicContact NH1-OE1 3.51Å; R189-E202 PolarHBondContact NH1-OE1 3.21Å; N199-E202 HydrophobicContact CB-CB 4.2Å; N199-E202 PolarHBondContact ND2-OE2 2.94Å; N199-E202 VanDerWaalsContact O-CB 3.27Å; N199-E202 WeakPolarHBondContact O-CB 3.32Å; N199-E202 PolarHBondContact O-N 3.02Å; E202-R228 PolarHBondContact O-NH1 2.82Å; E202-R228 VanDerWaalsContact O-NH1 3.09Å; E202-R228 PolarHBondContact O-NH2 3.31Å
203	A	94.6	Very high	84.1	Confident	4 Å²	4	61.3 Å²	61.3	3%	0.033	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-81.1	125.8	171.4	0	0	0	0	0	109.7	P175 Y176 F178 W243	P175-A203 HydrophobicContact CB-CB 3.82Å; P175-A203 HydrophobicContact CG-CB 4.19Å; Y176-A203 WeakPolarHBondContact O-CB 3.43Å; F178-A203 HydrophobicContact CD2-CB 4.3Å; F178-A203 HydrophobicContact CE2-CB 4.07Å; A203-W243 HydrophobicContact CB-CH2 4.24Å
204	L	93.3	Very high	83.7	Confident	35 Å²	35	63 Å²	63	18%	0.183	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-87.5	160.8	-179.5	-62.7	-174.8	0	0	0	111.8	Q177 F178 A193 I195	Q177-L204 PolarHBondContact NE2-O 3.12Å; F178-L204 PolarHBondContact N-O 3.43Å; A193-L204 HydrophobicContact CB-CD2 3.89Å; A193-L204 WeakPolarHBondContact O-CD2 3.43Å; I195-L204 HydrophobicContact CD1-CD1 3.56Å; I195-L204 HydrophobicContact CD1-CD2 4.18Å; I195-L204 HydrophobicContact CD1-CG 3.85Å; I195-L204 HydrophobicContact CG1-CD1 3.81Å; I195-L204 HydrophobicContact CG1-CD2 3.79Å; I195-L204 HydrophobicContact CG1-CG 4.02Å
205	C	94.1	Very high	83.3	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.007	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	129.3	164.8	-169.3	0	0	0	0	109.9	F178 C183 R189 K192	F178-C205 HydrophobicContact CB-CB 3.82Å; F178-C205 WeakPolarHBondContact O-CA 3.48Å; C183-C205 VanDerWaalsContact CA-SG 3.54Å; C183-C205 HydrophobicContact CB-CB 3.66Å; C183-C205 WeakPolarHBondContact CB-SG 3.4Å; C183-C205 WeakPolarHBondContact SG-CB 3.28Å; C183-C205 CovalentContact SG-SG 2.03Å; C183-C205 PolarHBondContact SG-SG 2.89Å; R189-C205 HydrophobicContact CB-CB 3.93Å; K192-C205 PolarHBondContact N-O 3.33Å
206	A	90.3	Very high	83	Confident	22 Å²	22	61.2 Å²	61.2	18%	0.182	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	148.9	-179.7	0	0	0	0	0	111.6	F178 Y179 S180	F178-A206 PolarHBondContact O-N 3.19Å; F178-A206 VanDerWaalsContact O-N 3.08Å; Y179-A206 VanDerWaalsContact CA-O 3.26Å; Y179-A206 WeakPolarHBondContact CA-O 3.26Å; Y179-A206 HydrophobicContact CD1-CB 4.29Å; Y179-A206 HydrophobicContact CE1-CB 4.42Å; S180-A206 PolarHBondContact N-O 3.23Å; S180-A206 VanDerWaalsContact N-O 3.15Å
207	D	82.9	Confident	82.7	Confident	44 Å²	44	59.9 Å²	59.9	24%	0.235	32%	0.319	C	S	.	.			trans	-96.6	-8.5	175.7	56.5	12.7	0	0	0	113.2	N191 K192 H209 T210	N191-D207 PolarHBondContact ND2-OD2 2.9Å; K192-D207 WeakPolarHBondContact CE-OD1 3.44Å; K192-D207 IonicContact NZ-OD1 2.65Å; K192-D207 PolarHBondContact NZ-OD1 3.41Å; K192-D207 IonicContact NZ-OD2 3.62Å; D207-H209 PolarHBondContact O-N 3.3Å; D207-T210 PolarHBondContact O-N 3.28Å; D207-T210 PolarHBondContact O-OG1 3.24Å
208	G	65	Low	82.7	Confident	48 Å²	48	52.8 Å²	52.8	50%	0.495	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-1.5	-167.1	0	0	0	0	0	117.3
209	H	66.6	Low	82.7	Confident	63 Å²	63	49.3 Å²	49.3	29%	0.292	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.6	14.8	176.8	-55.6	-66	0	0	0	113	R157 Y179 D207 E211 I220	R157-H209 PolarHBondContact NE-O 3.42Å; Y179-H209 AromaticContact CD1-CD2 3.95Å; Y179-H209 AromaticContact CE1-CD2 3.49Å; Y179-H209 VanDerWaalsContact CE1-CD2 3.49Å; Y179-H209 WeakPolarHBondContact CE1-CD2 3.42Å; D207-H209 PolarHBondContact O-N 3.3Å; H209-E211 VanDerWaalsContact C-N 3.29Å; H209-I220 HydrophobicContact CB-CG1 4.39Å
210	T	63.8	Low	82.8	Confident	22 Å²	22	47.4 Å²	47.4	14%	0.135	26%	0.264	C	S	.	.			trans	-90.9	12	178.1	65.8	0	0	0	0	112.9	E159 D207 Q257	E159-T210 VanDerWaalsContact O-CG2 3.25Å; E159-T210 WeakPolarHBondContact O-CG2 3.49Å; D207-T210 PolarHBondContact O-N 3.28Å; D207-T210 PolarHBondContact O-OG1 3.24Å; T210-Q257 PolarHBondContact O-NE2 3.17Å
211	E	69.8	Low	82.9	Confident	141 Å²	141	49.5 Å²	49.5	66%	0.659	28%	0.283	S	S	*	.			trans	-74.1	135.3	171	-67.1	-176.2	178.7	0	0	109.7	R157 H209 Y213	R157-E211 PolarHBondContact NE-O 3.22Å; R157-E211 PolarHBondContact NH2-O 2.98Å; H209-E211 VanDerWaalsContact C-N 3.29Å; E211-Y213 PolarHBondContact O-N 3.18Å
212	M	68.9	Low	82.9	Confident	44 Å²	44	46 Å²	46	22%	0.217	27%	0.266	C	S	.	.			trans	-65.1	-28.7	-176	-174.6	177.8	175.9	0	0	112.7	P214 L215 Q257 P259	M212-P214 CarbonylContact O-C 3.45Å; M212-L215 HydrophobicContact CE-CD2 3.58Å; M212-L215 HydrophobicContact CG-CD2 3.89Å; M212-L215 HydrophobicContact SD-CD2 4.41Å; M212-Q257 HydrophobicContact CG-CB 4.44Å; M212-P259 HydrophobicContact CE-CB 3.59Å; M212-P259 HydrophobicContact CE-CG 3.38Å; M212-P259 HydrophobicContact SD-CB 4.41Å
213	Y	72.2	Confident	83.1	Confident	142 Å²	142	46 Å²	46	56%	0.557	27%	0.272	S	S	*	.			trans	-86.9	140.8	178	-69	-91.2	0	0	0	111.7	E82 R157 E211	E82-Y213 WeakPolarHBondContact OE1-CE1 3.42Å; E82-Y213 PolarHBondContact OE1-OH 3.28Å; E82-Y213 WeakPolarHBondContact OE2-CE1 3.49Å; R157-Y213 PolarHBondContact NH2-O 2.79Å; E211-Y213 PolarHBondContact O-N 3.18Å
214	P	81.2	Confident	83.1	Confident	62 Å²	62	45.9 Å²	45.9	40%	0.403	27%	0.271	S	S	.	.	S	Bend	cis	-77.2	150	-2.9	33.9	-36.4	0	0	0	112	M212 S216	M212-P214 CarbonylContact O-C 3.45Å; P214-S216 WeakPolarHBondContact CB-O 3.26Å; P214-S216 PolarHBondContact O-N 2.7Å
215	L	78.5	Confident	83.2	Confident	21 Å²	21	46.7 Å²	46.7	11%	0.11	28%	0.275	C	S	.	.	S	Bend	trans	-67.6	-19.4	179.2	-61.5	-178.5	0	0	0	113.7	V80 E82 S155 P156 M212	V80-L215 HydrophobicContact CG1-CD1 4.4Å; E82-L215 HydrophobicContact CG-CD1 3.72Å; E82-L215 WeakPolarHBondContact OE1-CD1 3.4Å; S155-L215 CarbonylContact C-O 3.59Å; P156-L215 VanDerWaalsContact CD-O 3.26Å; P156-L215 WeakPolarHBondContact CD-O 3.32Å; P156-L215 HydrophobicContact CG-CB 4.5Å; P156-L215 HydrophobicContact CG-CD2 4.19Å; M212-L215 HydrophobicContact CE-CD2 3.58Å; M212-L215 HydrophobicContact CG-CD2 3.89Å; M212-L215 HydrophobicContact SD-CD2 4.41Å
216	S	83.3	Confident	83.1	Confident	78 Å²	78	52.5 Å²	52.5	55%	0.545	31%	0.306	S	S	.	.	S	Bend	trans	-146.5	150.1	173.6	-178.8	0	0	0	0	109.2	C154 P214 G218	C154-S216 PolarHBondContact O-OG 2.89Å; P214-S216 WeakPolarHBondContact CB-O 3.26Å; P214-S216 PolarHBondContact O-N 2.7Å; S216-G218 VanDerWaalsContact C-N 3.28Å; S216-G218 PolarHBondContact O-N 3.25Å
217	G	85	Confident	82.9	Confident	34 Å²	34	54 Å²	54	35%	0.351	32%	0.324	S	S	.	.	S	Bend	trans	77	12.3	-175.6	0	0	0	0	0	114.1	F153 L219	F153-G217 VanDerWaalsContact O-CA 3.24Å; F153-G217 WeakPolarHBondContact O-CA 3.43Å; F153-G217 PolarHBondContact O-N 2.04Å; G217-L219 PolarHBondContact O-N 2.78Å
218	G	88.6	Confident	83.4	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	32%	0.316	C	S	.	.			trans	-63	128.8	178.4	0	0	0	0	0	111.3	F153 S216	F153-G218 WeakPolarHBondContact CD2-O 3.15Å; F153-G218 PolarHBondContact N-O 3.37Å; S216-G218 VanDerWaalsContact C-N 3.28Å; S216-G218 PolarHBondContact O-N 3.25Å
219	L	90.7	Very high	84.8	Confident	93 Å²	93	53.2 Å²	53.2	49%	0.487	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	133.4	177.6	-175.9	66.3	0	0	0	110.3	Q152 R157 G217 A221	Q152-L219 HydrophobicContact CB-CD1 4.44Å; R157-L219 PolarHBondContact NH1-O 2.74Å; G217-L219 PolarHBondContact O-N 2.78Å; L219-A221 HydrophobicContact CG-CB 4.44Å
220	I	92.6	Very high	86.1	Confident	3 Å²	3	51.4 Å²	51.4	2%	0.015	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	118.7	162.2	-62.4	-178.2	0	0	0	106.8	S150 L151 F153 R157 L161 Y179 H209	S150-I220 CarbonylContact C-O 3.53Å; S150-I220 WeakPolarHBondContact CA-O 3.39Å; L151-I220 PolarHBondContact N-O 3.32Å; L151-I220 PolarHBondContact O-N 2.83Å; F153-I220 HydrophobicContact CD2-CD1 4.48Å; F153-I220 HydrophobicContact CD2-CG1 4.41Å; F153-I220 HydrophobicContact CE2-CB 4.15Å; F153-I220 HydrophobicContact CE2-CD1 3.6Å; F153-I220 HydrophobicContact CE2-CG1 3.8Å; F153-I220 HydrophobicContact CZ-CD1 4.03Å; R157-I220 HydrophobicContact CB-CD1 4.27Å; R157-I220 HydrophobicContact CG-CD1 4.28Å; R157-I220 HydrophobicContact CG-CG1 4.17Å; L161-I220 HydrophobicContact CD1-CD1 3.99Å; Y179-I220 HydrophobicContact CD2-CG2 4.07Å; Y179-I220 HydrophobicContact CE2-CG2 3.61Å; H209-I220 HydrophobicContact CB-CG1 4.39Å
221	A	92.7	Very high	87.3	Confident	48 Å²	48	51.4 Å²	51.4	40%	0.397	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	118.4	177.7	0	0	0	0	0	109.8	L219	L219-A221 HydrophobicContact CG-CB 4.44Å
222	F	94.8	Very high	88.2	Confident	6 Å²	6	54.9 Å²	54.9	3%	0.026	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	113.6	174.3	165.5	-124.8	0	0	0	109.1	Y148 V149 I163 Y176 Q177 T224 W243	Y148-F222 CarbonylContact C-O 3.54Å; Y148-F222 WeakPolarHBondContact CA-O 3.32Å; Y148-F222 WeakPolarHBondContact CB-O 3.24Å; V149-F222 HydrophobicContact CB-CB 4.48Å; V149-F222 HydrophobicContact CB-CD1 4.22Å; V149-F222 HydrophobicContact CG2-CD1 4.15Å; V149-F222 PolarHBondContact N-O 2.81Å; V149-F222 PolarHBondContact O-N 2.9Å; I163-F222 HydrophobicContact CD1-CB 3.87Å; I163-F222 HydrophobicContact CD1-CD1 4.24Å; I163-F222 HydrophobicContact CD1-CG 4.29Å; Y176-F222 AromaticContact CD1-CE1 3.74Å; Y176-F222 HydrophobicContact CD1-CE1 3.74Å; Y176-F222 AromaticContact CD2-CE1 3.6Å; Y176-F222 HydrophobicContact CD2-CE1 3.6Å; Y176-F222 AromaticContact CD2-CZ 3.64Å; Y176-F222 HydrophobicContact CD2-CZ 3.64Å; Y176-F222 AromaticContact CE1-CE1 3.91Å; Y176-F222 HydrophobicContact CE1-CE1 3.91Å; Y176-F222 AromaticContact CE2-CE1 3.82Å; Y176-F222 HydrophobicContact CE2-CE1 3.82Å; Y176-F222 AromaticContact CE2-CZ 3.89Å; Y176-F222 HydrophobicContact CE2-CZ 3.89Å; Y176-F222 AromaticContact CG-CE1 3.61Å; Y176-F222 HydrophobicContact CG-CE1 3.61Å; Y176-F222 HydrophobicContact CG-CZ 4.08Å; Y176-F222 AromaticContact CZ-CE1 3.98Å; Q177-F222 HydrophobicContact CB-CD1 4.15Å; Q177-F222 HydrophobicContact CB-CD2 3.63Å; Q177-F222 HydrophobicContact CB-CE1 4.24Å; Q177-F222 HydrophobicContact CB-CE2 3.74Å; Q177-F222 HydrophobicContact CB-CG 3.84Å; Q177-F222 HydrophobicContact CB-CZ 4.04Å; Q177-F222 HydrophobicContact CG-CB 4.4Å; Q177-F222 HydrophobicContact CG-CD2 3.6Å; Q177-F222 HydrophobicContact CG-CE2 4.05Å; Q177-F222 HydrophobicContact CG-CG 4.03Å; F222-T224 HydrophobicContact CD1-CG2 4.38Å; F222-T224 HydrophobicContact CE1-CG2 3.74Å; F222-T224 HydrophobicContact CZ-CG2 4.08Å; F222-W243 HydrophobicContact CZ-CZ2 4.29Å
223	S	95.6	Very high	89.3	Confident	55 Å²	55	56.9 Å²	56.9	39%	0.385	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	125.5	170.4	176	0	0	0	0	110	L225 D226	S223-L225 VanDerWaalsContact C-N 3.34Å; S223-L225 PolarHBondContact O-N 3.26Å; S223-D226 PolarHBondContact O-N 3.38Å
224	T	95.6	Very high	90.2	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.006	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-30.7	-169.9	58.9	0	0	0	0	113.1	I146 T147 Y176 F222 R228 W243	I146-T224 HydrophobicContact CB-CG2 4.45Å; I146-T224 HydrophobicContact CG2-CG2 4.07Å; I146-T224 WeakPolarHBondContact O-CG2 3.42Å; I146-T224 PolarHBondContact O-OG1 3.28Å; T147-T224 PolarHBondContact O-N 2.86Å; T147-T224 PolarHBondContact O-OG1 2.85Å; Y176-T224 HydrophobicContact CE1-CG2 4.28Å; Y176-T224 HydrophobicContact CE2-CG2 4.18Å; Y176-T224 WeakPolarHBondContact OH-CG2 3.43Å; F222-T224 HydrophobicContact CD1-CG2 4.38Å; F222-T224 HydrophobicContact CE1-CG2 3.74Å; F222-T224 HydrophobicContact CZ-CG2 4.08Å; T224-R228 WeakPolarHBondContact O-CD 3.48Å; T224-R228 PolarHBondContact O-NE 2.86Å; T224-W243 PolarHBondContact O-NE1 3.23Å
225	L	94.3	Very high	90.6	Very high	52 Å²	52	51.4 Å²	51.4	27%	0.272	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-3.3	-176.5	-63.3	-179.6	0	0	0	113.8	S223 R228 F234 L240 V244	S223-L225 VanDerWaalsContact C-N 3.34Å; S223-L225 PolarHBondContact O-N 3.26Å; L225-R228 PolarHBondContact O-N 2.8Å; L225-F234 HydrophobicContact CD1-CD2 4.23Å; L225-F234 HydrophobicContact CD2-CD2 4.14Å; L225-F234 HydrophobicContact CD2-CE2 4.45Å; L225-L240 HydrophobicContact CD2-CB 4.32Å; L225-L240 HydrophobicContact CD2-CD1 4.21Å; L225-L240 HydrophobicContact CD2-CD2 4.41Å; L225-V244 HydrophobicContact CD2-CG1 3.65Å; L225-V244 HydrophobicContact CG-CG1 4.13Å
226	D	91.9	Very high	91.2	Very high	123 Å²	123	55 Å²	55	66%	0.658	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	137.6	-177.3	-171.5	29.5	0	0	0	111.9	S223 R228	S223-D226 PolarHBondContact O-N 3.38Å; D226-R228 PolarHBondContact O-N 2.84Å; D226-R228 VanDerWaalsContact O-N 3.13Å
227	G	87.6	Confident	91.7	Very high	55 Å²	55	52 Å²	52	57%	0.567	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	6.8	-176.4	0	0	0	0	0	116.2
228	R	93.8	Very high	92.1	Very high	15 Å²	15	54.6 Å²	54.6	6%	0.057	32%	0.318	C	S	.	.			trans	-94.5	119.7	-177.9	-56.7	-166.2	-172.5	-91.3	-14.4	112	I195 E200 E202 T224 L225 D226 S230 G231 L240 W243	I195-R228 HydrophobicContact CD1-CG 3.85Å; I195-R228 HydrophobicContact CG2-CG 4.43Å; E200-R228 VanDerWaalsContact C-NH1 3.27Å; E200-R228 PolarHBondContact O-NH1 3.34Å; E202-R228 PolarHBondContact O-NH1 2.82Å; E202-R228 VanDerWaalsContact O-NH1 3.09Å; E202-R228 PolarHBondContact O-NH2 3.31Å; T224-R228 WeakPolarHBondContact O-CD 3.48Å; T224-R228 PolarHBondContact O-NE 2.86Å; L225-R228 PolarHBondContact O-N 2.8Å; D226-R228 PolarHBondContact O-N 2.84Å; D226-R228 VanDerWaalsContact O-N 3.13Å; R228-S230 PolarHBondContact O-N 2.84Å; R228-G231 PolarHBondContact O-N 3.41Å; R228-L240 HydrophobicContact CB-CD1 4.41Å; R228-L240 HydrophobicContact CB-CD2 4.13Å; R228-L240 HydrophobicContact CG-CD2 4.41Å; R228-W243 VanDerWaalsContact CZ-NE1 3.33Å
229	P	92.9	Very high	92.4	Very high	60 Å²	60	57.5 Å²	57.5	39%	0.39	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-55.4	-41.8	-173.1	-27.9	34.1	0	0	0	115.2	K197 E200 G231	K197-P229 HydrophobicContact CG-CB 4.06Å; K197-P229 HydrophobicContact CG-CG 4.47Å; E200-P229 WeakPolarHBondContact OE1-CD 3.27Å; P229-G231 PolarHBondContact O-N 3.44Å
230	S	93.9	Very high	92.7	Very high	25 Å²	25	53 Å²	53	18%	0.175	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-82.2	4.8	-178.5	-48.9	0	0	0	0	113.9	E200 R228 K232 D233 F234 L240	E200-S230 VanDerWaalsContact CD-OG 3.26Å; E200-S230 VanDerWaalsContact OE1-CB 3.25Å; E200-S230 WeakPolarHBondContact OE1-CB 3.4Å; E200-S230 PolarHBondContact OE1-N 2.92Å; E200-S230 PolarHBondContact OE1-OG 3.09Å; E200-S230 VanDerWaalsContact OE2-CB 3.27Å; E200-S230 WeakPolarHBondContact OE2-CB 3.47Å; E200-S230 PolarHBondContact OE2-OG 2.8Å; E200-S230 VanDerWaalsContact OE2-OG 3.11Å; R228-S230 PolarHBondContact O-N 2.84Å; S230-K232 PolarHBondContact O-N 3.48Å; S230-D233 CarbonylContact O-C 3.53Å; S230-D233 VanDerWaalsContact O-C 3.24Å; S230-D233 PolarHBondContact O-N 2.83Å; S230-F234 PolarHBondContact O-N 2.82Å; S230-L240 WeakPolarHBondContact O-CD1 3.48Å
231	G	90.4	Very high	92.8	Very high	21 Å²	21	54 Å²	54	22%	0.216	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-59.7	-32.1	178.8	0	0	0	0	0	113.3	R228 P229 D233 L240	R228-G231 PolarHBondContact O-N 3.41Å; P229-G231 PolarHBondContact O-N 3.44Å; G231-D233 VanDerWaalsContact C-N 3.26Å; G231-D233 PolarHBondContact O-N 3.49Å; G231-L240 VanDerWaalsContact N-CD1 3.32Å
232	K	88.6	Confident	93	Very high	215 Å²	215	54.8 Å²	54.8	94%	0.935	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-67.6	-25	175.3	-63.3	-176.2	-178.2	-179.5	0	113.3	S230	S230-K232 PolarHBondContact O-N 3.48Å
233	D	90.8	Very high	93.1	Very high	85 Å²	85	54.5 Å²	54.5	46%	0.455	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-118.8	44.1	179.4	-168.4	24.6	0	0	0	110.9	S230 G231 D235 N236 S237	S230-D233 CarbonylContact O-C 3.53Å; S230-D233 VanDerWaalsContact O-C 3.24Å; S230-D233 PolarHBondContact O-N 2.83Å; G231-D233 VanDerWaalsContact C-N 3.26Å; G231-D233 PolarHBondContact O-N 3.49Å; D233-D235 VanDerWaalsContact C-N 3.26Å; D233-D235 PolarHBondContact O-N 2.74Å; D233-N236 PolarHBondContact O-N 2.91Å; D233-N236 PolarHBondContact OD1-ND2 3.02Å; D233-S237 PolarHBondContact O-N 3.01Å; D233-S237 VanDerWaalsContact O-N 3.17Å
234	F	91.6	Very high	93.1	Very high	37 Å²	37	52.1 Å²	52.1	16%	0.162	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-56.9	-38.1	-176.9	173.9	-97.8	0	0	0	113	L225 S230 N236 S237 L240 Q241 V244	L225-F234 HydrophobicContact CD1-CD2 4.23Å; L225-F234 HydrophobicContact CD2-CD2 4.14Å; L225-F234 HydrophobicContact CD2-CE2 4.45Å; S230-F234 PolarHBondContact O-N 2.82Å; F234-N236 PolarHBondContact O-N 3.48Å; F234-S237 PolarHBondContact O-N 3.13Å; F234-L240 HydrophobicContact CD2-CB 3.97Å; F234-L240 HydrophobicContact CE2-CB 4.26Å; F234-Q241 HydrophobicContact CE1-CG 4.15Å; F234-Q241 HydrophobicContact CE2-CG 3.98Å; F234-Q241 HydrophobicContact CZ-CB 4.4Å; F234-Q241 HydrophobicContact CZ-CG 3.76Å; F234-Q241 PolarHBondContact O-NE2 3.12Å; F234-V244 HydrophobicContact CE2-CG1 4.12Å; F234-V244 HydrophobicContact CE2-CG2 3.64Å; F234-V244 HydrophobicContact CZ-CG2 3.63Å
235	D	88.9	Confident	93.2	Very high	53 Å²	53	52.1 Å²	52.1	28%	0.283	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-60.5	-28.4	-178	-76	-23.1	0	0	0	113.1	R50 D233 Q241	R50-D235 IonicContact CZ-OD2 2.91Å; R50-D235 IonicContact NH1-OD1 3.36Å; R50-D235 PolarHBondContact NH1-OD1 2.94Å; R50-D235 IonicContact NH1-OD2 3.93Å; R50-D235 PolarHBondContact NH1-OD2 3.22Å; R50-D235 IonicContact NH2-OD2 3.1Å; D233-D235 VanDerWaalsContact C-N 3.26Å; D233-D235 PolarHBondContact O-N 2.74Å; D235-Q241 VanDerWaalsContact C-NE2 3.26Å; D235-Q241 PolarHBondContact O-NE2 2.98Å
236	N	90.6	Very high	93.4	Very high	96 Å²	96	49.6 Å²	49.6	51%	0.513	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-105.9	-6.7	-179.7	-60.3	-52	0	0	0	113.5	D233 F234 P238	D233-N236 PolarHBondContact O-N 2.91Å; D233-N236 PolarHBondContact OD1-ND2 3.02Å; F234-N236 PolarHBondContact O-N 3.48Å; N236-P238 WeakPolarHBondContact O-CD 3.3Å
237	S	94.5	Very high	93.7	Very high	14 Å²	14	43.8 Å²	43.8	10%	0.098	25%	0.252	C	S	.	.			trans	-92.9	98.1	178.9	-177.6	0	0	0	0	111.8	D233 F234 V239 L240 Q241	D233-S237 PolarHBondContact O-N 3.01Å; D233-S237 VanDerWaalsContact O-N 3.17Å; F234-S237 PolarHBondContact O-N 3.13Å; S237-V239 PolarHBondContact O-N 3.22Å; S237-L240 PolarHBondContact O-N 3.4Å; S237-L240 PolarHBondContact OG-N 3.26Å; S237-Q241 VanDerWaalsContact O-CG 3.25Å; S237-Q241 WeakPolarHBondContact O-CG 3.37Å; S237-Q241 PolarHBondContact O-N 3.12Å; S237-Q241 VanDerWaalsContact O-N 3.09Å
238	P	94.1	Very high	94.2	Very high	90 Å²	90	41.5 Å²	41.5	58%	0.584	23%	0.226	S	C	*	.	H	α-helix	trans	-63.4	-28.2	176.4	26.9	-35.6	0	0	0	112.1	N236 Q241 D242	N236-P238 WeakPolarHBondContact O-CD 3.3Å; P238-Q241 PolarHBondContact O-N 2.85Å; P238-D242 WeakPolarHBondContact O-CB 3.48Å; P238-D242 PolarHBondContact O-N 3.06Å
239	V	95.6	Very high	94.4	Very high	60 Å²	60	40.8 Å²	40.8	36%	0.364	22%	0.224	S	C	.	.	H	α-helix	trans	-62.6	-48.4	179.3	178.5	0	0	0	0	110.4	E200 Q201 S237 D242 W243	E200-V239 HydrophobicContact CB-CG1 4.12Å; Q201-V239 HydrophobicContact CG-CG1 3.53Å; Q201-V239 PolarHBondContact NE2-O 3.34Å; S237-V239 PolarHBondContact O-N 3.22Å; V239-D242 PolarHBondContact O-N 2.98Å; V239-W243 PolarHBondContact O-N 3.25Å
240	L	95.7	Very high	94.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-75	-33.6	178.2	-68.8	-176.9	0	0	0	112.9	E200 L225 R228 S230 G231 F234 S237 D242 W243 V244	E200-L240 HydrophobicContact CB-CD2 4.01Å; L225-L240 HydrophobicContact CD2-CB 4.32Å; L225-L240 HydrophobicContact CD2-CD1 4.21Å; L225-L240 HydrophobicContact CD2-CD2 4.41Å; R228-L240 HydrophobicContact CB-CD1 4.41Å; R228-L240 HydrophobicContact CB-CD2 4.13Å; R228-L240 HydrophobicContact CG-CD2 4.41Å; S230-L240 WeakPolarHBondContact O-CD1 3.48Å; G231-L240 VanDerWaalsContact N-CD1 3.32Å; F234-L240 HydrophobicContact CD2-CB 3.97Å; F234-L240 HydrophobicContact CE2-CB 4.26Å; S237-L240 PolarHBondContact O-N 3.4Å; S237-L240 PolarHBondContact OG-N 3.26Å; L240-D242 PolarHBondContact O-N 3.28Å; L240-W243 HydrophobicContact CD2-CB 4.39Å; L240-W243 WeakPolarHBondContact O-CB 3.38Å; L240-W243 PolarHBondContact O-N 2.77Å; L240-W243 VanDerWaalsContact O-N 3.15Å; L240-V244 WeakPolarHBondContact O-CG2 3.31Å; L240-V244 PolarHBondContact O-N 3.07Å
241	Q	95.5	Very high	94.8	Very high	22 Å²	22	40.4 Å²	40.4	10%	0.103	21%	0.211	C	C	.	.	H	α-helix	trans	-59.2	-38.4	173.6	-71	169.1	22.8	0	0	111.7	F234 D235 S237 P238 V244 T245	F234-Q241 HydrophobicContact CE1-CG 4.15Å; F234-Q241 HydrophobicContact CE2-CG 3.98Å; F234-Q241 HydrophobicContact CZ-CB 4.4Å; F234-Q241 HydrophobicContact CZ-CG 3.76Å; F234-Q241 PolarHBondContact O-NE2 3.12Å; D235-Q241 VanDerWaalsContact C-NE2 3.26Å; D235-Q241 PolarHBondContact O-NE2 2.98Å; S237-Q241 VanDerWaalsContact O-CG 3.25Å; S237-Q241 WeakPolarHBondContact O-CG 3.37Å; S237-Q241 PolarHBondContact O-N 3.12Å; S237-Q241 VanDerWaalsContact O-N 3.09Å; P238-Q241 PolarHBondContact O-N 2.85Å; Q241-V244 WeakPolarHBondContact O-CG2 3.36Å; Q241-T245 PolarHBondContact O-N 3.19Å; Q241-T245 PolarHBondContact O-OG1 2.05Å
242	D	95.6	Very high	95.1	Very high	65 Å²	65	40.1 Å²	40.1	35%	0.348	21%	0.205	S	C	.	.	H	α-helix	trans	-73.5	-39.2	173.2	-166.1	61.9	0	0	0	112	K165 P238 V239 L240 V244 T245	K165-D242 PolarHBondContact NZ-O 2.89Å; P238-D242 WeakPolarHBondContact O-CB 3.48Å; P238-D242 PolarHBondContact O-N 3.06Å; V239-D242 PolarHBondContact O-N 2.98Å; L240-D242 PolarHBondContact O-N 3.28Å; D242-V244 VanDerWaalsContact C-N 3.33Å; D242-V244 PolarHBondContact O-N 3.15Å; D242-T245 WeakPolarHBondContact O-CB 3.14Å; D242-T245 PolarHBondContact O-N 2.68Å
243	W	96.9	Very high	95.4	Very high	1 Å²	1	29.9 Å²	29.9	0%	0.004	16%	0.16	C	C	.	.	H	α-helix	trans	-57.4	-40.8	175.5	176.9	-110.9	0	0	0	113.8	K165 M174 Y176 Q201 A203 F222 T224 R228 V239 L240 T245	K165-W243 PolarHBondContact NZ-O 2.94Å; M174-W243 HydrophobicContact CE-CZ3 4.36Å; Y176-W243 HydrophobicContact CD2-CD2 4.46Å; Y176-W243 AromaticContact CD2-CE2 3.83Å; Y176-W243 AromaticContact CD2-CH2 3.49Å; Y176-W243 HydrophobicContact CD2-CH2 3.49Å; Y176-W243 VanDerWaalsContact CD2-CH2 3.49Å; Y176-W243 AromaticContact CD2-CZ2 3.31Å; Y176-W243 HydrophobicContact CD2-CZ2 3.31Å; Y176-W243 HydrophobicContact CD2-CZ3 4.09Å; Y176-W243 AromaticContact CE2-CD2 3.96Å; Y176-W243 HydrophobicContact CE2-CD2 3.96Å; Y176-W243 AromaticContact CE2-CE2 3.46Å; Y176-W243 VanDerWaalsContact CE2-CE2 3.46Å; Y176-W243 HydrophobicContact CE2-CE3 4.36Å; Y176-W243 AromaticContact CE2-CH2 3.97Å; Y176-W243 HydrophobicContact CE2-CH2 3.97Å; Y176-W243 AromaticContact CE2-CZ2 3.49Å; Y176-W243 HydrophobicContact CE2-CZ2 3.49Å; Y176-W243 VanDerWaalsContact CE2-CZ2 3.49Å; Y176-W243 HydrophobicContact CE2-CZ3 4.35Å; Y176-W243 AromaticContact CE2-NE1 3.78Å; Y176-W243 WeakPolarHBondContact CE2-O 3.48Å; Y176-W243 WeakPolarHBondContact O-CH2 3.4Å; Y176-W243 PolarHBondContact OH-O 2.8Å; Q201-W243 HydrophobicContact CB-CE3 4.04Å; Q201-W243 HydrophobicContact CG-CB 4.29Å; Q201-W243 HydrophobicContact CG-CE3 4.45Å; Q201-W243 WeakPolarHBondContact O-CZ3 3.18Å; A203-W243 HydrophobicContact CB-CH2 4.24Å; F222-W243 HydrophobicContact CZ-CZ2 4.29Å; T224-W243 PolarHBondContact O-NE1 3.23Å; R228-W243 VanDerWaalsContact CZ-NE1 3.33Å; V239-W243 PolarHBondContact O-N 3.25Å; L240-W243 HydrophobicContact CD2-CB 4.39Å; L240-W243 WeakPolarHBondContact O-CB 3.38Å; L240-W243 PolarHBondContact O-N 2.77Å; L240-W243 VanDerWaalsContact O-N 3.15Å; W243-T245 VanDerWaalsContact C-N 3.28Å; W243-T245 PolarHBondContact O-N 2.87Å
244	V	97.1	Very high	95.5	Very high	4 Å²	4	26.1 Å²	26.1	2%	0.024	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-8.6	177.8	-56.8	0	0	0	0	113.1	E145 I146 L225 F234 L240 Q241 D242 V246	E145-V244 WeakPolarHBondContact CA-O 3.02Å; E145-V244 HydrophobicContact CB-CG2 3.9Å; E145-V244 HydrophobicContact CG-CG2 4.13Å; I146-V244 PolarHBondContact N-O 2.71Å; I146-V244 WeakPolarHBondContact O-CB 3.46Å; L225-V244 HydrophobicContact CD2-CG1 3.65Å; L225-V244 HydrophobicContact CG-CG1 4.13Å; F234-V244 HydrophobicContact CE2-CG1 4.12Å; F234-V244 HydrophobicContact CE2-CG2 3.64Å; F234-V244 HydrophobicContact CZ-CG2 3.63Å; L240-V244 WeakPolarHBondContact O-CG2 3.31Å; L240-V244 PolarHBondContact O-N 3.07Å; Q241-V244 WeakPolarHBondContact O-CG2 3.36Å; D242-V244 VanDerWaalsContact C-N 3.33Å; D242-V244 PolarHBondContact O-N 3.15Å; V244-V246 PolarHBondContact O-N 3.17Å
245	T	97.9	Very high	95.3	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.006	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	126.8	-179.4	-62.3	0	0	0	0	110.6	K143 F144 K165 M167 Q241 D242 W243 K301	K143-T245 HydrophobicContact CB-CG2 4.19Å; K143-T245 HydrophobicContact CD-CG2 4.05Å; K143-T245 HydrophobicContact CG-CG2 4.22Å; F144-T245 CarbonylContact O-C 3.52Å; F144-T245 VanDerWaalsContact O-CA 3.28Å; F144-T245 WeakPolarHBondContact O-CA 3.3Å; K165-T245 PolarHBondContact NZ-O 2.92Å; K165-T245 VanDerWaalsContact NZ-O 3.17Å; M167-T245 WeakPolarHBondContact CG-O 3Å; Q241-T245 PolarHBondContact O-N 3.19Å; Q241-T245 PolarHBondContact O-OG1 2.05Å; D242-T245 WeakPolarHBondContact O-CB 3.14Å; D242-T245 PolarHBondContact O-N 2.68Å; W243-T245 VanDerWaalsContact C-N 3.28Å; W243-T245 PolarHBondContact O-N 2.87Å; T245-K301 HydrophobicContact CG2-CD 3.82Å; T245-K301 PolarHBondContact OG1-NZ 3.45Å
246	V	97.6	Very high	95.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	139.7	-177.1	-174.6	0	0	0	0	110.7	K143 F144 I146 K165 S166 Y176 V244 D248 I249	K143-V246 CarbonylContact C-O 3.55Å; K143-V246 WeakPolarHBondContact CA-O 3.32Å; F144-V246 PolarHBondContact N-O 3.01Å; F144-V246 PolarHBondContact O-N 3.37Å; I146-V246 HydrophobicContact CB-CG2 4.17Å; I146-V246 HydrophobicContact CG1-CB 3.79Å; I146-V246 HydrophobicContact CG1-CG2 3.7Å; K165-V246 HydrophobicContact CB-CG1 3.99Å; K165-V246 HydrophobicContact CB-CG2 4.14Å; K165-V246 HydrophobicContact CD-CG2 3.81Å; S166-V246 WeakPolarHBondContact O-CA 3.12Å; Y176-V246 HydrophobicContact CE1-CG2 3.64Å; V244-V246 PolarHBondContact O-N 3.17Å; V246-D248 WeakPolarHBondContact CG1-O 3.18Å; V246-I249 HydrophobicContact CG1-CD1 4.18Å; V246-I249 HydrophobicContact CG1-CG1 3.54Å
247	T	97.5	Very high	94.7	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	-33.2	166.6	55.9	0	0	0	0	112.3	L140 K143 S166 D168 Y169	L140-T247 WeakPolarHBondContact CB-O 3.07Å; L140-T247 WeakPolarHBondContact CG-O 3.07Å; L140-T247 PolarHBondContact N-O 3.2Å; K143-T247 HydrophobicContact CB-CG2 4.43Å; K143-T247 HydrophobicContact CG-CG2 3.5Å; K143-T247 VanDerWaalsContact CG-CG2 3.5Å; S166-T247 PolarHBondContact O-N 2.87Å; S166-T247 PolarHBondContact O-OG1 3.45Å; D168-T247 PolarHBondContact N-OG1 3.35Å; Y169-T247 HydrophobicContact CD1-CG2 4.18Å; Y169-T247 HydrophobicContact CD2-CG2 4.48Å; Y169-T247 HydrophobicContact CE1-CG2 4.13Å; Y169-T247 HydrophobicContact CE2-CG2 4.41Å; Y169-T247 HydrophobicContact CG-CG2 4.37Å; Y169-T247 PolarHBondContact N-OG1 3.14Å
248	D	98.1	Very high	93.5	Very high	7 Å²	7	25.3 Å²	25.3	4%	0.037	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	146	-176.1	-46.8	-103.4	0	0	0	109.5	L138 S139 K165 S166 Y169 G170 W173 V246	L138-D248 CarbonylContact O-C 3.58Å; L138-D248 VanDerWaalsContact O-CA 3.24Å; L138-D248 WeakPolarHBondContact O-CA 3.38Å; S139-D248 VanDerWaalsContact CA-OD1 3.26Å; S139-D248 WeakPolarHBondContact CA-OD1 3.32Å; S139-D248 WeakPolarHBondContact CB-OD1 3.06Å; S139-D248 PolarHBondContact OG-OD1 2.89Å; K165-D248 CarbonylContact C-O 3.56Å; K165-D248 WeakPolarHBondContact CA-O 3.36Å; S166-D248 PolarHBondContact N-O 2.99Å; Y169-D248 VanDerWaalsContact C-OD2 3.27Å; Y169-D248 WeakPolarHBondContact CA-OD2 3.43Å; G170-D248 PolarHBondContact N-OD2 2.83Å; W173-D248 HydrophobicContact CH2-CB 3.65Å; W173-D248 HydrophobicContact CZ2-CB 4.35Å; W173-D248 HydrophobicContact CZ3-CB 4.26Å; V246-D248 WeakPolarHBondContact CG1-O 3.18Å
249	I	98.3	Very high	91.9	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	135.8	178.5	-64.4	-178.8	0	0	0	108.4	T137 L138 V149 I163 V246 V251 F294 V296	T137-I249 WeakPolarHBondContact CA-O 3.47Å; L138-I249 PolarHBondContact N-O 3.4Å; L138-I249 PolarHBondContact O-N 3.43Å; V149-I249 HydrophobicContact CG1-CG2 4.42Å; V149-I249 HydrophobicContact CG2-CD1 3.72Å; I163-I249 HydrophobicContact CG2-CG2 4.14Å; V246-I249 HydrophobicContact CG1-CD1 4.18Å; V246-I249 HydrophobicContact CG1-CG1 3.54Å; I249-V251 HydrophobicContact CG2-CG2 4.33Å; I249-F294 HydrophobicContact CG2-CZ 3.99Å; I249-V296 HydrophobicContact CD1-CB 4.22Å; I249-V296 HydrophobicContact CD1-CG1 3.44Å; I249-V296 VanDerWaalsContact CD1-CG1 3.44Å; I249-V296 HydrophobicContact CD1-CG2 3.66Å
250	R	98.1	Very high	89.9	Confident	77 Å²	77	30.6 Å²	30.6	29%	0.291	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	126	173.4	175.6	-176	-63	168.9	0.2	109.6	L136 T137 I163 Y164 W173 V252	L136-R250 CarbonylContact O-C 3.36Å; L136-R250 VanDerWaalsContact O-CA 3.23Å; L136-R250 WeakPolarHBondContact O-CA 3.28Å; T137-R250 WeakPolarHBondContact OG1-CG 3.29Å; T137-R250 PolarHBondContact OG1-NE 2.98Å; I163-R250 CarbonylContact C-O 3.48Å; Y164-R250 PolarHBondContact N-O 3.43Å; Y164-R250 PolarHBondContact O-N 2.95Å; W173-R250 VanDerWaalsContact CE2-CZ 3.4Å; W173-R250 HydrophobicContact CE3-CB 3.71Å; W173-R250 HydrophobicContact CH2-CB 3.69Å; W173-R250 HydrophobicContact CZ2-CB 4.5Å; W173-R250 VanDerWaalsContact CZ2-NH2 3.33Å; W173-R250 HydrophobicContact CZ3-CB 3.26Å; W173-R250 VanDerWaalsContact NE1-NH2 3.16Å; R250-V252 HydrophobicContact CG-CG2 4Å
251	V	97.7	Very high	87.7	Confident	0 Å²	0	38 Å²	38	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	133	172.8	-173.9	0	0	0	0	107.9	T135 L136 L151 L161 A162 I249 F253 F294	T135-V251 CarbonylContact C-O 3.51Å; T135-V251 VanDerWaalsContact CA-O 3.26Å; T135-V251 WeakPolarHBondContact CA-O 3.44Å; L136-V251 HydrophobicContact CB-CB 4.37Å; L136-V251 PolarHBondContact N-O 3.15Å; L136-V251 PolarHBondContact O-N 2.97Å; L151-V251 HydrophobicContact CD1-CG1 4.47Å; L151-V251 HydrophobicContact CD1-CG2 4.26Å; L151-V251 HydrophobicContact CD2-CG1 4.12Å; L151-V251 HydrophobicContact CD2-CG2 4.36Å; L161-V251 HydrophobicContact CD1-CG1 3.91Å; L161-V251 HydrophobicContact CD2-CG1 4.08Å; L161-V251 HydrophobicContact CG-CG1 3.99Å; A162-V251 CarbonylContact O-C 3.59Å; A162-V251 WeakPolarHBondContact O-CA 3.32Å; I249-V251 HydrophobicContact CG2-CG2 4.33Å; V251-F253 HydrophobicContact CG1-CD1 4.09Å; V251-F253 HydrophobicContact CG1-CE1 3.48Å; V251-F253 VanDerWaalsContact CG1-CE1 3.48Å; V251-F253 HydrophobicContact CG1-CZ 4.1Å; V251-F294 HydrophobicContact CG2-CE2 4.2Å; V251-F294 HydrophobicContact CG2-CZ 4.05Å
252	V	96.9	Very high	85.4	Confident	15 Å²	15	41.7 Å²	41.7	9%	0.091	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	118.4	180	-175.4	0	0	0	0	108.5	N133 V134 T135 L161 A162 Y164 R250	N133-V252 HydrophobicContact CB-CG1 3.92Å; V134-V252 WeakPolarHBondContact O-CA 3.24Å; T135-V252 HydrophobicContact CG2-CB 4.49Å; T135-V252 HydrophobicContact CG2-CG1 4.2Å; T135-V252 HydrophobicContact CG2-CG2 3.97Å; L161-V252 CarbonylContact C-O 3.54Å; L161-V252 WeakPolarHBondContact CA-O 3.23Å; A162-V252 HydrophobicContact CB-CB 4.46Å; A162-V252 PolarHBondContact N-O 3.44Å; A162-V252 PolarHBondContact O-N 3.03Å; Y164-V252 HydrophobicContact CD2-CG2 3.9Å; Y164-V252 HydrophobicContact CE2-CB 4.33Å; Y164-V252 HydrophobicContact CE2-CG2 3.78Å; R250-V252 HydrophobicContact CG-CG2 4Å
253	F	94.9	Very high	82.9	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	119.4	171.3	-48.3	-44.7	0	0	0	108.1	W122 H132 N133 V134 L136 L151 F153 P158 L161 V251 Y289 V291	W122-F253 HydrophobicContact CH2-CE2 4.03Å; W122-F253 AromaticContact CZ3-CE2 3.88Å; W122-F253 HydrophobicContact CZ3-CE2 3.88Å; H132-F253 VanDerWaalsContact O-O 3.09Å; N133-F253 VanDerWaalsContact CA-O 3.32Å; N133-F253 WeakPolarHBondContact CA-O 3.45Å; V134-F253 HydrophobicContact CB-CB 4.42Å; V134-F253 HydrophobicContact CB-CD2 4.06Å; V134-F253 HydrophobicContact CG1-CD2 4.15Å; V134-F253 PolarHBondContact N-O 3.41Å; V134-F253 PolarHBondContact O-N 2.76Å; L136-F253 HydrophobicContact CD1-CE2 3.84Å; L136-F253 HydrophobicContact CD1-CZ 3.59Å; L136-F253 HydrophobicContact CD2-CE2 4.41Å; L136-F253 HydrophobicContact CG-CE2 3.92Å; L136-F253 HydrophobicContact CG-CZ 4.06Å; L151-F253 HydrophobicContact CD2-CE1 4.24Å; L151-F253 HydrophobicContact CD2-CZ 4.05Å; F153-F253 HydrophobicContact CE1-CE1 4.03Å; F153-F253 HydrophobicContact CE1-CZ 4.15Å; F153-F253 AromaticContact CZ-CE1 3.95Å; F153-F253 HydrophobicContact CZ-CE1 3.95Å; F153-F253 HydrophobicContact CZ-CZ 4.36Å; P158-F253 HydrophobicContact CG-CB 4.42Å; P158-F253 HydrophobicContact CG-CD1 3.81Å; P158-F253 HydrophobicContact CG-CE1 4.38Å; P158-F253 HydrophobicContact CG-CG 4.26Å; L161-F253 HydrophobicContact CD1-CD1 3.59Å; L161-F253 HydrophobicContact CD1-CE1 3.49Å; L161-F253 VanDerWaalsContact CD1-CE1 3.49Å; L161-F253 HydrophobicContact CG-CD1 4.03Å; L161-F253 HydrophobicContact CG-CE1 4.29Å; V251-F253 HydrophobicContact CG1-CD1 4.09Å; V251-F253 HydrophobicContact CG1-CE1 3.48Å; V251-F253 VanDerWaalsContact CG1-CE1 3.48Å; V251-F253 HydrophobicContact CG1-CZ 4.1Å; F253-Y289 HydrophobicContact CB-CD1 4.23Å; F253-Y289 HydrophobicContact CB-CD2 4.04Å; F253-Y289 HydrophobicContact CB-CE1 4Å; F253-Y289 HydrophobicContact CB-CE2 3.79Å; F253-Y289 HydrophobicContact CB-CG 4.23Å; F253-Y289 HydrophobicContact CD2-CD1 4.4Å; F253-Y289 HydrophobicContact CD2-CD2 4.1Å; F253-Y289 AromaticContact CD2-CG 3.92Å; F253-Y289 HydrophobicContact CD2-CG 3.92Å; F253-Y289 HydrophobicContact CG-CD1 4.34Å; F253-Y289 HydrophobicContact CG-CD2 4.44Å; F253-Y289 HydrophobicContact CG-CG 4.27Å; F253-V291 HydrophobicContact CE2-CG2 4.36Å; F253-V291 HydrophobicContact CZ-CG2 3.97Å
254	S	91.6	Very high	80.3	Confident	6 Å²	6	49.9 Å²	49.9	4%	0.042	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-36.1	-170.3	-48.8	0	0	0	0	113	S160 Y187	S160-S254 PolarHBondContact O-N 3.44Å; Y187-S254 PolarHBondContact OH-OG 2.02Å
255	R	89.3	Confident	77.6	Confident	70 Å²	70	52.9 Å²	52.9	26%	0.264	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	132.9	180	-165.8	178.7	-65	162.4	-14	111.5	E159 S160 M186 Y289	E159-R255 HydrophobicContact CB-CB 4.43Å; E159-R255 HydrophobicContact CB-CG 4.47Å; E159-R255 PolarHBondContact N-O 3.42Å; E159-R255 VanDerWaalsContact OE2-CD 3.28Å; E159-R255 WeakPolarHBondContact OE2-CD 3.35Å; E159-R255 IonicContact OE2-NE 2.7Å; E159-R255 IonicContact OE2-NH1 2.93Å; S160-R255 PolarHBondContact N-O 3.17Å; S160-R255 PolarHBondContact O-N 2.02Å; M186-R255 HydrophobicContact CE-CB 4.27Å; M186-R255 VanDerWaalsContact CE-NH2 3.25Å; R255-Y289 PolarHBondContact O-OH 2.86Å
256	P	86.9	Confident	74.9	Confident	8 Å²	8	59 Å²	59	5%	0.052	32%	0.322	C	S	.	.			trans	-77.7	162	175.6	34.9	-39.9	0	0	0	111.9	E159 L258 Y287 Y289	E159-P256 WeakPolarHBondContact CB-O 3.41Å; P256-L258 HydrophobicContact CG-CG 4.43Å; P256-Y287 HydrophobicContact CB-CD1 4.47Å; P256-Y287 HydrophobicContact CB-CD2 3.36Å; P256-Y287 HydrophobicContact CB-CE2 3.56Å; P256-Y287 HydrophobicContact CB-CG 3.84Å; P256-Y287 HydrophobicContact CG-CD1 3.95Å; P256-Y287 HydrophobicContact CG-CD2 3.59Å; P256-Y287 HydrophobicContact CG-CE1 3.84Å; P256-Y287 HydrophobicContact CG-CE2 3.42Å; P256-Y287 VanDerWaalsContact CG-CE2 3.42Å; P256-Y287 HydrophobicContact CG-CG 3.83Å; P256-Y289 HydrophobicContact CB-CE1 4.35Å; P256-Y289 WeakPolarHBondContact CD-OH 3.37Å
257	Q	79.3	Confident	72	Confident	42 Å²	42	62.1 Å²	62.1	20%	0.196	35%	0.354	C	S	.	.			trans	-81.6	130.6	160.7	-70.3	-70.7	-5	0	0	109.1	R157 E159 T210 M212	R157-Q257 WeakPolarHBondContact O-CG 3.42Å; E159-Q257 HydrophobicContact CB-CG 4.1Å; T210-Q257 PolarHBondContact O-NE2 3.17Å; M212-Q257 HydrophobicContact CG-CB 4.44Å
258	L	70	Confident	69.3	Low	64 Å²	64	68.3 Å²	68.3	34%	0.335	40%	0.397	S	S	.	.			trans	-112.1	123.1	177.9	-71.6	153.4	0	0	0	108.7	P256 R260 L284 P285	P256-L258 HydrophobicContact CG-CG 4.43Å; L258-R260 PolarHBondContact O-N 2.81Å; L258-L284 HydrophobicContact CD1-CD1 4.32Å; L258-L284 HydrophobicContact CD1-CD2 3.43Å; L258-L284 VanDerWaalsContact CD1-CD2 3.43Å; L258-L284 HydrophobicContact CD1-CG 4.47Å; L258-L284 HydrophobicContact CD2-CD2 4.14Å; L258-L284 HydrophobicContact CG-CD2 4.43Å; L258-P285 HydrophobicContact CD2-CG 3.82Å
259	P	60.6	Low	66.3	Low	36 Å²	36	73.2 Å²	73.2	23%	0.234	43%	0.432	C	S	.	.			trans	-58.2	125.5	173.3	-13.9	21.8	0	0	0	110.4	M212 E261 L262	M212-P259 HydrophobicContact CE-CB 3.59Å; M212-P259 HydrophobicContact CE-CG 3.38Å; M212-P259 HydrophobicContact SD-CB 4.41Å; P259-E261 PolarHBondContact O-N 3.04Å; P259-L262 HydrophobicContact CB-CD1 4.32Å; P259-L262 HydrophobicContact CG-CD1 3.93Å; P259-L262 PolarHBondContact O-N 3.27Å
260	R	53.1	Low	63.4	Low	224 Å²	224	80.3 Å²	80.3	85%	0.845	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-58.5	-27.9	179.6	-105.5	179.9	160.3	156.6	-5.5	113.4	L258 L262 A263	L258-R260 PolarHBondContact O-N 2.81Å; R260-L262 VanDerWaalsContact C-N 3.34Å; R260-L262 PolarHBondContact O-N 2.86Å; R260-A263 PolarHBondContact O-N 2.81Å
261	E	49.1	Very low	60.5	Low	155 Å²	155	80.4 Å²	80.4	72%	0.724	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-68.7	-28.1	-179.8	-67.8	-178.5	164.6	0	0	113.5	P259 A263 L264 G265	P259-E261 PolarHBondContact O-N 3.04Å; E261-A263 VanDerWaalsContact C-N 3.28Å; E261-A263 PolarHBondContact O-N 2.88Å; E261-L264 PolarHBondContact O-N 3.29Å; E261-G265 PolarHBondContact O-N 3.17Å
262	L	47	Very low	57.4	Low	101 Å²	101	84 Å²	84	53%	0.529	54%	0.537	S	S	.	.	G	3₁₀ helix	trans	-77.6	-12.2	175.6	-77.2	162.9	0	0	0	113.3	P259 R260	P259-L262 HydrophobicContact CB-CD1 4.32Å; P259-L262 HydrophobicContact CG-CD1 3.93Å; P259-L262 PolarHBondContact O-N 3.27Å; R260-L262 VanDerWaalsContact C-N 3.34Å; R260-L262 PolarHBondContact O-N 2.86Å
263	A	42.2	Very low	54.5	Low	91 Å²	91	95.2 Å²	95.2	75%	0.752	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-85.6	-16.2	173.9	0	0	0	0	0	112.9	R260 E261	R260-A263 PolarHBondContact O-N 2.81Å; E261-A263 VanDerWaalsContact C-N 3.28Å; E261-A263 PolarHBondContact O-N 2.88Å
264	L	43.8	Very low	52.1	Low	147 Å²	147	102.2 Å²	102.2	77%	0.77	62%	0.615	S	S	*	*	S	Bend	trans	-106.8	-2.8	-179.4	-80.9	131.6	0	0	0	113.4	E261 S266	E261-L264 PolarHBondContact O-N 3.29Å; L264-S266 PolarHBondContact O-N 2.79Å
265	G	39	Very low	49.6	Very low	67 Å²	67	109.7 Å²	109.7	69%	0.691	66%	0.655	S	S	*	*	S	Bend	trans	-89.8	29.3	-172	0	0	0	0	0	117	E261	E261-G265 PolarHBondContact O-N 3.17Å
266	S	42	Very low	46.9	Very low	130 Å²	130	113.1 Å²	113.1	91%	0.909	68%	0.679	S	S	*	*	S	Bend	trans	-141.7	52.9	170	-166.6	0	0	0	0	111.7	L264	L264-S266 PolarHBondContact O-N 2.79Å
267	G	36.9	Very low	44.9	Very low	65 Å²	65	118.7 Å²	118.7	67%	0.67	72%	0.715	S	S	*	*			trans	-155.5	54.3	179.3	0	0	0	0	0	112.3
268	S	41.2	Very low	43.1	Very low	130 Å²	130	124.8 Å²	124.8	91%	0.909	75%	0.745	S	S	*	*			trans	-129.2	78	165.2	-68.2	0	0	0	0	109.2
269	S	33.9	Very low	41.4	Very low	109 Å²	109	125.9 Å²	125.9	76%	0.762	76%	0.764	S	S	*	*			trans	-153.4	99.6	156.6	58	0	0	0	0	109.3
270	V	37.8	Very low	40.4	Very low	149 Å²	149	131.1 Å²	131.1	90%	0.903	80%	0.795	S	S	*	*			trans	7	119.4	138.4	-179	0	0	0	0	116.2
271	G	37.8	Very low	39.7	Very low	80 Å²	80	125.7 Å²	125.7	83%	0.825	79%	0.786	S	S	*	*			trans	84.7	117.7	141	0	0	0	0	0	118.6
272	G	33.1	Very low	39.5	Very low	76 Å²	76	123.6 Å²	123.6	78%	0.784	79%	0.789	S	S	*	*			trans	130.9	98.8	148.8	0	0	0	0	0	116.9
273	R	35.7	Very low	39.7	Very low	249 Å²	249	123.9 Å²	123.9	94%	0.94	80%	0.795	S	S	*	*			trans	49.8	144.5	142.9	-72.8	178.4	169.7	174.5	-4.1	121.6
274	D	43.9	Very low	40.5	Very low	147 Å²	147	122.1 Å²	122.1	79%	0.786	77%	0.773	S	S	*	*			trans	-58.8	164.1	-174.5	-56.5	-71.7	0	0	0	115.9
275	D	39.1	Very low	41.8	Very low	163 Å²	163	118 Å²	118	87%	0.872	76%	0.755	S	S	*	*			trans	92.6	84.6	165.1	-61.9	-49.3	0	0	0	118.6
276	D	32.2	Very low	43.7	Very low	143 Å²	143	118.9 Å²	118.9	77%	0.765	75%	0.747	S	S	*	*				-169.4	116.3	128.4	-144.6	-16.7	0	0	0	112.6	M278	D276-M278 PolarHBondContact O-N 3.46Å
277	P	44.3	Very low	45.8	Very low	124 Å²	124	113.6 Å²	113.6	81%	0.805	71%	0.707	S	S	*	*			trans	-97.8	55.2	175.8	37	-30.8	0	0	0	112
278	M	41.3	Very low	48.3	Very low	171 Å²	171	111.9 Å²	111.9	84%	0.842	68%	0.681	S	S	*	*			trans	-163.8	87.6	174	-120.2	177.9	149.6	0	0	113.9	D276	D276-M278 PolarHBondContact O-N 3.46Å
279	A	34.6	Very low	50.8	Low	87 Å²	87	105.9 Å²	105.9	72%	0.719	64%	0.639	S	S	*	*			trans	167.1	77.4	144.1	0	0	0	0	0	111.6	T281	A279-T281 VanDerWaalsContact C-N 3.28Å; A279-T281 PolarHBondContact O-N 3.09Å
280	V	39.7	Very low	53.6	Low	146 Å²	146	100.9 Å²	100.9	89%	0.885	60%	0.604	S	S	*	*			trans	-82.8	85.6	154.1	-173.1	0	0	0	0	106.2	S282	V280-S282 PolarHBondContact O-N 3.27Å
281	T	38.7	Very low	56.4	Low	109 Å²	109	93.8 Å²	93.8	67%	0.669	56%	0.561	S	S	*	*			trans	-57.3	112.3	169.4	36.4	0	0	0	0	108.6	A279 T283	A279-T281 VanDerWaalsContact C-N 3.28Å; A279-T281 PolarHBondContact O-N 3.09Å; T281-T283 PolarHBondContact O-N 3.08Å
282	S	45.3	Very low	59	Low	111 Å²	111	90 Å²	90	78%	0.776	52%	0.522	S	S	*	.			trans	-73.4	41.6	-176.8	42	0	0	0	0	113.4	V280 L284	V280-S282 PolarHBondContact O-N 3.27Å; S282-L284 PolarHBondContact O-N 2.99Å
283	T	50.3	Low	61.9	Low	108 Å²	108	87 Å²	87	66%	0.663	49%	0.488	S	S	*	.			trans	-83.9	101.1	172.6	39.8	0	0	0	0	109.4	T281	T281-T283 PolarHBondContact O-N 3.08Å
284	L	59.8	Low	64.7	Low	54 Å²	54	75.1 Å²	75.1	28%	0.283	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-64.3	148.2	172.9	-75.3	167.6	0	0	0	110.4	N128 L258 S282 T286	N128-L284 PolarHBondContact O-N 2.88Å; L258-L284 HydrophobicContact CD1-CD1 4.32Å; L258-L284 HydrophobicContact CD1-CD2 3.43Å; L258-L284 VanDerWaalsContact CD1-CD2 3.43Å; L258-L284 HydrophobicContact CD1-CG 4.47Å; L258-L284 HydrophobicContact CD2-CD2 4.14Å; L258-L284 HydrophobicContact CG-CD2 4.43Å; S282-L284 PolarHBondContact O-N 2.99Å; L284-T286 PolarHBondContact O-N 3.23Å
285	P	71.3	Confident	67.2	Low	61 Å²	61	70.9 Å²	70.9	40%	0.396	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-57.5	141.8	169.3	24.9	-32.2	0	0	0	109.7	L258 Y287	L258-P285 HydrophobicContact CD2-CG 3.82Å; P285-Y287 PolarHBondContact O-N 3.04Å
286	T	78.5	Confident	70	Confident	85 Å²	85	63.1 Å²	63.1	52%	0.521	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-54.9	125.9	-179	-48.5	0	0	0	0	111	N126 L127 L284	N126-T286 HydrophobicContact CB-CG2 3.38Å; L127-T286 WeakPolarHBondContact O-CA 3.38Å; L284-T286 PolarHBondContact O-N 3.23Å
287	Y	85.7	Confident	73.1	Confident	18 Å²	18	56.3 Å²	56.3	7%	0.071	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-130.2	163.6	178.9	69.7	-87.7	0	0	0	110.9	L127 T129 P256 P285 Y289	L127-Y287 HydrophobicContact CB-CD1 4.26Å; L127-Y287 HydrophobicContact CB-CD2 4.23Å; L127-Y287 HydrophobicContact CB-CE1 3.76Å; L127-Y287 HydrophobicContact CB-CE2 3.76Å; L127-Y287 HydrophobicContact CB-CG 4.48Å; L127-Y287 VanDerWaalsContact CB-CZ 3.49Å; L127-Y287 HydrophobicContact CD1-CD2 4.47Å; L127-Y287 HydrophobicContact CD1-CE2 3.68Å; L127-Y287 HydrophobicContact CG-CE2 4.35Å; L127-Y287 PolarHBondContact N-O 2.91Å; L127-Y287 VanDerWaalsContact O-CD1 3.26Å; L127-Y287 WeakPolarHBondContact O-CD1 3.38Å; L127-Y287 PolarHBondContact O-N 3.46Å; T129-Y287 PolarHBondContact O-OH 2.82Å; P256-Y287 HydrophobicContact CB-CD1 4.47Å; P256-Y287 HydrophobicContact CB-CD2 3.36Å; P256-Y287 HydrophobicContact CB-CE2 3.56Å; P256-Y287 HydrophobicContact CB-CG 3.84Å; P256-Y287 HydrophobicContact CG-CD1 3.95Å; P256-Y287 HydrophobicContact CG-CD2 3.59Å; P256-Y287 HydrophobicContact CG-CE1 3.84Å; P256-Y287 HydrophobicContact CG-CE2 3.42Å; P256-Y287 VanDerWaalsContact CG-CE2 3.42Å; P256-Y287 HydrophobicContact CG-CG 3.83Å; P285-Y287 PolarHBondContact O-N 3.04Å; Y287-Y289 AromaticContact CE2-CE2 3.98Å; Y287-Y289 HydrophobicContact CE2-CE2 3.98Å
288	F	91	Very high	75.6	Confident	30 Å²	30	50.4 Å²	50.4	13%	0.132	30%	0.302	C	S	.	.			trans	-149.2	161.6	176.8	60.9	-90	0	0	0	109.9	Q123 A290	Q123-F288 HydrophobicContact CG-CB 4.5Å; Q123-F288 HydrophobicContact CG-CD2 3.54Å; Q123-F288 HydrophobicContact CG-CE2 4.04Å; Q123-F288 HydrophobicContact CG-CG 4.22Å; F288-A290 HydrophobicContact CD2-CB 4.18Å; F288-A290 HydrophobicContact CE2-CB 4.04Å
289	Y	92.9	Very high	78.2	Confident	3 Å²	3	45.3 Å²	45.3	1%	0.012	27%	0.274	C	S	.	.			trans	-104.6	133.6	170.9	-60.2	-71.2	0	0	0	109.3	Q123 S124 L127 V134 P158 F253 R255 P256 Y287	Q123-Y289 WeakPolarHBondContact CA-O 3.48Å; S124-Y289 PolarHBondContact N-O 2.83Å; S124-Y289 PolarHBondContact OG-N 3.28Å; L127-Y289 HydrophobicContact CD1-CD2 4.38Å; L127-Y289 HydrophobicContact CD1-CE2 4.08Å; V134-Y289 HydrophobicContact CB-CD2 4.13Å; V134-Y289 HydrophobicContact CB-CE2 4.43Å; V134-Y289 HydrophobicContact CG2-CD2 3.94Å; V134-Y289 HydrophobicContact CG2-CE2 4.12Å; P158-Y289 HydrophobicContact CB-CE1 3.88Å; P158-Y289 HydrophobicContact CG-CD1 3.9Å; P158-Y289 HydrophobicContact CG-CE1 3.77Å; F253-Y289 HydrophobicContact CB-CD1 4.23Å; F253-Y289 HydrophobicContact CB-CD2 4.04Å; F253-Y289 HydrophobicContact CB-CE1 4Å; F253-Y289 HydrophobicContact CB-CE2 3.79Å; F253-Y289 HydrophobicContact CB-CG 4.23Å; F253-Y289 HydrophobicContact CD2-CD1 4.4Å; F253-Y289 HydrophobicContact CD2-CD2 4.1Å; F253-Y289 AromaticContact CD2-CG 3.92Å; F253-Y289 HydrophobicContact CD2-CG 3.92Å; F253-Y289 HydrophobicContact CG-CD1 4.34Å; F253-Y289 HydrophobicContact CG-CD2 4.44Å; F253-Y289 HydrophobicContact CG-CG 4.27Å; R255-Y289 PolarHBondContact O-OH 2.86Å; P256-Y289 HydrophobicContact CB-CE1 4.35Å; P256-Y289 WeakPolarHBondContact CD-OH 3.37Å; Y287-Y289 AromaticContact CE2-CE2 3.98Å; Y287-Y289 HydrophobicContact CE2-CE2 3.98Å
290	A	93.6	Very high	81.1	Confident	4 Å²	4	41.6 Å²	41.6	3%	0.033	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	128.7	172.8	0	0	0	0	0	110.8	W122 Q123 F153 C154 S155 F288	W122-A290 CarbonylContact O-C 3.49Å; W122-A290 WeakPolarHBondContact O-CA 3.5Å; Q123-A290 HydrophobicContact CB-CB 4.39Å; Q123-A290 HydrophobicContact CG-CB 4.2Å; F153-A290 WeakPolarHBondContact CA-O 3.24Å; C154-A290 HydrophobicContact CB-CB 3.94Å; C154-A290 PolarHBondContact N-O 3Å; S155-A290 PolarHBondContact N-O 3.47Å; S155-A290 PolarHBondContact OG-N 3.49Å; S155-A290 PolarHBondContact OG-O 3.02Å; F288-A290 HydrophobicContact CD2-CB 4.18Å; F288-A290 HydrophobicContact CE2-CB 4.04Å
291	V	95.2	Very high	83.9	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	127.7	-177.9	-179.9	0	0	0	0	108.2	L110 C121 W122 L151 Q152 F153 F253	L110-V291 HydrophobicContact CD2-CB 3.6Å; L110-V291 HydrophobicContact CD2-CG1 3.61Å; C121-V291 WeakPolarHBondContact CA-O 3.04Å; W122-V291 HydrophobicContact CE3-CB 4.02Å; W122-V291 HydrophobicContact CE3-CG2 4.12Å; W122-V291 HydrophobicContact CZ3-CB 4.46Å; W122-V291 HydrophobicContact CZ3-CG2 4.05Å; W122-V291 PolarHBondContact N-O 2.95Å; W122-V291 PolarHBondContact O-N 3Å; L151-V291 HydrophobicContact CB-CG1 4.35Å; L151-V291 HydrophobicContact CD2-CG1 4.29Å; L151-V291 HydrophobicContact CD2-CG2 4.48Å; Q152-V291 CarbonylContact O-C 3.16Å; Q152-V291 WeakPolarHBondContact O-CG1 3.35Å; F153-V291 HydrophobicContact CD1-CG2 3.72Å; F153-V291 HydrophobicContact CE1-CG2 3.62Å; F153-V291 HydrophobicContact CG-CG2 4.45Å; F153-V291 HydrophobicContact CZ-CG2 4.3Å; F253-V291 HydrophobicContact CE2-CG2 4.36Å; F253-V291 HydrophobicContact CZ-CG2 3.97Å
292	G	92.4	Very high	86.7	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-44.9	178.2	0	0	0	0	0	112.6	N114 T120 Q152 C154	N114-G292 PolarHBondContact ND2-O 2.86Å; T120-G292 WeakPolarHBondContact O-CA 3.05Å; Q152-G292 PolarHBondContact O-N 3.44Å; C154-G292 VanDerWaalsContact SG-CA 3.5Å; C154-G292 PolarHBondContact SG-N 3.45Å; C154-G292 VanDerWaalsContact SG-N 3.44Å
293	D	93.7	Very high	89.2	Confident	14 Å²	14	26 Å²	26	8%	0.075	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	133.9	-174.9	-169.3	25.1	0	0	0	111.2	L151 Q152 Q295	L151-D293 CarbonylContact C-O 3.54Å; L151-D293 VanDerWaalsContact CA-O 3.31Å; L151-D293 WeakPolarHBondContact CA-O 3.46Å; Q152-D293 HydrophobicContact CB-CB 4.13Å; Q152-D293 PolarHBondContact N-O 3.19Å; Q152-D293 PolarHBondContact O-N 2.63Å; D293-Q295 VanDerWaalsContact OD2-CD 3.28Å; D293-Q295 WeakPolarHBondContact OD2-CG 3.07Å; D293-Q295 PolarHBondContact OD2-NE2 3.09Å
294	F	95.6	Very high	91.4	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	101.7	177.5	179.3	-156.8	0	0	0	109.7	A59 V64 L110 L138 V149 L151 I249 V251 V296	A59-F294 VanDerWaalsContact CB-O 3.22Å; A59-F294 WeakPolarHBondContact CB-O 3.29Å; V64-F294 HydrophobicContact CG1-CD1 4.47Å; V64-F294 HydrophobicContact CG2-CD1 4.15Å; L110-F294 HydrophobicContact CB-CB 4.13Å; L110-F294 HydrophobicContact CD2-CB 4.47Å; L110-F294 WeakPolarHBondContact O-CA 3.28Å; L110-F294 WeakPolarHBondContact O-CB 3.42Å; L110-F294 PolarHBondContact O-N 2.86Å; L138-F294 HydrophobicContact CB-CE1 3.78Å; L138-F294 HydrophobicContact CB-CZ 4.33Å; L138-F294 HydrophobicContact CD2-CE1 4.12Å; L138-F294 HydrophobicContact CD2-CZ 4.33Å; V149-F294 HydrophobicContact CG1-CE2 3.72Å; L151-F294 HydrophobicContact CD1-CD2 4.44Å; L151-F294 HydrophobicContact CD2-CD2 4.37Å; L151-F294 HydrophobicContact CG-CD2 3.98Å; L151-F294 HydrophobicContact CG-CE2 4.48Å; I249-F294 HydrophobicContact CG2-CZ 3.99Å; V251-F294 HydrophobicContact CG2-CE2 4.2Å; V251-F294 HydrophobicContact CG2-CZ 4.05Å; F294-V296 HydrophobicContact CD2-CG2 4.4Å; F294-V296 HydrophobicContact CE2-CG2 3.8Å; F294-V296 HydrophobicContact CZ-CG2 4.06Å
295	Q	95.8	Very high	93.2	Very high	57 Å²	57	18.5 Å²	18.5	27%	0.266	10%	0.097	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	142.2	-178.3	-48.1	-174.6	-12.2	0	0	112	Y148 V149 S150 D293	Y148-Q295 HydrophobicContact CE2-CB 4.17Å; Y148-Q295 PolarHBondContact OH-OE1 2.85Å; V149-Q295 WeakPolarHBondContact CA-O 3.26Å; S150-Q295 PolarHBondContact N-O 3.12Å; S150-Q295 PolarHBondContact O-N 3.45Å; S150-Q295 WeakPolarHBondContact OG-CB 3.37Å; D293-Q295 VanDerWaalsContact OD2-CD 3.28Å; D293-Q295 WeakPolarHBondContact OD2-CG 3.07Å; D293-Q295 PolarHBondContact OD2-NE2 3.09Å
296	V	97.4	Very high	94.5	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	90.3	176	175	0	0	0	0	107.1	N57 A58 A59 L138 I146 V149 I249 F294	N57-V296 PolarHBondContact OD1-N 3.17Å; A58-V296 HydrophobicContact CB-CG1 4.38Å; A58-V296 PolarHBondContact N-O 3.31Å; A59-V296 HydrophobicContact CB-CB 4.09Å; A59-V296 HydrophobicContact CB-CG2 4.07Å; L138-V296 HydrophobicContact CD2-CB 4.37Å; L138-V296 HydrophobicContact CD2-CG2 3.74Å; I146-V296 HydrophobicContact CD1-CG1 3.42Å; I146-V296 VanDerWaalsContact CD1-CG1 3.42Å; I146-V296 HydrophobicContact CG1-CG1 4.09Å; I146-V296 HydrophobicContact CG2-CG1 4.23Å; V149-V296 HydrophobicContact CG1-CG2 4.38Å; I249-V296 HydrophobicContact CD1-CB 4.22Å; I249-V296 HydrophobicContact CD1-CG1 3.44Å; I249-V296 VanDerWaalsContact CD1-CG1 3.44Å; I249-V296 HydrophobicContact CD1-CG2 3.66Å; F294-V296 HydrophobicContact CD2-CG2 4.4Å; F294-V296 HydrophobicContact CE2-CG2 3.8Å; F294-V296 HydrophobicContact CZ-CG2 4.06Å
297	G	97.4	Very high	95.3	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	121.2	-176.9	0	0	0	0	0	111.1	F55 T147 Y148	F55-G297 VanDerWaalsContact CZ-C 3.46Å; T147-G297 PolarHBondContact N-O 2.95Å; Y148-G297 PolarHBondContact N-O 3.38Å; Y148-G297 VanDerWaalsContact N-O 3.14Å; Y148-G297 PolarHBondContact O-N 3.21Å
298	G	96.7	Very high	95.8	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.7	-168.9	178.7	0	0	0	0	0	113.1	I56 E145	I56-G298 PolarHBondContact N-O 3.41Å; I56-G298 PolarHBondContact O-N 3.41Å; I56-G298 VanDerWaalsContact O-O 3.05Å; E145-G298 VanDerWaalsContact O-CA 3.24Å; E145-G298 WeakPolarHBondContact O-CA 3.35Å
299	R	96.3	Very high	96	Very high	65 Å²	65	18 Å²	18	25%	0.245	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	154.4	175	64.1	-174.3	72.1	-123.6	6.3	110.6	P53 F144 E145 K301	P53-R299 PolarHBondContact O-NH1 2.77Å; F144-R299 CarbonylContact C-O 3.24Å; F144-R299 WeakPolarHBondContact CA-O 3.35Å; F144-R299 VanDerWaalsContact CD1-C 3.41Å; F144-R299 WeakPolarHBondContact CD1-O 3.33Å; E145-R299 HydrophobicContact CB-CG 4.3Å; E145-R299 PolarHBondContact N-O 2.94Å; E145-R299 PolarHBondContact O-N 3.4Å; R299-K301 PolarHBondContact O-N 3.48Å
300	C	96.5	Very high	96.1	Very high	9 Å²	9	21.7 Å²	21.7	6%	0.061	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	133.6	174.9	-74.8	0	0	0	0	110.8	P53 F144 C302 C309	P53-C300 HydrophobicContact CB-CB 4.24Å; P53-C300 HydrophobicContact CG-CB 4.05Å; F144-C300 HydrophobicContact CE1-CB 4.37Å; F144-C300 WeakPolarHBondContact CE1-SG 3.44Å; F144-C300 WeakPolarHBondContact CZ-SG 3.4Å; C300-C302 PolarHBondContact O-N 2.97Å; C300-C309 HydrophobicContact CB-CB 4.17Å; C300-C309 WeakPolarHBondContact CB-SG 3.36Å
301	K	97.8	Very high	96	Very high	26 Å²	26	29.3 Å²	29.3	11%	0.113	14%	0.135	C	C	.	.			trans	-75.2	110.6	177.5	-172.5	172.6	-175.4	174.5	0	109.9	K142 K143 E145 T245 R299 C319 E329	K142-K301 PolarHBondContact NZ-O 2.86Å; K143-K301 HydrophobicContact CB-CB 4.1Å; K143-K301 HydrophobicContact CB-CD 4.33Å; K143-K301 VanDerWaalsContact O-CB 3.24Å; K143-K301 WeakPolarHBondContact O-CB 3.38Å; K143-K301 PolarHBondContact O-N 3.26Å; E145-K301 HydrophobicContact CG-CB 3.94Å; E145-K301 HydrophobicContact CG-CD 4.23Å; E145-K301 HydrophobicContact CG-CG 3.93Å; T245-K301 HydrophobicContact CG2-CD 3.82Å; T245-K301 PolarHBondContact OG1-NZ 3.45Å; R299-K301 PolarHBondContact O-N 3.48Å; K301-C319 PolarHBondContact O-SG 3.31Å; K301-E329 HydrophobicContact CB-CG 4.26Å; K301-E329 HydrophobicContact CD-CG 4.44Å; K301-E329 HydrophobicContact CG-CG 4.23Å; K301-E329 WeakPolarHBondContact O-CG 3.32Å
302	C	97.8	Very high	95.9	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.014	15%	0.15	C	C	.	.			trans	-130.8	14.5	176.1	-57.1	0	0	0	0	113.4	P53 C300 G304 H305 A306 C309 C319 E329	P53-C302 HydrophobicContact CG-CB 4.32Å; C300-C302 PolarHBondContact O-N 2.97Å; C302-G304 PolarHBondContact O-N 2.83Å; C302-H305 PolarHBondContact O-N 2.76Å; C302-A306 HydrophobicContact CB-CB 3.71Å; C302-C309 PolarHBondContact SG-SG 3.33Å; C302-C319 WeakPolarHBondContact CA-SG 3.31Å; C302-C319 HydrophobicContact CB-CB 3.88Å; C302-C319 WeakPolarHBondContact CB-SG 3.45Å; C302-C319 WeakPolarHBondContact SG-CB 3.44Å; C302-C319 CovalentContact SG-SG 2.03Å; C302-C319 PolarHBondContact SG-SG 3.29Å; C302-E329 CarbonylContact C-O 3.58Å; C302-E329 VanDerWaalsContact C-O 3.23Å; C302-E329 WeakPolarHBondContact CA-O 3.41Å
303	N	97.5	Very high	95.8	Very high	11 Å²	11	41.9 Å²	41.9	6%	0.059	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	26.6	178.4	-63.2	-60.2	0	0	0	114.8	H305 E329 W342 R344 A345	N303-H305 VanDerWaalsContact C-N 3.31Å; N303-H305 PolarHBondContact O-CD2 3.35Å; N303-H305 PolarHBondContact O-N 3.03Å; N303-H305 PolarHBondContact O-NE2 3.21Å; N303-E329 PolarHBondContact ND2-O 3.45Å; N303-W342 HydrophobicContact CB-CH2 4.35Å; N303-W342 HydrophobicContact CB-CZ2 3.81Å; N303-R344 HydrophobicContact CB-CB 4.37Å; N303-R344 HydrophobicContact CB-CG 3.99Å; N303-R344 WeakPolarHBondContact O-CG 3.02Å; N303-A345 PolarHBondContact O-N 3Å
304	G	96.8	Very high	95.6	Very high	3 Å²	3	48.7 Å²	48.7	3%	0.031	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	14.5	-179.3	0	0	0	0	0	115.4	C51 C302 A345	C51-G304 PolarHBondContact N-O 2.82Å; C51-G304 VanDerWaalsContact N-O 3.11Å; C51-G304 CarbonylContact O-C 3.59Å; C51-G304 WeakPolarHBondContact O-CA 3.25Å; C51-G304 VanDerWaalsContact O-O 3.07Å; C302-G304 PolarHBondContact O-N 2.83Å; G304-A345 WeakPolarHBondContact O-CB 3.33Å
305	H	97.9	Very high	95.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-111.9	11.3	-178.8	-58.9	-70.6	0	0	0	113.8	C302 N303 K322 H323 T325 C330 W342 Q343 A345 A350	C302-H305 PolarHBondContact O-N 2.76Å; N303-H305 VanDerWaalsContact C-N 3.31Å; N303-H305 PolarHBondContact O-CD2 3.35Å; N303-H305 PolarHBondContact O-N 3.03Å; N303-H305 PolarHBondContact O-NE2 3.21Å; H305-K322 WeakPolarHBondContact O-CA 3.26Å; H305-K322 WeakPolarHBondContact O-CB 3.36Å; H305-K322 PolarHBondContact O-N 3.12Å; H305-H323 HydrophobicContact CB-CB 4.48Å; H305-H323 AromaticContact CE1-ND1 3.95Å; H305-H323 AromaticContact CG-ND1 3.95Å; H305-H323 AromaticContact ND1-CG 3.64Å; H305-H323 AromaticContact ND1-ND1 3.03Å; H305-H323 PolarHBondContact ND1-ND1 3.5Å; H305-T325 HydrophobicContact CB-CG2 4.18Å; H305-T325 WeakPolarHBondContact CB-OG1 3.5Å; H305-C330 HydrophobicContact CB-CB 3.77Å; H305-W342 AromaticContact NE2-NE1 3.99Å; H305-Q343 PolarHBondContact CE1-O 3.22Å; H305-Q343 PolarHBondContact NE2-O 2.9Å; H305-A345 PolarHBondContact NE2-N 3.01Å; H305-A350 PolarHBondContact CE1-O 3.26Å
306	A	97.6	Very high	95	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.252	C	S	.	.			trans	-150.5	142.4	173.7	0	0	0	0	0	110.8	C51 I52 P53 C302 C319 D320	C51-A306 CarbonylContact C-O 3.59Å; C51-A306 VanDerWaalsContact O-O 3.12Å; C51-A306 PolarHBondContact SG-N 3.46Å; I52-A306 CarbonylContact C-O 3.56Å; P53-A306 VanDerWaalsContact CD-O 3.26Å; P53-A306 WeakPolarHBondContact CD-O 3Å; C302-A306 HydrophobicContact CB-CB 3.71Å; A306-C319 HydrophobicContact CB-CB 3.96Å; A306-D320 VanDerWaalsContact CB-O 3.31Å; A306-D320 WeakPolarHBondContact CB-O 3.44Å
307	S	96.1	Very high	94.8	Very high	22 Å²	22	54.4 Å²	54.4	15%	0.154	26%	0.263	C	S	.	.	S	Bend	trans	-89.5	-12.4	179.1	54.9	0	0	0	0	114	P40 P53	P40-S307 VanDerWaalsContact CG-CB 3.41Å; P53-S307 WeakPolarHBondContact CA-O 3.38Å
308	R	95.3	Very high	94.8	Very high	137 Å²	137	56.1 Å²	56.1	52%	0.517	27%	0.273	S	S	.	.			trans	-158.6	165.3	-178.9	62.2	-176.4	-178.4	177.5	0.4	111.9	D320	R308-D320 HydrophobicContact CG-CB 4.15Å; R308-D320 IonicContact CZ-OD2 2.82Å; R308-D320 IonicContact NE-OD2 3.9Å; R308-D320 PolarHBondContact NE-OD2 2.99Å; R308-D320 IonicContact NH2-OD2 2.71Å; R308-D320 PolarHBondContact O-N 3.32Å; R308-D320 VanDerWaalsContact O-N 3.12Å
309	C	95.4	Very high	94.8	Very high	26 Å²	26	56.5 Å²	56.5	18%	0.176	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	143.6	169.9	-73.6	0	0	0	0	110.8	K142 C300 C302 L317 V318 C319	K142-C309 VanDerWaalsContact CE-SG 3.57Å; C300-C309 HydrophobicContact CB-CB 4.17Å; C300-C309 WeakPolarHBondContact CB-SG 3.36Å; C302-C309 PolarHBondContact SG-SG 3.33Å; C309-L317 HydrophobicContact CB-CD1 3.79Å; C309-L317 HydrophobicContact CB-CD2 4.42Å; C309-L317 HydrophobicContact CB-CG 3.93Å; C309-V318 CarbonylContact C-O 3.54Å; C309-V318 VanDerWaalsContact CA-O 3.26Å; C309-V318 WeakPolarHBondContact CA-O 3.32Å; C309-V318 WeakPolarHBondContact CB-O 3.46Å; C309-C319 VanDerWaalsContact SG-SG 3.7Å
310	L	94.4	Very high	94.8	Very high	80 Å²	80	55.1 Å²	55.1	42%	0.419	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	157.7	-178.3	-58.7	175.6	0	0	0	108.9	V318 D320	L310-V318 PolarHBondContact N-O 3.02Å; L310-V318 PolarHBondContact O-N 3.28Å; L310-V318 VanDerWaalsContact O-O 3.07Å; L310-D320 HydrophobicContact CD1-CB 4.03Å; L310-D320 HydrophobicContact CG-CB 4.36Å
311	K	93	Very high	94.9	Very high	164 Å²	164	55.5 Å²	55.5	71%	0.713	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	132.4	169.7	-66	-177.9	-178.9	178.8	0	108.9	K316 L317	K311-K316 CarbonylContact C-O 3.57Å; K311-K316 VanDerWaalsContact CA-O 3.32Å; K311-K316 WeakPolarHBondContact CA-O 3.29Å; K311-L317 HydrophobicContact CG-CD1 4.47Å
312	D	91.8	Very high	94.8	Very high	58 Å²	58	56.4 Å²	56.4	31%	0.31	28%	0.28	S	S	.	.			trans	-74.1	-176.2	172.2	66.6	13	0	0	0	111.6	E314 G315 K316 V318	D312-E314 VanDerWaalsContact CG-OE2 3.31Å; D312-E314 PolarHBondContact O-N 2.8Å; D312-E314 WeakPolarHBondContact OD1-CA 3.25Å; D312-E314 WeakPolarHBondContact OD1-CB 3.42Å; D312-E314 PolarHBondContact OD1-N 2.03Å; D312-E314 VanDerWaalsContact OD1-N 3.08Å; D312-G315 PolarHBondContact O-N 2.73Å; D312-G315 PolarHBondContact OD1-N 2.93Å; D312-K316 PolarHBondContact N-O 2.71Å; D312-K316 WeakPolarHBondContact OD1-CA 3.41Å; D312-K316 WeakPolarHBondContact OD1-CB 3.37Å; D312-K316 PolarHBondContact OD1-N 3.07Å; D312-V318 HydrophobicContact CB-CG2 4.45Å
313	K	90.5	Very high	94.8	Very high	206 Å²	206	56.3 Å²	56.3	90%	0.896	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-25.3	-178.1	-65.7	-178.3	179.3	-178.1	0	112	G315	K313-G315 VanDerWaalsContact C-N 3.3Å
314	E	91.1	Very high	94.8	Very high	156 Å²	156	58.3 Å²	58.3	73%	0.729	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	1.5	177.9	-59.7	70.9	-155.7	0	0	112.1	D312 K316	D312-E314 VanDerWaalsContact CG-OE2 3.31Å; D312-E314 PolarHBondContact O-N 2.8Å; D312-E314 WeakPolarHBondContact OD1-CA 3.25Å; D312-E314 WeakPolarHBondContact OD1-CB 3.42Å; D312-E314 PolarHBondContact OD1-N 2.03Å; D312-E314 VanDerWaalsContact OD1-N 3.08Å; E314-K316 VanDerWaalsContact C-N 3.31Å; E314-K316 PolarHBondContact O-N 3.2Å
315	G	87.9	Confident	94.9	Very high	46 Å²	46	58.2 Å²	58.2	47%	0.474	29%	0.289	S	S	.	.	S	Bend	trans	80.5	4.9	178.8	0	0	0	0	0	114.7	D312 K313	D312-G315 PolarHBondContact O-N 2.73Å; D312-G315 PolarHBondContact OD1-N 2.93Å; K313-G315 VanDerWaalsContact C-N 3.3Å
316	K	90.5	Very high	94.8	Very high	87 Å²	87	61 Å²	61	38%	0.378	30%	0.302	S	S	.	.			trans	-83.6	138.5	179.6	-176.1	179	-179.4	176.7	0	110.9	K311 D312 E314 V318	K311-K316 CarbonylContact C-O 3.57Å; K311-K316 VanDerWaalsContact CA-O 3.32Å; K311-K316 WeakPolarHBondContact CA-O 3.29Å; D312-K316 PolarHBondContact N-O 2.71Å; D312-K316 WeakPolarHBondContact OD1-CA 3.41Å; D312-K316 WeakPolarHBondContact OD1-CB 3.37Å; D312-K316 PolarHBondContact OD1-N 3.07Å; E314-K316 VanDerWaalsContact C-N 3.31Å; E314-K316 PolarHBondContact O-N 3.2Å; K316-V318 PolarHBondContact O-N 3.45Å
317	L	93.3	Very high	94.8	Very high	45 Å²	45	61.9 Å²	61.9	24%	0.236	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	124.9	178.1	-167.7	69	0	0	0	110.5	K142 F144 C309 K311	K142-L317 HydrophobicContact CB-CB 4.13Å; K142-L317 HydrophobicContact CB-CD2 4.29Å; K142-L317 HydrophobicContact CB-CG 4.48Å; K142-L317 HydrophobicContact CD-CB 4.35Å; K142-L317 HydrophobicContact CD-CD2 4.25Å; K142-L317 HydrophobicContact CD-CG 4.04Å; K142-L317 WeakPolarHBondContact CD-O 3.49Å; F144-L317 HydrophobicContact CE2-CD2 4.17Å; F144-L317 HydrophobicContact CZ-CD2 3.92Å; C309-L317 HydrophobicContact CB-CD1 3.79Å; C309-L317 HydrophobicContact CB-CD2 4.42Å; C309-L317 HydrophobicContact CB-CG 3.93Å; K311-L317 HydrophobicContact CG-CD1 4.47Å
318	V	96.4	Very high	94.7	Very high	35 Å²	35	62.7 Å²	62.7	21%	0.212	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	151.3	-176.9	173	0	0	0	0	109.9	C309 L310 D312 K316	C309-V318 CarbonylContact C-O 3.54Å; C309-V318 VanDerWaalsContact CA-O 3.26Å; C309-V318 WeakPolarHBondContact CA-O 3.32Å; C309-V318 WeakPolarHBondContact CB-O 3.46Å; L310-V318 PolarHBondContact N-O 3.02Å; L310-V318 PolarHBondContact O-N 3.28Å; L310-V318 VanDerWaalsContact O-O 3.07Å; D312-V318 HydrophobicContact CB-CG2 4.45Å; K316-V318 PolarHBondContact O-N 3.45Å
319	C	97.3	Very high	94.8	Very high	9 Å²	9	56.8 Å²	56.8	6%	0.061	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	140	175.6	-62.6	0	0	0	0	112.7	K142 K301 C302 A306 C309 C321 P328 C330	K142-C319 WeakPolarHBondContact CE-SG 3.44Å; K142-C319 PolarHBondContact NZ-SG 3.05Å; K301-C319 PolarHBondContact O-SG 3.31Å; C302-C319 WeakPolarHBondContact CA-SG 3.31Å; C302-C319 HydrophobicContact CB-CB 3.88Å; C302-C319 WeakPolarHBondContact CB-SG 3.45Å; C302-C319 WeakPolarHBondContact SG-CB 3.44Å; C302-C319 CovalentContact SG-SG 2.03Å; C302-C319 PolarHBondContact SG-SG 3.29Å; A306-C319 HydrophobicContact CB-CB 3.96Å; C309-C319 VanDerWaalsContact SG-SG 3.7Å; C319-C321 VanDerWaalsContact C-N 3.25Å; C319-C321 PolarHBondContact O-N 3.01Å; C319-P328 PolarHBondContact N-O 2.79Å; C319-P328 PolarHBondContact SG-O 2.85Å; C319-C330 WeakPolarHBondContact CB-SG 2.99Å
320	D	96.8	Very high	94.9	Very high	36 Å²	36	55.5 Å²	55.5	19%	0.193	29%	0.285	C	S	.	.			trans	-78.9	74.6	167.2	-179.2	8.2	0	0	0	109.8	A306 R308 L310 K322	A306-D320 VanDerWaalsContact CB-O 3.31Å; A306-D320 WeakPolarHBondContact CB-O 3.44Å; R308-D320 HydrophobicContact CG-CB 4.15Å; R308-D320 IonicContact CZ-OD2 2.82Å; R308-D320 IonicContact NE-OD2 3.9Å; R308-D320 PolarHBondContact NE-OD2 2.99Å; R308-D320 IonicContact NH2-OD2 2.71Å; R308-D320 PolarHBondContact O-N 3.32Å; R308-D320 VanDerWaalsContact O-N 3.12Å; L310-D320 HydrophobicContact CD1-CB 4.03Å; L310-D320 HydrophobicContact CG-CB 4.36Å; D320-K322 PolarHBondContact O-N 2.85Å; D320-K322 IonicContact OD1-NZ 3.21Å; D320-K322 PolarHBondContact OD1-NZ 2.8Å; D320-K322 IonicContact OD2-NZ 3.97Å; D320-K322 PolarHBondContact OD2-NZ 2.82Å
321	C	97.2	Very high	95.1	Very high	17 Å²	17	54.7 Å²	54.7	12%	0.115	28%	0.281	C	S	.	.			trans	-63.7	126.6	-169	-63.5	0	0	0	0	114.3	C319 T325 G327 C330	C319-C321 VanDerWaalsContact C-N 3.25Å; C319-C321 PolarHBondContact O-N 3.01Å; C321-T325 VanDerWaalsContact CB-O 3.25Å; C321-T325 WeakPolarHBondContact CB-O 3.33Å; C321-G327 PolarHBondContact SG-O 2.64Å; C321-G327 VanDerWaalsContact SG-O 3.35Å; C321-C330 WeakPolarHBondContact CA-SG 3.22Å; C321-C330 HydrophobicContact CB-CB 3.95Å; C321-C330 WeakPolarHBondContact CB-SG 2.95Å; C321-C330 WeakPolarHBondContact SG-CA 3.33Å; C321-C330 WeakPolarHBondContact SG-CB 3.26Å; C321-C330 CovalentContact SG-SG 2.04Å; C321-C330 PolarHBondContact SG-SG 3.18Å
322	K	97.1	Very high	95.3	Very high	44 Å²	44	53.1 Å²	53.1	19%	0.191	27%	0.271	C	S	.	.			trans	-106.8	-165.3	172.9	-52.2	-52.3	-178.8	-160.4	0	110.6	D39 C41 Y42 H305 D320 N324 T325	D39-K322 WeakPolarHBondContact OD2-CE 3.48Å; C41-K322 HydrophobicContact CB-CB 4.03Å; C41-K322 HydrophobicContact CB-CG 3.93Å; C41-K322 VanDerWaalsContact SG-CG 3.57Å; Y42-K322 HydrophobicContact CE2-CB 4.33Å; H305-K322 WeakPolarHBondContact O-CA 3.26Å; H305-K322 WeakPolarHBondContact O-CB 3.36Å; H305-K322 PolarHBondContact O-N 3.12Å; D320-K322 PolarHBondContact O-N 2.85Å; D320-K322 IonicContact OD1-NZ 3.21Å; D320-K322 PolarHBondContact OD1-NZ 2.8Å; D320-K322 IonicContact OD2-NZ 3.97Å; D320-K322 PolarHBondContact OD2-NZ 2.82Å; K322-N324 PolarHBondContact O-N 2.99Å; K322-T325 WeakPolarHBondContact O-CB 3.22Å; K322-T325 PolarHBondContact O-N 3.16Å; K322-T325 PolarHBondContact O-OG1 2.64Å
323	H	97.8	Very high	95.6	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.005	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	28.7	175.4	-57.9	176.1	0	0	0	113.7	C41 Y42 R49 H305 T325 A350 E352 C353	C41-H323 PolarHBondContact O-NE2 3.24Å; C41-H323 VanDerWaalsContact O-NE2 3.08Å; Y42-H323 PolarHBondContact OH-N 3.21Å; R49-H323 PolarHBondContact O-CE1 2.71Å; R49-H323 PolarHBondContact O-NE2 2.04Å; R49-H323 VanDerWaalsContact O-NE2 3.15Å; H305-H323 HydrophobicContact CB-CB 4.48Å; H305-H323 AromaticContact CE1-ND1 3.95Å; H305-H323 AromaticContact CG-ND1 3.95Å; H305-H323 AromaticContact ND1-CG 3.64Å; H305-H323 AromaticContact ND1-ND1 3.03Å; H305-H323 PolarHBondContact ND1-ND1 3.5Å; H323-T325 HydrophobicContact CB-CG2 4.38Å; H323-T325 PolarHBondContact O-N 3.23Å; H323-A350 PolarHBondContact ND1-O 3.28Å; H323-E352 HydrophobicContact CB-CB 3.62Å; H323-C353 PolarHBondContact O-N 3.4Å
324	N	97.8	Very high	95.9	Very high	53 Å²	53	44.6 Å²	44.6	28%	0.283	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	31.5	-173	-52.6	-46.3	0	0	0	114.4	K322 K334 H337 C353	K322-N324 PolarHBondContact O-N 2.99Å; N324-K334 WeakPolarHBondContact O-CB 3.46Å; N324-K334 WeakPolarHBondContact O-CG 3.36Å; N324-K334 PolarHBondContact O-N 3.45Å; N324-H337 HydrophobicContact CB-CB 4.21Å; N324-H337 WeakPolarHBondContact CB-CD2 3.4Å; N324-H337 PolarHBondContact ND2-CD2 2.96Å; N324-C353 HydrophobicContact CB-CB 4.01Å; N324-C353 WeakPolarHBondContact CB-O 3.11Å; N324-C353 PolarHBondContact ND2-O 2.03Å; N324-C353 WeakPolarHBondContact O-CB 3.47Å
325	T	98.2	Very high	96.2	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	158	174.1	62.1	0	0	0	0	111.4	H305 C321 K322 H323 C330 R332 K334	H305-T325 HydrophobicContact CB-CG2 4.18Å; H305-T325 WeakPolarHBondContact CB-OG1 3.5Å; C321-T325 VanDerWaalsContact CB-O 3.25Å; C321-T325 WeakPolarHBondContact CB-O 3.33Å; K322-T325 WeakPolarHBondContact O-CB 3.22Å; K322-T325 PolarHBondContact O-N 3.16Å; K322-T325 PolarHBondContact O-OG1 2.64Å; H323-T325 HydrophobicContact CB-CG2 4.38Å; H323-T325 PolarHBondContact O-N 3.23Å; T325-C330 WeakPolarHBondContact OG1-CB 3.38Å; T325-R332 CarbonylContact C-O 3.58Å; T325-R332 VanDerWaalsContact CA-O 3.26Å; T325-R332 WeakPolarHBondContact CA-O 3.25Å; T325-R332 WeakPolarHBondContact CB-O 3.02Å; T325-K334 WeakPolarHBondContact O-CE 3.27Å
326	E	96.6	Very high	96.7	Very high	60 Å²	60	41.4 Å²	41.4	28%	0.28	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	177.2	175	70.7	178.5	-174.7	0	0	110.6	C330 D331 R332 K334 P335	E326-C330 CarbonylContact O-C 3.56Å; E326-C330 WeakPolarHBondContact O-CA 3.18Å; E326-D331 PolarHBondContact O-N 2.79Å; E326-R332 HydrophobicContact CG-CG 3.77Å; E326-R332 PolarHBondContact N-O 3.16Å; E326-R332 WeakPolarHBondContact O-CG 3.41Å; E326-R332 PolarHBondContact O-N 2.89Å; E326-R332 IonicContact OE1-NE 3.57Å; E326-K334 HydrophobicContact CB-CG 3.89Å; E326-K334 HydrophobicContact CG-CG 4.36Å; E326-P335 VanDerWaalsContact OE2-CD 3.25Å; E326-P335 WeakPolarHBondContact OE2-CD 3.16Å
327	G	95.8	Very high	97.1	Very high	18 Å²	18	38.9 Å²	38.9	19%	0.186	20%	0.2	C	C	.	.	S	Bend	trans	98.5	165.5	-174.7	0	0	0	0	0	112	C321 E329 C330	C321-G327 PolarHBondContact SG-O 2.64Å; C321-G327 VanDerWaalsContact SG-O 3.35Å; G327-E329 PolarHBondContact O-N 2.87Å; G327-C330 PolarHBondContact O-N 2.99Å
328	P	95.6	Very high	97.3	Very high	38 Å²	38	40.3 Å²	40.3	25%	0.247	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-32.7	-174.4	23.5	-32.8	0	0	0	113	K142 C319	K142-P328 PolarHBondContact NZ-O 3.39Å; C319-P328 PolarHBondContact N-O 2.79Å; C319-P328 PolarHBondContact SG-O 2.85Å
329	E	97.3	Very high	97.4	Very high	13 Å²	13	39.6 Å²	39.6	6%	0.061	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.1	11.8	179.6	-74.8	68.9	-118.3	0	0	113	K142 K143 K301 C302 N303 G327 D331	K142-E329 IonicContact NZ-OE1 2.69Å; K142-E329 PolarHBondContact NZ-OE1 3.45Å; K143-E329 HydrophobicContact CB-CG 4.02Å; K143-E329 HydrophobicContact CD-CG 4.13Å; K301-E329 HydrophobicContact CB-CG 4.26Å; K301-E329 HydrophobicContact CD-CG 4.44Å; K301-E329 HydrophobicContact CG-CG 4.23Å; K301-E329 WeakPolarHBondContact O-CG 3.32Å; C302-E329 CarbonylContact C-O 3.58Å; C302-E329 VanDerWaalsContact C-O 3.23Å; C302-E329 WeakPolarHBondContact CA-O 3.41Å; N303-E329 PolarHBondContact ND2-O 3.45Å; G327-E329 PolarHBondContact O-N 2.87Å; E329-D331 HydrophobicContact CB-CB 4.26Å; E329-D331 PolarHBondContact O-N 3.22Å
330	C	97.7	Very high	97.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.203	C	C	.	.	S	Bend	trans	56.7	39.5	-170.5	-47.2	0	0	0	0	112.4	H305 C319 C321 T325 E326 G327 W342	H305-C330 HydrophobicContact CB-CB 3.77Å; C319-C330 WeakPolarHBondContact CB-SG 2.99Å; C321-C330 WeakPolarHBondContact CA-SG 3.22Å; C321-C330 HydrophobicContact CB-CB 3.95Å; C321-C330 WeakPolarHBondContact CB-SG 2.95Å; C321-C330 WeakPolarHBondContact SG-CA 3.33Å; C321-C330 WeakPolarHBondContact SG-CB 3.26Å; C321-C330 CovalentContact SG-SG 2.04Å; C321-C330 PolarHBondContact SG-SG 3.18Å; T325-C330 WeakPolarHBondContact OG1-CB 3.38Å; E326-C330 CarbonylContact O-C 3.56Å; E326-C330 WeakPolarHBondContact O-CA 3.18Å; G327-C330 PolarHBondContact O-N 2.99Å; C330-W342 PolarHBondContact O-NE1 3.02Å
331	D	97.1	Very high	97.4	Very high	63 Å²	63	41.5 Å²	41.5	34%	0.337	21%	0.206	S	C	.	.			trans	-91.6	2.6	-169.6	58.9	-52.9	0	0	0	113.9	E326 E329	E326-D331 PolarHBondContact O-N 2.79Å; E329-D331 HydrophobicContact CB-CB 4.26Å; E329-D331 PolarHBondContact O-N 3.22Å
332	R	97.3	Very high	97.4	Very high	130 Å²	130	44.6 Å²	44.6	49%	0.491	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	161.7	177.2	53.1	173.2	171.7	-115.8	2.7	111.8	T325 E326	T325-R332 CarbonylContact C-O 3.58Å; T325-R332 VanDerWaalsContact CA-O 3.26Å; T325-R332 WeakPolarHBondContact CA-O 3.25Å; T325-R332 WeakPolarHBondContact CB-O 3.02Å; E326-R332 HydrophobicContact CG-CG 3.77Å; E326-R332 PolarHBondContact N-O 3.16Å; E326-R332 WeakPolarHBondContact O-CG 3.41Å; E326-R332 PolarHBondContact O-N 2.89Å; E326-R332 IonicContact OE1-NE 3.57Å
333	C	98.3	Very high	97.4	Very high	8 Å²	8	47 Å²	47	5%	0.054	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	143.5	174.9	-64.7	0	0	0	0	112.2	H337 Y338 C353	C333-H337 HydrophobicContact CB-CB 4.47Å; C333-H337 WeakPolarHBondContact CB-O 3.33Å; C333-Y338 HydrophobicContact CB-CD1 3.85Å; C333-Y338 HydrophobicContact CB-CE1 3.81Å; C333-Y338 WeakPolarHBondContact O-CE1 3.22Å; C333-C353 WeakPolarHBondContact CA-SG 3.38Å; C333-C353 HydrophobicContact CB-CB 3.55Å; C333-C353 WeakPolarHBondContact CB-SG 3.32Å; C333-C353 WeakPolarHBondContact SG-CB 3.44Å; C333-C353 CovalentContact SG-SG 2.03Å; C333-C353 PolarHBondContact SG-SG 2.89Å
334	K	97.9	Very high	97.3	Very high	77 Å²	77	48.6 Å²	48.6	34%	0.335	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-56.2	153.2	170	-76.7	-178.5	-170.2	-178.1	0	110.8	N324 T325 E326 F336 H337	N324-K334 WeakPolarHBondContact O-CB 3.46Å; N324-K334 WeakPolarHBondContact O-CG 3.36Å; N324-K334 PolarHBondContact O-N 3.45Å; T325-K334 WeakPolarHBondContact O-CE 3.27Å; E326-K334 HydrophobicContact CB-CG 3.89Å; E326-K334 HydrophobicContact CG-CG 4.36Å; K334-F336 PolarHBondContact O-N 3.1Å; K334-H337 WeakPolarHBondContact O-CB 3.25Å; K334-H337 PolarHBondContact O-N 2.73Å
335	P	97.5	Very high	97.3	Very high	80 Å²	80	46.2 Å²	46.2	52%	0.519	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	142.7	171.6	-27.6	34.7	0	0	0	111.2	E326 H337	E326-P335 VanDerWaalsContact OE2-CD 3.25Å; E326-P335 WeakPolarHBondContact OE2-CD 3.16Å; P335-H337 PolarHBondContact O-N 2.91Å; P335-H337 PolarHBondContact O-ND1 3.2Å
336	F	98	Very high	97	Very high	55 Å²	55	47.5 Å²	47.5	24%	0.241	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.3	-2.7	-177.6	-160.2	-108.8	0	0	0	115.9	K334 P355 C356 C358 A362 R363 C365	K334-F336 PolarHBondContact O-N 3.1Å; F336-P355 WeakPolarHBondContact O-CA 2.95Å; F336-C356 WeakPolarHBondContact CE1-O 2.96Å; F336-C356 HydrophobicContact CE2-CB 4.33Å; F336-C356 HydrophobicContact CZ-CB 4.43Å; F336-C356 VanDerWaalsContact CZ-O 3.22Å; F336-C356 WeakPolarHBondContact CZ-O 3.47Å; F336-C356 PolarHBondContact O-N 3.36Å; F336-C358 HydrophobicContact CE2-CB 4.2Å; F336-C358 HydrophobicContact CZ-CB 4.05Å; F336-A362 WeakPolarHBondContact CE2-O 3.44Å; F336-R363 VanDerWaalsContact CD2-C 3.46Å; F336-R363 WeakPolarHBondContact CD2-O 3.2Å; F336-C365 HydrophobicContact CD2-CB 4.46Å; F336-C365 PolarHBondContact O-SG 3.21Å
337	H	98.2	Very high	96.6	Very high	34 Å²	34	48 Å²	48	16%	0.157	24%	0.242	C	C	.	.			trans	-105	47.4	178.4	-61.9	74.8	0	0	0	113	N324 C333 K334 P335 C353 L354	N324-H337 HydrophobicContact CB-CB 4.21Å; N324-H337 WeakPolarHBondContact CB-CD2 3.4Å; N324-H337 PolarHBondContact ND2-CD2 2.96Å; C333-H337 HydrophobicContact CB-CB 4.47Å; C333-H337 WeakPolarHBondContact CB-O 3.33Å; K334-H337 WeakPolarHBondContact O-CB 3.25Å; K334-H337 PolarHBondContact O-N 2.73Å; P335-H337 PolarHBondContact O-N 2.91Å; P335-H337 PolarHBondContact O-ND1 3.2Å; H337-C353 HydrophobicContact CB-CB 3.85Å; H337-L354 CarbonylContact C-O 3.49Å; H337-L354 WeakPolarHBondContact CA-O 3.42Å
338	Y	97.8	Very high	96.4	Very high	75 Å²	75	58.7 Å²	58.7	29%	0.294	28%	0.277	S	S	.	.			trans	-107.5	31.6	-175.2	-53.7	-49.5	0	0	0	112.7	C333 L354 C365 F367	C333-Y338 HydrophobicContact CB-CD1 3.85Å; C333-Y338 HydrophobicContact CB-CE1 3.81Å; C333-Y338 WeakPolarHBondContact O-CE1 3.22Å; Y338-L354 PolarHBondContact N-O 3.03Å; Y338-C365 WeakPolarHBondContact CD2-O 3.48Å; Y338-F367 WeakPolarHBondContact O-CD2 3.4Å
339	D	97.7	Very high	96.3	Very high	20 Å²	20	62.5 Å²	62.5	11%	0.107	29%	0.291	C	S	.	.	S	Bend	trans	-77.4	-27.8	-179.9	-162.7	49	0	0	0	112.9	L354 S379 G380 G381	D339-L354 HydrophobicContact CB-CB 4.03Å; D339-L354 WeakPolarHBondContact CB-O 3.48Å; D339-L354 PolarHBondContact N-O 3.26Å; D339-S379 VanDerWaalsContact CG-OG 3.28Å; D339-S379 PolarHBondContact OD1-OG 2.94Å; D339-S379 VanDerWaalsContact OD2-CB 3.26Å; D339-S379 WeakPolarHBondContact OD2-CB 3.15Å; D339-S379 PolarHBondContact OD2-OG 3.27Å; D339-G380 PolarHBondContact O-N 3.01Å; D339-G381 PolarHBondContact O-N 3.5Å; D339-G381 WeakPolarHBondContact OD1-CA 3.41Å; D339-G381 PolarHBondContact OD1-N 3.17Å
340	R	97	Very high	96.2	Very high	47 Å²	47	62.2 Å²	62.2	18%	0.177	29%	0.291	C	S	.	.	S	Bend	trans	-134.9	161.5	169.7	67.6	175.5	179.3	-174.5	-4.2	110.9	E352 L354 Y372	R340-E352 VanDerWaalsContact CZ-O 3.27Å; R340-E352 PolarHBondContact NE-O 3.25Å; R340-E352 VanDerWaalsContact NH2-N 3.19Å; R340-E352 PolarHBondContact NH2-O 2.87Å; R340-E352 IonicContact NH2-OE1 2.83Å; R340-E352 PolarHBondContact NH2-OE1 2.92Å; R340-E352 VanDerWaalsContact NH2-OE1 3.1Å; R340-E352 IonicContact NH2-OE2 2.88Å; R340-E352 PolarHBondContact NH2-OE2 3.43Å; R340-L354 HydrophobicContact CG-CB 4.49Å; R340-L354 HydrophobicContact CG-CD1 4.24Å; R340-L354 HydrophobicContact CG-CG 4.28Å; R340-Y372 HydrophobicContact CB-CD2 4.43Å; R340-Y372 HydrophobicContact CB-CE2 3.68Å
341	P	97.3	Very high	96.1	Very high	38 Å²	38	62.8 Å²	62.8	25%	0.247	29%	0.294	C	S	.	.			trans	-59.5	148.7	175.2	-20.5	32.6	0	0	0	111.9	F367 M369 Y372	P341-F367 HydrophobicContact CG-CE1 3.95Å; P341-F367 HydrophobicContact CG-CE2 3.97Å; P341-F367 HydrophobicContact CG-CZ 3.47Å; P341-F367 VanDerWaalsContact CG-CZ 3.47Å; P341-M369 HydrophobicContact CG-CE 4.32Å; P341-Y372 HydrophobicContact CG-CD1 4.32Å; P341-Y372 HydrophobicContact CG-CE1 4.09Å
342	W	97.8	Very high	96.1	Very high	82 Å²	82	62.4 Å²	62.4	31%	0.311	29%	0.29	S	S	.	.			trans	-64.5	140.6	167.7	175.1	89.4	0	0	0	110.3	N303 H305 C330 R344	N303-W342 HydrophobicContact CB-CH2 4.35Å; N303-W342 HydrophobicContact CB-CZ2 3.81Å; H305-W342 AromaticContact NE2-NE1 3.99Å; C330-W342 PolarHBondContact O-NE1 3.02Å; W342-R344 HydrophobicContact CH2-CB 4.37Å
343	Q	96.3	Very high	96.2	Very high	95 Å²	95	56.2 Å²	56.2	44%	0.444	27%	0.267	S	S	.	.			trans	-146.8	146.8	173	-64.3	-177.7	-68.2	0	0	109.5	H305 N351	H305-Q343 PolarHBondContact CE1-O 3.22Å; H305-Q343 PolarHBondContact NE2-O 2.9Å; Q343-N351 HydrophobicContact CB-CB 3.99Å; Q343-N351 WeakPolarHBondContact O-CB 3.44Å
344	R	96.7	Very high	96.1	Very high	35 Å²	35	58.2 Å²	58.2	13%	0.132	28%	0.277	C	S	.	.			trans	-59.7	140.8	171.8	-178.9	179.8	-177.6	129.7	6.9	110.6	E145 N303 W342 N351	E145-R344 IonicContact OE1-CZ 3.01Å; E145-R344 IonicContact OE1-NH1 3.53Å; E145-R344 PolarHBondContact OE1-NH1 3.03Å; E145-R344 IonicContact OE1-NH2 2.8Å; E145-R344 PolarHBondContact OE1-NH2 3.45Å; E145-R344 IonicContact OE2-NH2 3.9Å; E145-R344 PolarHBondContact OE2-NH2 2.84Å; N303-R344 HydrophobicContact CB-CB 4.37Å; N303-R344 HydrophobicContact CB-CG 3.99Å; N303-R344 WeakPolarHBondContact O-CG 3.02Å; W342-R344 HydrophobicContact CH2-CB 4.37Å; R344-N351 PolarHBondContact O-ND2 2.64Å
345	A	96.5	Very high	96.1	Very high	2 Å²	2	57.7 Å²	57.7	2%	0.017	28%	0.282	C	S	.	.			trans	-70.5	136.4	172.9	0	0	0	0	0	111.3	R50 N303 G304 H305 A350	R50-A345 HydrophobicContact CB-CB 4.01Å; R50-A345 HydrophobicContact CG-CB 3.92Å; N303-A345 PolarHBondContact O-N 3Å; G304-A345 WeakPolarHBondContact O-CB 3.33Å; H305-A345 PolarHBondContact NE2-N 3.01Å; A345-A350 VanDerWaalsContact CB-O 3.27Å; A345-A350 WeakPolarHBondContact CB-O 3.37Å
346	N	92.4	Very high	96.1	Very high	28 Å²	28	54.1 Å²	54.1	15%	0.15	26%	0.258	C	S	.	.			trans	-113.4	178.4	175.1	67.2	48.5	0	0	0	110.1	R50 R348 E349	R50-N346 WeakPolarHBondContact CB-O 3.48Å; N346-R348 PolarHBondContact O-N 3.15Å; N346-R348 WeakPolarHBondContact OD1-CA 3.13Å; N346-R348 PolarHBondContact OD1-N 2.95Å; N346-E349 PolarHBondContact N-O 2.93Å; N346-E349 PolarHBondContact OD1-N 3.33Å
347	A	89.4	Confident	96.1	Very high	70 Å²	70	55.9 Å²	55.9	58%	0.579	27%	0.27	S	S	*	.	S	Bend	trans	-62.7	-21.5	-177.1	0	0	0	0	0	114.3
348	R	89.9	Confident	96.1	Very high	242 Å²	242	54.4 Å²	54.4	91%	0.913	26%	0.264	S	S	*	.	S	Bend	trans	-102.3	-38.4	-176.5	-62.4	-176.9	179.4	-173.9	-0.5	113.1	N346	N346-R348 PolarHBondContact O-N 3.15Å; N346-R348 WeakPolarHBondContact OD1-CA 3.13Å; N346-R348 PolarHBondContact OD1-N 2.95Å
349	E	93.4	Very high	96.1	Very high	119 Å²	119	52.3 Å²	52.3	56%	0.556	26%	0.258	S	S	*	.			trans	-126.3	126.1	-172.1	-62.8	179.1	148.4	0	0	110	N346 N351	N346-E349 PolarHBondContact N-O 2.93Å; N346-E349 PolarHBondContact OD1-N 3.33Å; E349-N351 PolarHBondContact O-N 2.77Å
350	A	95.8	Very high	96.1	Very high	7 Å²	7	58 Å²	58	6%	0.058	29%	0.288	C	S	.	.			trans	-72.7	-17.9	178.8	0	0	0	0	0	113.9	A48 H305 H323 A345 E352	A48-A350 VanDerWaalsContact C-CB 3.4Å; A48-A350 HydrophobicContact CB-CB 3.67Å; A48-A350 VanDerWaalsContact O-CB 3.24Å; A48-A350 WeakPolarHBondContact O-CB 3.29Å; H305-A350 PolarHBondContact CE1-O 3.26Å; H323-A350 PolarHBondContact ND1-O 3.28Å; A345-A350 VanDerWaalsContact CB-O 3.27Å; A345-A350 WeakPolarHBondContact CB-O 3.37Å; A350-E352 VanDerWaalsContact C-N 3.26Å; A350-E352 PolarHBondContact O-N 3.27Å
351	N	96.5	Very high	96.1	Very high	12 Å²	12	55.9 Å²	55.9	6%	0.064	28%	0.28	C	S	.	.			trans	49.6	44.7	177.4	-66.4	-32.2	0	0	0	113.6	Q343 R344 E349	Q343-N351 HydrophobicContact CB-CB 3.99Å; Q343-N351 WeakPolarHBondContact O-CB 3.44Å; R344-N351 PolarHBondContact O-ND2 2.64Å; E349-N351 PolarHBondContact O-N 2.77Å
352	E	97.3	Very high	96.2	Very high	54 Å²	54	54.5 Å²	54.5	25%	0.252	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-67.1	147.6	179.3	77.9	-66	164.1	0	0	112.9	A48 H323 R340 A350 L354	A48-E352 HydrophobicContact CB-CB 4.21Å; A48-E352 HydrophobicContact CB-CG 4.33Å; H323-E352 HydrophobicContact CB-CB 3.62Å; R340-E352 VanDerWaalsContact CZ-O 3.27Å; R340-E352 PolarHBondContact NE-O 3.25Å; R340-E352 VanDerWaalsContact NH2-N 3.19Å; R340-E352 PolarHBondContact NH2-O 2.87Å; R340-E352 IonicContact NH2-OE1 2.83Å; R340-E352 PolarHBondContact NH2-OE1 2.92Å; R340-E352 VanDerWaalsContact NH2-OE1 3.1Å; R340-E352 IonicContact NH2-OE2 2.88Å; R340-E352 PolarHBondContact NH2-OE2 3.43Å; A350-E352 VanDerWaalsContact C-N 3.26Å; A350-E352 PolarHBondContact O-N 3.27Å; E352-L354 HydrophobicContact CG-CD2 4.13Å; E352-L354 WeakPolarHBondContact OE1-CD2 3.47Å
353	C	98	Very high	96.1	Very high	1 Å²	1	60.5 Å²	60.5	1%	0.007	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-75	130.4	175.5	-66.1	0	0	0	0	110.1	H323 N324 C333 H337	H323-C353 PolarHBondContact O-N 3.4Å; N324-C353 HydrophobicContact CB-CB 4.01Å; N324-C353 WeakPolarHBondContact CB-O 3.11Å; N324-C353 PolarHBondContact ND2-O 2.03Å; N324-C353 WeakPolarHBondContact O-CB 3.47Å; C333-C353 WeakPolarHBondContact CA-SG 3.38Å; C333-C353 HydrophobicContact CB-CB 3.55Å; C333-C353 WeakPolarHBondContact CB-SG 3.32Å; C333-C353 WeakPolarHBondContact SG-CB 3.44Å; C333-C353 CovalentContact SG-SG 2.03Å; C333-C353 PolarHBondContact SG-SG 2.89Å; H337-C353 HydrophobicContact CB-CB 3.85Å
354	L	96.9	Very high	96.2	Very high	50 Å²	50	64.9 Å²	64.9	26%	0.262	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-98.5	134.8	-174.6	-65.2	-179.6	0	0	0	111.6	H337 Y338 D339 R340 E352	H337-L354 CarbonylContact C-O 3.49Å; H337-L354 WeakPolarHBondContact CA-O 3.42Å; Y338-L354 PolarHBondContact N-O 3.03Å; D339-L354 HydrophobicContact CB-CB 4.03Å; D339-L354 WeakPolarHBondContact CB-O 3.48Å; D339-L354 PolarHBondContact N-O 3.26Å; R340-L354 HydrophobicContact CG-CB 4.49Å; R340-L354 HydrophobicContact CG-CD1 4.24Å; R340-L354 HydrophobicContact CG-CG 4.28Å; E352-L354 HydrophobicContact CG-CD2 4.13Å; E352-L354 WeakPolarHBondContact OE1-CD2 3.47Å
355	P	97.5	Very high	96.2	Very high	66 Å²	66	63.7 Å²	63.7	43%	0.429	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-65.6	140.2	178.2	28.6	-33.9	0	0	0	111.1	F336 N357	F336-P355 WeakPolarHBondContact O-CA 2.95Å; P355-N357 PolarHBondContact O-N 3.43Å
356	C	97.7	Very high	96.2	Very high	4 Å²	4	69.1 Å²	69.1	3%	0.027	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-67.7	131.3	173.2	-67.3	0	0	0	0	111.1	F336 C358 C365	F336-C356 WeakPolarHBondContact CE1-O 2.96Å; F336-C356 HydrophobicContact CE2-CB 4.33Å; F336-C356 HydrophobicContact CZ-CB 4.43Å; F336-C356 VanDerWaalsContact CZ-O 3.22Å; F336-C356 WeakPolarHBondContact CZ-O 3.47Å; F336-C356 PolarHBondContact O-N 3.36Å; C356-C358 PolarHBondContact O-N 3.14Å; C356-C365 HydrophobicContact CB-CB 3.4Å; C356-C365 VanDerWaalsContact CB-CB 3.4Å; C356-C365 WeakPolarHBondContact CB-SG 3Å; C356-C365 WeakPolarHBondContact SG-CB 3.26Å; C356-C365 CovalentContact SG-SG 2.02Å; C356-C365 PolarHBondContact SG-SG 3.48Å
357	N	97.9	Very high	96.5	Very high	93 Å²	93	70.6 Å²	70.6	50%	0.497	33%	0.329	S	S	.	.			trans	-80	100.1	173.6	-176.5	4.2	0	0	0	111.3	P355 N359 C383 H394	P355-N357 PolarHBondContact O-N 3.43Å; N357-N359 PolarHBondContact OD1-N 2.94Å; N357-C383 PolarHBondContact O-SG 2.88Å; N357-C383 VanDerWaalsContact O-SG 3.42Å; N357-H394 WeakPolarHBondContact O-CA 3.42Å; N357-H394 VanDerWaalsContact O-CB 3.22Å; N357-H394 WeakPolarHBondContact O-CB 3.25Å; N357-H394 PolarHBondContact O-CD2 2.02Å
358	C	98.1	Very high	96.9	Very high	3 Å²	3	69 Å²	69	2%	0.02	31%	0.31	C	S	.	.			trans	-112.8	16.4	177.9	-58.9	0	0	0	0	114.2	F336 C356 L360 H361 A362 C383 H394	F336-C358 HydrophobicContact CE2-CB 4.2Å; F336-C358 HydrophobicContact CZ-CB 4.05Å; C356-C358 PolarHBondContact O-N 3.14Å; C358-L360 PolarHBondContact O-N 3.46Å; C358-H361 PolarHBondContact O-N 2.96Å; C358-A362 HydrophobicContact CB-CB 3.81Å; C358-C383 WeakPolarHBondContact CA-SG 3.2Å; C358-C383 HydrophobicContact CB-CB 3.87Å; C358-C383 WeakPolarHBondContact CB-SG 3.31Å; C358-C383 WeakPolarHBondContact SG-CB 3.37Å; C358-C383 CovalentContact SG-SG 2.02Å; C358-C383 PolarHBondContact SG-SG 3.33Å; C358-H394 CarbonylContact C-O 3.54Å
359	N	97.6	Very high	97.3	Very high	31 Å²	31	61.9 Å²	61.9	17%	0.166	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	49	33.9	-177.2	-67	-68.3	0	0	0	113.1	N357 H361 H394 S411	N357-N359 PolarHBondContact OD1-N 2.94Å; N359-H361 PolarHBondContact O-CD2 2.9Å; N359-H361 PolarHBondContact O-N 2.75Å; N359-H361 VanDerWaalsContact O-N 3.15Å; N359-H361 PolarHBondContact O-NE2 2.99Å; N359-H394 PolarHBondContact ND2-O 3.43Å; N359-S411 VanDerWaalsContact O-CA 3.22Å; N359-S411 WeakPolarHBondContact O-CA 3.44Å; N359-S411 WeakPolarHBondContact O-CB 3.39Å
360	L	97.9	Very high	97.5	Very high	140 Å²	140	62.8 Å²	62.8	73%	0.733	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	17.5	-176.2	-49.7	178.2	0	0	0	115.5	C358	C358-L360 PolarHBondContact O-N 3.46Å
361	H	98.1	Very high	97.5	Very high	2 Å²	2	64.9 Å²	64.9	1%	0.009	30%	0.302	C	S	.	.	S	Bend	trans	-100.9	-7.7	178.5	-63.5	-66.5	0	0	0	114.2	C358 N359 R387 H388 T390 C395 I410 H412	C358-H361 PolarHBondContact O-N 2.96Å; N359-H361 PolarHBondContact O-CD2 2.9Å; N359-H361 PolarHBondContact O-N 2.75Å; N359-H361 VanDerWaalsContact O-N 3.15Å; N359-H361 PolarHBondContact O-NE2 2.99Å; H361-R387 VanDerWaalsContact O-CB 3.29Å; H361-R387 WeakPolarHBondContact O-CB 3.03Å; H361-R387 PolarHBondContact O-N 3.04Å; H361-H388 AromaticContact CE1-ND1 3.66Å; H361-H388 WeakPolarHBondContact ND1-CB 3.39Å; H361-H388 AromaticContact ND1-CG 3.49Å; H361-H388 AromaticContact ND1-ND1 2.94Å; H361-H388 PolarHBondContact ND1-ND1 2.86Å; H361-T390 HydrophobicContact CB-CG2 4.49Å; H361-T390 WeakPolarHBondContact CB-OG1 3.42Å; H361-C395 HydrophobicContact CB-CB 3.55Å; H361-I410 PolarHBondContact NE2-O 3.32Å; H361-H412 PolarHBondContact CE1-O 3.11Å
362	A	97.9	Very high	97.5	Very high	8 Å²	8	65.5 Å²	65.5	7%	0.066	30%	0.304	C	S	.	.			trans	-137	151.2	173.9	0	0	0	0	0	110.6	F336 C358 C383 M384	F336-A362 WeakPolarHBondContact CE2-O 3.44Å; C358-A362 HydrophobicContact CB-CB 3.81Å; A362-C383 HydrophobicContact CB-CB 4.02Å; A362-M384 WeakPolarHBondContact CB-O 3.32Å
363	R	96.4	Very high	97.5	Very high	208 Å²	208	69.6 Å²	69.6	79%	0.785	32%	0.321	S	S	*	.	S	Bend	trans	-107.8	-4.5	174.1	-67	-176.6	176.8	168.3	-3.7	113	F336	F336-R363 VanDerWaalsContact CD2-C 3.46Å; F336-R363 WeakPolarHBondContact CD2-O 3.2Å
364	R	97.4	Very high	97.5	Very high	187 Å²	187	76.1 Å²	76.1	71%	0.706	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.5	143.7	-178.9	-65.6	-179.4	69.7	175.4	1.8	108.2	M384	R364-M384 HydrophobicContact CB-CB 4.24Å; R364-M384 PolarHBondContact O-N 3.46Å
365	C	97.7	Very high	97.5	Very high	11 Å²	11	75.7 Å²	75.7	7%	0.074	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	170.8	170.3	66.1	0	0	0	0	109.3	F336 Y338 C356 V382	F336-C365 HydrophobicContact CD2-CB 4.46Å; F336-C365 PolarHBondContact O-SG 3.21Å; Y338-C365 WeakPolarHBondContact CD2-O 3.48Å; C356-C365 HydrophobicContact CB-CB 3.4Å; C356-C365 VanDerWaalsContact CB-CB 3.4Å; C356-C365 WeakPolarHBondContact CB-SG 3Å; C356-C365 WeakPolarHBondContact SG-CB 3.26Å; C356-C365 CovalentContact SG-SG 2.02Å; C356-C365 PolarHBondContact SG-SG 3.48Å; C365-V382 CarbonylContact C-O 3.46Å; C365-V382 WeakPolarHBondContact CA-O 3.41Å; C365-V382 VanDerWaalsContact CB-O 3.27Å; C365-V382 WeakPolarHBondContact CB-O 3.45Å
366	R	97.4	Very high	97.4	Very high	115 Å²	115	75.1 Å²	75.1	43%	0.434	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	154.8	170.9	65.7	178.9	-177.2	90.6	-6	109.2	V382 M384	R366-V382 HydrophobicContact CG-CB 4.13Å; R366-V382 PolarHBondContact N-O 2.86Å; R366-V382 PolarHBondContact O-N 2.7Å; R366-M384 HydrophobicContact CG-CG 4.32Å; R366-M384 HydrophobicContact CG-SD 3.87Å
367	F	98.2	Very high	97.2	Very high	60 Å²	60	84 Å²	84	26%	0.263	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	148.5	172	179.9	-107.9	0	0	0	111.4	Y338 P341 M369 Y372	Y338-F367 WeakPolarHBondContact O-CD2 3.4Å; P341-F367 HydrophobicContact CG-CE1 3.95Å; P341-F367 HydrophobicContact CG-CE2 3.97Å; P341-F367 HydrophobicContact CG-CZ 3.47Å; P341-F367 VanDerWaalsContact CG-CZ 3.47Å; F367-M369 HydrophobicContact CE1-CB 3.87Å; F367-M369 HydrophobicContact CE1-CE 3.86Å; F367-M369 HydrophobicContact CE1-SD 4.17Å; F367-M369 HydrophobicContact CZ-CB 4.41Å; F367-M369 HydrophobicContact CZ-CE 4.24Å; F367-M369 HydrophobicContact CZ-SD 4.16Å; F367-Y372 HydrophobicContact CE2-CD2 4.06Å; F367-Y372 AromaticContact CE2-CG 3.87Å; F367-Y372 HydrophobicContact CE2-CG 3.87Å; F367-Y372 HydrophobicContact CZ-CD1 4.09Å; F367-Y372 HydrophobicContact CZ-CD2 4.44Å; F367-Y372 AromaticContact CZ-CG 3.81Å; F367-Y372 HydrophobicContact CZ-CG 3.81Å
368	N	97.9	Very high	97.1	Very high	36 Å²	36	87.2 Å²	87.2	19%	0.193	41%	0.405	C	S	.	.			trans	-134.7	115.4	170	-175.4	-33.9	0	0	0	110.2	E370 L371 Y372 G380 V382	N368-E370 PolarHBondContact O-N 3.15Å; N368-E370 WeakPolarHBondContact OD1-CB 3.33Å; N368-E370 PolarHBondContact OD1-N 3.03Å; N368-L371 HydrophobicContact CB-CB 4.28Å; N368-L371 HydrophobicContact CB-CD1 4.04Å; N368-L371 HydrophobicContact CB-CG 4.31Å; N368-L371 PolarHBondContact OD1-N 3Å; N368-Y372 PolarHBondContact O-N 3.08Å; N368-Y372 VanDerWaalsContact O-N 3.12Å; N368-G380 PolarHBondContact N-O 2.82Å; N368-V382 HydrophobicContact CB-CG2 3.91Å
369	M	97	Very high	97.1	Very high	92 Å²	92	88.3 Å²	88.3	45%	0.453	41%	0.413	S	S	.	.	H	α-helix	trans	-65.5	-34.8	-177.2	-177.2	58.2	79.9	0	0	113.5	P341 F367 Y372 K373	P341-M369 HydrophobicContact CG-CE 4.32Å; F367-M369 HydrophobicContact CE1-CB 3.87Å; F367-M369 HydrophobicContact CE1-CE 3.86Å; F367-M369 HydrophobicContact CE1-SD 4.17Å; F367-M369 HydrophobicContact CZ-CB 4.41Å; F367-M369 HydrophobicContact CZ-CE 4.24Å; F367-M369 HydrophobicContact CZ-SD 4.16Å; M369-Y372 PolarHBondContact O-N 2.88Å; M369-Y372 HydrophobicContact SD-CD1 4.22Å; M369-K373 WeakPolarHBondContact O-CG 3.32Å; M369-K373 PolarHBondContact O-N 3.43Å; M369-K373 HydrophobicContact SD-CG 4.47Å
370	E	97.3	Very high	97	Very high	139 Å²	139	86.9 Å²	86.9	65%	0.65	41%	0.405	S	S	*	.	H	α-helix	trans	-68.1	-46.3	-178.7	-171.8	178.8	-172	0	0	110.9	N368 Y372 K373 L374	N368-E370 PolarHBondContact O-N 3.15Å; N368-E370 WeakPolarHBondContact OD1-CB 3.33Å; N368-E370 PolarHBondContact OD1-N 3.03Å; E370-Y372 VanDerWaalsContact C-N 3.29Å; E370-Y372 PolarHBondContact O-N 2.77Å; E370-K373 PolarHBondContact O-N 3.27Å; E370-L374 HydrophobicContact CG-CD1 4.34Å; E370-L374 WeakPolarHBondContact O-CG 3.41Å; E370-L374 PolarHBondContact O-N 2.89Å
371	L	96.4	Very high	97	Very high	50 Å²	50	80.2 Å²	80.2	26%	0.262	37%	0.371	S	S	.	.	H	α-helix	trans	-62.8	-37.8	175.1	-69.2	177.2	0	0	0	112	N368 L374 S375 V382	N368-L371 HydrophobicContact CB-CB 4.28Å; N368-L371 HydrophobicContact CB-CD1 4.04Å; N368-L371 HydrophobicContact CB-CG 4.31Å; N368-L371 PolarHBondContact OD1-N 3Å; L371-L374 PolarHBondContact O-N 3.05Å; L371-S375 WeakPolarHBondContact O-CB 3.39Å; L371-S375 PolarHBondContact O-N 2.85Å; L371-S375 PolarHBondContact O-OG 2.92Å; L371-V382 HydrophobicContact CD1-CG2 3.58Å
372	Y	97.4	Very high	97	Very high	26 Å²	26	81 Å²	81	10%	0.102	38%	0.375	C	S	.	.	H	α-helix	trans	-60.9	-47.6	175.3	-174.6	-113.8	0	0	0	111.6	R340 P341 F367 N368 M369 E370 S375 R377	R340-Y372 HydrophobicContact CB-CD2 4.43Å; R340-Y372 HydrophobicContact CB-CE2 3.68Å; P341-Y372 HydrophobicContact CG-CD1 4.32Å; P341-Y372 HydrophobicContact CG-CE1 4.09Å; F367-Y372 HydrophobicContact CE2-CD2 4.06Å; F367-Y372 AromaticContact CE2-CG 3.87Å; F367-Y372 HydrophobicContact CE2-CG 3.87Å; F367-Y372 HydrophobicContact CZ-CD1 4.09Å; F367-Y372 HydrophobicContact CZ-CD2 4.44Å; F367-Y372 AromaticContact CZ-CG 3.81Å; F367-Y372 HydrophobicContact CZ-CG 3.81Å; N368-Y372 PolarHBondContact O-N 3.08Å; N368-Y372 VanDerWaalsContact O-N 3.12Å; M369-Y372 PolarHBondContact O-N 2.88Å; M369-Y372 HydrophobicContact SD-CD1 4.22Å; E370-Y372 VanDerWaalsContact C-N 3.29Å; E370-Y372 PolarHBondContact O-N 2.77Å; Y372-S375 PolarHBondContact O-N 2.92Å; Y372-S375 PolarHBondContact O-OG 2.94Å; Y372-R377 HydrophobicContact CD1-CB 4.35Å; Y372-R377 HydrophobicContact CD1-CG 4.3Å; Y372-R377 HydrophobicContact CE1-CB 3.67Å; Y372-R377 HydrophobicContact CE1-CG 3.85Å; Y372-R377 HydrophobicContact CE2-CB 4.3Å; Y372-R377 WeakPolarHBondContact CE2-O 3.02Å; Y372-R377 VanDerWaalsContact CZ-C 3.42Å; Y372-R377 VanDerWaalsContact CZ-CA 3.49Å; Y372-R377 VanDerWaalsContact O-CA 3.31Å; Y372-R377 WeakPolarHBondContact O-CA 3.26Å; Y372-R377 PolarHBondContact O-N 2.97Å; Y372-R377 PolarHBondContact OH-O 2.84Å
373	K	97.2	Very high	97	Very high	140 Å²	140	81.1 Å²	81.1	61%	0.609	38%	0.376	S	S	*	.	H	α-helix	trans	-60.7	-46.7	175.5	-71.1	177.6	-178.7	-177.7	0	111.9	M369 E370 S375 G376	M369-K373 WeakPolarHBondContact O-CG 3.32Å; M369-K373 PolarHBondContact O-N 3.43Å; M369-K373 HydrophobicContact SD-CG 4.47Å; E370-K373 PolarHBondContact O-N 3.27Å; K373-S375 VanDerWaalsContact C-N 3.25Å; K373-S375 PolarHBondContact O-N 2.94Å; K373-G376 PolarHBondContact O-N 2.82Å
374	L	97.2	Very high	97.1	Very high	137 Å²	137	74.7 Å²	74.7	72%	0.717	36%	0.356	S	S	*	.	H	α-helix	trans	-62.8	-29.8	178.7	-71.1	171.7	0	0	0	113.2	E370 L371 G376	E370-L374 HydrophobicContact CG-CD1 4.34Å; E370-L374 WeakPolarHBondContact O-CG 3.41Å; E370-L374 PolarHBondContact O-N 2.89Å; L371-L374 PolarHBondContact O-N 3.05Å; L374-G376 PolarHBondContact O-N 2.97Å
375	S	96.2	Very high	97.1	Very high	41 Å²	41	72.1 Å²	72.1	29%	0.287	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	1.1	175.5	75.1	0	0	0	0	114.4	L371 Y372 K373 K378 S379	L371-S375 WeakPolarHBondContact O-CB 3.39Å; L371-S375 PolarHBondContact O-N 2.85Å; L371-S375 PolarHBondContact O-OG 2.92Å; Y372-S375 PolarHBondContact O-N 2.92Å; Y372-S375 PolarHBondContact O-OG 2.94Å; K373-S375 VanDerWaalsContact C-N 3.25Å; K373-S375 PolarHBondContact O-N 2.94Å; S375-K378 PolarHBondContact OG-N 3.39Å; S375-S379 PolarHBondContact OG-N 3.04Å; S375-S379 PolarHBondContact OG-O 3.4Å
376	G	96.6	Very high	97.1	Very high	55 Å²	55	73.4 Å²	73.4	57%	0.567	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	38.3	-171.2	0	0	0	0	0	112.6	K373 L374 K378	K373-G376 PolarHBondContact O-N 2.82Å; L374-G376 PolarHBondContact O-N 2.97Å; G376-K378 VanDerWaalsContact C-N 3.32Å; G376-K378 PolarHBondContact O-N 3.48Å
377	R	94.3	Very high	97.1	Very high	190 Å²	190	74.9 Å²	74.9	72%	0.717	37%	0.37	S	S	*	.	S	Bend	trans	60.3	35.7	-177.6	-59.6	-177.1	176.4	175	-1.1	114	Y372	Y372-R377 HydrophobicContact CD1-CB 4.35Å; Y372-R377 HydrophobicContact CD1-CG 4.3Å; Y372-R377 HydrophobicContact CE1-CB 3.67Å; Y372-R377 HydrophobicContact CE1-CG 3.85Å; Y372-R377 HydrophobicContact CE2-CB 4.3Å; Y372-R377 WeakPolarHBondContact CE2-O 3.02Å; Y372-R377 VanDerWaalsContact CZ-C 3.42Å; Y372-R377 VanDerWaalsContact CZ-CA 3.49Å; Y372-R377 VanDerWaalsContact O-CA 3.31Å; Y372-R377 WeakPolarHBondContact O-CA 3.26Å; Y372-R377 PolarHBondContact O-N 2.97Å; Y372-R377 PolarHBondContact OH-O 2.84Å
378	K	95.1	Very high	97.1	Very high	161 Å²	161	74.4 Å²	74.4	70%	0.7	37%	0.369	S	S	*	.	S	Bend	trans	-101.7	-53.1	178.4	-66.1	-173.9	178	-176.5	0	113.1	S375 G376	S375-K378 PolarHBondContact OG-N 3.39Å; G376-K378 VanDerWaalsContact C-N 3.32Å; G376-K378 PolarHBondContact O-N 3.48Å
379	S	96.9	Very high	97.1	Very high	26 Å²	26	75.3 Å²	75.3	18%	0.182	37%	0.373	C	S	.	.			trans	-147.1	125.2	-174.9	166.7	0	0	0	0	112.3	D339 S375 R393	D339-S379 VanDerWaalsContact CG-OG 3.28Å; D339-S379 PolarHBondContact OD1-OG 2.94Å; D339-S379 VanDerWaalsContact OD2-CB 3.26Å; D339-S379 WeakPolarHBondContact OD2-CB 3.15Å; D339-S379 PolarHBondContact OD2-OG 3.27Å; S375-S379 PolarHBondContact OG-N 3.04Å; S375-S379 PolarHBondContact OG-O 3.4Å; S379-R393 PolarHBondContact O-NH2 3.29Å; S379-R393 PolarHBondContact OG-NH2 2.87Å; S379-R393 VanDerWaalsContact OG-NH2 3.09Å
380	G	97.1	Very high	97.1	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	35%	0.354	C	S	.	.			trans	-120.7	2.5	175.5	0	0	0	0	0	114.1	D339 N368 R393	D339-G380 PolarHBondContact O-N 3.01Å; N368-G380 PolarHBondContact N-O 2.82Å; G380-R393 VanDerWaalsContact C-NH2 3.34Å; G380-R393 VanDerWaalsContact CA-NH2 3.34Å
381	G	97.4	Very high	97.1	Very high	1 Å²	1	65.7 Å²	65.7	1%	0.01	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	137.8	-178.1	0	0	0	0	0	113	D339 R393	D339-G381 PolarHBondContact O-N 3.5Å; D339-G381 WeakPolarHBondContact OD1-CA 3.41Å; D339-G381 PolarHBondContact OD1-N 3.17Å; G381-R393 PolarHBondContact O-NE 2.78Å; G381-R393 PolarHBondContact O-NH2 2.66Å
382	V	98.3	Very high	97.2	Very high	18 Å²	18	64.4 Å²	64.4	11%	0.109	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	121.4	176.1	-175.9	0	0	0	0	109.4	C365 R366 N368 L371 R393	C365-V382 CarbonylContact C-O 3.46Å; C365-V382 WeakPolarHBondContact CA-O 3.41Å; C365-V382 VanDerWaalsContact CB-O 3.27Å; C365-V382 WeakPolarHBondContact CB-O 3.45Å; R366-V382 HydrophobicContact CG-CB 4.13Å; R366-V382 PolarHBondContact N-O 2.86Å; R366-V382 PolarHBondContact O-N 2.7Å; N368-V382 HydrophobicContact CB-CG2 3.91Å; L371-V382 HydrophobicContact CD1-CG2 3.58Å; V382-R393 HydrophobicContact CB-CG 4.48Å; V382-R393 HydrophobicContact CG1-CG 4.36Å; V382-R393 HydrophobicContact CG2-CG 4.22Å
383	C	98.4	Very high	97.1	Very high	11 Å²	11	66 Å²	66	7%	0.074	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	144.8	-179.8	-56.3	0	0	0	0	111.7	N357 C358 A362 R393	N357-C383 PolarHBondContact O-SG 2.88Å; N357-C383 VanDerWaalsContact O-SG 3.42Å; C358-C383 WeakPolarHBondContact CA-SG 3.2Å; C358-C383 HydrophobicContact CB-CB 3.87Å; C358-C383 WeakPolarHBondContact CB-SG 3.31Å; C358-C383 WeakPolarHBondContact SG-CB 3.37Å; C358-C383 CovalentContact SG-SG 2.02Å; C358-C383 PolarHBondContact SG-SG 3.33Å; A362-C383 HydrophobicContact CB-CB 4.02Å; C383-R393 WeakPolarHBondContact CB-O 3.26Å; C383-R393 PolarHBondContact N-O 3.19Å; C383-R393 PolarHBondContact SG-O 3.23Å
384	M	97.9	Very high	97.1	Very high	73 Å²	73	61.4 Å²	61.4	36%	0.36	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	136.3	-178.6	-61.5	-65.1	-70.9	0	0	109.8	A362 R364 R366	A362-M384 WeakPolarHBondContact CB-O 3.32Å; R364-M384 HydrophobicContact CB-CB 4.24Å; R364-M384 PolarHBondContact O-N 3.46Å; R366-M384 HydrophobicContact CG-CG 4.32Å; R366-M384 HydrophobicContact CG-SD 3.87Å
385	N	97	Very high	97.2	Very high	132 Å²	132	54.9 Å²	54.9	71%	0.706	28%	0.282	S	S	*	.	S	Bend	trans	53.8	60.2	177.8	-58.2	-21.6	0	0	0	113	R387	N385-R387 PolarHBondContact O-N 3.46Å
386	C	98.1	Very high	97.2	Very high	38 Å²	38	57.2 Å²	57.2	26%	0.257	29%	0.289	S	S	.	.			trans	-53	121.3	175.2	-67.9	0	0	0	0	111.2	T390 C395	C386-T390 VanDerWaalsContact CB-O 3.28Å; C386-T390 WeakPolarHBondContact CB-O 3.45Å; C386-C395 VanDerWaalsContact CA-SG 3.57Å; C386-C395 HydrophobicContact CB-CB 3.85Å; C386-C395 WeakPolarHBondContact CB-SG 3.35Å; C386-C395 WeakPolarHBondContact SG-CA 3.47Å; C386-C395 WeakPolarHBondContact SG-CB 3.47Å; C386-C395 CovalentContact SG-SG 2.05Å; C386-C395 PolarHBondContact SG-SG 2.65Å
387	R	97.9	Very high	97.2	Very high	147 Å²	147	59.3 Å²	59.3	56%	0.555	28%	0.28	S	S	*	.			trans	-91.2	179.6	177.6	-61.2	174.7	64.7	130.9	-0.3	110.3	H361 N385 N389 T390	H361-R387 VanDerWaalsContact O-CB 3.29Å; H361-R387 WeakPolarHBondContact O-CB 3.03Å; H361-R387 PolarHBondContact O-N 3.04Å; N385-R387 PolarHBondContact O-N 3.46Å; R387-N389 PolarHBondContact O-N 2.73Å; R387-T390 PolarHBondContact O-N 3.47Å; R387-T390 PolarHBondContact O-OG1 2.9Å
388	H	98	Very high	97.4	Very high	50 Å²	50	50.4 Å²	50.4	23%	0.231	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	30.9	174.6	-49.4	138.1	0	0	0	113.5	H361 T390 R413	H361-H388 AromaticContact CE1-ND1 3.66Å; H361-H388 WeakPolarHBondContact ND1-CB 3.39Å; H361-H388 AromaticContact ND1-CG 3.49Å; H361-H388 AromaticContact ND1-ND1 2.94Å; H361-H388 PolarHBondContact ND1-ND1 2.86Å; H388-T390 PolarHBondContact O-N 2.86Å; H388-R413 WeakPolarHBondContact CB-O 3.31Å
389	N	97.5	Very high	97.4	Very high	55 Å²	55	46.6 Å²	46.6	29%	0.294	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	26	179.3	-52.8	-51	0	0	0	114.3	R387 K399 F402 C416	R387-N389 PolarHBondContact O-N 2.73Å; N389-K399 HydrophobicContact CB-CD 4.05Å; N389-K399 HydrophobicContact CB-CG 4.15Å; N389-K399 WeakPolarHBondContact O-CG 3.34Å; N389-K399 PolarHBondContact O-N 2.77Å; N389-K399 WeakPolarHBondContact OD1-CE 3.5Å; N389-K399 PolarHBondContact OD1-NZ 3.02Å; N389-F402 HydrophobicContact CB-CD1 3.54Å; N389-F402 HydrophobicContact CB-CD2 4.03Å; N389-F402 HydrophobicContact CB-CE1 3.68Å; N389-F402 HydrophobicContact CB-CE2 4.17Å; N389-F402 HydrophobicContact CB-CG 3.75Å; N389-F402 HydrophobicContact CB-CZ 4Å; N389-F402 VanDerWaalsContact CG-CZ 3.43Å; N389-F402 WeakPolarHBondContact ND2-CE1 3.08Å; N389-C416 HydrophobicContact CB-CB 4.13Å
390	T	98	Very high	97.4	Very high	6 Å²	6	53.2 Å²	53.2	4%	0.037	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	162.4	172.7	59.6	0	0	0	0	111	H361 C386 R387 H388 C395 Y397	H361-T390 HydrophobicContact CB-CG2 4.49Å; H361-T390 WeakPolarHBondContact CB-OG1 3.42Å; C386-T390 VanDerWaalsContact CB-O 3.28Å; C386-T390 WeakPolarHBondContact CB-O 3.45Å; R387-T390 PolarHBondContact O-N 3.47Å; R387-T390 PolarHBondContact O-OG1 2.9Å; H388-T390 PolarHBondContact O-N 2.86Å; T390-C395 WeakPolarHBondContact OG1-CB 3.07Å; T390-Y397 CarbonylContact C-O 3.49Å; T390-Y397 VanDerWaalsContact CA-O 3.26Å; T390-Y397 WeakPolarHBondContact CA-O 3.04Å
391	A	97.2	Very high	97.2	Very high	23 Å²	23	54.2 Å²	54.2	19%	0.19	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	171.8	179.7	0	0	0	0	0	110.7	C395 H396 Y397 K399	A391-C395 CarbonylContact O-C 3.59Å; A391-C395 WeakPolarHBondContact O-CA 3.49Å; A391-H396 PolarHBondContact O-N 2.85Å; A391-Y397 HydrophobicContact CB-CD2 3.97Å; A391-Y397 HydrophobicContact CB-CE2 3.44Å; A391-Y397 VanDerWaalsContact CB-CE2 3.44Å; A391-Y397 PolarHBondContact N-O 3.34Å; A391-Y397 PolarHBondContact O-N 3.23Å; A391-K399 HydrophobicContact CB-CB 4.07Å
392	G	96.6	Very high	97.2	Very high	22 Å²	22	56 Å²	56	23%	0.227	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.7	171.5	-178.1	0	0	0	0	0	114.4	H394 C395 Y397	G392-H394 VanDerWaalsContact C-N 3.29Å; G392-H394 PolarHBondContact O-N 3.26Å; G392-C395 PolarHBondContact O-N 3.37Å; G392-Y397 VanDerWaalsContact CA-CZ 3.46Å; G392-Y397 WeakPolarHBondContact CA-OH 3.38Å; G392-Y397 PolarHBondContact N-OH 3.34Å
393	R	96.7	Very high	97.2	Very high	61 Å²	61	57.1 Å²	57.1	23%	0.23	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-45.2	-174.7	178.2	-178.1	171.5	-177	-5.6	113.8	S379 G380 G381 V382 C383	S379-R393 PolarHBondContact O-NH2 3.29Å; S379-R393 PolarHBondContact OG-NH2 2.87Å; S379-R393 VanDerWaalsContact OG-NH2 3.09Å; G380-R393 VanDerWaalsContact C-NH2 3.34Å; G380-R393 VanDerWaalsContact CA-NH2 3.34Å; G381-R393 PolarHBondContact O-NE 2.78Å; G381-R393 PolarHBondContact O-NH2 2.66Å; V382-R393 HydrophobicContact CB-CG 4.48Å; V382-R393 HydrophobicContact CG1-CG 4.36Å; V382-R393 HydrophobicContact CG2-CG 4.22Å; C383-R393 WeakPolarHBondContact CB-O 3.26Å; C383-R393 PolarHBondContact N-O 3.19Å; C383-R393 PolarHBondContact SG-O 3.23Å
394	H	97.6	Very high	97.1	Very high	42 Å²	42	58.9 Å²	58.9	19%	0.194	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	15.9	-179.2	-57.1	119.8	0	0	0	113.1	N357 C358 N359 G392 H396	N357-H394 WeakPolarHBondContact O-CA 3.42Å; N357-H394 VanDerWaalsContact O-CB 3.22Å; N357-H394 WeakPolarHBondContact O-CB 3.25Å; N357-H394 PolarHBondContact O-CD2 2.02Å; C358-H394 CarbonylContact C-O 3.54Å; N359-H394 PolarHBondContact ND2-O 3.43Å; G392-H394 VanDerWaalsContact C-N 3.29Å; G392-H394 PolarHBondContact O-N 3.26Å; H394-H396 HydrophobicContact CB-CB 4.29Å; H394-H396 PolarHBondContact N-ND1 3.49Å; H394-H396 PolarHBondContact O-N 3.31Å
395	C	98.1	Very high	97	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	43.4	-172.3	-50.2	0	0	0	0	112.5	H361 C386 T390 A391 G392	H361-C395 HydrophobicContact CB-CB 3.55Å; C386-C395 VanDerWaalsContact CA-SG 3.57Å; C386-C395 HydrophobicContact CB-CB 3.85Å; C386-C395 WeakPolarHBondContact CB-SG 3.35Å; C386-C395 WeakPolarHBondContact SG-CA 3.47Å; C386-C395 WeakPolarHBondContact SG-CB 3.47Å; C386-C395 CovalentContact SG-SG 2.05Å; C386-C395 PolarHBondContact SG-SG 2.65Å; T390-C395 WeakPolarHBondContact OG1-CB 3.07Å; A391-C395 CarbonylContact O-C 3.59Å; A391-C395 WeakPolarHBondContact O-CA 3.49Å; G392-C395 PolarHBondContact O-N 3.37Å
396	H	97.1	Very high	96.9	Very high	91 Å²	91	57 Å²	57	42%	0.421	27%	0.273	S	S	.	.			trans	-103.3	-4.1	-165.1	60	-76.7	0	0	0	113.7	A391 H394 I410	A391-H396 PolarHBondContact O-N 2.85Å; H394-H396 HydrophobicContact CB-CB 4.29Å; H394-H396 PolarHBondContact N-ND1 3.49Å; H394-H396 PolarHBondContact O-N 3.31Å; H396-I410 WeakPolarHBondContact O-CD1 3.37Å
397	Y	96.8	Very high	96.8	Very high	99 Å²	99	59.7 Å²	59.7	39%	0.388	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	168.8	172.5	62.4	-101.7	0	0	0	110.4	T390 A391 G392	T390-Y397 CarbonylContact C-O 3.49Å; T390-Y397 VanDerWaalsContact CA-O 3.26Å; T390-Y397 WeakPolarHBondContact CA-O 3.04Å; A391-Y397 HydrophobicContact CB-CD2 3.97Å; A391-Y397 HydrophobicContact CB-CE2 3.44Å; A391-Y397 VanDerWaalsContact CB-CE2 3.44Å; A391-Y397 PolarHBondContact N-O 3.34Å; A391-Y397 PolarHBondContact O-N 3.23Å; G392-Y397 VanDerWaalsContact CA-CZ 3.46Å; G392-Y397 WeakPolarHBondContact CA-OH 3.38Å; G392-Y397 PolarHBondContact N-OH 3.34Å
398	C	97.3	Very high	96.7	Very high	2 Å²	2	57 Å²	57	1%	0.014	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	140.8	-177.9	-60.8	0	0	0	0	111.9	F402 Y403 C416 Q433	C398-F402 HydrophobicContact CB-CB 3.96Å; C398-Y403 VanDerWaalsContact SG-C 3.59Å; C398-C416 WeakPolarHBondContact CA-SG 3.37Å; C398-C416 HydrophobicContact CB-CB 3.77Å; C398-C416 WeakPolarHBondContact CB-SG 3.43Å; C398-C416 WeakPolarHBondContact SG-CA 3.04Å; C398-C416 WeakPolarHBondContact SG-CB 3.31Å; C398-C416 CovalentContact SG-SG 2.04Å; C398-C416 PolarHBondContact SG-SG 2.82Å; C398-Q433 PolarHBondContact O-NE2 3.5Å
399	K	96.4	Very high	96.6	Very high	82 Å²	82	58.6 Å²	58.6	36%	0.357	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-62	159.8	175.3	75.2	179.9	-177.5	-177.9	0	110.9	N389 A391 G401 F402	N389-K399 HydrophobicContact CB-CD 4.05Å; N389-K399 HydrophobicContact CB-CG 4.15Å; N389-K399 WeakPolarHBondContact O-CG 3.34Å; N389-K399 PolarHBondContact O-N 2.77Å; N389-K399 WeakPolarHBondContact OD1-CE 3.5Å; N389-K399 PolarHBondContact OD1-NZ 3.02Å; A391-K399 HydrophobicContact CB-CB 4.07Å; K399-G401 PolarHBondContact O-N 3.21Å; K399-F402 HydrophobicContact CD-CD2 4.1Å; K399-F402 HydrophobicContact CD-CE2 4.26Å; K399-F402 HydrophobicContact CG-CB 4.44Å; K399-F402 HydrophobicContact CG-CD2 3.58Å; K399-F402 HydrophobicContact CG-CE2 4.24Å; K399-F402 HydrophobicContact CG-CG 4.23Å; K399-F402 WeakPolarHBondContact O-CB 3.26Å; K399-F402 PolarHBondContact O-N 3.33Å
400	E	95.3	Very high	96.6	Very high	164 Å²	164	58 Å²	58	77%	0.766	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	138.1	175.5	-65.7	-178	176.8	0	0	111.9	F402 T430	E400-F402 VanDerWaalsContact C-N 3.31Å; E400-T430 HydrophobicContact CB-CG2 4.31Å
401	G	94.8	Very high	96.6	Very high	21 Å²	21	59.9 Å²	59.9	22%	0.216	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.9	4.1	-171.2	0	0	0	0	0	114.5	K399 C419	K399-G401 PolarHBondContact O-N 3.21Å; G401-C419 WeakPolarHBondContact O-CB 3.15Å; G401-C419 PolarHBondContact O-N 3.31Å; G401-C419 PolarHBondContact O-SG 3.3Å
402	F	97.3	Very high	96.6	Very high	38 Å²	38	62 Å²	62	17%	0.167	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	154.5	171.8	-68.7	-104.9	0	0	0	110.7	N389 C398 K399 E400 C416 K417 A418	N389-F402 HydrophobicContact CB-CD1 3.54Å; N389-F402 HydrophobicContact CB-CD2 4.03Å; N389-F402 HydrophobicContact CB-CE1 3.68Å; N389-F402 HydrophobicContact CB-CE2 4.17Å; N389-F402 HydrophobicContact CB-CG 3.75Å; N389-F402 HydrophobicContact CB-CZ 4Å; N389-F402 VanDerWaalsContact CG-CZ 3.43Å; N389-F402 WeakPolarHBondContact ND2-CE1 3.08Å; C398-F402 HydrophobicContact CB-CB 3.96Å; K399-F402 HydrophobicContact CD-CD2 4.1Å; K399-F402 HydrophobicContact CD-CE2 4.26Å; K399-F402 HydrophobicContact CG-CB 4.44Å; K399-F402 HydrophobicContact CG-CD2 3.58Å; K399-F402 HydrophobicContact CG-CE2 4.24Å; K399-F402 HydrophobicContact CG-CG 4.23Å; K399-F402 WeakPolarHBondContact O-CB 3.26Å; K399-F402 PolarHBondContact O-N 3.33Å; E400-F402 VanDerWaalsContact C-N 3.31Å; F402-C416 HydrophobicContact CB-CB 4.22Å; F402-C416 HydrophobicContact CD1-CB 4.39Å; F402-K417 CarbonylContact C-O 3.59Å; F402-K417 WeakPolarHBondContact CA-O 3.25Å; F402-K417 WeakPolarHBondContact CB-O 3.32Å; F402-K417 VanDerWaalsContact CD1-C 3.49Å; F402-K417 WeakPolarHBondContact CD1-O 3.39Å; F402-A418 HydrophobicContact CD1-CB 4.15Å; F402-A418 HydrophobicContact CE1-CB 3.76Å; F402-A418 HydrophobicContact CZ-CB 4.17Å
403	Y	96.9	Very high	96.6	Very high	43 Å²	43	69.8 Å²	69.8	17%	0.169	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	160.9	175.7	76.2	-81.2	0	0	0	111.5	C398 C416 K417 A418 N432 Q433 G436	C398-Y403 VanDerWaalsContact SG-C 3.59Å; Y403-C416 CarbonylContact O-C 3.46Å; Y403-C416 WeakPolarHBondContact O-CA 3.48Å; Y403-K417 HydrophobicContact CD1-CB 4.24Å; Y403-K417 VanDerWaalsContact CD1-O 3.3Å; Y403-K417 WeakPolarHBondContact CD1-O 3.16Å; Y403-K417 HydrophobicContact CE1-CB 3.76Å; Y403-K417 HydrophobicContact CE1-CD 4.12Å; Y403-K417 HydrophobicContact CE1-CG 3.78Å; Y403-K417 PolarHBondContact N-O 2.93Å; Y403-K417 PolarHBondContact O-N 3.02Å; Y403-K417 WeakPolarHBondContact OH-CD 3.26Å; Y403-A418 WeakPolarHBondContact CE1-O 3.12Å; Y403-N432 WeakPolarHBondContact CB-O 3.35Å; Y403-Q433 CarbonylContact C-O 3.59Å; Y403-Q433 WeakPolarHBondContact CA-O 3.42Å; Y403-G436 VanDerWaalsContact CG-CA 3.46Å
404	R	96.9	Very high	96.6	Very high	47 Å²	47	75.4 Å²	75.4	18%	0.177	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	121.4	-175.4	-178.2	69.6	-179.1	79	18.4	111	M406 R408 A415 Q433	R404-M406 HydrophobicContact CG-CE 4.05Å; R404-M406 HydrophobicContact CG-SD 3.7Å; R404-M406 PolarHBondContact O-N 3.24Å; R404-R408 PolarHBondContact NH1-O 2.98Å; R404-R408 PolarHBondContact NH2-O 3.34Å; R404-A415 PolarHBondContact NH1-O 2.88Å; R404-Q433 WeakPolarHBondContact CB-O 3.43Å; R404-Q433 PolarHBondContact N-O 3.49Å
405	D	96.3	Very high	96.6	Very high	40 Å²	40	73.4 Å²	73.4	21%	0.214	35%	0.352	C	S	.	.			trans	-84.6	90.9	171.7	179.2	10.4	0	0	0	111	A407 R408 A415	D405-A407 PolarHBondContact O-N 3.49Å; D405-A407 WeakPolarHBondContact OD1-CB 3.44Å; D405-A407 PolarHBondContact OD1-N 2.8Å; D405-R408 PolarHBondContact O-N 3.26Å; D405-R408 VanDerWaalsContact OD2-CD 3.32Å; D405-R408 WeakPolarHBondContact OD2-CD 3.13Å; D405-R408 IonicContact OD2-NE 3.35Å; D405-R408 PolarHBondContact OD2-NE 3.49Å; D405-A415 PolarHBondContact N-O 3Å
406	M	94.6	Very high	96.6	Very high	127 Å²	127	73.8 Å²	73.8	63%	0.626	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-17.8	-175.2	-65.7	-59.7	-168	0	0	114.5	R404 R408 T434	R404-M406 HydrophobicContact CG-CE 4.05Å; R404-M406 HydrophobicContact CG-SD 3.7Å; R404-M406 PolarHBondContact O-N 3.24Å; M406-R408 PolarHBondContact O-N 2.9Å; M406-T434 HydrophobicContact CE-CG2 3.81Å
407	A	95.5	Very high	96.5	Very high	93 Å²	93	74.4 Å²	74.4	77%	0.769	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-14.3	175.3	0	0	0	0	0	113.6	D405	D405-A407 PolarHBondContact O-N 3.49Å; D405-A407 WeakPolarHBondContact OD1-CB 3.44Å; D405-A407 PolarHBondContact OD1-N 2.8Å
408	R	95.8	Very high	96.5	Very high	90 Å²	90	71.4 Å²	71.4	34%	0.34	35%	0.352	S	S	.	.	S	Bend	trans	-118.1	149	-178.3	-60	177.6	-176.5	-92.8	-4.2	110.4	R404 D405 M406 H412	R404-R408 PolarHBondContact NH1-O 2.98Å; R404-R408 PolarHBondContact NH2-O 3.34Å; D405-R408 PolarHBondContact O-N 3.26Å; D405-R408 VanDerWaalsContact OD2-CD 3.32Å; D405-R408 WeakPolarHBondContact OD2-CD 3.13Å; D405-R408 IonicContact OD2-NE 3.35Å; D405-R408 PolarHBondContact OD2-NE 3.49Å; M406-R408 PolarHBondContact O-N 2.9Å; R408-H412 HydrophobicContact CB-CB 4.09Å; R408-H412 PolarHBondContact NH1-CE1 3.32Å; R408-H412 PolarHBondContact NH1-NE2 2.89Å
409	P	97.1	Very high	96.5	Very high	84 Å²	84	72.1 Å²	72.1	55%	0.545	36%	0.357	S	S	.	.			trans	-66.4	156.7	173	28.3	-33.6	0	0	0	110.9	S411 H412 A415	P409-S411 PolarHBondContact O-N 3.06Å; P409-H412 HydrophobicContact CG-CB 4.15Å; P409-H412 VanDerWaalsContact O-CB 3.26Å; P409-H412 WeakPolarHBondContact O-CB 3.37Å; P409-H412 PolarHBondContact O-N 3.43Å; P409-A415 WeakPolarHBondContact O-CB 3.02Å
410	I	96.5	Very high	96.5	Very high	42 Å²	42	73.5 Å²	73.5	22%	0.215	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-34.5	-177.3	-177	58	0	0	0	112.2	H361 H396 H412 A415	H361-I410 PolarHBondContact NE2-O 3.32Å; H396-I410 WeakPolarHBondContact O-CD1 3.37Å; I410-H412 PolarHBondContact O-N 3.13Å; I410-A415 VanDerWaalsContact O-CB 3.24Å; I410-A415 WeakPolarHBondContact O-CB 3.41Å
411	S	97.3	Very high	96.5	Very high	47 Å²	47	66.6 Å²	66.6	33%	0.329	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-7	-179.3	57.5	0	0	0	0	115.2	N359 P409	N359-S411 VanDerWaalsContact O-CA 3.22Å; N359-S411 WeakPolarHBondContact O-CA 3.44Å; N359-S411 WeakPolarHBondContact O-CB 3.39Å; P409-S411 PolarHBondContact O-N 3.06Å
412	H	98	Very high	96.6	Very high	67 Å²	67	69.2 Å²	69.2	31%	0.31	34%	0.344	S	S	.	.	S	Bend	trans	-72.2	140.2	-176.9	-171.9	-86.5	0	0	0	111.4	H361 R408 P409 I410 R414 A415	H361-H412 PolarHBondContact CE1-O 3.11Å; R408-H412 HydrophobicContact CB-CB 4.09Å; R408-H412 PolarHBondContact NH1-CE1 3.32Å; R408-H412 PolarHBondContact NH1-NE2 2.89Å; P409-H412 HydrophobicContact CG-CB 4.15Å; P409-H412 VanDerWaalsContact O-CB 3.26Å; P409-H412 WeakPolarHBondContact O-CB 3.37Å; P409-H412 PolarHBondContact O-N 3.43Å; I410-H412 PolarHBondContact O-N 3.13Å; H412-R414 PolarHBondContact ND1-N 3.11Å; H412-R414 PolarHBondContact O-N 2.8Å; H412-A415 HydrophobicContact CB-CB 4.38Å; H412-A415 VanDerWaalsContact O-CB 3.23Å; H412-A415 WeakPolarHBondContact O-CB 3.3Å; H412-A415 PolarHBondContact O-N 2.81Å
413	R	97.3	Very high	96.5	Very high	186 Å²	186	73.1 Å²	73.1	70%	0.702	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-19.5	-180	-61.1	-168.5	-178.8	170.7	1.6	115.4	H388	H388-R413 WeakPolarHBondContact CB-O 3.31Å
414	R	96.8	Very high	96.4	Very high	178 Å²	178	73.4 Å²	73.4	67%	0.672	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.5	25.7	177.1	-58.4	-175.2	-177.2	171.4	1.2	112.6	H412 C416	H412-R414 PolarHBondContact ND1-N 3.11Å; H412-R414 PolarHBondContact O-N 2.8Å; R414-C416 PolarHBondContact O-N 2.87Å
415	A	96.9	Very high	96.3	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	37%	0.373	C	S	.	.	S	Bend	trans	-62.6	-21.4	176.3	0	0	0	0	0	113	R404 D405 P409 I410 H412	R404-A415 PolarHBondContact NH1-O 2.88Å; D405-A415 PolarHBondContact N-O 3Å; P409-A415 WeakPolarHBondContact O-CB 3.02Å; I410-A415 VanDerWaalsContact O-CB 3.24Å; I410-A415 WeakPolarHBondContact O-CB 3.41Å; H412-A415 HydrophobicContact CB-CB 4.38Å; H412-A415 VanDerWaalsContact O-CB 3.23Å; H412-A415 WeakPolarHBondContact O-CB 3.3Å; H412-A415 PolarHBondContact O-N 2.81Å
416	C	97.3	Very high	96.3	Very high	9 Å²	9	69.9 Å²	69.9	6%	0.061	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	120.5	176.1	-65.6	0	0	0	0	111.2	N389 C398 F402 Y403 R414	N389-C416 HydrophobicContact CB-CB 4.13Å; C398-C416 WeakPolarHBondContact CA-SG 3.37Å; C398-C416 HydrophobicContact CB-CB 3.77Å; C398-C416 WeakPolarHBondContact CB-SG 3.43Å; C398-C416 WeakPolarHBondContact SG-CA 3.04Å; C398-C416 WeakPolarHBondContact SG-CB 3.31Å; C398-C416 CovalentContact SG-SG 2.04Å; C398-C416 PolarHBondContact SG-SG 2.82Å; F402-C416 HydrophobicContact CB-CB 4.22Å; F402-C416 HydrophobicContact CD1-CB 4.39Å; Y403-C416 CarbonylContact O-C 3.46Å; Y403-C416 WeakPolarHBondContact O-CA 3.48Å; R414-C416 PolarHBondContact O-N 2.87Å
417	K	96.6	Very high	96.3	Very high	103 Å²	103	67.5 Å²	67.5	45%	0.448	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	144.2	178.2	-174.9	167.6	167.6	-167.3	0	110.3	F402 Y403	F402-K417 CarbonylContact C-O 3.59Å; F402-K417 WeakPolarHBondContact CA-O 3.25Å; F402-K417 WeakPolarHBondContact CB-O 3.32Å; F402-K417 VanDerWaalsContact CD1-C 3.49Å; F402-K417 WeakPolarHBondContact CD1-O 3.39Å; Y403-K417 HydrophobicContact CD1-CB 4.24Å; Y403-K417 VanDerWaalsContact CD1-O 3.3Å; Y403-K417 WeakPolarHBondContact CD1-O 3.16Å; Y403-K417 HydrophobicContact CE1-CB 3.76Å; Y403-K417 HydrophobicContact CE1-CD 4.12Å; Y403-K417 HydrophobicContact CE1-CG 3.78Å; Y403-K417 PolarHBondContact N-O 2.93Å; Y403-K417 PolarHBondContact O-N 3.02Å; Y403-K417 WeakPolarHBondContact OH-CD 3.26Å
418	A	96.9	Very high	96.2	Very high	36 Å²	36	64.4 Å²	64.4	30%	0.298	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	146.2	-177.7	0	0	0	0	0	111.5	F402 Y403 D420	F402-A418 HydrophobicContact CD1-CB 4.15Å; F402-A418 HydrophobicContact CE1-CB 3.76Å; F402-A418 HydrophobicContact CZ-CB 4.17Å; Y403-A418 WeakPolarHBondContact CE1-O 3.12Å; A418-D420 PolarHBondContact O-N 2.88Å
419	C	96	Very high	96	Very high	18 Å²	18	69 Å²	69	12%	0.122	37%	0.367	C	S	.	.			trans	-78.1	100.9	169.4	-60	0	0	0	0	109.2	G401 C421 C431	G401-C419 WeakPolarHBondContact O-CB 3.15Å; G401-C419 PolarHBondContact O-N 3.31Å; G401-C419 PolarHBondContact O-SG 3.3Å; C419-C421 PolarHBondContact O-N 2.91Å; C419-C431 HydrophobicContact CB-CB 3.64Å; C419-C431 WeakPolarHBondContact CB-SG 3.24Å; C419-C431 WeakPolarHBondContact SG-CB 3.21Å; C419-C431 PolarHBondContact SG-N 2.97Å; C419-C431 CovalentContact SG-SG 2.02Å; C419-C431 PolarHBondContact SG-SG 3.18Å
420	D	96	Very high	95.9	Very high	111 Å²	111	68.8 Å²	68.8	59%	0.594	36%	0.364	S	S	*	.			trans	-83.3	51.7	177.2	-64.5	-30.5	0	0	0	111.4	A418 H422 T448	A418-D420 PolarHBondContact O-N 2.88Å; D420-H422 PolarHBondContact O-N 2.75Å; D420-T448 HydrophobicContact CB-CG2 4.11Å; D420-T448 WeakPolarHBondContact O-CB 3.32Å; D420-T448 WeakPolarHBondContact O-CG2 3.29Å
421	C	96.4	Very high	95.9	Very high	19 Å²	19	67.4 Å²	67.4	13%	0.128	36%	0.358	C	S	.	.			trans	-65.3	127.8	-178.4	-58.5	0	0	0	0	111.3	C419 A426 C438	C419-C421 PolarHBondContact O-N 2.91Å; C421-A426 HydrophobicContact CB-CB 3.84Å; C421-C438 WeakPolarHBondContact CA-SG 3.42Å; C421-C438 HydrophobicContact CB-CB 3.77Å; C421-C438 WeakPolarHBondContact CB-SG 3.24Å; C421-C438 WeakPolarHBondContact SG-CB 3.39Å; C421-C438 CovalentContact SG-SG 2.03Å; C421-C438 PolarHBondContact SG-SG 2.84Å
422	H	96.4	Very high	95.8	Very high	75 Å²	75	69 Å²	69	35%	0.347	36%	0.363	S	S	.	.			trans	-62.5	126.5	-176.7	-166.8	-95.7	0	0	0	110.7	D420 V424 G425 A426 T448 C449	D420-H422 PolarHBondContact O-N 2.75Å; H422-V424 PolarHBondContact O-N 2.79Å; H422-V424 VanDerWaalsContact O-N 3.11Å; H422-G425 PolarHBondContact ND1-N 3.05Å; H422-G425 PolarHBondContact O-N 2.81Å; H422-A426 WeakPolarHBondContact O-CB 3.36Å; H422-A426 PolarHBondContact O-N 2.91Å; H422-T448 WeakPolarHBondContact CB-O 3.2Å; H422-T448 PolarHBondContact N-O 2.89Å; H422-C449 VanDerWaalsContact CB-O 3.29Å; H422-C449 WeakPolarHBondContact CB-O 3.43Å
423	P	95	Very high	95.5	Very high	120 Å²	120	69.5 Å²	69.5	78%	0.779	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-29	-169.8	23	-34.1	0	0	0	113.5
424	V	95.1	Very high	95.2	Very high	50 Å²	50	64.9 Å²	64.9	30%	0.303	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-35.4	179.2	-173.5	0	0	0	0	112	H422 K441 P462 P465	H422-V424 PolarHBondContact O-N 2.79Å; H422-V424 VanDerWaalsContact O-N 3.11Å; V424-K441 WeakPolarHBondContact O-CD 3.28Å; V424-K441 VanDerWaalsContact O-CE 3.23Å; V424-K441 WeakPolarHBondContact O-CE 3.36Å; V424-K441 PolarHBondContact O-NZ 2.86Å; V424-P462 HydrophobicContact CG1-CB 4.34Å; V424-P462 WeakPolarHBondContact CG1-O 3.24Å; V424-P465 HydrophobicContact CG1-CB 3.83Å; V424-P465 HydrophobicContact CG1-CG 4.2Å
425	G	94.5	Very high	95.1	Very high	3 Å²	3	60.1 Å²	60.1	3%	0.031	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-24.8	-168.9	0	0	0	0	0	114	H422 K441 C449	H422-G425 PolarHBondContact ND1-N 3.05Å; H422-G425 PolarHBondContact O-N 2.81Å; G425-K441 WeakPolarHBondContact O-CB 3.41Å; G425-K441 WeakPolarHBondContact O-CG 3.34Å; G425-K441 PolarHBondContact O-N 2.75Å; G425-C449 WeakPolarHBondContact CA-O 3.39Å
426	A	96.6	Very high	95	Very high	9 Å²	9	60.2 Å²	60.2	7%	0.074	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-91.3	149.9	174.2	0	0	0	0	0	111.4	C421 H422 C438 P439 K441 C449	C421-A426 HydrophobicContact CB-CB 3.84Å; H422-A426 WeakPolarHBondContact O-CB 3.36Å; H422-A426 PolarHBondContact O-N 2.91Å; A426-C438 HydrophobicContact CB-CB 4.41Å; A426-P439 CarbonylContact C-O 3.38Å; A426-P439 WeakPolarHBondContact CA-O 3.27Å; A426-K441 WeakPolarHBondContact O-CE 3.35Å; A426-C449 HydrophobicContact CB-CB 4.07Å
427	A	94.4	Very high	94.9	Very high	77 Å²	77	63.2 Å²	63.2	64%	0.636	36%	0.363	S	S	*	.	S	Bend	trans	-82.6	-13.6	171.8	0	0	0	0	0	112.7	P439 K441	A427-P439 PolarHBondContact N-O 2.72Å; A427-K441 HydrophobicContact CB-CG 4.33Å
428	G	93.1	Very high	95	Very high	29 Å²	29	58.4 Å²	58.4	30%	0.299	34%	0.342	S	S	.	.			trans	-163	165	-179.1	0	0	0	0	0	112.7
429	K	92.4	Very high	94.9	Very high	185 Å²	185	59.2 Å²	59.2	80%	0.804	35%	0.345	S	S	*	.	S	Bend	trans	-88	-15.1	-178	-63.2	-177.5	179	-177.5	0	113.8
430	T	95.3	Very high	95	Very high	80 Å²	80	60.3 Å²	60.3	49%	0.491	35%	0.352	S	S	.	.			trans	-89.5	112.2	-179.4	51.2	0	0	0	0	110.1	E400 P439	E400-T430 HydrophobicContact CB-CG2 4.31Å; T430-P439 WeakPolarHBondContact O-CD 3.46Å
431	C	95.4	Very high	95	Very high	13 Å²	13	57.8 Å²	57.8	9%	0.088	34%	0.336	C	S	.	.			trans	-89	168.3	173.3	72.7	0	0	0	0	112.1	C419 Q433 G436 Q437	C419-C431 HydrophobicContact CB-CB 3.64Å; C419-C431 WeakPolarHBondContact CB-SG 3.24Å; C419-C431 WeakPolarHBondContact SG-CB 3.21Å; C419-C431 PolarHBondContact SG-N 2.97Å; C419-C431 CovalentContact SG-SG 2.02Å; C419-C431 PolarHBondContact SG-SG 3.18Å; C431-Q433 PolarHBondContact O-N 3.01Å; C431-G436 WeakPolarHBondContact CB-O 3.45Å; C431-Q437 WeakPolarHBondContact CA-O 3.49Å; C431-Q437 WeakPolarHBondContact CB-O 3.36Å
432	N	95.3	Very high	94.9	Very high	80 Å²	80	64.1 Å²	64.1	43%	0.428	37%	0.368	S	S	.	.			trans	-62.6	127.6	173.4	-177.1	-50.3	0	0	0	110.5	Y403 T434 T435 G436 Q437	Y403-N432 WeakPolarHBondContact CB-O 3.35Å; N432-T434 PolarHBondContact O-N 3.46Å; N432-T434 PolarHBondContact OD1-N 2.77Å; N432-T435 WeakPolarHBondContact CB-OG1 3.49Å; N432-T435 PolarHBondContact OD1-N 2.83Å; N432-G436 VanDerWaalsContact O-CA 3.26Å; N432-G436 WeakPolarHBondContact O-CA 3.18Å; N432-G436 PolarHBondContact O-N 3.19Å; N432-Q437 HydrophobicContact CB-CB 4.45Å; N432-Q437 PolarHBondContact N-O 2.77Å
433	Q	91.9	Very high	94.8	Very high	78 Å²	78	61 Å²	61	36%	0.364	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-23	-174.8	-69.4	-178.5	-2.1	0	0	114.2	C398 Y403 R404 C431	C398-Q433 PolarHBondContact O-NE2 3.5Å; Y403-Q433 CarbonylContact C-O 3.59Å; Y403-Q433 WeakPolarHBondContact CA-O 3.42Å; R404-Q433 WeakPolarHBondContact CB-O 3.43Å; R404-Q433 PolarHBondContact N-O 3.49Å; C431-Q433 PolarHBondContact O-N 3.01Å
434	T	91.8	Very high	94.9	Very high	89 Å²	89	56.1 Å²	56.1	55%	0.546	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-44.9	-178.6	-51.5	0	0	0	0	111.6	M406 N432	M406-T434 HydrophobicContact CE-CG2 3.81Å; N432-T434 PolarHBondContact O-N 3.46Å; N432-T434 PolarHBondContact OD1-N 2.77Å
435	T	93.3	Very high	94.9	Very high	79 Å²	79	56.6 Å²	56.6	49%	0.485	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-18.3	-173.3	63.1	0	0	0	0	113.9	N432 Q437	N432-T435 WeakPolarHBondContact CB-OG1 3.49Å; N432-T435 PolarHBondContact OD1-N 2.83Å; T435-Q437 PolarHBondContact O-N 2.66Å; T435-Q437 WeakPolarHBondContact OG1-CB 3.43Å; T435-Q437 PolarHBondContact OG1-N 3.12Å
436	G	94.9	Very high	94.9	Very high	2 Å²	2	56.9 Å²	56.9	2%	0.021	33%	0.331	C	S	.	.			trans	74.7	3.3	-171.4	0	0	0	0	0	114.3	Y403 C431 N432 C438 I447	Y403-G436 VanDerWaalsContact CG-CA 3.46Å; C431-G436 WeakPolarHBondContact CB-O 3.45Å; N432-G436 VanDerWaalsContact O-CA 3.26Å; N432-G436 WeakPolarHBondContact O-CA 3.18Å; N432-G436 PolarHBondContact O-N 3.19Å; G436-C438 PolarHBondContact O-N 3.04Å; G436-I447 WeakPolarHBondContact O-CG2 3.37Å
437	Q	96.6	Very high	94.8	Very high	71 Å²	71	60.6 Å²	60.6	33%	0.332	35%	0.348	S	S	.	.			trans	-67.7	120.7	-177.7	-178.5	60.1	55	0	0	111.3	C431 N432 T435 C440 G446 I447	C431-Q437 WeakPolarHBondContact CA-O 3.49Å; C431-Q437 WeakPolarHBondContact CB-O 3.36Å; N432-Q437 HydrophobicContact CB-CB 4.45Å; N432-Q437 PolarHBondContact N-O 2.77Å; T435-Q437 PolarHBondContact O-N 2.66Å; T435-Q437 WeakPolarHBondContact OG1-CB 3.43Å; T435-Q437 PolarHBondContact OG1-N 3.12Å; Q437-C440 PolarHBondContact NE2-SG 2.94Å; Q437-C440 VanDerWaalsContact NE2-SG 3.41Å; Q437-G446 PolarHBondContact NE2-O 2.87Å; Q437-I447 PolarHBondContact NE2-O 3.09Å
438	C	96.8	Very high	94.9	Very high	3 Å²	3	58.9 Å²	58.9	2%	0.02	33%	0.33	C	S	.	.			trans	-75.7	150.6	172.9	-66.5	0	0	0	0	111.4	C421 A426 G436 C440 I447 C449	C421-C438 WeakPolarHBondContact CA-SG 3.42Å; C421-C438 HydrophobicContact CB-CB 3.77Å; C421-C438 WeakPolarHBondContact CB-SG 3.24Å; C421-C438 WeakPolarHBondContact SG-CB 3.39Å; C421-C438 CovalentContact SG-SG 2.03Å; C421-C438 PolarHBondContact SG-SG 2.84Å; A426-C438 HydrophobicContact CB-CB 4.41Å; G436-C438 PolarHBondContact O-N 3.04Å; C438-C440 PolarHBondContact O-N 2.9Å; C438-I447 VanDerWaalsContact CB-O 3.3Å; C438-I447 WeakPolarHBondContact CB-O 3.4Å; C438-I447 PolarHBondContact N-O 3.34Å; C438-I447 PolarHBondContact SG-O 3.38Å; C438-C449 WeakPolarHBondContact CB-SG 3.49Å; C438-C449 PolarHBondContact O-SG 3.18Å; C438-C449 VanDerWaalsContact O-SG 3.42Å
439	P	96.6	Very high	95.1	Very high	53 Å²	53	57.6 Å²	57.6	34%	0.344	32%	0.316	S	S	.	.			trans	-73.3	98.4	175.2	29.4	-33.2	0	0	0	109.6	A426 A427 T430	A426-P439 CarbonylContact C-O 3.38Å; A426-P439 WeakPolarHBondContact CA-O 3.27Å; A427-P439 PolarHBondContact N-O 2.72Å; T430-P439 WeakPolarHBondContact O-CD 3.46Å
440	C	96.9	Very high	95.2	Very high	41 Å²	41	53.2 Å²	53.2	28%	0.277	30%	0.302	S	S	.	.	B	Isolated β-bridge	trans	-78	146.9	-176.1	-57	0	0	0	0	112.7	Q437 C438 V444 G446 C449	Q437-C440 PolarHBondContact NE2-SG 2.94Å; Q437-C440 VanDerWaalsContact NE2-SG 3.41Å; C438-C440 PolarHBondContact O-N 2.9Å; C440-V444 HydrophobicContact CB-CB 4.17Å; C440-V444 HydrophobicContact CB-CG1 4.39Å; C440-V444 WeakPolarHBondContact CB-O 3.43Å; C440-G446 PolarHBondContact SG-O 3.15Å; C440-C449 WeakPolarHBondContact CA-SG 3.21Å; C440-C449 HydrophobicContact CB-CB 3.77Å; C440-C449 WeakPolarHBondContact CB-SG 3.44Å; C440-C449 PolarHBondContact N-SG 3.17Å; C440-C449 WeakPolarHBondContact SG-CA 3.43Å; C440-C449 WeakPolarHBondContact SG-CB 3.37Å; C440-C449 CovalentContact SG-SG 2.04Å; C440-C449 PolarHBondContact SG-SG 3.21Å
441	K	95.8	Very high	95.2	Very high	57 Å²	57	57.2 Å²	57.2	25%	0.248	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-71.5	165.8	170.4	-68.2	-177.7	-178.8	171.7	0	111	V424 G425 A426 A427 G443 V444 P462 V463 P465	V424-K441 WeakPolarHBondContact O-CD 3.28Å; V424-K441 VanDerWaalsContact O-CE 3.23Å; V424-K441 WeakPolarHBondContact O-CE 3.36Å; V424-K441 PolarHBondContact O-NZ 2.86Å; G425-K441 WeakPolarHBondContact O-CB 3.41Å; G425-K441 WeakPolarHBondContact O-CG 3.34Å; G425-K441 PolarHBondContact O-N 2.75Å; A426-K441 WeakPolarHBondContact O-CE 3.35Å; A427-K441 HydrophobicContact CB-CG 4.33Å; K441-G443 PolarHBondContact O-N 3Å; K441-V444 HydrophobicContact CB-CG2 4.03Å; K441-V444 WeakPolarHBondContact O-CB 3.43Å; K441-V444 PolarHBondContact O-N 3.36Å; K441-P462 PolarHBondContact NZ-O 3.11Å; K441-V463 PolarHBondContact NZ-O 3.17Å; K441-P465 HydrophobicContact CD-CG 4.23Å
442	D	94.9	Very high	95.3	Very high	152 Å²	152	58.2 Å²	58.2	81%	0.813	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	131.3	178.9	-66	-28.4	0	0	0	111.5	V444	D442-V444 PolarHBondContact O-N 3.49Å
443	G	93.9	Very high	95.3	Very high	11 Å²	11	55.7 Å²	55.7	11%	0.113	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	1.5	-178.3	0	0	0	0	0	115.6	K441 C452 A453 Y456 C466	K441-G443 PolarHBondContact O-N 3Å; G443-C452 CarbonylContact O-C 3.58Å; G443-C452 WeakPolarHBondContact O-CA 3.45Å; G443-A453 PolarHBondContact O-N 2.89Å; G443-Y456 VanDerWaalsContact CA-CD1 3.44Å; G443-C466 WeakPolarHBondContact O-CB 3.35Å
444	V	97.3	Very high	95.4	Very high	16 Å²	16	62.3 Å²	62.3	10%	0.097	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	143.8	177	-172.1	0	0	0	0	110.3	C440 K441 D442 C449 R451 P465 C466	C440-V444 HydrophobicContact CB-CB 4.17Å; C440-V444 HydrophobicContact CB-CG1 4.39Å; C440-V444 WeakPolarHBondContact CB-O 3.43Å; K441-V444 HydrophobicContact CB-CG2 4.03Å; K441-V444 WeakPolarHBondContact O-CB 3.43Å; K441-V444 PolarHBondContact O-N 3.36Å; D442-V444 PolarHBondContact O-N 3.49Å; V444-C449 HydrophobicContact CG1-CB 3.74Å; V444-C449 WeakPolarHBondContact CG1-O 3.41Å; V444-R451 CarbonylContact C-O 3.49Å; V444-R451 WeakPolarHBondContact CA-O 3.35Å; V444-R451 WeakPolarHBondContact CG1-O 3.47Å; V444-P465 HydrophobicContact CG2-CG 3.83Å; V444-C466 HydrophobicContact CG2-CB 4.15Å
445	T	95.1	Very high	95.4	Very high	60 Å²	60	60 Å²	60	37%	0.368	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	179.5	177.9	-166.4	0	0	0	0	112.1	C449 N450 R451 A453	T445-C449 CarbonylContact O-C 3.57Å; T445-C449 WeakPolarHBondContact O-CA 3.49Å; T445-N450 PolarHBondContact O-N 2.99Å; T445-R451 HydrophobicContact CG2-CG 3.83Å; T445-R451 PolarHBondContact N-O 3.33Å; T445-R451 WeakPolarHBondContact O-CG 3.49Å; T445-R451 PolarHBondContact O-N 3.25Å; T445-A453 HydrophobicContact CG2-CB 4.23Å
446	G	94.6	Very high	95.5	Very high	9 Å²	9	59.4 Å²	59.4	9%	0.093	32%	0.316	C	S	.	.	S	Bend	trans	95.3	156.6	-172.2	0	0	0	0	0	112.8	Q437 C440 T448 C449	Q437-G446 PolarHBondContact NE2-O 2.87Å; C440-G446 PolarHBondContact SG-O 3.15Å; G446-T448 PolarHBondContact O-N 3.26Å; G446-C449 PolarHBondContact O-N 3.2Å
447	I	94.3	Very high	95.3	Very high	88 Å²	88	64 Å²	64	45%	0.451	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-41.5	-179.3	-61.5	-65.1	0	0	0	111	G436 Q437 C438	G436-I447 WeakPolarHBondContact O-CG2 3.37Å; Q437-I447 PolarHBondContact NE2-O 3.09Å; C438-I447 VanDerWaalsContact CB-O 3.3Å; C438-I447 WeakPolarHBondContact CB-O 3.4Å; C438-I447 PolarHBondContact N-O 3.34Å; C438-I447 PolarHBondContact SG-O 3.38Å
448	T	96.5	Very high	95.2	Very high	41 Å²	41	68.4 Å²	68.4	25%	0.252	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	5.4	179.8	53.5	0	0	0	0	113.6	D420 H422 G446	D420-T448 HydrophobicContact CB-CG2 4.11Å; D420-T448 WeakPolarHBondContact O-CB 3.32Å; D420-T448 WeakPolarHBondContact O-CG2 3.29Å; H422-T448 WeakPolarHBondContact CB-O 3.2Å; H422-T448 PolarHBondContact N-O 2.89Å; G446-T448 PolarHBondContact O-N 3.26Å
449	C	96.9	Very high	95	Very high	1 Å²	1	69.6 Å²	69.6	1%	0.007	37%	0.366	C	S	.	.	S	Bend	trans	58.3	43.1	-176.3	-47.6	0	0	0	0	113.7	H422 G425 A426 C438 C440 V444 T445 G446	H422-C449 VanDerWaalsContact CB-O 3.29Å; H422-C449 WeakPolarHBondContact CB-O 3.43Å; G425-C449 WeakPolarHBondContact CA-O 3.39Å; A426-C449 HydrophobicContact CB-CB 4.07Å; C438-C449 WeakPolarHBondContact CB-SG 3.49Å; C438-C449 PolarHBondContact O-SG 3.18Å; C438-C449 VanDerWaalsContact O-SG 3.42Å; C440-C449 WeakPolarHBondContact CA-SG 3.21Å; C440-C449 HydrophobicContact CB-CB 3.77Å; C440-C449 WeakPolarHBondContact CB-SG 3.44Å; C440-C449 PolarHBondContact N-SG 3.17Å; C440-C449 WeakPolarHBondContact SG-CA 3.43Å; C440-C449 WeakPolarHBondContact SG-CB 3.37Å; C440-C449 CovalentContact SG-SG 2.04Å; C440-C449 PolarHBondContact SG-SG 3.21Å; V444-C449 HydrophobicContact CG1-CB 3.74Å; V444-C449 WeakPolarHBondContact CG1-O 3.41Å; T445-C449 CarbonylContact O-C 3.57Å; T445-C449 WeakPolarHBondContact O-CA 3.49Å; G446-C449 PolarHBondContact O-N 3.2Å
450	N	95.8	Very high	94.8	Very high	94 Å²	94	79.3 Å²	79.3	50%	0.503	40%	0.395	S	S	.	.			trans	-99.7	0.9	-171.8	66.2	-29.9	0	0	0	114.7	T445	T445-N450 PolarHBondContact O-N 2.99Å
451	R	95.5	Very high	94.6	Very high	164 Å²	164	79.8 Å²	79.8	62%	0.619	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.7	154.2	-177.9	59.5	-177.6	175.7	-170.2	-0.1	112.2	V444 T445	V444-R451 CarbonylContact C-O 3.49Å; V444-R451 WeakPolarHBondContact CA-O 3.35Å; V444-R451 WeakPolarHBondContact CG1-O 3.47Å; T445-R451 HydrophobicContact CG2-CG 3.83Å; T445-R451 PolarHBondContact N-O 3.33Å; T445-R451 WeakPolarHBondContact O-CG 3.49Å; T445-R451 PolarHBondContact O-N 3.25Å
452	C	95.8	Very high	94.3	Very high	34 Å²	34	81.3 Å²	81.3	23%	0.23	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	146.1	172.8	-61.1	0	0	0	0	111.1	G443 C466	G443-C452 CarbonylContact O-C 3.58Å; G443-C452 WeakPolarHBondContact O-CA 3.45Å; C452-C466 WeakPolarHBondContact CA-SG 3.46Å; C452-C466 HydrophobicContact CB-CB 3.87Å; C452-C466 WeakPolarHBondContact CB-SG 3.26Å; C452-C466 WeakPolarHBondContact SG-CB 3.41Å; C452-C466 CovalentContact SG-SG 2.04Å; C452-C466 PolarHBondContact SG-SG 3Å
453	A	95.4	Very high	94.2	Very high	27 Å²	27	79.8 Å²	79.8	22%	0.223	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-67.6	160	172.5	0	0	0	0	0	110.7	G443 T445 G455 Y456	G443-A453 PolarHBondContact O-N 2.89Å; T445-A453 HydrophobicContact CG2-CB 4.23Å; A453-G455 PolarHBondContact O-N 2.92Å; A453-Y456 HydrophobicContact CB-CD2 4.09Å; A453-Y456 WeakPolarHBondContact O-CB 3.33Å; A453-Y456 PolarHBondContact O-N 2.67Å
454	K	94.6	Very high	94.1	Very high	217 Å²	217	81.5 Å²	81.5	94%	0.943	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	131.4	175.9	-168.5	175.6	-179.9	179.9	0	110
455	G	92.3	Very high	94	Very high	40 Å²	40	81.3 Å²	81.3	41%	0.412	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.2	7.5	-175.1	0	0	0	0	0	115.1	A453 K468 I469	A453-G455 PolarHBondContact O-N 2.92Å; G455-K468 WeakPolarHBondContact O-CA 3.3Å; G455-I469 PolarHBondContact O-N 3.01Å
456	Y	94.4	Very high	93.9	Very high	67 Å²	67	79 Å²	79	26%	0.263	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	149.8	173.1	-69.7	-107.6	0	0	0	111	G443 A453 C466 I467 K468	G443-Y456 VanDerWaalsContact CA-CD1 3.44Å; A453-Y456 HydrophobicContact CB-CD2 4.09Å; A453-Y456 WeakPolarHBondContact O-CB 3.33Å; A453-Y456 PolarHBondContact O-N 2.67Å; Y456-C466 HydrophobicContact CD1-CB 4.22Å; Y456-I467 CarbonylContact C-O 3.59Å; Y456-I467 WeakPolarHBondContact CA-O 3.44Å; Y456-I467 WeakPolarHBondContact CB-O 3.21Å; Y456-I467 VanDerWaalsContact CD1-C 3.42Å; Y456-K468 HydrophobicContact CD1-CB 4.48Å; Y456-K468 HydrophobicContact CD1-CG 3.85Å; Y456-K468 HydrophobicContact CD2-CG 4.41Å; Y456-K468 HydrophobicContact CE1-CB 4.36Å; Y456-K468 HydrophobicContact CE1-CD 4.4Å; Y456-K468 HydrophobicContact CE1-CG 3.33Å; Y456-K468 HydrophobicContact CE2-CG 3.96Å; Y456-K468 HydrophobicContact CG-CG 4.36Å; Y456-K468 WeakPolarHBondContact OH-CE 3.43Å
457	Q	92	Very high	93.9	Very high	97 Å²	97	82.3 Å²	82.3	45%	0.453	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	154.2	173.8	64.4	179.2	0.5	0	0	111.2	C466 I467 I469	Q457-C466 WeakPolarHBondContact O-CA 3.4Å; Q457-I467 HydrophobicContact CG-CD1 4.34Å; Q457-I467 HydrophobicContact CG-CG1 3.8Å; Q457-I467 PolarHBondContact N-O 3.18Å; Q457-I467 PolarHBondContact O-N 3.35Å; Q457-I469 HydrophobicContact CB-CG1 4.05Å; Q457-I469 HydrophobicContact CG-CG1 4.18Å
458	Q	93.7	Very high	93.8	Very high	164 Å²	164	85 Å²	85	77%	0.766	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	131.7	-178.6	-169	173.3	9.3	0	0	110.9	P465	Q458-P465 CarbonylContact C-O 3.57Å; Q458-P465 VanDerWaalsContact CA-O 3.32Å; Q458-P465 WeakPolarHBondContact CA-O 3.24Å
459	S	93.2	Very high	93.4	Very high	29 Å²	29	87.2 Å²	87.2	20%	0.203	44%	0.442	C	S	.	.			trans	-100.6	165.4	174	102.1	0	0	0	0	110.7	S461 A464 P465	S459-S461 VanDerWaalsContact C-N 3.27Å; S459-S461 WeakPolarHBondContact OG-CB 3.26Å; S459-S461 PolarHBondContact OG-N 2.78Å; S459-A464 WeakPolarHBondContact CB-O 3.22Å; S459-A464 PolarHBondContact OG-O 2.9Å; S459-P465 PolarHBondContact N-O 2.99Å
460	R	92.4	Very high	92.6	Very high	257 Å²	257	91.6 Å²	91.6	97%	0.97	47%	0.47	S	S	*	.	S	Bend	trans	-80.6	-5.9	173.1	-63.2	-175.7	-179.4	177.1	0.3	113.4	P462	R460-P462 WeakPolarHBondContact O-CD 3.35Å
461	S	91.2	Very high	91.5	Very high	51 Å²	51	93.1 Å²	93.1	36%	0.357	48%	0.483	S	S	.	.			trans	-84.1	124.6	-177.3	178.9	0	0	0	0	111.5	S459 V463 A464 P465	S459-S461 VanDerWaalsContact C-N 3.27Å; S459-S461 WeakPolarHBondContact OG-CB 3.26Å; S459-S461 PolarHBondContact OG-N 2.78Å; S461-V463 PolarHBondContact O-N 3.47Å; S461-V463 PolarHBondContact OG-N 3.15Å; S461-A464 CarbonylContact O-C 3.53Å; S461-A464 PolarHBondContact OG-N 3.15Å; S461-P465 WeakPolarHBondContact O-CA 3.23Å
462	P	91.1	Very high	89.6	Confident	89 Å²	89	91.3 Å²	91.3	58%	0.578	49%	0.489	S	S	*	.	S	Bend	trans	-65.9	-23.3	173.1	-21.6	33.4	0	0	0	113.6	V424 K441 R460	V424-P462 HydrophobicContact CG1-CB 4.34Å; V424-P462 WeakPolarHBondContact CG1-O 3.24Å; K441-P462 PolarHBondContact NZ-O 3.11Å; R460-P462 WeakPolarHBondContact O-CD 3.35Å
463	V	91.8	Very high	87.3	Confident	119 Å²	119	95.9 Å²	95.9	72%	0.721	51%	0.512	S	S	*	.	S	Bend	trans	-79.2	-44.2	-178.6	-178.1	0	0	0	0	110.4	K441 S461 P465	K441-V463 PolarHBondContact NZ-O 3.17Å; S461-V463 PolarHBondContact O-N 3.47Å; S461-V463 PolarHBondContact OG-N 3.15Å; V463-P465 WeakPolarHBondContact O-CD 3.28Å
464	A	92.3	Very high	84.9	Confident	48 Å²	48	100 Å²	100	40%	0.397	54%	0.536	S	S	.	.	S	Bend	trans	-123.8	77	-179.7	0	0	0	0	0	110.8	S459 S461 C466	S459-A464 WeakPolarHBondContact CB-O 3.22Å; S459-A464 PolarHBondContact OG-O 2.9Å; S461-A464 CarbonylContact O-C 3.53Å; S461-A464 PolarHBondContact OG-N 3.15Å; A464-C466 VanDerWaalsContact C-N 3.29Å; A464-C466 PolarHBondContact O-N 2.03Å
465	P	94	Very high	82.7	Confident	11 Å²	11	96.5 Å²	96.5	7%	0.071	53%	0.533	C	S	.	.			trans	-70.6	-18.8	-170.9	26.8	-35.6	0	0	0	115	V424 K441 V444 Q458 S459 S461 V463	V424-P465 HydrophobicContact CG1-CB 3.83Å; V424-P465 HydrophobicContact CG1-CG 4.2Å; K441-P465 HydrophobicContact CD-CG 4.23Å; V444-P465 HydrophobicContact CG2-CG 3.83Å; Q458-P465 CarbonylContact C-O 3.57Å; Q458-P465 VanDerWaalsContact CA-O 3.32Å; Q458-P465 WeakPolarHBondContact CA-O 3.24Å; S459-P465 PolarHBondContact N-O 2.99Å; S461-P465 WeakPolarHBondContact O-CA 3.23Å; V463-P465 WeakPolarHBondContact O-CD 3.28Å
466	C	94.8	Very high	80.1	Confident	13 Å²	13	99.2 Å²	99.2	9%	0.088	55%	0.551	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-128	124.7	179	-65.6	0	0	0	0	109.7	G443 V444 C452 Y456 Q457 A464	G443-C466 WeakPolarHBondContact O-CB 3.35Å; V444-C466 HydrophobicContact CG2-CB 4.15Å; C452-C466 WeakPolarHBondContact CA-SG 3.46Å; C452-C466 HydrophobicContact CB-CB 3.87Å; C452-C466 WeakPolarHBondContact CB-SG 3.26Å; C452-C466 WeakPolarHBondContact SG-CB 3.41Å; C452-C466 CovalentContact SG-SG 2.04Å; C452-C466 PolarHBondContact SG-SG 3Å; Y456-C466 HydrophobicContact CD1-CB 4.22Å; Q457-C466 WeakPolarHBondContact O-CA 3.4Å; A464-C466 VanDerWaalsContact C-N 3.29Å; A464-C466 PolarHBondContact O-N 2.03Å
467	I	93.8	Very high	77.4	Confident	77 Å²	77	100.3 Å²	100.3	40%	0.395	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.5	146.8	177.1	58.8	171.6	0	0	0	109.7	Y456 Q457	Y456-I467 CarbonylContact C-O 3.59Å; Y456-I467 WeakPolarHBondContact CA-O 3.44Å; Y456-I467 WeakPolarHBondContact CB-O 3.21Å; Y456-I467 VanDerWaalsContact CD1-C 3.42Å; Q457-I467 HydrophobicContact CG-CD1 4.34Å; Q457-I467 HydrophobicContact CG-CG1 3.8Å; Q457-I467 PolarHBondContact N-O 3.18Å; Q457-I467 PolarHBondContact O-N 3.35Å
468	K	92.3	Very high	75	Confident	145 Å²	145	102.7 Å²	102.7	63%	0.63	60%	0.596	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-63.6	138.1	177.8	-72.8	-174	178.4	-178.5	0	110.1	G455 Y456 P470	G455-K468 WeakPolarHBondContact O-CA 3.3Å; Y456-K468 HydrophobicContact CD1-CB 4.48Å; Y456-K468 HydrophobicContact CD1-CG 3.85Å; Y456-K468 HydrophobicContact CD2-CG 4.41Å; Y456-K468 HydrophobicContact CE1-CB 4.36Å; Y456-K468 HydrophobicContact CE1-CD 4.4Å; Y456-K468 HydrophobicContact CE1-CG 3.33Å; Y456-K468 HydrophobicContact CE2-CG 3.96Å; Y456-K468 HydrophobicContact CG-CG 4.36Å; Y456-K468 WeakPolarHBondContact OH-CE 3.43Å; K468-P470 WeakPolarHBondContact O-CD 3.48Å
469	I	88.9	Confident	72.1	Confident	87 Å²	87	99.8 Å²	99.8	45%	0.446	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-68.8	121.1	171.9	-59.2	168.4	0	0	0	106.9	G455 Q457 V471	G455-I469 PolarHBondContact O-N 3.01Å; Q457-I469 HydrophobicContact CB-CG1 4.05Å; Q457-I469 HydrophobicContact CG-CG1 4.18Å; I469-V471 PolarHBondContact O-N 2.88Å
470	P	79.6	Confident	69.7	Low	94 Å²	94	103.5 Å²	103.5	61%	0.61	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-64.4	126.6	174.5	25.2	-30.2	0	0	0	108.6	K468 V472	K468-P470 WeakPolarHBondContact O-CD 3.48Å; P470-V472 PolarHBondContact O-N 2.99Å
471	V	71.9	Confident	67.1	Low	125 Å²	125	97.4 Å²	97.4	76%	0.758	61%	0.611	S	S	*	*			trans	-74.7	107.9	170.8	-171.1	0	0	0	0	106.3	I469 N473	I469-V471 PolarHBondContact O-N 2.88Å; V471-N473 PolarHBondContact O-N 2.91Å
472	V	56.2	Low	64.6	Low	126 Å²	126	103.9 Å²	103.9	76%	0.764	64%	0.635	S	S	*	*			trans	-78.3	98.6	167.5	-171	0	0	0	0	105.9	P470	P470-V472 PolarHBondContact O-N 2.99Å
473	N	47.1	Very low	62.5	Low	131 Å²	131	108.4 Å²	108.4	70%	0.701	65%	0.649	S	S	*	*			trans	-69.5	128.2	165.4	-81.6	-0.4	0	0	0	107.8	V471 T475	V471-N473 PolarHBondContact O-N 2.91Å; N473-T475 PolarHBondContact O-N 2.98Å
474	P	45.6	Very low	60.3	Low	113 Å²	113	108 Å²	108	73%	0.734	65%	0.649	S	S	*	*			trans	-60.6	132.1	165.5	-14.4	28.4	0	0	0	108.8	A476	P474-A476 PolarHBondContact O-N 2.79Å
475	T	47.7	Very low	58.5	Low	144 Å²	144	110.4 Å²	110.4	88%	0.883	67%	0.668	S	S	*	*			trans	-1.7	99.5	168.3	-5.2	0	0	0	0	115.5	N473	N473-T475 PolarHBondContact O-N 2.98Å
476	A	37.8	Very low	56.8	Low	96 Å²	96	114.9 Å²	114.9	79%	0.793	69%	0.692	S	S	*	*			trans	-81.5	117.9	157.7	0	0	0	0	0	107.7	P474	P474-A476 PolarHBondContact O-N 2.79Å
477	A	38	Very low	55.3	Low	91 Å²	91	116.4 Å²	116.4	75%	0.752	70%	0.702	S	S	*	*			trans	-52	143.1	165.5	0	0	0	0	0	109.9	S479	A477-S479 PolarHBondContact O-N 3.05Å
478	V	41.9	Very low	53.8	Low	147 Å²	147	120.3 Å²	120.3	89%	0.891	72%	0.718	S	S	*	*			trans	-50.9	112.6	172.3	178.4	0	0	0	0	108.8
479	S	31.6	Very low	52.6	Low	102 Å²	102	117.3 Å²	117.3	71%	0.713	72%	0.716	S	S	*	*			trans	-131.5	98.6	155.7	-171.3	0	0	0	0	106.5	A477 T481	A477-S479 PolarHBondContact O-N 3.05Å; S479-T481 PolarHBondContact O-N 2.84Å
480	S	44.3	Very low	51.6	Low	107 Å²	107	117 Å²	117	75%	0.748	71%	0.71	S	S	*	*			trans	-52.2	114.9	166.4	46.3	0	0	0	0	110.4
481	T	37.7	Very low	51	Low	129 Å²	129	113 Å²	113	79%	0.791	68%	0.683	S	S	*	*			trans	-134.6	94.4	150.9	38.6	0	0	0	0	107.3	S479	S479-T481 PolarHBondContact O-N 2.84Å
482	E	39	Very low	50.5	Low	187 Å²	187	116.2 Å²	116.2	87%	0.874	69%	0.687	S	S	*	*			trans	21.1	100.8	149.5	-61.9	177.3	163.1	0	0	116.4
483	E	46.3	Very low	50.5	Low	185 Å²	185	113.2 Å²	113.2	86%	0.864	67%	0.67	S	S	*	*			trans	-59.7	130.5	144.9	-79.2	-157.2	140.8	0	0	107.5	A485	E483-A485 VanDerWaalsContact C-N 3.26Å; E483-A485 PolarHBondContact O-N 3.46Å
484	P	46.2	Very low	50.9	Low	110 Å²	110	111.8 Å²	111.8	71%	0.714	67%	0.666	S	S	*	*			trans	-66	98.5	161.5	-5.5	20.5	0	0	0	106.9	D486	P484-D486 PolarHBondContact O-N 2.88Å
485	A	53.3	Low	51	Low	98 Å²	98	115 Å²	115	81%	0.81	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	78.1	164.2	0	0	0	0	0	109	E483	E483-A485 VanDerWaalsContact C-N 3.26Å; E483-A485 PolarHBondContact O-N 3.46Å
486	D	59.6	Low	51.3	Low	105 Å²	105	111 Å²	111	56%	0.561	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-165.5	5.6	154.9	-133.6	3.2	0	0	0	115.9	P484 E488 S489 Y490	P484-D486 PolarHBondContact O-N 2.88Å; D486-E488 PolarHBondContact O-N 2.89Å; D486-S489 PolarHBondContact O-N 2.95Å; D486-S489 PolarHBondContact O-OG 3.14Å; D486-S489 VanDerWaalsContact OD1-CB 3.29Å; D486-S489 WeakPolarHBondContact OD1-CB 3.44Å; D486-S489 PolarHBondContact OD1-OG 2.8Å; D486-S489 PolarHBondContact OD2-OG 2.69Å; D486-Y490 VanDerWaalsContact O-CB 3.25Å; D486-Y490 WeakPolarHBondContact O-CB 3.44Å; D486-Y490 PolarHBondContact O-N 2.94Å
487	C	61.9	Low	52	Low	45 Å²	45	112.8 Å²	112.8	30%	0.304	65%	0.653	S	S	.	*	H	α-helix	trans	-65.2	-24.5	-179.1	-75	0	0	0	0	113.5	C491 C560	C487-C491 PolarHBondContact O-N 2.9Å; C487-C560 VanDerWaalsContact CA-SG 3.58Å; C487-C560 HydrophobicContact CB-CB 3.7Å; C487-C560 WeakPolarHBondContact CB-SG 3.49Å; C487-C560 WeakPolarHBondContact SG-CA 3.44Å; C487-C560 WeakPolarHBondContact SG-CB 3.47Å; C487-C560 CovalentContact SG-SG 2.06Å; C487-C560 PolarHBondContact SG-SG 3.2Å
488	E	63.1	Low	53.1	Low	159 Å²	159	110.1 Å²	110.1	74%	0.743	63%	0.626	S	S	*	*	H	α-helix	trans	-79.3	-21.6	-179.5	-154	155.1	-154.6	0	0	113	D486	D486-E488 PolarHBondContact O-N 2.89Å
489	S	66.1	Low	54.2	Low	82 Å²	82	110.2 Å²	110.2	57%	0.573	61%	0.614	S	S	*	*	H	α-helix	trans	-89	-32.5	169.6	86.3	0	0	0	0	112	D486	D486-S489 PolarHBondContact O-N 2.95Å; D486-S489 PolarHBondContact O-OG 3.14Å; D486-S489 VanDerWaalsContact OD1-CB 3.29Å; D486-S489 WeakPolarHBondContact OD1-CB 3.44Å; D486-S489 PolarHBondContact OD1-OG 2.8Å; D486-S489 PolarHBondContact OD2-OG 2.69Å
490	Y	67.8	Low	56	Low	81 Å²	81	106 Å²	106	32%	0.318	58%	0.583	S	S	.	*	H	α-helix	trans	-71.6	-37.7	-173.4	-174	-103.7	0	0	0	114.1	D486 D557 K585	D486-Y490 VanDerWaalsContact O-CB 3.25Å; D486-Y490 WeakPolarHBondContact O-CB 3.44Å; D486-Y490 PolarHBondContact O-N 2.94Å; Y490-D557 VanDerWaalsContact CE1-OD1 3.3Å; Y490-D557 WeakPolarHBondContact CE1-OD1 3.38Å; Y490-K585 HydrophobicContact CE1-CD 4.28Å
491	C	68	Low	57.5	Low	9 Å²	9	104.2 Å²	104.2	6%	0.061	57%	0.565	C	S	.	*			trans	-138.7	131.6	172	62.8	0	0	0	0	110	C487 P493 C562 K585	C487-C491 PolarHBondContact O-N 2.9Å; C491-P493 WeakPolarHBondContact O-CD 3.34Å; C491-C562 HydrophobicContact CB-CB 3.63Å; C491-C562 WeakPolarHBondContact CB-SG 3.27Å; C491-C562 WeakPolarHBondContact SG-CB 3.23Å; C491-C562 CovalentContact SG-SG 2.05Å; C491-C562 PolarHBondContact SG-SG 3.23Å; C491-K585 HydrophobicContact CB-CB 4.26Å
492	K	61.3	Low	59.3	Low	194 Å²	194	99.6 Å²	99.6	84%	0.843	54%	0.535	S	S	*	.			trans	-83.9	99.2	166.3	-75.7	-175.9	179.8	178.2	0	108.1	V494	K492-V494 PolarHBondContact O-N 2.88Å
493	P	56.4	Low	60.9	Low	62 Å²	62	96.3 Å²	96.3	40%	0.403	52%	0.518	S	S	.	.			trans	-58.7	132.4	173.9	24.9	-34.2	0	0	0	108.4	C491 K495	C491-P493 WeakPolarHBondContact O-CD 3.34Å; P493-K495 PolarHBondContact O-N 2.97Å
494	V	56.3	Low	62.2	Low	101 Å²	101	92.3 Å²	92.3	61%	0.612	50%	0.498	S	S	*	.			trans	-67.5	96.7	-178.1	-168.7	0	0	0	0	109.1	K492 G496 L498	K492-V494 PolarHBondContact O-N 2.88Å; V494-G496 PolarHBondContact O-N 2.8Å; V494-L498 HydrophobicContact CB-CD1 4.3Å; V494-L498 HydrophobicContact CG1-CD1 3.36Å
495	K	47.3	Very low	63.6	Low	180 Å²	180	87.7 Å²	87.7	78%	0.783	47%	0.466	S	S	*	.			trans	-70.5	106.6	177.2	-71	-178.8	-179.9	176	0	108.6	P493	P493-K495 PolarHBondContact O-N 2.97Å
496	G	53.3	Low	64.5	Low	61 Å²	61	83.8 Å²	83.8	63%	0.629	43%	0.433	S	S	*	.	S	Bend	trans	138.6	161.5	170.9	0	0	0	0	0	115.7	V494 L498	V494-G496 PolarHBondContact O-N 2.8Å; G496-L498 PolarHBondContact O-N 2.75Å
497	N	53.3	Low	64.9	Low	134 Å²	134	86.8 Å²	86.8	72%	0.717	44%	0.441	S	S	*	.			trans	-65	95.5	171.2	-87.4	-52.8	0	0	0	109.7	K499 R593	N497-K499 PolarHBondContact O-N 3.19Å; N497-R593 PolarHBondContact OD1-NH2 3.38Å
498	L	61.1	Low	64.9	Low	35 Å²	35	87.8 Å²	87.8	18%	0.183	44%	0.44	C	S	.	.			trans	-66.3	107.4	-177.2	-154.1	97.2	0	0	0	111.5	V494 G496 L588 I590	V494-L498 HydrophobicContact CB-CD1 4.3Å; V494-L498 HydrophobicContact CG1-CD1 3.36Å; G496-L498 PolarHBondContact O-N 2.75Å; L498-L588 HydrophobicContact CD1-CD1 4.43Å; L498-L588 HydrophobicContact CD2-CD1 3.38Å; L498-L588 HydrophobicContact CD2-CD2 3.42Å; L498-L588 VanDerWaalsContact CD2-CD2 3.42Å; L498-L588 HydrophobicContact CD2-CG 3.94Å; L498-L588 HydrophobicContact CG-CD1 4.5Å; L498-I590 HydrophobicContact CB-CG2 4.47Å; L498-I590 HydrophobicContact CD2-CD1 4.5Å; L498-I590 HydrophobicContact CD2-CG2 4.28Å
499	K	63.3	Low	64.5	Low	148 Å²	148	84.4 Å²	84.4	64%	0.643	43%	0.427	S	S	*	.			trans	-90.2	112.4	174.7	-163.5	176.3	-173.9	177.1	0	109.2	N497 N501	N497-K499 PolarHBondContact O-N 3.19Å; K499-N501 PolarHBondContact O-N 2.97Å
500	I	70.5	Confident	64.5	Low	14 Å²	14	83.4 Å²	83.4	7%	0.072	41%	0.411	C	S	.	.			trans	-71.1	113.3	174	-57.5	176.7	0	0	0	108.7	L572 I590 R599 L600 F603	I500-L572 HydrophobicContact CD1-CD2 3.27Å; I500-I590 HydrophobicContact CD1-CD1 3.66Å; I500-I590 HydrophobicContact CG1-CD1 4.17Å; I500-R599 PolarHBondContact O-NE 3.46Å; I500-R599 PolarHBondContact O-NH2 3.26Å; I500-L600 HydrophobicContact CD1-CD2 4.36Å; I500-L600 HydrophobicContact CG2-CD2 4.28Å; I500-F603 HydrophobicContact CG2-CD2 4.37Å; I500-F603 HydrophobicContact CG2-CE2 4Å; I500-F603 WeakPolarHBondContact O-CE2 3.46Å
501	N	75.3	Confident	64.2	Low	69 Å²	69	80.1 Å²	80.1	37%	0.369	40%	0.4	S	S	.	.			trans	-102.3	169.9	171.7	67.4	8.2	0	0	0	110.2	K499 K503 K504 Y505	K499-N501 PolarHBondContact O-N 2.97Å; N501-K503 VanDerWaalsContact C-N 3.31Å; N501-K503 PolarHBondContact O-N 3.28Å; N501-K504 PolarHBondContact O-N 3.41Å; N501-K504 WeakPolarHBondContact OD1-CB 3.47Å; N501-K504 VanDerWaalsContact OD1-CG 3.24Å; N501-K504 WeakPolarHBondContact OD1-CG 3.47Å; N501-K504 PolarHBondContact OD1-N 2.66Å; N501-Y505 PolarHBondContact O-N 2.84Å
502	M	75.9	Confident	64.4	Low	32 Å²	32	80 Å²	80	16%	0.158	40%	0.4	C	S	.	.	H	α-helix	trans	-59.8	-43.3	-178.3	-175	64.1	80.1	0	0	111.8	K504 Y505 C506 F603 K606 A615	M502-K504 PolarHBondContact O-N 3.45Å; M502-Y505 WeakPolarHBondContact O-CB 3.47Å; M502-Y505 PolarHBondContact O-N 2.77Å; M502-Y505 VanDerWaalsContact O-N 3.11Å; M502-Y505 HydrophobicContact SD-CD1 4.23Å; M502-C506 WeakPolarHBondContact O-CB 3.42Å; M502-C506 PolarHBondContact O-N 3.27Å; M502-C506 PolarHBondContact O-SG 2.92Å; M502-C506 VanDerWaalsContact O-SG 3.39Å; M502-F603 HydrophobicContact CB-CE1 4.37Å; M502-F603 HydrophobicContact CE-CB 4.22Å; M502-F603 HydrophobicContact CE-CD1 3.31Å; M502-F603 HydrophobicContact CE-CE1 3.92Å; M502-F603 HydrophobicContact CE-CG 4.02Å; M502-F603 HydrophobicContact SD-CB 4.01Å; M502-F603 HydrophobicContact SD-CD1 3.82Å; M502-F603 HydrophobicContact SD-CE1 4.47Å; M502-F603 HydrophobicContact SD-CG 3.98Å; M502-K606 HydrophobicContact CE-CB 3.51Å; M502-K606 HydrophobicContact CE-CD 3.18Å; M502-K606 HydrophobicContact CE-CG 3.94Å; M502-A615 HydrophobicContact CG-CB 3.95Å
503	K	73.3	Confident	65.3	Low	118 Å²	118	70.8 Å²	70.8	51%	0.513	36%	0.36	S	S	.	.	H	α-helix	trans	-58.6	-44.1	179.2	-165.1	168.5	-165.1	167.4	0	112.3	N501 C506 K507 A615	N501-K503 VanDerWaalsContact C-N 3.31Å; N501-K503 PolarHBondContact O-N 3.28Å; K503-C506 PolarHBondContact O-N 2.91Å; K503-K507 WeakPolarHBondContact O-CB 3.3Å; K503-K507 PolarHBondContact O-N 2.86Å; K503-A615 WeakPolarHBondContact CB-OXT 3.32Å; K503-A615 VanDerWaalsContact CD-OXT 3.25Å; K503-A615 WeakPolarHBondContact CD-OXT 3.36Å; K503-A615 VanDerWaalsContact CG-OXT 3.28Å; K503-A615 WeakPolarHBondContact CG-OXT 3.27Å
504	K	72.7	Confident	66.6	Low	101 Å²	101	68.3 Å²	68.3	44%	0.439	34%	0.343	S	S	.	.	H	α-helix	trans	-68.4	-32.5	174.9	-75.9	-178.7	179.3	-177.7	0	113.1	N501 M502	N501-K504 PolarHBondContact O-N 3.41Å; N501-K504 WeakPolarHBondContact OD1-CB 3.47Å; N501-K504 VanDerWaalsContact OD1-CG 3.24Å; N501-K504 WeakPolarHBondContact OD1-CG 3.47Å; N501-K504 PolarHBondContact OD1-N 2.66Å; M502-K504 PolarHBondContact O-N 3.45Å
505	Y	75.6	Confident	68	Low	13 Å²	13	63.6 Å²	63.6	5%	0.051	31%	0.314	C	S	.	.	H	α-helix	trans	-70.5	-38.6	175.4	175	-85.6	0	0	0	111.8	N501 M502 Y537 K538 L600 F603 Q604 E607	N501-Y505 PolarHBondContact O-N 2.84Å; M502-Y505 WeakPolarHBondContact O-CB 3.47Å; M502-Y505 PolarHBondContact O-N 2.77Å; M502-Y505 VanDerWaalsContact O-N 3.11Å; M502-Y505 HydrophobicContact SD-CD1 4.23Å; Y505-Y537 PolarHBondContact OH-O 3.48Å; Y505-Y537 VanDerWaalsContact OH-O 3.13Å; Y505-K538 PolarHBondContact O-NZ 3.49Å; Y505-L600 HydrophobicContact CD2-CD2 3.92Å; Y505-L600 HydrophobicContact CE2-CD2 4.22Å; Y505-F603 HydrophobicContact CD1-CB 3.66Å; Y505-F603 HydrophobicContact CD1-CG 4.46Å; Y505-F603 HydrophobicContact CD2-CB 3.87Å; Y505-F603 HydrophobicContact CD2-CD2 4.01Å; Y505-F603 HydrophobicContact CD2-CG 4.45Å; Y505-F603 HydrophobicContact CE1-CB 3.8Å; Y505-F603 HydrophobicContact CE2-CB 3.98Å; Y505-F603 HydrophobicContact CG-CB 3.72Å; Y505-F603 AromaticContact CG-CD2 3.9Å; Y505-F603 HydrophobicContact CG-CD2 3.9Å; Y505-F603 HydrophobicContact CG-CG 4.2Å; Y505-Q604 WeakPolarHBondContact OH-CA 3.21Å; Y505-E607 HydrophobicContact CE1-CB 4.07Å; Y505-E607 WeakPolarHBondContact CE1-OE2 3.41Å; Y505-E607 PolarHBondContact OH-OE2 2.87Å
506	C	73.4	Confident	69.8	Low	16 Å²	16	57 Å²	57	11%	0.108	29%	0.288	C	S	.	.	H	α-helix	trans	-78.9	-42.4	179.3	-66.9	0	0	0	0	113.1	M502 K503 K508 K538 C612	M502-C506 WeakPolarHBondContact O-CB 3.42Å; M502-C506 PolarHBondContact O-N 3.27Å; M502-C506 PolarHBondContact O-SG 2.92Å; M502-C506 VanDerWaalsContact O-SG 3.39Å; K503-C506 PolarHBondContact O-N 2.91Å; C506-K508 VanDerWaalsContact C-N 3.32Å; C506-K508 PolarHBondContact O-N 2.89Å; C506-K538 PolarHBondContact O-NZ 3.05Å; C506-C612 HydrophobicContact CB-CB 3.59Å; C506-C612 WeakPolarHBondContact CB-SG 3.37Å; C506-C612 WeakPolarHBondContact SG-CA 3.25Å; C506-C612 WeakPolarHBondContact SG-CB 3.05Å; C506-C612 CovalentContact SG-SG 2.05Å; C506-C612 PolarHBondContact SG-SG 2.74Å
507	K	67.4	Low	71.3	Confident	169 Å²	169	54.1 Å²	54.1	74%	0.735	26%	0.258	S	S	*	.	H	α-helix	trans	-72.5	-17.1	-173.6	-166.3	176.2	-176.6	-177.1	0	114.7	K503	K503-K507 WeakPolarHBondContact O-CB 3.3Å; K503-K507 PolarHBondContact O-N 2.86Å
508	K	61.1	Low	72.7	Confident	65 Å²	65	52 Å²	52	28%	0.283	25%	0.246	S	C	.	.			trans	-95.1	119.2	-177.5	-80.1	-171.7	162.9	-141.2	0	110.4	C506 Y510 K538	C506-K508 VanDerWaalsContact C-N 3.32Å; C506-K508 PolarHBondContact O-N 2.89Å; K508-Y510 HydrophobicContact CB-CD2 3.57Å; K508-Y510 HydrophobicContact CB-CE2 4Å; K508-Y510 HydrophobicContact CB-CG 4.38Å; K508-Y510 HydrophobicContact CD-CD2 3.81Å; K508-Y510 HydrophobicContact CD-CE2 3.92Å; K508-Y510 HydrophobicContact CG-CD2 3.83Å; K508-Y510 HydrophobicContact CG-CE2 3.81Å; K508-Y510 PolarHBondContact O-N 3.26Å; K508-K538 PolarHBondContact O-NZ 2.03Å
509	D	55.7	Low	73.8	Confident	88 Å²	88	54.4 Å²	54.4	47%	0.471	26%	0.259	S	S	.	.			trans	-78	39.5	177.6	-59	-53.6	0	0	0	112.5	R540	D509-R540 IonicContact OD1-CZ 3.17Å; D509-R540 IonicContact OD1-NH1 3.89Å; D509-R540 PolarHBondContact OD1-NH1 3Å; D509-R540 IonicContact OD1-NH2 2.77Å
510	Y	64.5	Low	74.7	Confident	62 Å²	62	51 Å²	51	24%	0.243	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-121.8	145.5	-168	-56.8	-42.5	0	0	0	112	K508 A512 S574 G575 P576	K508-Y510 HydrophobicContact CB-CD2 3.57Å; K508-Y510 HydrophobicContact CB-CE2 4Å; K508-Y510 HydrophobicContact CB-CG 4.38Å; K508-Y510 HydrophobicContact CD-CD2 3.81Å; K508-Y510 HydrophobicContact CD-CE2 3.92Å; K508-Y510 HydrophobicContact CG-CD2 3.83Å; K508-Y510 HydrophobicContact CG-CE2 3.81Å; K508-Y510 PolarHBondContact O-N 3.26Å; Y510-A512 PolarHBondContact O-N 3.31Å; Y510-S574 VanDerWaalsContact CB-OG 3.31Å; Y510-S574 WeakPolarHBondContact CB-OG 3.08Å; Y510-G575 WeakPolarHBondContact CB-O 2.98Å; Y510-G575 WeakPolarHBondContact CD1-O 3.43Å; Y510-G575 VanDerWaalsContact CG-O 3.26Å; Y510-P576 VanDerWaalsContact CD1-CA 3.43Å; Y510-P576 HydrophobicContact CD1-CB 4.46Å; Y510-P576 HydrophobicContact CE1-CB 4.06Å
511	A	62.5	Low	75.4	Confident	11 Å²	11	54.5 Å²	54.5	9%	0.091	26%	0.263	C	S	.	.			trans	-62.6	120.7	169.4	0	0	0	0	0	110.1	V513 K538 L544 V573 S574	A511-V513 HydrophobicContact CB-CG2 4.07Å; A511-K538 CarbonylContact C-O 3.58Å; A511-K538 VanDerWaalsContact CA-O 3.26Å; A511-K538 WeakPolarHBondContact CA-O 3.43Å; A511-L544 HydrophobicContact CB-CD1 3.63Å; A511-V573 VanDerWaalsContact O-O 3.07Å; A511-S574 WeakPolarHBondContact O-CA 3.23Å
512	A	72.3	Confident	75.8	Confident	7 Å²	7	55.5 Å²	55.5	6%	0.058	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	98.8	178.8	0	0	0	0	0	109.3	Y510 Y537 K538 L572	Y510-A512 PolarHBondContact O-N 3.31Å; A512-Y537 WeakPolarHBondContact O-CB 3.48Å; A512-Y537 PolarHBondContact O-N 3.46Å; A512-K538 HydrophobicContact CB-CB 3.95Å; A512-K538 PolarHBondContact N-O 3.07Å; A512-L572 HydrophobicContact CB-CD1 4.43Å
513	V	79.3	Confident	76.2	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	131.9	-169.2	-169.6	0	0	0	0	111.1	A511 V515 V533 V536 L544 L572 V573 L581	A511-V513 HydrophobicContact CB-CG2 4.07Å; V513-V515 HydrophobicContact CB-CG1 4.37Å; V513-V515 HydrophobicContact CG1-CG1 3.84Å; V513-V533 HydrophobicContact CG1-CB 4.17Å; V513-V533 HydrophobicContact CG1-CG1 3.35Å; V513-V533 HydrophobicContact CG1-CG2 3.94Å; V513-V536 HydrophobicContact CG1-CG2 4.24Å; V513-V536 HydrophobicContact CG2-CG1 4.42Å; V513-V536 HydrophobicContact CG2-CG2 4.38Å; V513-L544 HydrophobicContact CG2-CD1 4Å; V513-L572 WeakPolarHBondContact O-CA 3.42Å; V513-V573 PolarHBondContact N-O 2.88Å; V513-V573 PolarHBondContact O-N 2.76Å; V513-L581 HydrophobicContact CB-CD1 4.49Å; V513-L581 HydrophobicContact CG2-CD1 4.27Å
514	Q	84	Confident	76.8	Confident	11 Å²	11	55.2 Å²	55.2	5%	0.051	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	117.6	167.5	178.1	-174	-3.8	0	0	108.8	V534 S535 Y537 F571 W592	Q514-V534 HydrophobicContact CB-CB 4.42Å; Q514-V534 HydrophobicContact CG-CB 4.01Å; Q514-V534 HydrophobicContact CG-CG2 4.46Å; Q514-V534 PolarHBondContact O-N 2.73Å; Q514-S535 PolarHBondContact N-O 3.13Å; Q514-S535 PolarHBondContact O-N 3.29Å; Q514-Y537 HydrophobicContact CB-CE2 3.95Å; Q514-Y537 PolarHBondContact OE1-OH 3.11Å; Q514-F571 WeakPolarHBondContact CA-O 3.25Å; Q514-W592 HydrophobicContact CB-CE3 4.08Å; Q514-W592 HydrophobicContact CB-CH2 4.24Å; Q514-W592 HydrophobicContact CB-CZ3 3.88Å; Q514-W592 HydrophobicContact CG-CD2 3.91Å; Q514-W592 HydrophobicContact CG-CE3 3.8Å; Q514-W592 HydrophobicContact CG-CH2 4.33Å; Q514-W592 HydrophobicContact CG-CZ2 4.37Å; Q514-W592 HydrophobicContact CG-CZ3 4.04Å; Q514-W592 VanDerWaalsContact OE1-CZ2 3.29Å
515	V	85.3	Confident	77.3	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.006	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	147.9	179.6	-60.8	0	0	0	0	111.3	V513 V531 S532 V533 R570 F571 V573 L581	V513-V515 HydrophobicContact CB-CG1 4.37Å; V513-V515 HydrophobicContact CG1-CG1 3.84Å; V515-V531 HydrophobicContact CB-CB 4.18Å; V515-V531 HydrophobicContact CG1-CG2 4.37Å; V515-S532 CarbonylContact C-O 3.28Å; V515-S532 WeakPolarHBondContact CA-O 3.04Å; V515-V533 HydrophobicContact CG1-CG2 4.09Å; V515-R570 CarbonylContact O-C 3.57Å; V515-R570 VanDerWaalsContact O-CA 3.27Å; V515-R570 WeakPolarHBondContact O-CA 3.44Å; V515-F571 HydrophobicContact CG2-CB 4.24Å; V515-F571 PolarHBondContact N-O 3.02Å; V515-F571 PolarHBondContact O-N 3.35Å; V515-V573 HydrophobicContact CG2-CG2 3.53Å; V515-L581 HydrophobicContact CG1-CD2 3.74Å
516	N	86.1	Confident	77.7	Confident	42 Å²	42	59.7 Å²	59.7	23%	0.225	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	124.1	167.3	-168.7	42.3	0	0	0	108.9	V531 S532 V534 R570	N516-V531 CarbonylContact O-C 3.59Å; N516-V531 VanDerWaalsContact O-CA 3.25Å; N516-V531 WeakPolarHBondContact O-CA 3.31Å; N516-S532 PolarHBondContact N-O 3.4Å; N516-S532 PolarHBondContact O-N 2.86Å; N516-V534 HydrophobicContact CB-CG2 4.45Å; N516-R570 HydrophobicContact CB-CG 4.43Å
517	V	83.9	Confident	78.4	Confident	1 Å²	1	59 Å²	59	1%	0.006	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	120	-178.1	-174.9	0	0	0	0	109.2	F529 V531 I565 M567 S568 K569 F571	V517-F529 HydrophobicContact CG1-CB 4.49Å; V517-F529 HydrophobicContact CG1-CD1 3.75Å; V517-V531 HydrophobicContact CG2-CG1 4.16Å; V517-I565 HydrophobicContact CG1-CG2 4.18Å; V517-I565 HydrophobicContact CG2-CG2 3.85Å; V517-M567 HydrophobicContact CG1-SD 3.98Å; V517-S568 VanDerWaalsContact O-CA 3.28Å; V517-S568 WeakPolarHBondContact O-CA 3.27Å; V517-S568 PolarHBondContact O-N 3.26Å; V517-K569 PolarHBondContact N-O 3.39Å; V517-F571 HydrophobicContact CG2-CD2 4.02Å; V517-F571 HydrophobicContact CG2-CE2 4.35Å
518	L	84	Confident	79.4	Confident	88 Å²	88	53.1 Å²	53.1	46%	0.461	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-54	-173.8	-58.5	177.5	0	0	0	111.7	S530 M567	L518-S530 WeakPolarHBondContact CB-O 3.36Å; L518-S530 PolarHBondContact N-O 2.85Å; L518-M567 VanDerWaalsContact O-CE 3.31Å; L518-M567 WeakPolarHBondContact O-CE 3.49Å
519	D	83.2	Confident	80.6	Confident	86 Å²	86	50.3 Å²	50.3	46%	0.46	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	164.9	-176.7	-157.5	8	0	0	0	112.2	F529 S530	D519-F529 CarbonylContact O-C 3.53Å; D519-F529 VanDerWaalsContact O-CA 3.32Å; D519-F529 WeakPolarHBondContact O-CA 3.27Å; D519-S530 PolarHBondContact N-O 3.2Å; D519-S530 PolarHBondContact O-N 3.09Å
520	M	82.8	Confident	82.1	Confident	78 Å²	78	47.9 Å²	47.9	38%	0.384	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	124.8	176.7	-176.1	-160.2	76.6	0	0	111.5	K528 F529 L558 M567	M520-K528 WeakPolarHBondContact CA-O 3.5Å; M520-F529 HydrophobicContact CB-CD1 3.72Å; M520-F529 HydrophobicContact CB-CE1 3.69Å; M520-F529 HydrophobicContact CB-CZ 4.47Å; M520-F529 HydrophobicContact CG-CD1 3.76Å; M520-F529 HydrophobicContact CG-CE1 3.42Å; M520-F529 VanDerWaalsContact CG-CE1 3.42Å; M520-F529 HydrophobicContact CG-CE2 4.27Å; M520-F529 HydrophobicContact CG-CG 4.32Å; M520-F529 HydrophobicContact CG-CZ 3.71Å; M520-F529 HydrophobicContact SD-CE1 3.65Å; M520-F529 HydrophobicContact SD-CZ 3.64Å; M520-L558 HydrophobicContact SD-CD2 4.2Å; M520-M567 HydrophobicContact CB-CE 4.42Å; M520-M567 HydrophobicContact CB-SD 4.02Å
521	E	86.2	Confident	83.2	Confident	87 Å²	87	45 Å²	45	41%	0.407	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	148.1	172.5	-64.1	174.9	160.3	0	0	109.9	K528	E521-K528 HydrophobicContact CB-CB 4.42Å; E521-K528 PolarHBondContact N-O 2.9Å; E521-K528 WeakPolarHBondContact O-CB 3.47Å; E521-K528 PolarHBondContact O-N 2.65Å; E521-K528 IonicContact OE2-NZ 3.71Å; E521-K528 PolarHBondContact OE2-NZ 2.93Å
522	T	83.4	Confident	84.4	Confident	89 Å²	89	46 Å²	46	55%	0.546	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	125.1	172.2	51.1	0	0	0	0	110	M555	T522-M555 HydrophobicContact CG2-CE 4.22Å; T522-M555 HydrophobicContact CG2-SD 3.99Å
523	V	84.4	Confident	85	Confident	74 Å²	74	45.8 Å²	45.8	45%	0.448	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	97.3	-179.7	-174.4	0	0	0	0	108.2	D525 W526 K528 W552	V523-D525 PolarHBondContact O-N 3.11Å; V523-W526 CarbonylContact C-O 3.48Å; V523-W526 PolarHBondContact N-O 3.2Å; V523-W526 PolarHBondContact O-N 2.66Å; V523-W526 VanDerWaalsContact O-N 3.12Å; V523-K528 HydrophobicContact CG2-CB 4.27Å; V523-K528 HydrophobicContact CG2-CD 4.19Å; V523-W552 HydrophobicContact CB-CZ3 4.25Å
524	G	84.4	Confident	85.3	Confident	71 Å²	71	48.6 Å²	48.6	73%	0.732	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	-130.1	-174.7	0	0	0	0	0	112.1	W526	G524-W526 PolarHBondContact O-N 2.87Å
525	D	84.1	Confident	85.3	Confident	113 Å²	113	48.9 Å²	48.9	60%	0.604	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	7.7	177.6	-70.2	-36.4	0	0	0	114.3	V523 M555	V523-D525 PolarHBondContact O-N 3.11Å; D525-M555 WeakPolarHBondContact O-CB 3.34Å; D525-M555 WeakPolarHBondContact O-CG 3.1Å; D525-M555 PolarHBondContact O-N 3.47Å
526	W	84.6	Confident	85.1	Confident	95 Å²	95	50.2 Å²	50.2	36%	0.36	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	137.3	-176.5	-66.5	85.1	0	0	0	112.6	V523 G524 W552 H554 V582	V523-W526 CarbonylContact C-O 3.48Å; V523-W526 PolarHBondContact N-O 3.2Å; V523-W526 PolarHBondContact O-N 2.66Å; V523-W526 VanDerWaalsContact O-N 3.12Å; G524-W526 PolarHBondContact O-N 2.87Å; W526-W552 HydrophobicContact CB-CE3 3.8Å; W526-W552 HydrophobicContact CB-CZ3 3.99Å; W526-W552 HydrophobicContact CE3-CB 4.01Å; W526-W552 HydrophobicContact CG-CE3 4.47Å; W526-W552 HydrophobicContact CZ3-CB 4.29Å; W526-H554 AromaticContact CE2-CD2 3.85Å; W526-H554 HydrophobicContact CE3-CB 4.31Å; W526-H554 HydrophobicContact CH2-CB 4.47Å; W526-H554 AromaticContact CZ2-CD2 3.9Å; W526-H554 HydrophobicContact CZ3-CB 4.19Å; W526-V582 HydrophobicContact CH2-CG1 4.5Å; W526-V582 HydrophobicContact CZ3-CG1 4.02Å
527	A	86.4	Confident	84.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	124.4	164.8	0	0	0	0	0	109.7	F529 V553 M555 L558	A527-F529 HydrophobicContact CB-CD2 4.46Å; A527-F529 HydrophobicContact CB-CE2 3.84Å; A527-F529 HydrophobicContact CB-CZ 4.48Å; A527-V553 PolarHBondContact N-O 3.34Å; A527-V553 PolarHBondContact O-N 3.02Å; A527-M555 HydrophobicContact CB-SD 4.14Å; A527-L558 HydrophobicContact CB-CD2 3.61Å
528	K	88.8	Confident	84.4	Confident	47 Å²	47	49 Å²	49	20%	0.204	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	107.3	-179.3	-176.7	-170.5	163	-152.8	0	108.7	M520 E521 V523 I550 W552	M520-K528 WeakPolarHBondContact CA-O 3.5Å; E521-K528 HydrophobicContact CB-CB 4.42Å; E521-K528 PolarHBondContact N-O 2.9Å; E521-K528 WeakPolarHBondContact O-CB 3.47Å; E521-K528 PolarHBondContact O-N 2.65Å; E521-K528 IonicContact OE2-NZ 3.71Å; E521-K528 PolarHBondContact OE2-NZ 2.93Å; V523-K528 HydrophobicContact CG2-CB 4.27Å; V523-K528 HydrophobicContact CG2-CD 4.19Å; K528-I550 HydrophobicContact CD-CG2 4.38Å; K528-I550 HydrophobicContact CG-CG2 3.48Å; K528-I550 VanDerWaalsContact CG-CG2 3.48Å; K528-W552 HydrophobicContact CB-CE3 3.94Å; K528-W552 HydrophobicContact CB-CH2 3.98Å; K528-W552 HydrophobicContact CB-CZ3 3.62Å; K528-W552 HydrophobicContact CD-CH2 3.84Å; K528-W552 HydrophobicContact CD-CZ2 4.19Å; K528-W552 HydrophobicContact CD-CZ3 4.35Å; K528-W552 HydrophobicContact CG-CE3 4.3Å; K528-W552 HydrophobicContact CG-CH2 3.82Å; K528-W552 HydrophobicContact CG-CZ2 4.04Å; K528-W552 HydrophobicContact CG-CZ3 3.96Å
529	F	87.6	Confident	83.8	Confident	6 Å²	6	46.8 Å²	46.8	3%	0.026	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	122.3	175.5	-67.7	-90.5	0	0	0	110.4	V517 D519 M520 A527 V531 I550 L551 V553 L558 I565 M567	V517-F529 HydrophobicContact CG1-CB 4.49Å; V517-F529 HydrophobicContact CG1-CD1 3.75Å; D519-F529 CarbonylContact O-C 3.53Å; D519-F529 VanDerWaalsContact O-CA 3.32Å; D519-F529 WeakPolarHBondContact O-CA 3.27Å; M520-F529 HydrophobicContact CB-CD1 3.72Å; M520-F529 HydrophobicContact CB-CE1 3.69Å; M520-F529 HydrophobicContact CB-CZ 4.47Å; M520-F529 HydrophobicContact CG-CD1 3.76Å; M520-F529 HydrophobicContact CG-CE1 3.42Å; M520-F529 VanDerWaalsContact CG-CE1 3.42Å; M520-F529 HydrophobicContact CG-CE2 4.27Å; M520-F529 HydrophobicContact CG-CG 4.32Å; M520-F529 HydrophobicContact CG-CZ 3.71Å; M520-F529 HydrophobicContact SD-CE1 3.65Å; M520-F529 HydrophobicContact SD-CZ 3.64Å; A527-F529 HydrophobicContact CB-CD2 4.46Å; A527-F529 HydrophobicContact CB-CE2 3.84Å; A527-F529 HydrophobicContact CB-CZ 4.48Å; F529-V531 HydrophobicContact CB-CG1 4.04Å; F529-V531 PolarHBondContact O-N 3.21Å; F529-I550 WeakPolarHBondContact O-CA 3.4Å; F529-L551 HydrophobicContact CB-CB 4.04Å; F529-L551 WeakPolarHBondContact CB-O 3.45Å; F529-L551 PolarHBondContact N-O 2.66Å; F529-L551 PolarHBondContact O-N 2.74Å; F529-V553 HydrophobicContact CD2-CB 4.43Å; F529-V553 HydrophobicContact CD2-CG2 3.87Å; F529-V553 HydrophobicContact CE2-CB 4.04Å; F529-V553 HydrophobicContact CE2-CG2 3.78Å; F529-L558 HydrophobicContact CE2-CD1 4.36Å; F529-L558 HydrophobicContact CZ-CD1 3.96Å; F529-L558 HydrophobicContact CZ-CD2 4.31Å; F529-I565 HydrophobicContact CD1-CG2 4.16Å; F529-I565 HydrophobicContact CE1-CG2 3.92Å; F529-I565 HydrophobicContact CE2-CD1 4.31Å; F529-I565 HydrophobicContact CZ-CB 4.5Å; F529-I565 HydrophobicContact CZ-CG2 4.3Å; F529-M567 HydrophobicContact CE1-SD 4.45Å
530	S	86.3	Confident	82.8	Confident	37 Å²	37	49.9 Å²	49.9	26%	0.259	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	115	169	-65.7	0	0	0	0	108.3	L518 D519	L518-S530 WeakPolarHBondContact CB-O 3.36Å; L518-S530 PolarHBondContact N-O 2.85Å; D519-S530 PolarHBondContact N-O 3.2Å; D519-S530 PolarHBondContact O-N 3.09Å
531	V	87.6	Confident	81.7	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.006	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	140.8	-174.7	-60.6	0	0	0	0	112.2	V515 N516 V517 F529 N549 L551 L581	V515-V531 HydrophobicContact CB-CB 4.18Å; V515-V531 HydrophobicContact CG1-CG2 4.37Å; N516-V531 CarbonylContact O-C 3.59Å; N516-V531 VanDerWaalsContact O-CA 3.25Å; N516-V531 WeakPolarHBondContact O-CA 3.31Å; V517-V531 HydrophobicContact CG2-CG1 4.16Å; F529-V531 HydrophobicContact CB-CG1 4.04Å; F529-V531 PolarHBondContact O-N 3.21Å; V531-N549 HydrophobicContact CG2-CB 4.22Å; V531-N549 WeakPolarHBondContact CG2-O 3.36Å; V531-N549 PolarHBondContact N-O 3.18Å; V531-N549 CarbonylContact O-C 3.59Å; V531-N549 PolarHBondContact O-N 2.83Å; V531-L551 HydrophobicContact CB-CB 4.49Å; V531-L551 HydrophobicContact CG1-CB 3.71Å; V531-L551 HydrophobicContact CG1-CD2 4.24Å; V531-L551 HydrophobicContact CG2-CB 3.88Å; V531-L581 HydrophobicContact CG2-CD2 4.02Å
532	S	87.1	Confident	80.5	Confident	32 Å²	32	56.2 Å²	56.2	22%	0.224	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	116.8	171.3	-168.3	0	0	0	0	110.4	V515 N516 V534	V515-S532 CarbonylContact C-O 3.28Å; V515-S532 WeakPolarHBondContact CA-O 3.04Å; N516-S532 PolarHBondContact N-O 3.4Å; N516-S532 PolarHBondContact O-N 2.86Å; S532-V534 PolarHBondContact O-N 3.13Å
533	V	86	Confident	79.5	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.018	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	106.5	177.3	172.8	0	0	0	0	109.6	V513 V515 V536 G547 N549	V513-V533 HydrophobicContact CG1-CB 4.17Å; V513-V533 HydrophobicContact CG1-CG1 3.35Å; V513-V533 HydrophobicContact CG1-CG2 3.94Å; V515-V533 HydrophobicContact CG1-CG2 4.09Å; V533-V536 HydrophobicContact CG1-CG2 3.84Å; V533-G547 PolarHBondContact N-O 2.78Å; V533-G547 PolarHBondContact O-N 3.44Å; V533-G547 VanDerWaalsContact O-N 3.14Å; V533-N549 HydrophobicContact CG2-CB 3.96Å; V533-N549 WeakPolarHBondContact CG2-ND2 3.03Å
534	V	85.1	Confident	78.9	Confident	59 Å²	59	55.6 Å²	55.6	36%	0.358	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-41.7	-177.8	-178	0	0	0	0	111.4	Q514 N516 S532	Q514-V534 HydrophobicContact CB-CB 4.42Å; Q514-V534 HydrophobicContact CG-CB 4.01Å; Q514-V534 HydrophobicContact CG-CG2 4.46Å; Q514-V534 PolarHBondContact O-N 2.73Å; N516-V534 HydrophobicContact CB-CG2 4.45Å; S532-V534 PolarHBondContact O-N 3.13Å
535	S	83.3	Confident	78.1	Confident	16 Å²	16	60.4 Å²	60.4	11%	0.112	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	135.4	-176.7	-75.2	0	0	0	0	111.8	Q514	Q514-S535 PolarHBondContact N-O 3.13Å; Q514-S535 PolarHBondContact O-N 3.29Å
536	V	82.7	Confident	77.9	Confident	30 Å²	30	63.7 Å²	63.7	18%	0.182	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	120.6	174.3	-177	0	0	0	0	108.4	V513 V533 L544	V513-V536 HydrophobicContact CG1-CG2 4.24Å; V513-V536 HydrophobicContact CG2-CG1 4.42Å; V513-V536 HydrophobicContact CG2-CG2 4.38Å; V533-V536 HydrophobicContact CG1-CG2 3.84Å; V536-L544 HydrophobicContact CG2-CB 4.14Å
537	Y	78.3	Confident	77.8	Confident	5 Å²	5	60.4 Å²	60.4	2%	0.02	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-27.2	-177.8	-64.2	-82.7	0	0	0	112.6	Y505 A512 Q514 L572 W592 L600 R601 Q604	Y505-Y537 PolarHBondContact OH-O 3.48Å; Y505-Y537 VanDerWaalsContact OH-O 3.13Å; A512-Y537 WeakPolarHBondContact O-CB 3.48Å; A512-Y537 PolarHBondContact O-N 3.46Å; Q514-Y537 HydrophobicContact CB-CE2 3.95Å; Q514-Y537 PolarHBondContact OE1-OH 3.11Å; Y537-L572 HydrophobicContact CD2-CD1 4.42Å; Y537-W592 AromaticContact CE2-CH2 3.56Å; Y537-W592 HydrophobicContact CE2-CH2 3.56Å; Y537-W592 AromaticContact CE2-CZ3 3.96Å; Y537-W592 HydrophobicContact CE2-CZ3 3.96Å; Y537-W592 AromaticContact CZ-CH2 3.59Å; Y537-W592 VanDerWaalsContact OH-CH2 3.26Å; Y537-W592 WeakPolarHBondContact OH-CH2 3.26Å; Y537-L600 HydrophobicContact CD1-CB 3.58Å; Y537-L600 HydrophobicContact CD1-CD1 4.46Å; Y537-L600 HydrophobicContact CD2-CD1 4.13Å; Y537-L600 HydrophobicContact CE1-CB 3.94Å; Y537-L600 HydrophobicContact CE2-CD1 4.3Å; Y537-L600 HydrophobicContact CG-CB 3.98Å; Y537-L600 HydrophobicContact CG-CD1 4.23Å; Y537-R601 HydrophobicContact CD1-CG 4.49Å; Y537-R601 HydrophobicContact CE1-CG 4.05Å; Y537-Q604 WeakPolarHBondContact O-CG 3.4Å; Y537-Q604 PolarHBondContact O-NE2 3.13Å; Y537-Q604 VanDerWaalsContact O-NE2 3.12Å
538	K	76.4	Confident	77.6	Confident	13 Å²	13	66.9 Å²	66.9	6%	0.057	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	136.1	176.6	-168.3	179.1	-178.8	-176.9	0	109.1	Y505 C506 K508 A511 A512 E607	Y505-K538 PolarHBondContact O-NZ 3.49Å; C506-K538 PolarHBondContact O-NZ 3.05Å; K508-K538 PolarHBondContact O-NZ 2.03Å; A511-K538 CarbonylContact C-O 3.58Å; A511-K538 VanDerWaalsContact CA-O 3.26Å; A511-K538 WeakPolarHBondContact CA-O 3.43Å; A512-K538 HydrophobicContact CB-CB 3.95Å; A512-K538 PolarHBondContact N-O 3.07Å; K538-E607 WeakPolarHBondContact CE-OE1 3.16Å; K538-E607 IonicContact NZ-OE1 3.78Å
539	S	71.6	Confident	77.4	Confident	41 Å²	41	66.7 Å²	66.7	29%	0.287	34%	0.342	S	S	.	.			trans	-153	133.8	175	-142.5	0	0	0	0	105.7	E542	S539-E542 PolarHBondContact OG-O 3.43Å
540	R	61.4	Low	77.3	Confident	151 Å²	151	69.7 Å²	69.7	57%	0.57	36%	0.358	S	S	*	.	S	Bend	trans	-98.9	-40.9	-179.9	-94.4	-168.3	171.3	168.1	5.3	112.6	D509 E577	D509-R540 IonicContact OD1-CZ 3.17Å; D509-R540 IonicContact OD1-NH1 3.89Å; D509-R540 PolarHBondContact OD1-NH1 3Å; D509-R540 IonicContact OD1-NH2 2.77Å; R540-E577 PolarHBondContact N-OE1 3.15Å
541	D	60.9	Low	77.3	Confident	137 Å²	137	68 Å²	68	73%	0.733	35%	0.346	S	S	*	.	S	Bend	trans	-103	-109.4	-177.9	-64.2	-28.1	0	0	0	111.7	E577	D541-E577 PolarHBondContact N-OE1 3.08Å
542	E	59.9	Low	77.2	Confident	160 Å²	160	71.7 Å²	71.7	75%	0.748	36%	0.36	S	S	*	.	S	Bend	trans	-69.4	135.7	-176.9	-79.6	-162.8	149.2	0	0	112.1	S539 L544	S539-E542 PolarHBondContact OG-O 3.43Å; E542-L544 PolarHBondContact O-N 2.84Å
543	P	63.7	Low	77.2	Confident	110 Å²	110	70.1 Å²	70.1	71%	0.714	35%	0.349	S	S	*	.			trans	-69.9	103.2	177.2	27.2	-31.7	0	0	0	110.1	K545	P543-K545 PolarHBondContact O-N 2.92Å; P543-K545 VanDerWaalsContact O-N 3.09Å
544	L	70.2	Confident	77.1	Confident	41 Å²	41	72 Å²	72	22%	0.215	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-49.9	116.9	166.2	-84	151.3	0	0	0	110	A511 V513 V536 E542 L581	A511-L544 HydrophobicContact CB-CD1 3.63Å; V513-L544 HydrophobicContact CG2-CD1 4Å; V536-L544 HydrophobicContact CG2-CB 4.14Å; E542-L544 PolarHBondContact O-N 2.84Å; L544-L581 HydrophobicContact CD1-CD1 4.49Å; L544-L581 HydrophobicContact CD2-CD1 4.42Å
545	K	68.9	Low	76.9	Confident	171 Å²	171	72.6 Å²	72.6	74%	0.743	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-73	139.1	-179.9	-68.9	-178.2	-177.9	174.2	0	110.1	P543 N549	P543-K545 PolarHBondContact O-N 2.92Å; P543-K545 VanDerWaalsContact O-N 3.09Å; K545-N549 PolarHBondContact O-ND2 2.84Å
546	R	79.2	Confident	76.7	Confident	182 Å²	182	78.3 Å²	78.3	69%	0.687	38%	0.38	S	S	*	.	S	Bend	trans	-69.8	150.1	170.7	-64.3	-176.6	-172.3	170.9	3	109.7
547	G	81.8	Confident	76.5	Confident	27 Å²	27	77.3 Å²	77.3	28%	0.278	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	108	-156.6	-175.5	0	0	0	0	0	112	V533 N549	V533-G547 PolarHBondContact N-O 2.78Å; V533-G547 PolarHBondContact O-N 3.44Å; V533-G547 VanDerWaalsContact O-N 3.14Å; G547-N549 PolarHBondContact O-N 2.86Å; G547-N549 PolarHBondContact O-ND2 3.34Å
548	D	83.6	Confident	76.6	Confident	135 Å²	135	79.1 Å²	79.1	72%	0.722	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	126.5	-169.1	-57.8	-26.8	0	0	0	111.1
549	N	84.1	Confident	76.6	Confident	44 Å²	44	82.3 Å²	82.3	24%	0.235	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	169.2	-178.3	-76.5	-95.1	0	0	0	108.7	V531 V533 K545 G547	V531-N549 HydrophobicContact CG2-CB 4.22Å; V531-N549 WeakPolarHBondContact CG2-O 3.36Å; V531-N549 PolarHBondContact N-O 3.18Å; V531-N549 CarbonylContact O-C 3.59Å; V531-N549 PolarHBondContact O-N 2.83Å; V533-N549 HydrophobicContact CG2-CB 3.96Å; V533-N549 WeakPolarHBondContact CG2-ND2 3.03Å; K545-N549 PolarHBondContact O-ND2 2.84Å; G547-N549 PolarHBondContact O-N 2.86Å; G547-N549 PolarHBondContact O-ND2 3.34Å
550	I	85.9	Confident	76.8	Confident	69 Å²	69	81.6 Å²	81.6	35%	0.354	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	130.4	179	-61.3	166.9	0	0	0	108.6	K528 F529 W552 L581	K528-I550 HydrophobicContact CD-CG2 4.38Å; K528-I550 HydrophobicContact CG-CG2 3.48Å; K528-I550 VanDerWaalsContact CG-CG2 3.48Å; F529-I550 WeakPolarHBondContact O-CA 3.4Å; I550-W552 HydrophobicContact CG2-CD2 4.16Å; I550-W552 HydrophobicContact CG2-CG 4.33Å; I550-W552 HydrophobicContact CG2-CZ2 4.08Å; I550-L581 WeakPolarHBondContact O-CB 3.2Å
551	L	86.3	Confident	77.3	Confident	0 Å²	0	81.4 Å²	81.4	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	117.2	171.7	174.8	64.3	0	0	0	109.6	F529 V531 V553 I565 V573 L581 A583	F529-L551 HydrophobicContact CB-CB 4.04Å; F529-L551 WeakPolarHBondContact CB-O 3.45Å; F529-L551 PolarHBondContact N-O 2.66Å; F529-L551 PolarHBondContact O-N 2.74Å; V531-L551 HydrophobicContact CB-CB 4.49Å; V531-L551 HydrophobicContact CG1-CB 3.71Å; V531-L551 HydrophobicContact CG1-CD2 4.24Å; V531-L551 HydrophobicContact CG2-CB 3.88Å; L551-V553 HydrophobicContact CG-CG2 4.34Å; L551-I565 HydrophobicContact CD2-CD1 3.83Å; L551-V573 HydrophobicContact CD1-CG1 4.45Å; L551-V573 HydrophobicContact CD2-CG2 4.48Å; L551-L581 CarbonylContact C-O 3.54Å; L551-L581 VanDerWaalsContact CA-O 3.29Å; L551-L581 WeakPolarHBondContact CA-O 3.48Å; L551-L581 HydrophobicContact CB-CD2 4.01Å; L551-L581 HydrophobicContact CD1-CB 4.15Å; L551-L581 HydrophobicContact CD1-CD2 3.71Å; L551-L581 HydrophobicContact CD1-CG 3.77Å; L551-L581 HydrophobicContact CG-CD2 4.31Å; L551-A583 HydrophobicContact CD1-CB 3.9Å
552	W	85.2	Confident	77.8	Confident	79 Å²	79	75.5 Å²	75.5	30%	0.299	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	135.6	177.9	-65.1	97.4	0	0	0	111.7	V523 W526 K528 I550 L581 V582 A583	V523-W552 HydrophobicContact CB-CZ3 4.25Å; W526-W552 HydrophobicContact CB-CE3 3.8Å; W526-W552 HydrophobicContact CB-CZ3 3.99Å; W526-W552 HydrophobicContact CE3-CB 4.01Å; W526-W552 HydrophobicContact CG-CE3 4.47Å; W526-W552 HydrophobicContact CZ3-CB 4.29Å; K528-W552 HydrophobicContact CB-CE3 3.94Å; K528-W552 HydrophobicContact CB-CH2 3.98Å; K528-W552 HydrophobicContact CB-CZ3 3.62Å; K528-W552 HydrophobicContact CD-CH2 3.84Å; K528-W552 HydrophobicContact CD-CZ2 4.19Å; K528-W552 HydrophobicContact CD-CZ3 4.35Å; K528-W552 HydrophobicContact CG-CE3 4.3Å; K528-W552 HydrophobicContact CG-CH2 3.82Å; K528-W552 HydrophobicContact CG-CZ2 4.04Å; K528-W552 HydrophobicContact CG-CZ3 3.96Å; I550-W552 HydrophobicContact CG2-CD2 4.16Å; I550-W552 HydrophobicContact CG2-CG 4.33Å; I550-W552 HydrophobicContact CG2-CZ2 4.08Å; W552-L581 PolarHBondContact N-O 2.9Å; W552-V582 HydrophobicContact CB-CG1 4.44Å; W552-V582 HydrophobicContact CB-CG2 4.28Å; W552-V582 CarbonylContact O-C 3.56Å; W552-V582 WeakPolarHBondContact O-CA 3.31Å; W552-V582 WeakPolarHBondContact O-CG1 3.47Å; W552-A583 PolarHBondContact O-N 3.24Å
553	V	86.4	Confident	78.4	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	131.2	176.5	-176.3	0	0	0	0	108.8	A527 F529 L551 D557 L558 I565 A583	A527-V553 PolarHBondContact N-O 3.34Å; A527-V553 PolarHBondContact O-N 3.02Å; F529-V553 HydrophobicContact CD2-CB 4.43Å; F529-V553 HydrophobicContact CD2-CG2 3.87Å; F529-V553 HydrophobicContact CE2-CB 4.04Å; F529-V553 HydrophobicContact CE2-CG2 3.78Å; L551-V553 HydrophobicContact CG-CG2 4.34Å; V553-D557 HydrophobicContact CG1-CB 4.19Å; V553-L558 HydrophobicContact CG1-CB 4.26Å; V553-I565 HydrophobicContact CG2-CD1 3.73Å; V553-A583 HydrophobicContact CG2-CB 4.2Å
554	H	85.1	Confident	78.9	Confident	41 Å²	41	69.8 Å²	69.8	19%	0.19	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	141.1	179.1	-164.2	-88.1	0	0	0	110.7	W526 K556 D557 L558	W526-H554 AromaticContact CE2-CD2 3.85Å; W526-H554 HydrophobicContact CE3-CB 4.31Å; W526-H554 HydrophobicContact CH2-CB 4.47Å; W526-H554 AromaticContact CZ2-CD2 3.9Å; W526-H554 HydrophobicContact CZ3-CB 4.19Å; H554-K556 VanDerWaalsContact C-N 3.25Å; H554-K556 WeakPolarHBondContact ND1-CB 3.26Å; H554-K556 PolarHBondContact ND1-N 2.83Å; H554-K556 PolarHBondContact O-N 2.96Å; H554-D557 HydrophobicContact CB-CB 4.39Å; H554-D557 WeakPolarHBondContact O-CA 3.37Å; H554-D557 WeakPolarHBondContact O-CB 3.35Å; H554-D557 PolarHBondContact O-N 2.88Å; H554-L558 PolarHBondContact O-N 2.96Å
555	M	79.6	Confident	79.4	Confident	72 Å²	72	69 Å²	69	36%	0.355	34%	0.338	S	S	.	.	H	α-helix	trans	-60.7	-34.1	-176.9	-79.4	-69	-76.7	0	0	112.6	T522 D525 A527 D557 L558 A559	T522-M555 HydrophobicContact CG2-CE 4.22Å; T522-M555 HydrophobicContact CG2-SD 3.99Å; D525-M555 WeakPolarHBondContact O-CB 3.34Å; D525-M555 WeakPolarHBondContact O-CG 3.1Å; D525-M555 PolarHBondContact O-N 3.47Å; A527-M555 HydrophobicContact CB-SD 4.14Å; M555-D557 VanDerWaalsContact C-N 3.34Å; M555-D557 PolarHBondContact O-N 3.35Å; M555-L558 PolarHBondContact O-N 3.23Å; M555-L558 HydrophobicContact SD-CD2 4.21Å; M555-A559 VanDerWaalsContact O-CB 3.28Å; M555-A559 WeakPolarHBondContact O-CB 3.46Å; M555-A559 PolarHBondContact O-N 3.48Å
556	K	79.5	Confident	79.8	Confident	136 Å²	136	65.4 Å²	65.4	59%	0.591	32%	0.324	S	S	*	.	H	α-helix	trans	-60.6	-39.2	172.1	-63	-179.9	-179.1	-179.9	0	112.9	H554 C560	H554-K556 VanDerWaalsContact C-N 3.25Å; H554-K556 WeakPolarHBondContact ND1-CB 3.26Å; H554-K556 PolarHBondContact ND1-N 2.83Å; H554-K556 PolarHBondContact O-N 2.96Å; K556-C560 PolarHBondContact O-N 2.8Å
557	D	79.1	Confident	79.9	Confident	9 Å²	9	60.7 Å²	60.7	5%	0.048	31%	0.31	C	S	.	.	H	α-helix	trans	-72.8	-38.4	177.8	-75.5	-22.9	0	0	0	111.4	Y490 V553 H554 M555 K561 C562 D584 K585	Y490-D557 VanDerWaalsContact CE1-OD1 3.3Å; Y490-D557 WeakPolarHBondContact CE1-OD1 3.38Å; V553-D557 HydrophobicContact CG1-CB 4.19Å; H554-D557 HydrophobicContact CB-CB 4.39Å; H554-D557 WeakPolarHBondContact O-CA 3.37Å; H554-D557 WeakPolarHBondContact O-CB 3.35Å; H554-D557 PolarHBondContact O-N 2.88Å; M555-D557 VanDerWaalsContact C-N 3.34Å; M555-D557 PolarHBondContact O-N 3.35Å; D557-K561 PolarHBondContact O-N 2.87Å; D557-C562 WeakPolarHBondContact CB-O 3.23Å; D557-C562 CarbonylContact O-C 3.56Å; D557-C562 PolarHBondContact O-N 3.36Å; D557-D584 WeakPolarHBondContact OD2-CA 3.44Å; D557-K585 PolarHBondContact OD2-N 3.21Å
558	L	80.1	Confident	79.6	Confident	44 Å²	44	64 Å²	64	23%	0.23	33%	0.329	C	S	.	.	H	α-helix	trans	-68.3	-41.3	176.8	-170.9	65.3	0	0	0	111.9	M520 A527 F529 V553 H554 M555 C560 K561	M520-L558 HydrophobicContact SD-CD2 4.2Å; A527-L558 HydrophobicContact CB-CD2 3.61Å; F529-L558 HydrophobicContact CE2-CD1 4.36Å; F529-L558 HydrophobicContact CZ-CD1 3.96Å; F529-L558 HydrophobicContact CZ-CD2 4.31Å; V553-L558 HydrophobicContact CG1-CB 4.26Å; H554-L558 PolarHBondContact O-N 2.96Å; M555-L558 PolarHBondContact O-N 3.23Å; M555-L558 HydrophobicContact SD-CD2 4.21Å; L558-C560 VanDerWaalsContact C-N 3.34Å; L558-C560 PolarHBondContact O-N 3.34Å; L558-K561 PolarHBondContact O-N 2.88Å
559	A	76.7	Confident	79.6	Confident	79 Å²	79	61.3 Å²	61.3	65%	0.653	31%	0.311	S	S	*	.	H	α-helix	trans	-60.3	-42.2	176.6	0	0	0	0	0	111.8	M555 K561	M555-A559 VanDerWaalsContact O-CB 3.28Å; M555-A559 WeakPolarHBondContact O-CB 3.46Å; M555-A559 PolarHBondContact O-N 3.48Å; A559-K561 PolarHBondContact O-N 3.26Å
560	C	75.2	Confident	79.6	Confident	26 Å²	26	65.4 Å²	65.4	18%	0.176	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	5.3	174.4	-67.1	0	0	0	0	114.4	C487 K556 L558 C562	C487-C560 VanDerWaalsContact CA-SG 3.58Å; C487-C560 HydrophobicContact CB-CB 3.7Å; C487-C560 WeakPolarHBondContact CB-SG 3.49Å; C487-C560 WeakPolarHBondContact SG-CA 3.44Å; C487-C560 WeakPolarHBondContact SG-CB 3.47Å; C487-C560 CovalentContact SG-SG 2.06Å; C487-C560 PolarHBondContact SG-SG 3.2Å; K556-C560 PolarHBondContact O-N 2.8Å; L558-C560 VanDerWaalsContact C-N 3.34Å; L558-C560 PolarHBondContact O-N 3.34Å; C560-C562 VanDerWaalsContact C-N 3.3Å; C560-C562 PolarHBondContact O-N 3.44Å
561	K	71.3	Confident	79.6	Confident	147 Å²	147	62.4 Å²	62.4	64%	0.639	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	38	-178	-60.8	176.4	-179.9	164.4	0	113.4	D557 L558 A559 K564	D557-K561 PolarHBondContact O-N 2.87Å; L558-K561 PolarHBondContact O-N 2.88Å; A559-K561 PolarHBondContact O-N 3.26Å; K561-K564 HydrophobicContact CB-CG 4.19Å; K561-K564 WeakPolarHBondContact O-CG 3.25Å; K561-K564 PolarHBondContact O-N 3.5Å
562	C	73.2	Confident	79.6	Confident	14 Å²	14	62.6 Å²	62.6	10%	0.095	31%	0.309	C	S	.	.	S	Bend	trans	-132.1	74.2	-176.7	-78.4	0	0	0	0	110.3	C491 D557 C560	C491-C562 HydrophobicContact CB-CB 3.63Å; C491-C562 WeakPolarHBondContact CB-SG 3.27Å; C491-C562 WeakPolarHBondContact SG-CB 3.23Å; C491-C562 CovalentContact SG-SG 2.05Å; C491-C562 PolarHBondContact SG-SG 3.23Å; D557-C562 WeakPolarHBondContact CB-O 3.23Å; D557-C562 CarbonylContact O-C 3.56Å; D557-C562 PolarHBondContact O-N 3.36Å; C560-C562 VanDerWaalsContact C-N 3.3Å; C560-C562 PolarHBondContact O-N 3.44Å
563	P	71.1	Confident	79.4	Confident	9 Å²	9	59 Å²	59	6%	0.058	30%	0.295	C	S	.	.	S	Bend	cis	-105.2	150	34.6	10	8.1	0	0	0	115	I565 A583 V589	P563-I565 HydrophobicContact CB-CG1 4.43Å; P563-I565 HydrophobicContact CG-CD1 4.28Å; P563-I565 PolarHBondContact O-N 3.13Å; P563-A583 HydrophobicContact CG-CB 3.72Å; P563-V589 HydrophobicContact CB-CB 3.53Å; P563-V589 HydrophobicContact CB-CG1 4.3Å; P563-V589 HydrophobicContact CB-CG2 3.37Å; P563-V589 HydrophobicContact CG-CB 4.38Å; P563-V589 HydrophobicContact CG-CG2 3.66Å
564	K	74.6	Confident	78.8	Confident	141 Å²	141	59.5 Å²	59.5	61%	0.613	30%	0.299	S	S	*	.			trans	-74.8	84.9	174.5	-66.1	-169.8	-179.2	178.8	0	111.4	K561 F571	K561-K564 HydrophobicContact CB-CG 4.19Å; K561-K564 WeakPolarHBondContact O-CG 3.25Å; K561-K564 PolarHBondContact O-N 3.5Å; K564-F571 WeakPolarHBondContact O-CE1 3.47Å
565	I	79.9	Confident	78.1	Confident	24 Å²	24	57.9 Å²	57.9	12%	0.123	29%	0.293	C	S	.	.			trans	-93.1	140.1	173.1	-64.2	163.8	0	0	0	109.1	V517 F529 L551 V553 P563 V589	V517-I565 HydrophobicContact CG1-CG2 4.18Å; V517-I565 HydrophobicContact CG2-CG2 3.85Å; F529-I565 HydrophobicContact CD1-CG2 4.16Å; F529-I565 HydrophobicContact CE1-CG2 3.92Å; F529-I565 HydrophobicContact CE2-CD1 4.31Å; F529-I565 HydrophobicContact CZ-CB 4.5Å; F529-I565 HydrophobicContact CZ-CG2 4.3Å; L551-I565 HydrophobicContact CD2-CD1 3.83Å; V553-I565 HydrophobicContact CG2-CD1 3.73Å; P563-I565 HydrophobicContact CB-CG1 4.43Å; P563-I565 HydrophobicContact CG-CD1 4.28Å; P563-I565 PolarHBondContact O-N 3.13Å; I565-V589 HydrophobicContact CG1-CG1 3.89Å
566	Q	79.2	Confident	77.2	Confident	96 Å²	96	56.2 Å²	56.2	45%	0.449	29%	0.288	S	S	.	.			trans	-129.7	140.1	176	-64.9	-175.9	-32.5	0	0	109.5	K569 F571	Q566-K569 HydrophobicContact CB-CD 4.02Å; Q566-K569 HydrophobicContact CB-CG 4.49Å; Q566-K569 VanDerWaalsContact OE1-CD 3.27Å; Q566-K569 VanDerWaalsContact OE1-CE 3.31Å; Q566-F571 HydrophobicContact CB-CE2 4.42Å; Q566-F571 HydrophobicContact CB-CZ 4Å; Q566-F571 HydrophobicContact CG-CZ 4.48Å; Q566-F571 WeakPolarHBondContact O-CE2 3.17Å
567	M	80.4	Confident	75.9	Confident	82 Å²	82	53.2 Å²	53.2	40%	0.404	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	146.6	177.6	-61.8	-56.3	-71.1	0	0	111.8	V517 L518 M520 F529 K569	V517-M567 HydrophobicContact CG1-SD 3.98Å; L518-M567 VanDerWaalsContact O-CE 3.31Å; L518-M567 WeakPolarHBondContact O-CE 3.49Å; M520-M567 HydrophobicContact CB-CE 4.42Å; M520-M567 HydrophobicContact CB-SD 4.02Å; F529-M567 HydrophobicContact CE1-SD 4.45Å; M567-K569 PolarHBondContact O-N 3.4Å
568	S	75	Confident	75.1	Confident	97 Å²	97	60.8 Å²	60.8	68%	0.678	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	17.9	175.3	-43.9	0	0	0	0	115.2	V517	V517-S568 VanDerWaalsContact O-CA 3.28Å; V517-S568 WeakPolarHBondContact O-CA 3.27Å; V517-S568 PolarHBondContact O-N 3.26Å
569	K	83.8	Confident	74.2	Confident	78 Å²	78	66 Å²	66	34%	0.339	34%	0.337	S	S	.	.			trans	-111.4	153.6	174.9	-73.4	-170.9	-179.2	-177.4	0	111.1	V517 Q566 M567 F571	V517-K569 PolarHBondContact N-O 3.39Å; Q566-K569 HydrophobicContact CB-CD 4.02Å; Q566-K569 HydrophobicContact CB-CG 4.49Å; Q566-K569 VanDerWaalsContact OE1-CD 3.27Å; Q566-K569 VanDerWaalsContact OE1-CE 3.31Å; M567-K569 PolarHBondContact O-N 3.4Å; K569-F571 HydrophobicContact CB-CD2 4.31Å; K569-F571 HydrophobicContact CB-CE2 3.48Å; K569-F571 VanDerWaalsContact CB-CE2 3.48Å; K569-F571 HydrophobicContact CB-CZ 3.92Å; K569-F571 WeakPolarHBondContact O-CD2 3.03Å
570	R	85.3	Confident	73.8	Confident	131 Å²	131	64.4 Å²	64.4	49%	0.494	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	134.6	176	-64	176.2	-170.8	175.4	1.7	109.7	V515 N516 W592	V515-R570 CarbonylContact O-C 3.57Å; V515-R570 VanDerWaalsContact O-CA 3.27Å; V515-R570 WeakPolarHBondContact O-CA 3.44Å; N516-R570 HydrophobicContact CB-CG 4.43Å; R570-W592 HydrophobicContact CB-CB 3.59Å; R570-W592 HydrophobicContact CB-CG 4.16Å; R570-W592 VanDerWaalsContact O-CB 3.24Å; R570-W592 WeakPolarHBondContact O-CB 3.49Å; R570-W592 PolarHBondContact O-N 2.86Å
571	F	85.4	Confident	73.9	Confident	6 Å²	6	63.7 Å²	63.7	3%	0.026	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	147.9	177.5	-66.4	-92.5	0	0	0	110.4	Q514 V515 V517 K564 Q566 K569 V573 V589 I590 Q591	Q514-F571 WeakPolarHBondContact CA-O 3.25Å; V515-F571 HydrophobicContact CG2-CB 4.24Å; V515-F571 PolarHBondContact N-O 3.02Å; V515-F571 PolarHBondContact O-N 3.35Å; V517-F571 HydrophobicContact CG2-CD2 4.02Å; V517-F571 HydrophobicContact CG2-CE2 4.35Å; K564-F571 WeakPolarHBondContact O-CE1 3.47Å; Q566-F571 HydrophobicContact CB-CE2 4.42Å; Q566-F571 HydrophobicContact CB-CZ 4Å; Q566-F571 HydrophobicContact CG-CZ 4.48Å; Q566-F571 WeakPolarHBondContact O-CE2 3.17Å; K569-F571 HydrophobicContact CB-CD2 4.31Å; K569-F571 HydrophobicContact CB-CE2 3.48Å; K569-F571 VanDerWaalsContact CB-CE2 3.48Å; K569-F571 HydrophobicContact CB-CZ 3.92Å; K569-F571 WeakPolarHBondContact O-CD2 3.03Å; F571-V573 HydrophobicContact CB-CG2 4.33Å; F571-V589 HydrophobicContact CB-CG1 3.97Å; F571-V589 HydrophobicContact CD1-CG1 3.68Å; F571-V589 HydrophobicContact CE1-CG1 4.47Å; F571-V589 HydrophobicContact CG-CG1 3.98Å; F571-I590 CarbonylContact C-O 3.58Å; F571-I590 WeakPolarHBondContact CA-O 3.4Å; F571-Q591 HydrophobicContact CD1-CB 4.19Å; F571-Q591 HydrophobicContact CE1-CB 3.93Å; F571-Q591 HydrophobicContact CE1-CG 4.33Å
572	L	85.2	Confident	74.4	Confident	4 Å²	4	57.9 Å²	57.9	2%	0.021	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	118.2	156.8	179.1	76.1	0	0	0	106.8	I500 A512 V513 Y537 V589 I590 W592 W596 L600	I500-L572 HydrophobicContact CD1-CD2 3.27Å; A512-L572 HydrophobicContact CB-CD1 4.43Å; V513-L572 WeakPolarHBondContact O-CA 3.42Å; Y537-L572 HydrophobicContact CD2-CD1 4.42Å; L572-V589 WeakPolarHBondContact O-CA 3.25Å; L572-I590 HydrophobicContact CB-CD1 4.36Å; L572-I590 HydrophobicContact CB-CG1 3.82Å; L572-I590 HydrophobicContact CD2-CD1 3.85Å; L572-I590 HydrophobicContact CD2-CG1 4.16Å; L572-I590 HydrophobicContact CG-CG1 4.47Å; L572-I590 PolarHBondContact N-O 2.04Å; L572-I590 PolarHBondContact O-N 2.93Å; L572-W592 HydrophobicContact CB-CE3 4.02Å; L572-W592 HydrophobicContact CB-CZ3 4.2Å; L572-W592 HydrophobicContact CD1-CZ3 4.06Å; L572-W596 HydrophobicContact CB-CZ3 4.42Å; L572-L600 HydrophobicContact CD1-CD1 4.09Å; L572-L600 HydrophobicContact CD2-CD1 4.21Å
573	V	82.1	Confident	74.8	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.018	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	133.4	174.6	178.7	0	0	0	0	108	A511 V513 V515 L551 F571 A583 L588 V589	A511-V573 VanDerWaalsContact O-O 3.07Å; V513-V573 PolarHBondContact N-O 2.88Å; V513-V573 PolarHBondContact O-N 2.76Å; V515-V573 HydrophobicContact CG2-CG2 3.53Å; L551-V573 HydrophobicContact CD1-CG1 4.45Å; L551-V573 HydrophobicContact CD2-CG2 4.48Å; F571-V573 HydrophobicContact CB-CG2 4.33Å; V573-A583 HydrophobicContact CG1-CB 4.49Å; V573-L588 CarbonylContact C-O 3.55Å; V573-V589 HydrophobicContact CG1-CG2 4.34Å; V573-V589 HydrophobicContact CG2-CG1 4.24Å; V573-V589 HydrophobicContact CG2-CG2 4.22Å
574	S	73.3	Confident	75.2	Confident	11 Å²	11	58.3 Å²	58.3	8%	0.077	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	97.7	176.3	179.4	0	0	0	0	109.1	Y510 A511 L588	Y510-S574 VanDerWaalsContact CB-OG 3.31Å; Y510-S574 WeakPolarHBondContact CB-OG 3.08Å; A511-S574 WeakPolarHBondContact O-CA 3.23Å; S574-L588 PolarHBondContact N-O 3.22Å; S574-L588 PolarHBondContact O-N 3.04Å
575	G	69.5	Low	75.1	Confident	7 Å²	7	56.3 Å²	56.3	7%	0.072	29%	0.292	C	S	.	.			trans	-134.4	173	-176.2	0	0	0	0	0	112.7	Y510 E577 S587	Y510-G575 WeakPolarHBondContact CB-O 2.98Å; Y510-G575 WeakPolarHBondContact CD1-O 3.43Å; Y510-G575 VanDerWaalsContact CG-O 3.26Å; G575-E577 PolarHBondContact O-N 2.83Å; G575-S587 VanDerWaalsContact CA-OG 3.29Å; G575-S587 WeakPolarHBondContact CA-OG 3.44Å
576	P	60.8	Low	74.8	Confident	36 Å²	36	60.2 Å²	60.2	23%	0.234	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-55.1	133.9	179.6	22.8	-28.9	0	0	0	111.3	Y510 R578 D584 S587	Y510-P576 VanDerWaalsContact CD1-CA 3.43Å; Y510-P576 HydrophobicContact CD1-CB 4.46Å; Y510-P576 HydrophobicContact CE1-CB 4.06Å; P576-R578 PolarHBondContact O-N 3.1Å; P576-D584 WeakPolarHBondContact CG-OD2 3.22Å; P576-S587 VanDerWaalsContact CD-OG 3.25Å; P576-S587 WeakPolarHBondContact CD-OG 3.27Å
577	E	53.8	Low	74.6	Confident	73 Å²	73	56.3 Å²	56.3	34%	0.341	30%	0.296	S	S	.	.			trans	-74	95.7	-177.4	-158.1	160.3	-169.7	0	0	108.2	R540 D541 G575	R540-E577 PolarHBondContact N-OE1 3.15Å; D541-E577 PolarHBondContact N-OE1 3.08Å; G575-E577 PolarHBondContact O-N 2.83Å
578	R	62.2	Low	74.4	Confident	168 Å²	168	53.5 Å²	53.5	63%	0.634	28%	0.283	S	S	*	.			trans	-108.2	168.6	165.5	-65.6	-171	-178.7	-154.5	0.7	108.1	P576 G580 V582	P576-R578 PolarHBondContact O-N 3.1Å; R578-G580 PolarHBondContact O-N 2.03Å; R578-V582 HydrophobicContact CB-CG2 4.39Å
579	V	59.9	Low	74.7	Confident	154 Å²	154	49.9 Å²	49.9	93%	0.933	26%	0.257	S	S	*	.	S	Bend	trans	-60.5	104.6	174.6	-176.8	0	0	0	0	108.9
580	G	68.3	Low	74.6	Confident	46 Å²	46	47.3 Å²	47.3	47%	0.474	25%	0.246	S	C	.	.	S	Bend	trans	97.1	174.1	-175.2	0	0	0	0	0	115	R578 V582	R578-G580 PolarHBondContact O-N 2.03Å; G580-V582 PolarHBondContact O-N 2.86Å
581	L	78.1	Confident	74.4	Confident	11 Å²	11	45.9 Å²	45.9	6%	0.058	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	113.7	-179	-152	81.7	0	0	0	109.1	V513 V515 V531 L544 I550 L551 W552	V513-L581 HydrophobicContact CB-CD1 4.49Å; V513-L581 HydrophobicContact CG2-CD1 4.27Å; V515-L581 HydrophobicContact CG1-CD2 3.74Å; V531-L581 HydrophobicContact CG2-CD2 4.02Å; L544-L581 HydrophobicContact CD1-CD1 4.49Å; L544-L581 HydrophobicContact CD2-CD1 4.42Å; I550-L581 WeakPolarHBondContact O-CB 3.2Å; L551-L581 CarbonylContact C-O 3.54Å; L551-L581 VanDerWaalsContact CA-O 3.29Å; L551-L581 WeakPolarHBondContact CA-O 3.48Å; L551-L581 HydrophobicContact CB-CD2 4.01Å; L551-L581 HydrophobicContact CD1-CB 4.15Å; L551-L581 HydrophobicContact CD1-CD2 3.71Å; L551-L581 HydrophobicContact CD1-CG 3.77Å; L551-L581 HydrophobicContact CG-CD2 4.31Å; W552-L581 PolarHBondContact N-O 2.9Å
582	V	82.2	Confident	74.4	Confident	24 Å²	24	46.5 Å²	46.5	15%	0.145	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	136.3	177.5	-173	0	0	0	0	109.1	W526 W552 R578 G580	W526-V582 HydrophobicContact CH2-CG1 4.5Å; W526-V582 HydrophobicContact CZ3-CG1 4.02Å; W552-V582 HydrophobicContact CB-CG1 4.44Å; W552-V582 HydrophobicContact CB-CG2 4.28Å; W552-V582 CarbonylContact O-C 3.56Å; W552-V582 WeakPolarHBondContact O-CA 3.31Å; W552-V582 WeakPolarHBondContact O-CG1 3.47Å; R578-V582 HydrophobicContact CB-CG2 4.39Å; G580-V582 PolarHBondContact O-N 2.86Å
583	A	81.6	Confident	74.2	Confident	1 Å²	1	53 Å²	53	1%	0.008	27%	0.271	C	S	.	.			trans	-122.6	122.4	172.5	0	0	0	0	0	110.9	L551 W552 V553 P563 V573 S587 V589	L551-A583 HydrophobicContact CD1-CB 3.9Å; W552-A583 PolarHBondContact O-N 3.24Å; V553-A583 HydrophobicContact CG2-CB 4.2Å; P563-A583 HydrophobicContact CG-CB 3.72Å; V573-A583 HydrophobicContact CG1-CB 4.49Å; A583-S587 WeakPolarHBondContact CA-OG 3.43Å; A583-V589 HydrophobicContact CB-CG2 3.99Å
584	D	78.8	Confident	74.1	Confident	32 Å²	32	58.4 Å²	58.4	17%	0.171	30%	0.3	C	S	.	.			trans	-118.1	-177	-179.7	67.6	2.9	0	0	0	111.8	D557 P576 N586 S587	D557-D584 WeakPolarHBondContact OD2-CA 3.44Å; P576-D584 WeakPolarHBondContact CG-OD2 3.22Å; D584-N586 PolarHBondContact O-N 3.05Å; D584-N586 WeakPolarHBondContact OD1-CA 3.21Å; D584-N586 PolarHBondContact OD1-N 3.11Å; D584-S587 PolarHBondContact N-OG 3.1Å; D584-S587 WeakPolarHBondContact O-CB 3.34Å; D584-S587 PolarHBondContact O-N 2.97Å; D584-S587 WeakPolarHBondContact OD1-CB 3.44Å; D584-S587 PolarHBondContact OD1-N 3.32Å; D584-S587 PolarHBondContact OD1-OG 2.88Å
585	K	72.6	Confident	74.3	Confident	98 Å²	98	63.5 Å²	63.5	43%	0.426	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-21.8	174.6	64	-177.9	177.4	-178.5	0	116	Y490 C491 D557	Y490-K585 HydrophobicContact CE1-CD 4.28Å; C491-K585 HydrophobicContact CB-CB 4.26Å; D557-K585 PolarHBondContact OD2-N 3.21Å
586	N	72.9	Confident	74.7	Confident	107 Å²	107	64.7 Å²	64.7	57%	0.572	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-8.8	178.1	-67.5	-32.9	0	0	0	112.7	D584	D584-N586 PolarHBondContact O-N 3.05Å; D584-N586 WeakPolarHBondContact OD1-CA 3.21Å; D584-N586 PolarHBondContact OD1-N 3.11Å
587	S	76.3	Confident	75.7	Confident	14 Å²	14	64.7 Å²	64.7	10%	0.098	33%	0.333	C	S	.	.			trans	-78.5	137.3	-177.7	-62.5	0	0	0	0	111.4	G575 P576 A583 D584 V589	G575-S587 VanDerWaalsContact CA-OG 3.29Å; G575-S587 WeakPolarHBondContact CA-OG 3.44Å; P576-S587 VanDerWaalsContact CD-OG 3.25Å; P576-S587 WeakPolarHBondContact CD-OG 3.27Å; A583-S587 WeakPolarHBondContact CA-OG 3.43Å; D584-S587 PolarHBondContact N-OG 3.1Å; D584-S587 WeakPolarHBondContact O-CB 3.34Å; D584-S587 PolarHBondContact O-N 2.97Å; D584-S587 WeakPolarHBondContact OD1-CB 3.44Å; D584-S587 PolarHBondContact OD1-N 3.32Å; D584-S587 PolarHBondContact OD1-OG 2.88Å; S587-V589 PolarHBondContact O-N 2.98Å
588	L	76.1	Confident	77	Confident	23 Å²	23	71.7 Å²	71.7	12%	0.12	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	104	175.8	-172.8	76.1	0	0	0	109.6	L498 V573 S574 I590	L498-L588 HydrophobicContact CD1-CD1 4.43Å; L498-L588 HydrophobicContact CD2-CD1 3.38Å; L498-L588 HydrophobicContact CD2-CD2 3.42Å; L498-L588 VanDerWaalsContact CD2-CD2 3.42Å; L498-L588 HydrophobicContact CD2-CG 3.94Å; L498-L588 HydrophobicContact CG-CD1 4.5Å; V573-L588 CarbonylContact C-O 3.55Å; S574-L588 PolarHBondContact N-O 3.22Å; S574-L588 PolarHBondContact O-N 3.04Å; L588-I590 HydrophobicContact CD1-CG2 3.98Å; L588-I590 HydrophobicContact CD2-CD1 4.33Å; L588-I590 HydrophobicContact CG-CG2 4.02Å
589	V	80.1	Confident	77.9	Confident	21 Å²	21	67.8 Å²	67.8	13%	0.127	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	110.5	172.3	-176.4	0	0	0	0	108.6	P563 I565 F571 L572 V573 A583 S587	P563-V589 HydrophobicContact CB-CB 3.53Å; P563-V589 HydrophobicContact CB-CG1 4.3Å; P563-V589 HydrophobicContact CB-CG2 3.37Å; P563-V589 HydrophobicContact CG-CB 4.38Å; P563-V589 HydrophobicContact CG-CG2 3.66Å; I565-V589 HydrophobicContact CG1-CG1 3.89Å; F571-V589 HydrophobicContact CB-CG1 3.97Å; F571-V589 HydrophobicContact CD1-CG1 3.68Å; F571-V589 HydrophobicContact CE1-CG1 4.47Å; F571-V589 HydrophobicContact CG-CG1 3.98Å; L572-V589 WeakPolarHBondContact O-CA 3.25Å; V573-V589 HydrophobicContact CG1-CG2 4.34Å; V573-V589 HydrophobicContact CG2-CG1 4.24Å; V573-V589 HydrophobicContact CG2-CG2 4.22Å; A583-V589 HydrophobicContact CB-CG2 3.99Å; S587-V589 PolarHBondContact O-N 2.98Å
590	I	81.4	Confident	79	Confident	24 Å²	24	60.6 Å²	60.6	12%	0.123	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	135.1	-177.8	55.9	175.8	0	0	0	110.3	L498 I500 F571 L572 L588 W592 W596	L498-I590 HydrophobicContact CB-CG2 4.47Å; L498-I590 HydrophobicContact CD2-CD1 4.5Å; L498-I590 HydrophobicContact CD2-CG2 4.28Å; I500-I590 HydrophobicContact CD1-CD1 3.66Å; I500-I590 HydrophobicContact CG1-CD1 4.17Å; F571-I590 CarbonylContact C-O 3.58Å; F571-I590 WeakPolarHBondContact CA-O 3.4Å; L572-I590 HydrophobicContact CB-CD1 4.36Å; L572-I590 HydrophobicContact CB-CG1 3.82Å; L572-I590 HydrophobicContact CD2-CD1 3.85Å; L572-I590 HydrophobicContact CD2-CG1 4.16Å; L572-I590 HydrophobicContact CG-CG1 4.47Å; L572-I590 PolarHBondContact N-O 2.04Å; L572-I590 PolarHBondContact O-N 2.93Å; L588-I590 HydrophobicContact CD1-CG2 3.98Å; L588-I590 HydrophobicContact CD2-CD1 4.33Å; L588-I590 HydrophobicContact CG-CG2 4.02Å; I590-W592 PolarHBondContact O-N 3.34Å; I590-W596 HydrophobicContact CB-CH2 3.88Å; I590-W596 HydrophobicContact CB-CZ3 4.12Å; I590-W596 HydrophobicContact CD1-CE3 4.1Å; I590-W596 HydrophobicContact CD1-CH2 3.21Å; I590-W596 HydrophobicContact CD1-CZ2 3.96Å; I590-W596 HydrophobicContact CD1-CZ3 3.29Å; I590-W596 HydrophobicContact CG1-CH2 3.62Å; I590-W596 HydrophobicContact CG1-CZ3 3.47Å; I590-W596 VanDerWaalsContact CG1-CZ3 3.47Å
591	Q	82.7	Confident	79.7	Confident	100 Å²	100	64.7 Å²	64.7	47%	0.467	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	129.4	179.1	-169.6	-175.1	-7.9	0	0	109.9	F571 W596	F571-Q591 HydrophobicContact CD1-CB 4.19Å; F571-Q591 HydrophobicContact CE1-CB 3.93Å; F571-Q591 HydrophobicContact CE1-CG 4.33Å; Q591-W596 VanDerWaalsContact O-CH2 3.25Å; Q591-W596 WeakPolarHBondContact O-CH2 3.37Å; Q591-W596 WeakPolarHBondContact O-CZ3 3.38Å
592	W	84.1	Confident	80	Confident	20 Å²	20	70.2 Å²	70.2	8%	0.076	32%	0.322	C	S	.	.			trans	-61.5	138.5	-175.1	-174.8	-99.5	0	0	0	111.9	Q514 Y537 R570 L572 I590 D594 W596 T597 L600	Q514-W592 HydrophobicContact CB-CE3 4.08Å; Q514-W592 HydrophobicContact CB-CH2 4.24Å; Q514-W592 HydrophobicContact CB-CZ3 3.88Å; Q514-W592 HydrophobicContact CG-CD2 3.91Å; Q514-W592 HydrophobicContact CG-CE3 3.8Å; Q514-W592 HydrophobicContact CG-CH2 4.33Å; Q514-W592 HydrophobicContact CG-CZ2 4.37Å; Q514-W592 HydrophobicContact CG-CZ3 4.04Å; Q514-W592 VanDerWaalsContact OE1-CZ2 3.29Å; Y537-W592 AromaticContact CE2-CH2 3.56Å; Y537-W592 HydrophobicContact CE2-CH2 3.56Å; Y537-W592 AromaticContact CE2-CZ3 3.96Å; Y537-W592 HydrophobicContact CE2-CZ3 3.96Å; Y537-W592 AromaticContact CZ-CH2 3.59Å; Y537-W592 VanDerWaalsContact OH-CH2 3.26Å; Y537-W592 WeakPolarHBondContact OH-CH2 3.26Å; R570-W592 HydrophobicContact CB-CB 3.59Å; R570-W592 HydrophobicContact CB-CG 4.16Å; R570-W592 VanDerWaalsContact O-CB 3.24Å; R570-W592 WeakPolarHBondContact O-CB 3.49Å; R570-W592 PolarHBondContact O-N 2.86Å; L572-W592 HydrophobicContact CB-CE3 4.02Å; L572-W592 HydrophobicContact CB-CZ3 4.2Å; L572-W592 HydrophobicContact CD1-CZ3 4.06Å; I590-W592 PolarHBondContact O-N 3.34Å; W592-D594 PolarHBondContact NE1-OD1 3.49Å; W592-W596 HydrophobicContact CE3-CE3 4.28Å; W592-W596 HydrophobicContact CH2-CB 4.42Å; W592-T597 VanDerWaalsContact CZ2-OG1 3.28Å; W592-T597 WeakPolarHBondContact CZ2-OG1 3.24Å; W592-L600 HydrophobicContact CH2-CD1 3.98Å; W592-L600 HydrophobicContact CZ3-CD1 3.94Å
593	R	82.1	Confident	80.1	Confident	139 Å²	139	69.9 Å²	69.9	53%	0.525	32%	0.319	S	S	.	.			trans	-126.4	133.1	168.2	-61.3	-173.7	-176.4	179.5	6.9	108.6	N497 V595 W596	N497-R593 PolarHBondContact OD1-NH2 3.38Å; R593-V595 PolarHBondContact O-N 2.71Å; R593-W596 HydrophobicContact CB-CD2 4.3Å; R593-W596 HydrophobicContact CG-CZ2 4.45Å; R593-W596 VanDerWaalsContact O-CB 3.32Å; R593-W596 WeakPolarHBondContact O-CB 3.28Å; R593-W596 PolarHBondContact O-N 2.82Å
594	D	79.1	Confident	80.1	Confident	117 Å²	117	72.7 Å²	72.7	63%	0.626	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.5	-174.3	-64.7	-41.2	0	0	0	114.3	W592 W596 T597	W592-D594 PolarHBondContact NE1-OD1 3.49Å; D594-W596 PolarHBondContact O-N 3.49Å; D594-T597 WeakPolarHBondContact O-CB 3.44Å; D594-T597 PolarHBondContact O-N 3.47Å; D594-T597 PolarHBondContact O-OG1 2.94Å; D594-T597 VanDerWaalsContact O-OG1 3.09Å
595	V	77.3	Confident	80.3	Confident	118 Å²	118	79.7 Å²	79.7	72%	0.715	36%	0.356	S	S	*	.	H	α-helix	trans	-60.7	-25.1	173.8	-167.9	0	0	0	0	111.8	R593	R593-V595 PolarHBondContact O-N 2.71Å
596	W	79.4	Confident	80.7	Confident	32 Å²	32	78.8 Å²	78.8	12%	0.121	35%	0.352	C	S	.	.	H	α-helix	trans	-74.4	-26	179.3	-65.1	-10.2	0	0	0	113.4	L572 I590 Q591 W592 R593 D594 R598 R599 L600	L572-W596 HydrophobicContact CB-CZ3 4.42Å; I590-W596 HydrophobicContact CB-CH2 3.88Å; I590-W596 HydrophobicContact CB-CZ3 4.12Å; I590-W596 HydrophobicContact CD1-CE3 4.1Å; I590-W596 HydrophobicContact CD1-CH2 3.21Å; I590-W596 HydrophobicContact CD1-CZ2 3.96Å; I590-W596 HydrophobicContact CD1-CZ3 3.29Å; I590-W596 HydrophobicContact CG1-CH2 3.62Å; I590-W596 HydrophobicContact CG1-CZ3 3.47Å; I590-W596 VanDerWaalsContact CG1-CZ3 3.47Å; Q591-W596 VanDerWaalsContact O-CH2 3.25Å; Q591-W596 WeakPolarHBondContact O-CH2 3.37Å; Q591-W596 WeakPolarHBondContact O-CZ3 3.38Å; W592-W596 HydrophobicContact CE3-CE3 4.28Å; W592-W596 HydrophobicContact CH2-CB 4.42Å; R593-W596 HydrophobicContact CB-CD2 4.3Å; R593-W596 HydrophobicContact CG-CZ2 4.45Å; R593-W596 VanDerWaalsContact O-CB 3.32Å; R593-W596 WeakPolarHBondContact O-CB 3.28Å; R593-W596 PolarHBondContact O-N 2.82Å; D594-W596 PolarHBondContact O-N 3.49Å; W596-R598 PolarHBondContact O-N 2.51Å; W596-R599 PolarHBondContact O-N 2.84Å; W596-R599 VanDerWaalsContact O-N 3.11Å; W596-L600 HydrophobicContact CB-CD1 4.17Å; W596-L600 WeakPolarHBondContact O-CB 2.96Å; W596-L600 WeakPolarHBondContact O-CG 3.02Å; W596-L600 PolarHBondContact O-N 3.06Å
597	T	80.3	Confident	80.9	Confident	37 Å²	37	76.2 Å²	76.2	23%	0.227	34%	0.336	C	S	.	.	H	α-helix	trans	-54.4	-52.6	178.9	-46.2	0	0	0	0	111.5	W592 D594 R599 R601	W592-T597 VanDerWaalsContact CZ2-OG1 3.28Å; W592-T597 WeakPolarHBondContact CZ2-OG1 3.24Å; D594-T597 WeakPolarHBondContact O-CB 3.44Å; D594-T597 PolarHBondContact O-N 3.47Å; D594-T597 PolarHBondContact O-OG1 2.94Å; D594-T597 VanDerWaalsContact O-OG1 3.09Å; T597-R599 VanDerWaalsContact C-N 3.31Å; T597-R599 PolarHBondContact O-N 3.49Å; T597-R601 WeakPolarHBondContact O-CB 3.29Å; T597-R601 VanDerWaalsContact O-CG 3.28Å; T597-R601 WeakPolarHBondContact O-CG 3.42Å; T597-R601 PolarHBondContact O-N 2.89Å; T597-R601 VanDerWaalsContact O-N 3.13Å
598	R	80.9	Confident	81.1	Confident	220 Å²	220	83.9 Å²	83.9	83%	0.83	37%	0.368	S	S	*	.	H	α-helix	trans	-66.4	-36.4	179.9	-65.5	-174.5	-167.7	172.6	4.4	111.4	W596 K602	W596-R598 PolarHBondContact O-N 2.51Å; R598-K602 WeakPolarHBondContact O-CB 3.24Å; R598-K602 PolarHBondContact O-N 3.3Å; R598-K602 VanDerWaalsContact O-N 3.08Å
599	R	81.6	Confident	81.3	Confident	85 Å²	85	90.6 Å²	90.6	32%	0.321	40%	0.396	S	S	.	.	H	α-helix	trans	-72.2	-46.4	-176.3	-169.4	173	176.8	143.4	1.8	112.3	I500 W596 T597 K602 F603	I500-R599 PolarHBondContact O-NE 3.46Å; I500-R599 PolarHBondContact O-NH2 3.26Å; W596-R599 PolarHBondContact O-N 2.84Å; W596-R599 VanDerWaalsContact O-N 3.11Å; T597-R599 VanDerWaalsContact C-N 3.31Å; T597-R599 PolarHBondContact O-N 3.49Å; R599-K602 WeakPolarHBondContact O-CB 3.26Å; R599-K602 PolarHBondContact O-N 3.32Å; R599-F603 HydrophobicContact CG-CE1 4.2Å; R599-F603 HydrophobicContact CG-CE2 3.83Å; R599-F603 HydrophobicContact CG-CZ 3.67Å; R599-F603 WeakPolarHBondContact O-CD1 3.06Å; R599-F603 VanDerWaalsContact O-CG 3.3Å; R599-F603 WeakPolarHBondContact O-CG 3.08Å; R599-F603 PolarHBondContact O-N 3.32Å
600	L	82.9	Confident	81.1	Confident	4 Å²	4	91.9 Å²	91.9	2%	0.021	41%	0.414	C	S	.	.	H	α-helix	trans	-67.7	-40.4	177.3	-69.7	170.1	0	0	0	111.4	I500 Y505 Y537 L572 W592 W596 K602 F603 Q604	I500-L600 HydrophobicContact CD1-CD2 4.36Å; I500-L600 HydrophobicContact CG2-CD2 4.28Å; Y505-L600 HydrophobicContact CD2-CD2 3.92Å; Y505-L600 HydrophobicContact CE2-CD2 4.22Å; Y537-L600 HydrophobicContact CD1-CB 3.58Å; Y537-L600 HydrophobicContact CD1-CD1 4.46Å; Y537-L600 HydrophobicContact CD2-CD1 4.13Å; Y537-L600 HydrophobicContact CE1-CB 3.94Å; Y537-L600 HydrophobicContact CE2-CD1 4.3Å; Y537-L600 HydrophobicContact CG-CB 3.98Å; Y537-L600 HydrophobicContact CG-CD1 4.23Å; L572-L600 HydrophobicContact CD1-CD1 4.09Å; L572-L600 HydrophobicContact CD2-CD1 4.21Å; W592-L600 HydrophobicContact CH2-CD1 3.98Å; W592-L600 HydrophobicContact CZ3-CD1 3.94Å; W596-L600 HydrophobicContact CB-CD1 4.17Å; W596-L600 WeakPolarHBondContact O-CB 2.96Å; W596-L600 WeakPolarHBondContact O-CG 3.02Å; W596-L600 PolarHBondContact O-N 3.06Å; L600-K602 VanDerWaalsContact C-N 3.28Å; L600-K602 PolarHBondContact O-N 2.75Å; L600-F603 HydrophobicContact CD2-CD2 4.31Å; L600-F603 PolarHBondContact O-N 2.91Å; L600-Q604 PolarHBondContact O-N 3.01Å
601	R	84.3	Confident	80.6	Confident	131 Å²	131	96.2 Å²	96.2	49%	0.494	43%	0.432	S	S	.	.	H	α-helix	trans	-60.8	-36.3	171.2	-72.3	-176.7	-177.9	-164.1	1.4	112.6	Y537 T597 F603 R605	Y537-R601 HydrophobicContact CD1-CG 4.49Å; Y537-R601 HydrophobicContact CE1-CG 4.05Å; T597-R601 WeakPolarHBondContact O-CB 3.29Å; T597-R601 VanDerWaalsContact O-CG 3.28Å; T597-R601 WeakPolarHBondContact O-CG 3.42Å; T597-R601 PolarHBondContact O-N 2.89Å; T597-R601 VanDerWaalsContact O-N 3.13Å; R601-F603 VanDerWaalsContact C-N 3.34Å; R601-R605 VanDerWaalsContact O-CG 3.32Å; R601-R605 WeakPolarHBondContact O-CG 3.25Å; R601-R605 PolarHBondContact O-N 3.49Å; R601-R605 VanDerWaalsContact O-N 3.09Å
602	K	83.6	Confident	80	Confident	127 Å²	127	93.1 Å²	93.1	55%	0.552	42%	0.421	S	S	*	.	H	α-helix	trans	-67.7	-34.1	173.6	-171	175.4	-175.9	174	0	111.8	R598 R599 L600 K606	R598-K602 WeakPolarHBondContact O-CB 3.24Å; R598-K602 PolarHBondContact O-N 3.3Å; R598-K602 VanDerWaalsContact O-N 3.08Å; R599-K602 WeakPolarHBondContact O-CB 3.26Å; R599-K602 PolarHBondContact O-N 3.32Å; L600-K602 VanDerWaalsContact C-N 3.28Å; L600-K602 PolarHBondContact O-N 2.75Å; K602-K606 WeakPolarHBondContact O-CG 2.87Å; K602-K606 PolarHBondContact O-N 2.76Å
603	F	84.9	Confident	78.9	Confident	18 Å²	18	97.4 Å²	97.4	8%	0.079	45%	0.454	C	S	.	.	H	α-helix	trans	-70.9	-47.5	175.9	-63.5	-16.6	0	0	0	112	I500 M502 Y505 R599 L600 R601 R605 K606 E607	I500-F603 HydrophobicContact CG2-CD2 4.37Å; I500-F603 HydrophobicContact CG2-CE2 4Å; I500-F603 WeakPolarHBondContact O-CE2 3.46Å; M502-F603 HydrophobicContact CB-CE1 4.37Å; M502-F603 HydrophobicContact CE-CB 4.22Å; M502-F603 HydrophobicContact CE-CD1 3.31Å; M502-F603 HydrophobicContact CE-CE1 3.92Å; M502-F603 HydrophobicContact CE-CG 4.02Å; M502-F603 HydrophobicContact SD-CB 4.01Å; M502-F603 HydrophobicContact SD-CD1 3.82Å; M502-F603 HydrophobicContact SD-CE1 4.47Å; M502-F603 HydrophobicContact SD-CG 3.98Å; Y505-F603 HydrophobicContact CD1-CB 3.66Å; Y505-F603 HydrophobicContact CD1-CG 4.46Å; Y505-F603 HydrophobicContact CD2-CB 3.87Å; Y505-F603 HydrophobicContact CD2-CD2 4.01Å; Y505-F603 HydrophobicContact CD2-CG 4.45Å; Y505-F603 HydrophobicContact CE1-CB 3.8Å; Y505-F603 HydrophobicContact CE2-CB 3.98Å; Y505-F603 HydrophobicContact CG-CB 3.72Å; Y505-F603 AromaticContact CG-CD2 3.9Å; Y505-F603 HydrophobicContact CG-CD2 3.9Å; Y505-F603 HydrophobicContact CG-CG 4.2Å; R599-F603 HydrophobicContact CG-CE1 4.2Å; R599-F603 HydrophobicContact CG-CE2 3.83Å; R599-F603 HydrophobicContact CG-CZ 3.67Å; R599-F603 WeakPolarHBondContact O-CD1 3.06Å; R599-F603 VanDerWaalsContact O-CG 3.3Å; R599-F603 WeakPolarHBondContact O-CG 3.08Å; R599-F603 PolarHBondContact O-N 3.32Å; L600-F603 HydrophobicContact CD2-CD2 4.31Å; L600-F603 PolarHBondContact O-N 2.91Å; R601-F603 VanDerWaalsContact C-N 3.34Å; F603-R605 VanDerWaalsContact C-N 3.3Å; F603-R605 PolarHBondContact O-N 3.32Å; F603-K606 CarbonylContact O-C 3.56Å; F603-K606 WeakPolarHBondContact O-CA 2.95Å; F603-K606 PolarHBondContact O-N 3.23Å; F603-E607 PolarHBondContact O-N 3.44Å
604	Q	80.6	Confident	77.6	Confident	59 Å²	59	100.1 Å²	100.1	28%	0.276	47%	0.469	S	S	.	.	H	α-helix	trans	-55.1	-42.9	173.6	-167	-178.1	33	0	0	112.4	Y505 Y537 L600 K606 E607 K608	Y505-Q604 WeakPolarHBondContact OH-CA 3.21Å; Y537-Q604 WeakPolarHBondContact O-CG 3.4Å; Y537-Q604 PolarHBondContact O-NE2 3.13Å; Y537-Q604 VanDerWaalsContact O-NE2 3.12Å; L600-Q604 PolarHBondContact O-N 3.01Å; Q604-K606 VanDerWaalsContact C-N 3.33Å; Q604-K606 PolarHBondContact O-N 3.28Å; Q604-E607 PolarHBondContact O-N 3.45Å; Q604-K608 WeakPolarHBondContact O-CG 3.5Å; Q604-K608 PolarHBondContact O-N 3.21Å
605	R	82.8	Confident	76.3	Confident	180 Å²	180	97.3 Å²	97.3	68%	0.679	46%	0.463	S	S	*	.	H	α-helix	trans	-65.7	-32	174.5	-73.9	177.2	-176.4	-178.7	0.1	113.7	R601 F603 K609	R601-R605 VanDerWaalsContact O-CG 3.32Å; R601-R605 WeakPolarHBondContact O-CG 3.25Å; R601-R605 PolarHBondContact O-N 3.49Å; R601-R605 VanDerWaalsContact O-N 3.09Å; F603-R605 VanDerWaalsContact C-N 3.3Å; F603-R605 PolarHBondContact O-N 3.32Å; R605-K609 VanDerWaalsContact O-CG 3.31Å; R605-K609 WeakPolarHBondContact O-CG 3.46Å; R605-K609 PolarHBondContact O-N 3.18Å
606	K	80.9	Confident	76.2	Confident	79 Å²	79	96.3 Å²	96.3	34%	0.343	45%	0.45	S	S	.	.	H	α-helix	trans	-80.1	-33.8	179.2	-80.2	-176.4	169.8	-166.3	0	111.6	M502 K602 F603 Q604 K609 K611	M502-K606 HydrophobicContact CE-CB 3.51Å; M502-K606 HydrophobicContact CE-CD 3.18Å; M502-K606 HydrophobicContact CE-CG 3.94Å; K602-K606 WeakPolarHBondContact O-CG 2.87Å; K602-K606 PolarHBondContact O-N 2.76Å; F603-K606 CarbonylContact O-C 3.56Å; F603-K606 WeakPolarHBondContact O-CA 2.95Å; F603-K606 PolarHBondContact O-N 3.23Å; Q604-K606 VanDerWaalsContact C-N 3.33Å; Q604-K606 PolarHBondContact O-N 3.28Å; K606-K609 CarbonylContact O-C 3.49Å; K606-K609 PolarHBondContact O-N 3.42Å; K606-K611 HydrophobicContact CB-CB 4.39Å; K606-K611 HydrophobicContact CG-CD 4.44Å; K606-K611 VanDerWaalsContact O-CB 3.32Å; K606-K611 WeakPolarHBondContact O-CB 3.09Å; K606-K611 PolarHBondContact O-N 2.82Å
607	E	78.7	Confident	76.1	Confident	52 Å²	52	99.7 Å²	99.7	24%	0.243	47%	0.467	C	S	.	.	H	α-helix	trans	-63.1	-49.1	170.5	176.9	174.8	-135.7	0	0	111.5	Y505 K538 F603 Q604 K609 G610	Y505-E607 HydrophobicContact CE1-CB 4.07Å; Y505-E607 WeakPolarHBondContact CE1-OE2 3.41Å; Y505-E607 PolarHBondContact OH-OE2 2.87Å; K538-E607 WeakPolarHBondContact CE-OE1 3.16Å; K538-E607 IonicContact NZ-OE1 3.78Å; F603-E607 PolarHBondContact O-N 3.44Å; Q604-E607 PolarHBondContact O-N 3.45Å; E607-K609 PolarHBondContact O-N 3.23Å; E607-G610 PolarHBondContact O-N 2.65Å
608	K	78.8	Confident	75.8	Confident	176 Å²	176	103.2 Å²	103.2	77%	0.765	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-20.3	172.1	-73.7	-171.5	177.7	-165.6	0	114	Q604	Q604-K608 WeakPolarHBondContact O-CG 3.5Å; Q604-K608 PolarHBondContact O-N 3.21Å
609	K	80.8	Confident	75.5	Confident	163 Å²	163	96.3 Å²	96.3	71%	0.709	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	17.1	175.6	-69.4	-178.7	177.5	-162.2	0	112.9	R605 K606 E607 K611	R605-K609 VanDerWaalsContact O-CG 3.31Å; R605-K609 WeakPolarHBondContact O-CG 3.46Å; R605-K609 PolarHBondContact O-N 3.18Å; K606-K609 CarbonylContact O-C 3.49Å; K606-K609 PolarHBondContact O-N 3.42Å; E607-K609 PolarHBondContact O-N 3.23Å; K609-K611 VanDerWaalsContact C-N 3.28Å; K609-K611 PolarHBondContact O-N 3.29Å
610	G	75.3	Confident	75.1	Confident	48 Å²	48	97 Å²	97	50%	0.495	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	10.7	176.6	0	0	0	0	0	115.4	E607 C612 S613	E607-G610 PolarHBondContact O-N 2.65Å; G610-C612 PolarHBondContact O-N 3.41Å; G610-S613 PolarHBondContact O-OG 3.47Å; G610-S613 VanDerWaalsContact O-OG 3.12Å
611	K	72.6	Confident	74.6	Confident	115 Å²	115	103.2 Å²	103.2	50%	0.5	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	4.1	-173.6	-59.2	-164.9	174.7	-165.4	0	114.7	K606 K609	K606-K611 HydrophobicContact CB-CB 4.39Å; K606-K611 HydrophobicContact CG-CD 4.44Å; K606-K611 VanDerWaalsContact O-CB 3.32Å; K606-K611 WeakPolarHBondContact O-CB 3.09Å; K606-K611 PolarHBondContact O-N 2.82Å; K609-K611 VanDerWaalsContact C-N 3.28Å; K609-K611 PolarHBondContact O-N 3.29Å
612	C	69.2	Low	73.9	Confident	36 Å²	36	101.2 Å²	101.2	24%	0.243	50%	0.499	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-18.7	175.1	-82.5	0	0	0	0	113.8	C506 G610 K614	C506-C612 HydrophobicContact CB-CB 3.59Å; C506-C612 WeakPolarHBondContact CB-SG 3.37Å; C506-C612 WeakPolarHBondContact SG-CA 3.25Å; C506-C612 WeakPolarHBondContact SG-CB 3.05Å; C506-C612 CovalentContact SG-SG 2.05Å; C506-C612 PolarHBondContact SG-SG 2.74Å; G610-C612 PolarHBondContact O-N 3.41Å; C612-K614 VanDerWaalsContact C-N 3.31Å
613	S	60.4	Low	73.2	Confident	109 Å²	109	99.2 Å²	99.2	76%	0.762	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-14.2	173.3	56.7	0	0	0	0	113.9	G610	G610-S613 PolarHBondContact O-OG 3.47Å; G610-S613 VanDerWaalsContact O-OG 3.12Å
614	K	55.5	Low	72.2	Confident	196 Å²	196	106 Å²	106	85%	0.852	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	12.9	-177.3	-65.2	-173	175.5	-174.3	0	113.9	C612	C612-K614 VanDerWaalsContact C-N 3.31Å
615	A	51.2	Low	71.5	Confident	59 Å²	59	110.3 Å²	110.3	49%	0.488	55%	0.553	S	S	.	*			trans	-115.2	0	-165.9	0	0	0	0	0	115.5	M502 K503	M502-A615 HydrophobicContact CG-CB 3.95Å; K503-A615 WeakPolarHBondContact CB-OXT 3.32Å; K503-A615 VanDerWaalsContact CD-OXT 3.25Å; K503-A615 WeakPolarHBondContact CD-OXT 3.36Å; K503-A615 VanDerWaalsContact CG-OXT 3.28Å; K503-A615 WeakPolarHBondContact CG-OXT 3.27Å

Retrieved 615 of 615 residues in 424 ms (Link to these results)

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